#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hou n LYS 70 N 0.00 -1.59 -0.12 3.23 4.76 -1.26 -4.60 118.16 118.59 3hou n LYS 70 Ca 0.00 0.54 0.11 0.00 -2.87 0.00 0.00 58.31 56.09 3hou n LYS 70 Cb 0.00 -4.79 0.17 0.00 -1.84 0.00 0.00 35.03 28.57 3hou n LYS 70 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 3hou n GLU 71 N -0.16 2.33 0.00 1.97 1.02 -1.26 -3.46 120.64 121.07 3hou n GLU 71 Ca -0.03 -2.10 0.08 0.00 -0.02 0.00 0.00 57.16 55.09 3hou n GLU 71 Cb 0.44 -1.47 0.06 0.00 -0.02 0.00 0.00 31.44 30.46 3hou n GLU 71 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 3hou n LYS 72 N 1.36 1.09 -2.79 3.49 2.85 -1.26 -4.89 118.16 118.01 3hou n LYS 72 Ca 0.17 -1.39 -0.43 0.00 -1.05 0.00 0.00 58.31 55.60 3hou n LYS 72 Cb 0.58 -1.29 -0.04 0.00 -0.65 0.00 0.00 35.03 33.63 3hou n LYS 72 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3hou s ALA 73 N -1.26 3.18 -0.31 0.58 0.00 -1.23 -1.59 121.76 121.14 3hou s ALA 73 Ca 0.18 -0.94 -0.28 0.00 0.00 0.00 0.00 51.96 50.92 3hou s ALA 73 Cb 0.13 -3.73 0.01 0.00 0.00 0.00 0.00 23.12 19.53 3hou s ALA 73 CO 0.19 -2.25 1.02 0.42 0.00 0.00 0.00 175.76 175.14 3hou s ILE 74 N 3.99 4.57 0.43 0.00 1.01 -0.89 -4.98 121.20 125.34 3hou s ILE 74 Ca 0.36 1.68 -0.21 0.00 0.00 0.00 0.00 60.65 62.48 3hou s ILE 74 Cb -0.10 -4.36 -0.14 0.00 0.01 0.00 0.00 42.46 37.86 3hou s ILE 74 CO 0.24 -0.41 0.18 -0.81 0.00 0.00 0.00 174.94 174.14 3hou n PRO 75 N 6.70 0.15 -0.11 2.79 -0.04 -1.26 -4.66 135.00 138.58 3hou n PRO 75 Ca 0.11 0.06 0.26 0.00 -0.04 0.00 0.00 63.50 63.88 3hou n PRO 75 Cb 0.47 -1.16 0.72 0.00 -0.04 0.00 0.00 33.50 33.49 3hou n PRO 75 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 3hou h LYS 76 N 0.36 0.00 -6.34 0.54 1.63 -1.94 -3.29 116.57 107.53 3hou h LYS 76 Ca -0.39 0.00 -0.55 0.00 -0.85 0.00 0.00 60.65 58.87 3hou h LYS 76 Cb 1.43 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 33.04 3hou h LYS 76 CO 0.47 0.00 -0.21 0.34 -3.45 0.00 0.00 179.45 176.60 3hou s ASP 77 N -5.63 6.51 0.00 4.20 -1.08 -1.26 -3.89 116.67 115.51 3hou s ASP 77 Ca -0.05 0.71 0.00 0.00 -0.52 0.00 0.00 52.55 52.69 3hou s ASP 77 Cb 0.20 -2.14 0.00 0.00 -1.46 0.00 0.00 42.92 39.52 3hou s ASP 77 CO 0.73 -0.06 0.00 0.00 0.52 0.00 0.00 175.17 176.35 3hou n GLN 78 N -0.32 0.00 -1.91 4.34 6.02 -1.25 -5.02 117.38 119.24 3hou n GLN 78 Ca -0.01 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.57 3hou n GLN 78 Cb 0.53 -1.73 -0.01 0.00 1.02 0.00 0.00 30.24 30.05 3hou n GLN 78 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 3hou s ARG 79 N -0.29 4.20 0.00 -1.09 6.06 -1.24 -4.91 118.95 121.67 3hou s ARG 79 Ca 0.00 2.45 0.00 0.00 -2.50 0.00 0.00 55.73 55.68 3hou s ARG 79 Cb 0.00 -3.01 0.00 0.00 0.06 0.00 0.00 34.95 32.00 3hou s ARG 79 CO 0.00 -0.43 0.00 0.00 -2.50 0.00 0.00 175.30 172.37 3hou n ALA 80 N 0.79 1.43 -0.62 6.12 0.00 -1.26 -5.08 120.51 121.89 3hou n ALA 80 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.16 3hou n ALA 80 Cb 0.40 0.00 0.26 0.00 0.00 0.00 0.00 19.45 20.11 3hou n ALA 80 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3hou s THR 81 N -0.91 1.62 0.38 0.00 -4.23 -1.26 -4.94 115.64 106.30 3hou s THR 81 Ca 0.00 0.00 -0.27 0.00 -1.18 0.00 0.00 61.69 60.24 3hou s THR 81 Cb 0.00 -2.17 -0.10 0.00 1.34 0.00 0.00 72.50 71.57 3hou s THR 81 CO 0.00 0.00 1.39 -0.89 -0.54 0.00 0.00 174.62 174.58 3hou s THR 82 N -2.52 2.34 -0.32 3.99 2.01 -1.26 -4.89 115.64 115.00 3hou s THR 82 Ca 0.69 0.32 0.25 0.00 0.31 0.00 0.00 61.69 63.26 3hou s THR 82 Cb -0.17 -3.20 0.35 0.00 0.01 0.00 0.00 72.50 69.48 3hou s THR 82 CO 0.60 0.07 1.69 -0.65 -0.69 0.00 0.00 174.62 175.63 3hou h PRO 83 N 2.90 0.00 -6.83 4.92 0.11 -1.99 -3.45 132.00 127.66 3hou h PRO 83 Ca -0.50 0.00 -0.49 0.00 0.11 0.00 0.00 66.00 65.12 3hou h PRO 83 Cb 1.24 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.37 3hou h PRO 83 CO 0.64 0.01 0.06 0.71 -0.21 0.00 0.00 178.00 179.21 3hou s TYR 84 N -3.31 3.53 -0.12 0.65 1.51 -1.26 -2.18 117.35 116.18 3hou s TYR 84 Ca 0.06 0.80 -0.19 0.00 -1.01 0.00 0.00 57.07 56.73 3hou s TYR 84 Cb 0.06 -2.27 -0.04 0.00 -0.11 0.00 0.00 41.96 39.60 3hou s TYR 84 CO 0.64 -0.16 0.51 1.41 -1.11 0.00 0.00 175.55 176.85 3hou s MET 85 N -4.40 4.34 0.61 -0.62 -2.45 -0.83 -4.78 119.30 111.17 3hou s MET 85 Ca 0.47 0.51 -0.16 0.00 -1.25 0.00 0.00 55.69 55.26 3hou s MET 85 Cb -0.10 -3.45 -0.02 0.00 1.25 0.00 0.00 34.83 32.50 3hou s MET 85 CO 0.40 0.11 1.09 0.95 1.05 0.00 0.00 175.02 178.62 3hou s THR 86 N 0.75 3.45 0.22 10.11 -4.23 -1.26 -4.80 115.64 119.88 3hou s THR 86 Ca 0.27 0.72 -0.08 0.00 -1.18 0.00 0.00 61.69 61.42 3hou s THR 86 Cb -0.15 -3.24 0.16 0.00 1.34 0.00 0.00 72.50 70.61 3hou s THR 86 CO 0.11 -0.37 1.78 0.07 -0.54 0.00 0.00 174.62 175.67 3hou h LYS 87 N 0.39 0.58 0.14 3.99 2.10 -1.99 -0.87 116.57 120.91 3hou h LYS 87 Ca -0.47 -0.03 0.01 0.00 -2.00 0.00 0.00 60.65 58.15 3hou h LYS 87 Cb 1.24 -0.13 -0.02 0.00 -0.90 0.00 0.00 32.23 32.42 3hou h LYS 87 CO 0.56 0.38 -0.16 1.88 -2.00 0.00 0.00 179.45 180.11 3hou h TYR 88 N 0.60 -0.41 -0.00 0.07 -1.99 -1.98 0.56 116.97 113.82 3hou h TYR 88 Ca 0.33 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.07 3hou h TYR 88 Cb 0.32 0.16 -0.01 0.00 2.00 0.00 0.00 36.73 39.20 3hou h TYR 88 CO -0.11 -0.24 -0.07 0.93 -0.00 0.00 0.00 178.16 178.68 3hou h GLU 89 N -0.33 -0.09 -0.83 4.88 5.08 -1.69 0.13 114.58 121.72 3hou h GLU 89 Ca 0.01 0.01 0.16 0.00 -1.00 0.00 0.00 59.36 58.53 3hou h GLU 89 Cb 0.32 0.02 -0.10 0.00 0.50 0.00 0.00 28.75 29.49 3hou h GLU 89 CO -0.05 -0.06 0.39 0.07 -1.00 0.00 0.00 179.01 178.36 3hou h ARG 90 N -0.09 0.52 -0.51 2.33 0.11 -1.06 0.29 114.38 115.97 3hou h ARG 90 Ca 0.00 -0.03 0.06 0.00 0.10 0.00 0.00 59.98 60.11 3hou h ARG 90 Cb 0.10 -0.12 -0.05 0.00 1.11 0.00 0.00 29.97 31.00 3hou h ARG 90 CO -0.05 0.35 0.22 0.00 0.10 0.00 0.00 179.97 180.58 3hou h ALA 91 N 1.58 0.64 0.00 0.08 0.00 0.59 -0.74 119.26 121.41 3hou h ALA 91 Ca 0.47 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.35 3hou h ALA 91 Cb 0.72 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 3hou h ALA 91 CO -0.40 -0.16 -0.36 -0.09 0.00 0.00 0.00 179.25 178.24 3hou h ARG 92 N 0.42 0.00 0.40 0.00 2.43 0.21 -2.11 114.38 115.74 3hou h ARG 92 Ca 0.24 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.39 3hou h ARG 92 Cb 0.22 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.77 3hou h ARG 92 CO -0.21 0.36 -0.19 0.82 -1.51 0.00 0.00 179.97 179.23 3hou h ILE 93 N 0.00 0.29 -0.92 1.20 5.03 0.57 -1.55 117.51 122.12 3hou h ILE 93 Ca -0.00 -0.65 0.25 0.00 -0.12 0.00 0.00 64.86 64.34 3hou h ILE 93 Cb 0.80 0.45 -0.14 0.00 -3.03 0.00 0.00 36.82 34.90 3hou h ILE 93 CO 0.05 0.06 0.40 -0.07 -0.68 0.00 0.00 178.15 177.91 3hou h LEU 94 N -1.04 0.30 0.01 1.44 3.38 -1.18 0.16 115.31 118.38 3hou h LEU 94 Ca -0.05 0.17 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 3hou h LEU 94 Cb 0.51 0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.43 3hou h LEU 94 CO 0.09 -0.07 -0.00 1.23 0.09 0.00 0.00 178.44 179.77 3hou h GLY 95 N 0.34 -0.01 0.74 0.83 0.00 -1.38 -0.63 103.07 102.95 3hou h GLY 95 Ca 0.60 0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.97 3hou h GLY 95 CO -0.58 -0.00 0.16 -0.84 0.00 0.00 0.00 176.54 175.27 3hou h THR 96 N -0.29 0.93 0.02 4.70 2.02 0.08 0.10 112.91 120.48 3hou h THR 96 Ca -0.00 -0.11 -0.00 0.00 0.77 0.00 0.00 66.41 67.06 3hou h THR 96 Cb 0.28 0.57 0.00 0.00 -1.74 0.00 0.00 68.15 67.26 3hou h THR 96 CO 0.00 0.06 -0.01 -0.09 0.37 0.00 0.00 175.52 175.85 3hou h ARG 97 N 0.33 -0.03 -0.59 6.66 9.65 -0.74 -1.41 114.38 128.25 3hou h ARG 97 Ca 0.17 0.00 0.12 0.00 -1.10 0.00 0.00 59.98 59.17 3hou h ARG 97 Cb 0.11 0.01 -0.09 0.00 -1.39 0.00 0.00 29.97 28.61 3hou h ARG 97 CO -0.15 0.04 0.07 0.00 2.80 0.00 0.00 179.97 182.73 3hou h ALA 98 N 0.88 0.65 0.14 2.80 0.00 -0.73 0.51 119.26 123.51 3hou h ALA 98 Ca -0.00 0.15 0.02 0.00 0.00 0.00 0.00 54.91 55.08 3hou h ALA 98 Cb 0.08 0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 3hou h ALA 98 CO 0.01 -0.35 -0.44 1.25 0.00 0.00 0.00 179.25 179.72 3hou h LEU 99 N 0.19 -1.30 -1.38 0.00 5.85 -0.41 0.21 115.31 118.48 3hou h LEU 99 Ca 0.31 0.14 -0.04 0.00 0.84 0.00 0.00 57.88 59.13 3hou h LEU 99 Cb 0.48 0.48 -0.01 0.00 0.37 0.00 0.00 40.66 41.98 3hou h LEU 99 CO -0.45 -0.51 -0.04 1.56 -0.34 0.00 0.00 178.44 178.66 3hou h GLN 100 N -0.68 0.36 -0.17 1.25 4.20 -0.37 -0.96 115.11 118.73 3hou h GLN 100 Ca 0.01 -0.07 -0.08 0.00 0.06 0.00 0.00 58.65 58.58 3hou h GLN 100 Cb 0.70 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.41 3hou h GLN 100 CO -0.24 0.42 -0.23 0.82 -0.67 0.00 0.00 178.83 178.93 3hou h ILE 101 N 0.35 1.24 0.00 2.54 2.04 0.64 0.10 117.51 124.41 3hou h ILE 101 Ca 0.08 -1.10 -0.10 0.00 1.00 0.00 0.00 64.86 64.73 3hou h ILE 101 Cb 0.31 1.36 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 3hou h ILE 101 CO 0.01 0.34 -0.47 0.77 0.00 0.00 0.00 178.15 178.81 3hou h SER 102 N 0.28 0.00 0.00 1.72 4.64 -0.04 -2.63 113.55 117.52 3hou h SER 102 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 3hou h SER 102 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 3hou h SER 102 CO 0.04 0.47 0.00 0.23 -0.87 0.00 0.00 176.83 176.70 3hou n MET 103 N -3.29 0.96 -2.91 4.77 2.81 -0.46 -4.84 117.12 114.16 3hou n MET 103 Ca 0.01 0.00 -0.11 0.00 -1.81 0.00 0.00 57.70 55.80 3hou n MET 103 Cb 0.68 -1.14 0.03 0.00 -0.71 0.00 0.00 33.22 32.08 3hou n MET 103 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 3hou n ASN 104 N -0.64 -3.90 -4.86 7.83 3.02 -0.99 -5.04 115.26 110.68 3hou n ASN 104 Ca 0.07 -0.22 -0.26 0.00 -0.03 0.00 0.00 54.58 54.13 3hou n ASN 104 Cb 0.03 -2.54 0.08 0.00 -0.61 0.00 0.00 39.78 36.74 3hou n ASN 104 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hou s ALA 105 N -3.07 3.03 0.36 5.41 0.00 -0.05 -5.01 121.76 122.43 3hou s ALA 105 Ca 0.24 -0.93 -0.28 0.00 0.00 0.00 0.00 51.96 50.99 3hou s ALA 105 Cb -0.10 -2.65 -0.10 0.00 0.00 0.00 0.00 23.12 20.27 3hou s ALA 105 CO 0.29 -1.45 1.31 -2.14 0.00 0.00 0.00 175.76 173.78 3hou s PRO 106 N -5.34 4.19 -0.16 0.00 0.02 -1.26 -4.77 135.00 127.68 3hou s PRO 106 Ca 0.62 2.21 -0.05 0.00 0.02 0.00 0.00 61.00 63.79 3hou s PRO 106 Cb -0.10 -2.94 -0.04 0.00 0.02 0.00 0.00 34.50 31.44 3hou s PRO 106 CO 0.46 -0.33 0.02 0.08 -0.33 0.00 0.00 177.00 176.91 3hou s VAL 107 N -1.19 4.45 -0.36 3.83 1.01 -1.26 -4.93 120.40 121.94 3hou s VAL 107 Ca 0.52 -0.16 0.10 0.00 0.00 0.00 0.00 61.98 62.44 3hou s VAL 107 Cb -0.39 -2.97 0.67 0.00 0.00 0.00 0.00 36.38 33.68 3hou s VAL 107 CO 0.52 0.50 1.62 0.49 0.00 0.00 0.00 175.10 178.23 3hou n PHE 108 N 3.28 2.00 -4.25 5.22 3.01 -1.26 -4.91 117.46 120.55 3hou n PHE 108 Ca -0.17 -0.89 -0.15 0.00 1.01 0.00 0.00 57.45 57.26 3hou n PHE 108 Cb 0.53 -0.56 -0.10 0.00 -0.01 0.00 0.00 39.48 39.34 3hou n PHE 108 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 3hou s VAL 109 N -2.58 0.09 -0.13 -4.37 1.01 -1.26 -4.94 120.40 108.23 3hou s VAL 109 Ca 0.47 -2.00 -0.18 0.00 0.00 0.00 0.00 61.98 60.27 3hou s VAL 109 Cb 0.37 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 34.19 3hou s VAL 109 CO 0.12 0.00 0.48 -1.81 0.00 0.00 0.00 175.10 173.89 3hou s ASP 110 N -3.24 6.67 -0.68 3.32 1.01 -1.26 -4.98 116.67 117.51 3hou s ASP 110 Ca 0.39 0.80 -0.27 0.00 0.71 0.00 0.00 52.55 54.18 3hou s ASP 110 Cb 0.06 -2.29 0.01 0.00 1.01 0.00 0.00 42.92 41.72 3hou s ASP 110 CO 0.16 -0.01 1.45 -0.76 0.21 0.00 0.00 175.17 176.22 3hou s LEU 111 N 0.71 3.23 0.00 1.23 1.02 -1.26 -4.79 118.68 118.81 3hou s LEU 111 Ca 0.26 -0.14 -0.01 0.00 0.02 0.00 0.00 54.13 54.25 3hou s LEU 111 Cb -0.15 -2.62 -0.04 0.00 0.02 0.00 0.00 46.19 43.40 3hou s LEU 111 CO 0.10 -1.97 0.98 1.21 0.02 0.00 0.00 176.35 176.69 3hou n GLU 112 N 9.23 0.43 -0.01 1.70 4.07 -1.26 -3.90 120.64 130.90 3hou n GLU 112 Ca 0.09 -0.14 0.00 0.00 -0.06 0.00 0.00 57.16 57.05 3hou n GLU 112 Cb 0.50 -1.50 0.00 0.00 -0.06 0.00 0.00 31.44 30.38 3hou n GLU 112 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3hou n GLY 113 N 2.34 0.25 3.76 8.31 0.00 -1.26 -5.05 105.19 113.54 3hou n GLY 113 Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 3hou n GLY 113 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hou s GLU 114 N -0.94 3.58 0.00 1.61 0.41 -1.25 -4.93 118.70 117.18 3hou s GLU 114 Ca 0.00 2.18 0.00 0.00 -0.41 0.00 0.00 54.97 56.74 3hou s GLU 114 Cb 0.00 -2.51 0.00 0.00 -1.78 0.00 0.00 34.13 29.84 3hou s GLU 114 CO 0.00 -0.82 0.30 0.25 -0.49 0.00 0.00 175.26 174.50 3hou n THR 115 N -0.44 0.00 -3.73 3.63 -2.24 -1.26 -4.86 114.28 105.38 3hou n THR 115 Ca 0.07 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.49 3hou n THR 115 Cb 0.44 1.21 -0.09 0.00 -2.10 0.00 0.00 70.33 69.79 3hou n THR 115 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3hou s ASP 116 N 0.00 6.03 0.21 3.42 -1.08 -1.26 -5.01 116.67 118.98 3hou s ASP 116 Ca 0.00 0.12 -0.09 0.00 -0.52 0.00 0.00 52.55 52.06 3hou s ASP 116 Cb 0.00 -2.07 0.27 0.00 -1.46 0.00 0.00 42.92 39.66 3hou s ASP 116 CO 0.00 0.11 1.76 1.55 0.52 0.00 0.00 175.17 179.11 3hou h PRO 117 N 7.21 0.46 -0.75 4.34 0.13 -1.94 0.76 132.00 142.21 3hou h PRO 117 Ca -0.39 -0.03 -0.05 0.00 -0.87 0.00 0.00 66.00 64.67 3hou h PRO 117 Cb 1.16 -0.10 -0.03 0.00 0.13 0.00 0.00 31.00 32.16 3hou h PRO 117 CO 0.69 0.31 0.29 1.25 -0.23 0.00 0.00 178.00 180.30 3hou h LEU 118 N 0.48 1.04 -0.33 1.56 5.85 -1.90 -0.56 115.31 121.45 3hou h LEU 118 Ca 0.31 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.85 3hou h LEU 118 Cb 0.34 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 3hou h LEU 118 CO -0.27 0.93 0.21 -0.09 -0.34 0.00 0.00 178.44 178.89 3hou h ARG 119 N 1.08 0.43 -0.26 1.25 9.65 -1.75 0.18 114.38 124.97 3hou h ARG 119 Ca 0.25 -0.03 -0.02 0.00 -1.10 0.00 0.00 59.98 59.08 3hou h ARG 119 Cb 0.23 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 28.70 3hou h ARG 119 CO -0.02 0.29 0.06 0.82 2.80 0.00 0.00 179.97 183.92 3hou h ILE 120 N 0.44 1.13 -0.12 1.20 2.04 -0.56 -0.25 117.51 121.39 3hou h ILE 120 Ca 0.12 -0.47 -0.10 0.00 1.00 0.00 0.00 64.86 65.42 3hou h ILE 120 Cb -0.04 0.88 0.00 0.00 -0.74 0.00 0.00 36.82 36.92 3hou h ILE 120 CO -0.03 0.17 -0.30 0.00 0.00 0.00 0.00 178.15 177.99 3hou h ALA 121 N 1.70 0.20 -0.02 1.87 0.00 -0.28 0.60 119.26 123.33 3hou h ALA 121 Ca 0.09 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 3hou h ALA 121 Cb 0.16 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 3hou h ALA 121 CO -0.00 0.22 -0.08 0.52 0.00 0.00 0.00 179.25 179.92 3hou h MET 122 N 0.00 0.03 -0.02 0.00 2.86 -0.17 0.57 114.93 118.20 3hou h MET 122 Ca -0.00 -0.00 -0.23 0.00 -2.06 0.00 0.00 59.70 57.41 3hou h MET 122 Cb 0.90 -0.01 0.02 0.00 0.06 0.00 0.00 31.60 32.57 3hou h MET 122 CO 0.06 0.10 -0.87 -0.22 1.06 0.00 0.00 176.91 177.05 3hou h LYS 123 N 0.03 0.63 -0.49 1.72 3.64 -0.83 -1.97 116.57 119.29 3hou h LYS 123 Ca 0.01 -0.65 -0.03 0.00 -1.27 0.00 0.00 60.65 58.71 3hou h LYS 123 Cb 0.15 0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 3hou h LYS 123 CO 0.01 1.25 0.16 0.93 -2.27 0.00 0.00 179.45 179.53 3hou h GLU 124 N 0.26 0.72 0.00 1.90 5.08 0.14 -2.01 114.58 120.67 3hou h GLU 124 Ca -0.10 -0.12 -0.10 0.00 -1.00 0.00 0.00 59.36 58.04 3hou h GLU 124 Cb 1.53 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.64 3hou h GLU 124 CO 0.17 0.62 -0.48 1.25 -1.00 0.00 0.00 179.01 179.58 3hou h LEU 125 N 0.71 0.00 -0.36 1.33 5.85 -0.89 -0.18 115.31 121.76 3hou h LEU 125 Ca 0.17 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.83 3hou h LEU 125 Cb 0.20 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 3hou h LEU 125 CO -0.01 0.48 -0.30 0.00 -0.34 0.00 0.00 178.44 178.27 3hou h ALA 126 N 1.52 0.85 -0.47 1.25 0.00 -0.65 -2.87 119.26 118.89 3hou h ALA 126 Ca -0.00 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.55 3hou h ALA 126 Cb 0.99 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.68 3hou h ALA 126 CO 0.06 0.37 0.07 0.39 0.00 0.00 0.00 179.25 180.15 3hou n GLU 127 N -3.24 3.41 -3.45 0.00 1.02 -0.89 -4.94 120.64 112.55 3hou n GLU 127 Ca 0.02 -3.02 -0.26 0.00 -0.02 0.00 0.00 57.16 53.88 3hou n GLU 127 Cb 0.59 -2.04 -0.05 0.00 -0.02 0.00 0.00 31.44 29.93 3hou n GLU 127 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3hou n LYS 128 N -0.27 -1.20 -1.97 3.49 4.76 -0.93 -4.79 118.16 117.25 3hou n LYS 128 Ca 0.30 0.08 -0.34 0.00 -2.87 0.00 0.00 58.31 55.49 3hou n LYS 128 Cb 1.12 -3.65 0.03 0.00 -1.84 0.00 0.00 35.03 30.69 3hou n LYS 128 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 3hou n LYS 129 N -2.97 3.03 -3.85 1.97 5.02 -0.13 -4.65 118.16 116.59 3hou n LYS 129 Ca 0.07 -3.82 -0.36 0.00 -2.02 0.00 0.00 58.31 52.18 3hou n LYS 129 Cb 0.36 -2.27 -0.13 0.00 -0.02 0.00 0.00 35.03 32.97 3hou n LYS 129 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3hou s ILE 130 N -5.09 3.41 0.00 -0.18 1.01 -1.26 -4.72 121.20 114.36 3hou s ILE 130 Ca 0.53 -0.98 0.00 0.00 0.00 0.00 0.00 60.65 60.21 3hou s ILE 130 Cb 0.44 -2.80 0.00 0.00 0.01 0.00 0.00 42.46 40.11 3hou s ILE 130 CO -0.22 0.06 0.60 -0.81 0.00 0.00 0.00 174.94 174.57 3hou n PRO 131 N 4.75 0.44 -4.19 2.79 -0.04 -1.26 -4.54 135.00 132.94 3hou n PRO 131 Ca -0.15 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.04 3hou n PRO 131 Cb 0.46 -1.28 -0.08 0.00 -0.04 0.00 0.00 33.50 32.57 3hou n PRO 131 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3hou s LEU 132 N 0.00 3.33 -0.05 1.53 1.43 -1.26 -5.06 118.68 118.59 3hou s LEU 132 Ca 0.00 -0.36 0.04 0.00 -1.03 0.00 0.00 54.13 52.78 3hou s LEU 132 Cb 0.00 -2.00 -0.00 0.00 0.03 0.00 0.00 46.19 44.22 3hou s LEU 132 CO 0.00 0.11 -0.18 -0.69 0.23 0.00 0.00 176.35 175.82 3hou s VAL 133 N -1.63 1.53 -0.24 -1.59 1.01 -1.26 -2.31 120.40 115.91 3hou s VAL 133 Ca 0.27 -0.76 -0.16 0.00 0.00 0.00 0.00 61.98 61.33 3hou s VAL 133 Cb -0.10 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.93 3hou s VAL 133 CO 0.18 0.44 0.42 -0.63 0.00 0.00 0.00 175.10 175.52 3hou s ILE 134 N 0.12 5.15 -0.49 2.22 1.01 0.14 -4.92 121.20 124.42 3hou s ILE 134 Ca -0.07 0.72 -0.16 0.00 0.00 0.00 0.00 60.65 61.14 3hou s ILE 134 Cb -0.13 -3.75 0.09 0.00 0.01 0.00 0.00 42.46 38.68 3hou s ILE 134 CO 0.03 0.18 0.43 -0.60 0.00 0.00 0.00 174.94 174.98 3hou s ARG 135 N 1.83 2.99 -0.04 2.79 3.52 -1.26 -1.54 118.95 127.23 3hou s ARG 135 Ca 0.18 -1.42 -0.29 0.00 -0.13 0.00 0.00 55.73 54.07 3hou s ARG 135 Cb -0.15 -4.17 -0.02 0.00 -1.56 0.00 0.00 34.95 29.04 3hou s ARG 135 CO 0.09 -1.11 0.97 1.03 -0.81 0.00 0.00 175.30 175.46 3hou s ARG 136 N 1.68 4.50 -0.13 5.12 0.52 -0.10 -4.92 118.95 125.62 3hou s ARG 136 Ca 0.04 1.36 -0.06 0.00 -0.52 0.00 0.00 55.73 56.56 3hou s ARG 136 Cb -0.25 -3.49 -0.04 0.00 0.52 0.00 0.00 34.95 31.69 3hou s ARG 136 CO 0.06 -0.13 0.09 0.71 0.02 0.00 0.00 175.30 176.05 3hou s TYR 137 N 1.35 3.42 0.24 -0.53 1.51 -1.26 -1.82 117.35 120.26 3hou s TYR 137 Ca 0.49 0.36 -0.02 0.00 -1.01 0.00 0.00 57.07 56.90 3hou s TYR 137 Cb -0.20 -1.93 -0.05 0.00 -0.11 0.00 0.00 41.96 39.67 3hou s TYR 137 CO 0.24 0.55 0.46 -0.51 -1.11 0.00 0.00 175.55 175.19 3hou s LEU 138 N -0.70 4.15 0.64 -1.29 1.43 -0.17 -4.97 118.68 117.78 3hou s LEU 138 Ca 0.12 0.53 0.24 0.00 -1.03 0.00 0.00 54.13 53.99 3hou s LEU 138 Cb -0.12 -3.32 1.23 0.00 0.03 0.00 0.00 46.19 44.01 3hou s LEU 138 CO 0.03 -0.12 1.69 1.55 0.23 0.00 0.00 176.35 179.73 3hou h PRO 139 N 1.80 0.00 0.00 1.29 0.13 -1.99 0.10 132.00 133.33 3hou h PRO 139 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 3hou h PRO 139 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3hou h PRO 139 CO 0.67 0.00 -1.08 -0.40 -0.23 0.00 0.00 178.00 176.96 3hou n ASP 140 N -3.03 0.76 0.00 1.44 5.75 -1.26 -4.94 116.55 115.27 3hou n ASP 140 Ca 0.03 0.28 0.00 0.00 -0.01 0.00 0.00 54.79 55.08 3hou n ASP 140 Cb 0.66 0.58 0.00 0.00 -1.03 0.00 0.00 41.12 41.33 3hou n ASP 140 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3hou n GLY 141 N 1.20 1.46 3.60 6.12 0.00 0.02 -5.11 105.19 112.48 3hou n GLY 141 Ca -0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 3hou n GLY 141 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hou s SER 142 N -1.70 1.80 -0.28 1.61 0.01 -1.26 -4.76 113.70 109.12 3hou s SER 142 Ca 0.00 1.20 -0.24 0.00 1.31 0.00 0.00 55.95 58.22 3hou s SER 142 Cb 0.00 -1.87 0.11 0.00 0.21 0.00 0.00 66.02 64.47 3hou s SER 142 CO 0.00 -3.65 0.93 0.72 0.41 0.00 0.00 173.24 171.65 3hou s PHE 143 N -2.80 -0.59 -0.11 2.43 -0.12 -0.62 -1.00 117.98 115.17 3hou s PHE 143 Ca 0.67 1.40 -0.01 0.00 -0.05 0.00 0.00 56.93 58.94 3hou s PHE 143 Cb -0.20 0.35 -0.03 0.00 -0.63 0.00 0.00 43.02 42.52 3hou s PHE 143 CO 0.60 -0.29 -0.07 -1.21 -0.05 0.00 0.00 175.22 174.20 3hou s GLU 144 N 0.44 3.21 -0.17 1.99 2.02 -0.76 -2.09 118.70 123.34 3hou s GLU 144 Ca 0.01 -0.56 -0.10 0.00 0.02 0.00 0.00 54.97 54.33 3hou s GLU 144 Cb -0.05 -2.72 -0.05 0.00 0.10 0.00 0.00 34.13 31.41 3hou s GLU 144 CO -0.06 0.43 0.17 -0.51 0.02 0.00 0.00 175.26 175.31 3hou s ASP 145 N -0.18 6.30 -0.02 -0.19 1.01 -1.26 -0.93 116.67 121.40 3hou s ASP 145 Ca 0.02 0.35 0.03 0.00 0.71 0.00 0.00 52.55 53.66 3hou s ASP 145 Cb -0.13 -2.11 0.00 0.00 1.01 0.00 0.00 42.92 41.69 3hou s ASP 145 CO 0.03 0.21 -0.11 0.26 0.21 0.00 0.00 175.17 175.77 3hou s TRP 146 N 0.10 1.06 0.29 4.23 0.52 -0.59 -4.98 118.94 119.58 3hou s TRP 146 Ca 0.11 -0.26 -0.12 0.00 0.02 0.00 0.00 56.10 55.85 3hou s TRP 146 Cb -0.12 -0.74 -0.08 0.00 -1.15 0.00 0.00 33.47 31.39 3hou s TRP 146 CO 0.01 -0.09 0.66 -1.54 0.02 0.00 0.00 176.95 176.00 3hou s SER 147 N 0.09 6.67 0.45 2.95 1.04 -1.26 0.23 113.70 123.87 3hou s SER 147 Ca -0.02 1.10 0.12 0.00 0.48 0.00 0.00 55.95 57.64 3hou s SER 147 Cb -0.08 -2.30 1.02 0.00 0.10 0.00 0.00 66.02 64.76 3hou s SER 147 CO 0.00 -0.17 2.05 -0.37 0.98 0.00 0.00 173.24 175.73 3hou h VAL 148 N 1.86 1.09 0.01 5.02 -1.51 -1.70 -1.69 116.25 119.33 3hou h VAL 148 Ca -0.47 -0.34 0.00 0.00 -1.23 0.00 0.00 66.70 64.65 3hou h VAL 148 Cb 1.17 1.02 -0.01 0.00 -2.13 0.00 0.00 31.29 31.35 3hou h VAL 148 CO 0.67 0.11 -0.06 -0.33 -1.23 0.00 0.00 177.57 176.73 3hou h GLU 149 N 0.16 -0.07 -0.39 5.19 5.08 -1.82 -3.15 114.58 119.59 3hou h GLU 149 Ca 0.04 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.46 3hou h GLU 149 Cb 0.14 0.02 -0.08 0.00 0.50 0.00 0.00 28.75 29.32 3hou h GLU 149 CO 0.00 -0.05 -0.51 0.93 -1.00 0.00 0.00 179.01 178.38 3hou h GLU 150 N -0.08 -0.38 -6.22 2.33 5.08 -1.81 -3.42 114.58 110.09 3hou h GLU 150 Ca 0.00 0.03 -0.71 0.00 -1.00 0.00 0.00 59.36 57.68 3hou h GLU 150 Cb 0.08 0.09 0.04 0.00 0.50 0.00 0.00 28.75 29.46 3hou h GLU 150 CO -0.04 -0.25 0.55 1.28 -1.00 0.00 0.00 179.01 179.55 3hou n LEU 151 N -5.40 1.72 -4.75 1.33 4.77 -0.69 -4.94 117.00 109.04 3hou n LEU 151 Ca -0.03 1.11 -0.30 0.00 -0.03 0.00 0.00 56.01 56.77 3hou n LEU 151 Cb 0.35 -1.15 0.12 0.00 -2.33 0.00 0.00 43.42 40.40 3hou n LEU 151 CO 0.02 -0.94 0.68 -0.63 -1.33 0.00 0.00 177.39 175.20 3hou s ILE 152 N 1.28 2.85 -0.39 -0.08 1.01 -0.92 -4.80 121.20 120.15 3hou s ILE 152 Ca 0.89 0.28 0.10 0.00 0.00 0.00 0.00 60.65 61.92 3hou s ILE 152 Cb -1.01 -2.84 0.31 0.00 0.01 0.00 0.00 42.46 38.93 3hou s ILE 152 CO 0.53 -0.36 0.66 1.33 0.00 0.00 0.00 174.94 177.10 3hou n VAL 153 N -3.71 -0.22 0.00 2.92 0.24 -1.26 -1.97 118.33 114.33 3hou n VAL 153 Ca 0.07 -4.43 0.00 0.00 -2.04 0.00 0.00 64.34 57.94 3hou n VAL 153 Cb 0.55 -0.91 0.00 0.00 -1.47 0.00 0.00 33.84 32.01 3hou n VAL 153 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 3hou n ASP 154 N 0.67 0.00 0.00 -1.34 -0.08 -1.26 -5.06 116.55 109.47 3hou n ASP 154 Ca 0.24 0.85 0.00 0.00 -1.51 0.00 0.00 54.79 54.36 3hou n ASP 154 Cb 0.60 -0.47 0.00 0.00 2.34 0.00 0.00 41.12 43.60 3hou n ASP 154 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50