#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hoy n LYS 70 N 0.00 -1.02 -0.11 3.23 4.76 -1.26 -4.65 118.16 119.11 3hoy n LYS 70 Ca 0.00 0.38 0.12 0.00 -2.87 0.00 0.00 58.31 55.93 3hoy n LYS 70 Cb 0.00 -4.21 0.22 0.00 -1.84 0.00 0.00 35.03 29.20 3hoy n LYS 70 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 3hoy n GLU 71 N -1.17 2.32 0.00 1.97 1.02 -1.26 -3.54 120.64 119.97 3hoy n GLU 71 Ca -0.02 -1.96 0.07 0.00 -0.02 0.00 0.00 57.16 55.23 3hoy n GLU 71 Cb 0.28 -1.48 -0.02 0.00 -0.02 0.00 0.00 31.44 30.20 3hoy n GLU 71 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 3hoy n LYS 72 N 1.23 1.94 -2.72 3.49 2.85 -1.26 -4.85 118.16 118.83 3hoy n LYS 72 Ca 0.17 -0.59 -0.42 0.00 -1.05 0.00 0.00 58.31 56.42 3hoy n LYS 72 Cb 0.56 -1.21 -0.03 0.00 -0.65 0.00 0.00 35.03 33.70 3hoy n LYS 72 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3hoy s ALA 73 N -1.87 3.00 -0.24 0.58 0.00 -1.23 -1.17 121.76 120.83 3hoy s ALA 73 Ca 0.10 -2.41 -0.37 0.00 0.00 0.00 0.00 51.96 49.29 3hoy s ALA 73 Cb 0.11 -4.29 -0.13 0.00 0.00 0.00 0.00 23.12 18.81 3hoy s ALA 73 CO 0.41 -3.30 1.92 -0.89 0.00 0.00 0.00 175.76 173.89 3hoy n ILE 74 N 6.25 0.36 -1.57 0.00 5.41 -0.83 -4.89 119.36 124.10 3hoy n ILE 74 Ca 0.26 -0.13 -0.40 0.00 1.00 0.00 0.00 62.75 63.48 3hoy n ILE 74 Cb 0.50 -1.55 0.03 0.00 -0.71 0.00 0.00 39.64 37.91 3hoy n ILE 74 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 3hoy n PRO 75 N 6.62 0.98 -0.36 0.38 -0.04 -1.26 -4.72 135.00 136.60 3hoy n PRO 75 Ca 0.30 0.36 -0.10 0.00 -0.04 0.00 0.00 63.50 64.02 3hoy n PRO 75 Cb 0.21 -1.95 -0.09 0.00 -0.04 0.00 0.00 33.50 31.63 3hoy n PRO 75 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 3hoy n LYS 76 N -0.15 -0.38 -1.54 0.54 4.81 -1.26 -3.72 118.16 116.45 3hoy n LYS 76 Ca 0.11 1.33 -0.30 0.00 -0.87 0.00 0.00 58.31 58.59 3hoy n LYS 76 Cb 0.43 -1.96 0.20 0.00 0.02 0.00 0.00 35.03 33.72 3hoy n LYS 76 CO 0.00 0.00 0.00 0.16 1.17 0.00 0.00 177.40 178.73 3hoy s ASP 77 N -5.39 2.22 0.00 3.14 1.47 -1.26 -2.91 116.67 113.94 3hoy s ASP 77 Ca -0.10 0.47 0.00 0.00 1.18 0.00 0.00 52.55 54.10 3hoy s ASP 77 Cb 0.10 -0.64 0.00 0.00 -0.34 0.00 0.00 42.92 42.04 3hoy s ASP 77 CO 0.54 -3.31 0.00 0.00 0.68 0.00 0.00 175.17 173.08 3hoy n GLN 78 N -4.19 0.00 -1.93 2.11 6.02 -1.26 -4.95 117.38 113.19 3hoy n GLN 78 Ca 0.14 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.72 3hoy n GLN 78 Cb 0.59 -2.10 -0.00 0.00 1.02 0.00 0.00 30.24 29.75 3hoy n GLN 78 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 3hoy s ARG 79 N 0.00 4.10 0.00 -1.09 3.52 -1.15 -4.91 118.95 119.42 3hoy s ARG 79 Ca 0.00 2.39 0.00 0.00 -0.13 0.00 0.00 55.73 57.99 3hoy s ARG 79 Cb 0.00 -2.92 0.00 0.00 -1.56 0.00 0.00 34.95 30.47 3hoy s ARG 79 CO 0.00 -0.47 0.38 0.00 -0.81 0.00 0.00 175.30 174.40 3hoy n ALA 80 N 0.42 1.06 -1.00 6.12 0.00 -1.26 -5.07 120.51 120.78 3hoy n ALA 80 Ca 0.02 -0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.08 3hoy n ALA 80 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.86 3hoy n ALA 80 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3hoy n THR 81 N -0.07 0.00 -4.53 0.00 -2.24 -1.26 -4.98 114.28 101.20 3hoy n THR 81 Ca 0.00 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.44 3hoy n THR 81 Cb 0.27 0.00 -0.11 0.00 -2.10 0.00 0.00 70.33 68.39 3hoy n THR 81 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3hoy s THR 82 N 0.00 3.82 0.23 4.28 2.01 -1.26 -4.98 115.64 119.74 3hoy s THR 82 Ca 0.00 -0.52 0.16 0.00 0.31 0.00 0.00 61.69 61.64 3hoy s THR 82 Cb 0.00 -2.60 0.09 0.00 0.01 0.00 0.00 72.50 70.00 3hoy s THR 82 CO 0.00 0.54 1.73 -0.65 -0.69 0.00 0.00 174.62 175.54 3hoy h PRO 83 N 5.00 0.00 -6.36 4.92 0.11 -1.97 -3.44 132.00 130.26 3hoy h PRO 83 Ca -0.49 0.00 -0.55 0.00 0.11 0.00 0.00 66.00 65.07 3hoy h PRO 83 Cb 1.17 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.25 3hoy h PRO 83 CO 0.53 0.43 -0.18 0.71 -0.21 0.00 0.00 178.00 179.28 3hoy s TYR 84 N -3.71 3.44 -0.06 0.65 1.51 -1.26 -1.77 117.35 116.15 3hoy s TYR 84 Ca -0.01 0.76 -0.30 0.00 -1.01 0.00 0.00 57.07 56.51 3hoy s TYR 84 Cb 0.12 -2.17 -0.02 0.00 -0.11 0.00 0.00 41.96 39.78 3hoy s TYR 84 CO 0.71 0.31 0.99 1.41 -1.11 0.00 0.00 175.55 177.86 3hoy s MET 85 N -2.81 4.48 0.85 -0.62 -2.45 -0.55 -4.82 119.30 113.37 3hoy s MET 85 Ca 0.45 1.39 -0.11 0.00 -1.25 0.00 0.00 55.69 56.17 3hoy s MET 85 Cb -0.11 -3.51 0.10 0.00 1.25 0.00 0.00 34.83 32.56 3hoy s MET 85 CO 0.23 -0.20 1.09 0.95 1.05 0.00 0.00 175.02 178.14 3hoy s THR 86 N 1.59 2.89 0.27 10.11 -4.23 -1.26 -4.77 115.64 120.24 3hoy s THR 86 Ca 0.50 0.29 -0.04 0.00 -1.18 0.00 0.00 61.69 61.25 3hoy s THR 86 Cb -0.19 -2.83 0.25 0.00 1.34 0.00 0.00 72.50 71.07 3hoy s THR 86 CO 0.22 -0.38 1.93 0.07 -0.54 0.00 0.00 174.62 175.93 3hoy h LYS 87 N -1.36 1.21 -0.22 3.99 2.10 -1.99 -2.14 116.57 118.16 3hoy h LYS 87 Ca -0.48 -0.09 -0.11 0.00 -2.00 0.00 0.00 60.65 57.98 3hoy h LYS 87 Cb 1.27 -0.27 -0.00 0.00 -0.90 0.00 0.00 32.23 32.33 3hoy h LYS 87 CO 0.55 0.82 -0.28 1.88 -2.00 0.00 0.00 179.45 180.42 3hoy h TYR 88 N 1.24 0.70 -0.78 0.07 -1.99 -1.98 0.10 116.97 114.34 3hoy h TYR 88 Ca 0.33 -0.22 0.11 0.00 2.00 0.00 0.00 58.73 60.95 3hoy h TYR 88 Cb -0.11 -0.14 -0.08 0.00 2.00 0.00 0.00 36.73 38.40 3hoy h TYR 88 CO 0.00 0.94 0.40 0.93 -0.00 0.00 0.00 178.16 180.43 3hoy h GLU 89 N 0.26 0.63 -0.11 4.88 5.08 -1.86 0.95 114.58 124.41 3hoy h GLU 89 Ca 0.03 -0.04 -0.19 0.00 -1.00 0.00 0.00 59.36 58.16 3hoy h GLU 89 Cb 0.85 -0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.97 3hoy h GLU 89 CO 0.07 0.41 -0.66 0.07 -1.00 0.00 0.00 179.01 177.90 3hoy h ARG 90 N 0.64 0.64 -0.80 2.33 0.11 -1.22 0.40 114.38 116.48 3hoy h ARG 90 Ca 0.40 -0.54 0.01 0.00 0.10 0.00 0.00 59.98 59.94 3hoy h ARG 90 Cb 0.46 0.12 -0.04 0.00 1.11 0.00 0.00 29.97 31.62 3hoy h ARG 90 CO -0.30 1.16 0.52 0.00 0.10 0.00 0.00 179.97 181.45 3hoy h ALA 91 N 0.49 1.02 0.00 0.08 0.00 -0.09 0.95 119.26 121.71 3hoy h ALA 91 Ca -0.05 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.71 3hoy h ALA 91 Cb 1.30 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 3hoy h ALA 91 CO 0.13 0.44 -0.44 -0.09 0.00 0.00 0.00 179.25 179.29 3hoy h ARG 92 N 1.09 0.00 0.00 0.00 2.43 0.10 -1.75 114.38 116.25 3hoy h ARG 92 Ca 0.29 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.45 3hoy h ARG 92 Cb -0.11 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.44 3hoy h ARG 92 CO -0.06 0.44 -0.04 0.82 -1.51 0.00 0.00 179.97 179.61 3hoy h ILE 93 N 0.00 1.64 -0.95 1.20 2.04 0.73 -1.97 117.51 120.20 3hoy h ILE 93 Ca -0.00 -1.95 0.15 0.00 1.00 0.00 0.00 64.86 64.05 3hoy h ILE 93 Cb 1.07 2.95 -0.09 0.00 -0.74 0.00 0.00 36.82 40.01 3hoy h ILE 93 CO 0.06 0.51 0.56 -0.07 0.00 0.00 0.00 178.15 179.21 3hoy h LEU 94 N -0.78 0.76 0.04 1.44 3.38 -0.85 0.15 115.31 119.44 3hoy h LEU 94 Ca -0.01 0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 3hoy h LEU 94 Cb 0.86 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.54 3hoy h LEU 94 CO 0.01 0.35 -0.02 1.23 0.09 0.00 0.00 178.44 180.10 3hoy h GLY 95 N 0.81 -0.05 0.58 0.83 0.00 -1.35 -0.67 103.07 103.22 3hoy h GLY 95 Ca 0.51 0.02 0.04 0.00 0.00 0.00 0.00 47.33 47.89 3hoy h GLY 95 CO -0.32 -0.02 -0.08 -0.84 0.00 0.00 0.00 176.54 175.28 3hoy h THR 96 N -0.39 0.74 -0.43 4.70 2.02 -0.73 0.22 112.91 119.04 3hoy h THR 96 Ca -0.00 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.15 3hoy h THR 96 Cb 0.36 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 67.49 3hoy h THR 96 CO 0.01 0.00 0.17 -0.09 0.37 0.00 0.00 175.52 175.98 3hoy h ARG 97 N -0.07 0.61 0.14 6.66 9.65 -0.75 -0.95 114.38 129.67 3hoy h ARG 97 Ca 0.09 -0.08 -0.01 0.00 -1.10 0.00 0.00 59.98 58.88 3hoy h ARG 97 Cb 0.20 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 28.67 3hoy h ARG 97 CO -0.20 0.50 -0.07 0.00 2.80 0.00 0.00 179.97 183.00 3hoy h ALA 98 N 1.59 -0.19 -0.47 2.80 0.00 -0.34 -2.27 119.26 120.37 3hoy h ALA 98 Ca 0.15 -0.19 0.14 0.00 0.00 0.00 0.00 54.91 55.00 3hoy h ALA 98 Cb 0.12 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3hoy h ALA 98 CO -0.02 -0.41 0.58 1.25 0.00 0.00 0.00 179.25 180.65 3hoy h LEU 99 N -0.58 0.00 0.07 0.00 5.85 0.35 0.41 115.31 121.40 3hoy h LEU 99 Ca -0.02 0.00 -0.33 0.00 0.84 0.00 0.00 57.88 58.37 3hoy h LEU 99 Cb 0.45 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.44 3hoy h LEU 99 CO 0.03 0.00 -1.89 0.00 -0.34 0.00 0.00 178.44 176.24 3hoy n GLN 100 N -3.51 0.70 0.13 1.25 6.02 -0.45 -3.41 117.38 118.11 3hoy n GLN 100 Ca 0.09 0.27 -0.02 0.00 -0.01 0.00 0.00 57.00 57.33 3hoy n GLN 100 Cb 0.77 -1.74 0.15 0.00 1.02 0.00 0.00 30.24 30.43 3hoy n GLN 100 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 3hoy h ILE 101 N 0.04 1.45 0.00 5.09 2.04 -0.60 0.10 117.51 125.63 3hoy h ILE 101 Ca -0.37 -2.18 0.00 0.00 1.00 0.00 0.00 64.86 63.31 3hoy h ILE 101 Cb 2.03 2.17 0.00 0.00 -0.74 0.00 0.00 36.82 40.28 3hoy h ILE 101 CO 0.08 0.63 0.00 -1.54 0.00 0.00 0.00 178.15 177.32 3hoy n SER 102 N -3.79 0.36 -1.00 1.72 3.41 0.13 -2.18 113.62 112.27 3hoy n SER 102 Ca -0.01 0.57 0.08 0.00 -0.26 0.00 0.00 58.87 59.25 3hoy n SER 102 Cb 0.64 -0.65 0.27 0.00 -0.26 0.00 0.00 64.21 64.20 3hoy n SER 102 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3hoy n MET 103 N -1.88 3.16 -1.31 4.33 2.81 -0.57 -4.94 117.12 118.73 3hoy n MET 103 Ca 0.04 -2.79 -0.06 0.00 -1.81 0.00 0.00 57.70 53.08 3hoy n MET 103 Cb 0.24 -1.83 -0.02 0.00 -0.71 0.00 0.00 33.22 30.91 3hoy n MET 103 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 3hoy n ASN 104 N -0.21 -3.53 -4.68 7.83 3.02 -0.93 -5.01 115.26 111.76 3hoy n ASN 104 Ca 0.21 0.13 -0.30 0.00 -0.03 0.00 0.00 54.58 54.59 3hoy n ASN 104 Cb 0.87 -1.74 0.16 0.00 -0.61 0.00 0.00 39.78 38.46 3hoy n ASN 104 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hoy s ALA 105 N -2.23 1.29 0.17 5.41 0.00 0.25 -4.94 121.76 121.70 3hoy s ALA 105 Ca 0.00 0.14 -0.30 0.00 0.00 0.00 0.00 51.96 51.80 3hoy s ALA 105 Cb 0.00 -3.28 -0.07 0.00 0.00 0.00 0.00 23.12 19.77 3hoy s ALA 105 CO 0.00 -2.62 1.09 -2.14 0.00 0.00 0.00 175.76 172.08 3hoy s PRO 106 N -4.78 4.60 0.08 0.00 0.02 -1.26 -4.72 135.00 128.94 3hoy s PRO 106 Ca 0.65 1.69 -0.06 0.00 0.02 0.00 0.00 61.00 63.30 3hoy s PRO 106 Cb -0.20 -3.29 -0.05 0.00 0.02 0.00 0.00 34.50 30.98 3hoy s PRO 106 CO 0.58 0.09 0.34 0.08 -0.33 0.00 0.00 177.00 177.76 3hoy s VAL 107 N -0.22 5.20 -0.24 3.83 1.01 -1.26 -4.97 120.40 123.75 3hoy s VAL 107 Ca 0.49 0.17 0.13 0.00 0.00 0.00 0.00 61.98 62.77 3hoy s VAL 107 Cb -0.29 -3.61 0.61 0.00 0.00 0.00 0.00 36.38 33.09 3hoy s VAL 107 CO 0.34 0.22 1.56 0.49 0.00 0.00 0.00 175.10 177.71 3hoy n PHE 108 N 0.65 1.47 -4.16 5.22 3.01 -1.26 -4.99 117.46 117.41 3hoy n PHE 108 Ca -0.07 -1.08 -0.11 0.00 1.01 0.00 0.00 57.45 57.20 3hoy n PHE 108 Cb 0.52 -0.46 -0.09 0.00 -0.01 0.00 0.00 39.48 39.43 3hoy n PHE 108 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 3hoy s VAL 109 N -2.95 0.02 -0.28 -4.37 1.01 -1.26 -4.95 120.40 107.62 3hoy s VAL 109 Ca 0.47 -1.89 -0.27 0.00 0.00 0.00 0.00 61.98 60.29 3hoy s VAL 109 Cb 0.39 -2.36 0.01 0.00 0.00 0.00 0.00 36.38 34.41 3hoy s VAL 109 CO 0.09 -0.09 0.95 -1.81 0.00 0.00 0.00 175.10 174.24 3hoy s ASP 110 N -3.12 6.87 -0.20 3.32 1.01 -1.26 -4.87 116.67 118.42 3hoy s ASP 110 Ca 0.34 1.01 -0.06 0.00 0.71 0.00 0.00 52.55 54.55 3hoy s ASP 110 Cb 0.06 -2.49 -0.21 0.00 1.01 0.00 0.00 42.92 41.29 3hoy s ASP 110 CO 0.09 -0.70 3.15 0.18 0.21 0.00 0.00 175.17 178.10 3hoy n LEU 111 N 6.43 4.99 -3.33 1.23 4.32 -1.26 -4.85 117.00 124.53 3hoy n LEU 111 Ca 0.09 -2.99 -0.04 0.00 -0.02 0.00 0.00 56.01 53.05 3hoy n LEU 111 Cb 0.47 -1.26 -0.04 0.00 -1.62 0.00 0.00 43.42 40.97 3hoy n LEU 111 CO 0.53 1.45 1.00 -0.62 -1.22 0.00 0.00 177.39 178.52 3hoy n GLU 112 N 2.74 0.00 0.00 3.23 1.02 -1.26 -1.50 120.64 124.86 3hoy n GLU 112 Ca 0.42 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.56 3hoy n GLU 112 Cb 0.71 -0.81 0.00 0.00 -0.02 0.00 0.00 31.44 31.32 3hoy n GLU 112 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hoy n GLY 113 N 3.82 2.34 1.59 0.62 0.00 -1.26 -5.01 105.19 107.29 3hoy n GLY 113 Ca 0.12 -0.45 -0.21 0.00 0.00 0.00 0.00 46.02 45.48 3hoy n GLY 113 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hoy n GLU 114 N 0.00 0.00 0.00 1.61 -0.58 -0.56 -4.95 120.64 116.15 3hoy n GLU 114 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 3hoy n GLU 114 Cb 0.00 -0.48 0.00 0.00 -0.57 0.00 0.00 31.44 30.39 3hoy n GLU 114 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 3hoy n THR 115 N -0.30 0.00 -3.76 2.62 -2.24 -1.26 -4.92 114.28 104.42 3hoy n THR 115 Ca 0.07 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.49 3hoy n THR 115 Cb 0.16 0.72 -0.10 0.00 -2.10 0.00 0.00 70.33 69.02 3hoy n THR 115 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3hoy s ASP 116 N 0.00 5.92 0.24 3.42 2.15 -1.26 -5.01 116.67 122.14 3hoy s ASP 116 Ca 0.00 0.09 -0.04 0.00 0.43 0.00 0.00 52.55 53.03 3hoy s ASP 116 Cb 0.00 -2.05 0.45 0.00 -0.30 0.00 0.00 42.92 41.02 3hoy s ASP 116 CO 0.00 0.10 1.74 1.55 -0.17 0.00 0.00 175.17 178.39 3hoy h PRO 117 N 7.26 0.46 -0.57 4.34 0.13 -1.93 0.11 132.00 141.80 3hoy h PRO 117 Ca -0.38 -0.03 -0.03 0.00 -0.87 0.00 0.00 66.00 64.69 3hoy h PRO 117 Cb 1.17 -0.10 -0.03 0.00 0.13 0.00 0.00 31.00 32.17 3hoy h PRO 117 CO 0.67 0.30 0.22 1.25 -0.23 0.00 0.00 178.00 180.22 3hoy h LEU 118 N 0.47 0.76 0.24 1.56 5.85 -1.89 0.74 115.31 123.04 3hoy h LEU 118 Ca 0.41 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 59.02 3hoy h LEU 118 Cb 0.60 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.44 3hoy h LEU 118 CO -0.39 0.69 -0.12 -0.09 -0.34 0.00 0.00 178.44 178.20 3hoy h ARG 119 N 0.82 -0.31 -0.56 1.25 9.65 -1.55 0.14 114.38 123.82 3hoy h ARG 119 Ca 0.19 0.02 0.06 0.00 -1.10 0.00 0.00 59.98 59.15 3hoy h ARG 119 Cb 0.18 0.07 -0.05 0.00 -1.39 0.00 0.00 29.97 28.78 3hoy h ARG 119 CO -0.02 -0.10 0.27 0.82 2.80 0.00 0.00 179.97 183.75 3hoy h ILE 120 N -0.47 0.92 -0.07 1.20 2.04 -0.36 -1.48 117.51 119.29 3hoy h ILE 120 Ca -0.03 -0.18 0.03 0.00 1.00 0.00 0.00 64.86 65.68 3hoy h ILE 120 Cb 0.36 0.36 -0.04 0.00 -0.74 0.00 0.00 36.82 36.76 3hoy h ILE 120 CO 0.05 0.09 -0.17 0.00 0.00 0.00 0.00 178.15 178.13 3hoy h ALA 121 N 1.32 -0.15 -0.87 1.87 0.00 0.79 0.05 119.26 122.27 3hoy h ALA 121 Ca 0.25 0.03 0.09 0.00 0.00 0.00 0.00 54.91 55.28 3hoy h ALA 121 Cb 0.19 0.31 -0.07 0.00 0.00 0.00 0.00 17.79 18.22 3hoy h ALA 121 CO -0.19 -0.64 0.52 0.52 0.00 0.00 0.00 179.25 179.46 3hoy h MET 122 N -0.24 0.87 -0.27 0.00 2.86 -0.16 -1.30 114.93 116.69 3hoy h MET 122 Ca 0.08 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.66 3hoy h MET 122 Cb 0.34 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 3hoy h MET 122 CO -0.21 0.58 0.16 -0.22 1.06 0.00 0.00 176.91 178.27 3hoy h LYS 123 N 0.90 0.37 0.04 1.72 3.64 -0.27 -0.59 116.57 122.37 3hoy h LYS 123 Ca 0.41 -0.04 0.03 0.00 -1.27 0.00 0.00 60.65 59.78 3hoy h LYS 123 Cb 0.31 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 32.01 3hoy h LYS 123 CO -0.22 0.30 -0.27 0.93 -2.27 0.00 0.00 179.45 177.91 3hoy h GLU 124 N 0.33 -0.43 -0.95 1.90 5.08 -0.16 -1.17 114.58 119.19 3hoy h GLU 124 Ca 0.10 0.03 0.18 0.00 -1.00 0.00 0.00 59.36 58.66 3hoy h GLU 124 Cb 0.03 0.10 -0.08 0.00 0.50 0.00 0.00 28.75 29.29 3hoy h GLU 124 CO -0.02 -0.28 0.60 1.25 -1.00 0.00 0.00 179.01 179.56 3hoy h LEU 125 N -0.44 0.64 -0.83 1.33 5.85 -0.96 -1.72 115.31 119.18 3hoy h LEU 125 Ca 0.05 0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.78 3hoy h LEU 125 Cb 0.51 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 3hoy h LEU 125 CO -0.21 0.27 0.25 0.00 -0.34 0.00 0.00 178.44 178.40 3hoy h ALA 126 N 1.61 1.06 -0.82 1.25 0.00 0.12 -2.00 119.26 120.47 3hoy h ALA 126 Ca 0.51 -0.21 -0.31 0.00 0.00 0.00 0.00 54.91 54.90 3hoy h ALA 126 Cb 0.93 -0.29 -0.18 0.00 0.00 0.00 0.00 17.79 18.25 3hoy h ALA 126 CO -0.26 0.65 0.39 0.39 0.00 0.00 0.00 179.25 180.41 3hoy n GLU 127 N -4.26 3.30 -3.61 0.00 1.02 -0.73 -4.93 120.64 111.43 3hoy n GLU 127 Ca 0.06 -3.04 -0.28 0.00 -0.02 0.00 0.00 57.16 53.88 3hoy n GLU 127 Cb 0.21 -2.21 -0.05 0.00 -0.02 0.00 0.00 31.44 29.37 3hoy n GLU 127 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3hoy n LYS 128 N -0.43 -1.08 -1.70 3.49 4.76 -0.75 -4.81 118.16 117.64 3hoy n LYS 128 Ca 0.47 0.09 -0.33 0.00 -2.87 0.00 0.00 58.31 55.66 3hoy n LYS 128 Cb 1.48 -3.72 0.05 0.00 -1.84 0.00 0.00 35.03 31.00 3hoy n LYS 128 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 3hoy n LYS 129 N -3.10 2.94 -3.77 1.97 5.02 -0.72 -4.70 118.16 115.80 3hoy n LYS 129 Ca 0.08 -3.62 -0.37 0.00 -2.02 0.00 0.00 58.31 52.38 3hoy n LYS 129 Cb 0.36 -2.28 -0.13 0.00 -0.02 0.00 0.00 35.03 32.97 3hoy n LYS 129 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3hoy s ILE 130 N -4.91 3.67 0.00 -0.18 1.01 -1.26 -4.70 121.20 114.84 3hoy s ILE 130 Ca 0.58 -1.16 -0.03 0.00 0.00 0.00 0.00 60.65 60.04 3hoy s ILE 130 Cb 0.47 -3.08 -0.12 0.00 0.01 0.00 0.00 42.46 39.74 3hoy s ILE 130 CO -0.11 -0.16 1.96 -0.81 0.00 0.00 0.00 174.94 175.81 3hoy n PRO 131 N 4.79 0.96 -4.44 2.79 -0.04 -1.26 -4.54 135.00 133.26 3hoy n PRO 131 Ca -0.13 -0.44 -0.23 0.00 -0.04 0.00 0.00 63.50 62.66 3hoy n PRO 131 Cb 0.44 -1.68 -0.10 0.00 -0.04 0.00 0.00 33.50 32.12 3hoy n PRO 131 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3hoy s LEU 132 N 0.00 2.56 -0.05 1.53 1.43 -1.26 -5.08 118.68 117.81 3hoy s LEU 132 Ca 0.29 -1.00 0.01 0.00 -1.03 0.00 0.00 54.13 52.41 3hoy s LEU 132 Cb 0.14 -1.02 0.02 0.00 0.03 0.00 0.00 46.19 45.36 3hoy s LEU 132 CO 0.00 0.01 -0.07 -0.69 0.23 0.00 0.00 176.35 175.84 3hoy s VAL 133 N -2.46 0.70 -0.22 -1.59 1.01 -1.26 -2.37 120.40 114.21 3hoy s VAL 133 Ca 0.27 -0.22 -0.22 0.00 0.00 0.00 0.00 61.98 61.81 3hoy s VAL 133 Cb -0.05 -0.69 -0.02 0.00 0.00 0.00 0.00 36.38 35.62 3hoy s VAL 133 CO 0.13 0.26 0.69 -0.63 0.00 0.00 0.00 175.10 175.55 3hoy s ILE 134 N 0.85 4.96 -0.43 2.22 1.01 0.71 -4.88 121.20 125.64 3hoy s ILE 134 Ca -0.12 1.29 -0.15 0.00 0.00 0.00 0.00 60.65 61.67 3hoy s ILE 134 Cb -0.15 -3.99 0.03 0.00 0.01 0.00 0.00 42.46 38.36 3hoy s ILE 134 CO 0.01 0.04 0.32 -0.60 0.00 0.00 0.00 174.94 174.71 3hoy s ARG 135 N 2.32 2.97 -0.41 2.79 3.52 -1.26 -1.24 118.95 127.64 3hoy s ARG 135 Ca 0.30 -1.11 -0.20 0.00 -0.13 0.00 0.00 55.73 54.59 3hoy s ARG 135 Cb -0.16 -4.02 0.02 0.00 -1.56 0.00 0.00 34.95 29.23 3hoy s ARG 135 CO 0.09 -0.82 0.61 1.03 -0.81 0.00 0.00 175.30 175.40 3hoy s ARG 136 N 1.67 3.38 0.15 5.12 0.52 0.22 -4.93 118.95 125.07 3hoy s ARG 136 Ca 0.05 -0.30 -0.29 0.00 -0.52 0.00 0.00 55.73 54.67 3hoy s ARG 136 Cb -0.20 -3.91 -0.07 0.00 0.52 0.00 0.00 34.95 31.29 3hoy s ARG 136 CO 0.09 -0.91 0.90 0.71 0.02 0.00 0.00 175.30 176.11 3hoy s TYR 137 N 2.71 3.87 0.06 -0.53 1.51 -1.26 -2.00 117.35 121.71 3hoy s TYR 137 Ca 0.22 1.76 -0.03 0.00 -1.01 0.00 0.00 57.07 58.01 3hoy s TYR 137 Cb -0.15 -2.95 -0.04 0.00 -0.11 0.00 0.00 41.96 38.71 3hoy s TYR 137 CO 0.17 0.34 0.25 -0.51 -1.11 0.00 0.00 175.55 174.70 3hoy s LEU 138 N -0.53 4.34 0.53 -1.29 1.43 -0.04 -4.96 118.68 118.16 3hoy s LEU 138 Ca 0.42 0.40 0.07 0.00 -1.03 0.00 0.00 54.13 54.00 3hoy s LEU 138 Cb -0.24 -2.95 0.39 0.00 0.03 0.00 0.00 46.19 43.43 3hoy s LEU 138 CO 0.29 0.17 1.14 1.55 0.23 0.00 0.00 176.35 179.73 3hoy h PRO 139 N 3.26 0.00 0.00 1.29 0.13 -1.97 0.28 132.00 134.99 3hoy h PRO 139 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3hoy h PRO 139 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 3hoy h PRO 139 CO 0.73 0.00 -0.66 -0.40 -0.23 0.00 0.00 178.00 177.43 3hoy n ASP 140 N -2.32 0.66 0.00 1.44 5.75 -1.26 -4.95 116.55 115.87 3hoy n ASP 140 Ca -0.00 -0.48 0.00 0.00 -0.01 0.00 0.00 54.79 54.30 3hoy n ASP 140 Cb 0.73 0.49 0.00 0.00 -1.03 0.00 0.00 41.12 41.31 3hoy n ASP 140 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3hoy n GLY 141 N 1.50 2.53 3.76 6.12 0.00 0.99 -5.08 105.19 115.00 3hoy n GLY 141 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 3hoy n GLY 141 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hoy s SER 142 N -1.29 4.63 0.02 1.61 1.04 -1.26 -4.73 113.70 113.72 3hoy s SER 142 Ca 0.00 1.98 -0.14 0.00 0.48 0.00 0.00 55.95 58.27 3hoy s SER 142 Cb 0.00 -2.54 0.02 0.00 0.10 0.00 0.00 66.02 63.60 3hoy s SER 142 CO 0.00 -1.96 0.30 0.72 0.98 0.00 0.00 173.24 173.29 3hoy s PHE 143 N -2.55 -0.13 -0.06 5.02 -0.12 -0.31 -0.86 117.98 118.96 3hoy s PHE 143 Ca 0.65 0.07 0.04 0.00 -0.05 0.00 0.00 56.93 57.64 3hoy s PHE 143 Cb -0.20 0.09 -0.02 0.00 -0.63 0.00 0.00 43.02 42.26 3hoy s PHE 143 CO 0.49 -0.46 -0.18 -1.21 -0.05 0.00 0.00 175.22 173.80 3hoy s GLU 144 N -2.11 2.62 -0.02 1.99 2.02 -0.84 -1.96 118.70 120.39 3hoy s GLU 144 Ca -0.08 -0.78 -0.03 0.00 0.02 0.00 0.00 54.97 54.10 3hoy s GLU 144 Cb -0.02 -2.32 -0.04 0.00 0.10 0.00 0.00 34.13 31.85 3hoy s GLU 144 CO -0.01 0.48 0.17 -0.51 0.02 0.00 0.00 175.26 175.41 3hoy s ASP 145 N -0.37 6.32 0.01 -0.19 1.11 -1.26 -0.61 116.67 121.68 3hoy s ASP 145 Ca 0.03 0.35 0.00 0.00 0.18 0.00 0.00 52.55 53.11 3hoy s ASP 145 Cb -0.12 -1.98 -0.01 0.00 1.07 0.00 0.00 42.92 41.88 3hoy s ASP 145 CO 0.02 0.28 -0.02 0.26 1.18 0.00 0.00 175.17 176.89 3hoy s TRP 146 N -1.28 0.21 0.13 4.23 0.52 -0.37 -4.98 118.94 117.40 3hoy s TRP 146 Ca 0.25 -0.28 -0.13 0.00 0.02 0.00 0.00 56.10 55.97 3hoy s TRP 146 Cb -0.12 -0.14 -0.07 0.00 -1.15 0.00 0.00 33.47 31.99 3hoy s TRP 146 CO 0.17 -0.09 0.51 -1.54 0.02 0.00 0.00 176.95 176.02 3hoy s SER 147 N -0.77 6.76 0.43 2.95 1.04 -1.26 -0.21 113.70 122.64 3hoy s SER 147 Ca -0.08 0.99 0.29 0.00 0.48 0.00 0.00 55.95 57.63 3hoy s SER 147 Cb -0.05 -2.25 1.55 0.00 0.10 0.00 0.00 66.02 65.36 3hoy s SER 147 CO -0.00 0.11 1.88 0.58 0.98 0.00 0.00 173.24 176.79 3hoy h VAL 148 N 2.77 0.00 0.20 5.02 2.07 -1.71 -1.55 116.25 123.05 3hoy h VAL 148 Ca -0.49 -0.02 -0.01 0.00 0.82 0.00 0.00 66.70 67.00 3hoy h VAL 148 Cb 1.19 0.68 0.00 0.00 -1.52 0.00 0.00 31.29 31.64 3hoy h VAL 148 CO 0.66 0.00 -0.10 -0.08 0.02 0.00 0.00 177.57 178.08 3hoy h GLU 149 N 0.00 -0.26 -0.50 1.57 4.81 -1.84 -3.35 114.58 115.02 3hoy h GLU 149 Ca 0.00 0.02 0.10 0.00 -0.13 0.00 0.00 59.36 59.35 3hoy h GLU 149 Cb 0.03 0.06 -0.10 0.00 0.63 0.00 0.00 28.75 29.37 3hoy h GLU 149 CO 0.00 -0.16 -0.13 0.93 -0.73 0.00 0.00 179.01 178.92 3hoy h GLU 150 N -1.07 -0.01 -6.19 1.92 5.08 -1.70 -3.43 114.58 109.19 3hoy h GLU 150 Ca -0.03 0.00 -0.70 0.00 -1.00 0.00 0.00 59.36 57.63 3hoy h GLU 150 Cb 0.22 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.49 3hoy h GLU 150 CO 0.04 -0.01 0.93 1.28 -1.00 0.00 0.00 179.01 180.26 3hoy n LEU 151 N -5.37 2.62 -4.68 1.33 4.77 -0.71 -4.91 117.00 110.05 3hoy n LEU 151 Ca 0.05 1.05 -0.42 0.00 -0.03 0.00 0.00 56.01 56.66 3hoy n LEU 151 Cb 0.27 -1.20 -0.03 0.00 -2.33 0.00 0.00 43.42 40.13 3hoy n LEU 151 CO 0.10 -0.36 1.26 -0.63 -1.33 0.00 0.00 177.39 176.42 3hoy s ILE 152 N 3.50 3.45 -0.99 -0.08 1.01 -0.73 -4.75 121.20 122.61 3hoy s ILE 152 Ca 0.96 0.79 -0.02 0.00 0.00 0.00 0.00 60.65 62.38 3hoy s ILE 152 Cb -0.97 -3.51 0.30 0.00 0.01 0.00 0.00 42.46 38.29 3hoy s ILE 152 CO 0.61 -0.02 1.37 0.52 0.00 0.00 0.00 174.94 177.42 3hoy n VAL 153 N 4.90 4.83 0.00 2.92 0.31 -1.26 -1.48 118.33 128.55 3hoy n VAL 153 Ca 0.15 -5.81 0.00 0.00 -0.01 0.00 0.00 64.34 58.67 3hoy n VAL 153 Cb 0.42 -2.02 0.00 0.00 -0.91 0.00 0.00 33.84 31.33 3hoy n VAL 153 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 3hoy n ASP 154 N 1.08 0.00 0.00 4.52 -0.08 -1.26 -5.07 116.55 115.74 3hoy n ASP 154 Ca 0.28 0.38 0.00 0.00 -1.51 0.00 0.00 54.79 53.94 3hoy n ASP 154 Cb 0.34 -0.19 0.00 0.00 2.34 0.00 0.00 41.12 43.61 3hoy n ASP 154 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50