#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dgt s SER 69 N 0.00 5.38 -0.24 1.61 0.15 -1.26 -5.08 113.70 114.26 2dgt s SER 69 Ca 0.00 -0.01 -0.02 0.00 0.70 0.00 0.00 55.95 56.62 2dgt s SER 69 Cb 0.00 -1.92 0.08 0.00 -1.71 0.00 0.00 66.02 62.47 2dgt s SER 69 CO 0.00 0.14 0.06 -0.55 1.20 0.00 0.00 173.24 174.08 2dgt s SER 70 N 0.57 3.43 -0.72 5.45 0.15 -1.26 -4.86 113.70 116.45 2dgt s SER 70 Ca 0.02 -1.17 -0.02 0.00 0.70 0.00 0.00 55.95 55.48 2dgt s SER 70 Cb -0.13 -0.73 -0.02 0.00 -1.71 0.00 0.00 66.02 63.43 2dgt s SER 70 CO 0.02 -0.35 0.62 0.61 1.20 0.00 0.00 173.24 175.33 2dgt n GLY 71 N 4.96 -0.21 3.84 9.45 0.00 -1.26 -5.01 105.19 116.95 2dgt n GLY 71 Ca -0.07 0.05 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 2dgt n GLY 71 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dgt s SER 72 N -3.61 6.85 -0.75 1.61 1.04 -1.26 -5.04 113.70 112.54 2dgt s SER 72 Ca 0.12 1.19 0.03 0.00 0.48 0.00 0.00 55.95 57.78 2dgt s SER 72 Cb -0.02 -2.33 0.19 0.00 0.10 0.00 0.00 66.02 63.96 2dgt s SER 72 CO 0.47 0.00 0.60 -1.20 0.98 0.00 0.00 173.24 174.09 2dgt n SER 73 N 0.44 3.43 -4.59 7.02 7.64 -1.26 -5.06 113.62 121.23 2dgt n SER 73 Ca -0.02 -3.22 -0.40 0.00 1.01 0.00 0.00 58.87 56.24 2dgt n SER 73 Cb 0.52 -0.83 -0.09 0.00 -1.01 0.00 0.00 64.21 62.80 2dgt n SER 73 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dgt s GLY 74 N -1.27 1.88 -0.03 0.23 0.00 -1.26 -4.97 107.32 101.90 2dgt s GLY 74 Ca 0.27 -0.91 -0.25 0.00 0.00 0.00 0.00 44.72 43.83 2dgt s GLY 74 CO -0.14 1.00 1.20 0.50 0.00 0.00 0.00 173.10 175.66 2dgt h LYS 75 N 8.26 0.09 -0.51 2.90 1.57 -2.01 -3.27 116.57 123.60 2dgt h LYS 75 Ca -0.31 -0.06 0.07 0.00 -1.87 0.00 0.00 60.65 58.49 2dgt h LYS 75 Cb 1.16 0.01 -0.06 0.00 0.08 0.00 0.00 32.23 33.41 2dgt h LYS 75 CO 0.66 0.64 0.16 0.00 -0.57 0.00 0.00 179.45 180.35 2dgt h ALA 76 N 0.45 0.61 -1.45 3.86 0.00 -1.93 -3.43 119.26 117.37 2dgt h ALA 76 Ca 0.00 0.08 -0.46 0.00 0.00 0.00 0.00 54.91 54.52 2dgt h ALA 76 Cb 0.64 0.06 0.10 0.00 0.00 0.00 0.00 17.79 18.59 2dgt h ALA 76 CO 0.01 -0.24 0.17 -1.12 0.00 0.00 0.00 179.25 178.07 2dgt s SER 77 N -5.37 4.10 0.04 0.00 0.01 -1.23 -4.48 113.70 106.77 2dgt s SER 77 Ca -0.13 -0.26 -0.01 0.00 1.31 0.00 0.00 55.95 56.86 2dgt s SER 77 Cb 0.15 -0.05 -0.03 0.00 0.21 0.00 0.00 66.02 66.30 2dgt s SER 77 CO 0.73 -2.04 -0.02 0.42 0.41 0.00 0.00 173.24 172.74 2dgt s THR 78 N -3.29 0.17 -0.09 1.44 -4.23 -0.06 -4.80 115.64 104.78 2dgt s THR 78 Ca 0.68 -1.42 0.01 0.00 -1.18 0.00 0.00 61.69 59.78 2dgt s THR 78 Cb -0.05 -1.01 0.02 0.00 1.34 0.00 0.00 72.50 72.80 2dgt s THR 78 CO 0.46 -0.78 -0.11 -0.75 -0.54 0.00 0.00 174.62 172.90 2dgt s LYS 79 N -2.91 1.75 -0.23 3.99 2.47 -1.26 0.12 119.74 123.66 2dgt s LYS 79 Ca -0.02 -0.39 -0.02 0.00 -1.56 0.00 0.00 55.97 53.98 2dgt s LYS 79 Cb 0.01 -1.58 0.02 0.00 -1.46 0.00 0.00 37.83 34.81 2dgt s LYS 79 CO -0.06 -0.10 -0.07 -0.51 0.16 0.00 0.00 175.35 174.76 2dgt s LEU 80 N 1.11 2.98 0.01 5.43 1.43 -0.32 -0.75 118.68 128.56 2dgt s LEU 80 Ca -0.06 -0.71 -0.20 0.00 -1.03 0.00 0.00 54.13 52.13 2dgt s LEU 80 Cb -0.14 -1.66 -0.06 0.00 0.03 0.00 0.00 46.19 44.36 2dgt s LEU 80 CO -0.02 -0.08 0.58 -2.28 0.23 0.00 0.00 176.35 174.77 2dgt s HIS 81 N 1.37 3.70 0.07 0.29 5.65 0.20 -0.05 115.29 126.53 2dgt s HIS 81 Ca 0.02 1.19 0.09 0.00 0.25 0.00 0.00 55.06 56.61 2dgt s HIS 81 Cb -0.15 -2.57 -0.03 0.00 -1.18 0.00 0.00 32.58 28.65 2dgt s HIS 81 CO -0.05 0.41 -0.23 0.08 -0.65 0.00 0.00 174.74 174.30 2dgt s VAL 82 N -0.39 1.87 0.23 0.89 1.01 0.30 -1.13 120.40 123.18 2dgt s VAL 82 Ca 0.30 -1.42 0.05 0.00 0.00 0.00 0.00 61.98 60.92 2dgt s VAL 82 Cb -0.18 -1.64 -0.05 0.00 0.00 0.00 0.00 36.38 34.50 2dgt s VAL 82 CO 0.17 0.15 -0.06 -0.83 0.00 0.00 0.00 175.10 174.53 2dgt s GLY 83 N -1.52 1.55 -1.12 4.51 0.00 -0.42 -0.12 107.32 110.20 2dgt s GLY 83 Ca 0.09 -1.75 -0.03 0.00 0.00 0.00 0.00 44.72 43.03 2dgt s GLY 83 CO 0.03 -1.73 0.96 -2.01 0.00 0.00 0.00 173.10 170.35 2dgt n ASN 84 N -0.43 -4.31 -4.91 1.64 5.15 0.62 -2.07 115.26 110.94 2dgt n ASN 84 Ca -0.06 -0.66 -0.27 0.00 -0.60 0.00 0.00 54.58 52.98 2dgt n ASN 84 Cb 0.63 -5.16 -0.00 0.00 -0.53 0.00 0.00 39.78 34.72 2dgt n ASN 84 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2dgt s ILE 85 N -3.37 4.91 0.39 -1.44 -1.09 -0.85 -4.08 121.20 115.67 2dgt s ILE 85 Ca 0.23 0.19 -0.22 0.00 -2.23 0.00 0.00 60.65 58.61 2dgt s ILE 85 Cb -0.03 -3.86 -0.11 0.00 -1.58 0.00 0.00 42.46 36.88 2dgt s ILE 85 CO 0.73 -0.85 0.94 -0.55 -1.23 0.00 0.00 174.94 173.99 2dgt s SER 86 N -4.11 7.06 0.17 3.58 0.15 -1.26 -4.70 113.70 114.59 2dgt s SER 86 Ca 0.47 1.72 0.20 0.00 0.70 0.00 0.00 55.95 59.05 2dgt s SER 86 Cb -0.10 -2.55 0.85 0.00 -1.71 0.00 0.00 66.02 62.51 2dgt s SER 86 CO 0.45 -0.26 1.62 -0.81 1.20 0.00 0.00 173.24 175.43 2dgt n PRO 87 N -0.25 0.12 -0.11 5.44 -0.04 -1.26 -2.26 135.00 136.64 2dgt n PRO 87 Ca 0.05 0.37 0.05 0.00 -0.04 0.00 0.00 63.50 63.93 2dgt n PRO 87 Cb 0.53 -1.74 0.10 0.00 -0.04 0.00 0.00 33.50 32.35 2dgt n PRO 87 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2dgt n THR 88 N -1.97 1.41 -1.76 0.52 -2.24 -1.26 -5.05 114.28 103.93 2dgt n THR 88 Ca 0.03 -1.45 -0.41 0.00 -2.27 0.00 0.00 64.05 59.94 2dgt n THR 88 Cb 0.20 0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.64 2dgt n THR 88 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dgt s THR 90 N -1.13 2.65 0.33 0.00 -4.23 -1.26 -5.01 115.64 106.99 2dgt s THR 90 Ca 0.55 -0.86 0.10 0.00 -1.18 0.00 0.00 61.69 60.30 2dgt s THR 90 Cb -0.49 -2.02 0.32 0.00 1.34 0.00 0.00 72.50 71.65 2dgt s THR 90 CO 0.63 0.57 1.74 0.78 -0.54 0.00 0.00 174.62 177.80 2dgt h ASN 91 N 5.77 0.66 0.50 3.99 4.21 -1.96 0.84 115.58 129.59 2dgt h ASN 91 Ca -0.39 0.13 -0.04 0.00 1.21 0.00 0.00 56.30 57.20 2dgt h ASN 91 Cb 1.16 0.02 -0.01 0.00 -1.12 0.00 0.00 38.32 38.38 2dgt h ASN 91 CO 0.50 0.12 -0.21 -0.61 -1.29 0.00 0.00 177.43 175.94 2dgt h GLN 92 N 0.58 0.00 0.01 0.81 4.15 -1.98 0.01 115.11 118.69 2dgt h GLN 92 Ca 0.63 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 60.05 2dgt h GLN 92 Cb 1.22 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.91 2dgt h GLN 92 CO -0.44 0.21 -0.00 0.93 -1.93 0.00 0.00 178.83 177.59 2dgt h GLU 93 N 0.00 -0.01 0.57 1.69 4.39 0.24 -2.81 114.58 118.65 2dgt h GLU 93 Ca -0.00 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 2dgt h GLU 93 Cb 0.52 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.17 2dgt h GLU 93 CO 0.03 0.74 -0.27 1.25 -1.16 0.00 0.00 179.01 179.59 2dgt h LEU 94 N -0.97 -0.65 0.19 1.33 5.85 -1.15 -2.52 115.31 117.38 2dgt h LEU 94 Ca -0.00 -0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.69 2dgt h LEU 94 Cb 0.76 0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.91 2dgt h LEU 94 CO 0.00 -0.30 -0.53 -0.09 -0.34 0.00 0.00 178.44 177.18 2dgt h ARG 95 N -1.02 -0.77 -0.80 1.25 2.43 -1.18 -1.88 114.38 112.41 2dgt h ARG 95 Ca -0.08 0.05 0.14 0.00 -0.81 0.00 0.00 59.98 59.29 2dgt h ARG 95 Cb 0.65 0.18 -0.15 0.00 -0.42 0.00 0.00 29.97 30.23 2dgt h ARG 95 CO 0.13 -0.51 -0.29 0.00 -1.51 0.00 0.00 179.97 177.78 2dgt h ALA 96 N -0.60 0.27 -0.82 2.80 0.00 -1.58 0.63 119.26 119.96 2dgt h ALA 96 Ca -0.02 0.26 0.13 0.00 0.00 0.00 0.00 54.91 55.28 2dgt h ALA 96 Cb 0.78 0.77 -0.09 0.00 0.00 0.00 0.00 17.79 19.26 2dgt h ALA 96 CO -0.25 -0.54 0.44 -0.22 0.00 0.00 0.00 179.25 178.67 2dgt h LYS 97 N -0.05 0.65 0.00 0.00 3.64 -0.97 0.20 116.57 120.04 2dgt h LYS 97 Ca 0.34 -0.04 -0.13 0.00 -1.27 0.00 0.00 60.65 59.54 2dgt h LYS 97 Cb 0.59 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.24 2dgt h LYS 97 CO -0.84 0.43 -0.64 0.74 -2.27 0.00 0.00 179.45 176.87 2dgt h PHE 98 N 0.67 0.00 0.00 1.91 -1.00 0.57 -3.02 116.94 116.07 2dgt h PHE 98 Ca 0.43 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 61.19 2dgt h PHE 98 Cb 0.54 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.09 2dgt h PHE 98 CO -0.09 0.64 -0.11 0.93 -1.61 0.00 0.00 178.31 178.08 2dgt h GLU 99 N 0.00 0.00 0.00 1.51 5.08 0.21 -1.71 114.58 119.67 2dgt h GLU 99 Ca -0.01 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2dgt h GLU 99 Cb 1.20 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.45 2dgt h GLU 99 CO 0.08 0.11 -0.02 0.93 -1.00 0.00 0.00 179.01 179.11 2dgt h GLU 100 N 0.00 0.00 0.01 2.33 5.08 -1.30 -2.98 114.58 117.72 2dgt h GLU 100 Ca -0.00 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.04 2dgt h GLU 100 Cb 0.27 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.47 2dgt h GLU 100 CO 0.01 0.02 -1.72 0.66 -1.00 0.00 0.00 179.01 176.98 2dgt n TYR 101 N -3.46 0.69 -3.99 4.33 4.02 -0.66 -5.06 117.16 113.03 2dgt n TYR 101 Ca -0.03 0.29 -0.10 0.00 -0.01 0.00 0.00 57.90 58.05 2dgt n TYR 101 Cb 0.12 -1.07 -0.04 0.00 -0.02 0.00 0.00 39.34 38.32 2dgt n TYR 101 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 2dgt s GLY 102 N -5.12 0.65 -1.06 2.72 0.00 -1.11 -4.83 107.32 98.56 2dgt s GLY 102 Ca -0.32 -0.95 -0.23 0.00 0.00 0.00 0.00 44.72 43.22 2dgt s GLY 102 CO 0.57 -0.64 1.94 2.56 0.00 0.00 0.00 173.10 177.53 2dgt s PRO 103 N -3.74 2.52 0.38 2.90 0.04 -1.26 -4.04 135.00 131.79 2dgt s PRO 103 Ca 0.23 -0.79 -0.24 0.00 0.04 0.00 0.00 61.00 60.24 2dgt s PRO 103 Cb -0.01 -5.17 -0.12 0.00 0.04 0.00 0.00 34.50 29.24 2dgt s PRO 103 CO 0.11 -3.72 0.77 0.28 0.04 0.00 0.00 177.00 174.48 2dgt n VAL 104 N 7.84 2.05 -0.13 -0.36 0.31 -1.26 -4.02 118.33 122.75 2dgt n VAL 104 Ca 0.43 -0.50 -0.28 0.00 -0.01 0.00 0.00 64.34 63.98 2dgt n VAL 104 Cb 0.47 -0.77 -0.09 0.00 -0.91 0.00 0.00 33.84 32.53 2dgt n VAL 104 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 2dgt n ILE 105 N -0.50 1.53 -3.65 2.52 5.41 0.72 -4.92 119.36 120.47 2dgt n ILE 105 Ca 0.11 -0.33 -0.05 0.00 1.00 0.00 0.00 62.75 63.48 2dgt n ILE 105 Cb 0.37 -1.93 -0.07 0.00 -0.71 0.00 0.00 39.64 37.30 2dgt n ILE 105 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 2dgt s GLU 106 N -2.55 0.58 0.04 0.38 -1.05 -1.06 -5.01 118.70 110.04 2dgt s GLU 106 Ca -0.38 1.25 0.08 0.00 -0.15 0.00 0.00 54.97 55.78 2dgt s GLU 106 Cb 0.14 0.43 -0.03 0.00 -0.44 0.00 0.00 34.13 34.23 2dgt s GLU 106 CO 0.48 -0.18 -0.23 0.00 0.95 0.00 0.00 175.26 176.28 2dgt s ASP 108 N -1.31 -0.10 0.18 0.00 1.01 -0.70 -5.01 116.67 110.73 2dgt s ASP 108 Ca 0.13 0.25 -0.01 0.00 0.71 0.00 0.00 52.55 53.63 2dgt s ASP 108 Cb -0.10 0.19 -0.04 0.00 1.01 0.00 0.00 42.92 43.97 2dgt s ASP 108 CO 0.03 -0.10 0.36 -0.63 0.21 0.00 0.00 175.17 175.05 2dgt s ILE 109 N 0.69 5.23 0.28 0.77 1.01 -1.26 -1.07 121.20 126.84 2dgt s ILE 109 Ca -0.05 -0.34 0.02 0.00 0.00 0.00 0.00 60.65 60.28 2dgt s ILE 109 Cb -0.07 -3.71 -0.04 0.00 0.01 0.00 0.00 42.46 38.65 2dgt s ILE 109 CO -0.03 -0.11 0.16 -0.69 0.00 0.00 0.00 174.94 174.27 2dgt s VAL 110 N -1.80 0.24 0.00 2.92 1.01 0.35 -4.92 120.40 118.21 2dgt s VAL 110 Ca 0.38 -2.00 0.00 0.00 0.00 0.00 0.00 61.98 60.36 2dgt s VAL 110 Cb -0.11 -2.52 0.00 0.00 0.00 0.00 0.00 36.38 33.74 2dgt s VAL 110 CO 0.28 0.00 0.56 0.29 0.00 0.00 0.00 175.10 176.23 2dgt n LYS 111 N -0.50 0.00 -0.14 2.72 5.02 -1.26 -3.25 118.16 120.75 2dgt n LYS 111 Ca 0.02 0.56 0.09 0.00 -2.02 0.00 0.00 58.31 56.96 2dgt n LYS 111 Cb 0.65 -0.94 0.13 0.00 -0.02 0.00 0.00 35.03 34.85 2dgt n LYS 111 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2dgt n ASP 112 N -1.76 2.08 -3.52 4.39 9.92 -1.26 -4.66 116.55 121.75 2dgt n ASP 112 Ca 0.00 -3.02 -0.13 0.00 -0.53 0.00 0.00 54.79 51.11 2dgt n ASP 112 Cb 0.00 -0.41 -0.05 0.00 -0.64 0.00 0.00 41.12 40.02 2dgt n ASP 112 CO 0.00 0.00 0.00 -0.72 0.13 0.00 0.00 177.20 176.61 2dgt s TYR 113 N -2.60 0.95 0.35 1.24 1.13 -1.20 0.23 117.35 117.45 2dgt s TYR 113 Ca 0.29 -1.20 -0.15 0.00 -1.41 0.00 0.00 57.07 54.61 2dgt s TYR 113 Cb 0.26 -0.10 0.04 0.00 -1.10 0.00 0.00 41.96 41.06 2dgt s TYR 113 CO 0.02 -1.04 0.73 0.00 -2.51 0.00 0.00 175.55 172.75 2dgt s ALA 114 N -3.40 -0.64 -0.21 9.51 0.00 0.83 0.13 121.76 127.99 2dgt s ALA 114 Ca 0.30 -0.76 -0.04 0.00 0.00 0.00 0.00 51.96 51.46 2dgt s ALA 114 Cb 0.00 0.78 0.11 0.00 0.00 0.00 0.00 23.12 24.01 2dgt s ALA 114 CO 0.17 -0.97 0.31 -0.06 0.00 0.00 0.00 175.76 175.21 2dgt s PHE 115 N -2.77 -0.58 -0.43 0.00 0.40 -0.23 -0.54 117.98 113.83 2dgt s PHE 115 Ca 0.17 0.66 -0.13 0.00 -0.60 0.00 0.00 56.93 57.02 2dgt s PHE 115 Cb -0.05 -0.11 0.06 0.00 0.51 0.00 0.00 43.02 43.43 2dgt s PHE 115 CO 0.11 -0.63 0.31 0.08 0.70 0.00 0.00 175.22 175.80 2dgt s VAL 116 N 2.45 4.86 -0.50 -0.44 1.01 0.93 -1.73 120.40 126.99 2dgt s VAL 116 Ca 0.09 -1.05 -0.29 0.00 0.00 0.00 0.00 61.98 60.73 2dgt s VAL 116 Cb -0.15 -3.85 0.03 0.00 0.00 0.00 0.00 36.38 32.41 2dgt s VAL 116 CO -0.13 -0.45 1.14 -2.28 0.00 0.00 0.00 175.10 173.38 2dgt s HIS 117 N 1.58 2.78 0.60 5.22 2.46 0.12 -1.18 115.29 126.87 2dgt s HIS 117 Ca 0.03 0.66 -0.01 0.00 0.47 0.00 0.00 55.06 56.21 2dgt s HIS 117 Cb -0.22 -4.45 0.05 0.00 -0.13 0.00 0.00 32.58 27.82 2dgt s HIS 117 CO 0.06 -1.32 0.86 -1.64 -2.47 0.00 0.00 174.74 170.22 2dgt s MET 118 N 4.53 2.39 -0.19 2.88 -1.94 0.12 -0.20 119.30 126.89 2dgt s MET 118 Ca 0.47 -0.65 -0.17 0.00 -1.71 0.00 0.00 55.69 53.63 2dgt s MET 118 Cb -0.07 -2.39 -0.06 0.00 2.01 0.00 0.00 34.83 34.32 2dgt s MET 118 CO 0.31 -0.91 -0.33 -1.91 -0.01 0.00 0.00 175.02 172.17 2dgt n GLU 119 N -2.54 0.53 -3.89 2.03 2.13 -1.26 -0.88 120.64 116.77 2dgt n GLU 119 Ca 0.08 0.25 -0.35 0.00 0.66 0.00 0.00 57.16 57.80 2dgt n GLU 119 Cb 0.60 -1.46 -0.05 0.00 0.27 0.00 0.00 31.44 30.79 2dgt n GLU 119 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 2dgt s ARG 120 N -2.81 3.45 0.10 5.31 0.52 -1.26 -3.92 118.95 120.35 2dgt s ARG 120 Ca -0.29 -0.24 -0.29 0.00 -0.52 0.00 0.00 55.73 54.40 2dgt s ARG 120 Cb 0.05 -3.13 -0.11 0.00 0.52 0.00 0.00 34.95 32.28 2dgt s ARG 120 CO 0.42 0.71 1.63 0.00 0.02 0.00 0.00 175.30 178.08 2dgt h ALA 121 N 4.23 -0.56 -1.10 2.13 0.00 -1.92 -1.78 119.26 120.27 2dgt h ALA 121 Ca -0.51 -0.08 0.33 0.00 0.00 0.00 0.00 54.91 54.66 2dgt h ALA 121 Cb 1.20 0.43 -0.13 0.00 0.00 0.00 0.00 17.79 19.29 2dgt h ALA 121 CO 0.65 -0.85 0.67 0.93 0.00 0.00 0.00 179.25 180.65 2dgt h GLU 122 N -0.57 0.28 -0.29 0.00 5.08 -1.98 0.56 114.58 117.66 2dgt h GLU 122 Ca 0.00 -0.02 -0.14 0.00 -1.00 0.00 0.00 59.36 58.21 2dgt h GLU 122 Cb 0.54 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.73 2dgt h GLU 122 CO -0.09 0.19 -0.36 -0.44 -1.00 0.00 0.00 179.01 177.30 2dgt h ASP 123 N 0.29 0.82 0.42 1.42 3.32 -1.68 -2.24 116.42 118.78 2dgt h ASP 123 Ca 0.72 -0.49 -0.02 0.00 0.02 0.00 0.00 57.03 57.25 2dgt h ASP 123 Cb 1.85 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 41.18 2dgt h ASP 123 CO -0.47 1.15 -0.20 0.00 -1.72 0.00 0.00 179.24 178.00 2dgt h ALA 124 N 0.70 -0.57 -0.85 3.45 0.00 0.75 0.62 119.26 123.36 2dgt h ALA 124 Ca 0.04 -0.19 0.15 0.00 0.00 0.00 0.00 54.91 54.91 2dgt h ALA 124 Cb 0.95 0.22 -0.06 0.00 0.00 0.00 0.00 17.79 18.89 2dgt h ALA 124 CO 0.09 -0.65 0.55 0.28 0.00 0.00 0.00 179.25 179.52 2dgt h VAL 125 N -0.91 0.80 0.01 0.00 2.07 -0.79 -1.90 116.25 115.54 2dgt h VAL 125 Ca -0.06 -0.19 -0.00 0.00 0.82 0.00 0.00 66.70 67.27 2dgt h VAL 125 Cb 0.56 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.52 2dgt h VAL 125 CO 0.10 0.10 -0.00 -0.33 0.02 0.00 0.00 177.57 177.45 2dgt h GLU 126 N 0.56 -0.01 -0.37 1.57 4.39 -1.34 -2.45 114.58 116.94 2dgt h GLU 126 Ca 0.42 0.00 0.11 0.00 0.34 0.00 0.00 59.36 60.23 2dgt h GLU 126 Cb 0.82 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.46 2dgt h GLU 126 CO -0.17 0.65 0.45 0.00 -1.16 0.00 0.00 179.01 178.78 2dgt h ALA 127 N 0.30 2.03 0.00 3.43 0.00 -0.20 -1.84 119.26 122.98 2dgt h ALA 127 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2dgt h ALA 127 Cb 0.67 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2dgt h ALA 127 CO 0.00 -0.64 -0.12 0.82 0.00 0.00 0.00 179.25 179.31 2dgt h ILE 128 N 0.00 0.00 -0.46 0.00 2.04 -1.32 -0.96 117.51 116.80 2dgt h ILE 128 Ca 0.18 -0.69 0.13 0.00 1.00 0.00 0.00 64.86 65.48 2dgt h ILE 128 Cb 1.08 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 2dgt h ILE 128 CO -0.00 0.00 0.83 -0.09 0.00 0.00 0.00 178.15 178.89 2dgt h ARG 129 N -0.69 0.00 0.00 2.37 2.43 -1.09 1.56 114.38 118.95 2dgt h ARG 129 Ca 0.00 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.03 2dgt h ARG 129 Cb 0.12 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.65 2dgt h ARG 129 CO 0.00 0.00 -1.34 0.41 -1.51 0.00 0.00 179.97 177.53 2dgt n GLY 130 N -1.53 -0.62 0.00 2.80 0.00 -0.72 -4.37 105.19 100.75 2dgt n GLY 130 Ca 0.10 -0.21 0.11 0.00 0.00 0.00 0.00 46.02 46.01 2dgt n GLY 130 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dgt n LEU 131 N -4.43 0.00 -4.66 0.99 4.77 -0.36 -4.75 117.00 108.56 2dgt n LEU 131 Ca -0.25 0.06 -0.43 0.00 -0.03 0.00 0.00 56.01 55.37 2dgt n LEU 131 Cb 0.59 -0.06 -0.02 0.00 -2.33 0.00 0.00 43.42 41.59 2dgt n LEU 131 CO 0.14 -0.02 1.23 -0.62 -1.33 0.00 0.00 177.39 176.80 2dgt s ASP 132 N -2.12 6.80 -1.08 -1.43 2.15 0.53 -3.31 116.67 118.21 2dgt s ASP 132 Ca 0.30 1.96 -0.02 0.00 0.43 0.00 0.00 52.55 55.22 2dgt s ASP 132 Cb 0.15 -2.54 -0.03 0.00 -0.30 0.00 0.00 42.92 40.20 2dgt s ASP 132 CO 0.27 -0.85 0.92 0.59 -0.17 0.00 0.00 175.17 175.92 2dgt n ASN 133 N 6.90 -3.93 -4.18 -0.34 4.13 -1.11 -4.95 115.26 111.79 2dgt n ASN 133 Ca 0.16 -0.62 -0.32 0.00 1.68 0.00 0.00 54.58 55.47 2dgt n ASN 133 Cb 0.44 -4.92 -0.17 0.00 -1.54 0.00 0.00 39.78 33.59 2dgt n ASN 133 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 2dgt s THR 134 N -3.35 2.02 -0.47 3.41 -4.23 -1.21 -4.93 115.64 106.88 2dgt s THR 134 Ca 0.19 -0.97 -0.31 0.00 -1.18 0.00 0.00 61.69 59.41 2dgt s THR 134 Cb -0.02 -1.77 -0.11 0.00 1.34 0.00 0.00 72.50 71.93 2dgt s THR 134 CO 0.70 0.55 2.33 1.21 -0.54 0.00 0.00 174.62 178.86 2dgt n GLU 135 N 3.88 1.02 -3.68 3.99 2.13 -1.26 -2.93 120.64 123.80 2dgt n GLU 135 Ca -0.20 0.20 -0.37 0.00 0.66 0.00 0.00 57.16 57.45 2dgt n GLU 135 Cb 0.52 -2.69 -0.12 0.00 0.27 0.00 0.00 31.44 29.42 2dgt n GLU 135 CO 0.00 0.00 0.00 0.12 -0.41 0.00 0.00 177.13 176.84 2dgt s PHE 136 N 9.06 3.15 -0.97 4.31 2.19 0.28 -4.47 117.98 131.52 2dgt s PHE 136 Ca 1.09 -0.20 -0.05 0.00 0.33 0.00 0.00 56.93 58.10 2dgt s PHE 136 Cb -0.66 -2.31 0.04 0.00 -1.31 0.00 0.00 43.02 38.78 2dgt s PHE 136 CO 0.41 -0.28 0.23 1.04 1.83 0.00 0.00 175.22 178.45 2dgt n GLN 137 N 4.99 -2.78 0.00 10.12 6.02 -1.26 -0.46 117.38 134.01 2dgt n GLN 137 Ca -0.15 0.39 0.00 0.00 -0.01 0.00 0.00 57.00 57.23 2dgt n GLN 137 Cb 0.51 -5.01 0.00 0.00 1.02 0.00 0.00 30.24 26.76 2dgt n GLN 137 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2dgt n GLY 138 N -0.90 3.12 3.78 1.08 0.00 -1.26 -4.99 105.19 106.02 2dgt n GLY 138 Ca -0.05 -0.91 -0.36 0.00 0.00 0.00 0.00 46.02 44.71 2dgt n GLY 138 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dgt s LYS 139 N 0.00 3.85 0.05 1.61 -2.85 0.39 -4.92 119.74 117.87 2dgt s LYS 139 Ca 0.00 -0.20 -0.30 0.00 -1.00 0.00 0.00 55.97 54.47 2dgt s LYS 139 Cb 0.00 -3.30 -0.04 0.00 -2.06 0.00 0.00 37.83 32.43 2dgt s LYS 139 CO 0.00 0.50 0.99 0.50 0.10 0.00 0.00 175.35 177.44 2dgt s ARG 140 N -0.21 4.60 0.07 1.78 3.52 -1.26 1.00 118.95 128.44 2dgt s ARG 140 Ca 0.10 1.47 0.04 0.00 -0.13 0.00 0.00 55.73 57.22 2dgt s ARG 140 Cb -0.11 -3.42 -0.04 0.00 -1.56 0.00 0.00 34.95 29.82 2dgt s ARG 140 CO 0.01 0.03 -0.03 0.00 -0.81 0.00 0.00 175.30 174.50 2dgt s MET 141 N 0.61 2.51 -0.27 5.12 0.00 -1.15 -4.76 119.30 121.37 2dgt s MET 141 Ca 0.51 -0.82 -0.15 0.00 0.00 0.00 0.00 55.69 55.23 2dgt s MET 141 Cb -0.23 -2.51 -0.04 0.00 0.00 0.00 0.00 34.83 32.05 2dgt s MET 141 CO 0.29 0.56 0.37 -1.01 0.00 0.00 0.00 175.02 175.23 2dgt s HIS 142 N -1.21 3.25 -0.15 3.16 0.09 -0.88 -2.73 115.29 116.82 2dgt s HIS 142 Ca 0.23 0.42 -0.05 0.00 -0.00 0.00 0.00 55.06 55.66 2dgt s HIS 142 Cb -0.11 -2.57 -0.03 0.00 -0.00 0.00 0.00 32.58 29.86 2dgt s HIS 142 CO 0.15 -0.22 0.02 0.08 -0.00 0.00 0.00 174.74 174.76 2dgt s VAL 143 N 2.04 4.39 0.24 -0.90 1.01 -1.26 -1.30 120.40 124.62 2dgt s VAL 143 Ca 0.15 -0.19 -0.22 0.00 0.00 0.00 0.00 61.98 61.73 2dgt s VAL 143 Cb -0.16 -2.93 0.03 0.00 0.00 0.00 0.00 36.38 33.33 2dgt s VAL 143 CO 0.10 0.51 0.71 0.00 0.00 0.00 0.00 175.10 176.41 2dgt s GLN 144 N 0.03 1.64 -0.02 2.72 -2.07 -0.28 -4.73 119.66 116.96 2dgt s GLN 144 Ca 0.03 -0.85 -0.30 0.00 -1.82 0.00 0.00 55.36 52.42 2dgt s GLN 144 Cb -0.13 0.59 -0.08 0.00 -1.09 0.00 0.00 33.01 32.31 2dgt s GLN 144 CO 0.02 -0.75 2.00 -0.51 -1.32 0.00 0.00 175.29 174.73 2dgt s LEU 145 N -2.88 4.23 0.31 2.60 2.01 -1.26 0.60 118.68 124.29 2dgt s LEU 145 Ca 0.09 2.49 0.06 0.00 0.01 0.00 0.00 54.13 56.78 2dgt s LEU 145 Cb -0.05 -3.53 0.86 0.00 0.01 0.00 0.00 46.19 43.49 2dgt s LEU 145 CO 0.02 -1.23 1.62 -1.28 1.01 0.00 0.00 176.35 176.50 2dgt h SER 146 N 11.42 0.02 -3.36 2.29 0.87 -1.24 -3.38 113.55 120.18 2dgt h SER 146 Ca -0.47 0.22 -0.58 0.00 -1.23 0.00 0.00 61.79 59.73 2dgt h SER 146 Cb 1.23 0.29 -0.34 0.00 -0.44 0.00 0.00 62.40 63.15 2dgt h SER 146 CO 0.95 -0.23 -0.84 0.28 -0.53 0.00 0.00 176.83 176.46 2dgt s THR 147 N -5.85 1.47 -0.68 2.23 -1.32 -1.26 -4.89 115.64 105.34 2dgt s THR 147 Ca -0.12 -0.66 -0.22 0.00 -1.21 0.00 0.00 61.69 59.49 2dgt s THR 147 Cb 0.28 -1.31 0.08 0.00 -1.51 0.00 0.00 72.50 70.04 2dgt s THR 147 CO 0.78 0.43 0.95 -0.44 -2.21 0.00 0.00 174.62 174.13 2dgt s SER 148 N 0.66 6.21 -0.39 8.08 0.01 -1.26 -5.00 113.70 122.00 2dgt s SER 148 Ca -0.14 -1.13 -0.29 0.00 1.31 0.00 0.00 55.95 55.71 2dgt s SER 148 Cb -0.16 -2.41 0.02 0.00 0.21 0.00 0.00 66.02 63.68 2dgt s SER 148 CO 0.04 -1.38 1.18 -0.60 0.41 0.00 0.00 173.24 172.89 2dgt s ARG 149 N 3.81 3.85 0.03 12.44 3.52 -1.26 -4.94 118.95 136.41 2dgt s ARG 149 Ca 0.22 0.88 -0.26 0.00 -0.13 0.00 0.00 55.73 56.44 2dgt s ARG 149 Cb -0.17 -3.86 -0.14 0.00 -1.56 0.00 0.00 34.95 29.22 2dgt s ARG 149 CO 0.08 -1.21 1.29 -0.07 -0.81 0.00 0.00 175.30 174.58 2dgt h LEU 150 N 10.91 -0.79 -8.52 -0.88 -0.00 -2.07 -3.41 115.31 110.55 2dgt h LEU 150 Ca -0.23 0.03 -0.67 0.00 -0.00 0.00 0.00 57.88 57.00 2dgt h LEU 150 Cb 1.07 0.20 -0.23 0.00 -0.00 0.00 0.00 40.66 41.70 2dgt h LEU 150 CO 1.08 -0.53 -0.57 -0.13 -0.00 0.00 0.00 178.44 178.29 2dgt s ARG 151 N -4.88 3.28 -0.71 1.13 3.00 -1.26 -5.05 118.95 114.47 2dgt s ARG 151 Ca -0.14 -0.75 -0.15 0.00 0.00 0.00 0.00 55.73 54.70 2dgt s ARG 151 Cb 0.01 -3.51 0.18 0.00 0.00 0.00 0.00 34.95 31.63 2dgt s ARG 151 CO 0.41 -0.42 0.66 0.95 0.00 0.00 0.00 175.30 176.90 2dgt s THR 152 N 1.59 5.43 -1.10 0.02 -4.23 -1.26 -4.49 115.64 111.60 2dgt s THR 152 Ca 0.04 -2.04 -0.06 0.00 -1.18 0.00 0.00 61.69 58.45 2dgt s THR 152 Cb -0.17 -4.42 0.01 0.00 1.34 0.00 0.00 72.50 69.26 2dgt s THR 152 CO 0.05 -0.97 0.95 0.00 -0.54 0.00 0.00 174.62 174.12 2dgt n ALA 153 N 4.56 -1.20 -1.63 3.99 0.00 -1.26 -4.88 120.51 120.09 2dgt n ALA 153 Ca 0.02 0.26 -0.47 0.00 0.00 0.00 0.00 53.44 53.26 2dgt n ALA 153 Cb 0.44 -4.17 -0.04 0.00 0.00 0.00 0.00 19.45 15.68 2dgt n ALA 153 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2dgt n SER 154 N -2.33 3.37 -4.07 0.00 3.41 -1.26 -4.95 113.62 107.78 2dgt n SER 154 Ca -0.04 0.73 -0.09 0.00 -0.26 0.00 0.00 58.87 59.21 2dgt n SER 154 Cb 0.57 -1.42 -0.11 0.00 -0.26 0.00 0.00 64.21 62.99 2dgt n SER 154 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dgt s GLY 155 N 5.45 0.46 0.00 5.00 0.00 -1.26 -5.02 107.32 111.96 2dgt s GLY 155 Ca 0.96 -0.97 0.15 0.00 0.00 0.00 0.00 44.72 44.87 2dgt s GLY 155 CO 0.46 -1.05 1.38 -1.55 0.00 0.00 0.00 173.10 172.34 2dgt n PRO 156 N 0.79 0.33 -3.38 2.90 -0.04 -1.26 -4.85 135.00 129.49 2dgt n PRO 156 Ca -0.18 0.08 -0.24 0.00 -0.04 0.00 0.00 63.50 63.11 2dgt n PRO 156 Cb 0.58 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.57 2dgt n PRO 156 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2dgt n SER 157 N -1.16 -5.42 0.02 3.54 7.64 -1.26 -4.90 113.62 112.08 2dgt n SER 157 Ca 0.09 -0.45 -0.13 0.00 1.01 0.00 0.00 58.87 59.39 2dgt n SER 157 Cb 0.09 -4.36 -0.09 0.00 -1.01 0.00 0.00 64.21 58.84 2dgt n SER 157 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2dgt h SER 158 N -1.68 -0.05 0.00 6.43 4.64 -2.04 -3.57 113.55 117.27 2dgt h SER 158 Ca -0.53 -0.39 0.00 0.00 -0.47 0.00 0.00 61.79 60.40 2dgt h SER 158 Cb 1.35 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.46 2dgt h SER 158 CO 0.58 0.37 0.00 0.61 -0.87 0.00 0.00 176.83 177.52