#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hc5 n ASN 2 N 0.00 -7.41 0.09 -1.43 5.15 -1.26 -4.67 115.26 105.73 2hc5 n ASN 2 Ca 0.00 0.98 0.19 0.00 -0.60 0.00 0.00 54.58 55.16 2hc5 n ASN 2 Cb 0.00 -3.73 0.75 0.00 -0.53 0.00 0.00 39.78 36.27 2hc5 n ASN 2 CO 0.00 0.00 0.00 -0.29 1.40 0.00 0.00 177.26 178.37 2hc5 h ILE 3 N 3.27 0.53 0.00 -1.44 2.10 -1.95 -1.33 117.51 118.69 2hc5 h ILE 3 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 2hc5 h ILE 3 Cb 0.44 0.73 0.00 0.00 -1.09 0.00 0.00 36.82 36.90 2hc5 h ILE 3 CO 0.06 0.00 0.08 -0.08 -1.08 0.00 0.00 178.15 177.13 2hc5 h GLU 4 N 0.00 0.00 0.00 2.19 4.22 -1.87 -1.45 114.58 117.67 2hc5 h GLU 4 Ca 0.19 0.00 -0.03 0.00 0.08 0.00 0.00 59.36 59.60 2hc5 h GLU 4 Cb 0.90 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.09 2hc5 h GLU 4 CO -0.00 0.00 -0.43 0.54 -2.18 0.00 0.00 179.01 176.94 2hc5 n ARG 5 N -2.84 0.64 0.23 1.92 1.74 -0.50 -1.84 116.66 116.01 2hc5 n ARG 5 Ca -0.02 -2.01 -0.15 0.00 -0.77 0.00 0.00 57.85 54.89 2hc5 n ARG 5 Cb 0.14 -0.90 -0.08 0.00 -1.02 0.00 0.00 32.46 30.61 2hc5 n ARG 5 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2hc5 h LEU 6 N 0.32 -0.82 -1.75 0.55 5.85 -1.29 -3.47 115.31 114.70 2hc5 h LEU 6 Ca -0.04 0.06 -0.59 0.00 0.84 0.00 0.00 57.88 58.15 2hc5 h LEU 6 Cb 1.30 0.27 -0.22 0.00 0.37 0.00 0.00 40.66 42.38 2hc5 h LEU 6 CO 0.02 -0.46 -0.93 1.07 -0.34 0.00 0.00 178.44 177.80 2hc5 n THR 7 N -5.43 -1.18 -3.64 1.05 5.66 -1.26 -4.92 114.28 104.55 2hc5 n THR 7 Ca -0.10 -0.34 -0.07 0.00 -3.05 0.00 0.00 64.05 60.49 2hc5 n THR 7 Cb 0.33 -1.28 -0.07 0.00 -1.55 0.00 0.00 70.33 67.76 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 -3.94 0.00 -0.07 1.09 -1.32 -1.26 -4.94 115.64 105.20 2hc5 s THR 8 Ca 0.27 0.00 0.10 0.00 -1.21 0.00 0.00 61.69 60.85 2hc5 s THR 8 Cb -0.15 -1.00 0.15 0.00 -1.51 0.00 0.00 72.50 69.99 2hc5 s THR 8 CO 0.98 0.00 1.08 0.18 -2.21 0.00 0.00 174.62 174.64 2hc5 n LEU 9 N 2.10 1.27 -0.07 9.08 4.77 -1.26 -4.89 117.00 128.00 2hc5 n LEU 9 Ca -0.12 -2.12 -0.07 0.00 -0.03 0.00 0.00 56.01 53.67 2hc5 n LEU 9 Cb 0.56 -0.23 -0.01 0.00 -2.33 0.00 0.00 43.42 41.41 2hc5 n LEU 9 CO 0.02 0.50 0.86 -0.61 -1.33 0.00 0.00 177.39 176.82 2hc5 h GLN 10 N 0.00 0.08 0.00 3.23 5.75 -2.00 -0.91 115.11 121.26 2hc5 h GLN 10 Ca 0.00 -0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.49 2hc5 h GLN 10 Cb 1.18 -0.02 -0.00 0.00 1.07 0.00 0.00 27.48 29.71 2hc5 h GLN 10 CO 0.00 0.05 -0.01 -1.35 -2.65 0.00 0.00 178.83 174.87 2hc5 h PRO 11 N 0.08 0.00 -0.17 -2.39 0.11 -2.01 -2.10 132.00 125.53 2hc5 h PRO 11 Ca 0.13 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 66.07 2hc5 h PRO 11 Cb 0.17 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.28 2hc5 h PRO 11 CO -0.21 0.01 -0.54 0.28 -0.21 0.00 0.00 178.00 177.32 2hc5 h VAL 12 N 0.00 1.32 0.00 3.15 2.07 -1.50 -2.75 116.25 118.53 2hc5 h VAL 12 Ca -0.00 -1.79 -0.04 0.00 0.82 0.00 0.00 66.70 65.69 2hc5 h VAL 12 Cb 0.05 1.98 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 2hc5 h VAL 12 CO 0.00 0.56 -0.21 -0.50 0.02 0.00 0.00 177.57 177.44 2hc5 h TRP 13 N 0.34 0.00 0.05 1.57 -0.00 -1.02 -0.50 115.95 116.39 2hc5 h TRP 13 Ca -0.02 0.00 -0.00 0.00 -0.00 0.00 0.00 58.89 58.87 2hc5 h TRP 13 Cb 1.17 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.33 2hc5 h TRP 13 CO 0.10 0.21 -0.03 0.22 -0.00 0.00 0.00 178.44 178.94 2hc5 h ASP 14 N 0.00 -0.06 -0.01 -3.49 3.58 -1.39 -2.41 116.42 112.64 2hc5 h ASP 14 Ca -0.00 -0.43 -0.04 0.00 0.42 0.00 0.00 57.03 56.98 2hc5 h ASP 14 Cb 0.41 0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.46 2hc5 h ASP 14 CO 0.03 0.41 -0.09 0.03 -2.88 0.00 0.00 179.24 176.74 2hc5 h ARG 15 N -0.54 0.23 -0.88 0.28 3.08 -1.27 -0.35 114.38 114.92 2hc5 h ARG 15 Ca -0.01 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.02 2hc5 h ARG 15 Cb 0.48 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.45 2hc5 h ARG 15 CO 0.01 0.33 0.58 -0.92 -1.07 0.00 0.00 179.97 178.90 2hc5 h TYR 16 N 0.22 1.08 0.03 3.04 3.20 -1.00 -2.19 116.97 121.35 2hc5 h TYR 16 Ca 0.05 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.94 2hc5 h TYR 16 Cb 0.30 -0.36 0.00 0.00 1.54 0.00 0.00 36.73 38.21 2hc5 h TYR 16 CO 0.00 0.65 -0.01 0.22 -1.64 0.00 0.00 178.16 177.38 2hc5 h ASP 17 N 1.14 -0.04 -0.79 -2.11 3.58 -0.77 -3.10 116.42 114.34 2hc5 h ASP 17 Ca 0.34 -0.60 0.16 0.00 0.42 0.00 0.00 57.03 57.35 2hc5 h ASP 17 Cb -0.05 0.01 -0.10 0.00 1.72 0.00 0.00 39.33 40.91 2hc5 h ASP 17 CO -0.09 0.73 0.32 0.71 -2.88 0.00 0.00 179.24 178.03 2hc5 h THR 18 N -0.95 0.63 -0.16 2.25 1.35 -1.05 -0.19 112.91 114.79 2hc5 h THR 18 Ca -0.00 -0.15 -0.18 0.00 -0.55 0.00 0.00 66.41 65.53 2hc5 h THR 18 Cb 0.63 0.14 -0.00 0.00 -1.73 0.00 0.00 68.15 67.19 2hc5 h THR 18 CO 0.01 0.08 -0.63 -0.61 -0.25 0.00 0.00 175.52 174.12 2hc5 h GLN 19 N 0.45 0.55 -0.01 4.72 4.15 -1.54 -2.56 115.11 120.86 2hc5 h GLN 19 Ca 0.44 -0.39 0.00 0.00 0.77 0.00 0.00 58.65 59.48 2hc5 h GLN 19 Cb 0.70 0.06 -0.00 0.00 0.21 0.00 0.00 27.48 28.45 2hc5 h GLN 19 CO -0.43 1.00 0.01 0.82 -1.93 0.00 0.00 178.83 178.31 2hc5 h ILE 20 N 0.41 0.44 -0.13 2.39 2.04 -0.97 0.22 117.51 121.91 2hc5 h ILE 20 Ca -0.01 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.85 2hc5 h ILE 20 Cb 1.19 0.99 0.00 0.00 -0.74 0.00 0.00 36.82 38.26 2hc5 h ILE 20 CO 0.12 0.00 0.00 1.41 0.00 0.00 0.00 178.15 179.68 2hc5 n HIS 21 N -3.73 0.15 -0.01 1.37 8.25 -0.90 -4.52 115.22 115.83 2hc5 n HIS 21 Ca -0.03 -0.07 -0.02 0.00 -0.26 0.00 0.00 57.72 57.34 2hc5 n HIS 21 Cb 0.09 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.20 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 1.21 0.37 -3.35 0.41 2.85 0.54 -5.01 115.26 112.27 2hc5 n ASN 22 Ca 0.16 0.06 -0.24 0.00 -0.11 0.00 0.00 54.58 54.45 2hc5 n ASN 22 Cb 0.56 -0.47 0.03 0.00 1.24 0.00 0.00 39.78 41.14 2hc5 n ASN 22 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2hc5 n GLN 23 N -2.86 -4.85 -0.57 1.20 1.13 0.08 -4.84 117.38 106.66 2hc5 n GLN 23 Ca -0.02 0.71 -0.10 0.00 -1.94 0.00 0.00 57.00 55.65 2hc5 n GLN 23 Cb 0.09 -5.55 0.05 0.00 0.11 0.00 0.00 30.24 24.93 2hc5 n GLN 23 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2hc5 n LYS 24 N -4.16 1.48 0.00 -1.09 5.02 -1.26 -4.93 118.16 113.22 2hc5 n LYS 24 Ca -0.04 -1.04 0.00 0.00 -2.02 0.00 0.00 58.31 55.21 2hc5 n LYS 24 Cb 0.57 -1.41 0.00 0.00 -0.02 0.00 0.00 35.03 34.17 2hc5 n LYS 24 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2hc5 n ASP 25 N 0.27 0.00 -4.21 4.39 2.03 -1.26 -4.75 116.55 113.02 2hc5 n ASP 25 Ca 0.20 0.00 -0.21 0.00 0.52 0.00 0.00 54.79 55.31 2hc5 n ASP 25 Cb 0.75 0.00 -0.12 0.00 -0.72 0.00 0.00 41.12 41.02 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 -4.00 2.01 0.00 1.67 3.84 -1.26 -4.98 114.94 112.22 2hc5 s ASN 26 Ca 0.00 -0.62 0.00 0.00 0.21 0.00 0.00 52.86 52.45 2hc5 s ASN 26 Cb 0.00 -0.10 0.00 0.00 -0.55 0.00 0.00 41.25 40.60 2hc5 s ASN 26 CO 0.00 -0.00 0.00 -0.67 -2.79 0.00 0.00 177.10 173.64 2hc5 n ASP 27 N 1.32 0.00 0.00 -4.21 2.03 -1.26 -5.13 116.55 109.30 2hc5 n ASP 27 Ca -0.20 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.11 2hc5 n ASP 27 Cb 0.54 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.94 2hc5 n ASP 27 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2hc5 n ASN 28 N -0.22 0.00 0.13 1.67 3.02 -1.26 -4.97 115.26 113.63 2hc5 n ASN 28 Ca 0.00 0.00 0.12 0.00 -0.03 0.00 0.00 54.58 54.67 2hc5 n ASN 28 Cb 0.00 0.09 0.05 0.00 -0.61 0.00 0.00 39.78 39.31 2hc5 n ASN 28 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 2hc5 h GLU 29 N 0.00 0.00 -6.45 3.52 5.08 -2.00 -3.46 114.58 111.26 2hc5 h GLU 29 Ca 0.00 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.83 2hc5 h GLU 29 Cb 0.00 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.28 2hc5 h GLU 29 CO 0.00 0.00 1.08 0.54 -1.00 0.00 0.00 179.01 179.63 2hc5 s VAL 30 N -3.32 2.85 -0.88 3.13 0.11 -1.26 -4.91 120.40 116.11 2hc5 s VAL 30 Ca 0.02 0.25 -0.25 0.00 -2.93 0.00 0.00 61.98 59.07 2hc5 s VAL 30 Cb 0.08 -3.16 0.04 0.00 -1.53 0.00 0.00 36.38 31.81 2hc5 s VAL 30 CO 0.76 -0.00 1.36 -2.16 -3.33 0.00 0.00 175.10 171.73 2hc5 s PRO 31 N 2.98 3.39 -0.40 1.54 0.04 -1.26 -4.83 135.00 136.47 2hc5 s PRO 31 Ca 0.79 -0.69 -0.14 0.00 0.04 0.00 0.00 61.00 60.99 2hc5 s PRO 31 Cb -0.42 -4.78 0.02 0.00 0.04 0.00 0.00 34.50 29.36 2hc5 s PRO 31 CO 0.35 -2.18 0.27 0.08 0.04 0.00 0.00 177.00 175.57 2hc5 s VAL 32 N 5.33 5.12 0.13 -0.36 1.01 -1.26 -5.04 120.40 125.33 2hc5 s VAL 32 Ca 0.40 -0.66 -0.08 0.00 0.00 0.00 0.00 61.98 61.64 2hc5 s VAL 32 Cb -0.04 -3.83 -0.01 0.00 0.00 0.00 0.00 36.38 32.50 2hc5 s VAL 32 CO 0.02 -0.26 0.24 -1.38 0.00 0.00 0.00 175.10 173.72 2hc5 s HIS 33 N 1.66 0.33 -0.06 5.22 -3.43 -1.26 -5.12 115.29 112.63 2hc5 s HIS 33 Ca 0.04 -0.72 -0.30 0.00 -0.80 0.00 0.00 55.06 53.29 2hc5 s HIS 33 Cb -0.19 -0.08 -0.05 0.00 -1.43 0.00 0.00 32.58 30.83 2hc5 s HIS 33 CO 0.09 -0.64 1.50 -1.14 -2.00 0.00 0.00 174.74 172.55 2hc5 s GLN 34 N -3.93 4.22 -0.22 -0.38 0.74 -1.26 -4.98 119.66 113.85 2hc5 s GLN 34 Ca 0.13 2.02 -0.14 0.00 0.05 0.00 0.00 55.36 57.42 2hc5 s GLN 34 Cb 0.04 -3.80 -0.04 0.00 1.10 0.00 0.00 33.01 30.31 2hc5 s GLN 34 CO -0.04 -0.74 0.34 0.08 -0.55 0.00 0.00 175.29 174.38 2hc5 s VAL 35 N 3.39 5.24 0.46 1.34 1.01 -1.26 -5.01 120.40 125.56 2hc5 s VAL 35 Ca 0.67 0.56 0.01 0.00 0.00 0.00 0.00 61.98 63.22 2hc5 s VAL 35 Cb -0.31 -3.67 0.01 0.00 0.00 0.00 0.00 36.38 32.42 2hc5 s VAL 35 CO 0.26 0.26 0.12 -0.24 0.00 0.00 0.00 175.10 175.50 2hc5 n SER 36 N 4.54 3.00 -0.04 3.32 2.88 -1.26 -4.99 113.62 121.06 2hc5 n SER 36 Ca -0.10 -2.86 -0.09 0.00 -1.33 0.00 0.00 58.87 54.49 2hc5 n SER 36 Cb 0.51 0.19 -0.03 0.00 -0.75 0.00 0.00 64.21 64.14 2hc5 n SER 36 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 2hc5 h TYR 37 N 1.03 0.16 -0.63 0.66 5.03 -1.97 -1.65 116.97 119.60 2hc5 h TYR 37 Ca -0.35 0.01 -0.03 0.00 2.58 0.00 0.00 58.73 60.94 2hc5 h TYR 37 Cb 1.12 -0.04 -0.03 0.00 1.55 0.00 0.00 36.73 39.33 2hc5 h TYR 37 CO 0.00 0.09 0.28 1.79 -1.32 0.00 0.00 178.16 179.00 2hc5 h THR 38 N 0.20 1.21 -0.62 1.81 1.35 -2.01 -2.79 112.91 112.06 2hc5 h THR 38 Ca 0.08 -0.61 -0.09 0.00 -0.55 0.00 0.00 66.41 65.24 2hc5 h THR 38 Cb 0.03 0.43 -0.02 0.00 -1.73 0.00 0.00 68.15 66.86 2hc5 h THR 38 CO -0.07 0.25 0.03 0.78 -0.25 0.00 0.00 175.52 176.26 2hc5 h ASN 39 N 0.89 1.05 -0.31 5.36 -0.26 -1.80 -2.75 115.58 117.75 2hc5 h ASN 39 Ca 0.22 -0.29 0.06 0.00 -0.56 0.00 0.00 56.30 55.72 2hc5 h ASN 39 Cb 0.12 -0.28 -0.05 0.00 -1.06 0.00 0.00 38.32 37.04 2hc5 h ASN 39 CO -0.03 1.08 -0.02 -0.07 -1.06 0.00 0.00 177.43 177.33 2hc5 h LEU 40 N 0.98 -0.17 -1.78 1.61 3.38 -1.04 -0.62 115.31 117.66 2hc5 h LEU 40 Ca 0.18 0.08 0.04 0.00 0.09 0.00 0.00 57.88 58.27 2hc5 h LEU 40 Cb 0.53 0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 2hc5 h LEU 40 CO 0.03 -0.05 0.23 0.00 0.09 0.00 0.00 178.44 178.74 2hc5 h ALA 41 N 1.28 1.97 0.24 1.53 0.00 -1.42 0.27 119.26 123.12 2hc5 h ALA 41 Ca 0.15 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2hc5 h ALA 41 Cb 0.21 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2hc5 h ALA 41 CO -0.27 -0.03 -0.11 0.93 0.00 0.00 0.00 179.25 179.77 2hc5 h GLU 42 N 0.28 -0.31 -0.55 0.00 4.39 -0.87 -2.41 114.58 115.11 2hc5 h GLU 42 Ca 0.15 0.02 -0.08 0.00 0.34 0.00 0.00 59.36 59.79 2hc5 h GLU 42 Cb 0.23 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.93 2hc5 h GLU 42 CO -0.03 0.02 0.02 0.52 -1.16 0.00 0.00 179.01 178.38 2hc5 h MET 43 N -0.67 0.93 -0.97 2.33 2.86 -0.78 -2.56 114.93 116.08 2hc5 h MET 43 Ca -0.03 -0.26 0.12 0.00 -2.06 0.00 0.00 59.70 57.47 2hc5 h MET 43 Cb 0.47 -0.10 -0.08 0.00 0.06 0.00 0.00 31.60 31.95 2hc5 h MET 43 CO 0.05 0.91 0.61 0.28 1.06 0.00 0.00 176.91 179.83 2hc5 h VAL 44 N 0.87 0.91 0.26 -2.22 2.07 -0.48 0.70 116.25 118.35 2hc5 h VAL 44 Ca 0.17 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 2hc5 h VAL 44 Cb 0.48 -0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.16 2hc5 h VAL 44 CO 0.02 0.17 -0.13 1.23 0.02 0.00 0.00 177.57 178.88 2hc5 h GLY 45 N 0.92 -0.37 2.00 2.17 0.00 -1.00 -1.76 103.07 105.03 2hc5 h GLY 45 Ca 0.48 0.14 -0.11 0.00 0.00 0.00 0.00 47.33 47.84 2hc5 h GLY 45 CO -0.24 -0.13 -0.51 1.05 0.00 0.00 0.00 176.54 176.71 2hc5 h GLU 46 N -0.39 0.00 -0.16 4.80 4.11 -1.36 -2.59 114.58 119.00 2hc5 h GLU 46 Ca -0.04 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.39 2hc5 h GLU 46 Cb 0.30 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 2hc5 h GLU 46 CO 0.06 0.51 0.07 0.52 0.07 0.00 0.00 179.01 180.23 2hc5 h MET 47 N 0.00 0.23 -0.64 1.06 2.86 -0.73 -2.89 114.93 114.81 2hc5 h MET 47 Ca -0.01 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.57 2hc5 h MET 47 Cb 0.91 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 32.51 2hc5 h MET 47 CO 0.07 0.29 0.30 -0.91 1.06 0.00 0.00 176.91 177.72 2hc5 h ASN 48 N 0.11 0.84 0.20 1.22 2.35 -1.16 -2.37 115.58 116.78 2hc5 h ASN 48 Ca 0.05 -0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 2hc5 h ASN 48 Cb 0.14 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.30 2hc5 h ASN 48 CO -0.01 0.75 0.00 0.29 -1.65 0.00 0.00 177.43 176.81 2hc5 n LYS 49 N -4.48 0.38 0.05 0.81 5.02 -0.99 -0.57 118.16 118.38 2hc5 n LYS 49 Ca 0.04 0.07 0.00 0.00 -2.02 0.00 0.00 58.31 56.41 2hc5 n LYS 49 Cb 0.13 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.58 2hc5 n LYS 49 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2hc5 h LEU 50 N 0.00 0.00 0.00 -0.35 3.38 -1.21 -3.39 115.31 113.74 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 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2hc5 h LEU 50 CO 0.00 0.58 -0.73 0.18 0.09 0.00 0.00 178.44 178.56 2hc5 n LEU 51 N -2.95 0.29 -0.09 1.67 4.77 -0.42 -4.55 117.00 115.73 2hc5 n LEU 51 Ca -0.08 -0.35 -0.07 0.00 -0.03 0.00 0.00 56.01 55.49 2hc5 n LEU 51 Cb 0.83 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.92 2hc5 n LEU 51 CO 0.43 0.07 0.91 -0.33 -1.33 0.00 0.00 177.39 177.14 2hc5 h GLU 52 N 0.00 0.19 -1.31 3.23 4.39 -1.03 -2.41 114.58 117.64 2hc5 h GLU 52 Ca 0.00 -0.01 -0.08 0.00 0.34 0.00 0.00 59.36 59.61 2hc5 h GLU 52 Cb 0.28 -0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 28.84 2hc5 h GLU 52 CO 0.00 0.12 0.11 -2.30 -1.16 0.00 0.00 179.01 175.78 2hc5 n PRO 53 N -5.07 1.20 -3.52 2.33 -0.02 -1.26 -4.84 135.00 123.81 2hc5 n PRO 53 Ca 0.00 -0.44 -0.16 0.00 -2.02 0.00 0.00 63.50 60.89 2hc5 n PRO 53 Cb 0.13 -1.17 -0.05 0.00 -0.02 0.00 0.00 33.50 32.39 2hc5 n PRO 53 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2hc5 n SER 54 N 0.59 0.91 -0.05 2.55 3.41 -0.91 -3.61 113.62 116.51 2hc5 n SER 54 Ca 0.09 -2.39 -0.16 0.00 -0.26 0.00 0.00 58.87 56.15 2hc5 n SER 54 Cb 0.61 0.72 -0.06 0.00 -0.26 0.00 0.00 64.21 65.22 2hc5 n SER 54 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 2hc5 h GLN 55 N 0.00 0.75 -4.50 4.33 5.75 -1.49 -3.41 115.11 116.53 2hc5 h GLN 55 Ca -0.20 -0.54 -0.72 0.00 -0.15 0.00 0.00 58.65 57.05 2hc5 h GLN 55 Cb 0.78 0.09 -0.21 0.00 1.07 0.00 0.00 27.48 29.20 2hc5 h GLN 55 CO 0.31 1.16 -0.23 0.14 -2.65 0.00 0.00 178.83 177.55 2hc5 s VAL 56 N -3.93 5.14 -1.13 2.39 -7.23 -1.26 -4.92 120.40 109.46 2hc5 s VAL 56 Ca -0.11 -0.87 -0.14 0.00 -1.81 0.00 0.00 61.98 59.05 2hc5 s VAL 56 Cb 0.08 -4.16 0.18 0.00 0.56 0.00 0.00 36.38 33.05 2hc5 s VAL 56 CO 0.87 -0.62 1.31 -1.00 -0.31 0.00 0.00 175.10 175.35 2hc5 s HIS 57 N 1.92 3.56 -0.12 2.82 3.76 -1.26 -4.65 115.29 121.32 2hc5 s HIS 57 Ca 0.07 -2.09 -0.29 0.00 -0.15 0.00 0.00 55.06 52.60 2hc5 s HIS 57 Cb -0.22 -4.22 -0.03 0.00 1.11 0.00 0.00 32.58 29.22 2hc5 s HIS 57 CO 0.08 -1.33 1.44 -0.51 -0.85 0.00 0.00 174.74 173.57 2hc5 s LEU 58 N 1.28 4.23 -0.51 0.89 2.01 -1.26 -3.30 118.68 122.03 2hc5 s LEU 58 Ca 0.38 1.92 -0.19 0.00 0.01 0.00 0.00 54.13 56.25 2hc5 s LEU 58 Cb -0.04 -3.54 0.06 0.00 0.01 0.00 0.00 46.19 42.68 2hc5 s LEU 58 CO -0.03 -0.84 0.64 -0.54 1.01 0.00 0.00 176.35 176.58 2hc5 s LYS 59 N 3.76 3.14 -0.31 1.70 1.02 0.88 -4.78 119.74 125.15 2hc5 s LYS 59 Ca 0.63 -0.84 -0.22 0.00 0.02 0.00 0.00 55.97 55.56 2hc5 s LYS 59 Cb -0.27 -4.09 -0.00 0.00 -0.52 0.00 0.00 37.83 32.95 2hc5 s LYS 59 CO 0.21 -1.23 0.71 -0.06 -0.92 0.00 0.00 175.35 174.07 2hc5 s PHE 60 N 2.69 3.20 -0.05 3.18 0.08 -1.26 -1.12 117.98 124.70 2hc5 s PHE 60 Ca 0.16 0.68 0.06 0.00 0.12 0.00 0.00 56.93 57.95 2hc5 s PHE 60 Cb -0.19 -3.12 -0.01 0.00 -0.57 0.00 0.00 43.02 39.13 2hc5 s PHE 60 CO 0.12 -0.53 -0.24 -2.00 -0.10 0.00 0.00 175.22 172.47 2hc5 s GLU 61 N 2.80 2.50 -0.13 0.44 2.56 -0.65 -4.93 118.70 121.29 2hc5 s GLU 61 Ca 0.29 -0.89 -0.22 0.00 0.00 0.00 0.00 54.97 54.15 2hc5 s GLU 61 Cb -0.14 -2.17 -0.03 0.00 2.00 0.00 0.00 34.13 33.78 2hc5 s GLU 61 CO 0.12 0.43 0.68 -1.17 -0.56 0.00 0.00 175.26 174.76 2hc5 s LEU 62 N -0.27 4.23 -0.02 2.70 2.96 -1.26 -0.88 118.68 126.13 2hc5 s LEU 62 Ca -0.00 1.03 0.01 0.00 -0.22 0.00 0.00 54.13 54.95 2hc5 s LEU 62 Cb -0.13 -3.00 0.01 0.00 0.50 0.00 0.00 46.19 43.57 2hc5 s LEU 62 CO 0.03 -0.21 -0.05 -1.00 -1.32 0.00 0.00 176.35 173.80 2hc5 s HIS 63 N 1.40 0.60 0.32 5.38 3.76 0.22 -5.00 115.29 121.97 2hc5 s HIS 63 Ca 0.33 -0.13 0.09 0.00 -0.15 0.00 0.00 55.06 55.20 2hc5 s HIS 63 Cb -0.17 -0.48 -0.05 0.00 1.11 0.00 0.00 32.58 33.00 2hc5 s HIS 63 CO 0.14 -0.09 0.05 0.16 -0.85 0.00 0.00 174.74 174.15 2hc5 s ASP 64 N 0.36 4.44 0.00 1.40 -4.77 -1.26 -0.51 116.67 116.32 2hc5 s ASP 64 Ca -0.04 -0.83 0.00 0.00 -3.30 0.00 0.00 52.55 48.38 2hc5 s ASP 64 Cb -0.08 -0.67 0.00 0.00 -1.09 0.00 0.00 42.92 41.07 2hc5 s ASP 64 CO -0.00 -0.20 0.00 2.29 0.70 0.00 0.00 175.17 177.96 2hc5 n LYS 65 N -1.01 0.00 0.00 2.11 2.85 0.10 -4.96 118.16 117.25 2hc5 n LYS 65 Ca -0.04 0.00 -0.03 0.00 -1.05 0.00 0.00 58.31 57.19 2hc5 n LYS 65 Cb 0.61 0.00 -0.02 0.00 -0.65 0.00 0.00 35.03 34.97 2hc5 n LYS 65 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 177.40 178.60 2hc5 h LEU 66 N 0.00 -0.29 0.00 -5.58 6.46 -2.06 -3.38 115.31 110.46 2hc5 h LEU 66 Ca 0.00 0.03 -0.10 0.00 -0.12 0.00 0.00 57.88 57.69 2hc5 h LEU 66 Cb 0.00 0.11 -0.02 0.00 -0.73 0.00 0.00 40.66 40.02 2hc5 h LEU 66 CO 0.00 -0.09 -1.46 -3.20 -0.62 0.00 0.00 178.44 173.07 2hc5 n ASN 67 N -3.03 3.22 -4.91 1.25 4.05 -1.26 -5.03 115.26 109.54 2hc5 n ASN 67 Ca -0.01 0.00 -0.29 0.00 0.45 0.00 0.00 54.58 54.73 2hc5 n ASN 67 Cb 0.07 0.84 -0.04 0.00 1.23 0.00 0.00 39.78 41.88 2hc5 n ASN 67 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 177.26 172.60 2hc5 s GLU 68 N -2.26 3.36 -0.12 1.20 0.41 -1.26 -5.10 118.70 114.92 2hc5 s GLU 68 Ca -0.03 -0.55 -0.03 0.00 -0.41 0.00 0.00 54.97 53.94 2hc5 s GLU 68 Cb 0.03 -2.96 0.05 0.00 -1.78 0.00 0.00 34.13 29.47 2hc5 s GLU 68 CO 0.30 0.56 0.06 1.52 -0.49 0.00 0.00 175.26 177.21 2hc5 s TYR 69 N -1.61 0.37 0.30 1.61 1.13 -1.26 0.00 117.35 117.89 2hc5 s TYR 69 Ca 0.34 -0.23 0.06 0.00 -1.41 0.00 0.00 57.07 55.83 2hc5 s TYR 69 Cb -0.12 -0.71 -0.06 0.00 -1.10 0.00 0.00 41.96 39.97 2hc5 s TYR 69 CO 0.27 -0.41 -0.02 1.52 -2.51 0.00 0.00 175.55 174.40 2hc5 s TYR 70 N 2.07 2.00 -0.13 -3.49 1.13 0.33 -4.07 117.35 115.18 2hc5 s TYR 70 Ca 0.03 -0.77 -0.02 0.00 -1.41 0.00 0.00 57.07 54.89 2hc5 s TYR 70 Cb -0.15 -1.21 -0.03 0.00 -1.10 0.00 0.00 41.96 39.48 2hc5 s TYR 70 CO -0.07 0.21 -0.05 0.08 -2.51 0.00 0.00 175.55 173.22 2hc5 s VAL 71 N -3.07 3.83 -0.00 -3.49 1.01 -0.85 -0.61 120.40 117.22 2hc5 s VAL 71 Ca 0.32 -0.39 0.03 0.00 0.00 0.00 0.00 61.98 61.94 2hc5 s VAL 71 Cb 0.06 -2.65 -0.03 0.00 0.00 0.00 0.00 36.38 33.75 2hc5 s VAL 71 CO 0.13 0.52 -0.08 -1.59 0.00 0.00 0.00 175.10 174.09 2hc5 s LYS 72 N 0.06 2.53 -0.36 2.72 -2.85 -0.06 -1.21 119.74 120.57 2hc5 s LYS 72 Ca -0.01 -0.73 -0.16 0.00 -1.00 0.00 0.00 55.97 54.07 2hc5 s LYS 72 Cb -0.14 -2.48 -0.00 0.00 -2.06 0.00 0.00 37.83 33.15 2hc5 s LYS 72 CO 0.03 0.60 0.42 0.08 0.10 0.00 0.00 175.35 176.58 2hc5 s VAL 73 N -0.97 5.11 -0.31 1.79 1.01 0.12 -1.63 120.40 125.52 2hc5 s VAL 73 Ca 0.16 0.01 -0.05 0.00 0.00 0.00 0.00 61.98 62.10 2hc5 s VAL 73 Cb -0.11 -3.91 0.03 0.00 0.00 0.00 0.00 36.38 32.39 2hc5 s VAL 73 CO 0.07 -0.21 0.06 -0.63 0.00 0.00 0.00 175.10 174.39 2hc5 s ILE 74 N 2.14 3.54 0.24 2.22 1.01 -0.27 -1.62 121.20 128.45 2hc5 s ILE 74 Ca 0.13 -1.07 -0.30 0.00 0.00 0.00 0.00 60.65 59.41 2hc5 s ILE 74 Cb -0.16 -2.95 -0.10 0.00 0.01 0.00 0.00 42.46 39.26 2hc5 s ILE 74 CO 0.13 -0.06 1.36 -0.70 0.00 0.00 0.00 174.94 175.66 2hc5 s GLU 75 N 1.38 4.34 0.09 2.79 2.56 -0.79 -0.08 118.70 128.98 2hc5 s GLU 75 Ca -0.01 2.18 0.03 0.00 0.00 0.00 0.00 54.97 57.17 2hc5 s GLU 75 Cb -0.19 -3.14 -0.24 0.00 2.00 0.00 0.00 34.13 32.57 2hc5 s GLU 75 CO 0.01 -0.30 1.16 0.22 -0.56 0.00 0.00 175.26 175.80 2hc5 h ASP 76 N 4.84 0.15 -0.28 -1.70 3.58 -1.88 0.19 116.42 121.32 2hc5 h ASP 76 Ca -0.46 -0.17 -0.05 0.00 0.42 0.00 0.00 57.03 56.77 2hc5 h ASP 76 Cb 1.22 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 42.21 2hc5 h ASP 76 CO 0.75 1.14 -0.01 -1.28 -2.88 0.00 0.00 179.24 176.95 2hc5 h SER 77 N 0.03 0.50 0.43 2.28 0.87 -1.91 -3.25 113.55 112.49 2hc5 h SER 77 Ca -0.08 -0.32 -0.15 0.00 -1.23 0.00 0.00 61.79 60.01 2hc5 h SER 77 Cb 1.86 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 63.66 2hc5 h SER 77 CO 0.15 0.70 -1.69 0.35 -0.53 0.00 0.00 176.83 175.80 2hc5 n THR 78 N -4.58 0.89 -1.41 2.23 -2.24 -1.25 -4.97 114.28 102.96 2hc5 n THR 78 Ca -0.03 -0.66 -0.14 0.00 -2.27 0.00 0.00 64.05 60.95 2hc5 n THR 78 Cb 0.26 -0.47 -0.06 0.00 -2.10 0.00 0.00 70.33 67.96 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 -2.69 -4.68 -4.88 3.42 3.02 0.66 -5.00 115.26 105.11 2hc5 n ASN 79 Ca -0.12 0.34 -0.21 0.00 -0.03 0.00 0.00 54.58 54.57 2hc5 n ASN 79 Cb 0.81 -3.41 -0.03 0.00 -0.61 0.00 0.00 39.78 36.54 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 -3.19 2.63 -0.46 3.52 -1.05 -1.23 -4.90 118.70 114.03 2hc5 s GLU 80 Ca 0.00 -1.42 -0.21 0.00 -0.15 0.00 0.00 54.97 53.19 2hc5 s GLU 80 Cb 0.00 -2.45 0.03 0.00 -0.44 0.00 0.00 34.13 31.27 2hc5 s GLU 80 CO 0.00 -0.10 0.68 0.08 0.95 0.00 0.00 175.26 176.87 2hc5 s VAL 81 N -2.40 4.78 -0.76 1.83 1.01 -1.26 -1.89 120.40 121.70 2hc5 s VAL 81 Ca 0.46 0.09 0.24 0.00 0.00 0.00 0.00 61.98 62.77 2hc5 s VAL 81 Cb -0.05 -4.26 -0.01 0.00 0.00 0.00 0.00 36.38 32.07 2hc5 s VAL 81 CO 0.28 -0.68 1.27 2.30 0.00 0.00 0.00 175.10 178.27 2hc5 n ILE 82 N 5.89 0.18 -3.63 2.22 -5.35 -0.64 -4.91 119.36 113.12 2hc5 n ILE 82 Ca -0.01 -0.17 -0.10 0.00 -0.27 0.00 0.00 62.75 62.19 2hc5 n ILE 82 Cb 0.48 0.10 -0.07 0.00 -1.74 0.00 0.00 39.64 38.40 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 -3.12 0.56 -0.22 6.28 6.06 -1.21 -5.02 118.95 122.29 2hc5 s ARG 83 Ca 0.07 0.59 0.02 0.00 -2.50 0.00 0.00 55.73 53.91 2hc5 s ARG 83 Cb 0.15 0.27 0.05 0.00 0.06 0.00 0.00 34.95 35.48 2hc5 s ARG 83 CO 0.74 -0.08 -0.11 -1.21 -2.50 0.00 0.00 175.30 172.13 2hc5 s GLU 84 N 0.08 2.20 -0.31 5.12 2.02 -1.26 0.10 118.70 126.66 2hc5 s GLU 84 Ca 0.02 -1.05 -0.10 0.00 0.02 0.00 0.00 54.97 53.86 2hc5 s GLU 84 Cb -0.04 -2.64 -0.01 0.00 0.10 0.00 0.00 34.13 31.54 2hc5 s GLU 84 CO -0.04 -0.47 0.15 0.42 0.02 0.00 0.00 175.26 175.34 2hc5 s ILE 85 N 1.27 4.63 0.69 -1.63 1.09 -0.35 -5.00 121.20 121.91 2hc5 s ILE 85 Ca -0.04 -0.40 -0.14 0.00 -1.10 0.00 0.00 60.65 58.97 2hc5 s ILE 85 Cb -0.17 -3.36 0.02 0.00 -1.06 0.00 0.00 42.46 37.89 2hc5 s ILE 85 CO -0.07 0.07 1.13 -2.16 -0.10 0.00 0.00 174.94 173.80 2hc5 s PRO 86 N 1.62 2.55 0.45 2.79 0.04 -1.26 -2.01 135.00 139.18 2hc5 s PRO 86 Ca 0.05 1.44 0.16 0.00 0.04 0.00 0.00 61.00 62.68 2hc5 s PRO 86 Cb -0.17 -1.92 1.09 0.00 0.04 0.00 0.00 34.50 33.54 2hc5 s PRO 86 CO 0.06 -1.45 1.97 -1.00 0.04 0.00 0.00 177.00 176.63 2hc5 h PRO 87 N -0.22 0.33 -0.30 0.56 0.13 -1.95 0.15 132.00 130.70 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 1.25 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2hc5 h PRO 87 CO 0.52 0.22 0.00 0.36 -0.23 0.00 0.00 178.00 178.88 2hc5 n LYS 88 N -4.46 1.74 0.00 0.86 2.85 -1.26 -2.74 118.16 115.14 2hc5 n LYS 88 Ca 0.10 -1.14 0.00 0.00 -1.05 0.00 0.00 58.31 56.22 2hc5 n LYS 88 Cb 0.43 -1.27 0.00 0.00 -0.65 0.00 0.00 35.03 33.54 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 0.42 2.87 -0.15 -1.58 5.12 0.41 -4.77 116.66 118.97 2hc5 n ARG 89 Ca 0.11 -0.21 -0.01 0.00 -1.93 0.00 0.00 57.85 55.82 2hc5 n ARG 89 Cb 0.28 -0.68 0.24 0.00 -1.16 0.00 0.00 32.46 31.14 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 0.00 0.85 -0.16 -1.55 2.91 -1.01 -2.32 115.95 114.66 2hc5 h TRP 90 Ca 0.00 -0.03 -0.06 0.00 1.13 0.00 0.00 58.89 59.94 2hc5 h TRP 90 Cb 0.03 -0.27 -0.01 0.00 -0.51 0.00 0.00 29.16 28.40 2hc5 h TRP 90 CO 0.00 0.63 -0.15 -0.07 -1.03 0.00 0.00 178.44 177.82 2hc5 h LEU 91 N 0.85 0.25 -0.16 0.65 -0.00 -1.86 0.36 115.31 115.40 2hc5 h LEU 91 Ca 0.21 -0.06 -0.04 0.00 -0.00 0.00 0.00 57.88 57.99 2hc5 h LEU 91 Cb 0.10 -0.07 -0.00 0.00 -0.00 0.00 0.00 40.66 40.69 2hc5 h LEU 91 CO -0.03 0.42 -0.06 0.44 -0.00 0.00 0.00 178.44 179.21 2hc5 h ASP 92 N 0.25 0.33 -0.28 -0.43 3.32 -1.77 -1.63 116.42 116.20 2hc5 h ASP 92 Ca 0.05 -0.40 -0.05 0.00 0.02 0.00 0.00 57.03 56.65 2hc5 h ASP 92 Cb 0.42 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 2hc5 h ASP 92 CO 0.03 0.65 -0.02 0.15 -1.72 0.00 0.00 179.24 178.33 2hc5 h PHE 93 N -0.00 0.56 -0.71 4.55 3.57 -1.21 -1.56 116.94 122.14 2hc5 h PHE 93 Ca 0.04 -0.10 0.01 0.00 3.53 0.00 0.00 57.97 61.44 2hc5 h PHE 93 Cb 0.52 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 39.08 2hc5 h PHE 93 CO 0.06 0.67 0.46 -0.92 -2.23 0.00 0.00 178.31 176.36 2hc5 h TYR 94 N 0.29 0.88 -0.38 0.41 3.20 -0.32 -1.41 116.97 119.64 2hc5 h TYR 94 Ca 0.08 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.92 2hc5 h TYR 94 Cb 0.46 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.42 2hc5 h TYR 94 CO 0.04 0.54 0.03 0.00 -1.64 0.00 0.00 178.16 177.13 2hc5 h ALA 95 N 1.27 0.50 -0.47 1.82 0.00 -1.23 -2.56 119.26 118.59 2hc5 h ALA 95 Ca 0.26 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.98 2hc5 h ALA 95 Cb -0.08 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.53 2hc5 h ALA 95 CO -0.07 0.24 0.23 0.00 0.00 0.00 0.00 179.25 179.66 2hc5 h ALA 96 N 0.89 0.59 -0.45 0.00 0.00 -0.80 -0.37 119.26 119.12 2hc5 h ALA 96 Ca 0.11 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 2hc5 h ALA 96 Cb 0.42 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2hc5 h ALA 96 CO 0.01 -0.12 0.02 0.52 0.00 0.00 0.00 179.25 179.68 2hc5 h MET 97 N 0.46 0.79 -0.57 0.00 2.07 -1.24 -2.22 114.93 114.22 2hc5 h MET 97 Ca 0.21 -0.24 -0.09 0.00 -2.07 0.00 0.00 59.70 57.51 2hc5 h MET 97 Cb 0.12 -0.08 -0.02 0.00 -1.87 0.00 0.00 31.60 29.75 2hc5 h MET 97 CO -0.15 0.84 0.01 1.15 1.07 0.00 0.00 176.91 179.83 2hc5 h THR 98 N 0.64 1.26 -0.91 2.22 2.02 -1.11 0.52 112.91 117.56 2hc5 h THR 98 Ca 0.13 -1.09 -0.01 0.00 0.77 0.00 0.00 66.41 66.21 2hc5 h THR 98 Cb 0.47 0.81 -0.04 0.00 -1.74 0.00 0.00 68.15 67.65 2hc5 h THR 98 CO 0.02 0.39 0.52 -0.33 0.37 0.00 0.00 175.52 176.49 2hc5 h GLU 99 N 0.90 1.25 0.00 6.66 4.39 -0.96 -0.23 114.58 126.58 2hc5 h GLU 99 Ca 0.17 -0.13 -0.02 0.00 0.34 0.00 0.00 59.36 59.72 2hc5 h GLU 99 Cb 0.51 -0.25 -0.00 0.00 -0.10 0.00 0.00 28.75 28.90 2hc5 h GLU 99 CO 0.02 0.90 -0.18 0.35 -1.16 0.00 0.00 179.01 178.95 2hc5 h PHE 100 N 1.27 0.00 0.00 4.33 3.57 -0.87 -3.38 116.94 121.85 2hc5 h PHE 100 Ca 0.32 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.82 2hc5 h PHE 100 Cb -0.01 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.73 2hc5 h PHE 100 CO 0.01 0.29 0.00 -0.07 -2.23 0.00 0.00 178.31 176.31 2hc5 h LEU 101 N -1.00 0.00 0.00 0.59 4.07 -0.07 -2.76 115.31 116.14 2hc5 h LEU 101 Ca -0.02 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.94 2hc5 h LEU 101 Cb 0.37 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.11 2hc5 h LEU 101 CO -0.01 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 177.96 2hc5 n GLY 102 N 0.97 -0.95 0.09 0.83 0.00 -0.10 -1.93 105.19 104.09 2hc5 n GLY 102 Ca 0.04 -0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.16 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 -0.54 0.71 -1.23 0.99 4.77 -1.04 -4.05 117.00 116.61 2hc5 n LEU 103 Ca 0.02 0.24 0.07 0.00 -0.03 0.00 0.00 56.01 56.31 2hc5 n LEU 103 Cb 0.01 -0.07 0.27 0.00 -2.33 0.00 0.00 43.42 41.30 2hc5 n LEU 103 CO 0.01 -0.13 0.71 0.49 -1.33 0.00 0.00 177.39 177.15 2hc5 n PHE 104 N -2.49 1.07 -2.76 -1.77 3.72 -0.82 -4.94 117.46 109.48 2hc5 n PHE 104 Ca 0.00 -0.44 -0.41 0.00 -0.05 0.00 0.00 57.45 56.56 2hc5 n PHE 104 Cb 0.53 -0.17 -0.05 0.00 -0.94 0.00 0.00 39.48 38.85 2hc5 n PHE 104 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 2hc5 s VAL 105 N -1.70 4.33 -0.24 -4.37 -7.23 -1.26 -5.00 120.40 104.93 2hc5 s VAL 105 Ca 0.38 2.05 -0.04 0.00 -1.81 0.00 0.00 61.98 62.57 2hc5 s VAL 105 Cb 0.24 -4.31 0.01 0.00 0.56 0.00 0.00 36.38 32.87 2hc5 s VAL 105 CO 0.19 0.40 -0.03 -0.62 -0.31 0.00 0.00 175.10 174.73 2hc5 s ASP 106 N -0.53 4.39 0.01 4.85 -1.08 -1.26 -5.02 116.67 118.03 2hc5 s ASP 106 Ca 0.44 -0.59 -0.01 0.00 -0.52 0.00 0.00 52.55 51.87 2hc5 s ASP 106 Cb -0.24 -1.73 0.01 0.00 -1.46 0.00 0.00 42.92 39.49 2hc5 s ASP 106 CO 0.30 -0.08 0.06 -0.62 0.52 0.00 0.00 175.17 175.35 2hc5 n GLU 107 N 4.77 -0.01 0.00 4.34 4.71 -1.26 0.14 120.64 133.32 2hc5 n GLU 107 Ca -0.17 0.06 0.15 0.00 -0.01 0.00 0.00 57.16 57.18 2hc5 n GLU 107 Cb 0.49 -0.09 0.74 0.00 -1.01 0.00 0.00 31.44 31.58 2hc5 n GLU 107 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 2hc5 n LYS 108 N -4.05 0.37 -0.18 3.49 4.76 -1.26 -2.27 118.16 119.01 2hc5 n LYS 108 Ca 0.00 0.00 0.07 0.00 -2.87 0.00 0.00 58.31 55.51 2hc5 n LYS 108 Cb 0.01 -1.50 0.17 0.00 -1.84 0.00 0.00 35.03 31.87 2hc5 n LYS 108 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2hc5 n LYS 109 N -1.32 2.48 0.01 1.97 5.02 0.37 -4.71 118.16 121.98 2hc5 n LYS 109 Ca 0.13 -2.03 -0.00 0.00 -2.02 0.00 0.00 58.31 54.39 2hc5 n LYS 109 Cb 0.26 -1.32 -0.00 0.00 -0.02 0.00 0.00 35.03 33.94 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 2.57 -0.02 2.59 -0.35 3.38 -0.89 -3.46 115.31 119.13 2hc5 h LEU 110 Ca 0.00 0.00 -0.39 0.00 0.09 0.00 0.00 57.88 57.58 2hc5 h LEU 110 Cb 0.75 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 2hc5 h LEU 110 CO 0.00 -0.00 -0.51 -0.62 0.09 0.00 0.00 178.44 177.40 2hc5 n GLU 111 N -2.11 -1.91 -4.06 1.13 1.02 -1.26 -5.00 120.64 108.44 2hc5 n GLU 111 Ca -0.00 0.94 -0.36 0.00 -0.02 0.00 0.00 57.16 57.72 2hc5 n GLU 111 Cb 0.01 -5.55 -0.07 0.00 -0.02 0.00 0.00 31.44 25.80 2hc5 n GLU 111 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 2hc5 s HIS 112 N -3.00 3.43 -0.02 -0.32 3.76 -1.26 -5.03 115.29 112.86 2hc5 s HIS 112 Ca 0.03 0.39 -0.34 0.00 -0.15 0.00 0.00 55.06 55.00 2hc5 s HIS 112 Cb -0.01 -1.87 -0.12 0.00 1.11 0.00 0.00 32.58 31.68 2hc5 s HIS 112 CO 0.04 0.63 1.83 1.58 -0.85 0.00 0.00 174.74 177.97 2hc5 n HIS 113 N 1.96 2.35 0.00 1.40 -0.00 -1.26 -4.32 115.22 115.35 2hc5 n HIS 113 Ca -0.19 0.00 0.00 0.00 0.46 0.00 0.00 57.72 57.99 2hc5 n HIS 113 Cb 0.54 -2.66 0.00 0.00 -0.12 0.00 0.00 29.99 27.75 2hc5 n HIS 113 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 2hc5 n HIS 114 N 6.04 0.00 0.00 1.57 -0.00 -1.26 -4.23 115.22 117.34 2hc5 n HIS 114 Ca 0.21 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.39 2hc5 n HIS 114 Cb 0.31 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.18 2hc5 n HIS 114 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 2hc5 n HIS 115 N 0.00 0.00 -1.40 1.57 -0.00 -1.26 -5.04 115.22 109.09 2hc5 n HIS 115 Ca 0.00 0.00 -0.25 0.00 0.46 0.00 0.00 57.72 57.93 2hc5 n HIS 115 Cb 0.00 0.00 0.12 0.00 -0.12 0.00 0.00 29.99 29.99 2hc5 n HIS 115 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 2hc5 n HIS 116 N 0.00 2.78 -1.44 1.57 -0.00 -1.26 -5.23 115.22 111.64 2hc5 n HIS 116 Ca 0.00 -2.34 0.00 0.00 -0.00 0.00 0.00 57.72 55.38 2hc5 n HIS 116 Cb 0.00 -1.01 0.00 0.00 -0.00 0.00 0.00 29.99 28.98 2hc5 n HIS 116 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92