#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 -8.01 0.27 -1.43 4.13 -1.26 -4.69 115.26 104.28 2hc5 n ASN 2 Ca 0.00 1.80 0.17 0.00 1.68 0.00 0.00 54.58 58.23 2hc5 n ASN 2 Cb 0.00 -5.28 0.71 0.00 -1.54 0.00 0.00 39.78 33.67 2hc5 n ASN 2 CO 0.00 0.00 0.00 -0.29 0.28 0.00 0.00 177.26 177.25 2hc5 h ILE 3 N 4.28 0.00 0.00 2.41 6.09 -1.95 -1.68 117.51 126.65 2hc5 h ILE 3 Ca -0.10 -0.46 0.00 0.00 -1.37 0.00 0.00 64.86 62.92 2hc5 h ILE 3 Cb 0.24 1.44 0.00 0.00 0.47 0.00 0.00 36.82 38.97 2hc5 h ILE 3 CO 0.00 0.00 0.00 -0.62 -3.07 0.00 0.00 178.15 174.46 2hc5 n GLU 4 N -3.03 0.05 0.00 2.19 4.71 -1.26 -1.56 120.64 121.73 2hc5 n GLU 4 Ca 0.00 0.25 0.08 0.00 -0.01 0.00 0.00 57.16 57.48 2hc5 n GLU 4 Cb 0.29 -1.50 0.02 0.00 -1.01 0.00 0.00 31.44 29.24 2hc5 n GLU 4 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 2hc5 n ARG 5 N -1.44 1.58 -2.09 3.49 1.74 -0.63 -4.40 116.66 114.92 2hc5 n ARG 5 Ca 0.04 -1.03 -0.42 0.00 -0.77 0.00 0.00 57.85 55.67 2hc5 n ARG 5 Cb 0.13 -1.29 -0.03 0.00 -1.02 0.00 0.00 32.46 30.26 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 -1.83 3.46 -0.15 0.55 2.96 -0.60 -4.84 118.68 118.23 2hc5 s LEU 6 Ca 0.15 0.94 -0.14 0.00 -0.22 0.00 0.00 54.13 54.87 2hc5 s LEU 6 Cb 0.13 -3.26 -0.24 0.00 0.50 0.00 0.00 46.19 43.32 2hc5 s LEU 6 CO 0.34 -1.82 0.36 0.71 -1.32 0.00 0.00 176.35 174.62 2hc5 h THR 7 N 6.75 0.83 -3.63 3.68 1.35 -1.88 0.25 112.91 120.26 2hc5 h THR 7 Ca -0.30 -2.30 -0.12 0.00 -0.55 0.00 0.00 66.41 63.13 2hc5 h THR 7 Cb 1.15 2.46 -0.06 0.00 -1.73 0.00 0.00 68.15 69.97 2hc5 h THR 7 CO 1.09 0.64 -0.03 0.28 -0.25 0.00 0.00 175.52 177.26 2hc5 s THR 8 N -2.47 0.00 -0.55 6.82 -1.32 -1.26 -3.05 115.64 113.80 2hc5 s THR 8 Ca -0.24 -1.35 -0.01 0.00 -1.21 0.00 0.00 61.69 58.87 2hc5 s THR 8 Cb 0.06 -2.54 0.41 0.00 -1.51 0.00 0.00 72.50 68.92 2hc5 s THR 8 CO 0.70 0.00 2.01 0.18 -2.21 0.00 0.00 174.62 175.30 2hc5 n LEU 9 N -0.50 7.25 0.08 9.08 4.77 -1.26 -4.71 117.00 131.71 2hc5 n LEU 9 Ca -0.02 -3.94 -0.13 0.00 -0.03 0.00 0.00 56.01 51.89 2hc5 n LEU 9 Cb 0.61 -0.98 -0.06 0.00 -2.33 0.00 0.00 43.42 40.66 2hc5 n LEU 9 CO 0.26 1.35 0.63 -0.61 -1.33 0.00 0.00 177.39 177.69 2hc5 h GLN 10 N 1.74 -0.52 0.00 3.23 5.75 -2.00 -0.65 115.11 122.66 2hc5 h GLN 10 Ca 0.53 0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 59.06 2hc5 h GLN 10 Cb 1.05 0.12 -0.00 0.00 1.07 0.00 0.00 27.48 29.71 2hc5 h GLN 10 CO 1.32 -0.35 -0.03 -1.35 -2.65 0.00 0.00 178.83 175.78 2hc5 h PRO 11 N -0.54 0.00 -0.08 -2.39 0.11 -2.00 -2.43 132.00 124.66 2hc5 h PRO 11 Ca 0.05 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 66.00 2hc5 h PRO 11 Cb 0.60 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.72 2hc5 h PRO 11 CO -0.26 0.03 -0.56 0.28 -0.21 0.00 0.00 178.00 177.28 2hc5 h VAL 12 N 0.00 1.37 -0.20 3.15 2.07 -1.63 -2.43 116.25 118.58 2hc5 h VAL 12 Ca -0.00 -1.90 -0.09 0.00 0.82 0.00 0.00 66.70 65.53 2hc5 h VAL 12 Cb 0.34 2.25 -0.01 0.00 -1.52 0.00 0.00 31.29 32.35 2hc5 h VAL 12 CO 0.00 0.57 -0.28 -0.50 0.02 0.00 0.00 177.57 177.39 2hc5 h TRP 13 N 0.13 0.44 -0.54 1.57 -0.00 -0.73 0.47 115.95 117.29 2hc5 h TRP 13 Ca -0.05 -0.09 -0.04 0.00 -0.00 0.00 0.00 58.89 58.70 2hc5 h TRP 13 Cb 1.22 -0.11 -0.02 0.00 -0.00 0.00 0.00 29.16 30.25 2hc5 h TRP 13 CO 0.12 0.64 0.16 -0.44 -0.00 0.00 0.00 178.44 178.92 2hc5 h ASP 14 N 0.35 0.79 0.86 -3.49 3.32 -1.43 -2.47 116.42 114.34 2hc5 h ASP 14 Ca 0.05 -0.21 -0.16 0.00 0.02 0.00 0.00 57.03 56.73 2hc5 h ASP 14 Cb 0.67 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.99 2hc5 h ASP 14 CO 0.05 0.79 -0.77 -0.09 -1.72 0.00 0.00 179.24 177.50 2hc5 h ARG 15 N 0.74 0.00 -0.63 3.56 2.43 -1.14 -3.20 114.38 116.14 2hc5 h ARG 15 Ca 0.17 0.00 0.09 0.00 -0.81 0.00 0.00 59.98 59.43 2hc5 h ARG 15 Cb 0.29 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 29.77 2hc5 h ARG 15 CO -0.00 0.77 0.27 -0.92 -1.51 0.00 0.00 179.97 178.58 2hc5 h TYR 16 N 0.00 0.49 -0.64 2.20 5.03 0.23 -0.18 116.97 124.09 2hc5 h TYR 16 Ca -0.01 0.03 -0.07 0.00 2.58 0.00 0.00 58.73 61.27 2hc5 h TYR 16 Cb 1.40 -0.12 -0.03 0.00 1.55 0.00 0.00 36.73 39.54 2hc5 h TYR 16 CO 0.00 0.16 0.15 0.22 -1.32 0.00 0.00 178.16 177.36 2hc5 h ASP 17 N 0.48 0.99 0.83 -2.11 3.58 -1.45 0.28 116.42 119.02 2hc5 h ASP 17 Ca 0.31 -0.24 0.00 0.00 0.42 0.00 0.00 57.03 57.53 2hc5 h ASP 17 Cb 0.35 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 41.14 2hc5 h ASP 17 CO -0.28 0.97 0.00 0.35 -2.88 0.00 0.00 179.24 177.40 2hc5 n THR 18 N -4.30 0.13 -0.12 2.25 -2.24 -0.78 -2.46 114.28 106.76 2hc5 n THR 18 Ca 0.04 0.03 -0.19 0.00 -2.27 0.00 0.00 64.05 61.66 2hc5 n THR 18 Cb 0.26 -0.57 -0.10 0.00 -2.10 0.00 0.00 70.33 67.82 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 -1.45 0.56 0.21 -0.78 6.02 -0.15 -4.56 117.38 117.24 2hc5 n GLN 19 Ca 0.08 0.16 0.12 0.00 -0.01 0.00 0.00 57.00 57.36 2hc5 n GLN 19 Cb 0.29 -1.43 0.71 0.00 1.02 0.00 0.00 30.24 30.83 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 -0.29 0.82 0.00 5.09 1.08 -0.43 -1.52 117.51 122.26 2hc5 h ILE 20 Ca -0.55 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 63.92 2hc5 h ILE 20 Cb 1.72 0.93 0.00 0.00 -3.07 0.00 0.00 36.82 36.40 2hc5 h ILE 20 CO -0.18 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.28 2hc5 n HIS 21 N -4.32 0.00 -3.36 1.37 1.44 -1.03 -4.64 115.22 104.68 2hc5 n HIS 21 Ca -0.00 0.00 -0.06 0.00 -2.01 0.00 0.00 57.72 55.64 2hc5 n HIS 21 Cb 0.21 -0.10 -0.07 0.00 0.12 0.00 0.00 29.99 30.15 2hc5 n HIS 21 CO 0.00 0.00 0.00 1.21 -2.81 0.00 0.00 176.34 174.74 2hc5 s ASN 22 N -2.20 -0.16 -0.14 4.39 2.47 -0.57 -5.04 114.94 113.69 2hc5 s ASN 22 Ca 0.40 0.49 -0.04 0.00 0.42 0.00 0.00 52.86 54.12 2hc5 s ASN 22 Cb 0.21 1.37 -0.12 0.00 -1.45 0.00 0.00 41.25 41.26 2hc5 s ASN 22 CO 0.39 -0.28 3.10 0.00 -3.72 0.00 0.00 177.10 176.59 2hc5 n GLN 23 N 5.38 1.97 -4.02 0.43 3.00 -1.26 -4.82 117.38 118.06 2hc5 n GLN 23 Ca -0.04 -1.27 -0.31 0.00 -0.01 0.00 0.00 57.00 55.37 2hc5 n GLN 23 Cb 0.50 -1.89 -0.15 0.00 0.00 0.00 0.00 30.24 28.70 2hc5 n GLN 23 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.06 177.21 2hc5 s LYS 24 N -0.03 2.00 -0.36 -1.09 -0.14 -1.26 -4.96 119.74 113.90 2hc5 s LYS 24 Ca 0.54 -1.20 -0.05 0.00 -1.36 0.00 0.00 55.97 53.90 2hc5 s LYS 24 Cb 0.29 -2.77 0.20 0.00 -1.68 0.00 0.00 37.83 33.88 2hc5 s LYS 24 CO -0.06 -0.58 1.02 0.34 -0.76 0.00 0.00 175.35 175.32 2hc5 s ASP 25 N 1.22 -0.49 -0.46 2.83 2.15 -1.26 -5.13 116.67 115.53 2hc5 s ASP 25 Ca -0.08 -0.49 -0.10 0.00 0.43 0.00 0.00 52.55 52.32 2hc5 s ASP 25 Cb -0.19 0.64 0.11 0.00 -0.30 0.00 0.00 42.92 43.17 2hc5 s ASP 25 CO -0.06 -0.03 0.33 0.21 -0.17 0.00 0.00 175.17 175.46 2hc5 s ASN 26 N 1.24 5.72 -0.13 -0.34 3.84 -1.26 -5.03 114.94 118.99 2hc5 s ASN 26 Ca 0.22 -1.79 -0.08 0.00 0.21 0.00 0.00 52.86 51.41 2hc5 s ASN 26 Cb 0.08 -2.02 0.05 0.00 -0.55 0.00 0.00 41.25 38.81 2hc5 s ASN 26 CO -0.11 -0.66 0.32 -0.62 -2.79 0.00 0.00 177.10 173.23 2hc5 s ASP 27 N 2.59 -0.36 -0.17 -4.21 2.15 -1.26 -5.04 116.67 110.37 2hc5 s ASP 27 Ca 0.05 0.67 -0.11 0.00 0.43 0.00 0.00 52.55 53.59 2hc5 s ASP 27 Cb -0.26 0.58 0.04 0.00 -0.30 0.00 0.00 42.92 42.99 2hc5 s ASP 27 CO 0.00 -0.16 0.22 0.59 -0.17 0.00 0.00 175.17 175.66 2hc5 n ASN 28 N 3.89 -0.52 -3.54 -0.34 3.02 -1.26 -4.81 115.26 111.70 2hc5 n ASN 28 Ca -0.21 1.20 -0.41 0.00 -0.03 0.00 0.00 54.58 55.13 2hc5 n ASN 28 Cb 0.55 -4.80 -0.01 0.00 -0.61 0.00 0.00 39.78 34.91 2hc5 n ASN 28 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 2hc5 n GLU 29 N 1.51 3.46 -2.60 3.52 0.28 -1.26 -4.94 120.64 120.60 2hc5 n GLU 29 Ca -0.38 -2.61 -0.35 0.00 -0.16 0.00 0.00 57.16 53.67 2hc5 n GLU 29 Cb 0.59 -2.99 -0.04 0.00 1.43 0.00 0.00 31.44 30.43 2hc5 n GLU 29 CO 0.00 0.00 0.00 0.14 -0.16 0.00 0.00 177.13 177.11 2hc5 s VAL 30 N 2.07 3.89 -0.93 3.84 -7.23 -1.26 -4.95 120.40 115.83 2hc5 s VAL 30 Ca 0.57 1.25 -0.24 0.00 -1.81 0.00 0.00 61.98 61.74 2hc5 s VAL 30 Cb 0.16 -3.55 -0.05 0.00 0.56 0.00 0.00 36.38 33.50 2hc5 s VAL 30 CO -0.07 -0.18 1.94 -2.16 -0.31 0.00 0.00 175.10 174.32 2hc5 s PRO 31 N -3.01 2.55 -0.29 4.82 0.04 -1.26 -4.83 135.00 133.03 2hc5 s PRO 31 Ca 0.64 -0.37 -0.20 0.00 0.04 0.00 0.00 61.00 61.10 2hc5 s PRO 31 Cb -0.16 -5.08 0.15 0.00 0.04 0.00 0.00 34.50 29.45 2hc5 s PRO 31 CO 0.21 -3.43 1.09 0.54 0.04 0.00 0.00 177.00 175.45 2hc5 s VAL 32 N 10.16 0.00 0.24 -0.36 0.11 -1.26 -5.09 120.40 124.19 2hc5 s VAL 32 Ca 0.70 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.75 2hc5 s VAL 32 Cb -0.06 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.79 2hc5 s VAL 32 CO 0.01 0.00 0.00 0.00 -3.33 0.00 0.00 175.10 171.78 2hc5 n HIS 33 N 2.82 -2.40 -0.58 1.54 1.44 -1.26 -4.88 115.22 111.90 2hc5 n HIS 33 Ca -0.15 0.54 -0.04 0.00 -2.01 0.00 0.00 57.72 56.05 2hc5 n HIS 33 Cb 0.57 1.21 0.25 0.00 0.12 0.00 0.00 29.99 32.13 2hc5 n HIS 33 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 2hc5 n GLN 34 N -3.17 3.21 0.00 -1.40 3.00 -1.26 -4.99 117.38 112.77 2hc5 n GLN 34 Ca 0.00 -2.41 0.00 0.00 -0.01 0.00 0.00 57.00 54.58 2hc5 n GLN 34 Cb 0.00 -2.03 0.00 0.00 0.00 0.00 0.00 30.24 28.21 2hc5 n GLN 34 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 2hc5 n VAL 35 N -0.03 0.00 0.00 5.09 0.31 -1.26 -4.77 118.33 117.67 2hc5 n VAL 35 Ca 0.32 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.65 2hc5 n VAL 35 Cb 1.17 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 34.10 2hc5 n VAL 35 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2hc5 n SER 36 N 6.98 0.00 -0.05 4.52 2.88 -1.26 -4.87 113.62 121.82 2hc5 n SER 36 Ca 0.00 0.00 -0.07 0.00 -1.33 0.00 0.00 58.87 57.47 2hc5 n SER 36 Cb 0.00 0.00 0.11 0.00 -0.75 0.00 0.00 64.21 63.57 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 0.00 0.76 -0.10 0.66 3.20 -2.01 -1.21 116.97 118.29 2hc5 h TYR 37 Ca 0.00 -0.18 -0.05 0.00 3.14 0.00 0.00 58.73 61.64 2hc5 h TYR 37 Cb 0.00 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 38.09 2hc5 h TYR 37 CO 0.00 0.87 -0.12 1.15 -1.64 0.00 0.00 178.16 178.43 2hc5 h THR 38 N 0.57 1.37 0.00 1.81 2.02 -2.00 -3.28 112.91 113.41 2hc5 h THR 38 Ca 0.07 -1.32 -0.05 0.00 0.77 0.00 0.00 66.41 65.89 2hc5 h THR 38 Cb 0.77 2.02 -0.01 0.00 -1.74 0.00 0.00 68.15 69.19 2hc5 h THR 38 CO 0.06 0.37 -0.25 -1.13 0.37 0.00 0.00 175.52 174.95 2hc5 h ASN 39 N -0.17 0.00 -0.34 4.18 -0.00 -1.87 -1.68 115.58 115.69 2hc5 h ASN 39 Ca 0.01 0.00 0.01 0.00 -0.00 0.00 0.00 56.30 56.32 2hc5 h ASN 39 Cb 0.65 0.00 -0.02 0.00 -0.00 0.00 0.00 38.32 38.95 2hc5 h ASN 39 CO 0.03 0.25 0.21 0.25 -0.00 0.00 0.00 177.43 178.17 2hc5 h LEU 40 N 0.00 0.35 -0.83 0.34 7.12 -1.27 0.29 115.31 121.30 2hc5 h LEU 40 Ca -0.00 -0.00 -0.12 0.00 0.13 0.00 0.00 57.88 57.88 2hc5 h LEU 40 Cb 0.47 -0.08 -0.01 0.00 -0.53 0.00 0.00 40.66 40.51 2hc5 h LEU 40 CO 0.03 0.25 -0.50 0.00 -0.13 0.00 0.00 178.44 178.10 2hc5 h ALA 41 N 1.14 1.01 -0.41 1.25 0.00 -1.43 0.40 119.26 121.22 2hc5 h ALA 41 Ca 0.13 -0.47 -0.11 0.00 0.00 0.00 0.00 54.91 54.47 2hc5 h ALA 41 Cb -0.02 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2hc5 h ALA 41 CO -0.05 0.65 -0.17 0.93 0.00 0.00 0.00 179.25 180.61 2hc5 h GLU 42 N 0.17 0.78 -0.02 0.00 5.08 -0.82 -2.68 114.58 117.09 2hc5 h GLU 42 Ca 0.01 -0.29 -0.08 0.00 -1.00 0.00 0.00 59.36 58.00 2hc5 h GLU 42 Cb 0.94 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 30.14 2hc5 h GLU 42 CO 0.08 0.90 -0.29 0.52 -1.00 0.00 0.00 179.01 179.21 2hc5 h MET 43 N 0.70 0.23 -0.74 2.33 2.86 -0.06 -3.06 114.93 117.18 2hc5 h MET 43 Ca 0.11 -0.22 0.08 0.00 -2.06 0.00 0.00 59.70 57.60 2hc5 h MET 43 Cb 0.67 0.06 -0.05 0.00 0.06 0.00 0.00 31.60 32.34 2hc5 h MET 43 CO 0.05 0.92 0.49 -0.39 1.06 0.00 0.00 176.91 179.03 2hc5 h VAL 44 N -0.37 0.99 -0.52 -2.22 -1.51 -0.96 0.44 116.25 112.11 2hc5 h VAL 44 Ca -0.03 -0.25 -0.02 0.00 -1.23 0.00 0.00 66.70 65.17 2hc5 h VAL 44 Cb 1.00 0.19 -0.02 0.00 -2.13 0.00 0.00 31.29 30.33 2hc5 h VAL 44 CO 0.06 0.13 0.24 1.23 -1.23 0.00 0.00 177.57 178.01 2hc5 h GLY 45 N 0.74 0.81 1.91 5.19 0.00 -1.52 -1.68 103.07 108.52 2hc5 h GLY 45 Ca 0.33 -0.41 -0.12 0.00 0.00 0.00 0.00 47.33 47.14 2hc5 h GLY 45 CO -0.11 0.39 -0.61 1.05 0.00 0.00 0.00 176.54 177.25 2hc5 h GLU 46 N 0.69 0.00 -0.24 4.80 4.11 -1.14 -2.98 114.58 119.83 2hc5 h GLU 46 Ca 0.18 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.60 2hc5 h GLU 46 Cb 0.13 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 2hc5 h GLU 46 CO -0.02 0.51 0.10 0.52 0.07 0.00 0.00 179.01 180.19 2hc5 h MET 47 N 0.00 0.35 -0.84 1.06 2.86 -0.00 -2.63 114.93 115.73 2hc5 h MET 47 Ca -0.02 -0.06 0.11 0.00 -2.06 0.00 0.00 59.70 57.67 2hc5 h MET 47 Cb 1.42 -0.06 -0.08 0.00 0.06 0.00 0.00 31.60 32.95 2hc5 h MET 47 CO 0.07 0.38 0.47 -0.91 1.06 0.00 0.00 176.91 177.97 2hc5 h ASN 48 N 0.24 0.65 0.33 1.22 2.35 -1.29 -1.07 115.58 118.02 2hc5 h ASN 48 Ca 0.08 0.06 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 2hc5 h ASN 48 Cb 0.15 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.45 2hc5 h ASN 48 CO -0.01 0.36 0.00 0.29 -1.65 0.00 0.00 177.43 176.42 2hc5 n LYS 49 N -4.76 0.18 0.02 0.81 5.02 -1.01 -0.70 118.16 117.72 2hc5 n LYS 49 Ca 0.14 0.16 0.09 0.00 -2.02 0.00 0.00 58.31 56.68 2hc5 n LYS 49 Cb 0.31 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 33.71 2hc5 n LYS 49 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2hc5 n LEU 50 N -1.32 0.32 -0.14 -0.35 4.77 -0.42 -4.42 117.00 115.44 2hc5 n LEU 50 Ca 0.07 0.13 0.03 0.00 -0.03 0.00 0.00 56.01 56.21 2hc5 n LEU 50 Cb 0.13 0.02 -0.00 0.00 -2.33 0.00 0.00 43.42 41.24 2hc5 n LEU 50 CO 0.12 -0.02 0.18 0.18 -1.33 0.00 0.00 177.39 176.52 2hc5 n LEU 51 N -2.47 0.95 0.06 2.23 4.77 -0.43 -4.47 117.00 117.65 2hc5 n LEU 51 Ca -0.05 -0.75 -0.21 0.00 -0.03 0.00 0.00 56.01 54.96 2hc5 n LEU 51 Cb 0.62 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.56 2hc5 n LEU 51 CO 0.44 0.20 -0.10 -0.33 -1.33 0.00 0.00 177.39 176.27 2hc5 h GLU 52 N 0.71 0.35 0.00 3.23 4.39 -1.12 0.14 114.58 122.27 2hc5 h GLU 52 Ca 0.00 -0.59 0.00 0.00 0.34 0.00 0.00 59.36 59.11 2hc5 h GLU 52 Cb 0.22 0.22 0.00 0.00 -0.10 0.00 0.00 28.75 29.09 2hc5 h GLU 52 CO 0.00 1.28 0.00 -1.00 -1.16 0.00 0.00 179.01 178.13 2hc5 h PRO 53 N -0.24 0.00 0.00 2.33 0.13 -1.80 -3.44 132.00 128.98 2hc5 h PRO 53 Ca -0.20 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.76 2hc5 h PRO 53 Cb 1.78 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.94 2hc5 h PRO 53 CO 0.17 0.00 0.04 -1.13 -0.23 0.00 0.00 178.00 176.84 2hc5 n SER 54 N -2.84 0.52 -0.81 1.44 3.41 -1.25 -4.47 113.62 109.62 2hc5 n SER 54 Ca -0.01 -1.43 0.11 0.00 -0.26 0.00 0.00 58.87 57.29 2hc5 n SER 54 Cb 0.18 -0.23 0.30 0.00 -0.26 0.00 0.00 64.21 64.20 2hc5 n SER 54 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2hc5 n GLN 55 N -1.66 2.06 0.06 4.33 6.02 0.87 -4.30 117.38 124.76 2hc5 n GLN 55 Ca 0.06 -1.60 -0.05 0.00 -0.01 0.00 0.00 57.00 55.40 2hc5 n GLN 55 Cb 0.22 -1.44 -0.03 0.00 1.02 0.00 0.00 30.24 30.01 2hc5 n GLN 55 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2hc5 h VAL 56 N 3.19 0.15 -5.40 5.09 2.07 -1.43 -3.45 116.25 116.47 2hc5 h VAL 56 Ca 0.00 -0.90 -0.02 0.00 0.82 0.00 0.00 66.70 66.60 2hc5 h VAL 56 Cb 0.70 0.27 0.00 0.00 -1.52 0.00 0.00 31.29 30.74 2hc5 h VAL 56 CO 0.00 0.05 -0.29 1.41 0.02 0.00 0.00 177.57 178.75 2hc5 n HIS 57 N -4.93 -3.19 -4.24 1.57 8.25 0.48 -4.49 115.22 108.67 2hc5 n HIS 57 Ca -0.04 1.26 -0.34 0.00 -0.26 0.00 0.00 57.72 58.33 2hc5 n HIS 57 Cb 0.13 -4.01 -0.10 0.00 1.12 0.00 0.00 29.99 27.13 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 -3.35 3.59 -0.33 2.41 1.43 -1.26 -0.30 118.68 120.88 2hc5 s LEU 58 Ca 0.12 0.05 -0.01 0.00 -1.03 0.00 0.00 54.13 53.26 2hc5 s LEU 58 Cb -0.03 -1.87 0.07 0.00 0.03 0.00 0.00 46.19 44.39 2hc5 s LEU 58 CO 0.77 0.24 0.05 -0.54 0.23 0.00 0.00 176.35 177.10 2hc5 s LYS 59 N -0.06 2.24 0.09 1.70 1.02 0.13 -4.67 119.74 120.18 2hc5 s LYS 59 Ca 0.04 -1.45 -0.30 0.00 0.02 0.00 0.00 55.97 54.28 2hc5 s LYS 59 Cb -0.13 -3.27 -0.05 0.00 -0.52 0.00 0.00 37.83 33.86 2hc5 s LYS 59 CO 0.02 -0.75 0.97 -0.06 -0.92 0.00 0.00 175.35 174.60 2hc5 s PHE 60 N 1.19 3.78 -0.07 3.18 0.40 -1.26 -0.88 117.98 124.32 2hc5 s PHE 60 Ca -0.01 1.78 0.05 0.00 -0.60 0.00 0.00 56.93 58.16 2hc5 s PHE 60 Cb -0.20 -3.07 -0.01 0.00 0.51 0.00 0.00 43.02 40.25 2hc5 s PHE 60 CO -0.03 0.16 -0.23 -1.21 0.70 0.00 0.00 175.22 174.61 2hc5 s GLU 61 N 0.17 2.68 -0.37 0.44 0.41 0.11 -4.96 118.70 117.19 2hc5 s GLU 61 Ca 0.48 -0.87 -0.08 0.00 -0.41 0.00 0.00 54.97 54.09 2hc5 s GLU 61 Cb -0.23 -2.23 0.05 0.00 -1.78 0.00 0.00 34.13 29.94 2hc5 s GLU 61 CO 0.30 0.36 0.17 -1.17 -0.49 0.00 0.00 175.26 174.43 2hc5 s LEU 62 N -0.09 4.69 0.00 1.80 2.96 -1.26 -1.08 118.68 125.70 2hc5 s LEU 62 Ca -0.05 -1.28 0.00 0.00 -0.22 0.00 0.00 54.13 52.58 2hc5 s LEU 62 Cb -0.14 -1.93 0.00 0.00 0.50 0.00 0.00 46.19 44.62 2hc5 s LEU 62 CO 0.04 -0.41 0.00 1.41 -1.32 0.00 0.00 176.35 176.07 2hc5 n HIS 63 N 4.86 -0.29 -4.86 5.38 8.25 0.11 -4.95 115.22 123.72 2hc5 n HIS 63 Ca -0.11 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.09 2hc5 n HIS 63 Cb 0.44 0.00 -0.16 0.00 1.12 0.00 0.00 29.99 31.39 2hc5 n HIS 63 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2hc5 s ASP 64 N -0.90 2.16 -0.07 0.41 2.15 -1.26 -0.28 116.67 118.87 2hc5 s ASP 64 Ca 0.00 -0.34 -0.05 0.00 0.43 0.00 0.00 52.55 52.58 2hc5 s ASP 64 Cb 0.00 -0.42 -0.02 0.00 -0.30 0.00 0.00 42.92 42.18 2hc5 s ASP 64 CO 0.00 0.19 -0.10 1.17 -0.17 0.00 0.00 175.17 176.25 2hc5 n LYS 65 N 2.89 0.21 0.18 4.34 4.81 0.36 -4.77 118.16 126.18 2hc5 n LYS 65 Ca -0.16 0.27 0.00 0.00 -0.87 0.00 0.00 58.31 57.55 2hc5 n LYS 65 Cb 0.53 -1.07 0.00 0.00 0.02 0.00 0.00 35.03 34.52 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 -3.31 -3.07 -0.00 3.14 7.94 -1.26 -4.93 117.00 115.51 2hc5 n LEU 66 Ca -0.04 0.68 0.01 0.00 -1.11 0.00 0.00 56.01 55.56 2hc5 n LEU 66 Cb 0.15 2.96 -0.02 0.00 0.53 0.00 0.00 43.42 47.05 2hc5 n LEU 66 CO 0.06 0.06 -0.35 -3.20 -1.11 0.00 0.00 177.39 172.85 2hc5 n ASN 67 N -3.24 2.93 -4.80 1.96 4.05 -1.26 -5.02 115.26 109.88 2hc5 n ASN 67 Ca 0.00 -0.19 -0.32 0.00 0.45 0.00 0.00 54.58 54.52 2hc5 n ASN 67 Cb 0.00 1.08 -0.06 0.00 1.23 0.00 0.00 39.78 42.03 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 -1.86 3.04 -0.42 1.20 8.01 -1.26 -5.08 118.70 122.33 2hc5 s GLU 68 Ca -0.00 -0.56 -0.17 0.00 0.01 0.00 0.00 54.97 54.25 2hc5 s GLU 68 Cb 0.02 -2.83 0.02 0.00 -4.31 0.00 0.00 34.13 27.03 2hc5 s GLU 68 CO 0.11 0.61 0.40 0.71 0.01 0.00 0.00 175.26 177.10 2hc5 s TYR 69 N -1.31 3.19 -0.24 1.61 2.02 -1.26 -0.49 117.35 120.87 2hc5 s TYR 69 Ca 0.27 -0.41 -0.29 0.00 -0.37 0.00 0.00 57.07 56.26 2hc5 s TYR 69 Cb -0.12 -2.82 -0.01 0.00 -0.40 0.00 0.00 41.96 38.61 2hc5 s TYR 69 CO 0.19 -0.67 1.28 -0.47 -1.57 0.00 0.00 175.55 174.31 2hc5 s TYR 70 N 2.03 2.76 -0.58 2.71 5.04 0.61 -3.89 117.35 126.03 2hc5 s TYR 70 Ca 0.10 0.94 -0.17 0.00 -2.44 0.00 0.00 57.07 55.51 2hc5 s TYR 70 Cb -0.17 -3.72 0.13 0.00 0.35 0.00 0.00 41.96 38.55 2hc5 s TYR 70 CO 0.13 -1.70 0.58 0.08 -1.34 0.00 0.00 175.55 173.29 2hc5 s VAL 71 N 3.98 5.13 -0.09 3.14 1.01 -0.33 -0.71 120.40 132.54 2hc5 s VAL 71 Ca 0.56 -1.44 -0.04 0.00 0.00 0.00 0.00 61.98 61.06 2hc5 s VAL 71 Cb -0.19 -4.39 -0.04 0.00 0.00 0.00 0.00 36.38 31.76 2hc5 s VAL 71 CO 0.19 -0.96 0.09 -1.59 0.00 0.00 0.00 175.10 172.83 2hc5 s LYS 72 N 1.79 3.23 -0.34 2.72 -2.85 -0.24 -0.39 119.74 123.67 2hc5 s LYS 72 Ca 0.07 -0.28 -0.15 0.00 -1.00 0.00 0.00 55.97 54.60 2hc5 s LYS 72 Cb -0.27 -3.00 -0.01 0.00 -2.06 0.00 0.00 37.83 32.49 2hc5 s LYS 72 CO 0.03 0.73 0.36 0.08 0.10 0.00 0.00 175.35 176.65 2hc5 s VAL 73 N -1.01 5.17 -0.35 1.79 1.01 0.10 -0.71 120.40 126.40 2hc5 s VAL 73 Ca 0.16 0.07 -0.10 0.00 0.00 0.00 0.00 61.98 62.11 2hc5 s VAL 73 Cb -0.12 -3.82 0.02 0.00 0.00 0.00 0.00 36.38 32.46 2hc5 s VAL 73 CO 0.05 -0.08 0.17 -0.63 0.00 0.00 0.00 175.10 174.62 2hc5 s ILE 74 N 2.02 4.49 0.29 2.22 1.01 -0.06 -0.60 121.20 130.57 2hc5 s ILE 74 Ca 0.12 -0.73 -0.29 0.00 0.00 0.00 0.00 60.65 59.75 2hc5 s ILE 74 Cb -0.16 -3.43 -0.10 0.00 0.01 0.00 0.00 42.46 38.78 2hc5 s ILE 74 CO 0.12 -0.11 1.17 -0.70 0.00 0.00 0.00 174.94 175.42 2hc5 s GLU 75 N 1.56 4.54 0.06 2.79 2.12 -0.34 0.19 118.70 129.63 2hc5 s GLU 75 Ca 0.03 1.95 -0.03 0.00 0.36 0.00 0.00 54.97 57.27 2hc5 s GLU 75 Cb -0.18 -3.15 -0.28 0.00 0.26 0.00 0.00 34.13 30.78 2hc5 s GLU 75 CO 0.06 0.06 1.08 0.22 -0.54 0.00 0.00 175.26 176.15 2hc5 h ASP 76 N 3.73 0.40 0.84 -1.70 3.58 -0.90 -0.57 116.42 121.80 2hc5 h ASP 76 Ca -0.47 -0.45 -0.04 0.00 0.42 0.00 0.00 57.03 56.49 2hc5 h ASP 76 Cb 1.22 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 42.14 2hc5 h ASP 76 CO 0.67 1.36 -0.46 0.28 -2.88 0.00 0.00 179.24 178.21 2hc5 h SER 77 N 0.07 -1.12 1.78 2.28 0.02 -1.79 -2.85 113.55 111.94 2hc5 h SER 77 Ca -0.15 0.05 -0.02 0.00 -0.84 0.00 0.00 61.79 60.83 2hc5 h SER 77 Cb 1.97 0.31 -0.00 0.00 0.14 0.00 0.00 62.40 64.82 2hc5 h SER 77 CO 0.19 -0.74 -0.22 0.71 -1.14 0.00 0.00 176.83 175.63 2hc5 h THR 78 N -1.20 0.11 -5.34 -2.27 1.35 -1.95 -3.48 112.91 100.14 2hc5 h THR 78 Ca -0.11 -1.17 -0.14 0.00 -0.55 0.00 0.00 66.41 64.44 2hc5 h THR 78 Cb 0.94 1.98 0.11 0.00 -1.73 0.00 0.00 68.15 69.46 2hc5 h THR 78 CO 0.15 0.06 -0.48 -3.20 -0.25 0.00 0.00 175.52 171.81 2hc5 n ASN 79 N -3.05 -6.98 -3.48 5.36 2.85 -0.26 -5.04 115.26 104.66 2hc5 n ASN 79 Ca 0.03 -0.42 -0.10 0.00 -0.11 0.00 0.00 54.58 53.98 2hc5 n ASN 79 Cb 0.56 -5.11 -0.02 0.00 1.24 0.00 0.00 39.78 36.45 2hc5 n ASN 79 CO 0.00 0.00 0.00 -1.83 -2.11 0.00 0.00 177.26 173.32 2hc5 s GLU 80 N -3.78 0.95 -0.04 1.20 -1.05 -0.99 -4.98 118.70 110.02 2hc5 s GLU 80 Ca 0.26 -0.34 -0.30 0.00 -0.15 0.00 0.00 54.97 54.44 2hc5 s GLU 80 Cb -0.03 0.44 -0.05 0.00 -0.44 0.00 0.00 34.13 34.05 2hc5 s GLU 80 CO 0.72 -0.41 1.44 0.08 0.95 0.00 0.00 175.26 178.04 2hc5 s VAL 81 N -3.25 3.76 -0.27 1.83 1.01 -1.26 -1.19 120.40 121.03 2hc5 s VAL 81 Ca 0.04 1.07 0.05 0.00 0.00 0.00 0.00 61.98 63.13 2hc5 s VAL 81 Cb -0.01 -3.69 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 2hc5 s VAL 81 CO -0.10 -0.04 0.26 2.30 0.00 0.00 0.00 175.10 177.52 2hc5 n ILE 82 N 4.97 0.00 -3.67 2.22 -5.35 0.23 -4.94 119.36 112.82 2hc5 n ILE 82 Ca 0.14 -0.41 -0.14 0.00 -0.27 0.00 0.00 62.75 62.08 2hc5 n ILE 82 Cb 0.44 1.02 -0.08 0.00 -1.74 0.00 0.00 39.64 39.27 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 -1.27 0.69 -0.23 6.28 6.06 -1.15 -4.98 118.95 124.33 2hc5 s ARG 83 Ca 0.02 0.82 0.02 0.00 -2.50 0.00 0.00 55.73 54.10 2hc5 s ARG 83 Cb 0.03 0.34 0.05 0.00 0.06 0.00 0.00 34.95 35.43 2hc5 s ARG 83 CO 0.17 -0.08 -0.12 -1.21 -2.50 0.00 0.00 175.30 171.56 2hc5 s GLU 84 N 0.32 2.26 -0.18 5.12 8.01 -1.26 0.01 118.70 132.98 2hc5 s GLU 84 Ca -0.00 -1.15 -0.02 0.00 0.01 0.00 0.00 54.97 53.81 2hc5 s GLU 84 Cb -0.04 -2.73 -0.01 0.00 -4.31 0.00 0.00 34.13 27.04 2hc5 s GLU 84 CO 0.01 -0.49 -0.08 0.42 0.01 0.00 0.00 175.26 175.13 2hc5 s ILE 85 N 1.21 3.26 0.33 -1.63 1.01 0.48 -4.99 121.20 120.87 2hc5 s ILE 85 Ca -0.05 -0.56 -0.28 0.00 0.00 0.00 0.00 60.65 59.77 2hc5 s ILE 85 Cb -0.18 -2.44 -0.09 0.00 0.01 0.00 0.00 42.46 39.76 2hc5 s ILE 85 CO -0.07 0.47 1.13 -2.16 0.00 0.00 0.00 174.94 174.31 2hc5 s PRO 86 N 1.00 4.41 0.51 2.79 0.04 -1.26 -1.19 135.00 141.30 2hc5 s PRO 86 Ca -0.00 1.82 0.19 0.00 0.04 0.00 0.00 61.00 63.05 2hc5 s PRO 86 Cb -0.15 -2.97 1.31 0.00 0.04 0.00 0.00 34.50 32.74 2hc5 s PRO 86 CO -0.00 -0.01 2.13 -1.00 0.04 0.00 0.00 177.00 178.16 2hc5 h PRO 87 N 3.31 0.00 -0.20 0.56 0.13 -1.95 0.48 132.00 134.32 2hc5 h PRO 87 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2hc5 h PRO 87 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2hc5 h PRO 87 CO 0.65 0.05 0.00 0.36 -0.23 0.00 0.00 178.00 178.83 2hc5 n LYS 88 N -4.32 1.57 0.00 0.86 2.85 -1.26 -2.40 118.16 115.46 2hc5 n LYS 88 Ca -0.03 -0.87 0.00 0.00 -1.05 0.00 0.00 58.31 56.36 2hc5 n LYS 88 Cb 0.13 -1.27 0.00 0.00 -0.65 0.00 0.00 35.03 33.25 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 0.16 1.34 0.21 -1.58 5.12 0.11 -4.69 116.66 117.33 2hc5 n ARG 89 Ca 0.11 -1.00 0.04 0.00 -1.93 0.00 0.00 57.85 55.08 2hc5 n ARG 89 Cb 0.23 -0.90 0.45 0.00 -1.16 0.00 0.00 32.46 31.08 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 0.00 -0.48 -1.55 2.91 -1.06 -2.82 115.95 112.95 2hc5 h TRP 90 Ca 0.00 0.00 0.03 0.00 1.13 0.00 0.00 58.89 60.05 2hc5 h TRP 90 Cb 0.43 0.00 -0.04 0.00 -0.51 0.00 0.00 29.16 29.05 2hc5 h TRP 90 CO 0.00 0.26 0.27 -0.07 -1.03 0.00 0.00 178.44 177.87 2hc5 h LEU 91 N 0.00 0.41 0.02 0.65 3.38 -1.84 0.33 115.31 118.26 2hc5 h LEU 91 Ca -0.00 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2hc5 h LEU 91 Cb 0.47 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.15 2hc5 h LEU 91 CO 0.03 0.29 -0.02 0.44 0.09 0.00 0.00 178.44 179.27 2hc5 h ASP 92 N 0.53 -0.05 -0.49 -0.43 5.19 -1.85 0.77 116.42 120.09 2hc5 h ASP 92 Ca 0.20 0.01 -0.02 0.00 -0.62 0.00 0.00 57.03 56.60 2hc5 h ASP 92 Cb 0.07 0.02 -0.02 0.00 0.18 0.00 0.00 39.33 39.58 2hc5 h ASP 92 CO -0.12 -0.03 0.23 0.15 -3.12 0.00 0.00 179.24 176.35 2hc5 h PHE 93 N -0.04 0.71 -0.94 4.55 3.57 -1.42 -1.86 116.94 121.51 2hc5 h PHE 93 Ca 0.00 -0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.47 2hc5 h PHE 93 Cb 0.05 -0.22 -0.05 0.00 2.79 0.00 0.00 35.95 38.52 2hc5 h PHE 93 CO -0.09 0.57 0.62 -0.92 -2.23 0.00 0.00 178.31 176.26 2hc5 h TYR 94 N 0.65 1.19 0.09 0.41 3.20 -0.10 -0.16 116.97 122.25 2hc5 h TYR 94 Ca 0.17 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.06 2hc5 h TYR 94 Cb 0.13 -0.40 0.00 0.00 1.54 0.00 0.00 36.73 38.00 2hc5 h TYR 94 CO -0.01 0.75 -0.04 0.00 -1.64 0.00 0.00 178.16 177.23 2hc5 h ALA 95 N 1.34 -0.12 -0.80 1.82 0.00 -0.50 -0.41 119.26 120.59 2hc5 h ALA 95 Ca 0.34 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.24 2hc5 h ALA 95 Cb -0.14 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 2hc5 h ALA 95 CO -0.07 -0.54 0.51 0.00 0.00 0.00 0.00 179.25 179.15 2hc5 h ALA 96 N 0.73 1.07 -0.29 0.00 0.00 -0.99 0.06 119.26 119.83 2hc5 h ALA 96 Ca -0.01 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2hc5 h ALA 96 Cb 0.14 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2hc5 h ALA 96 CO 0.02 0.31 0.15 0.52 0.00 0.00 0.00 179.25 180.26 2hc5 h MET 97 N 0.98 0.42 -0.35 0.00 2.07 -0.81 -0.13 114.93 117.11 2hc5 h MET 97 Ca 0.33 -0.05 -0.11 0.00 -2.07 0.00 0.00 59.70 57.79 2hc5 h MET 97 Cb 0.04 -0.08 -0.01 0.00 -1.87 0.00 0.00 31.60 29.68 2hc5 h MET 97 CO -0.12 0.37 -0.24 1.15 1.07 0.00 0.00 176.91 179.14 2hc5 h THR 98 N 0.35 1.27 -0.28 2.22 2.02 -0.64 0.24 112.91 118.08 2hc5 h THR 98 Ca 0.10 -1.34 -0.06 0.00 0.77 0.00 0.00 66.41 65.89 2hc5 h THR 98 Cb 0.09 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 2hc5 h THR 98 CO -0.02 0.44 -0.05 -0.33 0.37 0.00 0.00 175.52 175.93 2hc5 h GLU 99 N 0.60 0.54 0.00 6.66 4.39 -0.83 -1.63 114.58 124.30 2hc5 h GLU 99 Ca 0.08 -0.20 -0.01 0.00 0.34 0.00 0.00 59.36 59.58 2hc5 h GLU 99 Cb 0.73 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.34 2hc5 h GLU 99 CO 0.06 0.73 -0.13 0.35 -1.16 0.00 0.00 179.01 178.85 2hc5 h PHE 100 N 0.30 0.00 0.00 4.33 3.57 -0.83 -3.38 116.94 120.93 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 0.52 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.26 2hc5 h PHE 100 CO 0.05 0.22 -0.14 -0.07 -2.23 0.00 0.00 178.31 176.14 2hc5 h LEU 101 N -1.00 0.00 0.00 0.59 4.07 -0.70 -3.26 115.31 115.01 2hc5 h LEU 101 Ca -0.01 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.94 2hc5 h LEU 101 Cb 0.30 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.04 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 1.14 -0.90 0.39 0.83 0.00 -0.61 -1.73 105.19 104.30 2hc5 n GLY 102 Ca 0.04 -0.16 0.09 0.00 0.00 0.00 0.00 46.02 45.99 2hc5 n GLY 102 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2hc5 n LEU 103 N -0.94 1.72 0.07 0.99 -0.00 -1.23 -4.11 117.00 113.51 2hc5 n LEU 103 Ca 0.19 -0.76 0.11 0.00 -0.00 0.00 0.00 56.01 55.56 2hc5 n LEU 103 Cb 0.09 0.00 0.02 0.00 -0.00 0.00 0.00 43.42 43.53 2hc5 n LEU 103 CO 0.14 0.33 0.01 0.49 -0.00 0.00 0.00 177.39 178.36 2hc5 n PHE 104 N -0.13 0.66 -4.03 1.47 3.01 -0.71 -4.98 117.46 112.74 2hc5 n PHE 104 Ca 0.07 0.19 -0.21 0.00 1.01 0.00 0.00 57.45 58.51 2hc5 n PHE 104 Cb 0.38 -0.75 -0.03 0.00 -0.01 0.00 0.00 39.48 39.07 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 -3.30 4.92 -0.44 -4.37 -7.23 -1.17 -4.91 120.40 103.90 2hc5 s VAL 105 Ca 0.01 -1.16 0.05 0.00 -1.81 0.00 0.00 61.98 59.07 2hc5 s VAL 105 Cb 0.12 -3.67 0.17 0.00 0.56 0.00 0.00 36.38 33.56 2hc5 s VAL 105 CO 0.79 -0.34 0.48 -0.62 -0.31 0.00 0.00 175.10 175.10 2hc5 s ASP 106 N -3.92 0.40 0.00 4.85 2.15 -1.26 -4.98 116.67 113.91 2hc5 s ASP 106 Ca 0.34 -2.33 0.00 0.00 0.43 0.00 0.00 52.55 50.98 2hc5 s ASP 106 Cb -0.09 0.54 0.00 0.00 -0.30 0.00 0.00 42.92 43.07 2hc5 s ASP 106 CO 0.27 -0.15 0.00 1.21 -0.17 0.00 0.00 175.17 176.34 2hc5 n GLU 107 N 3.15 0.00 -0.35 4.34 0.00 -1.26 -0.94 120.64 125.58 2hc5 n GLU 107 Ca 0.22 0.00 0.11 0.00 0.00 0.00 0.00 57.16 57.50 2hc5 n GLU 107 Cb 0.50 0.00 0.30 0.00 0.00 0.00 0.00 31.44 32.24 2hc5 n GLU 107 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.13 178.00 2hc5 h LYS 108 N 0.00 0.80 -0.43 5.31 6.56 -1.94 0.36 116.57 127.23 2hc5 h LYS 108 Ca 0.00 -0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.54 2hc5 h LYS 108 Cb 0.00 -0.18 0.00 0.00 -0.57 0.00 0.00 32.23 31.48 2hc5 h LYS 108 CO 0.00 0.53 0.00 1.63 -2.06 0.00 0.00 179.45 179.55 2hc5 n LYS 109 N -4.72 2.02 0.08 3.15 4.01 -0.11 -3.82 118.16 118.77 2hc5 n LYS 109 Ca 0.22 -1.51 -0.10 0.00 -0.51 0.00 0.00 58.31 56.41 2hc5 n LYS 109 Cb 0.51 -1.35 -0.02 0.00 -0.51 0.00 0.00 35.03 33.66 2hc5 n LYS 109 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 2hc5 h LEU 110 N 2.41 0.34 0.28 -0.35 3.38 -1.11 -3.46 115.31 116.81 2hc5 h LEU 110 Ca 0.00 -0.28 -0.12 0.00 0.09 0.00 0.00 57.88 57.57 2hc5 h LEU 110 Cb 0.60 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.19 2hc5 h LEU 110 CO 0.01 1.08 -0.11 1.21 0.09 0.00 0.00 178.44 180.73 2hc5 n GLU 111 N -3.68 -1.36 0.00 1.13 2.13 -1.25 -4.88 120.64 112.74 2hc5 n GLU 111 Ca -0.05 0.63 0.00 0.00 0.66 0.00 0.00 57.16 58.40 2hc5 n GLU 111 Cb 0.82 -4.77 0.00 0.00 0.27 0.00 0.00 31.44 27.76 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 -2.36 0.00 -0.05 4.31 8.25 -1.26 -4.90 115.22 119.21 2hc5 n HIS 112 Ca -0.06 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.36 2hc5 n HIS 112 Cb 0.43 -0.12 -0.01 0.00 1.12 0.00 0.00 29.99 31.41 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 -2.08 0.47 -2.83 4.41 -0.00 -1.26 -5.06 115.22 108.86 2hc5 n HIS 113 Ca 0.00 0.20 -0.05 0.00 -0.00 0.00 0.00 57.72 57.87 2hc5 n HIS 113 Cb 0.00 -0.54 0.01 0.00 -0.00 0.00 0.00 29.99 29.45 2hc5 n HIS 113 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2hc5 n HIS 114 N -3.93 -3.11 0.04 1.57 -0.00 -1.25 -5.00 115.22 103.54 2hc5 n HIS 114 Ca -0.07 1.23 0.00 0.00 -0.00 0.00 0.00 57.72 58.89 2hc5 n HIS 114 Cb 0.24 -3.93 0.00 0.00 -0.00 0.00 0.00 29.99 26.30 2hc5 n HIS 114 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2hc5 n HIS 115 N -0.77 -0.74 0.00 1.57 -0.00 -1.26 -4.99 115.22 109.03 2hc5 n HIS 115 Ca 0.08 0.13 0.00 0.00 0.46 0.00 0.00 57.72 58.39 2hc5 n HIS 115 Cb 0.45 0.52 0.00 0.00 -0.12 0.00 0.00 29.99 30.84 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 -2.78 0.00 -0.58 1.57 -0.00 -1.26 -5.00 115.22 107.16 2hc5 n HIS 116 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 2hc5 n HIS 116 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 2hc5 n HIS 116 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38