#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dgt n SER 69 N 0.00 0.66 -4.60 1.61 7.64 -1.26 -5.00 113.62 112.67 2dgt n SER 69 Ca 0.00 0.00 -0.39 0.00 1.01 0.00 0.00 58.87 59.49 2dgt n SER 69 Cb 0.00 -0.01 -0.09 0.00 -1.01 0.00 0.00 64.21 63.10 2dgt n SER 69 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2dgt s SER 70 N -4.89 6.27 -0.87 6.43 1.04 -1.26 -5.00 113.70 115.42 2dgt s SER 70 Ca -0.01 0.26 0.01 0.00 0.48 0.00 0.00 55.95 56.69 2dgt s SER 70 Cb 0.00 -2.22 0.31 0.00 0.10 0.00 0.00 66.02 64.22 2dgt s SER 70 CO 0.01 -0.22 1.40 0.61 0.98 0.00 0.00 173.24 176.01 2dgt n GLY 71 N 4.68 5.65 3.10 7.32 0.00 -1.26 -4.94 105.19 119.74 2dgt n GLY 71 Ca -0.08 -2.68 -0.36 0.00 0.00 0.00 0.00 46.02 42.90 2dgt n GLY 71 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dgt s SER 72 N -2.14 5.22 -0.09 1.61 0.15 -1.26 -4.96 113.70 112.23 2dgt s SER 72 Ca 0.40 -2.66 -0.03 0.00 0.70 0.00 0.00 55.95 54.36 2dgt s SER 72 Cb 0.18 -1.84 -0.06 0.00 -1.71 0.00 0.00 66.02 62.59 2dgt s SER 72 CO -0.07 -0.41 2.66 -1.20 1.20 0.00 0.00 173.24 175.42 2dgt n SER 73 N 3.74 5.59 -3.18 5.45 7.64 -1.26 -4.44 113.62 127.15 2dgt n SER 73 Ca 0.05 -2.61 -0.23 0.00 1.01 0.00 0.00 58.87 57.09 2dgt n SER 73 Cb 0.38 -1.23 -0.07 0.00 -1.01 0.00 0.00 64.21 62.29 2dgt n SER 73 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dgt n GLY 74 N 1.63 2.59 3.17 0.23 0.00 -1.26 -5.10 105.19 106.46 2dgt n GLY 74 Ca 0.25 -1.43 -0.12 0.00 0.00 0.00 0.00 46.02 44.71 2dgt n GLY 74 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2dgt s LYS 75 N -0.93 0.33 -0.75 1.61 2.20 -1.26 -5.10 119.74 115.85 2dgt s LYS 75 Ca 0.35 0.48 -0.26 0.00 -0.36 0.00 0.00 55.97 56.18 2dgt s LYS 75 Cb 0.16 0.10 -0.02 0.00 -1.51 0.00 0.00 37.83 36.55 2dgt s LYS 75 CO -0.13 -0.08 1.82 0.00 -0.36 0.00 0.00 175.35 176.60 2dgt s ALA 76 N 0.49 2.07 0.02 3.13 0.00 -1.26 -4.84 121.76 121.38 2dgt s ALA 76 Ca -0.03 -1.11 -0.24 0.00 0.00 0.00 0.00 51.96 50.59 2dgt s ALA 76 Cb -0.04 -4.40 0.08 0.00 0.00 0.00 0.00 23.12 18.75 2dgt s ALA 76 CO -0.03 -4.15 1.08 -1.13 0.00 0.00 0.00 175.76 171.53 2dgt n SER 77 N 12.67 -1.16 -3.98 0.00 3.41 -1.25 -4.94 113.62 118.36 2dgt n SER 77 Ca 0.27 -1.35 -0.09 0.00 -0.26 0.00 0.00 58.87 57.44 2dgt n SER 77 Cb 0.50 1.83 -0.10 0.00 -0.26 0.00 0.00 64.21 66.18 2dgt n SER 77 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2dgt s THR 78 N -2.05 0.15 -0.03 6.66 -4.23 -0.35 -4.85 115.64 110.93 2dgt s THR 78 Ca 0.25 -1.22 0.02 0.00 -1.18 0.00 0.00 61.69 59.55 2dgt s THR 78 Cb -0.01 -0.91 0.01 0.00 1.34 0.00 0.00 72.50 72.93 2dgt s THR 78 CO 0.01 -0.68 -0.06 -0.75 -0.54 0.00 0.00 174.62 172.60 2dgt s LYS 79 N -2.69 0.78 -0.02 3.99 2.47 -1.26 0.03 119.74 123.04 2dgt s LYS 79 Ca -0.04 -0.20 0.06 0.00 -1.56 0.00 0.00 55.97 54.23 2dgt s LYS 79 Cb -0.01 -0.76 -0.01 0.00 -1.46 0.00 0.00 37.83 35.59 2dgt s LYS 79 CO -0.05 0.04 -0.22 -0.51 0.16 0.00 0.00 175.35 174.77 2dgt s LEU 80 N 0.38 2.03 -0.04 5.43 1.43 -0.22 -1.38 118.68 126.31 2dgt s LEU 80 Ca -0.05 -0.40 -0.01 0.00 -1.03 0.00 0.00 54.13 52.63 2dgt s LEU 80 Cb -0.09 -1.13 -0.04 0.00 0.03 0.00 0.00 46.19 44.96 2dgt s LEU 80 CO 0.00 0.26 0.06 -2.28 0.23 0.00 0.00 176.35 174.62 2dgt s HIS 81 N -0.43 3.27 0.01 0.29 5.65 0.89 -0.51 115.29 124.46 2dgt s HIS 81 Ca 0.06 0.23 0.05 0.00 0.25 0.00 0.00 55.06 55.66 2dgt s HIS 81 Cb -0.09 -1.77 -0.02 0.00 -1.18 0.00 0.00 32.58 29.52 2dgt s HIS 81 CO -0.00 0.54 -0.16 0.08 -0.65 0.00 0.00 174.74 174.55 2dgt s VAL 82 N -1.08 1.30 0.27 0.89 1.01 0.69 -1.18 120.40 122.30 2dgt s VAL 82 Ca 0.19 -0.84 0.06 0.00 0.00 0.00 0.00 61.98 61.39 2dgt s VAL 82 Cb -0.12 -1.11 -0.06 0.00 0.00 0.00 0.00 36.38 35.10 2dgt s VAL 82 CO 0.09 0.26 -0.05 -0.83 0.00 0.00 0.00 175.10 174.57 2dgt s GLY 83 N -0.67 1.80 -1.18 4.51 0.00 -0.24 0.77 107.32 112.31 2dgt s GLY 83 Ca 0.05 -1.89 -0.02 0.00 0.00 0.00 0.00 44.72 42.87 2dgt s GLY 83 CO 0.00 -1.82 0.95 -2.01 0.00 0.00 0.00 173.10 170.22 2dgt n ASN 84 N -0.57 -2.97 -4.87 1.64 5.15 0.33 -2.12 115.26 111.86 2dgt n ASN 84 Ca -0.05 -0.67 -0.31 0.00 -0.60 0.00 0.00 54.58 52.95 2dgt n ASN 84 Cb 0.63 -5.00 -0.01 0.00 -0.53 0.00 0.00 39.78 34.88 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 -3.40 4.69 0.34 -1.44 -1.09 -0.87 -4.21 121.20 115.22 2dgt s ILE 85 Ca 0.11 0.87 -0.22 0.00 -2.23 0.00 0.00 60.65 59.18 2dgt s ILE 85 Cb -0.02 -3.82 -0.10 0.00 -1.58 0.00 0.00 42.46 36.94 2dgt s ILE 85 CO 0.74 -0.96 0.89 -0.55 -1.23 0.00 0.00 174.94 173.83 2dgt s SER 86 N -3.82 7.11 0.09 3.58 0.15 -1.26 -4.78 113.70 114.76 2dgt s SER 86 Ca 0.55 1.66 0.17 0.00 0.70 0.00 0.00 55.95 59.04 2dgt s SER 86 Cb -0.11 -2.52 0.74 0.00 -1.71 0.00 0.00 66.02 62.42 2dgt s SER 86 CO 0.46 -0.16 1.54 -0.81 1.20 0.00 0.00 173.24 175.48 2dgt n PRO 87 N 0.12 0.07 -0.06 5.44 -0.04 -1.26 -2.17 135.00 137.09 2dgt n PRO 87 Ca 0.03 0.31 0.02 0.00 -0.04 0.00 0.00 63.50 63.83 2dgt n PRO 87 Cb 0.52 -1.63 0.06 0.00 -0.04 0.00 0.00 33.50 32.41 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 -1.76 0.80 -1.79 0.52 -2.24 -1.26 -5.04 114.28 103.51 2dgt n THR 88 Ca 0.03 -0.90 -0.38 0.00 -2.27 0.00 0.00 64.05 60.53 2dgt n THR 88 Cb 0.19 0.62 0.04 0.00 -2.10 0.00 0.00 70.33 69.08 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 -1.31 2.48 0.59 0.00 -4.23 -1.26 -4.99 115.64 106.92 2dgt s THR 90 Ca 0.72 -0.90 0.29 0.00 -1.18 0.00 0.00 61.69 60.62 2dgt s THR 90 Cb -0.40 -1.96 0.40 0.00 1.34 0.00 0.00 72.50 71.88 2dgt s THR 90 CO 0.47 0.56 1.69 -1.13 -0.54 0.00 0.00 174.62 175.67 2dgt h ASN 91 N 6.19 0.00 0.95 3.99 -0.00 -1.96 1.14 115.58 125.90 2dgt h ASN 91 Ca -0.31 0.00 -0.22 0.00 -0.00 0.00 0.00 56.30 55.77 2dgt h ASN 91 Cb 1.19 0.00 -0.03 0.00 -0.00 0.00 0.00 38.32 39.49 2dgt h ASN 91 CO 0.50 0.00 -1.04 -0.61 -0.00 0.00 0.00 177.43 176.28 2dgt h GLN 92 N 0.00 0.04 -0.00 6.67 5.75 -1.97 -2.95 115.11 122.65 2dgt h GLN 92 Ca 0.34 -0.06 -0.00 0.00 -0.15 0.00 0.00 58.65 58.78 2dgt h GLN 92 Cb 1.89 0.02 0.00 0.00 1.07 0.00 0.00 27.48 30.46 2dgt h GLN 92 CO -0.00 1.03 -0.00 0.93 -2.65 0.00 0.00 178.83 178.13 2dgt h GLU 93 N 0.01 0.00 0.54 1.69 4.39 0.93 -2.08 114.58 120.07 2dgt h GLU 93 Ca -0.03 -0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.65 2dgt h GLU 93 Cb 1.80 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.45 2dgt h GLU 93 CO 0.14 0.57 -0.28 1.25 -1.16 0.00 0.00 179.01 179.53 2dgt h LEU 94 N -0.56 -0.67 0.19 1.33 5.85 -1.51 -2.24 115.31 117.70 2dgt h LEU 94 Ca 0.00 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 2dgt h LEU 94 Cb 0.57 0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.77 2dgt h LEU 94 CO 0.00 -0.46 -0.23 -0.09 -0.34 0.00 0.00 178.44 177.32 2dgt h ARG 95 N -0.75 -0.41 -0.94 1.25 2.43 -1.63 -1.85 114.38 112.47 2dgt h ARG 95 Ca -0.07 0.03 0.31 0.00 -0.81 0.00 0.00 59.98 59.44 2dgt h ARG 95 Cb 0.59 0.09 -0.17 0.00 -0.42 0.00 0.00 29.97 30.06 2dgt h ARG 95 CO 0.11 -0.28 0.20 0.00 -1.51 0.00 0.00 179.97 178.49 2dgt n ALA 96 N -2.53 0.66 -0.11 2.80 0.00 -0.78 0.12 120.51 120.66 2dgt n ALA 96 Ca -0.05 1.00 -0.09 0.00 0.00 0.00 0.00 53.44 54.30 2dgt n ALA 96 Cb 0.20 -0.82 -0.01 0.00 0.00 0.00 0.00 19.45 18.82 2dgt n ALA 96 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2dgt h LYS 97 N 0.00 0.49 0.00 0.00 3.64 -0.89 -2.25 116.57 117.56 2dgt h LYS 97 Ca 0.66 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.92 2dgt h LYS 97 Cb 1.52 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 33.23 2dgt h LYS 97 CO -0.83 0.36 -0.35 0.74 -2.27 0.00 0.00 179.45 177.10 2dgt h PHE 98 N 0.47 0.00 0.00 1.91 -1.00 0.17 -2.60 116.94 115.89 2dgt h PHE 98 Ca 0.13 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.91 2dgt h PHE 98 Cb -0.00 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.56 2dgt h PHE 98 CO -0.04 0.35 -0.02 0.93 -1.61 0.00 0.00 178.31 177.92 2dgt h GLU 99 N 0.00 0.00 0.00 1.51 5.08 0.03 -1.23 114.58 119.97 2dgt h GLU 99 Ca -0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2dgt h GLU 99 Cb 0.72 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.97 2dgt h GLU 99 CO 0.05 0.02 -0.04 0.93 -1.00 0.00 0.00 179.01 178.96 2dgt h GLU 100 N 0.00 0.00 0.00 2.33 4.39 -1.39 -3.13 114.58 116.78 2dgt h GLU 100 Ca -0.00 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.52 2dgt h GLU 100 Cb 0.07 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.70 2dgt h GLU 100 CO 0.00 0.04 -1.17 0.66 -1.16 0.00 0.00 179.01 177.39 2dgt n TYR 101 N -3.90 0.84 -4.05 4.33 4.02 -0.48 -5.06 117.16 112.85 2dgt n TYR 101 Ca -0.03 0.36 -0.11 0.00 -0.01 0.00 0.00 57.90 58.11 2dgt n TYR 101 Cb 0.13 -0.96 -0.05 0.00 -0.02 0.00 0.00 39.34 38.43 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 -4.75 0.97 -0.96 2.72 0.00 -1.13 -4.85 107.32 99.33 2dgt s GLY 102 Ca -0.26 -1.20 -0.24 0.00 0.00 0.00 0.00 44.72 43.02 2dgt s GLY 102 CO 0.46 -0.86 1.94 2.56 0.00 0.00 0.00 173.10 177.21 2dgt s PRO 103 N -3.71 2.55 0.41 2.90 0.04 -1.26 -4.01 135.00 131.92 2dgt s PRO 103 Ca 0.27 -0.46 -0.24 0.00 0.04 0.00 0.00 61.00 60.61 2dgt s PRO 103 Cb 0.01 -5.10 -0.11 0.00 0.04 0.00 0.00 34.50 29.34 2dgt s PRO 103 CO 0.13 -3.49 0.99 0.28 0.04 0.00 0.00 177.00 174.95 2dgt n VAL 104 N 7.86 2.39 -0.13 -0.36 0.31 -1.26 -3.95 118.33 123.19 2dgt n VAL 104 Ca 0.41 -0.50 -0.25 0.00 -0.01 0.00 0.00 64.34 63.99 2dgt n VAL 104 Cb 0.47 -1.12 -0.08 0.00 -0.91 0.00 0.00 33.84 32.19 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 -0.47 1.51 -3.66 2.52 5.41 0.79 -4.93 119.36 120.54 2dgt n ILE 105 Ca 0.09 -0.26 -0.05 0.00 1.00 0.00 0.00 62.75 63.53 2dgt n ILE 105 Cb 0.39 -1.99 -0.07 0.00 -0.71 0.00 0.00 39.64 37.26 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 -2.60 0.53 0.17 0.38 -1.05 -1.12 -5.01 118.70 110.01 2dgt s GLU 106 Ca -0.36 1.22 0.11 0.00 -0.15 0.00 0.00 54.97 55.78 2dgt s GLU 106 Cb 0.12 0.44 -0.04 0.00 -0.44 0.00 0.00 34.13 34.21 2dgt s GLU 106 CO 0.47 -0.19 -0.24 0.00 0.95 0.00 0.00 175.26 176.25 2dgt s ASP 108 N -2.49 -0.39 -0.03 0.00 1.01 -0.31 -5.00 116.67 109.47 2dgt s ASP 108 Ca 0.18 0.73 -0.06 0.00 0.71 0.00 0.00 52.55 54.11 2dgt s ASP 108 Cb -0.08 0.71 -0.04 0.00 1.01 0.00 0.00 42.92 44.52 2dgt s ASP 108 CO 0.08 -0.14 0.23 -0.63 0.21 0.00 0.00 175.17 174.92 2dgt s ILE 109 N 0.45 5.37 0.42 0.77 1.01 -1.26 -1.23 121.20 126.72 2dgt s ILE 109 Ca -0.02 0.14 0.04 0.00 0.00 0.00 0.00 60.65 60.81 2dgt s ILE 109 Cb -0.04 -3.53 -0.05 0.00 0.01 0.00 0.00 42.46 38.85 2dgt s ILE 109 CO -0.02 0.42 0.03 -0.69 0.00 0.00 0.00 174.94 174.68 2dgt s VAL 110 N -1.23 1.46 0.00 2.92 1.01 0.32 -4.94 120.40 119.94 2dgt s VAL 110 Ca 0.24 -2.00 0.00 0.00 0.00 0.00 0.00 61.98 60.22 2dgt s VAL 110 Cb -0.13 -2.66 0.00 0.00 0.00 0.00 0.00 36.38 33.59 2dgt s VAL 110 CO 0.14 0.00 0.68 0.29 0.00 0.00 0.00 175.10 176.21 2dgt n LYS 111 N -0.99 0.00 -0.06 2.72 4.01 -1.26 -3.41 118.16 119.17 2dgt n LYS 111 Ca -0.08 0.68 0.02 0.00 -0.51 0.00 0.00 58.31 58.42 2dgt n LYS 111 Cb 0.67 -1.14 0.05 0.00 -0.51 0.00 0.00 35.03 34.09 2dgt n LYS 111 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 2dgt n ASP 112 N -1.90 2.30 -3.48 4.39 8.00 -1.26 -4.68 116.55 119.92 2dgt n ASP 112 Ca 0.00 -2.00 -0.22 0.00 0.71 0.00 0.00 54.79 53.28 2dgt n ASP 112 Cb 0.00 -0.08 -0.08 0.00 -0.02 0.00 0.00 41.12 40.95 2dgt n ASP 112 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dgt n TYR 113 N -0.16 -0.54 -3.85 1.24 4.11 -1.22 0.12 117.16 116.86 2dgt n TYR 113 Ca 0.04 -2.83 -0.07 0.00 -0.00 0.00 0.00 57.90 55.04 2dgt n TYR 113 Cb 0.31 0.21 -0.02 0.00 -0.00 0.00 0.00 39.34 39.84 2dgt n TYR 113 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2dgt s ALA 114 N -3.32 -1.24 -0.12 -3.48 0.00 0.23 0.12 121.76 113.95 2dgt s ALA 114 Ca 0.35 -0.29 -0.05 0.00 0.00 0.00 0.00 51.96 51.97 2dgt s ALA 114 Cb 0.02 0.82 0.06 0.00 0.00 0.00 0.00 23.12 24.01 2dgt s ALA 114 CO 0.25 -1.04 0.25 -0.06 0.00 0.00 0.00 175.76 175.16 2dgt s PHE 115 N -3.74 -0.39 -0.25 0.00 0.40 -0.37 -0.22 117.98 113.41 2dgt s PHE 115 Ca 0.11 0.92 -0.04 0.00 -0.60 0.00 0.00 56.93 57.32 2dgt s PHE 115 Cb -0.05 -0.06 0.01 0.00 0.51 0.00 0.00 43.02 43.43 2dgt s PHE 115 CO 0.07 -0.34 -0.01 0.08 0.70 0.00 0.00 175.22 175.72 2dgt s VAL 116 N 2.31 3.40 -0.45 -0.44 1.01 0.34 -1.16 120.40 125.41 2dgt s VAL 116 Ca 0.01 -0.72 -0.25 0.00 0.00 0.00 0.00 61.98 61.02 2dgt s VAL 116 Cb -0.12 -2.67 0.03 0.00 0.00 0.00 0.00 36.38 33.62 2dgt s VAL 116 CO -0.08 0.25 0.89 -2.28 0.00 0.00 0.00 175.10 173.88 2dgt s HIS 117 N 1.44 2.95 0.43 5.22 2.46 0.15 -1.05 115.29 126.89 2dgt s HIS 117 Ca 0.03 0.36 0.02 0.00 0.47 0.00 0.00 55.06 55.94 2dgt s HIS 117 Cb -0.16 -3.88 -0.00 0.00 -0.13 0.00 0.00 32.58 28.41 2dgt s HIS 117 CO -0.02 -1.05 0.64 -1.64 -2.47 0.00 0.00 174.74 170.20 2dgt s MET 118 N 3.63 3.05 -0.13 2.88 -1.94 0.10 -0.15 119.30 126.74 2dgt s MET 118 Ca 0.35 -0.61 -0.10 0.00 -1.71 0.00 0.00 55.69 53.63 2dgt s MET 118 Cb -0.11 -2.61 -0.03 0.00 2.01 0.00 0.00 34.83 34.10 2dgt s MET 118 CO 0.25 -0.23 -0.19 -1.91 -0.01 0.00 0.00 175.02 172.93 2dgt n GLU 119 N -2.01 0.39 -3.91 2.03 2.13 -1.25 -1.22 120.64 116.81 2dgt n GLU 119 Ca 0.01 0.40 -0.35 0.00 0.66 0.00 0.00 57.16 57.88 2dgt n GLU 119 Cb 0.58 -1.47 -0.06 0.00 0.27 0.00 0.00 31.44 30.77 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 -2.19 3.42 0.09 5.31 1.81 -1.26 -3.92 118.95 122.21 2dgt s ARG 120 Ca -0.15 -0.24 -0.22 0.00 -1.72 0.00 0.00 55.73 53.40 2dgt s ARG 120 Cb 0.02 -3.13 -0.13 0.00 -0.45 0.00 0.00 34.95 31.26 2dgt s ARG 120 CO 0.23 0.73 1.69 0.00 -0.68 0.00 0.00 175.30 177.26 2dgt h ALA 121 N 4.41 0.09 -1.08 2.13 0.00 -1.93 -1.89 119.26 120.99 2dgt h ALA 121 Ca -0.52 -0.04 0.33 0.00 0.00 0.00 0.00 54.91 54.68 2dgt h ALA 121 Cb 1.21 -0.03 -0.13 0.00 0.00 0.00 0.00 17.79 18.84 2dgt h ALA 121 CO 0.63 -0.38 0.65 0.93 0.00 0.00 0.00 179.25 181.08 2dgt h GLU 122 N 0.03 0.28 0.03 0.00 4.39 -2.00 0.31 114.58 117.62 2dgt h GLU 122 Ca 0.02 -0.02 -0.17 0.00 0.34 0.00 0.00 59.36 59.53 2dgt h GLU 122 Cb 0.07 -0.06 0.02 0.00 -0.10 0.00 0.00 28.75 28.67 2dgt h GLU 122 CO -0.00 0.19 -0.70 -0.44 -1.16 0.00 0.00 179.01 176.89 2dgt h ASP 123 N 0.29 0.56 0.54 1.42 3.32 -1.79 -3.11 116.42 117.66 2dgt h ASP 123 Ca 0.73 -0.80 -0.02 0.00 0.02 0.00 0.00 57.03 56.96 2dgt h ASP 123 Cb 1.83 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 41.20 2dgt h ASP 123 CO -0.51 1.29 -0.35 0.00 -1.72 0.00 0.00 179.24 177.96 2dgt h ALA 124 N 0.28 -0.86 -0.91 3.45 0.00 0.25 0.67 119.26 122.14 2dgt h ALA 124 Ca -0.10 -0.17 0.19 0.00 0.00 0.00 0.00 54.91 54.84 2dgt h ALA 124 Cb 1.43 0.43 -0.11 0.00 0.00 0.00 0.00 17.79 19.54 2dgt h ALA 124 CO 0.14 -1.00 0.48 0.28 0.00 0.00 0.00 179.25 179.14 2dgt h VAL 125 N -0.85 0.63 0.15 0.00 2.07 -0.84 -1.74 116.25 115.67 2dgt h VAL 125 Ca -0.06 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 2dgt h VAL 125 Cb 0.69 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.46 2dgt h VAL 125 CO 0.06 0.11 -0.07 -0.33 0.02 0.00 0.00 177.57 177.35 2dgt h GLU 126 N 0.58 -0.20 -1.43 1.57 4.39 -1.40 -2.70 114.58 115.39 2dgt h GLU 126 Ca 0.54 0.01 0.42 0.00 0.34 0.00 0.00 59.36 60.68 2dgt h GLU 126 Cb 0.89 0.05 -0.08 0.00 -0.10 0.00 0.00 28.75 29.51 2dgt h GLU 126 CO -0.43 0.13 1.00 0.00 -1.16 0.00 0.00 179.01 178.55 2dgt h ALA 127 N 0.22 3.14 0.10 3.43 0.00 0.03 -1.08 119.26 125.10 2dgt h ALA 127 Ca -0.02 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2dgt h ALA 127 Cb 0.42 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2dgt h ALA 127 CO 0.03 -1.62 -0.05 0.82 0.00 0.00 0.00 179.25 178.43 2dgt h ILE 128 N 0.07 0.00 -0.33 0.00 2.04 -1.28 0.12 117.51 118.12 2dgt h ILE 128 Ca 0.74 -0.45 0.10 0.00 1.00 0.00 0.00 64.86 66.24 2dgt h ILE 128 Cb 2.69 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 38.75 2dgt h ILE 128 CO -0.15 0.00 0.84 -0.09 0.00 0.00 0.00 178.15 178.75 2dgt h ARG 129 N -0.59 0.00 0.00 2.37 2.43 -0.99 1.81 114.38 119.40 2dgt h ARG 129 Ca -0.01 0.00 -0.24 0.00 -0.81 0.00 0.00 59.98 58.92 2dgt h ARG 129 Cb 0.11 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.62 2dgt h ARG 129 CO 0.02 0.00 -1.64 0.41 -1.51 0.00 0.00 179.97 177.26 2dgt n GLY 130 N -1.50 -0.61 0.00 2.80 0.00 -0.50 -4.37 105.19 101.02 2dgt n GLY 130 Ca 0.07 -0.15 0.11 0.00 0.00 0.00 0.00 46.02 46.06 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 -4.39 0.00 -4.64 0.99 4.77 0.41 -4.74 117.00 109.41 2dgt n LEU 131 Ca -0.34 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.22 2dgt n LEU 131 Cb 0.67 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.74 2dgt n LEU 131 CO 0.12 0.00 1.18 -0.62 -1.33 0.00 0.00 177.39 176.74 2dgt s ASP 132 N -1.72 6.65 -0.95 -1.43 -1.08 0.60 -3.35 116.67 115.39 2dgt s ASP 132 Ca 0.34 1.40 -0.00 0.00 -0.52 0.00 0.00 52.55 53.77 2dgt s ASP 132 Cb 0.16 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 39.08 2dgt s ASP 132 CO 0.26 -1.07 0.79 0.59 0.52 0.00 0.00 175.17 176.27 2dgt n ASN 133 N 7.63 -2.12 -4.29 -0.34 3.02 -1.05 -4.96 115.26 113.16 2dgt n ASN 133 Ca 0.16 -0.49 -0.32 0.00 -0.03 0.00 0.00 54.58 53.89 2dgt n ASN 133 Cb 0.46 -4.14 -0.16 0.00 -0.61 0.00 0.00 39.78 35.34 2dgt n ASN 133 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2dgt s THR 134 N -3.28 2.56 -0.56 3.41 -4.23 -1.21 -4.91 115.64 107.41 2dgt s THR 134 Ca 0.01 -0.84 -0.26 0.00 -1.18 0.00 0.00 61.69 59.42 2dgt s THR 134 Cb -0.01 -2.03 -0.09 0.00 1.34 0.00 0.00 72.50 71.72 2dgt s THR 134 CO 0.57 0.54 2.42 1.21 -0.54 0.00 0.00 174.62 178.82 2dgt n GLU 135 N 3.57 0.93 -4.39 3.99 2.13 -1.26 -2.76 120.64 122.85 2dgt n GLU 135 Ca -0.19 -0.19 -0.34 0.00 0.66 0.00 0.00 57.16 57.10 2dgt n GLU 135 Cb 0.53 -3.50 -0.12 0.00 0.27 0.00 0.00 31.44 28.62 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 12.83 3.05 -1.76 4.31 5.36 0.33 -4.46 117.98 137.63 2dgt s PHE 136 Ca 0.97 -0.20 0.00 0.00 -0.96 0.00 0.00 56.93 56.74 2dgt s PHE 136 Cb -0.17 -1.93 0.00 0.00 -0.34 0.00 0.00 43.02 40.58 2dgt s PHE 136 CO 0.22 0.05 0.00 1.04 -1.46 0.00 0.00 175.22 175.07 2dgt n GLN 137 N 3.31 -1.63 0.00 10.12 1.13 -1.26 -1.04 117.38 128.01 2dgt n GLN 137 Ca -0.17 0.99 0.00 0.00 -1.94 0.00 0.00 57.00 55.87 2dgt n GLN 137 Cb 0.53 -5.49 0.00 0.00 0.11 0.00 0.00 30.24 25.38 2dgt n GLN 137 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2dgt n GLY 138 N -0.66 2.82 3.52 1.08 0.00 -1.26 -4.88 105.19 105.81 2dgt n GLY 138 Ca -0.20 -0.19 -0.31 0.00 0.00 0.00 0.00 46.02 45.32 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 2.21 0.04 1.61 -2.85 -0.21 -4.97 119.74 115.57 2dgt s LYS 139 Ca 0.00 -0.93 -0.29 0.00 -1.00 0.00 0.00 55.97 53.76 2dgt s LYS 139 Cb 0.00 -2.30 -0.04 0.00 -2.06 0.00 0.00 37.83 33.43 2dgt s LYS 139 CO 0.00 0.55 0.91 0.50 0.10 0.00 0.00 175.35 177.41 2dgt s ARG 140 N -1.63 4.59 0.10 1.78 3.52 -1.26 0.12 118.95 126.17 2dgt s ARG 140 Ca 0.17 1.32 0.07 0.00 -0.13 0.00 0.00 55.73 57.16 2dgt s ARG 140 Cb -0.11 -3.41 -0.04 0.00 -1.56 0.00 0.00 34.95 29.83 2dgt s ARG 140 CO 0.08 0.11 -0.09 0.00 -0.81 0.00 0.00 175.30 174.59 2dgt s MET 141 N 0.46 2.17 -0.27 5.12 0.23 -1.11 -4.72 119.30 121.18 2dgt s MET 141 Ca 0.47 -1.00 -0.14 0.00 -1.03 0.00 0.00 55.69 53.98 2dgt s MET 141 Cb -0.21 -2.33 -0.04 0.00 -1.53 0.00 0.00 34.83 30.71 2dgt s MET 141 CO 0.27 0.51 0.32 -1.01 -2.03 0.00 0.00 175.02 173.08 2dgt s HIS 142 N -1.22 3.25 -0.16 3.16 3.76 -0.90 -2.53 115.29 120.65 2dgt s HIS 142 Ca 0.22 0.34 -0.04 0.00 -0.15 0.00 0.00 55.06 55.43 2dgt s HIS 142 Cb -0.11 -2.50 -0.03 0.00 1.11 0.00 0.00 32.58 31.05 2dgt s HIS 142 CO 0.14 -0.18 -0.03 0.08 -0.85 0.00 0.00 174.74 173.90 2dgt s VAL 143 N 1.89 4.01 0.27 -0.90 1.01 -1.26 -1.08 120.40 124.34 2dgt s VAL 143 Ca 0.13 -0.32 -0.04 0.00 0.00 0.00 0.00 61.98 61.75 2dgt s VAL 143 Cb -0.16 -2.76 0.02 0.00 0.00 0.00 0.00 36.38 33.48 2dgt s VAL 143 CO 0.10 0.49 0.43 0.00 0.00 0.00 0.00 175.10 176.12 2dgt n GLN 144 N 3.49 0.62 -2.53 2.72 10.64 -0.33 -4.75 117.38 127.25 2dgt n GLN 144 Ca -0.17 -2.00 -0.42 0.00 -1.83 0.00 0.00 57.00 52.58 2dgt n GLN 144 Cb 0.52 2.05 -0.03 0.00 -0.86 0.00 0.00 30.24 31.92 2dgt n GLN 144 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 2dgt s LEU 145 N 0.00 4.41 -0.04 2.61 2.01 -1.26 -0.08 118.68 126.33 2dgt s LEU 145 Ca 0.19 1.94 -0.01 0.00 0.01 0.00 0.00 54.13 56.27 2dgt s LEU 145 Cb -0.02 -3.58 -0.01 0.00 0.01 0.00 0.00 46.19 42.59 2dgt s LEU 145 CO 0.14 -0.33 0.09 0.28 1.01 0.00 0.00 176.35 177.54 2dgt h SER 146 N 6.26 -0.04 -2.72 2.29 0.02 -1.52 -3.42 113.55 114.42 2dgt h SER 146 Ca -0.42 0.00 -0.66 0.00 -0.84 0.00 0.00 61.79 59.87 2dgt h SER 146 Cb 1.21 0.01 -0.07 0.00 0.14 0.00 0.00 62.40 63.70 2dgt h SER 146 CO 0.77 0.17 -0.49 -0.89 -1.14 0.00 0.00 176.83 175.25 2dgt s THR 147 N -1.47 5.43 0.13 -2.27 2.01 -1.26 -4.99 115.64 113.22 2dgt s THR 147 Ca -0.01 0.07 -0.31 0.00 0.31 0.00 0.00 61.69 61.75 2dgt s THR 147 Cb 0.00 -3.42 -0.11 0.00 0.01 0.00 0.00 72.50 68.99 2dgt s THR 147 CO 0.02 0.52 1.85 -1.20 -0.69 0.00 0.00 174.62 175.12 2dgt n SER 148 N 1.65 4.10 -1.17 3.53 7.64 -1.26 -4.87 113.62 123.24 2dgt n SER 148 Ca -0.17 0.98 0.09 0.00 1.01 0.00 0.00 58.87 60.78 2dgt n SER 148 Cb 0.54 -1.56 0.27 0.00 -1.01 0.00 0.00 64.21 62.46 2dgt n SER 148 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 2dgt n ARG 149 N 5.71 2.64 -4.27 1.43 -4.01 -1.26 -4.90 116.66 111.99 2dgt n ARG 149 Ca 0.18 -2.19 -0.33 0.00 -1.04 0.00 0.00 57.85 54.46 2dgt n ARG 149 Cb 0.38 -1.56 -0.09 0.00 -3.04 0.00 0.00 32.46 28.15 2dgt n ARG 149 CO 0.00 0.00 0.00 -0.48 -3.04 0.00 0.00 177.63 174.11 2dgt s LEU 150 N -1.18 3.60 -0.17 2.89 0.05 -1.26 -5.11 118.68 117.50 2dgt s LEU 150 Ca 0.40 0.06 -0.28 0.00 0.05 0.00 0.00 54.13 54.36 2dgt s LEU 150 Cb 0.23 -2.01 0.09 0.00 -2.05 0.00 0.00 46.19 42.45 2dgt s LEU 150 CO 0.25 0.31 0.82 -0.60 -0.55 0.00 0.00 176.35 176.57 2dgt s ARG 151 N -1.41 0.81 -0.27 1.48 3.00 -1.26 -5.15 118.95 116.16 2dgt s ARG 151 Ca 0.18 0.48 -0.09 0.00 -1.00 0.00 0.00 55.73 55.30 2dgt s ARG 151 Cb -0.12 0.39 -0.03 0.00 0.00 0.00 0.00 34.95 35.19 2dgt s ARG 151 CO 0.09 -0.20 0.12 0.99 0.00 0.00 0.00 175.30 176.30 2dgt s THR 152 N -0.54 4.72 -0.30 4.11 2.01 -1.26 -5.04 115.64 119.34 2dgt s THR 152 Ca -0.04 -0.06 -0.16 0.00 0.31 0.00 0.00 61.69 61.74 2dgt s THR 152 Cb -0.02 -3.24 0.17 0.00 0.01 0.00 0.00 72.50 69.42 2dgt s THR 152 CO 0.03 0.28 1.04 0.00 -0.69 0.00 0.00 174.62 175.29 2dgt s ALA 153 N 1.67 -2.84 0.12 7.40 0.00 -1.26 -5.06 121.76 121.79 2dgt s ALA 153 Ca 0.06 1.97 -0.25 0.00 0.00 0.00 0.00 51.96 53.75 2dgt s ALA 153 Cb -0.16 -2.12 -0.06 0.00 0.00 0.00 0.00 23.12 20.78 2dgt s ALA 153 CO 0.07 -0.98 1.66 0.66 0.00 0.00 0.00 175.76 177.16 2dgt h SER 154 N 7.45 -0.55 -5.19 0.00 4.64 -1.96 -3.45 113.55 114.49 2dgt h SER 154 Ca -0.15 0.08 -0.09 0.00 -0.47 0.00 0.00 61.79 61.15 2dgt h SER 154 Cb 1.12 0.23 -0.14 0.00 -0.31 0.00 0.00 62.40 63.30 2dgt h SER 154 CO 0.07 -0.25 -0.42 -0.83 -0.87 0.00 0.00 176.83 174.52 2dgt s GLY 155 N -2.49 0.21 0.00 -0.77 0.00 -1.26 -5.02 107.32 97.98 2dgt s GLY 155 Ca -0.15 -0.75 0.14 0.00 0.00 0.00 0.00 44.72 43.96 2dgt s GLY 155 CO 0.66 -0.90 1.43 -1.55 0.00 0.00 0.00 173.10 172.75 2dgt n PRO 156 N -0.05 0.08 0.40 2.90 -0.04 -1.26 -3.48 135.00 133.55 2dgt n PRO 156 Ca -0.14 0.21 -0.16 0.00 -0.04 0.00 0.00 63.50 63.37 2dgt n PRO 156 Cb 0.62 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.51 2dgt n PRO 156 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2dgt h SER 157 N 0.00 -0.89 -3.63 3.54 0.02 -2.00 -3.41 113.55 107.19 2dgt h SER 157 Ca 0.00 0.03 -0.67 0.00 -0.84 0.00 0.00 61.79 60.31 2dgt h SER 157 Cb 0.20 0.23 -0.24 0.00 0.14 0.00 0.00 62.40 62.73 2dgt h SER 157 CO 0.00 -0.52 -0.59 -0.94 -1.14 0.00 0.00 176.83 173.64 2dgt s SER 158 N -4.35 5.34 0.00 3.07 1.04 -1.23 -5.24 113.70 112.34 2dgt s SER 158 Ca -0.15 -0.59 0.00 0.00 0.48 0.00 0.00 55.95 55.68 2dgt s SER 158 Cb 0.02 -1.95 0.00 0.00 0.10 0.00 0.00 66.02 64.19 2dgt s SER 158 CO 0.46 -0.19 0.00 0.61 0.98 0.00 0.00 173.24 175.10