#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 -4.28 -4.54 1.61 2.88 -1.26 -4.98 113.62 103.05 2dgt n SER 69 Ca 0.00 -0.39 -0.42 0.00 -1.33 0.00 0.00 58.87 56.73 2dgt n SER 69 Cb 0.00 -3.67 -0.07 0.00 -0.75 0.00 0.00 64.21 59.72 2dgt n SER 69 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dgt s SER 70 N -3.41 6.34 0.00 -3.46 1.04 -1.26 -4.76 113.70 108.19 2dgt s SER 70 Ca 0.30 -0.16 0.00 0.00 0.48 0.00 0.00 55.95 56.57 2dgt s SER 70 Cb -0.13 -2.30 0.00 0.00 0.10 0.00 0.00 66.02 63.68 2dgt s SER 70 CO 0.51 -0.64 0.00 0.61 0.98 0.00 0.00 173.24 174.70 2dgt n GLY 71 N 4.89 0.90 4.09 7.32 0.00 -1.26 -5.01 105.19 116.12 2dgt n GLY 71 Ca -0.03 -0.60 -0.34 0.00 0.00 0.00 0.00 46.02 45.05 2dgt n GLY 71 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dgt n SER 72 N 0.00 -0.91 -0.15 1.61 2.88 -1.26 -4.77 113.62 111.02 2dgt n SER 72 Ca 0.00 -1.07 -0.03 0.00 -1.33 0.00 0.00 58.87 56.44 2dgt n SER 72 Cb 0.00 -1.36 0.06 0.00 -0.75 0.00 0.00 64.21 62.16 2dgt n SER 72 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2dgt h SER 73 N -0.92 0.08 0.00 -3.46 0.02 -1.99 -3.45 113.55 103.83 2dgt h SER 73 Ca -0.53 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 2dgt h SER 73 Cb 1.19 0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.81 2dgt h SER 73 CO 0.72 0.07 0.00 0.61 -1.14 0.00 0.00 176.83 177.10 2dgt n GLY 74 N -1.27 2.96 3.04 -3.77 0.00 -1.26 -4.95 105.19 99.93 2dgt n GLY 74 Ca 0.05 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.97 2dgt n GLY 74 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dgt s LYS 75 N -0.15 0.46 0.36 1.61 0.00 -1.26 -5.17 119.74 115.60 2dgt s LYS 75 Ca 0.00 -0.83 0.04 0.00 0.00 0.00 0.00 55.97 55.18 2dgt s LYS 75 Cb 0.00 0.02 -0.01 0.00 0.00 0.00 0.00 37.83 37.83 2dgt s LYS 75 CO 0.00 -0.04 0.14 0.00 0.00 0.00 0.00 175.35 175.45 2dgt n ALA 76 N 1.12 0.53 -0.90 0.59 0.00 -1.26 -5.16 120.51 115.44 2dgt n ALA 76 Ca -0.21 -1.85 -0.18 0.00 0.00 0.00 0.00 53.44 51.20 2dgt n ALA 76 Cb 0.57 1.27 0.24 0.00 0.00 0.00 0.00 19.45 21.53 2dgt n ALA 76 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2dgt n SER 77 N -1.60 -2.46 -4.17 0.00 7.64 -1.26 -4.76 113.62 107.01 2dgt n SER 77 Ca -0.04 -1.06 -0.18 0.00 1.01 0.00 0.00 58.87 58.60 2dgt n SER 77 Cb 0.55 -0.94 -0.12 0.00 -1.01 0.00 0.00 64.21 62.69 2dgt n SER 77 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2dgt s THR 78 N -2.69 1.08 0.04 0.44 -4.23 0.61 -4.93 115.64 105.96 2dgt s THR 78 Ca 0.66 -1.37 0.09 0.00 -1.18 0.00 0.00 61.69 59.89 2dgt s THR 78 Cb -0.07 -1.12 -0.03 0.00 1.34 0.00 0.00 72.50 72.62 2dgt s THR 78 CO 0.51 -0.29 -0.26 -0.75 -0.54 0.00 0.00 174.62 173.30 2dgt s LYS 79 N -1.93 1.81 -0.13 3.99 2.47 -1.26 0.74 119.74 125.43 2dgt s LYS 79 Ca -0.01 -1.08 -0.01 0.00 -1.56 0.00 0.00 55.97 53.32 2dgt s LYS 79 Cb -0.09 -1.95 0.04 0.00 -1.46 0.00 0.00 37.83 34.36 2dgt s LYS 79 CO 0.02 0.51 -0.04 -0.51 0.16 0.00 0.00 175.35 175.49 2dgt s LEU 80 N -1.16 1.20 0.10 5.43 1.43 -0.06 -2.72 118.68 122.90 2dgt s LEU 80 Ca 0.11 -0.44 -0.19 0.00 -1.03 0.00 0.00 54.13 52.58 2dgt s LEU 80 Cb -0.10 -0.74 -0.07 0.00 0.03 0.00 0.00 46.19 45.31 2dgt s LEU 80 CO 0.02 -0.18 0.59 -2.28 0.23 0.00 0.00 176.35 174.72 2dgt s HIS 81 N 1.76 3.78 0.01 0.29 5.65 0.24 -0.23 115.29 126.80 2dgt s HIS 81 Ca 0.03 1.28 0.05 0.00 0.25 0.00 0.00 55.06 56.66 2dgt s HIS 81 Cb -0.14 -2.51 -0.02 0.00 -1.18 0.00 0.00 32.58 28.74 2dgt s HIS 81 CO -0.07 0.55 -0.14 0.08 -0.65 0.00 0.00 174.74 174.51 2dgt s VAL 82 N -1.18 1.09 0.23 0.89 1.01 -0.37 -0.71 120.40 121.35 2dgt s VAL 82 Ca 0.31 -0.78 0.07 0.00 0.00 0.00 0.00 61.98 61.58 2dgt s VAL 82 Cb -0.19 -0.95 -0.05 0.00 0.00 0.00 0.00 36.38 35.19 2dgt s VAL 82 CO 0.20 0.16 -0.11 -0.83 0.00 0.00 0.00 175.10 174.52 2dgt s GLY 83 N -0.71 1.56 -1.03 4.51 0.00 -0.37 0.35 107.32 111.63 2dgt s GLY 83 Ca 0.04 -1.74 -0.03 0.00 0.00 0.00 0.00 44.72 42.99 2dgt s GLY 83 CO 0.00 -1.77 0.87 -2.01 0.00 0.00 0.00 173.10 170.19 2dgt n ASN 84 N -0.45 -4.11 -4.89 1.64 5.15 0.66 -1.77 115.26 111.50 2dgt n ASN 84 Ca -0.07 -0.60 -0.29 0.00 -0.60 0.00 0.00 54.58 53.01 2dgt n ASN 84 Cb 0.62 -4.76 -0.02 0.00 -0.53 0.00 0.00 39.78 35.09 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 -3.34 4.84 0.25 -1.44 -1.09 0.03 -4.09 121.20 116.36 2dgt s ILE 85 Ca 0.21 0.46 -0.23 0.00 -2.23 0.00 0.00 60.65 58.86 2dgt s ILE 85 Cb -0.03 -3.77 -0.09 0.00 -1.58 0.00 0.00 42.46 36.99 2dgt s ILE 85 CO 0.67 -0.62 0.82 -0.55 -1.23 0.00 0.00 174.94 174.03 2dgt s SER 86 N -3.46 7.23 0.00 3.58 0.15 -1.26 -4.71 113.70 115.22 2dgt s SER 86 Ca 0.50 1.62 0.15 0.00 0.70 0.00 0.00 55.95 58.91 2dgt s SER 86 Cb -0.10 -2.49 0.78 0.00 -1.71 0.00 0.00 66.02 62.49 2dgt s SER 86 CO 0.36 0.03 1.40 -0.81 1.20 0.00 0.00 173.24 175.41 2dgt n PRO 87 N 0.83 0.25 -0.04 5.44 -0.04 -1.26 -1.93 135.00 138.25 2dgt n PRO 87 Ca -0.01 0.12 0.02 0.00 -0.04 0.00 0.00 63.50 63.59 2dgt n PRO 87 Cb 0.50 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.50 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 -1.24 0.62 -2.07 0.52 -2.24 -1.26 -5.04 114.28 103.57 2dgt n THR 88 Ca 0.08 -0.81 -0.38 0.00 -2.27 0.00 0.00 64.05 60.67 2dgt n THR 88 Cb 0.11 0.72 0.01 0.00 -2.10 0.00 0.00 70.33 69.07 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 -1.39 1.78 0.46 0.00 -4.23 -1.26 -5.01 115.64 105.99 2dgt s THR 90 Ca 0.64 -0.97 0.30 0.00 -1.18 0.00 0.00 61.69 60.48 2dgt s THR 90 Cb -0.35 -1.48 0.50 0.00 1.34 0.00 0.00 72.50 72.52 2dgt s THR 90 CO 0.42 0.49 1.71 0.78 -0.54 0.00 0.00 174.62 177.48 2dgt h ASN 91 N 5.55 0.22 0.09 3.99 4.21 -1.96 1.10 115.58 128.78 2dgt h ASN 91 Ca -0.41 0.07 -0.14 0.00 1.21 0.00 0.00 56.30 57.04 2dgt h ASN 91 Cb 1.13 0.05 -0.01 0.00 -1.12 0.00 0.00 38.32 38.37 2dgt h ASN 91 CO 0.47 -0.04 -0.47 -0.61 -1.29 0.00 0.00 177.43 175.49 2dgt h GLN 92 N 0.15 0.45 0.03 0.81 5.75 -1.98 0.46 115.11 120.79 2dgt h GLN 92 Ca 0.70 -0.25 -0.00 0.00 -0.15 0.00 0.00 58.65 58.95 2dgt h GLN 92 Cb 2.32 0.02 0.00 0.00 1.07 0.00 0.00 27.48 30.88 2dgt h GLN 92 CO -0.24 0.83 -0.02 0.93 -2.65 0.00 0.00 178.83 177.69 2dgt h GLU 93 N 0.36 -0.04 0.39 1.69 4.39 0.82 -1.91 114.58 120.27 2dgt h GLU 93 Ca 0.02 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.70 2dgt h GLU 93 Cb 0.97 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.63 2dgt h GLU 93 CO 0.08 0.46 -0.19 1.25 -1.16 0.00 0.00 179.01 179.46 2dgt h LEU 94 N -0.57 -0.44 -0.14 1.33 5.85 -1.32 -2.43 115.31 117.59 2dgt h LEU 94 Ca -0.00 -0.13 0.05 0.00 0.84 0.00 0.00 57.88 58.63 2dgt h LEU 94 Cb 0.53 0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.61 2dgt h LEU 94 CO 0.01 -0.06 -0.38 -0.09 -0.34 0.00 0.00 178.44 177.58 2dgt h ARG 95 N -0.88 -0.43 -0.66 1.25 2.43 -1.03 -1.08 114.38 113.97 2dgt h ARG 95 Ca -0.05 0.03 0.14 0.00 -0.81 0.00 0.00 59.98 59.28 2dgt h ARG 95 Cb 0.55 0.10 -0.10 0.00 -0.42 0.00 0.00 29.97 30.09 2dgt h ARG 95 CO 0.09 -0.29 0.11 0.00 -1.51 0.00 0.00 179.97 178.37 2dgt h ALA 96 N 0.26 0.78 -0.25 2.80 0.00 -1.41 0.63 119.26 122.06 2dgt h ALA 96 Ca 0.09 0.16 0.04 0.00 0.00 0.00 0.00 54.91 55.20 2dgt h ALA 96 Cb 0.59 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.59 2dgt h ALA 96 CO -0.38 -0.34 0.02 -0.22 0.00 0.00 0.00 179.25 178.32 2dgt h LYS 97 N 0.22 0.10 0.00 0.00 3.64 -0.77 -1.71 116.57 118.04 2dgt h LYS 97 Ca 0.36 -0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.64 2dgt h LYS 97 Cb 0.58 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.37 2dgt h LYS 97 CO -0.48 0.07 -0.46 0.74 -2.27 0.00 0.00 179.45 177.04 2dgt h PHE 98 N 0.10 0.00 -0.02 1.91 -1.00 -0.02 -2.87 116.94 115.05 2dgt h PHE 98 Ca 0.12 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.89 2dgt h PHE 98 Cb 0.14 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.70 2dgt h PHE 98 CO -0.18 0.46 -0.02 0.93 -1.61 0.00 0.00 178.31 177.88 2dgt h GLU 99 N 0.00 0.03 -0.38 1.51 5.08 0.11 -1.52 114.58 119.41 2dgt h GLU 99 Ca -0.00 -0.00 0.10 0.00 -1.00 0.00 0.00 59.36 58.45 2dgt h GLU 99 Cb 0.87 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.10 2dgt h GLU 99 CO 0.06 0.05 0.27 0.93 -1.00 0.00 0.00 179.01 179.32 2dgt h GLU 100 N 0.03 0.06 0.00 2.33 5.08 -1.23 -2.83 114.58 118.02 2dgt h GLU 100 Ca 0.01 -0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 2dgt h GLU 100 Cb 0.06 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2dgt h GLU 100 CO 0.00 0.04 -0.55 1.88 -1.00 0.00 0.00 179.01 179.38 2dgt h TYR 101 N 0.07 0.00 -3.79 4.33 -1.99 -1.46 -3.50 116.97 110.63 2dgt h TYR 101 Ca 0.18 0.00 -0.09 0.00 2.00 0.00 0.00 58.73 60.82 2dgt h TYR 101 Cb 0.63 0.00 -0.11 0.00 2.00 0.00 0.00 36.73 39.25 2dgt h TYR 101 CO -0.00 0.93 -0.22 0.20 -0.00 0.00 0.00 178.16 179.08 2dgt s GLY 102 N -4.38 0.56 -1.08 3.88 0.00 -1.07 -4.85 107.32 100.38 2dgt s GLY 102 Ca -0.20 -0.91 -0.23 0.00 0.00 0.00 0.00 44.72 43.38 2dgt s GLY 102 CO 0.50 -0.74 1.94 2.56 0.00 0.00 0.00 173.10 177.37 2dgt s PRO 103 N -4.00 2.51 0.52 2.90 0.04 -1.26 -3.99 135.00 131.71 2dgt s PRO 103 Ca 0.21 -0.84 -0.20 0.00 0.04 0.00 0.00 61.00 60.22 2dgt s PRO 103 Cb 0.01 -5.17 -0.10 0.00 0.04 0.00 0.00 34.50 29.28 2dgt s PRO 103 CO 0.05 -3.77 0.54 0.28 0.04 0.00 0.00 177.00 174.14 2dgt n VAL 104 N 7.84 2.05 -0.13 -0.36 0.31 -1.26 -4.12 118.33 122.66 2dgt n VAL 104 Ca 0.43 -0.50 -0.24 0.00 -0.01 0.00 0.00 64.34 64.02 2dgt n VAL 104 Cb 0.47 -0.65 -0.11 0.00 -0.91 0.00 0.00 33.84 32.64 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 -1.39 1.51 -3.46 2.52 5.41 0.93 -4.90 119.36 119.98 2dgt n ILE 105 Ca 0.11 -0.48 0.01 0.00 1.00 0.00 0.00 62.75 63.39 2dgt n ILE 105 Cb 0.45 -1.65 -0.04 0.00 -0.71 0.00 0.00 39.64 37.69 2dgt n ILE 105 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 2dgt s GLU 106 N -2.51 0.39 0.08 0.38 2.02 -1.14 -5.02 118.70 112.89 2dgt s GLU 106 Ca -0.37 0.95 0.02 0.00 0.02 0.00 0.00 54.97 55.60 2dgt s GLU 106 Cb 0.12 0.57 -0.04 0.00 0.10 0.00 0.00 34.13 34.88 2dgt s GLU 106 CO 0.54 -0.15 0.11 0.00 0.02 0.00 0.00 175.26 175.78 2dgt s ASP 108 N -2.42 -0.12 0.05 0.00 1.01 -0.51 -4.99 116.67 109.68 2dgt s ASP 108 Ca 0.30 0.31 0.00 0.00 0.71 0.00 0.00 52.55 53.87 2dgt s ASP 108 Cb -0.12 0.22 -0.04 0.00 1.01 0.00 0.00 42.92 43.98 2dgt s ASP 108 CO 0.23 -0.13 0.19 -0.63 0.21 0.00 0.00 175.17 175.05 2dgt s ILE 109 N 0.96 5.31 0.33 0.77 1.01 -1.26 -0.77 121.20 127.55 2dgt s ILE 109 Ca -0.07 -0.40 0.03 0.00 0.00 0.00 0.00 60.65 60.21 2dgt s ILE 109 Cb -0.09 -3.58 -0.04 0.00 0.01 0.00 0.00 42.46 38.76 2dgt s ILE 109 CO -0.05 0.16 0.12 -0.69 0.00 0.00 0.00 174.94 174.48 2dgt s VAL 110 N -1.48 0.62 0.00 2.92 1.01 0.33 -4.93 120.40 118.87 2dgt s VAL 110 Ca 0.34 -2.00 0.00 0.00 0.00 0.00 0.00 61.98 60.32 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 0.57 0.29 0.00 0.00 0.00 175.10 176.23 2dgt n LYS 111 N -0.68 0.00 -0.01 2.72 5.02 -1.26 -3.39 118.16 120.56 2dgt n LYS 111 Ca -0.02 0.57 0.00 0.00 -2.02 0.00 0.00 58.31 56.85 2dgt n LYS 111 Cb 0.65 -0.96 0.01 0.00 -0.02 0.00 0.00 35.03 34.71 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 -1.78 1.88 -3.96 4.39 9.92 -1.26 -4.69 116.55 121.05 2dgt n ASP 112 Ca 0.00 -1.85 -0.21 0.00 -0.53 0.00 0.00 54.79 52.20 2dgt n ASP 112 Cb 0.00 -0.01 -0.09 0.00 -0.64 0.00 0.00 41.12 40.38 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 -0.85 1.70 0.36 1.24 1.13 -1.22 0.24 117.35 119.94 2dgt s TYR 113 Ca 0.01 -1.37 -0.11 0.00 -1.41 0.00 0.00 57.07 54.20 2dgt s TYR 113 Cb 0.00 -0.95 0.03 0.00 -1.10 0.00 0.00 41.96 39.95 2dgt s TYR 113 CO 0.01 -0.48 0.65 0.00 -2.51 0.00 0.00 175.55 173.22 2dgt s ALA 114 N -3.45 -0.14 -0.25 9.51 0.00 0.16 0.12 121.76 127.71 2dgt s ALA 114 Ca 0.33 -1.05 -0.04 0.00 0.00 0.00 0.00 51.96 51.20 2dgt s ALA 114 Cb 0.04 0.88 0.14 0.00 0.00 0.00 0.00 23.12 24.18 2dgt s ALA 114 CO 0.18 -0.91 0.44 -0.06 0.00 0.00 0.00 175.76 175.41 2dgt s PHE 115 N -2.71 -1.00 -0.32 0.00 0.40 0.05 -1.24 117.98 113.16 2dgt s PHE 115 Ca 0.21 1.23 -0.11 0.00 -0.60 0.00 0.00 56.93 57.66 2dgt s PHE 115 Cb -0.03 0.23 -0.01 0.00 0.51 0.00 0.00 43.02 43.71 2dgt s PHE 115 CO 0.15 -0.70 0.19 0.08 0.70 0.00 0.00 175.22 175.64 2dgt s VAL 116 N 2.64 4.95 -0.60 -0.44 1.01 0.69 -1.43 120.40 127.21 2dgt s VAL 116 Ca 0.10 -0.29 -0.24 0.00 0.00 0.00 0.00 61.98 61.56 2dgt s VAL 116 Cb -0.14 -3.52 0.05 0.00 0.00 0.00 0.00 36.38 32.77 2dgt s VAL 116 CO -0.16 0.05 0.98 -2.28 0.00 0.00 0.00 175.10 173.68 2dgt s HIS 117 N 1.67 2.71 0.44 5.22 2.46 -0.39 -0.88 115.29 126.52 2dgt s HIS 117 Ca 0.05 -0.20 -0.03 0.00 0.47 0.00 0.00 55.06 55.35 2dgt s HIS 117 Cb -0.17 -4.19 -0.03 0.00 -0.13 0.00 0.00 32.58 28.05 2dgt s HIS 117 CO 0.08 -1.51 0.70 -1.64 -2.47 0.00 0.00 174.74 169.90 2dgt s MET 118 N 4.14 3.49 -0.12 2.88 -1.94 0.23 -0.05 119.30 127.93 2dgt s MET 118 Ca 0.28 -0.01 -0.06 0.00 -1.71 0.00 0.00 55.69 54.18 2dgt s MET 118 Cb -0.14 -2.48 -0.02 0.00 2.01 0.00 0.00 34.83 34.21 2dgt s MET 118 CO 0.16 -0.10 -0.12 1.49 -0.01 0.00 0.00 175.02 176.44 2dgt h GLU 119 N 0.40 0.00 -5.79 2.03 4.81 -1.82 0.17 114.58 114.39 2dgt h GLU 119 Ca -0.48 0.00 -0.65 0.00 -0.13 0.00 0.00 59.36 58.10 2dgt h GLU 119 Cb 1.21 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 30.53 2dgt h GLU 119 CO 0.61 0.00 -0.50 1.03 -0.73 0.00 0.00 179.01 179.42 2dgt s ARG 120 N -1.97 3.40 0.04 1.92 1.81 -1.26 -3.87 118.95 119.02 2dgt s ARG 120 Ca -0.10 -0.30 -0.24 0.00 -1.72 0.00 0.00 55.73 53.37 2dgt s ARG 120 Cb 0.01 -3.09 -0.17 0.00 -0.45 0.00 0.00 34.95 31.26 2dgt s ARG 120 CO 0.15 0.70 1.52 0.00 -0.68 0.00 0.00 175.30 176.98 2dgt h ALA 121 N 4.10 0.04 -1.07 2.13 0.00 -1.92 -2.06 119.26 120.49 2dgt h ALA 121 Ca -0.50 -0.12 0.38 0.00 0.00 0.00 0.00 54.91 54.66 2dgt h ALA 121 Cb 1.20 -0.01 -0.16 0.00 0.00 0.00 0.00 17.79 18.82 2dgt h ALA 121 CO 0.66 -0.34 0.62 0.93 0.00 0.00 0.00 179.25 181.11 2dgt h GLU 122 N -0.19 0.15 0.10 0.00 4.39 -1.99 0.46 114.58 117.51 2dgt h GLU 122 Ca 0.01 -0.01 -0.19 0.00 0.34 0.00 0.00 59.36 59.51 2dgt h GLU 122 Cb 0.24 -0.03 0.02 0.00 -0.10 0.00 0.00 28.75 28.88 2dgt h GLU 122 CO 0.00 0.10 -0.81 -0.44 -1.16 0.00 0.00 179.01 176.70 2dgt h ASP 123 N 0.16 0.53 0.23 1.42 3.32 -1.84 -3.13 116.42 117.12 2dgt h ASP 123 Ca 0.79 -0.88 0.00 0.00 0.02 0.00 0.00 57.03 56.96 2dgt h ASP 123 Cb 2.07 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 41.43 2dgt h ASP 123 CO -0.62 1.37 -0.22 0.00 -1.72 0.00 0.00 179.24 178.05 2dgt h ALA 124 N 0.17 -0.46 -0.85 3.45 0.00 0.45 0.55 119.26 122.57 2dgt h ALA 124 Ca -0.13 -0.07 0.13 0.00 0.00 0.00 0.00 54.91 54.84 2dgt h ALA 124 Cb 1.59 0.31 -0.06 0.00 0.00 0.00 0.00 17.79 19.62 2dgt h ALA 124 CO 0.15 -0.79 0.55 0.28 0.00 0.00 0.00 179.25 179.45 2dgt h VAL 125 N -0.48 0.86 0.03 0.00 2.07 -0.66 -2.10 116.25 115.96 2dgt h VAL 125 Ca -0.01 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.28 2dgt h VAL 125 Cb 0.44 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 2dgt h VAL 125 CO -0.04 0.12 -0.02 -0.33 0.02 0.00 0.00 177.57 177.32 2dgt h GLU 126 N 0.67 -0.04 -0.71 1.57 5.08 -1.35 -2.33 114.58 117.47 2dgt h GLU 126 Ca 0.42 0.00 0.21 0.00 -1.00 0.00 0.00 59.36 58.99 2dgt h GLU 126 Cb 0.67 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.91 2dgt h GLU 126 CO -0.18 0.42 0.57 0.00 -1.00 0.00 0.00 179.01 178.82 2dgt h ALA 127 N 0.41 2.59 0.03 3.43 0.00 -0.26 -1.84 119.26 123.61 2dgt h ALA 127 Ca -0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2dgt h ALA 127 Cb 0.49 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2dgt h ALA 127 CO 0.01 -0.94 -0.02 0.82 0.00 0.00 0.00 179.25 179.12 2dgt h ILE 128 N 0.00 0.00 -0.62 0.00 2.04 -1.30 0.11 117.51 117.74 2dgt h ILE 128 Ca 0.34 -0.62 0.18 0.00 1.00 0.00 0.00 64.86 65.76 2dgt h ILE 128 Cb 1.48 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.53 2dgt h ILE 128 CO -0.00 0.00 0.90 -0.09 0.00 0.00 0.00 178.15 178.95 2dgt h ARG 129 N -0.66 0.00 0.00 2.37 2.43 -1.06 1.42 114.38 118.88 2dgt h ARG 129 Ca -0.00 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.07 2dgt h ARG 129 Cb 0.04 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 2dgt h ARG 129 CO 0.01 0.00 -1.19 0.41 -1.51 0.00 0.00 179.97 177.68 2dgt n GLY 130 N -1.58 -0.62 0.00 2.80 0.00 -0.72 -4.37 105.19 100.70 2dgt n GLY 130 Ca 0.13 -0.24 0.08 0.00 0.00 0.00 0.00 46.02 45.99 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 -4.45 0.00 -4.63 0.99 4.77 0.39 -4.70 117.00 109.37 2dgt n LEU 131 Ca -0.21 0.16 -0.43 0.00 -0.03 0.00 0.00 56.01 55.50 2dgt n LEU 131 Cb 0.54 -0.16 -0.03 0.00 -2.33 0.00 0.00 43.42 41.45 2dgt n LEU 131 CO 0.16 -0.08 1.38 -0.62 -1.33 0.00 0.00 177.39 176.90 2dgt s ASP 132 N -2.32 6.39 -0.95 -1.43 -1.08 0.48 -3.08 116.67 114.67 2dgt s ASP 132 Ca 0.20 1.69 -0.01 0.00 -0.52 0.00 0.00 52.55 53.90 2dgt s ASP 132 Cb 0.11 -2.53 -0.01 0.00 -1.46 0.00 0.00 42.92 39.02 2dgt s ASP 132 CO 0.22 -1.24 0.80 0.59 0.52 0.00 0.00 175.17 176.06 2dgt n ASN 133 N 8.39 -3.02 -4.25 -0.34 4.13 -1.10 -4.93 115.26 114.15 2dgt n ASN 133 Ca 0.19 -0.53 -0.32 0.00 1.68 0.00 0.00 54.58 55.60 2dgt n ASN 133 Cb 0.45 -4.31 -0.16 0.00 -1.54 0.00 0.00 39.78 34.22 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 -3.30 2.34 -0.31 3.41 -4.23 -1.18 -4.92 115.64 107.45 2dgt s THR 134 Ca 0.10 -0.91 -0.34 0.00 -1.18 0.00 0.00 61.69 59.36 2dgt s THR 134 Cb -0.01 -1.93 -0.10 0.00 1.34 0.00 0.00 72.50 71.80 2dgt s THR 134 CO 0.60 0.55 2.18 1.21 -0.54 0.00 0.00 174.62 178.62 2dgt n GLU 135 N 3.63 1.32 -3.78 3.99 2.13 -1.26 -2.80 120.64 123.86 2dgt n GLU 135 Ca -0.19 0.37 -0.37 0.00 0.66 0.00 0.00 57.16 57.63 2dgt n GLU 135 Cb 0.53 -2.64 -0.13 0.00 0.27 0.00 0.00 31.44 29.47 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 7.38 3.16 -1.27 4.31 2.19 0.22 -4.57 117.98 129.41 2dgt s PHE 136 Ca 1.07 -1.10 -0.06 0.00 0.33 0.00 0.00 56.93 57.17 2dgt s PHE 136 Cb -0.74 -2.24 0.04 0.00 -1.31 0.00 0.00 43.02 38.78 2dgt s PHE 136 CO 0.46 -0.61 0.38 1.04 1.83 0.00 0.00 175.22 178.32 2dgt n GLN 137 N 4.84 -3.34 0.00 10.12 6.02 -1.26 -1.07 117.38 132.69 2dgt n GLN 137 Ca -0.14 0.57 0.00 0.00 -0.01 0.00 0.00 57.00 57.42 2dgt n GLN 137 Cb 0.47 -5.28 0.00 0.00 1.02 0.00 0.00 30.24 26.45 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 -1.13 3.10 3.69 1.08 0.00 -1.26 -5.00 105.19 105.67 2dgt n GLY 138 Ca -0.06 -0.91 -0.35 0.00 0.00 0.00 0.00 46.02 44.70 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 3.99 -0.04 1.61 -2.85 -0.23 -4.94 119.74 117.28 2dgt s LYS 139 Ca 0.00 -0.28 -0.30 0.00 -1.00 0.00 0.00 55.97 54.39 2dgt s LYS 139 Cb 0.00 -3.28 -0.03 0.00 -2.06 0.00 0.00 37.83 32.46 2dgt s LYS 139 CO 0.00 0.34 1.04 0.50 0.10 0.00 0.00 175.35 177.33 2dgt s ARG 140 N 0.21 4.46 0.07 1.78 3.52 -1.26 0.73 118.95 128.46 2dgt s ARG 140 Ca 0.06 1.48 0.02 0.00 -0.13 0.00 0.00 55.73 57.17 2dgt s ARG 140 Cb -0.12 -3.50 -0.04 0.00 -1.56 0.00 0.00 34.95 29.74 2dgt s ARG 140 CO -0.00 -0.24 0.10 0.00 -0.81 0.00 0.00 175.30 174.35 2dgt s MET 141 N 1.60 2.99 -0.33 5.12 0.00 -1.12 -4.79 119.30 122.76 2dgt s MET 141 Ca 0.52 -0.63 -0.16 0.00 0.00 0.00 0.00 55.69 55.41 2dgt s MET 141 Cb -0.21 -2.79 -0.01 0.00 0.00 0.00 0.00 34.83 31.81 2dgt s MET 141 CO 0.23 0.58 0.42 -1.01 0.00 0.00 0.00 175.02 175.24 2dgt s HIS 142 N -1.39 3.21 -0.12 3.16 0.09 -0.73 -2.69 115.29 116.82 2dgt s HIS 142 Ca 0.30 0.15 -0.06 0.00 -0.00 0.00 0.00 55.06 55.45 2dgt s HIS 142 Cb -0.12 -2.74 -0.04 0.00 -0.00 0.00 0.00 32.58 29.68 2dgt s HIS 142 CO 0.22 -0.42 0.09 0.08 -0.00 0.00 0.00 174.74 174.70 2dgt s VAL 143 N 2.16 5.03 0.16 -0.90 1.01 -1.26 -1.24 120.40 125.36 2dgt s VAL 143 Ca 0.15 0.03 -0.10 0.00 0.00 0.00 0.00 61.98 62.06 2dgt s VAL 143 Cb -0.16 -3.18 0.04 0.00 0.00 0.00 0.00 36.38 33.08 2dgt s VAL 143 CO 0.12 0.59 0.52 0.00 0.00 0.00 0.00 175.10 176.33 2dgt n GLN 144 N 2.29 0.50 -2.52 2.72 10.64 0.11 -4.67 117.38 126.45 2dgt n GLN 144 Ca -0.19 -1.04 -0.42 0.00 -1.83 0.00 0.00 57.00 53.52 2dgt n GLN 144 Cb 0.54 1.35 -0.03 0.00 -0.86 0.00 0.00 30.24 31.24 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 4.32 0.08 2.61 2.01 -1.26 0.79 118.68 127.23 2dgt s LEU 145 Ca 0.11 1.81 -0.31 0.00 0.01 0.00 0.00 54.13 55.75 2dgt s LEU 145 Cb -0.02 -3.57 -0.07 0.00 0.01 0.00 0.00 46.19 42.54 2dgt s LEU 145 CO 0.05 -0.48 1.34 -0.55 1.01 0.00 0.00 176.35 177.72 2dgt s SER 146 N 1.23 6.90 -0.51 2.29 0.15 -1.10 -4.56 113.70 118.10 2dgt s SER 146 Ca 0.55 2.20 -0.18 0.00 0.70 0.00 0.00 55.95 59.22 2dgt s SER 146 Cb -0.25 -2.58 0.07 0.00 -1.71 0.00 0.00 66.02 61.55 2dgt s SER 146 CO 0.24 -0.61 0.59 0.42 1.20 0.00 0.00 173.24 175.08 2dgt s THR 147 N 1.33 4.94 -0.09 6.45 -4.23 -1.26 -4.90 115.64 117.88 2dgt s THR 147 Ca 0.63 -0.70 -0.04 0.00 -1.18 0.00 0.00 61.69 60.40 2dgt s THR 147 Cb -0.34 -4.30 0.05 0.00 1.34 0.00 0.00 72.50 69.25 2dgt s THR 147 CO 0.29 -0.81 0.21 -0.44 -0.54 0.00 0.00 174.62 173.33 2dgt s SER 148 N 2.83 -0.07 -0.20 3.99 0.01 -1.26 -5.03 113.70 113.96 2dgt s SER 148 Ca 0.12 0.44 0.13 0.00 1.31 0.00 0.00 55.95 57.95 2dgt s SER 148 Cb -0.21 0.35 0.44 0.00 0.21 0.00 0.00 66.02 66.81 2dgt s SER 148 CO 0.10 -0.17 1.20 0.54 0.41 0.00 0.00 173.24 175.32 2dgt n ARG 149 N 4.42 1.87 -0.51 12.44 1.74 -1.26 -4.84 116.66 130.52 2dgt n ARG 149 Ca -0.22 -3.36 0.39 0.00 -0.77 0.00 0.00 57.85 53.89 2dgt n ARG 149 Cb 0.52 -1.57 0.62 0.00 -1.02 0.00 0.00 32.46 31.01 2dgt n ARG 149 CO 0.00 0.00 0.00 1.47 -1.52 0.00 0.00 177.63 177.58 2dgt n LEU 150 N -0.79 0.05 -3.69 0.55 -0.00 -1.26 -2.90 117.00 108.97 2dgt n LEU 150 Ca 0.23 0.89 -0.30 0.00 -0.00 0.00 0.00 56.01 56.83 2dgt n LEU 150 Cb 0.82 -0.44 -0.15 0.00 -0.00 0.00 0.00 43.42 43.65 2dgt n LEU 150 CO 0.07 -0.92 -0.33 -0.60 -0.00 0.00 0.00 177.39 175.61 2dgt s ARG 151 N -4.61 0.62 -0.07 1.47 3.52 -1.26 -5.10 118.95 113.51 2dgt s ARG 151 Ca -0.05 -1.00 -0.00 0.00 -0.13 0.00 0.00 55.73 54.55 2dgt s ARG 151 Cb 0.22 -1.81 0.02 0.00 -1.56 0.00 0.00 34.95 31.83 2dgt s ARG 151 CO 0.69 -1.01 -0.04 -0.08 -0.81 0.00 0.00 175.30 174.06 2dgt s THR 152 N 1.65 0.61 -0.15 4.11 -1.32 -1.14 -5.13 115.64 114.27 2dgt s THR 152 Ca 0.10 -0.08 0.02 0.00 -1.21 0.00 0.00 61.69 60.52 2dgt s THR 152 Cb -0.17 -0.68 0.01 0.00 -1.51 0.00 0.00 72.50 70.15 2dgt s THR 152 CO -0.26 0.28 -0.20 0.00 -2.21 0.00 0.00 174.62 172.22 2dgt s ALA 153 N 1.47 2.32 0.18 11.08 0.00 -1.26 -5.00 121.76 130.55 2dgt s ALA 153 Ca -0.02 -1.11 -0.01 0.00 0.00 0.00 0.00 51.96 50.82 2dgt s ALA 153 Cb -0.13 -1.08 0.08 0.00 0.00 0.00 0.00 23.12 21.99 2dgt s ALA 153 CO -0.03 -0.09 1.45 0.66 0.00 0.00 0.00 175.76 177.75 2dgt h SER 154 N 7.43 0.48 -4.68 0.00 4.64 -2.05 -3.49 113.55 115.88 2dgt h SER 154 Ca -0.35 -0.30 0.00 0.00 -0.47 0.00 0.00 61.79 60.67 2dgt h SER 154 Cb 1.18 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 2dgt h SER 154 CO 0.57 1.03 -0.52 0.61 -0.87 0.00 0.00 176.83 177.65 2dgt n GLY 155 N 0.50 -2.21 0.26 -0.77 0.00 -1.26 -4.90 105.19 96.80 2dgt n GLY 155 Ca -0.04 0.69 0.17 0.00 0.00 0.00 0.00 46.02 46.84 2dgt n GLY 155 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dgt h PRO 156 N 1.81 0.00 -5.30 1.61 0.13 -2.06 -3.40 132.00 124.79 2dgt h PRO 156 Ca 0.00 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.02 2dgt h PRO 156 Cb 0.47 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.59 2dgt h PRO 156 CO 0.12 0.00 0.33 0.45 -0.23 0.00 0.00 178.00 178.68 2dgt s SER 157 N -5.48 4.02 -1.04 1.44 0.15 -1.26 -4.85 113.70 106.69 2dgt s SER 157 Ca 0.01 -0.89 -0.16 0.00 0.70 0.00 0.00 55.95 55.62 2dgt s SER 157 Cb 0.09 -2.58 0.16 0.00 -1.71 0.00 0.00 66.02 61.98 2dgt s SER 157 CO 0.52 -4.04 1.21 -0.55 1.20 0.00 0.00 173.24 171.57 2dgt s SER 158 N 8.53 6.86 0.00 5.45 0.15 -1.26 -5.26 113.70 128.17 2dgt s SER 158 Ca 0.80 -2.57 0.00 0.00 0.70 0.00 0.00 55.95 54.87 2dgt s SER 158 Cb -0.06 -2.37 0.00 0.00 -1.71 0.00 0.00 66.02 61.88 2dgt s SER 158 CO 0.13 -0.84 0.00 0.61 1.20 0.00 0.00 173.24 174.34