#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hv4 h GLU -4 N 0.00 0.73 -4.78 -2.82 3.07 -2.08 -3.46 114.58 105.24 2hv4 h GLU -4 Ca 0.00 -0.04 -0.38 0.00 -0.50 0.00 0.00 59.36 58.43 2hv4 h GLU -4 Cb 0.00 -0.16 -0.14 0.00 -0.84 0.00 0.00 28.75 27.61 2hv4 h GLU -4 CO 0.00 0.48 -0.54 0.12 -1.40 0.00 0.00 179.01 177.67 2hv4 s PHE -3 N -5.65 1.53 -0.20 4.33 5.36 -1.26 -5.02 117.98 117.08 2hv4 s PHE -3 Ca -0.09 -1.55 -0.06 0.00 -0.96 0.00 0.00 56.93 54.27 2hv4 s PHE -3 Cb 0.18 -0.65 0.10 0.00 -0.34 0.00 0.00 43.02 42.30 2hv4 s PHE -3 CO 0.75 -0.79 0.39 0.21 -1.46 0.00 0.00 175.22 174.33 2hv4 s LYS -2 N -3.72 0.30 0.39 10.12 2.47 -1.26 -5.16 119.74 122.88 2hv4 s LYS -2 Ca 0.40 0.88 -0.28 0.00 -1.56 0.00 0.00 55.97 55.42 2hv4 s LYS -2 Cb 0.04 0.10 -0.11 0.00 -1.46 0.00 0.00 37.83 36.40 2hv4 s LYS -2 CO 0.22 -0.34 1.49 0.00 0.16 0.00 0.00 175.35 176.88 2hv4 s ALA -1 N 2.57 3.55 0.00 3.13 0.00 -1.26 -4.78 121.76 124.98 2hv4 s ALA -1 Ca 0.02 1.59 0.00 0.00 0.00 0.00 0.00 51.96 53.57 2hv4 s ALA -1 Cb -0.13 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.37 2hv4 s ALA -1 CO -0.13 -1.10 0.00 0.41 0.00 0.00 0.00 175.76 174.94 2hv4 n GLY 1 N 0.44 1.69 2.67 0.00 0.00 -1.26 -5.00 105.19 103.72 2hv4 n GLY 1 Ca 0.01 -0.56 -0.20 0.00 0.00 0.00 0.00 46.02 45.27 2hv4 n GLY 1 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2hv4 s SER 2 N -0.33 1.19 0.35 1.61 0.15 -1.26 -5.02 113.70 110.38 2hv4 s SER 2 Ca 0.00 0.05 0.10 0.00 0.70 0.00 0.00 55.95 56.80 2hv4 s SER 2 Cb 0.00 -0.14 0.85 0.00 -1.71 0.00 0.00 66.02 65.02 2hv4 s SER 2 CO 0.00 -0.25 1.82 0.00 1.20 0.00 0.00 173.24 176.01 2hv4 h ALA 3 N 8.44 1.87 0.00 5.45 0.00 -1.85 0.01 119.26 133.19 2hv4 h ALA 3 Ca -0.12 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2hv4 h ALA 3 Cb 1.12 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2hv4 h ALA 3 CO 0.16 -0.19 0.00 0.36 0.00 0.00 0.00 179.25 179.58 2hv4 n LYS 4 N -4.63 0.16 0.03 0.00 2.85 -1.26 -1.65 118.16 113.66 2hv4 n LYS 4 Ca 0.21 0.45 -0.07 0.00 -1.05 0.00 0.00 58.31 57.86 2hv4 n LYS 4 Cb 0.59 -1.85 -0.05 0.00 -0.65 0.00 0.00 35.03 33.07 2hv4 n LYS 4 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 177.40 178.22 2hv4 h LYS 5 N 0.00 -0.18 -0.74 -1.58 1.57 -1.34 -3.30 116.57 111.00 2hv4 h LYS 5 Ca 0.00 0.01 0.13 0.00 -1.87 0.00 0.00 60.65 58.92 2hv4 h LYS 5 Cb 0.27 0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.58 2hv4 h LYS 5 CO 0.00 0.09 0.49 0.78 -0.57 0.00 0.00 179.45 180.24 2hv4 h GLY 6 N -1.00 0.76 0.10 3.86 0.00 -1.48 -0.96 103.07 104.35 2hv4 h GLY 6 Ca -0.02 -0.20 0.06 0.00 0.00 0.00 0.00 47.33 47.16 2hv4 h GLY 6 CO 0.03 0.09 -0.30 0.00 0.00 0.00 0.00 176.54 176.36 2hv4 h ALA 7 N 1.65 -0.27 -0.21 3.60 0.00 -1.47 -0.05 119.26 122.51 2hv4 h ALA 7 Ca 0.35 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.28 2hv4 h ALA 7 Cb 0.71 0.59 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 2hv4 h ALA 7 CO -0.12 -0.75 -0.02 1.79 0.00 0.00 0.00 179.25 180.15 2hv4 h THR 8 N -0.33 1.15 0.47 0.00 1.35 -1.25 -1.18 112.91 113.12 2hv4 h THR 8 Ca 0.12 -0.59 -0.02 0.00 -0.55 0.00 0.00 66.41 65.37 2hv4 h THR 8 Cb 0.52 1.01 0.00 0.00 -1.73 0.00 0.00 68.15 67.96 2hv4 h THR 8 CO -0.39 0.20 -0.23 -0.07 -0.25 0.00 0.00 175.52 174.78 2hv4 h LEU 9 N 0.31 -0.54 -0.86 3.87 3.38 -1.26 -3.29 115.31 116.92 2hv4 h LEU 9 Ca 0.07 0.00 0.22 0.00 0.09 0.00 0.00 57.88 58.26 2hv4 h LEU 9 Cb 0.25 0.14 -0.15 0.00 0.09 0.00 0.00 40.66 40.99 2hv4 h LEU 9 CO 0.01 -0.11 0.09 0.15 0.09 0.00 0.00 178.44 178.67 2hv4 h PHE 10 N -1.15 0.09 0.00 1.13 3.57 -0.94 -0.04 116.94 119.59 2hv4 h PHE 10 Ca -0.06 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.49 2hv4 h PHE 10 Cb 0.50 0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.34 2hv4 h PHE 10 CO 0.00 -0.28 0.08 -0.22 -2.23 0.00 0.00 178.31 175.66 2hv4 h LYS 11 N 0.11 0.00 -0.00 1.11 3.11 -1.28 -1.41 116.57 118.21 2hv4 h LYS 11 Ca 0.51 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 58.35 2hv4 h LYS 11 Cb 0.99 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.22 2hv4 h LYS 11 CO -0.73 0.00 -0.00 0.25 -2.81 0.00 0.00 179.45 176.16 2hv4 n THR 12 N -2.36 0.00 0.00 1.00 -2.24 -0.06 -4.73 114.28 105.89 2hv4 n THR 12 Ca -0.02 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 2hv4 n THR 12 Cb 0.11 1.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.36 2hv4 n THR 12 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2hv4 n ARG 13 N -0.01 0.00 -0.07 -0.78 5.12 -0.78 -4.95 116.66 115.18 2hv4 n ARG 13 Ca 0.01 0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 55.84 2hv4 n ARG 13 Cb 0.03 -0.46 -0.09 0.00 -1.16 0.00 0.00 32.46 30.78 2hv4 n ARG 13 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2hv4 h LEU 15 N 0.00 0.00 -2.01 0.00 5.85 -1.63 -0.83 115.31 116.69 2hv4 h LEU 15 Ca -0.35 0.00 0.16 0.00 0.84 0.00 0.00 57.88 58.52 2hv4 h LEU 15 Cb 1.67 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.68 2hv4 h LEU 15 CO -0.02 0.00 0.40 0.06 -0.34 0.00 0.00 178.44 178.54 2hv4 h GLN 16 N 0.00 0.00 0.00 1.25 3.07 -1.84 -3.17 115.11 114.42 2hv4 h GLN 16 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.93 2hv4 h GLN 16 Cb 0.87 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.43 2hv4 h GLN 16 CO -0.00 0.00 -0.88 0.00 0.09 0.00 0.00 178.83 178.04 2hv4 s HIS 18 N -2.00 1.84 0.20 0.00 3.76 -1.01 -1.29 115.29 116.79 2hv4 s HIS 18 Ca -0.01 -1.11 0.07 0.00 -0.15 0.00 0.00 55.06 53.86 2hv4 s HIS 18 Cb 0.03 -1.19 -0.05 0.00 1.11 0.00 0.00 32.58 32.48 2hv4 s HIS 18 CO 0.16 -0.15 -0.13 0.95 -0.85 0.00 0.00 174.74 174.72 2hv4 s THR 19 N -3.32 1.61 0.00 1.30 -4.23 -1.26 -4.65 115.64 105.09 2hv4 s THR 19 Ca 0.31 -2.17 0.00 0.00 -1.18 0.00 0.00 61.69 58.65 2hv4 s THR 19 Cb 0.06 -2.03 0.00 0.00 1.34 0.00 0.00 72.50 71.87 2hv4 s THR 19 CO 0.15 -0.60 0.00 0.55 -0.54 0.00 0.00 174.62 174.17 2hv4 n VAL 20 N -0.36 0.00 -3.79 2.29 3.14 -1.26 -1.24 118.33 117.12 2hv4 n VAL 20 Ca -0.08 -0.11 -0.23 0.00 -2.96 0.00 0.00 64.34 60.95 2hv4 n VAL 20 Cb 0.61 0.56 -0.03 0.00 -1.06 0.00 0.00 33.84 33.92 2hv4 n VAL 20 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 2hv4 s GLU 21 N -0.96 2.37 0.64 1.45 0.41 -1.26 -4.16 118.70 117.20 2hv4 s GLU 21 Ca 0.00 -1.75 -0.17 0.00 -0.41 0.00 0.00 54.97 52.63 2hv4 s GLU 21 Cb 0.00 -2.20 -0.06 0.00 -1.78 0.00 0.00 34.13 30.09 2hv4 s GLU 21 CO 0.00 -0.30 0.62 1.63 -0.49 0.00 0.00 175.26 176.72 2hv4 n LYS 22 N -1.54 0.49 0.00 1.61 5.02 -1.26 -3.33 118.16 119.15 2hv4 n LYS 22 Ca 0.01 0.20 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 2hv4 n LYS 22 Cb 0.63 -1.85 0.00 0.00 -0.02 0.00 0.00 35.03 33.79 2hv4 n LYS 22 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2hv4 n GLY 23 N 1.62 1.39 3.66 0.72 0.00 -1.26 -4.97 105.19 106.36 2hv4 n GLY 23 Ca 0.11 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.64 2hv4 n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hv4 n GLY 24 N -0.63 1.09 3.81 -0.02 0.00 -1.21 -4.97 105.19 103.27 2hv4 n GLY 24 Ca 0.00 0.76 -0.32 0.00 0.00 0.00 0.00 46.02 46.46 2hv4 n GLY 24 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2hv4 s PRO 25 N 2.16 3.33 -0.47 1.61 0.04 -1.26 -4.65 135.00 135.76 2hv4 s PRO 25 Ca 0.86 1.10 -0.26 0.00 0.04 0.00 0.00 61.00 62.74 2hv4 s PRO 25 Cb -0.77 -2.04 -0.06 0.00 0.04 0.00 0.00 34.50 31.67 2hv4 s PRO 25 CO 0.47 -0.79 2.31 -1.01 0.04 0.00 0.00 177.00 178.02 2hv4 s HIS 26 N -2.63 1.17 0.00 0.56 3.76 -1.26 -4.58 115.29 112.31 2hv4 s HIS 26 Ca 0.61 1.33 0.00 0.00 -0.15 0.00 0.00 55.06 56.86 2hv4 s HIS 26 Cb -0.15 -3.69 0.00 0.00 1.11 0.00 0.00 32.58 29.85 2hv4 s HIS 26 CO 0.41 -2.71 0.00 1.17 -0.85 0.00 0.00 174.74 172.75 2hv4 n LYS 27 N 8.99 0.00 -0.08 1.40 4.81 -1.26 -4.83 118.16 127.19 2hv4 n LYS 27 Ca 0.34 0.04 -0.09 0.00 -0.87 0.00 0.00 58.31 57.73 2hv4 n LYS 27 Cb 0.53 -0.40 -0.11 0.00 0.02 0.00 0.00 35.03 35.08 2hv4 n LYS 27 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2hv4 n VAL 28 N -1.01 1.03 -4.55 3.15 0.31 -0.65 -5.01 118.33 111.59 2hv4 n VAL 28 Ca 0.00 -0.56 -0.27 0.00 -0.01 0.00 0.00 64.34 63.50 2hv4 n VAL 28 Cb 0.00 -0.77 -0.08 0.00 -0.91 0.00 0.00 33.84 32.08 2hv4 n VAL 28 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2hv4 s GLY 29 N -5.11 2.67 0.77 2.92 0.00 -0.41 -5.05 107.32 103.10 2hv4 s GLY 29 Ca -0.13 -1.12 -0.12 0.00 0.00 0.00 0.00 44.72 43.36 2hv4 s GLY 29 CO 0.55 -1.89 1.11 2.56 0.00 0.00 0.00 173.10 175.43 2hv4 s PRO 30 N -3.74 2.33 0.45 2.90 0.04 -1.26 -4.47 135.00 131.25 2hv4 s PRO 30 Ca 0.21 0.51 -0.24 0.00 0.04 0.00 0.00 61.00 61.52 2hv4 s PRO 30 Cb 0.02 -1.96 -0.09 0.00 0.04 0.00 0.00 34.50 32.52 2hv4 s PRO 30 CO 0.13 -1.42 1.25 -1.71 0.04 0.00 0.00 177.00 175.29 2hv4 n ASN 31 N -3.28 2.38 -0.75 6.66 2.85 -1.26 -4.39 115.26 117.48 2hv4 n ASN 31 Ca 0.07 1.06 0.10 0.00 -0.11 0.00 0.00 54.58 55.71 2hv4 n ASN 31 Cb 0.57 -1.50 0.07 0.00 1.24 0.00 0.00 39.78 40.16 2hv4 n ASN 31 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 2hv4 n LEU 32 N -0.02 2.54 -4.56 1.20 4.77 -0.37 -4.87 117.00 115.69 2hv4 n LEU 32 Ca 0.08 -0.95 -0.35 0.00 -0.03 0.00 0.00 56.01 54.75 2hv4 n LEU 32 Cb 0.41 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.46 2hv4 n LEU 32 CO 0.57 0.44 1.41 -2.28 -1.33 0.00 0.00 177.39 176.20 2hv4 s HIS 33 N -1.81 2.16 0.00 -1.77 2.46 -1.26 -3.69 115.29 111.39 2hv4 s HIS 33 Ca 0.22 -0.08 0.00 0.00 0.47 0.00 0.00 55.06 55.67 2hv4 s HIS 33 Cb 0.17 -4.39 0.00 0.00 -0.13 0.00 0.00 32.58 28.23 2hv4 s HIS 33 CO 0.30 -1.90 0.00 0.41 -2.47 0.00 0.00 174.74 171.09 2hv4 n GLY 34 N 6.68 0.91 0.16 1.59 0.00 -1.26 -4.94 105.19 108.33 2hv4 n GLY 34 Ca 0.33 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.34 2hv4 n GLY 34 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 2hv4 h ILE 35 N 0.00 1.38 -2.76 -0.61 -2.65 -1.90 -3.42 117.51 107.55 2hv4 h ILE 35 Ca 0.00 -1.82 -0.52 0.00 1.03 0.00 0.00 64.86 63.55 2hv4 h ILE 35 Cb 0.00 1.97 0.06 0.00 -2.05 0.00 0.00 36.82 36.79 2hv4 h ILE 35 CO 0.00 0.52 0.97 -0.36 0.03 0.00 0.00 178.15 179.31 2hv4 s PHE 36 N -3.83 2.93 0.00 0.16 0.08 -1.26 -1.35 117.98 114.71 2hv4 s PHE 36 Ca -0.02 0.45 0.00 0.00 0.12 0.00 0.00 56.93 57.48 2hv4 s PHE 36 Cb 0.13 -4.08 0.00 0.00 -0.57 0.00 0.00 43.02 38.50 2hv4 s PHE 36 CO 0.75 -4.03 0.00 0.41 -0.10 0.00 0.00 175.22 172.25 2hv4 n GLY 37 N 3.77 0.53 3.98 4.36 0.00 0.01 -4.98 105.19 112.86 2hv4 n GLY 37 Ca 0.15 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.99 2hv4 n GLY 37 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2hv4 s ARG 38 N -0.41 2.73 -0.16 1.61 6.06 -0.46 -4.89 118.95 123.42 2hv4 s ARG 38 Ca 0.00 -1.34 -0.06 0.00 -2.50 0.00 0.00 55.73 51.83 2hv4 s ARG 38 Cb 0.00 -2.66 -0.04 0.00 0.06 0.00 0.00 34.95 32.31 2hv4 s ARG 38 CO 0.00 -0.29 0.06 -1.01 -2.50 0.00 0.00 175.30 171.55 2hv4 s HIS 39 N -2.40 3.26 0.02 5.12 3.76 -1.26 -1.38 115.29 122.41 2hv4 s HIS 39 Ca 0.54 0.11 -0.37 0.00 -0.15 0.00 0.00 55.06 55.18 2hv4 s HIS 39 Cb -0.08 -2.02 -0.17 0.00 1.11 0.00 0.00 32.58 31.42 2hv4 s HIS 39 CO 0.32 0.24 1.40 -1.13 -0.85 0.00 0.00 174.74 174.72 2hv4 n SER 40 N 3.21 1.73 -0.29 1.40 3.41 -0.12 -4.16 113.62 118.80 2hv4 n SER 40 Ca -0.17 1.11 0.00 0.00 -0.26 0.00 0.00 58.87 59.55 2hv4 n SER 40 Cb 0.53 -1.17 0.00 0.00 -0.26 0.00 0.00 64.21 63.30 2hv4 n SER 40 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2hv4 n GLY 41 N 2.78 0.83 0.11 5.00 0.00 -1.26 -4.32 105.19 108.33 2hv4 n GLY 41 Ca 0.20 -0.70 -0.12 0.00 0.00 0.00 0.00 46.02 45.40 2hv4 n GLY 41 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2hv4 n GLN 42 N -0.26 0.68 -2.51 1.61 6.02 -1.26 -4.85 117.38 116.81 2hv4 n GLN 42 Ca 0.00 0.05 -0.40 0.00 -0.01 0.00 0.00 57.00 56.65 2hv4 n GLN 42 Cb 0.10 -1.54 -0.03 0.00 1.02 0.00 0.00 30.24 29.79 2hv4 n GLN 42 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2hv4 s ALA 43 N -2.50 2.64 0.51 -1.58 0.00 -1.26 -4.89 121.76 114.67 2hv4 s ALA 43 Ca -0.16 -2.23 0.37 0.00 0.00 0.00 0.00 51.96 49.94 2hv4 s ALA 43 Cb 0.07 -4.54 1.52 0.00 0.00 0.00 0.00 23.12 20.17 2hv4 s ALA 43 CO 0.77 -3.73 1.70 1.49 0.00 0.00 0.00 175.76 176.00 2hv4 h GLU 44 N 9.81 0.07 -0.60 0.00 4.81 -2.05 -0.17 114.58 126.44 2hv4 h GLU 44 Ca 0.21 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.43 2hv4 h GLU 44 Cb 1.00 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.37 2hv4 h GLU 44 CO 1.41 0.04 0.00 0.41 -0.73 0.00 0.00 179.01 180.14 2hv4 n GLY 45 N -1.72 1.95 2.70 1.92 0.00 -1.26 -4.90 105.19 103.87 2hv4 n GLY 45 Ca 0.33 -0.63 -0.21 0.00 0.00 0.00 0.00 46.02 45.51 2hv4 n GLY 45 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2hv4 s TYR 46 N -1.64 0.22 -1.02 1.61 6.14 -0.08 -5.10 117.35 117.48 2hv4 s TYR 46 Ca 0.38 0.15 -0.23 0.00 0.64 0.00 0.00 57.07 58.01 2hv4 s TYR 46 Cb 0.23 -0.57 0.03 0.00 0.42 0.00 0.00 41.96 42.08 2hv4 s TYR 46 CO 0.20 -0.23 1.57 -1.54 0.64 0.00 0.00 175.55 176.20 2hv4 s SER 47 N 2.12 6.25 1.33 4.32 1.04 -1.26 -4.82 113.70 122.68 2hv4 s SER 47 Ca 0.05 -1.39 -0.19 0.00 0.48 0.00 0.00 55.95 54.90 2hv4 s SER 47 Cb -0.12 -2.57 0.33 0.00 0.10 0.00 0.00 66.02 63.76 2hv4 s SER 47 CO -0.04 -1.74 0.86 -1.22 0.98 0.00 0.00 173.24 172.08 2hv4 n TYR 48 N 9.89 -2.65 -2.43 5.02 4.02 -1.26 -5.04 117.16 124.71 2hv4 n TYR 48 Ca 0.36 -0.48 -0.40 0.00 -0.01 0.00 0.00 57.90 57.37 2hv4 n TYR 48 Cb 0.50 -1.49 -0.04 0.00 -0.02 0.00 0.00 39.34 38.29 2hv4 n TYR 48 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 2hv4 s THR 49 N -2.23 3.41 0.44 -0.72 -4.23 -1.26 -4.97 115.64 106.08 2hv4 s THR 49 Ca 0.66 1.36 0.17 0.00 -1.18 0.00 0.00 61.69 62.69 2hv4 s THR 49 Cb -0.17 -3.84 0.36 0.00 1.34 0.00 0.00 72.50 70.18 2hv4 s THR 49 CO 0.60 0.28 1.94 -0.78 -0.54 0.00 0.00 174.62 176.12 2hv4 h ASP 50 N 3.52 0.33 -0.64 3.99 3.58 -1.96 -1.81 116.42 123.44 2hv4 h ASP 50 Ca -0.47 0.02 -0.02 0.00 0.42 0.00 0.00 57.03 56.98 2hv4 h ASP 50 Cb 1.22 -0.05 -0.03 0.00 1.72 0.00 0.00 39.33 42.18 2hv4 h ASP 50 CO 0.66 0.18 0.35 0.00 -2.88 0.00 0.00 179.24 177.54 2hv4 h ALA 51 N 1.66 1.38 -0.08 -0.78 0.00 -1.91 0.27 119.26 119.80 2hv4 h ALA 51 Ca 0.34 -0.11 -0.18 0.00 0.00 0.00 0.00 54.91 54.96 2hv4 h ALA 51 Cb 0.83 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 2hv4 h ALA 51 CO -0.09 0.51 -0.72 -0.97 0.00 0.00 0.00 179.25 177.97 2hv4 h ASN 52 N 0.92 0.50 0.47 0.00 -1.24 -1.72 -3.15 115.58 111.36 2hv4 h ASN 52 Ca 0.23 -0.33 -0.02 0.00 0.71 0.00 0.00 56.30 56.89 2hv4 h ASN 52 Cb 0.04 -0.15 0.00 0.00 0.73 0.00 0.00 38.32 38.95 2hv4 h ASN 52 CO -0.04 1.06 -0.22 0.40 -1.29 0.00 0.00 177.43 177.34 2hv4 h ILE 53 N 0.29 0.00 0.00 2.57 2.04 -1.16 -3.21 117.51 118.04 2hv4 h ILE 53 Ca -0.03 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.38 2hv4 h ILE 53 Cb 1.30 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.38 2hv4 h ILE 53 CO 0.13 0.00 0.04 0.29 0.00 0.00 0.00 178.15 178.61 2hv4 n LYS 54 N -4.92 0.00 0.09 2.37 5.02 0.06 -0.86 118.16 119.91 2hv4 n LYS 54 Ca -0.08 0.32 -0.17 0.00 -2.02 0.00 0.00 58.31 56.36 2hv4 n LYS 54 Cb 0.25 -1.54 -0.11 0.00 -0.02 0.00 0.00 35.03 33.60 2hv4 n LYS 54 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 2hv4 h LYS 55 N 0.00 0.41 -6.38 1.97 1.63 -1.54 -3.48 116.57 109.17 2hv4 h LYS 55 Ca 0.00 -0.57 -0.49 0.00 -0.85 0.00 0.00 60.65 58.74 2hv4 h LYS 55 Cb 0.09 0.19 -0.26 0.00 -0.60 0.00 0.00 32.23 31.65 2hv4 h LYS 55 CO 0.00 1.23 -0.72 0.09 -3.45 0.00 0.00 179.45 176.60 2hv4 n ASN 56 N -3.67 -0.75 -4.68 4.20 5.03 -0.04 -4.87 115.26 110.48 2hv4 n ASN 56 Ca -0.10 -0.98 -0.42 0.00 0.87 0.00 0.00 54.58 53.95 2hv4 n ASN 56 Cb 0.96 -1.24 -0.03 0.00 -1.02 0.00 0.00 39.78 38.45 2hv4 n ASN 56 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2hv4 s VAL 57 N -3.16 3.25 -0.40 2.41 0.11 -1.26 -4.45 120.40 116.89 2hv4 s VAL 57 Ca 0.45 0.58 -0.28 0.00 -2.93 0.00 0.00 61.98 59.80 2hv4 s VAL 57 Cb -0.26 -3.37 -0.01 0.00 -1.53 0.00 0.00 36.38 31.20 2hv4 s VAL 57 CO 0.79 -0.02 1.73 -0.22 -3.33 0.00 0.00 175.10 174.06 2hv4 s LEU 58 N 3.09 3.48 0.04 2.54 0.20 -1.26 -0.95 118.68 125.82 2hv4 s LEU 58 Ca 0.74 1.02 -0.30 0.00 0.69 0.00 0.00 54.13 56.28 2hv4 s LEU 58 Cb -0.37 -3.33 -0.08 0.00 -0.43 0.00 0.00 46.19 41.97 2hv4 s LEU 58 CO 0.31 -1.78 1.80 0.26 -0.29 0.00 0.00 176.35 176.66 2hv4 s TRP 59 N 7.00 1.83 0.26 5.38 0.23 -0.48 -4.81 118.94 128.36 2hv4 s TRP 59 Ca 0.74 -0.07 0.01 0.00 -2.03 0.00 0.00 56.10 54.75 2hv4 s TRP 59 Cb -0.19 -4.10 -0.05 0.00 0.03 0.00 0.00 33.47 29.16 2hv4 s TRP 59 CO 0.31 -4.69 0.09 0.34 0.96 0.00 0.00 176.95 173.96 2hv4 s ASP 60 N 3.45 1.29 0.12 2.95 2.15 -1.26 -0.81 116.67 124.56 2hv4 s ASP 60 Ca 0.81 -1.37 -0.30 0.00 0.43 0.00 0.00 52.55 52.11 2hv4 s ASP 60 Cb -0.40 0.14 -0.09 0.00 -0.30 0.00 0.00 42.92 42.27 2hv4 s ASP 60 CO 0.36 -0.71 1.59 -0.33 -0.17 0.00 0.00 175.17 175.90 2hv4 h GLU 61 N 2.37 -0.59 0.09 4.34 5.08 -1.99 -0.37 114.58 123.52 2hv4 h GLU 61 Ca -0.38 0.04 -0.28 0.00 -1.00 0.00 0.00 59.36 57.74 2hv4 h GLU 61 Cb 1.25 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.62 2hv4 h GLU 61 CO 0.62 -0.39 -1.37 -0.91 -1.00 0.00 0.00 179.01 175.95 2hv4 h ASN 62 N -0.61 0.31 0.19 1.42 2.35 -1.98 -2.61 115.58 114.66 2hv4 h ASN 62 Ca 0.03 -0.39 -0.08 0.00 -0.55 0.00 0.00 56.30 55.31 2hv4 h ASN 62 Cb 0.66 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.92 2hv4 h ASN 62 CO -0.28 1.32 -0.31 -1.13 -1.65 0.00 0.00 177.43 175.39 2hv4 h ASN 63 N 0.05 0.18 -0.07 5.81 -1.24 -1.90 -1.40 115.58 117.02 2hv4 h ASN 63 Ca -0.18 -0.06 -0.18 0.00 0.71 0.00 0.00 56.30 56.59 2hv4 h ASN 63 Cb 1.96 -0.05 -0.00 0.00 0.73 0.00 0.00 38.32 40.96 2hv4 h ASN 63 CO 0.16 0.49 -0.60 -0.03 -1.29 0.00 0.00 177.43 176.16 2hv4 h MET 64 N 0.16 0.68 -0.56 6.67 4.05 -1.18 -3.30 114.93 121.46 2hv4 h MET 64 Ca 0.02 -0.46 0.06 0.00 -0.28 0.00 0.00 59.70 59.05 2hv4 h MET 64 Cb 0.63 0.07 -0.03 0.00 -0.80 0.00 0.00 31.60 31.46 2hv4 h MET 64 CO 0.05 1.08 0.37 0.66 0.23 0.00 0.00 176.91 179.30 2hv4 h SER 65 N 0.51 0.45 -0.40 1.39 4.64 -0.87 0.49 113.55 119.75 2hv4 h SER 65 Ca -0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 2hv4 h SER 65 Cb 1.18 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 63.17 2hv4 h SER 65 CO 0.12 0.29 -0.09 -0.08 -0.87 0.00 0.00 176.83 176.20 2hv4 h GLU 66 N 0.51 0.77 -0.43 4.77 4.57 -1.48 0.14 114.58 123.43 2hv4 h GLU 66 Ca 0.24 -0.29 -0.08 0.00 -1.18 0.00 0.00 59.36 58.05 2hv4 h GLU 66 Cb 0.30 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.83 2hv4 h GLU 66 CO -0.07 0.90 -0.04 -0.92 -1.18 0.00 0.00 179.01 177.70 2hv4 h TYR 67 N 0.59 0.78 0.00 0.92 3.20 -1.45 -1.30 116.97 119.71 2hv4 h TYR 67 Ca 0.10 -0.11 -0.05 0.00 3.14 0.00 0.00 58.73 61.81 2hv4 h TYR 67 Cb 0.61 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.66 2hv4 h TYR 67 CO 0.05 0.75 -0.22 -0.07 -1.64 0.00 0.00 178.16 177.03 2hv4 h LEU 68 N 0.68 0.00 0.44 2.82 3.38 -0.80 -2.10 115.31 119.73 2hv4 h LEU 68 Ca 0.13 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 2hv4 h LEU 68 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 2hv4 h LEU 68 CO 0.02 0.22 -0.21 0.74 0.09 0.00 0.00 178.44 179.31 2hv4 h THR 69 N 0.00 0.24 -1.87 0.22 2.02 -0.32 0.16 112.91 113.35 2hv4 h THR 69 Ca -0.00 -0.59 -0.50 0.00 0.77 0.00 0.00 66.41 66.09 2hv4 h THR 69 Cb 0.97 0.38 -0.38 0.00 -1.74 0.00 0.00 68.15 67.37 2hv4 h THR 69 CO 0.03 0.05 -1.12 -3.20 0.37 0.00 0.00 175.52 171.66 2hv4 n ASN 70 N -5.18 0.33 -0.23 4.18 4.05 -0.52 -4.17 115.26 113.72 2hv4 n ASN 70 Ca -0.09 -2.91 -0.00 0.00 0.45 0.00 0.00 54.58 52.03 2hv4 n ASN 70 Cb 0.27 -0.47 0.11 0.00 1.23 0.00 0.00 39.78 40.93 2hv4 n ASN 70 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 2hv4 h PRO 71 N 3.45 0.59 0.00 1.20 0.13 -1.55 -0.82 132.00 135.00 2hv4 h PRO 71 Ca 0.07 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 2hv4 h PRO 71 Cb 0.94 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 31.94 2hv4 h PRO 71 CO 0.47 0.39 0.00 1.17 -0.23 0.00 0.00 178.00 179.79 2hv4 n LYS 72 N -4.85 0.24 0.00 0.86 4.81 -1.26 -1.00 118.16 116.96 2hv4 n LYS 72 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.53 2hv4 n LYS 72 Cb 0.23 -1.30 0.00 0.00 0.02 0.00 0.00 35.03 33.98 2hv4 n LYS 72 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2hv4 n LYS 73 N -0.80 0.86 -0.31 1.64 5.02 -0.58 -4.77 118.16 119.22 2hv4 n LYS 73 Ca 0.03 0.00 -0.00 0.00 -2.02 0.00 0.00 58.31 56.32 2hv4 n LYS 73 Cb 0.02 -0.79 0.13 0.00 -0.02 0.00 0.00 35.03 34.36 2hv4 n LYS 73 CO 0.00 0.00 0.00 -0.92 -0.52 0.00 0.00 177.40 175.96 2hv4 h TYR 74 N 0.00 0.99 -3.52 2.13 3.20 -0.56 -3.27 116.97 115.94 2hv4 h TYR 74 Ca 0.00 0.03 -0.69 0.00 3.14 0.00 0.00 58.73 61.21 2hv4 h TYR 74 Cb 0.59 -0.32 -0.36 0.00 1.54 0.00 0.00 36.73 38.18 2hv4 h TYR 74 CO 0.00 0.53 -0.54 0.42 -1.64 0.00 0.00 178.16 176.93 2hv4 s ILE 75 N -6.08 3.19 -0.92 1.81 -1.09 -0.17 -5.06 121.20 112.88 2hv4 s ILE 75 Ca -0.13 -2.38 -0.24 0.00 -2.23 0.00 0.00 60.65 55.67 2hv4 s ILE 75 Cb 0.18 -3.18 -0.04 0.00 -1.58 0.00 0.00 42.46 37.84 2hv4 s ILE 75 CO 0.79 -0.73 1.91 -2.16 -1.23 0.00 0.00 174.94 173.52 2hv4 s PRO 76 N 0.75 2.64 0.00 2.79 0.04 -1.24 -3.15 135.00 136.83 2hv4 s PRO 76 Ca 0.11 -0.38 0.00 0.00 0.04 0.00 0.00 61.00 60.78 2hv4 s PRO 76 Cb -0.22 -5.09 0.00 0.00 0.04 0.00 0.00 34.50 29.23 2hv4 s PRO 76 CO -0.04 -3.30 0.00 0.41 0.04 0.00 0.00 177.00 174.11 2hv4 n GLY 77 N 6.83 -0.28 3.76 0.56 0.00 -1.26 -4.91 105.19 109.90 2hv4 n GLY 77 Ca 0.40 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.03 2hv4 n GLY 77 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2hv4 s THR 78 N -0.71 2.17 -0.73 2.61 -1.32 -1.19 -4.91 115.64 111.57 2hv4 s THR 78 Ca 0.00 0.14 0.17 0.00 -1.21 0.00 0.00 61.69 60.79 2hv4 s THR 78 Cb 0.00 -3.08 0.16 0.00 -1.51 0.00 0.00 72.50 68.07 2hv4 s THR 78 CO 0.00 0.01 1.51 0.29 -2.21 0.00 0.00 174.62 174.22 2hv4 n LYS 79 N -0.56 0.08 -2.05 7.08 5.02 -1.26 -4.53 118.16 121.94 2hv4 n LYS 79 Ca 0.07 0.39 -0.32 0.00 -2.02 0.00 0.00 58.31 56.43 2hv4 n LYS 79 Cb 0.44 -1.68 -0.05 0.00 -0.02 0.00 0.00 35.03 33.71 2hv4 n LYS 79 CO 0.00 0.00 0.00 -0.12 -0.52 0.00 0.00 177.40 176.76 2hv4 n MET 80 N -1.84 1.87 0.08 1.97 1.56 -1.26 -4.77 117.12 114.72 2hv4 n MET 80 Ca 0.02 -2.54 0.09 0.00 -0.27 0.00 0.00 57.70 54.99 2hv4 n MET 80 Cb 0.16 -3.61 0.38 0.00 2.15 0.00 0.00 33.22 32.30 2hv4 n MET 80 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2hv4 n ALA 81 N 12.62 1.44 -0.08 -5.12 0.00 -1.26 -4.38 120.51 123.73 2hv4 n ALA 81 Ca 0.46 0.06 -0.02 0.00 0.00 0.00 0.00 53.44 53.94 2hv4 n ALA 81 Cb 0.46 -1.27 -0.02 0.00 0.00 0.00 0.00 19.45 18.62 2hv4 n ALA 81 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2hv4 n PHE 82 N -1.92 -0.09 0.00 0.00 7.35 -1.26 -4.93 117.46 116.61 2hv4 n PHE 82 Ca 0.01 0.25 0.00 0.00 -0.76 0.00 0.00 57.45 56.95 2hv4 n PHE 82 Cb 0.14 -0.37 0.00 0.00 0.35 0.00 0.00 39.48 39.60 2hv4 n PHE 82 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2hv4 n GLY 83 N -1.05 2.26 0.00 7.13 0.00 -1.26 -5.08 105.19 107.19 2hv4 n GLY 83 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.41 2hv4 n GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hv4 n GLY 84 N 0.00 2.78 3.73 -0.02 0.00 -1.26 -4.25 105.19 106.17 2hv4 n GLY 84 Ca 0.00 -1.32 -0.35 0.00 0.00 0.00 0.00 46.02 44.34 2hv4 n GLY 84 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2hv4 s LEU 85 N 0.00 3.98 -0.05 0.99 1.43 0.04 -4.99 118.68 120.08 2hv4 s LEU 85 Ca 0.00 0.22 0.08 0.00 -1.03 0.00 0.00 54.13 53.40 2hv4 s LEU 85 Cb 0.00 -1.98 0.12 0.00 0.03 0.00 0.00 46.19 44.36 2hv4 s LEU 85 CO 0.00 0.28 1.03 1.17 0.23 0.00 0.00 176.35 179.07 2hv4 n LYS 86 N 2.80 0.67 -4.25 1.70 0.00 -1.26 -4.28 118.16 113.54 2hv4 n LYS 86 Ca -0.18 -1.65 -0.19 0.00 0.00 0.00 0.00 58.31 56.30 2hv4 n LYS 86 Cb 0.53 -0.93 -0.15 0.00 0.00 0.00 0.00 35.03 34.47 2hv4 n LYS 86 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 2hv4 s LYS 87 N -1.23 0.72 0.39 1.64 1.02 -1.26 -5.07 119.74 115.95 2hv4 s LYS 87 Ca 0.13 -0.21 0.08 0.00 0.02 0.00 0.00 55.97 55.99 2hv4 s LYS 87 Cb 0.12 -0.70 0.80 0.00 -0.52 0.00 0.00 37.83 37.53 2hv4 s LYS 87 CO 0.01 0.06 1.98 0.93 -0.92 0.00 0.00 175.35 177.41 2hv4 h GLU 88 N 6.47 0.42 0.16 1.68 3.07 -1.98 -1.22 114.58 123.17 2hv4 h GLU 88 Ca -0.33 -0.06 -0.01 0.00 -0.50 0.00 0.00 59.36 58.46 2hv4 h GLU 88 Cb 1.17 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 29.01 2hv4 h GLU 88 CO 0.49 0.39 -0.08 0.87 -1.40 0.00 0.00 179.01 179.28 2hv4 h LYS 89 N 0.41 -0.20 -0.31 2.33 1.79 -1.98 -0.04 116.57 118.57 2hv4 h LYS 89 Ca 0.10 0.01 0.07 0.00 -2.18 0.00 0.00 60.65 58.66 2hv4 h LYS 89 Cb 0.16 0.05 -0.08 0.00 -1.58 0.00 0.00 32.23 30.78 2hv4 h LYS 89 CO -0.00 0.21 -0.25 -0.44 -1.08 0.00 0.00 179.45 177.89 2hv4 h ASP 90 N -0.71 -0.82 -0.21 0.86 5.19 -1.95 0.11 116.42 118.89 2hv4 h ASP 90 Ca -0.02 0.15 0.05 0.00 -0.62 0.00 0.00 57.03 56.60 2hv4 h ASP 90 Cb 0.51 0.40 -0.07 0.00 0.18 0.00 0.00 39.33 40.34 2hv4 h ASP 90 CO 0.04 -0.28 -0.35 0.03 -3.12 0.00 0.00 179.24 175.56 2hv4 h ARG 91 N -0.22 -0.37 -0.41 3.56 3.08 -1.29 -0.28 114.38 118.46 2hv4 h ARG 91 Ca 0.16 0.03 0.02 0.00 0.07 0.00 0.00 59.98 60.25 2hv4 h ARG 91 Cb 0.47 0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.58 2hv4 h ARG 91 CO -0.44 -0.25 0.24 -0.91 -1.07 0.00 0.00 179.97 177.55 2hv4 h ASN 92 N -0.38 0.40 -0.29 7.04 -0.26 0.36 -1.24 115.58 121.21 2hv4 h ASN 92 Ca 0.11 0.00 -0.12 0.00 -0.56 0.00 0.00 56.30 55.73 2hv4 h ASN 92 Cb 0.57 -0.08 -0.01 0.00 -1.06 0.00 0.00 38.32 37.73 2hv4 h ASN 92 CO -0.42 0.29 -0.24 0.44 -1.06 0.00 0.00 177.43 176.44 2hv4 h ASP 93 N 0.49 0.79 -0.19 5.81 3.32 -0.77 -0.07 116.42 125.80 2hv4 h ASP 93 Ca 0.16 -0.29 -0.00 0.00 0.02 0.00 0.00 57.03 56.91 2hv4 h ASP 93 Cb -0.00 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 2hv4 h ASP 93 CO -0.07 1.00 0.10 0.25 -1.72 0.00 0.00 179.24 178.80 2hv4 h LEU 94 N 0.67 0.24 0.13 1.55 7.12 -0.78 0.32 115.31 124.56 2hv4 h LEU 94 Ca 0.09 -0.10 -0.00 0.00 0.13 0.00 0.00 57.88 58.00 2hv4 h LEU 94 Cb 0.75 -0.06 -0.00 0.00 -0.53 0.00 0.00 40.66 40.82 2hv4 h LEU 94 CO 0.06 0.27 -0.08 0.40 -0.13 0.00 0.00 178.44 178.96 2hv4 h ILE 95 N 0.19 0.82 -0.74 4.05 2.04 -1.22 0.05 117.51 122.70 2hv4 h ILE 95 Ca 0.07 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.98 2hv4 h ILE 95 Cb 0.09 0.82 -0.04 0.00 -0.74 0.00 0.00 36.82 36.94 2hv4 h ILE 95 CO -0.01 0.00 0.49 0.74 0.00 0.00 0.00 178.15 179.37 2hv4 h THR 96 N -0.21 1.07 0.71 -0.27 2.02 -0.87 -0.32 112.91 115.04 2hv4 h THR 96 Ca -0.01 -0.29 -0.03 0.00 0.77 0.00 0.00 66.41 66.85 2hv4 h THR 96 Cb 0.18 0.15 0.01 0.00 -1.74 0.00 0.00 68.15 66.75 2hv4 h THR 96 CO 0.01 0.15 -0.34 0.22 0.37 0.00 0.00 175.52 175.93 2hv4 h TYR 97 N 0.84 -0.89 0.00 3.16 3.20 -0.75 -3.16 116.97 119.37 2hv4 h TYR 97 Ca 0.31 -0.02 -0.07 0.00 3.14 0.00 0.00 58.73 62.09 2hv4 h TYR 97 Cb 0.15 0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 2hv4 h TYR 97 CO -0.00 -0.55 -0.32 -0.07 -1.64 0.00 0.00 178.16 175.57 2hv4 h LEU 98 N -1.18 0.00 -0.03 2.82 3.38 -0.51 0.33 115.31 120.12 2hv4 h LEU 98 Ca -0.10 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 2hv4 h LEU 98 Cb 0.73 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.48 2hv4 h LEU 98 CO 0.16 0.32 0.01 0.50 0.09 0.00 0.00 178.44 179.53 2hv4 h LYS 99 N 0.00 0.04 0.00 1.13 3.64 -1.23 -3.05 116.57 117.10 2hv4 h LYS 99 Ca -0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2hv4 h LYS 99 Cb 0.60 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 2hv4 h LYS 99 CO 0.04 0.18 0.00 -0.22 -2.27 0.00 0.00 179.45 177.19 2hv4 h LYS 100 N -0.11 0.00 0.00 1.90 3.11 -1.10 0.26 116.57 120.62 2hv4 h LYS 100 Ca 0.01 0.00 -0.06 0.00 -2.81 0.00 0.00 60.65 57.79 2hv4 h LYS 100 Cb 0.16 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.38 2hv4 h LYS 100 CO -0.00 0.00 -0.27 0.00 -2.81 0.00 0.00 179.45 176.37 2hv4 h ALA 101 N 2.07 1.11 0.00 5.00 0.00 -0.89 -3.32 119.26 123.23 2hv4 h ALA 101 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2hv4 h ALA 101 Cb 0.30 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2hv4 h ALA 101 CO 0.00 0.33 -1.38 -2.37 0.00 0.00 0.00 179.25 175.83 2hv4 n THR 102 N -3.57 0.00 0.01 0.00 5.66 -0.17 -4.85 114.28 111.36 2hv4 n THR 102 Ca -0.01 -0.23 0.00 0.00 -3.05 0.00 0.00 64.05 60.77 2hv4 n THR 102 Cb 0.41 0.33 0.00 0.00 -1.55 0.00 0.00 70.33 69.51 2hv4 n THR 102 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40