#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hv4 n LEU 2 N 0.00 -3.05 0.00 1.34 4.77 -1.26 -5.02 117.00 113.78 1hv4 n LEU 2 Ca 0.00 0.71 -0.15 0.00 -0.03 0.00 0.00 56.01 56.54 1hv4 n LEU 2 Cb 0.00 -1.52 0.13 0.00 -2.33 0.00 0.00 43.42 39.70 1hv4 n LEU 2 CO 0.00 -0.59 0.30 -1.54 -1.33 0.00 0.00 177.39 174.23 1hv4 n SER 3 N 0.44 -1.73 -0.03 -1.43 3.41 -1.26 -4.80 113.62 108.22 1hv4 n SER 3 Ca 0.00 -0.80 -0.13 0.00 -0.26 0.00 0.00 58.87 57.68 1hv4 n SER 3 Cb 0.00 -0.52 -0.09 0.00 -0.26 0.00 0.00 64.21 63.34 1hv4 n SER 3 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1hv4 h ALA 4 N -2.43 0.10 -0.03 7.33 0.00 -1.99 -2.52 119.26 119.71 1hv4 h ALA 4 Ca -0.21 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.39 1hv4 h ALA 4 Cb 0.65 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1hv4 h ALA 4 CO 0.14 -0.04 -0.05 0.00 0.00 0.00 0.00 179.25 179.30 1hv4 h ALA 5 N 0.49 -0.03 -0.63 0.00 0.00 -1.99 0.07 119.26 117.18 1hv4 h ALA 5 Ca 0.00 0.02 0.11 0.00 0.00 0.00 0.00 54.91 55.04 1hv4 h ALA 5 Cb 0.68 0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.48 1hv4 h ALA 5 CO 0.02 -0.54 0.21 -0.44 0.00 0.00 0.00 179.25 178.51 1hv4 h ASP 6 N -0.08 0.17 -0.51 0.00 3.45 -1.92 0.18 116.42 117.72 1hv4 h ASP 6 Ca 0.03 0.09 -0.01 0.00 0.43 0.00 0.00 57.03 57.58 1hv4 h ASP 6 Cb 0.12 0.09 -0.02 0.00 -0.56 0.00 0.00 39.33 38.95 1hv4 h ASP 6 CO -0.07 0.10 0.29 0.11 -1.57 0.00 0.00 179.24 178.09 1hv4 h LYS 7 N 0.37 0.69 -0.34 3.56 1.57 -0.94 -0.46 116.57 121.03 1hv4 h LYS 7 Ca 0.33 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 59.03 1hv4 h LYS 7 Cb 0.45 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 1hv4 h LYS 7 CO -0.35 0.52 0.19 1.15 -0.57 0.00 0.00 179.45 180.39 1hv4 h THR 8 N 0.67 1.14 -0.27 -0.16 2.02 0.10 -0.24 112.91 116.17 1hv4 h THR 8 Ca 0.18 -0.36 -0.02 0.00 0.77 0.00 0.00 66.41 66.98 1hv4 h THR 8 Cb 0.02 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 1hv4 h THR 8 CO -0.03 0.14 0.09 0.78 0.37 0.00 0.00 175.52 176.87 1hv4 h ASN 9 N 0.43 0.38 -0.08 4.18 -0.26 -0.48 -0.28 115.58 119.49 1hv4 h ASN 9 Ca 0.12 -0.19 0.03 0.00 -0.56 0.00 0.00 56.30 55.70 1hv4 h ASN 9 Cb 0.06 -0.10 -0.04 0.00 -1.06 0.00 0.00 38.32 37.18 1hv4 h ASN 9 CO -0.02 0.47 -0.14 0.58 -1.06 0.00 0.00 177.43 177.26 1hv4 h VAL 10 N 0.27 0.63 -0.62 2.81 2.07 -0.90 -1.54 116.25 118.97 1hv4 h VAL 10 Ca 0.09 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.69 1hv4 h VAL 10 Cb 0.22 0.63 -0.07 0.00 -1.52 0.00 0.00 31.29 30.56 1hv4 h VAL 10 CO -0.00 0.00 0.28 0.11 0.02 0.00 0.00 177.57 177.97 1hv4 h LYS 11 N -0.20 0.48 0.21 1.57 1.57 -0.88 -2.31 116.57 117.01 1hv4 h LYS 11 Ca 0.07 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1hv4 h LYS 11 Cb 0.30 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.48 1hv4 h LYS 11 CO -0.19 0.32 -0.36 0.78 -0.57 0.00 0.00 179.45 179.43 1hv4 h GLY 12 N 0.50 -1.14 2.00 3.86 0.00 -0.09 -1.24 103.07 106.96 1hv4 h GLY 12 Ca 0.30 0.56 -0.00 0.00 0.00 0.00 0.00 47.33 48.19 1hv4 h GLY 12 CO -0.26 -0.34 -0.00 -0.24 0.00 0.00 0.00 176.54 175.70 1hv4 h VAL 13 N -0.60 0.03 0.00 4.60 3.04 -1.28 0.21 116.25 122.24 1hv4 h VAL 13 Ca -0.02 -0.06 -0.06 0.00 -1.01 0.00 0.00 66.70 65.55 1hv4 h VAL 13 Cb 0.56 1.06 -0.01 0.00 -2.01 0.00 0.00 31.29 30.89 1hv4 h VAL 13 CO -0.12 0.00 -0.54 -0.26 -1.01 0.00 0.00 177.57 175.64 1hv4 h PHE 14 N 0.00 0.00 -0.19 3.17 0.04 -0.93 -3.04 116.94 115.98 1hv4 h PHE 14 Ca -0.00 0.00 -0.13 0.00 2.80 0.00 0.00 57.97 60.64 1hv4 h PHE 14 Cb 0.06 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.20 1hv4 h PHE 14 CO 0.00 0.26 -0.44 0.66 -0.60 0.00 0.00 178.31 178.19 1hv4 h SER 15 N 0.00 0.50 0.67 2.17 4.64 0.61 -0.28 113.55 121.86 1hv4 h SER 15 Ca -0.02 -0.23 -0.16 0.00 -0.47 0.00 0.00 61.79 60.91 1hv4 h SER 15 Cb 1.22 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 63.15 1hv4 h SER 15 CO 0.03 0.88 -0.74 0.11 -0.87 0.00 0.00 176.83 176.23 1hv4 h LYS 16 N 0.38 0.06 0.00 4.77 6.56 -1.50 -3.26 116.57 123.57 1hv4 h LYS 16 Ca 0.03 -0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 1hv4 h LYS 16 Cb 0.93 0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.60 1hv4 h LYS 16 CO 0.08 0.77 -1.24 0.44 -2.06 0.00 0.00 179.45 177.44 1hv4 n ILE 17 N -3.69 0.29 -1.57 1.86 -5.35 -1.15 -4.92 119.36 104.82 1hv4 n ILE 17 Ca -0.01 -0.41 -0.42 0.00 -0.27 0.00 0.00 62.75 61.64 1hv4 n ILE 17 Cb 0.72 -0.03 0.00 0.00 -1.74 0.00 0.00 39.64 38.59 1hv4 n ILE 17 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1hv4 n SER 18 N -2.28 0.84 0.00 7.28 3.41 -0.12 -1.96 113.62 120.78 1hv4 n SER 18 Ca -0.00 1.05 0.00 0.00 -0.26 0.00 0.00 58.87 59.66 1hv4 n SER 18 Cb 0.51 -1.29 0.00 0.00 -0.26 0.00 0.00 64.21 63.17 1hv4 n SER 18 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1hv4 n GLY 19 N 1.32 0.80 0.00 5.00 0.00 -1.26 -4.89 105.19 106.16 1hv4 n GLY 19 Ca 0.10 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.49 1hv4 n GLY 19 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1hv4 n HIS 20 N -2.78 0.00 -0.22 1.61 -0.00 -0.83 -4.96 115.22 108.05 1hv4 n HIS 20 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 57.72 57.65 1hv4 n HIS 20 Cb 0.17 0.07 -0.06 0.00 -0.00 0.00 0.00 29.99 30.17 1hv4 n HIS 20 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1hv4 h ALA 21 N 0.00 -0.42 -0.79 -1.41 0.00 -1.90 0.26 119.26 114.99 1hv4 h ALA 21 Ca 0.00 0.06 0.09 0.00 0.00 0.00 0.00 54.91 55.06 1hv4 h ALA 21 Cb 0.79 1.17 -0.12 0.00 0.00 0.00 0.00 17.79 19.64 1hv4 h ALA 21 CO 0.00 -0.66 -0.52 1.49 0.00 0.00 0.00 179.25 179.57 1hv4 h GLU 22 N -0.07 -0.12 0.24 0.00 4.57 -1.88 0.13 114.58 117.45 1hv4 h GLU 22 Ca 0.09 0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.26 1hv4 h GLU 22 Cb 0.29 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.91 1hv4 h GLU 22 CO -0.54 -0.08 -0.11 1.49 -1.18 0.00 0.00 179.01 178.58 1hv4 h GLU 23 N -0.13 -0.31 -0.12 1.92 4.81 -1.49 -2.92 114.58 116.35 1hv4 h GLU 23 Ca 0.18 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.41 1hv4 h GLU 23 Cb 0.51 0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.96 1hv4 h GLU 23 CO -0.83 -0.05 0.01 1.88 -0.73 0.00 0.00 179.01 179.30 1hv4 h TYR 24 N -0.54 0.22 -0.66 0.92 0.99 -0.34 -2.55 116.97 115.01 1hv4 h TYR 24 Ca -0.03 -0.03 0.12 0.00 2.00 0.00 0.00 58.73 60.78 1hv4 h TYR 24 Cb 0.40 -0.06 -0.08 0.00 1.00 0.00 0.00 36.73 37.98 1hv4 h TYR 24 CO -0.00 0.42 0.23 0.78 -0.00 0.00 0.00 178.16 179.59 1hv4 h GLY 25 N -0.04 0.94 1.43 3.88 0.00 -0.84 0.17 103.07 108.60 1hv4 h GLY 25 Ca 0.04 -0.10 -0.03 0.00 0.00 0.00 0.00 47.33 47.23 1hv4 h GLY 25 CO 0.00 -0.07 0.21 0.00 0.00 0.00 0.00 176.54 176.68 1hv4 h ALA 26 N 1.49 1.40 -0.17 3.60 0.00 -1.45 -2.24 119.26 121.88 1hv4 h ALA 26 Ca 0.35 -0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.96 1hv4 h ALA 26 Cb 0.50 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1hv4 h ALA 26 CO -0.37 0.45 -0.54 1.49 0.00 0.00 0.00 179.25 180.28 1hv4 h GLU 27 N 0.73 0.66 -0.53 0.00 4.81 -0.41 -2.34 114.58 117.50 1hv4 h GLU 27 Ca 0.18 -0.49 -0.09 0.00 -0.13 0.00 0.00 59.36 58.83 1hv4 h GLU 27 Cb 0.14 0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 1hv4 h GLU 27 CO -0.02 1.11 -0.02 1.79 -0.73 0.00 0.00 179.01 181.14 1hv4 h THR 28 N 0.35 1.26 -0.25 0.32 1.35 -0.65 -1.48 112.91 113.80 1hv4 h THR 28 Ca -0.02 -1.11 -0.01 0.00 -0.55 0.00 0.00 66.41 64.72 1hv4 h THR 28 Cb 1.16 0.87 -0.01 0.00 -1.73 0.00 0.00 68.15 68.44 1hv4 h THR 28 CO 0.11 0.40 0.13 -0.07 -0.25 0.00 0.00 175.52 175.84 1hv4 h LEU 29 N 0.85 0.33 -1.33 3.87 3.38 -1.40 -0.45 115.31 120.55 1hv4 h LEU 29 Ca 0.15 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 1hv4 h LEU 29 Cb 0.53 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1hv4 h LEU 29 CO 0.03 0.35 -0.26 -0.08 0.09 0.00 0.00 178.44 178.57 1hv4 h GLU 30 N 0.28 0.11 -0.04 1.13 4.81 -1.23 -1.40 114.58 118.24 1hv4 h GLU 30 Ca 0.09 -0.03 -0.19 0.00 -0.13 0.00 0.00 59.36 59.09 1hv4 h GLU 30 Cb 0.10 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 1hv4 h GLU 30 CO -0.01 0.37 -0.79 0.00 -0.73 0.00 0.00 179.01 177.85 1hv4 h ARG 31 N 0.10 0.34 -0.30 1.92 3.08 -0.96 -2.36 114.38 116.21 1hv4 h ARG 31 Ca 0.02 -0.31 -0.04 0.00 0.07 0.00 0.00 59.98 59.72 1hv4 h ARG 31 Cb 0.52 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.63 1hv4 h ARG 31 CO 0.04 0.97 0.03 1.98 -1.07 0.00 0.00 179.97 181.92 1hv4 h MET 32 N 0.22 0.51 0.00 0.04 4.05 -0.43 0.18 114.93 119.49 1hv4 h MET 32 Ca -0.04 -0.15 -0.08 0.00 -0.28 0.00 0.00 59.70 59.15 1hv4 h MET 32 Cb 1.38 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 32.12 1hv4 h MET 32 CO 0.13 0.63 -0.38 0.74 0.23 0.00 0.00 176.91 178.25 1hv4 h PHE 33 N 0.32 0.00 0.14 1.39 0.04 -1.31 0.79 116.94 118.31 1hv4 h PHE 33 Ca 0.09 0.00 -0.29 0.00 2.80 0.00 0.00 57.97 60.57 1hv4 h PHE 33 Cb 0.38 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.53 1hv4 h PHE 33 CO 0.03 0.38 -1.30 1.15 -0.60 0.00 0.00 178.31 177.97 1hv4 h THR 34 N 0.00 1.44 0.00 -1.55 2.02 -1.15 -3.05 112.91 110.62 1hv4 h THR 34 Ca -0.00 -3.00 -0.12 0.00 0.77 0.00 0.00 66.41 64.06 1hv4 h THR 34 Cb 0.78 2.94 -0.02 0.00 -1.74 0.00 0.00 68.15 70.11 1hv4 h THR 34 CO 0.05 0.88 -2.06 0.00 0.37 0.00 0.00 175.52 174.76 1hv4 n ALA 35 N -2.57 2.36 -3.09 6.16 0.00 0.03 -4.53 120.51 118.87 1hv4 n ALA 35 Ca -0.10 -0.76 -0.23 0.00 0.00 0.00 0.00 53.44 52.34 1hv4 n ALA 35 Cb 1.04 -0.60 -0.04 0.00 0.00 0.00 0.00 19.45 19.85 1hv4 n ALA 35 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1hv4 n TYR 36 N -2.45 2.27 -0.40 0.00 4.02 0.27 -4.97 117.16 115.90 1hv4 n TYR 36 Ca -0.13 -3.92 0.32 0.00 -0.01 0.00 0.00 57.90 54.17 1hv4 n TYR 36 Cb 0.76 -0.46 0.60 0.00 -0.02 0.00 0.00 39.34 40.22 1hv4 n TYR 36 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1hv4 h PRO 37 N 3.14 0.18 0.00 -0.72 0.13 -1.65 0.06 132.00 133.13 1hv4 h PRO 37 Ca 0.12 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1hv4 h PRO 37 Cb 0.72 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.81 1hv4 h PRO 37 CO 0.68 0.12 0.00 -0.56 -0.23 0.00 0.00 178.00 178.00 1hv4 h GLN 38 N 0.18 0.00 0.00 0.86 -0.00 -1.91 0.19 115.11 114.43 1hv4 h GLN 38 Ca 0.75 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.40 1hv4 h GLN 38 Cb 2.21 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 29.69 1hv4 h GLN 38 CO -0.39 0.00 0.00 0.25 -0.00 0.00 0.00 178.83 178.69 1hv4 n THR 39 N -2.63 0.78 -0.36 1.86 -2.24 0.01 -2.64 114.28 109.06 1hv4 n THR 39 Ca -0.02 0.15 -0.01 0.00 -2.27 0.00 0.00 64.05 61.91 1hv4 n THR 39 Cb 0.08 -0.99 0.13 0.00 -2.10 0.00 0.00 70.33 67.45 1hv4 n THR 39 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1hv4 h LYS 40 N 0.00 1.19 -1.33 -0.78 1.57 -1.15 -2.82 116.57 113.25 1hv4 h LYS 40 Ca 0.00 -0.07 0.39 0.00 -1.87 0.00 0.00 60.65 59.09 1hv4 h LYS 40 Cb 0.39 -0.27 -0.05 0.00 0.08 0.00 0.00 32.23 32.38 1hv4 h LYS 40 CO 0.00 0.79 1.09 2.41 -0.57 0.00 0.00 179.45 183.17 1hv4 n THR 41 N -4.47 0.00 1.25 -0.16 -1.04 -1.08 0.13 114.28 108.91 1hv4 n THR 41 Ca 0.13 1.13 0.13 0.00 -2.04 0.00 0.00 64.05 63.40 1hv4 n THR 41 Cb 0.08 -1.93 0.45 0.00 -1.82 0.00 0.00 70.33 67.11 1hv4 n THR 41 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1hv4 n TYR 42 N -3.30 0.00 -2.98 -1.42 4.01 -1.06 -4.33 117.16 108.07 1hv4 n TYR 42 Ca 0.30 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.82 1hv4 n TYR 42 Cb 1.49 -0.19 -0.03 0.00 -0.31 0.00 0.00 39.34 40.31 1hv4 n TYR 42 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1hv4 n PHE 43 N -0.94 2.18 0.14 -0.72 3.01 0.35 -4.87 117.46 116.61 1hv4 n PHE 43 Ca 0.12 -3.75 0.06 0.00 1.01 0.00 0.00 57.45 54.88 1hv4 n PHE 43 Cb 0.32 -0.42 0.52 0.00 -0.01 0.00 0.00 39.48 39.89 1hv4 n PHE 43 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1hv4 h PRO 44 N 2.96 0.24 -0.77 -1.08 0.11 -1.76 -1.21 132.00 130.49 1hv4 h PRO 44 Ca 0.11 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.20 1hv4 h PRO 44 Cb 0.78 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.84 1hv4 h PRO 44 CO 0.67 0.19 0.00 -2.39 -0.21 0.00 0.00 178.00 176.26 1hv4 n HIS 45 N -4.47 0.54 -4.30 0.65 1.44 -1.26 -4.88 115.22 102.94 1hv4 n HIS 45 Ca -0.00 -0.20 -0.31 0.00 -2.01 0.00 0.00 57.72 55.20 1hv4 n HIS 45 Cb 0.11 -0.18 -0.10 0.00 0.12 0.00 0.00 29.99 29.94 1hv4 n HIS 45 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 1hv4 s PHE 46 N -1.54 2.86 -0.73 -1.40 2.99 -0.46 -5.05 117.98 114.65 1hv4 s PHE 46 Ca 0.15 -0.08 -0.25 0.00 0.00 0.00 0.00 56.93 56.75 1hv4 s PHE 46 Cb 0.11 -1.53 0.04 0.00 0.00 0.00 0.00 43.02 41.64 1hv4 s PHE 46 CO 0.05 0.42 1.20 0.34 -0.00 0.00 0.00 175.22 177.23 1hv4 s ASP 47 N -1.89 6.19 0.00 1.36 -1.08 -1.26 -4.88 116.67 115.10 1hv4 s ASP 47 Ca 0.21 -0.67 0.28 0.00 -0.52 0.00 0.00 52.55 51.84 1hv4 s ASP 47 Cb -0.11 -2.52 1.01 0.00 -1.46 0.00 0.00 42.92 39.83 1hv4 s ASP 47 CO 0.12 -1.70 1.72 0.18 0.52 0.00 0.00 175.17 176.01 1hv4 n LEU 48 N 8.85 1.23 -4.72 -1.34 4.32 -1.26 -4.43 117.00 119.64 1hv4 n LEU 48 Ca 0.03 -0.37 -0.42 0.00 -0.02 0.00 0.00 56.01 55.23 1hv4 n LEU 48 Cb 0.48 -0.05 -0.03 0.00 -1.62 0.00 0.00 43.42 42.20 1hv4 n LEU 48 CO 0.69 0.21 1.36 0.00 -1.22 0.00 0.00 177.39 178.43 1hv4 n GLN 49 N -0.20 2.79 -1.23 3.23 0.00 -1.26 -4.82 117.38 115.89 1hv4 n GLN 49 Ca 0.17 1.00 -0.48 0.00 0.00 0.00 0.00 57.00 57.69 1hv4 n GLN 49 Cb 0.34 -2.85 -0.07 0.00 0.00 0.00 0.00 30.24 27.67 1hv4 n GLN 49 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.06 178.64 1hv4 n HIS 50 N 3.75 0.54 -1.54 2.61 -0.00 -1.26 -1.45 115.22 117.87 1hv4 n HIS 50 Ca 0.15 0.87 -0.09 0.00 -0.00 0.00 0.00 57.72 58.65 1hv4 n HIS 50 Cb 0.35 -1.71 -0.03 0.00 -0.00 0.00 0.00 29.99 28.60 1hv4 n HIS 50 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1hv4 n GLY 51 N 1.26 0.76 3.75 1.57 0.00 -1.26 -5.01 105.19 106.25 1hv4 n GLY 51 Ca 0.16 -0.58 -0.34 0.00 0.00 0.00 0.00 46.02 45.26 1hv4 n GLY 51 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1hv4 s SER 52 N -2.81 4.74 0.25 1.61 1.04 -0.53 -4.89 113.70 113.11 1hv4 s SER 52 Ca 0.00 2.18 -0.04 0.00 0.48 0.00 0.00 55.95 58.57 1hv4 s SER 52 Cb 0.00 -2.57 0.28 0.00 0.10 0.00 0.00 66.02 63.83 1hv4 s SER 52 CO 0.00 -1.89 1.76 0.00 0.98 0.00 0.00 173.24 174.10 1hv4 h ALA 53 N -0.02 1.09 0.38 5.32 0.00 -1.90 -1.83 119.26 122.30 1hv4 h ALA 53 Ca -0.47 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.18 1hv4 h ALA 53 Cb 1.27 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1hv4 h ALA 53 CO 0.52 0.60 -0.18 1.96 0.00 0.00 0.00 179.25 182.15 1hv4 h GLN 54 N 0.87 -0.49 -0.98 0.00 4.20 -1.92 0.59 115.11 117.39 1hv4 h GLN 54 Ca 0.18 0.03 0.08 0.00 0.06 0.00 0.00 58.65 59.01 1hv4 h GLN 54 Cb 0.38 0.11 -0.07 0.00 0.30 0.00 0.00 27.48 28.20 1hv4 h GLN 54 CO 0.01 -0.32 0.62 0.82 -0.67 0.00 0.00 178.83 179.29 1hv4 h ILE 55 N -0.52 1.02 0.06 2.54 2.04 -1.73 0.16 117.51 121.08 1hv4 h ILE 55 Ca -0.05 -0.37 -0.00 0.00 1.00 0.00 0.00 64.86 65.44 1hv4 h ILE 55 Cb 0.40 -0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.33 1hv4 h ILE 55 CO 0.09 0.20 -0.03 0.11 0.00 0.00 0.00 178.15 178.51 1hv4 h LYS 56 N 1.07 -0.08 -0.41 2.37 1.57 -1.05 0.49 116.57 120.52 1hv4 h LYS 56 Ca 0.45 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 59.26 1hv4 h LYS 56 Cb 0.28 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.58 1hv4 h LYS 56 CO -0.21 0.14 0.23 0.00 -0.57 0.00 0.00 179.45 179.04 1hv4 h ALA 57 N 0.63 0.52 -0.25 3.86 0.00 -0.26 -0.34 119.26 123.43 1hv4 h ALA 57 Ca -0.01 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 1hv4 h ALA 57 Cb 0.26 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1hv4 h ALA 57 CO 0.01 -0.11 -0.13 1.25 0.00 0.00 0.00 179.25 180.27 1hv4 h HIS 58 N 0.46 0.61 -0.24 0.00 -0.00 -0.64 -2.26 115.15 113.07 1hv4 h HIS 58 Ca 0.17 -0.15 0.05 0.00 -0.00 0.00 0.00 60.37 60.44 1hv4 h HIS 58 Cb 0.04 -0.14 -0.08 0.00 -0.00 0.00 0.00 27.41 27.24 1hv4 h HIS 58 CO -0.08 0.79 -0.41 0.78 -0.00 0.00 0.00 177.93 179.01 1hv4 h GLY 59 N 0.25 -0.61 0.11 5.26 0.00 0.38 0.15 103.07 108.61 1hv4 h GLY 59 Ca 0.05 0.51 0.16 0.00 0.00 0.00 0.00 47.33 48.06 1hv4 h GLY 59 CO 0.04 -0.21 0.39 1.70 0.00 0.00 0.00 176.54 178.46 1hv4 h LYS 60 N -0.41 0.51 -0.40 4.80 3.64 -0.97 -1.60 116.57 122.13 1hv4 h LYS 60 Ca 0.10 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.43 1hv4 h LYS 60 Cb 0.60 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.29 1hv4 h LYS 60 CO -0.46 0.34 0.15 0.87 -2.27 0.00 0.00 179.45 178.07 1hv4 h LYS 61 N 0.52 0.61 0.38 1.90 1.79 -0.28 -1.10 116.57 120.38 1hv4 h LYS 61 Ca 0.47 -0.12 -0.01 0.00 -2.18 0.00 0.00 60.65 58.81 1hv4 h LYS 61 Cb 0.73 -0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 31.26 1hv4 h LYS 61 CO -0.41 0.58 -0.43 0.28 -1.08 0.00 0.00 179.45 178.39 1hv4 h VAL 62 N 0.51 0.00 -0.17 0.50 2.07 0.17 -1.81 116.25 117.52 1hv4 h VAL 62 Ca 0.13 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.62 1hv4 h VAL 62 Cb 0.21 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.97 1hv4 h VAL 62 CO -0.01 0.00 -0.05 1.62 0.02 0.00 0.00 177.57 179.15 1hv4 h VAL 63 N -0.82 1.14 -0.90 2.57 3.04 -1.51 -1.70 116.25 118.06 1hv4 h VAL 63 Ca -0.05 -0.57 0.09 0.00 -1.01 0.00 0.00 66.70 65.16 1hv4 h VAL 63 Cb 0.72 1.07 -0.06 0.00 -2.01 0.00 0.00 31.29 31.01 1hv4 h VAL 63 CO -0.08 0.18 0.58 0.00 -1.01 0.00 0.00 177.57 177.25 1hv4 h ALA 64 N 1.72 1.60 -0.17 3.17 0.00 -0.83 0.16 119.26 124.90 1hv4 h ALA 64 Ca 0.05 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.75 1hv4 h ALA 64 Cb 0.25 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 17.83 1hv4 h ALA 64 CO 0.01 0.22 -0.72 0.00 0.00 0.00 0.00 179.25 178.77 1hv4 h ALA 65 N 1.54 0.31 -0.78 0.00 0.00 -0.47 -1.03 119.26 118.84 1hv4 h ALA 65 Ca 0.41 -0.58 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1hv4 h ALA 65 Cb 0.37 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 1hv4 h ALA 65 CO -0.18 0.65 0.34 -0.07 0.00 0.00 0.00 179.25 180.00 1hv4 h LEU 66 N 0.52 1.04 0.08 0.00 3.38 -0.75 0.16 115.31 119.73 1hv4 h LEU 66 Ca -0.04 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.79 1hv4 h LEU 66 Cb 1.35 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.83 1hv4 h LEU 66 CO 0.15 0.90 -0.04 0.58 0.09 0.00 0.00 178.44 180.12 1hv4 h VAL 67 N 1.12 1.03 -1.00 1.22 2.07 -0.68 -1.75 116.25 118.26 1hv4 h VAL 67 Ca 0.26 -0.37 0.20 0.00 0.82 0.00 0.00 66.70 67.62 1hv4 h VAL 67 Cb 0.16 1.27 -0.11 0.00 -1.52 0.00 0.00 31.29 31.09 1hv4 h VAL 67 CO -0.03 0.09 0.60 -0.08 0.02 0.00 0.00 177.57 178.18 1hv4 h GLU 68 N -0.27 0.70 -0.18 1.57 4.57 -0.56 0.37 114.58 120.78 1hv4 h GLU 68 Ca -0.01 -0.04 -0.08 0.00 -1.18 0.00 0.00 59.36 58.05 1hv4 h GLU 68 Cb 0.23 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 28.65 1hv4 h GLU 68 CO 0.02 0.46 -0.23 0.00 -1.18 0.00 0.00 179.01 178.09 1hv4 h ALA 69 N 1.66 1.28 -0.51 2.92 0.00 -0.45 -2.70 119.26 121.47 1hv4 h ALA 69 Ca 0.59 -0.30 -0.12 0.00 0.00 0.00 0.00 54.91 55.09 1hv4 h ALA 69 Cb 0.97 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 1hv4 h ALA 69 CO -0.40 0.48 -0.14 0.28 0.00 0.00 0.00 179.25 179.46 1hv4 h VAL 70 N 0.29 1.27 -0.18 0.00 2.07 0.59 0.13 116.25 120.43 1hv4 h VAL 70 Ca 0.05 -1.29 -0.01 0.00 0.82 0.00 0.00 66.70 66.27 1hv4 h VAL 70 Cb 0.57 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 1hv4 h VAL 70 CO 0.04 0.45 0.06 0.78 0.02 0.00 0.00 177.57 178.92 1hv4 h ASN 71 N 0.86 0.22 -0.76 0.57 2.35 -1.08 -1.66 115.58 116.08 1hv4 h ASN 71 Ca 0.13 -0.01 -0.54 0.00 -0.55 0.00 0.00 56.30 55.32 1hv4 h ASN 71 Cb 0.70 -0.05 -0.37 0.00 0.05 0.00 0.00 38.32 38.64 1hv4 h ASN 71 CO 0.05 0.21 -0.41 1.41 -1.65 0.00 0.00 177.43 177.04 1hv4 n HIS 72 N -4.45 2.69 0.00 1.19 8.25 -0.96 -4.79 115.22 117.14 1hv4 n HIS 72 Ca -0.00 -2.34 0.00 0.00 -0.26 0.00 0.00 57.72 55.12 1hv4 n HIS 72 Cb 0.12 -0.58 0.00 0.00 1.12 0.00 0.00 29.99 30.65 1hv4 n HIS 72 CO 0.00 0.00 0.00 1.51 0.64 0.00 0.00 176.34 178.49 1hv4 n ILE 73 N -0.79 0.00 0.44 1.59 3.06 0.43 -0.20 119.36 123.89 1hv4 n ILE 73 Ca 0.47 0.00 0.09 0.00 -2.50 0.00 0.00 62.75 60.81 1hv4 n ILE 73 Cb 0.90 -0.86 -0.13 0.00 0.54 0.00 0.00 39.64 40.09 1hv4 n ILE 73 CO 0.00 0.00 0.00 0.47 -2.50 0.00 0.00 176.55 174.52 1hv4 n ASP 74 N -0.82 0.70 -3.05 9.51 9.92 -1.26 -4.61 116.55 126.95 1hv4 n ASP 74 Ca 0.00 -0.47 -0.15 0.00 -0.53 0.00 0.00 54.79 53.64 1hv4 n ASP 74 Cb 0.00 1.45 0.01 0.00 -0.64 0.00 0.00 41.12 41.94 1hv4 n ASP 74 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 1hv4 n ASP 75 N -1.82 -0.04 -0.33 -2.24 4.64 0.72 -4.97 116.55 112.51 1hv4 n ASP 75 Ca -0.00 -3.19 0.10 0.00 -1.38 0.00 0.00 54.79 50.32 1hv4 n ASP 75 Cb 0.41 0.09 0.27 0.00 -1.04 0.00 0.00 41.12 40.84 1hv4 n ASP 75 CO 0.00 0.00 0.00 0.40 -0.82 0.00 0.00 177.20 176.78 1hv4 h ILE 76 N 1.60 0.74 0.78 5.18 2.04 -1.79 0.09 117.51 126.16 1hv4 h ILE 76 Ca 0.04 -0.25 -0.03 0.00 1.00 0.00 0.00 64.86 65.61 1hv4 h ILE 76 Cb 1.01 -0.05 -0.00 0.00 -0.74 0.00 0.00 36.82 37.03 1hv4 h ILE 76 CO 0.39 0.13 -0.49 0.00 0.00 0.00 0.00 178.15 178.18 1hv4 h ALA 77 N 1.60 -1.27 -0.43 1.87 0.00 -1.93 0.18 119.26 119.27 1hv4 h ALA 77 Ca 0.52 -0.25 0.08 0.00 0.00 0.00 0.00 54.91 55.26 1hv4 h ALA 77 Cb 0.74 0.62 -0.07 0.00 0.00 0.00 0.00 17.79 19.07 1hv4 h ALA 77 CO -0.36 -1.23 -0.04 0.78 0.00 0.00 0.00 179.25 178.39 1hv4 h GLY 78 N -1.20 0.39 0.94 0.00 0.00 -1.81 0.65 103.07 102.05 1hv4 h GLY 78 Ca -0.11 0.09 0.12 0.00 0.00 0.00 0.00 47.33 47.43 1hv4 h GLY 78 CO 0.10 -0.13 0.42 0.00 0.00 0.00 0.00 176.54 176.92 1hv4 h ALA 79 N 1.40 2.12 -0.01 3.60 0.00 -0.75 -2.85 119.26 122.78 1hv4 h ALA 79 Ca 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1hv4 h ALA 79 Cb 0.32 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1hv4 h ALA 79 CO -0.39 -0.28 0.00 1.28 0.00 0.00 0.00 179.25 179.86 1hv4 n LEU 80 N -4.46 2.26 -0.29 0.00 4.77 0.03 -4.77 117.00 114.55 1hv4 n LEU 80 Ca 0.11 -2.70 0.09 0.00 -0.03 0.00 0.00 56.01 53.48 1hv4 n LEU 80 Cb 0.45 -0.28 0.25 0.00 -2.33 0.00 0.00 43.42 41.50 1hv4 n LEU 80 CO 0.34 0.64 1.05 0.77 -1.33 0.00 0.00 177.39 178.86 1hv4 h SER 81 N 0.05 0.37 -0.07 -1.43 4.64 0.49 0.95 113.55 118.56 1hv4 h SER 81 Ca 0.00 0.12 -0.04 0.00 -0.47 0.00 0.00 61.79 61.40 1hv4 h SER 81 Cb 0.83 0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.99 1hv4 h SER 81 CO 0.00 0.10 -0.06 0.50 -0.87 0.00 0.00 176.83 176.50 1hv4 h LYS 82 N 0.48 0.31 0.00 4.77 3.11 -1.85 -2.75 116.57 120.64 1hv4 h LYS 82 Ca 0.49 -0.06 -0.08 0.00 -2.81 0.00 0.00 60.65 58.19 1hv4 h LYS 82 Cb 0.80 -0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 31.98 1hv4 h LYS 82 CO -0.44 0.39 -0.54 -0.07 -2.81 0.00 0.00 179.45 175.98 1hv4 h LEU 83 N 0.30 0.00 -0.68 5.20 3.38 -1.21 -3.09 115.31 119.22 1hv4 h LEU 83 Ca 0.07 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.94 1hv4 h LEU 83 Cb 0.31 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1hv4 h LEU 83 CO 0.01 0.33 -0.47 0.77 0.09 0.00 0.00 178.44 179.17 1hv4 h SER 84 N 0.00 0.00 0.41 -0.43 4.64 -0.98 -0.73 113.55 116.46 1hv4 h SER 84 Ca -0.02 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.28 1hv4 h SER 84 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1hv4 h SER 84 CO 0.04 0.47 -0.20 0.44 -0.87 0.00 0.00 176.83 176.71 1hv4 h ASP 85 N 0.00 -0.47 -0.10 4.97 3.45 -1.51 -0.11 116.42 122.66 1hv4 h ASP 85 Ca -0.00 -0.11 0.04 0.00 0.43 0.00 0.00 57.03 57.39 1hv4 h ASP 85 Cb 1.07 0.12 -0.05 0.00 -0.56 0.00 0.00 39.33 39.91 1hv4 h ASP 85 CO 0.06 -0.12 -0.23 0.25 -1.57 0.00 0.00 179.24 177.63 1hv4 h LEU 86 N -0.84 -0.70 -0.53 1.55 6.46 -1.44 0.02 115.31 119.82 1hv4 h LEU 86 Ca -0.06 0.11 -0.07 0.00 -0.12 0.00 0.00 57.88 57.74 1hv4 h LEU 86 Cb 0.55 0.31 -0.01 0.00 -0.73 0.00 0.00 40.66 40.78 1hv4 h LEU 86 CO 0.09 -0.28 -0.35 0.45 -0.62 0.00 0.00 178.44 177.73 1hv4 h HIS 87 N -0.31 0.00 0.00 1.25 3.86 -1.18 -0.54 115.15 118.23 1hv4 h HIS 87 Ca 0.09 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.30 1hv4 h HIS 87 Cb 0.44 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.91 1hv4 h HIS 87 CO -0.32 0.35 0.00 0.00 0.86 0.00 0.00 177.93 178.82 1hv4 n ALA 88 N -2.22 0.00 -0.15 2.45 0.00 -0.05 -0.94 120.51 119.59 1hv4 n ALA 88 Ca 0.01 -0.19 -0.08 0.00 0.00 0.00 0.00 53.44 53.17 1hv4 n ALA 88 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.03 1hv4 n ALA 88 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1hv4 h GLN 89 N 0.00 0.65 0.00 0.00 1.08 -1.12 -2.94 115.11 112.77 1hv4 h GLN 89 Ca 0.00 -0.11 0.00 0.00 -1.45 0.00 0.00 58.65 57.09 1hv4 h GLN 89 Cb 0.00 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 27.32 1hv4 h GLN 89 CO 0.00 0.57 0.00 1.17 -0.95 0.00 0.00 178.83 179.62 1hv4 n LYS 90 N -4.63 0.00 0.24 1.46 3.00 -0.92 -4.52 118.16 112.79 1hv4 n LYS 90 Ca 0.01 0.39 0.13 0.00 -0.00 0.00 0.00 58.31 58.84 1hv4 n LYS 90 Cb 0.13 -0.89 0.50 0.00 0.00 0.00 0.00 35.03 34.77 1hv4 n LYS 90 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 1hv4 h LEU 91 N 0.00 0.00 -3.02 3.14 3.38 -1.29 -3.48 115.31 114.04 1hv4 h LEU 91 Ca 0.00 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.57 1hv4 h LEU 91 Cb 0.00 0.00 0.10 0.00 0.09 0.00 0.00 40.66 40.85 1hv4 h LEU 91 CO 0.00 0.12 -0.92 0.54 0.09 0.00 0.00 178.44 178.26 1hv4 n ARG 92 N -3.23 -1.55 -2.42 1.13 5.12 -1.11 -4.89 116.66 109.71 1hv4 n ARG 92 Ca 0.01 0.53 -0.42 0.00 -1.93 0.00 0.00 57.85 56.04 1hv4 n ARG 92 Cb 0.40 -4.45 -0.03 0.00 -1.16 0.00 0.00 32.46 27.22 1hv4 n ARG 92 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1hv4 s VAL 93 N -3.47 4.07 0.03 1.55 1.01 -0.12 -4.95 120.40 118.52 1hv4 s VAL 93 Ca 0.45 1.47 -0.30 0.00 0.00 0.00 0.00 61.98 63.60 1hv4 s VAL 93 Cb -0.14 -3.94 -0.08 0.00 0.00 0.00 0.00 36.38 32.21 1hv4 s VAL 93 CO 0.84 0.10 1.75 -0.62 0.00 0.00 0.00 175.10 177.17 1hv4 s ASP 94 N 1.14 6.56 0.64 3.32 -1.08 -1.26 -4.84 116.67 121.16 1hv4 s ASP 94 Ca 0.58 2.49 0.23 0.00 -0.52 0.00 0.00 52.55 55.33 1hv4 s ASP 94 Cb -0.29 -2.55 1.17 0.00 -1.46 0.00 0.00 42.92 39.80 1hv4 s ASP 94 CO 0.28 -0.95 1.65 1.55 0.52 0.00 0.00 175.17 178.22 1hv4 h PRO 95 N 9.32 0.00 -0.13 4.34 0.13 -1.97 -0.96 132.00 142.73 1hv4 h PRO 95 Ca -0.44 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.61 1hv4 h PRO 95 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 1hv4 h PRO 95 CO 0.94 0.00 -0.29 -0.24 -0.23 0.00 0.00 178.00 178.18 1hv4 h VAL 96 N 0.00 1.26 0.00 1.56 3.04 -2.01 -2.97 116.25 117.13 1hv4 h VAL 96 Ca 0.09 -1.23 -0.05 0.00 -1.01 0.00 0.00 66.70 64.50 1hv4 h VAL 96 Cb 1.29 1.49 -0.01 0.00 -2.01 0.00 0.00 31.29 32.04 1hv4 h VAL 96 CO -0.00 0.37 -0.24 0.78 -1.01 0.00 0.00 177.57 177.48 1hv4 h ASN 97 N 0.23 0.00 0.14 3.17 4.21 -1.55 -2.57 115.58 119.21 1hv4 h ASN 97 Ca 0.03 0.00 -0.02 0.00 1.21 0.00 0.00 56.30 57.52 1hv4 h ASN 97 Cb 0.64 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.84 1hv4 h ASN 97 CO 0.05 0.24 -0.11 -0.26 -1.29 0.00 0.00 177.43 176.05 1hv4 h PHE 98 N 0.00 0.00 0.25 1.19 0.04 -1.67 -2.05 116.94 114.69 1hv4 h PHE 98 Ca -0.00 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 1hv4 h PHE 98 Cb 0.65 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.80 1hv4 h PHE 98 CO 0.00 0.11 -0.12 0.87 -0.60 0.00 0.00 178.31 178.57 1hv4 h LYS 99 N 0.00 -0.32 -0.73 1.51 1.57 -1.60 -2.37 116.57 114.63 1hv4 h LYS 99 Ca -0.00 0.02 0.16 0.00 -1.87 0.00 0.00 60.65 58.96 1hv4 h LYS 99 Cb 0.21 0.07 -0.11 0.00 0.08 0.00 0.00 32.23 32.48 1hv4 h LYS 99 CO 0.01 -0.03 0.16 0.74 -0.57 0.00 0.00 179.45 179.77 1hv4 h PHE 100 N -0.62 0.24 -0.48 -1.35 0.05 -1.46 -1.21 116.94 112.12 1hv4 h PHE 100 Ca -0.03 0.04 -0.10 0.00 3.82 0.00 0.00 57.97 61.70 1hv4 h PHE 100 Cb 0.44 0.01 -0.02 0.00 2.00 0.00 0.00 35.95 38.38 1hv4 h PHE 100 CO 0.01 -0.10 -0.08 1.25 -0.18 0.00 0.00 178.31 179.21 1hv4 h LEU 101 N 0.25 0.90 -1.02 1.54 6.46 -1.39 -2.14 115.31 119.90 1hv4 h LEU 101 Ca 0.41 -0.35 -0.07 0.00 -0.12 0.00 0.00 57.88 57.76 1hv4 h LEU 101 Cb 0.71 -0.24 -0.02 0.00 -0.73 0.00 0.00 40.66 40.38 1hv4 h LEU 101 CO -0.52 1.04 -0.02 1.23 -0.62 0.00 0.00 178.44 179.55 1hv4 h GLY 102 N 0.75 0.73 0.94 3.75 0.00 -0.85 -1.71 103.07 106.68 1hv4 h GLY 102 Ca 0.12 -0.48 -0.01 0.00 0.00 0.00 0.00 47.33 46.97 1hv4 h GLY 102 CO 0.04 0.44 -0.12 0.84 0.00 0.00 0.00 176.54 177.74 1hv4 h HIS 103 N 0.64 -0.31 -0.93 5.60 -0.00 -1.06 -1.83 115.15 117.27 1hv4 h HIS 103 Ca 0.13 -0.01 0.02 0.00 -0.00 0.00 0.00 60.37 60.51 1hv4 h HIS 103 Cb 0.42 0.10 -0.05 0.00 -0.00 0.00 0.00 27.41 27.89 1hv4 h HIS 103 CO 0.02 -0.15 0.61 0.00 -0.00 0.00 0.00 177.93 178.41 1hv4 h PHE 105 N 1.23 0.21 -0.73 0.00 3.04 -0.96 -0.19 116.94 119.54 1hv4 h PHE 105 Ca 0.35 0.02 -0.02 0.00 3.98 0.00 0.00 57.97 62.30 1hv4 h PHE 105 Cb -0.11 -0.03 -0.04 0.00 2.56 0.00 0.00 35.95 38.33 1hv4 h PHE 105 CO -0.01 0.06 0.39 -0.07 -2.02 0.00 0.00 178.31 176.66 1hv4 h LEU 106 N 0.28 0.91 -0.71 0.59 3.38 -0.87 -1.49 115.31 117.39 1hv4 h LEU 106 Ca 0.20 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1hv4 h LEU 106 Cb 0.22 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1hv4 h LEU 106 CO -0.23 0.74 0.41 0.58 0.09 0.00 0.00 178.44 180.03 1hv4 h VAL 107 N 1.02 1.21 -0.17 1.22 2.07 -0.29 -0.59 116.25 120.72 1hv4 h VAL 107 Ca 0.26 -0.49 -0.01 0.00 0.82 0.00 0.00 66.70 67.28 1hv4 h VAL 107 Cb 0.04 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.05 1hv4 h VAL 107 CO -0.04 0.22 0.08 0.58 0.02 0.00 0.00 177.57 178.43 1hv4 h VAL 108 N 0.97 1.14 -0.65 2.57 2.07 -0.40 -1.88 116.25 120.08 1hv4 h VAL 108 Ca 0.25 -0.43 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 1hv4 h VAL 108 Cb -0.01 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 1hv4 h VAL 108 CO -0.04 0.14 0.39 0.58 0.02 0.00 0.00 177.57 178.65 1hv4 h VAL 109 N 0.14 1.19 -0.64 2.57 2.07 -1.13 -2.44 116.25 118.01 1hv4 h VAL 109 Ca 0.06 -0.42 0.07 0.00 0.82 0.00 0.00 66.70 67.22 1hv4 h VAL 109 Cb 0.15 0.30 -0.06 0.00 -1.52 0.00 0.00 31.29 30.16 1hv4 h VAL 109 CO -0.01 0.20 0.33 0.00 0.02 0.00 0.00 177.57 178.11 1hv4 h ALA 110 N 1.20 0.85 -0.50 1.67 0.00 -0.84 0.29 119.26 121.93 1hv4 h ALA 110 Ca 0.23 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.09 1hv4 h ALA 110 Cb -0.02 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1hv4 h ALA 110 CO -0.04 -0.03 -0.03 0.82 0.00 0.00 0.00 179.25 179.97 1hv4 h ILE 111 N 0.60 1.25 0.00 0.00 2.04 -0.95 -2.96 117.51 117.49 1hv4 h ILE 111 Ca 0.30 -1.09 -0.25 0.00 1.00 0.00 0.00 64.86 64.81 1hv4 h ILE 111 Cb 0.24 0.90 -0.05 0.00 -0.74 0.00 0.00 36.82 37.17 1hv4 h ILE 111 CO -0.21 0.39 -2.03 1.41 0.00 0.00 0.00 178.15 177.71 1hv4 n HIS 112 N -4.19 0.34 -2.92 1.37 8.25 -0.96 -4.65 115.22 112.46 1hv4 n HIS 112 Ca 0.02 0.12 -0.14 0.00 -0.26 0.00 0.00 57.72 57.46 1hv4 n HIS 112 Cb 0.33 -0.96 -0.00 0.00 1.12 0.00 0.00 29.99 30.48 1hv4 n HIS 112 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1hv4 n HIS 113 N -2.74 0.84 0.04 4.41 8.25 0.98 -4.94 115.22 122.06 1hv4 n HIS 113 Ca -0.21 -3.34 0.22 0.00 -0.26 0.00 0.00 57.72 54.13 1hv4 n HIS 113 Cb 0.98 -0.39 0.66 0.00 1.12 0.00 0.00 29.99 32.36 1hv4 n HIS 113 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1hv4 h PRO 114 N 2.99 0.00 0.00 -0.41 0.13 -1.60 0.59 132.00 133.70 1hv4 h PRO 114 Ca 0.02 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.91 1hv4 h PRO 114 Cb 1.05 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.14 1hv4 h PRO 114 CO 0.52 0.00 -1.25 0.66 -0.23 0.00 0.00 178.00 177.70 1hv4 h SER 115 N 0.00 0.00 1.53 1.44 4.64 -1.92 -3.27 113.55 115.97 1hv4 h SER 115 Ca 0.25 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.56 1hv4 h SER 115 Cb 1.54 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.63 1hv4 h SER 115 CO -0.00 0.96 -0.05 0.00 -0.87 0.00 0.00 176.83 176.87 1hv4 h ALA 116 N 1.04 0.98 -1.22 5.18 0.00 -0.20 -3.34 119.26 121.70 1hv4 h ALA 116 Ca -0.11 -0.05 -0.79 0.00 0.00 0.00 0.00 54.91 53.95 1hv4 h ALA 116 Cb 1.84 -0.01 -0.28 0.00 0.00 0.00 0.00 17.79 19.34 1hv4 h ALA 116 CO 0.11 0.07 0.99 -0.11 0.00 0.00 0.00 179.25 180.30 1hv4 n LEU 117 N -3.13 7.32 -4.74 0.00 7.94 -0.92 -4.77 117.00 118.70 1hv4 n LEU 117 Ca 0.02 -5.26 -0.32 0.00 -1.11 0.00 0.00 56.01 49.34 1hv4 n LEU 117 Cb 0.46 -1.12 0.10 0.00 0.53 0.00 0.00 43.42 43.39 1hv4 n LEU 117 CO 0.32 1.99 0.71 0.42 -1.11 0.00 0.00 177.39 179.72 1hv4 s THR 118 N -4.53 2.86 0.49 1.96 -4.23 -1.25 -4.67 115.64 106.26 1hv4 s THR 118 Ca 0.42 0.31 0.24 0.00 -1.18 0.00 0.00 61.69 61.49 1hv4 s THR 118 Cb 0.25 -2.69 0.42 0.00 1.34 0.00 0.00 72.50 71.82 1hv4 s THR 118 CO -0.20 -0.33 1.91 0.00 -0.54 0.00 0.00 174.62 175.46 1hv4 h ALA 119 N -1.05 2.50 0.03 3.99 0.00 -1.96 -0.68 119.26 122.09 1hv4 h ALA 119 Ca -0.44 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.45 1hv4 h ALA 119 Cb 1.25 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1hv4 h ALA 119 CO 0.49 -0.73 -0.02 1.49 0.00 0.00 0.00 179.25 180.48 1hv4 h GLU 120 N 0.16 -0.04 -0.45 0.00 4.81 -1.99 -2.56 114.58 114.50 1hv4 h GLU 120 Ca 0.39 0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.64 1hv4 h GLU 120 Cb 1.29 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.65 1hv4 h GLU 120 CO -0.07 0.32 0.27 0.28 -0.73 0.00 0.00 179.01 179.08 1hv4 h VAL 121 N -0.41 1.05 -0.97 0.32 2.07 -1.65 -1.93 116.25 114.72 1hv4 h VAL 121 Ca -0.00 -0.19 0.29 0.00 0.82 0.00 0.00 66.70 67.62 1hv4 h VAL 121 Cb 0.38 0.46 -0.14 0.00 -1.52 0.00 0.00 31.29 30.47 1hv4 h VAL 121 CO 0.01 0.10 0.49 -0.74 0.02 0.00 0.00 177.57 177.45 1hv4 h HIS 122 N 0.54 0.79 -0.08 1.57 -0.00 -1.00 0.63 115.15 117.61 1hv4 h HIS 122 Ca 0.18 0.04 -0.21 0.00 -0.00 0.00 0.00 60.37 60.38 1hv4 h HIS 122 Cb 0.00 -0.19 0.01 0.00 -0.00 0.00 0.00 27.41 27.23 1hv4 h HIS 122 CO -0.07 -0.16 -0.78 0.00 -0.00 0.00 0.00 177.93 176.92 1hv4 h ALA 123 N 1.82 0.20 -0.81 5.26 0.00 -0.95 -2.23 119.26 122.55 1hv4 h ALA 123 Ca 0.68 -0.61 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1hv4 h ALA 123 Cb 1.49 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 19.26 1hv4 h ALA 123 CO -0.61 0.58 0.33 0.77 0.00 0.00 0.00 179.25 180.32 1hv4 h SER 124 N 0.33 1.11 -0.46 0.00 0.02 0.23 -2.03 113.55 112.74 1hv4 h SER 124 Ca -0.08 -0.17 -0.07 0.00 -0.84 0.00 0.00 61.79 60.63 1hv4 h SER 124 Cb 1.43 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 63.66 1hv4 h SER 124 CO 0.16 0.97 0.03 -0.07 -1.14 0.00 0.00 176.83 176.78 1hv4 h LEU 125 N 1.17 0.82 -0.72 5.07 3.38 0.02 -2.18 115.31 122.88 1hv4 h LEU 125 Ca 0.27 -0.20 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 1hv4 h LEU 125 Cb 0.21 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1hv4 h LEU 125 CO -0.02 0.87 0.04 -0.78 0.09 0.00 0.00 178.44 178.64 1hv4 h ASP 126 N 0.80 0.99 0.35 -0.43 1.82 -0.81 -1.19 116.42 117.95 1hv4 h ASP 126 Ca 0.16 -0.25 -0.12 0.00 -0.39 0.00 0.00 57.03 56.42 1hv4 h ASP 126 Cb 0.44 -0.26 -0.01 0.00 0.68 0.00 0.00 39.33 40.18 1hv4 h ASP 126 CO 0.02 1.02 -0.52 0.11 -1.61 0.00 0.00 179.24 178.26 1hv4 h LYS 127 N 0.95 0.18 0.05 0.28 1.57 -1.25 -2.12 116.57 116.24 1hv4 h LYS 127 Ca 0.18 -0.11 -0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1hv4 h LYS 127 Cb 0.49 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.81 1hv4 h LYS 127 CO 0.02 0.66 -0.02 0.35 -0.57 0.00 0.00 179.45 179.89 1hv4 h PHE 128 N 0.15 -0.06 -0.76 -1.35 3.57 -0.91 -1.73 116.94 115.85 1hv4 h PHE 128 Ca 0.00 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.45 1hv4 h PHE 128 Cb 0.96 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.69 1hv4 h PHE 128 CO 0.01 0.16 0.26 -0.07 -2.23 0.00 0.00 178.31 176.44 1hv4 h LEU 129 N -0.29 1.09 -0.89 0.59 3.38 -1.17 0.12 115.31 118.14 1hv4 h LEU 129 Ca -0.01 -0.20 -0.08 0.00 0.09 0.00 0.00 57.88 57.69 1hv4 h LEU 129 Cb 0.26 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1hv4 h LEU 129 CO 0.01 1.00 -0.01 0.00 0.09 0.00 0.00 178.44 179.53 1hv4 h ALA 131 N 1.23 -0.02 0.51 0.00 0.00 -0.73 0.11 119.26 120.36 1hv4 h ALA 131 Ca 0.15 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1hv4 h ALA 131 Cb 0.47 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1hv4 h ALA 131 CO 0.02 -0.44 -0.33 0.28 0.00 0.00 0.00 179.25 178.79 1hv4 h VAL 132 N -0.18 0.33 -0.51 0.00 2.07 -0.48 -2.14 116.25 115.35 1hv4 h VAL 132 Ca -0.00 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.61 1hv4 h VAL 132 Cb 0.17 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.25 1hv4 h VAL 132 CO 0.00 0.00 0.34 1.23 0.02 0.00 0.00 177.57 179.17 1hv4 h GLY 133 N -0.80 0.40 0.81 2.17 0.00 -0.61 -0.41 103.07 104.64 1hv4 h GLY 133 Ca -0.06 -0.12 -0.04 0.00 0.00 0.00 0.00 47.33 47.11 1hv4 h GLY 133 CO 0.05 0.08 -0.39 -0.84 0.00 0.00 0.00 176.54 175.44 1hv4 h THR 134 N 0.29 0.00 -0.88 4.70 2.02 -0.34 -2.94 112.91 115.76 1hv4 h THR 134 Ca 0.23 -0.03 0.18 0.00 0.77 0.00 0.00 66.41 67.56 1hv4 h THR 134 Cb 0.54 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 66.84 1hv4 h THR 134 CO -0.05 0.00 0.43 0.58 0.37 0.00 0.00 175.52 176.85 1hv4 h VAL 135 N -1.12 0.61 0.00 3.16 2.07 -0.76 3.91 116.25 124.12 1hv4 h VAL 135 Ca -0.11 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1hv4 h VAL 135 Cb 0.83 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1hv4 h VAL 135 CO 0.18 0.10 0.00 0.18 0.02 0.00 0.00 177.57 178.05 1hv4 n LEU 136 N -4.95 0.00 0.00 2.57 7.99 -0.22 -2.42 117.00 119.97 1hv4 n LEU 136 Ca 0.20 0.45 0.00 0.00 -0.01 0.00 0.00 56.01 56.65 1hv4 n LEU 136 Cb 0.55 -0.45 0.00 0.00 -0.11 0.00 0.00 43.42 43.40 1hv4 n LEU 136 CO 0.17 -0.28 -0.27 0.35 -1.51 0.00 0.00 177.39 175.86 1hv4 n THR 137 N -1.45 0.00 0.21 -5.08 -2.24 -0.70 -3.62 114.28 101.38 1hv4 n THR 137 Ca 0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 1hv4 n THR 137 Cb 0.12 -0.16 0.00 0.00 -2.10 0.00 0.00 70.33 68.19 1hv4 n THR 137 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hv4 n ALA 138 N -1.07 0.00 -0.65 6.98 0.00 1.28 -2.31 120.51 124.73 1hv4 n ALA 138 Ca 0.00 0.00 0.50 0.00 0.00 0.00 0.00 53.44 53.94 1hv4 n ALA 138 Cb 0.14 0.00 0.78 0.00 0.00 0.00 0.00 19.45 20.37 1hv4 n ALA 138 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1hv4 n LYS 139 N -1.83 -0.01 0.00 0.00 3.00 -1.26 0.46 118.16 118.52 1hv4 n LYS 139 Ca 0.00 1.08 0.00 0.00 -0.00 0.00 0.00 58.31 59.39 1hv4 n LYS 139 Cb 0.73 -2.43 0.00 0.00 0.00 0.00 0.00 35.03 33.33 1hv4 n LYS 139 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1hv4 n TYR 140 N -4.00 0.00 -1.48 5.64 0.53 -0.98 -5.16 117.16 111.71 1hv4 n TYR 140 Ca 0.43 -0.03 0.00 0.00 -1.02 0.00 0.00 57.90 57.28 1hv4 n TYR 140 Cb 1.89 -0.10 0.00 0.00 -1.03 0.00 0.00 39.34 40.10 1hv4 n TYR 140 CO 0.00 0.00 0.00 0.54 -1.02 0.00 0.00 176.86 176.38