#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 1.95 -0.34 1.61 3.41 -1.26 -4.49 113.62 114.49 2dgt n SER 69 Ca 0.00 0.28 0.02 0.00 -0.26 0.00 0.00 58.87 58.91 2dgt n SER 69 Cb 0.00 -0.80 0.08 0.00 -0.26 0.00 0.00 64.21 63.23 2dgt n SER 69 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2dgt n SER 70 N -4.11 -0.49 0.00 4.04 2.88 -1.26 -4.82 113.62 109.86 2dgt n SER 70 Ca -0.48 1.60 0.00 0.00 -1.33 0.00 0.00 58.87 58.66 2dgt n SER 70 Cb 0.87 -0.41 0.00 0.00 -0.75 0.00 0.00 64.21 63.92 2dgt n SER 70 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dgt n GLY 71 N -1.49 1.98 3.48 0.46 0.00 -1.26 -4.93 105.19 103.42 2dgt n GLY 71 Ca 0.12 -0.54 -0.43 0.00 0.00 0.00 0.00 46.02 45.16 2dgt n GLY 71 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dgt s SER 72 N 0.00 6.25 0.16 1.61 0.01 -1.26 -4.95 113.70 115.52 2dgt s SER 72 Ca 0.00 -0.74 0.04 0.00 1.31 0.00 0.00 55.95 56.56 2dgt s SER 72 Cb 0.00 -2.40 -0.05 0.00 0.21 0.00 0.00 66.02 63.78 2dgt s SER 72 CO 0.00 -1.26 -0.09 -0.44 0.41 0.00 0.00 173.24 171.86 2dgt s SER 73 N 3.20 1.82 0.00 2.44 0.01 -1.26 -5.13 113.70 114.78 2dgt s SER 73 Ca 0.24 -1.05 0.00 0.00 1.31 0.00 0.00 55.95 56.45 2dgt s SER 73 Cb -0.16 -0.01 0.00 0.00 0.21 0.00 0.00 66.02 66.06 2dgt s SER 73 CO 0.14 -0.36 0.00 0.61 0.41 0.00 0.00 173.24 174.04 2dgt n GLY 74 N -0.24 0.88 2.42 3.44 0.00 -1.26 -4.88 105.19 105.56 2dgt n GLY 74 Ca -0.09 -2.08 -0.33 0.00 0.00 0.00 0.00 46.02 43.51 2dgt n GLY 74 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2dgt n LYS 75 N -1.06 2.95 0.19 1.61 2.85 -1.26 -4.77 118.16 118.67 2dgt n LYS 75 Ca 0.00 -3.63 -0.16 0.00 -1.05 0.00 0.00 58.31 53.47 2dgt n LYS 75 Cb 0.00 -2.28 -0.09 0.00 -0.65 0.00 0.00 35.03 32.02 2dgt n LYS 75 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2dgt h ALA 76 N 2.32 -0.91 -2.93 0.58 0.00 -1.90 -3.47 119.26 112.96 2dgt h ALA 76 Ca 0.53 -0.12 -0.41 0.00 0.00 0.00 0.00 54.91 54.90 2dgt h ALA 76 Cb 0.77 0.72 -0.11 0.00 0.00 0.00 0.00 17.79 19.17 2dgt h ALA 76 CO 1.33 -1.07 -0.36 -1.12 0.00 0.00 0.00 179.25 178.03 2dgt s SER 77 N -4.58 1.47 0.04 0.00 0.01 -1.26 -4.85 113.70 104.53 2dgt s SER 77 Ca -0.17 -1.68 0.04 0.00 1.31 0.00 0.00 55.95 55.44 2dgt s SER 77 Cb 0.06 0.61 -0.02 0.00 0.21 0.00 0.00 66.02 66.88 2dgt s SER 77 CO 0.62 -1.18 -0.11 0.42 0.41 0.00 0.00 173.24 173.40 2dgt s THR 78 N -3.21 0.84 -0.05 1.44 -4.23 0.18 -4.97 115.64 105.65 2dgt s THR 78 Ca 0.37 -1.03 0.07 0.00 -1.18 0.00 0.00 61.69 59.91 2dgt s THR 78 Cb 0.01 -0.82 -0.01 0.00 1.34 0.00 0.00 72.50 73.02 2dgt s THR 78 CO 0.26 -0.18 -0.25 -0.75 -0.54 0.00 0.00 174.62 173.15 2dgt s LYS 79 N -1.36 2.41 -0.23 3.99 2.47 -1.26 0.11 119.74 125.88 2dgt s LYS 79 Ca -0.03 -0.91 0.01 0.00 -1.56 0.00 0.00 55.97 53.47 2dgt s LYS 79 Cb -0.09 -2.12 0.06 0.00 -1.46 0.00 0.00 37.83 34.22 2dgt s LYS 79 CO 0.01 0.44 -0.06 -0.51 0.16 0.00 0.00 175.35 175.38 2dgt s LEU 80 N -0.30 2.50 0.12 5.43 1.43 -0.30 -2.59 118.68 124.95 2dgt s LEU 80 Ca 0.01 -1.11 -0.25 0.00 -1.03 0.00 0.00 54.13 51.75 2dgt s LEU 80 Cb -0.13 -1.18 -0.07 0.00 0.03 0.00 0.00 46.19 44.84 2dgt s LEU 80 CO 0.02 -0.22 0.76 -2.28 0.23 0.00 0.00 176.35 174.87 2dgt s HIS 81 N 1.40 3.84 0.05 0.29 5.65 0.18 -0.45 115.29 126.25 2dgt s HIS 81 Ca -0.05 1.56 0.07 0.00 0.25 0.00 0.00 55.06 56.89 2dgt s HIS 81 Cb -0.18 -2.77 -0.03 0.00 -1.18 0.00 0.00 32.58 28.42 2dgt s HIS 81 CO -0.07 0.43 -0.20 0.08 -0.65 0.00 0.00 174.74 174.33 2dgt s VAL 82 N -0.74 1.61 0.20 0.89 1.01 -0.56 -0.89 120.40 121.92 2dgt s VAL 82 Ca 0.36 -1.22 0.08 0.00 0.00 0.00 0.00 61.98 61.20 2dgt s VAL 82 Cb -0.22 -1.42 -0.05 0.00 0.00 0.00 0.00 36.38 34.70 2dgt s VAL 82 CO 0.25 0.15 -0.15 -0.83 0.00 0.00 0.00 175.10 174.51 2dgt s GLY 83 N -1.27 1.43 -0.93 4.51 0.00 -0.28 -0.33 107.32 110.46 2dgt s GLY 83 Ca 0.07 -1.63 -0.02 0.00 0.00 0.00 0.00 44.72 43.13 2dgt s GLY 83 CO 0.02 -1.72 0.79 -2.01 0.00 0.00 0.00 173.10 170.18 2dgt n ASN 84 N -0.26 -3.49 -4.89 1.64 5.15 0.66 -1.87 115.26 112.20 2dgt n ASN 84 Ca -0.09 -0.53 -0.29 0.00 -0.60 0.00 0.00 54.58 53.07 2dgt n ASN 84 Cb 0.60 -4.29 -0.02 0.00 -0.53 0.00 0.00 39.78 35.54 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 -3.30 4.85 0.24 -1.44 -1.09 -0.13 -4.15 121.20 116.18 2dgt s ILE 85 Ca 0.14 0.42 -0.21 0.00 -2.23 0.00 0.00 60.65 58.77 2dgt s ILE 85 Cb -0.02 -3.80 -0.09 0.00 -1.58 0.00 0.00 42.46 36.98 2dgt s ILE 85 CO 0.60 -0.69 0.77 -0.55 -1.23 0.00 0.00 174.94 173.83 2dgt s SER 86 N -3.64 7.12 0.00 3.58 0.15 -1.26 -4.66 113.70 114.99 2dgt s SER 86 Ca 0.49 1.51 0.14 0.00 0.70 0.00 0.00 55.95 58.79 2dgt s SER 86 Cb -0.10 -2.45 0.67 0.00 -1.71 0.00 0.00 66.02 62.42 2dgt s SER 86 CO 0.39 0.01 1.43 -0.81 1.20 0.00 0.00 173.24 175.46 2dgt n PRO 87 N 0.70 0.09 0.00 5.44 -0.04 -1.26 -2.06 135.00 137.87 2dgt n PRO 87 Ca -0.01 0.21 0.05 0.00 -0.04 0.00 0.00 63.50 63.71 2dgt n PRO 87 Cb 0.51 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.44 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 -1.41 0.00 -1.67 0.52 -2.24 -1.26 -5.02 114.28 103.20 2dgt n THR 88 Ca 0.05 -0.32 -0.42 0.00 -2.27 0.00 0.00 64.05 61.09 2dgt n THR 88 Cb 0.14 1.06 -0.00 0.00 -2.10 0.00 0.00 70.33 69.44 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 -1.14 2.39 0.45 0.00 -4.23 -1.26 -5.01 115.64 106.83 2dgt s THR 90 Ca 0.58 -1.57 0.24 0.00 -1.18 0.00 0.00 61.69 59.75 2dgt s THR 90 Cb -0.57 -2.03 0.43 0.00 1.34 0.00 0.00 72.50 71.67 2dgt s THR 90 CO 0.60 0.18 1.80 0.78 -0.54 0.00 0.00 174.62 177.44 2dgt h ASN 91 N 4.13 0.30 0.51 3.99 4.21 -1.94 0.70 115.58 127.48 2dgt h ASN 91 Ca -0.49 0.05 -0.12 0.00 1.21 0.00 0.00 56.30 56.95 2dgt h ASN 91 Cb 1.16 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 38.35 2dgt h ASN 91 CO 0.42 0.07 -0.56 1.56 -1.29 0.00 0.00 177.43 177.63 2dgt h GLN 92 N 0.27 0.05 0.26 0.81 1.08 -1.97 -1.19 115.11 114.42 2dgt h GLN 92 Ca 0.55 -0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 57.71 2dgt h GLN 92 Cb 1.64 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.08 2dgt h GLN 92 CO -0.19 0.59 -0.13 0.93 -0.95 0.00 0.00 178.83 179.09 2dgt h GLU 93 N 0.04 -0.34 0.21 1.46 4.39 -0.04 -2.55 114.58 117.75 2dgt h GLU 93 Ca -0.00 0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.72 2dgt h GLU 93 Cb 1.00 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.71 2dgt h GLU 93 CO 0.08 -0.19 -0.17 1.25 -1.16 0.00 0.00 179.01 178.82 2dgt h LEU 94 N -1.08 -0.44 0.01 1.33 5.85 -1.36 -1.60 115.31 118.03 2dgt h LEU 94 Ca -0.04 0.04 0.03 0.00 0.84 0.00 0.00 57.88 58.75 2dgt h LEU 94 Cb 0.31 0.14 -0.05 0.00 0.37 0.00 0.00 40.66 41.43 2dgt h LEU 94 CO 0.06 -0.26 -0.44 -0.09 -0.34 0.00 0.00 178.44 177.36 2dgt h ARG 95 N -0.39 -0.58 -0.41 1.25 2.43 -1.37 -2.18 114.38 113.12 2dgt h ARG 95 Ca -0.01 0.04 0.08 0.00 -0.81 0.00 0.00 59.98 59.28 2dgt h ARG 95 Cb 0.35 0.13 -0.09 0.00 -0.42 0.00 0.00 29.97 29.94 2dgt h ARG 95 CO -0.01 -0.39 -0.25 0.00 -1.51 0.00 0.00 179.97 177.81 2dgt h ALA 96 N -0.12 -0.01 -1.06 2.80 0.00 -1.36 0.63 119.26 120.14 2dgt h ALA 96 Ca 0.04 0.13 0.28 0.00 0.00 0.00 0.00 54.91 55.36 2dgt h ALA 96 Cb 0.67 0.57 -0.08 0.00 0.00 0.00 0.00 17.79 18.96 2dgt h ALA 96 CO -0.32 -0.63 0.71 -0.22 0.00 0.00 0.00 179.25 178.80 2dgt h LYS 97 N -0.18 0.25 0.01 0.00 1.63 -0.78 0.29 116.57 117.78 2dgt h LYS 97 Ca 0.19 -0.01 -0.28 0.00 -0.85 0.00 0.00 60.65 59.70 2dgt h LYS 97 Cb 0.48 -0.06 -0.04 0.00 -0.60 0.00 0.00 32.23 32.01 2dgt h LYS 97 CO -0.51 0.16 -1.54 0.74 -3.45 0.00 0.00 179.45 174.85 2dgt h PHE 98 N 0.25 0.03 0.00 1.91 0.04 -0.06 -3.32 116.94 115.79 2dgt h PHE 98 Ca 0.57 -0.03 -0.01 0.00 2.80 0.00 0.00 57.97 61.30 2dgt h PHE 98 Cb 1.71 -0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.86 2dgt h PHE 98 CO -0.00 1.04 -0.05 0.93 -0.60 0.00 0.00 178.31 179.63 2dgt h GLU 99 N 0.01 0.00 -0.00 1.51 5.08 0.38 -1.55 114.58 120.00 2dgt h GLU 99 Ca -0.22 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.14 2dgt h GLU 99 Cb 1.96 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.21 2dgt h GLU 99 CO 0.09 0.05 0.00 0.93 -1.00 0.00 0.00 179.01 179.09 2dgt h GLU 100 N 0.00 0.00 0.00 2.33 4.39 -1.43 -2.96 114.58 116.91 2dgt h GLU 100 Ca -0.00 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.55 2dgt h GLU 100 Cb 0.15 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.77 2dgt h GLU 100 CO 0.01 0.00 -0.91 1.88 -1.16 0.00 0.00 179.01 178.83 2dgt h TYR 101 N 0.00 0.00 -3.53 4.33 -1.99 -1.51 -3.50 116.97 110.76 2dgt h TYR 101 Ca 0.00 0.00 -0.11 0.00 2.00 0.00 0.00 58.73 60.62 2dgt h TYR 101 Cb 0.00 0.00 -0.05 0.00 2.00 0.00 0.00 36.73 38.68 2dgt h TYR 101 CO 0.00 1.15 0.02 0.20 -0.00 0.00 0.00 178.16 179.53 2dgt s GLY 102 N -4.62 0.76 -0.87 3.88 0.00 -1.12 -4.87 107.32 100.48 2dgt s GLY 102 Ca -0.24 -1.01 -0.25 0.00 0.00 0.00 0.00 44.72 43.22 2dgt s GLY 102 CO 0.53 -0.60 1.94 2.56 0.00 0.00 0.00 173.10 177.53 2dgt s PRO 103 N -3.08 2.57 0.68 2.90 0.04 -1.26 -4.12 135.00 132.72 2dgt s PRO 103 Ca 0.22 -0.19 -0.17 0.00 0.04 0.00 0.00 61.00 60.90 2dgt s PRO 103 Cb -0.03 -4.99 0.00 0.00 0.04 0.00 0.00 34.50 29.53 2dgt s PRO 103 CO 0.14 -3.30 1.21 0.28 0.04 0.00 0.00 177.00 175.37 2dgt n VAL 104 N 7.80 4.12 -0.09 -0.36 0.31 -1.26 -4.04 118.33 124.80 2dgt n VAL 104 Ca 0.38 -0.43 -0.11 0.00 -0.01 0.00 0.00 64.34 64.17 2dgt n VAL 104 Cb 0.48 -1.37 -0.04 0.00 -0.91 0.00 0.00 33.84 32.00 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 -2.22 1.50 -3.66 2.52 5.41 0.10 -4.92 119.36 118.10 2dgt n ILE 105 Ca 0.15 0.09 -0.07 0.00 1.00 0.00 0.00 62.75 63.93 2dgt n ILE 105 Cb 0.49 -2.31 -0.08 0.00 -0.71 0.00 0.00 39.64 37.03 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 -2.87 0.44 -0.03 0.38 -1.05 -1.09 -5.01 118.70 109.48 2dgt s GLU 106 Ca -0.30 1.12 0.03 0.00 -0.15 0.00 0.00 54.97 55.68 2dgt s GLU 106 Cb 0.05 0.38 -0.03 0.00 -0.44 0.00 0.00 34.13 34.09 2dgt s GLU 106 CO 0.43 -0.21 -0.11 0.00 0.95 0.00 0.00 175.26 176.32 2dgt s ASP 108 N -1.03 0.98 0.05 0.00 1.01 -0.24 -4.99 116.67 112.45 2dgt s ASP 108 Ca 0.14 -0.15 -0.00 0.00 0.71 0.00 0.00 52.55 53.24 2dgt s ASP 108 Cb -0.11 -0.27 -0.04 0.00 1.01 0.00 0.00 42.92 43.51 2dgt s ASP 108 CO 0.03 0.04 0.20 -0.63 0.21 0.00 0.00 175.17 175.02 2dgt s ILE 109 N 0.25 5.37 0.34 0.77 1.01 -1.26 -0.88 121.20 126.79 2dgt s ILE 109 Ca -0.03 -0.36 0.03 0.00 0.00 0.00 0.00 60.65 60.29 2dgt s ILE 109 Cb -0.08 -3.60 -0.04 0.00 0.01 0.00 0.00 42.46 38.75 2dgt s ILE 109 CO 0.00 0.18 0.12 -0.69 0.00 0.00 0.00 174.94 174.55 2dgt s VAL 110 N -1.47 0.63 0.00 2.92 1.01 0.35 -4.92 120.40 118.92 2dgt s VAL 110 Ca 0.33 -2.00 0.00 0.00 0.00 0.00 0.00 61.98 60.31 2dgt s VAL 110 Cb -0.13 -2.54 0.00 0.00 0.00 0.00 0.00 36.38 33.71 2dgt s VAL 110 CO 0.26 0.00 0.83 1.17 0.00 0.00 0.00 175.10 177.36 2dgt n LYS 111 N -0.69 0.00 -0.00 2.72 3.00 -1.26 -3.43 118.16 118.50 2dgt n LYS 111 Ca -0.02 0.83 0.00 0.00 -0.00 0.00 0.00 58.31 59.13 2dgt n LYS 111 Cb 0.65 -1.27 0.00 0.00 0.00 0.00 0.00 35.03 34.41 2dgt n LYS 111 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2dgt n ASP 112 N -2.67 1.71 -3.84 3.14 8.00 -1.26 -4.66 116.55 116.97 2dgt n ASP 112 Ca 0.00 -1.87 -0.20 0.00 0.71 0.00 0.00 54.79 53.43 2dgt n ASP 112 Cb 0.00 -0.01 -0.09 0.00 -0.02 0.00 0.00 41.12 41.01 2dgt n ASP 112 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2dgt s TYR 113 N -0.88 1.65 0.35 1.24 1.13 -1.22 0.24 117.35 119.86 2dgt s TYR 113 Ca 0.01 -1.44 -0.10 0.00 -1.41 0.00 0.00 57.07 54.12 2dgt s TYR 113 Cb 0.00 -0.85 0.04 0.00 -1.10 0.00 0.00 41.96 40.05 2dgt s TYR 113 CO 0.00 -0.59 0.64 0.00 -2.51 0.00 0.00 175.55 173.09 2dgt n ALA 114 N -0.63 -1.22 -3.36 9.51 0.00 0.55 0.13 120.51 125.49 2dgt n ALA 114 Ca 0.02 -1.27 -0.02 0.00 0.00 0.00 0.00 53.44 52.17 2dgt n ALA 114 Cb 0.64 1.01 -0.05 0.00 0.00 0.00 0.00 19.45 21.06 2dgt n ALA 114 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2dgt s PHE 115 N -2.87 -1.22 -0.36 0.00 0.40 -0.06 -1.50 117.98 112.38 2dgt s PHE 115 Ca 0.18 1.52 -0.12 0.00 -0.60 0.00 0.00 56.93 57.91 2dgt s PHE 115 Cb -0.03 0.40 0.01 0.00 0.51 0.00 0.00 43.02 43.91 2dgt s PHE 115 CO 0.13 -0.74 0.23 0.08 0.70 0.00 0.00 175.22 175.62 2dgt s VAL 116 N 2.74 4.94 -0.70 -0.44 1.01 0.40 -1.08 120.40 127.27 2dgt s VAL 116 Ca 0.11 -0.56 -0.26 0.00 0.00 0.00 0.00 61.98 61.27 2dgt s VAL 116 Cb -0.14 -3.66 0.04 0.00 0.00 0.00 0.00 36.38 32.62 2dgt s VAL 116 CO -0.18 -0.14 1.20 -2.28 0.00 0.00 0.00 175.10 173.69 2dgt s HIS 117 N 1.64 2.41 0.61 5.22 2.46 0.74 -1.15 115.29 127.23 2dgt s HIS 117 Ca 0.04 -0.10 -0.06 0.00 0.47 0.00 0.00 55.06 55.42 2dgt s HIS 117 Cb -0.18 -4.53 0.02 0.00 -0.13 0.00 0.00 32.58 27.76 2dgt s HIS 117 CO 0.08 -1.92 0.92 -1.64 -2.47 0.00 0.00 174.74 169.71 2dgt s MET 118 N 5.26 2.72 -0.17 2.88 -1.94 0.30 0.01 119.30 128.36 2dgt s MET 118 Ca 0.33 -0.11 -0.14 0.00 -1.71 0.00 0.00 55.69 54.05 2dgt s MET 118 Cb -0.10 -2.26 -0.06 0.00 2.01 0.00 0.00 34.83 34.42 2dgt s MET 118 CO 0.15 -0.83 -0.27 -1.91 -0.01 0.00 0.00 175.02 172.16 2dgt n GLU 119 N -2.65 0.50 -4.02 2.03 2.13 -1.26 -0.65 120.64 116.73 2dgt n GLU 119 Ca 0.05 0.35 -0.27 0.00 0.66 0.00 0.00 57.16 57.95 2dgt n GLU 119 Cb 0.58 -1.55 -0.05 0.00 0.27 0.00 0.00 31.44 30.70 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 -2.61 3.12 0.02 5.31 0.52 -1.26 -4.13 118.95 119.92 2dgt s ARG 120 Ca -0.24 -0.73 -0.26 0.00 -0.52 0.00 0.00 55.73 53.97 2dgt s ARG 120 Cb 0.04 -2.79 -0.17 0.00 0.52 0.00 0.00 34.95 32.55 2dgt s ARG 120 CO 0.36 0.51 1.31 0.00 0.02 0.00 0.00 175.30 177.50 2dgt h ALA 121 N 2.43 -0.52 -1.31 2.13 0.00 -1.94 -2.11 119.26 117.95 2dgt h ALA 121 Ca -0.48 -0.18 0.43 0.00 0.00 0.00 0.00 54.91 54.68 2dgt h ALA 121 Cb 1.19 0.20 -0.13 0.00 0.00 0.00 0.00 17.79 19.06 2dgt h ALA 121 CO 0.66 -0.66 0.84 0.93 0.00 0.00 0.00 179.25 181.03 2dgt h GLU 122 N -0.78 0.09 0.12 0.00 4.39 -1.98 1.07 114.58 117.48 2dgt h GLU 122 Ca -0.05 -0.01 -0.29 0.00 0.34 0.00 0.00 59.36 59.35 2dgt h GLU 122 Cb 0.53 -0.02 0.03 0.00 -0.10 0.00 0.00 28.75 29.18 2dgt h GLU 122 CO 0.09 0.06 -1.23 -0.44 -1.16 0.00 0.00 179.01 176.32 2dgt h ASP 123 N 0.10 0.83 0.39 1.42 3.32 -1.86 -2.97 116.42 117.64 2dgt h ASP 123 Ca 0.81 -0.76 -0.02 0.00 0.02 0.00 0.00 57.03 57.08 2dgt h ASP 123 Cb 2.53 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 41.83 2dgt h ASP 123 CO -0.42 1.57 -0.19 0.00 -1.72 0.00 0.00 179.24 178.49 2dgt h ALA 124 N 0.34 -0.52 -0.99 3.45 0.00 0.16 -0.71 119.26 121.00 2dgt h ALA 124 Ca -0.18 -0.19 0.18 0.00 0.00 0.00 0.00 54.91 54.72 2dgt h ALA 124 Cb 1.91 0.20 -0.10 0.00 0.00 0.00 0.00 17.79 19.80 2dgt h ALA 124 CO 0.23 -0.58 0.61 0.28 0.00 0.00 0.00 179.25 179.80 2dgt h VAL 125 N -0.94 0.75 0.14 0.00 2.07 -0.45 -2.05 116.25 115.76 2dgt h VAL 125 Ca -0.05 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.20 2dgt h VAL 125 Cb 0.54 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 2dgt h VAL 125 CO 0.09 0.14 -0.07 -0.33 0.02 0.00 0.00 177.57 177.42 2dgt h GLU 126 N 0.75 -0.18 -1.01 1.57 5.08 -1.52 -2.44 114.58 116.85 2dgt h GLU 126 Ca 0.54 0.01 0.29 0.00 -1.00 0.00 0.00 59.36 59.21 2dgt h GLU 126 Cb 0.86 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 30.11 2dgt h GLU 126 CO -0.32 0.24 0.86 0.00 -1.00 0.00 0.00 179.01 178.79 2dgt h ALA 127 N 0.04 2.88 0.00 3.43 0.00 -0.44 -1.26 119.26 123.90 2dgt h ALA 127 Ca -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2dgt h ALA 127 Cb 0.51 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2dgt h ALA 127 CO 0.03 -1.38 -0.05 0.82 0.00 0.00 0.00 179.25 178.67 2dgt h ILE 128 N 0.00 0.00 -0.26 0.00 2.04 -1.32 -0.47 117.51 117.49 2dgt h ILE 128 Ca 0.48 -0.59 0.08 0.00 1.00 0.00 0.00 64.86 65.82 2dgt h ILE 128 Cb 2.19 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 38.26 2dgt h ILE 128 CO -0.01 0.00 0.81 -0.09 0.00 0.00 0.00 178.15 178.87 2dgt h ARG 129 N -0.59 0.00 0.00 2.37 2.43 -0.89 1.85 114.38 119.55 2dgt h ARG 129 Ca 0.00 0.00 -0.28 0.00 -0.81 0.00 0.00 59.98 58.89 2dgt h ARG 129 Cb 0.05 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.56 2dgt h ARG 129 CO 0.00 0.00 -1.84 0.41 -1.51 0.00 0.00 179.97 177.03 2dgt n GLY 130 N -1.47 -0.55 0.01 2.80 0.00 -0.54 -4.39 105.19 101.04 2dgt n GLY 130 Ca 0.05 -0.16 0.11 0.00 0.00 0.00 0.00 46.02 46.02 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 -4.35 0.02 -4.60 0.99 4.77 -0.19 -4.72 117.00 108.92 2dgt n LEU 131 Ca -0.38 -0.01 -0.43 0.00 -0.03 0.00 0.00 56.01 55.17 2dgt n LEU 131 Cb 0.72 -0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.79 2dgt n LEU 131 CO 0.10 0.00 1.12 -0.62 -1.33 0.00 0.00 177.39 176.66 2dgt s ASP 132 N -1.71 6.51 -0.47 -1.43 2.15 0.62 -3.56 116.67 118.78 2dgt s ASP 132 Ca 0.34 0.61 -0.00 0.00 0.43 0.00 0.00 52.55 53.94 2dgt s ASP 132 Cb 0.16 -2.55 -0.00 0.00 -0.30 0.00 0.00 42.92 40.23 2dgt s ASP 132 CO 0.26 -1.33 0.39 -3.20 -0.17 0.00 0.00 175.17 171.13 2dgt n ASN 133 N 8.26 -2.10 -4.09 -0.34 5.15 -1.10 -4.94 115.26 116.10 2dgt n ASN 133 Ca 0.14 -0.25 -0.30 0.00 -0.60 0.00 0.00 54.58 53.57 2dgt n ASN 133 Cb 0.49 -2.32 -0.17 0.00 -0.53 0.00 0.00 39.78 37.25 2dgt n ASN 133 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2dgt s THR 134 N -3.14 1.71 -0.60 -0.44 -4.23 -1.23 -4.94 115.64 102.77 2dgt s THR 134 Ca 0.01 -0.76 -0.30 0.00 -1.18 0.00 0.00 61.69 59.45 2dgt s THR 134 Cb -0.00 -1.55 -0.13 0.00 1.34 0.00 0.00 72.50 72.16 2dgt s THR 134 CO 0.29 0.48 2.44 1.21 -0.54 0.00 0.00 174.62 178.50 2dgt n GLU 135 N 4.24 0.75 -3.77 3.99 2.13 -1.26 -3.32 120.64 123.40 2dgt n GLU 135 Ca -0.19 0.09 -0.36 0.00 0.66 0.00 0.00 57.16 57.36 2dgt n GLU 135 Cb 0.51 -2.59 -0.09 0.00 0.27 0.00 0.00 31.44 29.54 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 9.86 3.30 -0.67 4.31 2.19 0.33 -4.40 117.98 132.91 2dgt s PHE 136 Ca 1.13 0.17 -0.01 0.00 0.33 0.00 0.00 56.93 58.54 2dgt s PHE 136 Cb -0.69 -2.20 0.01 0.00 -1.31 0.00 0.00 43.02 38.83 2dgt s PHE 136 CO 0.39 0.11 0.04 1.04 1.83 0.00 0.00 175.22 178.63 2dgt n GLN 137 N 3.98 -2.58 0.00 10.12 6.02 -1.26 -0.01 117.38 133.65 2dgt n GLN 137 Ca -0.16 0.35 0.00 0.00 -0.01 0.00 0.00 57.00 57.18 2dgt n GLN 137 Cb 0.52 -4.92 0.00 0.00 1.02 0.00 0.00 30.24 26.86 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 -0.71 3.10 3.77 1.08 0.00 -1.26 -4.99 105.19 106.18 2dgt n GLY 138 Ca -0.08 -0.93 -0.36 0.00 0.00 0.00 0.00 46.02 44.65 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 3.40 0.14 1.61 -2.85 0.98 -4.91 119.74 118.12 2dgt s LYS 139 Ca 0.00 -0.26 -0.29 0.00 -1.00 0.00 0.00 55.97 54.41 2dgt s LYS 139 Cb 0.00 -3.07 -0.07 0.00 -2.06 0.00 0.00 37.83 32.64 2dgt s LYS 139 CO 0.00 0.65 0.93 0.50 0.10 0.00 0.00 175.35 177.53 2dgt s ARG 140 N -0.69 4.72 0.06 1.78 3.52 -1.26 0.12 118.95 127.20 2dgt s ARG 140 Ca 0.12 1.42 0.09 0.00 -0.13 0.00 0.00 55.73 57.23 2dgt s ARG 140 Cb -0.12 -3.34 -0.03 0.00 -1.56 0.00 0.00 34.95 29.90 2dgt s ARG 140 CO 0.03 0.32 -0.23 0.00 -0.81 0.00 0.00 175.30 174.61 2dgt s MET 141 N -0.40 1.81 -0.28 5.12 0.23 -1.21 -4.70 119.30 119.87 2dgt s MET 141 Ca 0.44 -1.12 -0.17 0.00 -1.03 0.00 0.00 55.69 53.81 2dgt s MET 141 Cb -0.24 -2.04 -0.03 0.00 -1.53 0.00 0.00 34.83 31.00 2dgt s MET 141 CO 0.30 0.51 0.48 -1.01 -2.03 0.00 0.00 175.02 173.27 2dgt s HIS 142 N -0.91 3.25 -0.16 3.16 3.76 -0.78 -2.72 115.29 120.89 2dgt s HIS 142 Ca 0.13 0.52 -0.06 0.00 -0.15 0.00 0.00 55.06 55.51 2dgt s HIS 142 Cb -0.10 -2.72 -0.04 0.00 1.11 0.00 0.00 32.58 30.83 2dgt s HIS 142 CO 0.04 -0.31 0.04 0.08 -0.85 0.00 0.00 174.74 173.74 2dgt s VAL 143 N 2.27 4.59 0.37 -0.90 1.01 -1.26 -1.12 120.40 125.35 2dgt s VAL 143 Ca 0.20 -0.12 -0.16 0.00 0.00 0.00 0.00 61.98 61.90 2dgt s VAL 143 Cb -0.16 -3.03 0.05 0.00 0.00 0.00 0.00 36.38 33.24 2dgt s VAL 143 CO 0.10 0.50 0.76 0.00 0.00 0.00 0.00 175.10 176.46 2dgt s GLN 144 N 0.05 2.15 0.23 2.72 -2.07 -0.07 -4.72 119.66 117.95 2dgt s GLN 144 Ca 0.04 -1.39 -0.30 0.00 -1.82 0.00 0.00 55.36 51.89 2dgt s GLN 144 Cb -0.12 0.61 -0.09 0.00 -1.09 0.00 0.00 33.01 32.32 2dgt s GLN 144 CO 0.01 -1.00 1.25 -0.51 -1.32 0.00 0.00 175.29 173.72 2dgt s LEU 145 N -3.06 4.45 -0.15 2.60 2.01 -1.26 0.52 118.68 123.79 2dgt s LEU 145 Ca 0.16 2.38 -0.27 0.00 0.01 0.00 0.00 54.13 56.40 2dgt s LEU 145 Cb -0.05 -3.62 -0.24 0.00 0.01 0.00 0.00 46.19 42.29 2dgt s LEU 145 CO 0.11 -0.43 0.69 -1.28 1.01 0.00 0.00 176.35 176.45 2dgt h SER 146 N 4.82 0.00 -3.43 2.29 0.87 -1.83 -3.42 113.55 112.85 2dgt h SER 146 Ca -0.46 -0.92 -0.62 0.00 -1.23 0.00 0.00 61.79 58.57 2dgt h SER 146 Cb 1.22 0.00 -0.40 0.00 -0.44 0.00 0.00 62.40 62.78 2dgt h SER 146 CO 0.73 1.04 -0.74 -0.89 -0.53 0.00 0.00 176.83 176.45 2dgt s THR 147 N -2.22 1.53 -1.11 2.23 2.01 -1.26 -5.00 115.64 111.82 2dgt s THR 147 Ca -0.20 -1.91 -0.12 0.00 0.31 0.00 0.00 61.69 59.78 2dgt s THR 147 Cb -0.02 -2.14 0.23 0.00 0.01 0.00 0.00 72.50 70.58 2dgt s THR 147 CO 0.66 -0.66 1.19 -0.55 -0.69 0.00 0.00 174.62 174.57 2dgt s SER 148 N 1.20 7.15 0.38 3.53 0.15 -1.26 -4.87 113.70 119.98 2dgt s SER 148 Ca 0.11 -3.21 0.22 0.00 0.70 0.00 0.00 55.95 53.76 2dgt s SER 148 Cb -0.19 -2.29 1.29 0.00 -1.71 0.00 0.00 66.02 63.13 2dgt s SER 148 CO -0.16 -0.52 1.62 -0.09 1.20 0.00 0.00 173.24 175.30 2dgt h ARG 149 N 7.07 0.14 -3.01 5.44 9.65 -2.02 -3.42 114.38 128.23 2dgt h ARG 149 Ca 0.22 -0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 59.09 2dgt h ARG 149 Cb 0.90 -0.03 -0.10 0.00 -1.39 0.00 0.00 29.97 29.34 2dgt h ARG 149 CO 1.07 0.09 0.21 -1.17 2.80 0.00 0.00 179.97 182.97 2dgt s LEU 150 N -10.12 -0.47 -0.12 3.80 2.96 -1.26 -5.05 118.68 108.42 2dgt s LEU 150 Ca -0.09 -0.15 0.14 0.00 -0.22 0.00 0.00 54.13 53.82 2dgt s LEU 150 Cb 0.31 2.61 0.29 0.00 0.50 0.00 0.00 46.19 49.90 2dgt s LEU 150 CO 0.80 -1.05 1.15 -2.11 -1.32 0.00 0.00 176.35 173.81 2dgt n ARG 151 N -0.39 1.02 -3.99 1.98 -4.01 -1.26 -5.01 116.66 104.99 2dgt n ARG 151 Ca -0.14 -2.45 -0.34 0.00 -1.04 0.00 0.00 57.85 53.87 2dgt n ARG 151 Cb 0.64 -1.21 -0.15 0.00 -3.04 0.00 0.00 32.46 28.70 2dgt n ARG 151 CO 0.00 0.00 0.00 0.99 -3.04 0.00 0.00 177.63 175.58 2dgt s THR 152 N -2.20 2.78 -0.48 8.89 2.01 -1.26 -5.06 115.64 120.33 2dgt s THR 152 Ca 0.28 -0.80 0.03 0.00 0.31 0.00 0.00 61.69 61.52 2dgt s THR 152 Cb 0.27 -2.28 0.13 0.00 0.01 0.00 0.00 72.50 70.63 2dgt s THR 152 CO -0.02 0.40 0.25 0.00 -0.69 0.00 0.00 174.62 174.56 2dgt s ALA 153 N 1.37 2.68 -1.74 7.40 0.00 -1.26 -4.85 121.76 125.36 2dgt s ALA 153 Ca 0.04 -2.91 -0.22 0.00 0.00 0.00 0.00 51.96 48.87 2dgt s ALA 153 Cb -0.15 -2.01 0.22 0.00 0.00 0.00 0.00 23.12 21.18 2dgt s ALA 153 CO -0.07 -2.05 0.54 -1.13 0.00 0.00 0.00 175.76 173.05 2dgt n SER 154 N 3.31 -1.62 0.00 0.00 3.41 -1.26 -4.85 113.62 112.61 2dgt n SER 154 Ca 0.08 -1.15 0.00 0.00 -0.26 0.00 0.00 58.87 57.53 2dgt n SER 154 Cb 0.34 -1.48 0.00 0.00 -0.26 0.00 0.00 64.21 62.81 2dgt n SER 154 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dgt n GLY 155 N -1.06 -0.66 3.77 5.00 0.00 -1.26 -4.88 105.19 106.11 2dgt n GLY 155 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 2dgt n GLY 155 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dgt s PRO 156 N -0.52 2.82 0.31 1.61 0.04 -1.26 -5.07 135.00 132.93 2dgt s PRO 156 Ca 0.00 1.40 0.05 0.00 0.04 0.00 0.00 61.00 62.49 2dgt s PRO 156 Cb 0.00 -1.95 -0.03 0.00 0.04 0.00 0.00 34.50 32.56 2dgt s PRO 156 CO 0.00 -1.24 0.27 0.45 0.04 0.00 0.00 177.00 176.52 2dgt s SER 157 N -2.55 1.36 0.08 6.66 0.15 -1.26 -5.14 113.70 113.01 2dgt s SER 157 Ca 0.67 -1.67 -0.05 0.00 0.70 0.00 0.00 55.95 55.60 2dgt s SER 157 Cb -0.21 0.54 -0.02 0.00 -1.71 0.00 0.00 66.02 64.62 2dgt s SER 157 CO 0.41 -1.05 0.09 -0.94 1.20 0.00 0.00 173.24 172.95 2dgt s SER 158 N -3.33 0.29 0.00 5.45 1.04 -1.26 -5.30 113.70 110.60 2dgt s SER 158 Ca 0.40 -0.88 0.00 0.00 0.48 0.00 0.00 55.95 55.94 2dgt s SER 158 Cb 0.03 0.28 0.00 0.00 0.10 0.00 0.00 66.02 66.43 2dgt s SER 158 CO 0.25 -0.69 0.00 0.61 0.98 0.00 0.00 173.24 174.39