#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hov n LYS 70 N 0.00 -1.57 -0.12 3.23 4.76 -1.26 -4.61 118.16 118.58 3hov n LYS 70 Ca 0.00 0.76 0.10 0.00 -2.87 0.00 0.00 58.31 56.29 3hov n LYS 70 Cb 0.00 -5.07 0.15 0.00 -1.84 0.00 0.00 35.03 28.27 3hov n LYS 70 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 3hov n GLU 71 N -0.75 2.11 0.00 1.97 1.02 -1.26 -3.56 120.64 120.17 3hov n GLU 71 Ca -0.08 -1.96 0.08 0.00 -0.02 0.00 0.00 57.16 55.18 3hov n GLU 71 Cb 0.52 -1.40 0.04 0.00 -0.02 0.00 0.00 31.44 30.58 3hov n GLU 71 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 3hov n LYS 72 N 1.14 1.46 -2.95 3.49 2.85 -1.26 -4.88 118.16 118.01 3hov n LYS 72 Ca 0.15 -1.21 -0.43 0.00 -1.05 0.00 0.00 58.31 55.76 3hov n LYS 72 Cb 0.51 -1.30 -0.05 0.00 -0.65 0.00 0.00 35.03 33.54 3hov n LYS 72 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3hov s ALA 73 N -1.57 3.23 0.01 0.58 0.00 -1.23 -0.88 121.76 121.90 3hov s ALA 73 Ca 0.17 -1.56 -0.30 0.00 0.00 0.00 0.00 51.96 50.26 3hov s ALA 73 Cb 0.13 -3.63 -0.05 0.00 0.00 0.00 0.00 23.12 19.57 3hov s ALA 73 CO 0.28 -2.34 1.33 0.42 0.00 0.00 0.00 175.76 175.45 3hov s ILE 74 N 3.49 3.82 0.47 0.00 1.01 -0.74 -4.97 121.20 124.29 3hov s ILE 74 Ca 0.23 1.23 -0.23 0.00 0.00 0.00 0.00 60.65 61.88 3hov s ILE 74 Cb -0.16 -3.79 -0.09 0.00 0.01 0.00 0.00 42.46 38.43 3hov s ILE 74 CO 0.15 0.02 1.01 -0.81 0.00 0.00 0.00 174.94 175.31 3hov n PRO 75 N 4.96 1.28 -0.38 2.79 -0.04 -1.26 -4.67 135.00 137.68 3hov n PRO 75 Ca 0.12 0.47 0.35 0.00 -0.04 0.00 0.00 63.50 64.40 3hov n PRO 75 Cb 0.44 -2.11 0.70 0.00 -0.04 0.00 0.00 33.50 32.50 3hov n PRO 75 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 3hov h LYS 76 N 1.29 0.08 -6.09 0.54 1.63 -1.94 -3.27 116.57 108.81 3hov h LYS 76 Ca -0.46 -0.00 -0.60 0.00 -0.85 0.00 0.00 60.65 58.74 3hov h LYS 76 Cb 1.34 -0.02 -0.05 0.00 -0.60 0.00 0.00 32.23 32.90 3hov h LYS 76 CO 0.55 0.05 -0.19 0.34 -3.45 0.00 0.00 179.45 176.76 3hov s ASP 77 N -4.96 6.79 0.00 4.20 2.15 -1.26 -3.92 116.67 119.66 3hov s ASP 77 Ca -0.06 0.96 0.00 0.00 0.43 0.00 0.00 52.55 53.88 3hov s ASP 77 Cb 0.25 -2.25 0.00 0.00 -0.30 0.00 0.00 42.92 40.62 3hov s ASP 77 CO 0.82 0.26 0.00 0.00 -0.17 0.00 0.00 175.17 176.07 3hov n GLN 78 N 1.46 0.00 -1.60 4.34 6.02 -1.25 -5.05 117.38 121.30 3hov n GLN 78 Ca -0.11 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.46 3hov n GLN 78 Cb 0.52 -0.19 0.01 0.00 1.02 0.00 0.00 30.24 31.60 3hov n GLN 78 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3hov n ARG 79 N -2.00 1.33 0.00 -1.09 1.74 -1.23 -4.89 116.66 110.52 3hov n ARG 79 Ca 0.00 0.47 0.00 0.00 -0.77 0.00 0.00 57.85 57.55 3hov n ARG 79 Cb 0.00 -1.98 0.00 0.00 -1.02 0.00 0.00 32.46 29.46 3hov n ARG 79 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3hov n ALA 80 N -0.34 1.92 -0.52 7.54 0.00 -1.26 -5.06 120.51 122.78 3hov n ALA 80 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.24 3hov n ALA 80 Cb 0.38 0.00 0.24 0.00 0.00 0.00 0.00 19.45 20.07 3hov n ALA 80 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3hov n THR 81 N -1.25 0.00 -1.66 0.00 -2.24 -1.26 -4.92 114.28 102.96 3hov n THR 81 Ca 0.00 -0.42 -0.36 0.00 -2.27 0.00 0.00 64.05 61.00 3hov n THR 81 Cb 0.00 -0.92 0.07 0.00 -2.10 0.00 0.00 70.33 67.39 3hov n THR 81 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3hov s THR 82 N -2.37 2.16 -0.19 4.28 -1.32 -1.26 -4.91 115.64 112.03 3hov s THR 82 Ca 0.66 0.09 0.16 0.00 -1.21 0.00 0.00 61.69 61.39 3hov s THR 82 Cb -0.23 -2.91 0.09 0.00 -1.51 0.00 0.00 72.50 67.94 3hov s THR 82 CO 0.65 -0.03 1.44 -0.65 -2.21 0.00 0.00 174.62 173.83 3hov h PRO 83 N 0.28 0.00 -7.01 7.08 0.11 -1.98 -3.46 132.00 127.02 3hov h PRO 83 Ca -0.50 0.00 -0.49 0.00 0.11 0.00 0.00 66.00 65.13 3hov h PRO 83 Cb 1.32 0.00 0.04 0.00 0.11 0.00 0.00 31.00 32.47 3hov h PRO 83 CO 0.52 0.44 0.14 0.71 -0.21 0.00 0.00 178.00 179.60 3hov s TYR 84 N -2.99 3.45 -0.16 0.65 1.51 -1.26 -1.92 117.35 116.64 3hov s TYR 84 Ca 0.04 0.76 -0.15 0.00 -1.01 0.00 0.00 57.07 56.72 3hov s TYR 84 Cb 0.07 -2.47 -0.04 0.00 -0.11 0.00 0.00 41.96 39.41 3hov s TYR 84 CO 0.74 -0.49 0.33 1.41 -1.11 0.00 0.00 175.55 176.43 3hov s MET 85 N -4.84 4.27 0.75 -0.62 -2.45 -0.55 -4.75 119.30 111.10 3hov s MET 85 Ca 0.50 0.16 -0.12 0.00 -1.25 0.00 0.00 55.69 54.98 3hov s MET 85 Cb -0.10 -3.44 0.05 0.00 1.25 0.00 0.00 34.83 32.58 3hov s MET 85 CO 0.45 0.20 1.11 0.95 1.05 0.00 0.00 175.02 178.78 3hov s THR 86 N 0.57 3.14 0.19 10.11 -4.23 -1.26 -4.79 115.64 119.37 3hov s THR 86 Ca 0.18 0.43 -0.12 0.00 -1.18 0.00 0.00 61.69 61.00 3hov s THR 86 Cb -0.13 -2.89 0.10 0.00 1.34 0.00 0.00 72.50 70.92 3hov s THR 86 CO 0.05 -0.43 1.82 0.07 -0.54 0.00 0.00 174.62 175.60 3hov h LYS 87 N -0.79 0.67 -0.30 3.99 2.10 -1.99 -1.29 116.57 118.96 3hov h LYS 87 Ca -0.45 -0.04 0.02 0.00 -2.00 0.00 0.00 60.65 58.18 3hov h LYS 87 Cb 1.24 -0.15 -0.02 0.00 -0.90 0.00 0.00 32.23 32.40 3hov h LYS 87 CO 0.51 0.44 0.16 1.88 -2.00 0.00 0.00 179.45 180.44 3hov h TYR 88 N 0.69 0.29 0.35 0.07 -1.99 -1.98 0.27 116.97 114.67 3hov h TYR 88 Ca 0.25 0.01 -0.01 0.00 2.00 0.00 0.00 58.73 60.98 3hov h TYR 88 Cb 0.05 -0.09 -0.02 0.00 2.00 0.00 0.00 36.73 38.68 3hov h TYR 88 CO -0.06 0.16 -0.39 0.93 -0.00 0.00 0.00 178.16 178.81 3hov h GLU 89 N 0.33 -0.71 -0.57 4.88 5.08 -1.70 -0.34 114.58 121.54 3hov h GLU 89 Ca 0.12 0.05 0.03 0.00 -1.00 0.00 0.00 59.36 58.56 3hov h GLU 89 Cb 0.03 0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 3hov h GLU 89 CO -0.08 -0.48 0.38 0.07 -1.00 0.00 0.00 179.01 177.90 3hov h ARG 90 N -0.74 0.67 -0.37 2.33 0.11 -1.12 0.43 114.38 115.69 3hov h ARG 90 Ca -0.04 -0.04 0.01 0.00 0.10 0.00 0.00 59.98 60.01 3hov h ARG 90 Cb 0.65 -0.15 -0.02 0.00 1.11 0.00 0.00 29.97 31.56 3hov h ARG 90 CO -0.07 0.45 0.21 0.00 0.10 0.00 0.00 179.97 180.66 3hov h ALA 91 N 1.66 0.46 -0.12 0.08 0.00 -0.14 0.12 119.26 121.32 3hov h ALA 91 Ca 0.22 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.02 3hov h ALA 91 Cb 0.04 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3hov h ALA 91 CO -0.06 -0.13 -0.41 -0.09 0.00 0.00 0.00 179.25 178.57 3hov h ARG 92 N 0.44 0.25 0.15 0.00 2.43 0.67 -1.26 114.38 117.07 3hov h ARG 92 Ca 0.14 -0.12 -0.01 0.00 -0.81 0.00 0.00 59.98 59.19 3hov h ARG 92 Cb 0.00 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 3hov h ARG 92 CO -0.07 0.62 -0.07 0.82 -1.51 0.00 0.00 179.97 179.77 3hov h ILE 93 N 0.21 0.99 -0.63 1.20 5.03 0.59 -0.89 117.51 124.01 3hov h ILE 93 Ca 0.02 -0.76 0.11 0.00 -0.12 0.00 0.00 64.86 64.10 3hov h ILE 93 Cb 0.81 1.45 -0.08 0.00 -3.03 0.00 0.00 36.82 35.97 3hov h ILE 93 CO 0.06 0.18 0.21 -0.07 -0.68 0.00 0.00 178.15 177.85 3hov h LEU 94 N -0.58 0.16 0.58 1.44 3.38 -0.74 -1.01 115.31 118.54 3hov h LEU 94 Ca -0.02 0.09 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 3hov h LEU 94 Cb 0.44 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 3hov h LEU 94 CO 0.03 0.09 -0.36 1.23 0.09 0.00 0.00 178.44 179.52 3hov h GLY 95 N 0.36 -0.96 0.14 0.83 0.00 -1.12 -0.16 103.07 102.16 3hov h GLY 95 Ca 0.33 0.40 0.12 0.00 0.00 0.00 0.00 47.33 48.18 3hov h GLY 95 CO -0.35 -0.34 0.14 -0.84 0.00 0.00 0.00 176.54 175.14 3hov h THR 96 N -0.89 0.62 -0.46 4.70 2.02 -0.82 0.25 112.91 118.34 3hov h THR 96 Ca -0.07 -0.09 -0.04 0.00 0.77 0.00 0.00 66.41 66.98 3hov h THR 96 Cb 0.73 0.33 -0.02 0.00 -1.74 0.00 0.00 68.15 67.45 3hov h THR 96 CO 0.07 0.05 0.12 -0.09 0.37 0.00 0.00 175.52 176.03 3hov h ARG 97 N 0.27 0.73 -0.63 6.66 9.65 -1.04 -0.79 114.38 129.23 3hov h ARG 97 Ca 0.33 -0.17 -0.01 0.00 -1.10 0.00 0.00 59.98 59.03 3hov h ARG 97 Cb 0.50 -0.10 -0.03 0.00 -1.39 0.00 0.00 29.97 28.96 3hov h ARG 97 CO -0.42 0.72 0.36 0.00 2.80 0.00 0.00 179.97 183.43 3hov h ALA 98 N 0.98 0.80 0.15 2.80 0.00 -0.02 0.47 119.26 124.45 3hov h ALA 98 Ca 0.15 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.98 3hov h ALA 98 Cb 0.31 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 3hov h ALA 98 CO -0.00 0.30 -0.35 1.25 0.00 0.00 0.00 179.25 180.46 3hov h LEU 99 N 0.85 -1.00 -0.91 0.00 5.85 -0.10 -0.22 115.31 119.79 3hov h LEU 99 Ca 0.22 0.11 -0.03 0.00 0.84 0.00 0.00 57.88 59.02 3hov h LEU 99 Cb 0.01 0.37 -0.04 0.00 0.37 0.00 0.00 40.66 41.38 3hov h LEU 99 CO -0.04 -0.44 0.37 1.56 -0.34 0.00 0.00 178.44 179.55 3hov h GLN 100 N -0.59 1.16 -0.04 1.25 4.20 -0.76 -1.68 115.11 118.64 3hov h GLN 100 Ca 0.02 -0.17 -0.06 0.00 0.06 0.00 0.00 58.65 58.49 3hov h GLN 100 Cb 0.61 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 3hov h GLN 100 CO -0.19 0.90 -0.27 0.82 -0.67 0.00 0.00 178.83 179.42 3hov h ILE 101 N 1.14 1.21 0.00 2.54 2.04 0.29 -0.46 117.51 124.28 3hov h ILE 101 Ca 0.27 -1.02 0.00 0.00 1.00 0.00 0.00 64.86 65.12 3hov h ILE 101 Cb 0.14 1.50 0.00 0.00 -0.74 0.00 0.00 36.82 37.71 3hov h ILE 101 CO -0.03 0.30 -0.08 -1.54 0.00 0.00 0.00 178.15 176.79 3hov n SER 102 N -4.19 0.70 -0.59 1.72 3.41 -0.12 -2.48 113.62 112.07 3hov n SER 102 Ca -0.02 0.50 0.06 0.00 -0.26 0.00 0.00 58.87 59.15 3hov n SER 102 Cb 0.34 -0.64 0.17 0.00 -0.26 0.00 0.00 64.21 63.82 3hov n SER 102 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3hov n MET 103 N -2.14 1.74 -2.03 4.33 2.81 -0.30 -4.87 117.12 116.66 3hov n MET 103 Ca 0.05 -1.15 -0.07 0.00 -1.81 0.00 0.00 57.70 54.73 3hov n MET 103 Cb 0.42 -1.26 -0.01 0.00 -0.71 0.00 0.00 33.22 31.66 3hov n MET 103 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 3hov n ASN 104 N 0.43 -2.79 -4.83 7.83 3.02 -1.04 -5.03 115.26 112.85 3hov n ASN 104 Ca 0.11 0.01 -0.29 0.00 -0.03 0.00 0.00 54.58 54.38 3hov n ASN 104 Cb 0.28 -1.99 0.10 0.00 -0.61 0.00 0.00 39.78 37.55 3hov n ASN 104 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hov s ALA 105 N -2.34 2.27 0.36 5.41 0.00 -0.51 -5.00 121.76 121.94 3hov s ALA 105 Ca 0.00 -0.43 -0.27 0.00 0.00 0.00 0.00 51.96 51.26 3hov s ALA 105 Cb 0.00 -3.04 -0.09 0.00 0.00 0.00 0.00 23.12 19.99 3hov s ALA 105 CO 0.00 -1.82 1.24 -2.14 0.00 0.00 0.00 175.76 173.04 3hov s PRO 106 N -5.32 4.23 -0.13 0.00 0.02 -1.26 -4.75 135.00 127.78 3hov s PRO 106 Ca 0.62 2.05 -0.03 0.00 0.02 0.00 0.00 61.00 63.66 3hov s PRO 106 Cb -0.13 -2.91 -0.03 0.00 0.02 0.00 0.00 34.50 31.44 3hov s PRO 106 CO 0.52 -0.24 -0.04 0.08 -0.33 0.00 0.00 177.00 177.00 3hov s VAL 107 N -1.24 3.89 -0.67 3.83 1.01 -1.26 -4.93 120.40 121.03 3hov s VAL 107 Ca 0.52 -0.37 0.12 0.00 0.00 0.00 0.00 61.98 62.25 3hov s VAL 107 Cb -0.36 -2.68 0.61 0.00 0.00 0.00 0.00 36.38 33.96 3hov s VAL 107 CO 0.47 0.52 1.45 0.49 0.00 0.00 0.00 175.10 178.03 3hov n PHE 108 N 3.16 1.47 -4.22 5.22 3.01 -1.26 -4.91 117.46 119.92 3hov n PHE 108 Ca -0.18 -0.53 -0.13 0.00 1.01 0.00 0.00 57.45 57.63 3hov n PHE 108 Cb 0.53 -0.35 -0.10 0.00 -0.01 0.00 0.00 39.48 39.54 3hov n PHE 108 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 3hov s VAL 109 N -2.18 0.16 -0.18 -4.37 1.01 -1.26 -4.95 120.40 108.63 3hov s VAL 109 Ca 0.41 -1.99 -0.23 0.00 0.00 0.00 0.00 61.98 60.17 3hov s VAL 109 Cb 0.30 -2.48 -0.02 0.00 0.00 0.00 0.00 36.38 34.18 3hov s VAL 109 CO 0.14 -0.05 0.71 -1.81 0.00 0.00 0.00 175.10 174.09 3hov s ASP 110 N -3.19 6.80 -0.44 3.32 1.01 -1.26 -4.97 116.67 117.95 3hov s ASP 110 Ca 0.37 0.98 -0.28 0.00 0.71 0.00 0.00 52.55 54.33 3hov s ASP 110 Cb 0.07 -2.39 -0.00 0.00 1.01 0.00 0.00 42.92 41.61 3hov s ASP 110 CO 0.11 -0.31 1.56 -0.76 0.21 0.00 0.00 175.17 175.99 3hov s LEU 111 N 1.93 3.50 0.00 1.23 1.02 -1.26 -4.78 118.68 120.32 3hov s LEU 111 Ca 0.33 0.81 -0.02 0.00 0.02 0.00 0.00 54.13 55.27 3hov s LEU 111 Cb -0.16 -3.35 -0.09 0.00 0.02 0.00 0.00 46.19 42.61 3hov s LEU 111 CO 0.11 -1.65 1.68 1.21 0.02 0.00 0.00 176.35 177.72 3hov n GLU 112 N 8.39 0.81 -0.28 1.70 4.07 -1.26 -4.03 120.64 130.05 3hov n GLU 112 Ca 0.18 -0.33 0.00 0.00 -0.06 0.00 0.00 57.16 56.95 3hov n GLU 112 Cb 0.48 -1.59 0.00 0.00 -0.06 0.00 0.00 31.44 30.28 3hov n GLU 112 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3hov n GLY 113 N 2.44 0.79 3.77 8.31 0.00 -1.26 -5.04 105.19 114.19 3hov n GLY 113 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 3hov n GLY 113 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hov s GLU 114 N -0.63 3.71 0.00 1.61 0.41 -1.26 -4.93 118.70 117.61 3hov s GLU 114 Ca 0.00 2.42 0.00 0.00 -0.41 0.00 0.00 54.97 56.98 3hov s GLU 114 Cb 0.00 -2.67 0.00 0.00 -1.78 0.00 0.00 34.13 29.68 3hov s GLU 114 CO 0.00 -0.80 0.06 0.25 -0.49 0.00 0.00 175.26 174.28 3hov n THR 115 N -0.16 0.00 -3.72 3.63 -2.24 -1.26 -4.88 114.28 105.65 3hov n THR 115 Ca 0.05 -0.07 -0.35 0.00 -2.27 0.00 0.00 64.05 61.40 3hov n THR 115 Cb 0.42 1.71 -0.08 0.00 -2.10 0.00 0.00 70.33 70.28 3hov n THR 115 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3hov s ASP 116 N -0.02 6.22 0.16 3.42 -1.08 -1.26 -5.02 116.67 119.08 3hov s ASP 116 Ca 0.00 0.24 -0.20 0.00 -0.52 0.00 0.00 52.55 52.08 3hov s ASP 116 Cb 0.00 -2.10 0.06 0.00 -1.46 0.00 0.00 42.92 39.43 3hov s ASP 116 CO 0.00 0.17 1.65 1.55 0.52 0.00 0.00 175.17 179.06 3hov h PRO 117 N 6.69 -0.12 -0.88 4.34 0.13 -1.94 -0.04 132.00 140.19 3hov h PRO 117 Ca -0.41 0.01 0.02 0.00 -0.87 0.00 0.00 66.00 64.75 3hov h PRO 117 Cb 1.15 0.03 -0.05 0.00 0.13 0.00 0.00 31.00 32.26 3hov h PRO 117 CO 0.76 -0.08 0.57 1.25 -0.23 0.00 0.00 178.00 180.27 3hov h LEU 118 N -0.13 0.96 -0.47 1.56 5.85 -1.90 0.26 115.31 121.45 3hov h LEU 118 Ca 0.16 -0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.90 3hov h LEU 118 Cb 0.38 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.15 3hov h LEU 118 CO -0.40 0.67 0.25 -0.09 -0.34 0.00 0.00 178.44 178.53 3hov h ARG 119 N 1.13 0.48 -0.67 1.25 9.65 -1.78 0.52 114.38 124.96 3hov h ARG 119 Ca 0.34 -0.03 -0.08 0.00 -1.10 0.00 0.00 59.98 59.11 3hov h ARG 119 Cb -0.05 -0.11 -0.03 0.00 -1.39 0.00 0.00 29.97 28.40 3hov h ARG 119 CO -0.10 0.32 0.11 0.82 2.80 0.00 0.00 179.97 183.92 3hov h ILE 120 N 0.49 1.26 -0.29 1.20 2.04 -0.44 -1.46 117.51 120.32 3hov h ILE 120 Ca 0.20 -1.04 -0.04 0.00 1.00 0.00 0.00 64.86 64.98 3hov h ILE 120 Cb 0.08 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 36.79 3hov h ILE 120 CO -0.13 0.39 0.03 0.00 0.00 0.00 0.00 178.15 178.45 3hov h ALA 121 N 1.05 0.39 -0.21 1.87 0.00 0.21 0.19 119.26 122.76 3hov h ALA 121 Ca 0.20 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 3hov h ALA 121 Cb 0.44 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3hov h ALA 121 CO 0.01 0.10 -0.03 0.52 0.00 0.00 0.00 179.25 179.85 3hov h MET 122 N 0.30 0.31 -0.37 0.00 2.86 0.15 -1.44 114.93 116.75 3hov h MET 122 Ca 0.09 -0.06 -0.16 0.00 -2.06 0.00 0.00 59.70 57.51 3hov h MET 122 Cb 0.37 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.97 3hov h MET 122 CO 0.01 0.37 -0.40 -0.22 1.06 0.00 0.00 176.91 177.73 3hov h LYS 123 N 0.31 0.91 -0.70 1.72 3.64 -0.54 -0.45 116.57 121.46 3hov h LYS 123 Ca 0.07 -0.49 -0.07 0.00 -1.27 0.00 0.00 60.65 58.90 3hov h LYS 123 Cb 0.26 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.07 3hov h LYS 123 CO 0.01 1.14 0.18 0.93 -2.27 0.00 0.00 179.45 179.44 3hov h GLU 124 N 0.74 1.11 0.00 1.90 5.08 -0.14 -2.70 114.58 120.57 3hov h GLU 124 Ca 0.06 -0.26 -0.09 0.00 -1.00 0.00 0.00 59.36 58.06 3hov h GLU 124 Cb 0.99 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.08 3hov h GLU 124 CO 0.10 0.97 -0.45 1.25 -1.00 0.00 0.00 179.01 179.88 3hov h LEU 125 N 1.04 0.00 0.00 1.33 5.85 -1.16 0.11 115.31 122.48 3hov h LEU 125 Ca 0.22 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.94 3hov h LEU 125 Cb 0.36 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.39 3hov h LEU 125 CO 0.00 0.45 0.00 0.00 -0.34 0.00 0.00 178.44 178.55 3hov n ALA 126 N -2.40 2.44 -1.45 1.25 0.00 -0.19 -2.31 120.51 117.84 3hov n ALA 126 Ca -0.01 -0.13 0.07 0.00 0.00 0.00 0.00 53.44 53.36 3hov n ALA 126 Cb 0.50 -1.48 0.12 0.00 0.00 0.00 0.00 19.45 18.59 3hov n ALA 126 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3hov n GLU 127 N -1.32 1.03 -3.13 0.00 1.02 -0.98 -4.99 120.64 112.27 3hov n GLU 127 Ca 0.13 -2.42 -0.20 0.00 -0.02 0.00 0.00 57.16 54.64 3hov n GLU 127 Cb 0.26 -1.24 -0.04 0.00 -0.02 0.00 0.00 31.44 30.40 3hov n GLU 127 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3hov n LYS 128 N -0.97 -1.41 -1.63 3.49 4.76 -0.87 -4.76 118.16 116.76 3hov n LYS 128 Ca 0.13 0.07 -0.32 0.00 -2.87 0.00 0.00 58.31 55.32 3hov n LYS 128 Cb 0.70 -3.48 0.06 0.00 -1.84 0.00 0.00 35.03 30.46 3hov n LYS 128 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 3hov n LYS 129 N -2.70 2.99 -3.62 1.97 5.02 0.32 -4.55 118.16 117.59 3hov n LYS 129 Ca 0.06 -3.61 -0.40 0.00 -2.02 0.00 0.00 58.31 52.34 3hov n LYS 129 Cb 0.35 -2.28 -0.11 0.00 -0.02 0.00 0.00 35.03 32.96 3hov n LYS 129 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3hov s ILE 130 N -4.82 4.63 0.00 -0.18 1.01 -1.25 -4.71 121.20 115.88 3hov s ILE 130 Ca 0.59 -0.62 -0.01 0.00 0.00 0.00 0.00 60.65 60.61 3hov s ILE 130 Cb 0.47 -3.47 -0.06 0.00 0.01 0.00 0.00 42.46 39.41 3hov s ILE 130 CO -0.04 -0.09 1.78 -0.81 0.00 0.00 0.00 174.94 175.79 3hov n PRO 131 N 5.00 0.91 -4.36 2.79 -0.04 -1.26 -4.49 135.00 133.55 3hov n PRO 131 Ca -0.13 -0.22 -0.24 0.00 -0.04 0.00 0.00 63.50 62.88 3hov n PRO 131 Cb 0.48 -1.37 -0.08 0.00 -0.04 0.00 0.00 33.50 32.48 3hov n PRO 131 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3hov s LEU 132 N 0.00 2.96 -0.04 1.53 1.43 -1.26 -5.07 118.68 118.22 3hov s LEU 132 Ca 0.15 -0.88 0.01 0.00 -1.03 0.00 0.00 54.13 52.38 3hov s LEU 132 Cb 0.07 -1.42 0.02 0.00 0.03 0.00 0.00 46.19 44.89 3hov s LEU 132 CO 0.00 -0.08 -0.06 -0.69 0.23 0.00 0.00 176.35 175.75 3hov s VAL 133 N -2.45 0.64 -0.35 -1.59 1.01 -1.26 -2.67 120.40 113.74 3hov s VAL 133 Ca 0.32 -0.21 -0.20 0.00 0.00 0.00 0.00 61.98 61.89 3hov s VAL 133 Cb -0.04 -0.63 -0.00 0.00 0.00 0.00 0.00 36.38 35.71 3hov s VAL 133 CO 0.18 0.24 0.62 -0.63 0.00 0.00 0.00 175.10 175.52 3hov s ILE 134 N 0.71 4.91 -0.43 2.22 1.01 0.15 -4.91 121.20 124.85 3hov s ILE 134 Ca -0.10 0.62 -0.20 0.00 0.00 0.00 0.00 60.65 60.97 3hov s ILE 134 Cb -0.13 -4.05 0.02 0.00 0.01 0.00 0.00 42.46 38.31 3hov s ILE 134 CO 0.01 -0.27 0.59 -0.60 0.00 0.00 0.00 174.94 174.66 3hov s ARG 135 N 2.66 3.24 -0.23 2.79 3.52 -1.26 -1.41 118.95 128.26 3hov s ARG 135 Ca 0.24 -0.47 -0.20 0.00 -0.13 0.00 0.00 55.73 55.17 3hov s ARG 135 Cb -0.15 -3.95 -0.02 0.00 -1.56 0.00 0.00 34.95 29.27 3hov s ARG 135 CO 0.14 -0.96 0.63 1.03 -0.81 0.00 0.00 175.30 175.33 3hov s ARG 136 N 2.63 4.14 -0.04 5.12 0.52 0.16 -4.93 118.95 126.55 3hov s ARG 136 Ca 0.20 0.57 -0.14 0.00 -0.52 0.00 0.00 55.73 55.84 3hov s ARG 136 Cb -0.15 -3.62 -0.05 0.00 0.52 0.00 0.00 34.95 31.64 3hov s ARG 136 CO 0.17 -0.35 0.36 0.71 0.02 0.00 0.00 175.30 176.22 3hov s TYR 137 N 2.29 3.67 0.34 -0.53 1.51 -1.26 -1.62 117.35 121.75 3hov s TYR 137 Ca 0.27 0.88 -0.05 0.00 -1.01 0.00 0.00 57.07 57.16 3hov s TYR 137 Cb -0.16 -2.26 -0.05 0.00 -0.11 0.00 0.00 41.96 39.38 3hov s TYR 137 CO 0.09 0.58 0.62 -0.51 -1.11 0.00 0.00 175.55 175.22 3hov s LEU 138 N -0.78 3.95 0.07 -1.29 1.43 0.56 -4.95 118.68 117.68 3hov s LEU 138 Ca 0.22 0.75 0.03 0.00 -1.03 0.00 0.00 54.13 54.10 3hov s LEU 138 Cb -0.16 -3.61 0.15 0.00 0.03 0.00 0.00 46.19 42.61 3hov s LEU 138 CO 0.11 -0.30 0.89 -0.81 0.23 0.00 0.00 176.35 176.47 3hov n PRO 139 N -1.34 0.02 0.00 1.29 -0.04 -1.26 -1.11 135.00 132.56 3hov n PRO 139 Ca -0.01 0.35 0.06 0.00 -0.04 0.00 0.00 63.50 63.85 3hov n PRO 139 Cb 0.54 -1.80 -0.03 0.00 -0.04 0.00 0.00 33.50 32.18 3hov n PRO 139 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 3hov n ASP 140 N -1.45 1.03 0.00 3.54 5.75 -1.26 -4.98 116.55 119.18 3hov n ASP 140 Ca -0.00 -1.01 0.00 0.00 -0.01 0.00 0.00 54.79 53.76 3hov n ASP 140 Cb 0.24 0.69 0.00 0.00 -1.03 0.00 0.00 41.12 41.02 3hov n ASP 140 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3hov n GLY 141 N 1.11 2.19 3.63 6.12 0.00 -0.27 -5.10 105.19 112.87 3hov n GLY 141 Ca 0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 3hov n GLY 141 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hov s SER 142 N -1.99 2.46 -0.18 1.61 0.01 -1.26 -4.73 113.70 109.62 3hov s SER 142 Ca 0.00 1.75 -0.28 0.00 1.31 0.00 0.00 55.95 58.74 3hov s SER 142 Cb 0.00 -2.37 0.08 0.00 0.21 0.00 0.00 66.02 63.94 3hov s SER 142 CO 0.00 -3.32 0.74 0.72 0.41 0.00 0.00 173.24 171.79 3hov s PHE 143 N -2.67 -0.70 -0.11 2.43 -0.12 -0.06 -0.32 117.98 116.43 3hov s PHE 143 Ca 0.66 1.51 0.02 0.00 -0.05 0.00 0.00 56.93 59.07 3hov s PHE 143 Cb -0.22 0.34 -0.01 0.00 -0.63 0.00 0.00 43.02 42.50 3hov s PHE 143 CO 0.60 -0.46 -0.18 -1.21 -0.05 0.00 0.00 175.22 173.92 3hov s GLU 144 N -0.30 3.11 -0.12 1.99 2.02 -0.64 -1.79 118.70 122.97 3hov s GLU 144 Ca -0.04 -0.78 -0.14 0.00 0.02 0.00 0.00 54.97 54.03 3hov s GLU 144 Cb -0.03 -2.45 -0.05 0.00 0.10 0.00 0.00 34.13 31.71 3hov s GLU 144 CO 0.04 0.25 0.34 -0.51 0.02 0.00 0.00 175.26 175.40 3hov s ASP 145 N 0.21 6.55 0.03 -0.19 1.11 -1.26 -0.67 116.67 122.45 3hov s ASP 145 Ca -0.11 0.64 0.05 0.00 0.18 0.00 0.00 52.55 53.30 3hov s ASP 145 Cb -0.16 -2.21 -0.02 0.00 1.07 0.00 0.00 42.92 41.60 3hov s ASP 145 CO 0.06 0.14 -0.14 0.26 1.18 0.00 0.00 175.17 176.68 3hov s TRP 146 N 0.11 1.19 0.20 4.23 0.52 -0.50 -4.98 118.94 119.72 3hov s TRP 146 Ca 0.19 -0.33 -0.03 0.00 0.02 0.00 0.00 56.10 55.96 3hov s TRP 146 Cb -0.14 -0.72 -0.05 0.00 -1.15 0.00 0.00 33.47 31.42 3hov s TRP 146 CO 0.07 0.02 0.42 -1.54 0.02 0.00 0.00 176.95 175.94 3hov s SER 147 N -0.98 6.43 0.36 2.95 1.04 -1.26 0.29 113.70 122.53 3hov s SER 147 Ca 0.02 0.51 0.04 0.00 0.48 0.00 0.00 55.95 57.00 3hov s SER 147 Cb -0.07 -2.06 0.68 0.00 0.10 0.00 0.00 66.02 64.67 3hov s SER 147 CO 0.01 -0.04 2.00 -0.37 0.98 0.00 0.00 173.24 175.81 3hov h VAL 148 N 1.65 1.15 0.00 5.02 -1.51 -1.73 -1.82 116.25 119.01 3hov h VAL 148 Ca -0.47 -0.36 0.00 0.00 -1.23 0.00 0.00 66.70 64.64 3hov h VAL 148 Cb 1.18 0.42 0.00 0.00 -2.13 0.00 0.00 31.29 30.76 3hov h VAL 148 CO 0.69 0.16 0.00 -0.62 -1.23 0.00 0.00 177.57 176.57 3hov n GLU 149 N -4.42 0.00 -0.31 5.19 1.02 -1.26 -2.98 120.64 117.88 3hov n GLU 149 Ca 0.05 0.71 -0.11 0.00 -0.02 0.00 0.00 57.16 57.78 3hov n GLU 149 Cb 0.08 -1.39 -0.09 0.00 -0.02 0.00 0.00 31.44 30.02 3hov n GLU 149 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 3hov h GLU 150 N 0.00 -0.15 -6.11 3.49 5.08 -1.86 -3.43 114.58 111.61 3hov h GLU 150 Ca 0.00 0.01 -0.77 0.00 -1.00 0.00 0.00 59.36 57.60 3hov h GLU 150 Cb 0.00 0.03 0.01 0.00 0.50 0.00 0.00 28.75 29.30 3hov h GLU 150 CO 0.00 -0.10 0.86 1.28 -1.00 0.00 0.00 179.01 180.05 3hov n LEU 151 N -5.31 2.15 -4.72 1.33 4.77 -0.72 -4.93 117.00 109.56 3hov n LEU 151 Ca 0.00 1.10 -0.33 0.00 -0.03 0.00 0.00 56.01 56.75 3hov n LEU 151 Cb 0.30 -1.09 0.10 0.00 -2.33 0.00 0.00 43.42 40.41 3hov n LEU 151 CO -0.09 -0.51 0.74 -0.63 -1.33 0.00 0.00 177.39 175.57 3hov s ILE 152 N 3.46 2.54 -0.45 -0.08 1.01 -0.81 -4.74 121.20 122.13 3hov s ILE 152 Ca 1.00 0.23 0.09 0.00 0.00 0.00 0.00 60.65 61.96 3hov s ILE 152 Cb -1.16 -2.64 0.31 0.00 0.01 0.00 0.00 42.46 38.99 3hov s ILE 152 CO 0.69 -0.18 0.73 1.33 0.00 0.00 0.00 174.94 177.52 3hov n VAL 153 N -3.18 0.74 0.00 2.92 0.24 -1.26 -1.48 118.33 116.31 3hov n VAL 153 Ca 0.12 -4.76 0.00 0.00 -2.04 0.00 0.00 64.34 57.66 3hov n VAL 153 Cb 0.51 -1.11 0.00 0.00 -1.47 0.00 0.00 33.84 31.78 3hov n VAL 153 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 3hov n ASP 154 N 0.48 0.00 0.00 -1.34 -0.08 -1.26 -5.06 116.55 109.28 3hov n ASP 154 Ca 0.26 0.76 0.00 0.00 -1.51 0.00 0.00 54.79 54.31 3hov n ASP 154 Cb 0.54 -0.33 0.00 0.00 2.34 0.00 0.00 41.12 43.67 3hov n ASP 154 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50