#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wwb n ASP 58 N 0.00 3.33 -4.56 1.96 8.00 -1.26 -5.00 116.55 119.02 2wwb n ASP 58 Ca 0.00 -3.34 -0.28 0.00 0.71 0.00 0.00 54.79 51.87 2wwb n ASP 58 Cb 0.00 -0.40 -0.09 0.00 -0.02 0.00 0.00 41.12 40.60 2wwb n ASP 58 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2wwb s SER 59 N -3.44 3.53 0.23 -2.24 0.15 -1.26 -5.16 113.70 105.51 2wwb s SER 59 Ca 0.43 -1.53 0.00 0.00 0.70 0.00 0.00 55.95 55.55 2wwb s SER 59 Cb 0.38 0.14 -0.04 0.00 -1.71 0.00 0.00 66.02 64.80 2wwb s SER 59 CO -0.01 -0.71 0.15 -0.72 1.20 0.00 0.00 173.24 173.15 2wwb s TYR 60 N -2.96 1.28 -2.14 3.44 1.13 -1.26 -5.07 117.35 111.77 2wwb s TYR 60 Ca 0.23 -1.41 0.27 0.00 -1.41 0.00 0.00 57.07 54.75 2wwb s TYR 60 Cb 0.05 -0.61 0.87 0.00 -1.10 0.00 0.00 41.96 41.17 2wwb s TYR 60 CO 0.12 -0.65 1.64 1.63 -2.51 0.00 0.00 175.55 175.77 2wwb n LYS 61 N -0.34 1.27 0.00 -3.49 5.02 -1.26 -4.97 118.16 114.38 2wwb n LYS 61 Ca 0.03 -0.76 0.00 0.00 -2.02 0.00 0.00 58.31 55.56 2wwb n LYS 61 Cb 0.65 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 34.18 2wwb n LYS 61 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 2wwb n VAL 62 N -0.20 0.00 -1.81 -0.18 0.24 -1.26 -4.81 118.33 110.31 2wwb n VAL 62 Ca 0.15 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 62.03 2wwb n VAL 62 Cb 0.36 0.00 -0.03 0.00 -1.47 0.00 0.00 33.84 32.70 2wwb n VAL 62 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2wwb s ILE 63 N 0.00 3.22 -0.16 1.34 1.01 -1.26 -1.19 121.20 124.15 2wwb s ILE 63 Ca 0.00 0.30 -0.11 0.00 0.00 0.00 0.00 60.65 60.84 2wwb s ILE 63 Cb 0.00 -3.20 -0.23 0.00 0.01 0.00 0.00 42.46 39.04 2wwb s ILE 63 CO 0.00 -0.02 0.27 -0.62 0.00 0.00 0.00 174.94 174.56 2wwb n GLU 64 N 7.24 0.69 -3.60 2.79 1.02 -0.69 -4.92 120.64 123.18 2wwb n GLU 64 Ca 0.19 0.35 -0.08 0.00 -0.02 0.00 0.00 57.16 57.59 2wwb n GLU 64 Cb 0.42 -1.70 -0.02 0.00 -0.02 0.00 0.00 31.44 30.11 2wwb n GLU 64 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 2wwb s GLN 65 N -2.50 1.21 0.33 3.49 0.00 -0.85 -5.04 119.66 116.31 2wwb s GLN 65 Ca -0.25 -0.55 -0.27 0.00 -0.00 0.00 0.00 55.36 54.28 2wwb s GLN 65 Cb 0.07 0.49 -0.09 0.00 0.00 0.00 0.00 33.01 33.47 2wwb s GLN 65 CO 0.70 -0.54 1.04 -1.25 0.00 0.00 0.00 175.29 175.24 2wwb s PRO 66 N -3.48 4.48 -0.11 9.60 0.04 -1.26 -0.48 135.00 143.79 2wwb s PRO 66 Ca 0.07 1.60 -0.17 0.00 0.04 0.00 0.00 61.00 62.54 2wwb s PRO 66 Cb -0.02 -2.91 -0.05 0.00 0.04 0.00 0.00 34.50 31.57 2wwb s PRO 66 CO -0.05 0.12 0.42 -1.50 0.04 0.00 0.00 177.00 176.04 2wwb s ILE 67 N -1.41 5.19 -0.09 0.56 2.07 -0.94 -4.78 121.20 121.80 2wwb s ILE 67 Ca 0.50 0.84 0.04 0.00 -1.41 0.00 0.00 60.65 60.62 2wwb s ILE 67 Cb -0.26 -3.76 -0.00 0.00 0.13 0.00 0.00 42.46 38.57 2wwb s ILE 67 CO 0.33 0.38 -0.24 0.28 -1.91 0.00 0.00 174.94 173.78 2wwb s THR 68 N 0.33 2.04 0.27 4.00 -1.32 -1.26 -4.63 115.64 115.06 2wwb s THR 68 Ca 0.23 -1.01 -0.15 0.00 -1.21 0.00 0.00 61.69 59.55 2wwb s THR 68 Cb -0.15 -1.76 0.06 0.00 -1.51 0.00 0.00 72.50 69.14 2wwb s THR 68 CO 0.09 0.56 0.77 -1.54 -2.21 0.00 0.00 174.62 172.29 2wwb n SER 69 N 3.44 -1.82 -0.11 8.08 3.41 -1.26 -4.99 113.62 120.37 2wwb n SER 69 Ca -0.19 -2.16 -0.09 0.00 -0.26 0.00 0.00 58.87 56.17 2wwb n SER 69 Cb 0.53 3.00 -0.01 0.00 -0.26 0.00 0.00 64.21 67.47 2wwb n SER 69 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 2wwb h GLU 70 N 0.00 0.48 0.03 4.33 -0.00 -1.99 -1.84 114.58 115.59 2wwb h GLU 70 Ca -0.27 -0.06 -0.23 0.00 -0.00 0.00 0.00 59.36 58.80 2wwb h GLU 70 Cb 1.07 -0.09 0.00 0.00 -0.00 0.00 0.00 28.75 29.72 2wwb h GLU 70 CO 0.35 0.41 -0.99 0.00 -0.00 0.00 0.00 179.01 178.77 2wwb h THR 71 N 0.43 1.42 -0.42 -1.06 1.03 -1.98 -2.52 112.91 109.81 2wwb h THR 71 Ca 0.12 -2.56 -0.05 0.00 -0.01 0.00 0.00 66.41 63.91 2wwb h THR 71 Cb 0.06 2.52 -0.02 0.00 -1.07 0.00 0.00 68.15 69.64 2wwb h THR 71 CO -0.02 0.76 0.08 0.00 -0.01 0.00 0.00 175.52 176.33 2wwb h ALA 72 N 0.72 0.56 -0.32 0.00 0.00 -1.88 -2.17 119.26 116.17 2wwb h ALA 72 Ca -0.09 -0.21 -0.13 0.00 0.00 0.00 0.00 54.91 54.48 2wwb h ALA 72 Cb 1.65 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 19.26 2wwb h ALA 72 CO 0.17 0.27 -0.35 0.52 0.00 0.00 0.00 179.25 179.86 2wwb h MET 73 N 0.55 0.72 -0.23 0.00 2.86 -1.36 -3.10 114.93 114.38 2wwb h MET 73 Ca 0.13 -0.34 -0.08 0.00 -2.06 0.00 0.00 59.70 57.35 2wwb h MET 73 Cb 0.36 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.00 2wwb h MET 73 CO 0.01 0.95 -0.19 0.87 1.06 0.00 0.00 176.91 179.61 2wwb h LYS 74 N 0.60 0.40 -0.42 1.72 1.57 -1.32 -2.82 116.57 116.29 2wwb h LYS 74 Ca 0.06 -0.12 -0.03 0.00 -1.87 0.00 0.00 60.65 58.69 2wwb h LYS 74 Cb 0.87 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.12 2wwb h LYS 74 CO 0.08 0.58 0.14 0.87 -0.57 0.00 0.00 179.45 180.55 2wwb h LYS 75 N 0.36 0.60 -0.67 3.15 1.57 -1.31 -1.78 116.57 118.48 2wwb h LYS 75 Ca 0.06 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2wwb h LYS 75 Cb 0.55 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.71 2wwb h LYS 75 CO 0.04 0.52 0.41 0.28 -0.57 0.00 0.00 179.45 180.13 2wwb h VAL 76 N 0.60 1.19 -0.32 0.50 2.07 -1.15 -2.87 116.25 116.27 2wwb h VAL 76 Ca 0.14 -0.42 -0.06 0.00 0.82 0.00 0.00 66.70 67.18 2wwb h VAL 76 Cb 0.16 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.18 2wwb h VAL 76 CO -0.01 0.20 -0.05 -0.33 0.02 0.00 0.00 177.57 177.40 2wwb h GLU 77 N 0.92 0.59 -0.20 1.57 5.08 -1.46 -3.04 114.58 118.03 2wwb h GLU 77 Ca 0.24 -0.21 -0.04 0.00 -1.00 0.00 0.00 59.36 58.34 2wwb h GLU 77 Cb -0.04 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 2wwb h GLU 77 CO -0.05 0.76 -0.05 -0.44 -1.00 0.00 0.00 179.01 178.24 2wwb h ASP 78 N 0.37 0.39 0.00 1.42 3.32 -1.15 -3.42 116.42 117.37 2wwb h ASP 78 Ca 0.08 -0.36 -0.13 0.00 0.02 0.00 0.00 57.03 56.65 2wwb h ASP 78 Cb 0.53 -0.11 -0.12 0.00 0.22 0.00 0.00 39.33 39.85 2wwb h ASP 78 CO 0.03 0.67 -0.25 0.61 -1.72 0.00 0.00 179.24 178.58 2wwb n GLY 79 N -0.15 0.83 3.27 2.75 0.00 -1.11 -5.03 105.19 105.74 2wwb n GLY 79 Ca -0.05 -0.05 -0.15 0.00 0.00 0.00 0.00 46.02 45.77 2wwb n GLY 79 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wwb n ASN 80 N -0.48 -6.36 -4.05 1.61 4.13 -1.15 -4.50 115.26 104.46 2wwb n ASN 80 Ca -0.21 -0.71 -0.30 0.00 1.68 0.00 0.00 54.58 55.04 2wwb n ASN 80 Cb 0.71 -5.19 -0.17 0.00 -1.54 0.00 0.00 39.78 33.59 2wwb n ASN 80 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2wwb s ILE 81 N -3.39 1.61 0.27 2.41 1.01 -1.10 -0.89 121.20 121.12 2wwb s ILE 81 Ca 0.43 -0.68 0.06 0.00 0.00 0.00 0.00 60.65 60.45 2wwb s ILE 81 Cb -0.06 -1.49 -0.02 0.00 0.01 0.00 0.00 42.46 40.90 2wwb s ILE 81 CO 0.74 0.46 0.39 -0.76 0.00 0.00 0.00 174.94 175.78 2wwb s LEU 82 N 1.23 4.19 -0.04 2.97 1.43 -0.47 -2.10 118.68 125.90 2wwb s LEU 82 Ca -0.00 -0.02 -0.03 0.00 -1.03 0.00 0.00 54.13 53.04 2wwb s LEU 82 Cb -0.14 -2.81 0.02 0.00 0.03 0.00 0.00 46.19 43.29 2wwb s LEU 82 CO -0.07 -0.19 0.11 0.54 0.23 0.00 0.00 176.35 176.97 2wwb s VAL 83 N -2.05 -0.02 0.27 -1.59 0.11 -1.26 -1.41 120.40 114.45 2wwb s VAL 83 Ca 0.38 0.06 0.04 0.00 -2.93 0.00 0.00 61.98 59.52 2wwb s VAL 83 Cb -0.09 -0.16 -0.06 0.00 -1.53 0.00 0.00 36.38 34.54 2wwb s VAL 83 CO 0.30 0.02 0.01 -0.36 -3.33 0.00 0.00 175.10 171.74 2wwb s PHE 84 N 0.38 1.75 -0.18 1.54 0.40 0.06 -2.22 117.98 119.72 2wwb s PHE 84 Ca -0.03 -0.91 0.01 0.00 -0.60 0.00 0.00 56.93 55.40 2wwb s PHE 84 Cb -0.04 -1.06 0.02 0.00 0.51 0.00 0.00 43.02 42.45 2wwb s PHE 84 CO -0.01 0.01 -0.19 -0.65 0.70 0.00 0.00 175.22 175.08 2wwb s GLN 85 N -3.86 2.89 0.24 0.44 -0.21 0.37 -0.71 119.66 118.82 2wwb s GLN 85 Ca 0.32 -0.80 0.10 0.00 0.02 0.00 0.00 55.36 55.00 2wwb s GLN 85 Cb 0.06 -2.51 -0.05 0.00 1.00 0.00 0.00 33.01 31.51 2wwb s GLN 85 CO 0.12 -0.22 -0.19 0.14 -2.12 0.00 0.00 175.29 173.02 2wwb s VAL 86 N 1.31 2.20 0.86 1.09 -7.23 -0.09 -1.70 120.40 116.84 2wwb s VAL 86 Ca 0.05 -2.25 -0.14 0.00 -1.81 0.00 0.00 61.98 57.83 2wwb s VAL 86 Cb -0.13 -2.16 0.00 0.00 0.56 0.00 0.00 36.38 34.66 2wwb s VAL 86 CO -0.13 -0.40 0.45 -1.20 -0.31 0.00 0.00 175.10 173.52 2wwb n SER 87 N -0.32 -1.72 0.17 4.85 7.64 -0.34 -1.31 113.62 122.59 2wwb n SER 87 Ca -0.08 0.44 0.14 0.00 1.01 0.00 0.00 58.87 60.38 2wwb n SER 87 Cb 0.59 -1.21 0.50 0.00 -1.01 0.00 0.00 64.21 63.08 2wwb n SER 87 CO 0.00 0.00 0.00 -0.03 -3.01 0.00 0.00 175.04 172.00 2wwb h MET 88 N -1.04 0.00 0.00 1.43 4.05 -1.92 -2.08 114.93 115.36 2wwb h MET 88 Ca -0.44 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 58.98 2wwb h MET 88 Cb 1.31 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.11 2wwb h MET 88 CO 0.38 0.00 -0.64 1.63 0.23 0.00 0.00 176.91 178.51 2wwb n LYS 89 N -2.54 0.04 -1.66 0.39 5.02 -1.26 -5.00 118.16 113.15 2wwb n LYS 89 Ca 0.02 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.89 2wwb n LYS 89 Cb 0.31 -1.52 -0.03 0.00 -0.02 0.00 0.00 35.03 33.77 2wwb n LYS 89 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wwb n ALA 90 N -1.54 1.49 -2.38 7.82 0.00 -0.78 -5.01 120.51 120.11 2wwb n ALA 90 Ca 0.05 0.19 -0.28 0.00 0.00 0.00 0.00 53.44 53.40 2wwb n ALA 90 Cb 0.35 -2.67 -0.02 0.00 0.00 0.00 0.00 19.45 17.10 2wwb n ALA 90 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2wwb s ASN 91 N 4.68 6.41 0.18 0.00 2.47 -1.26 -4.99 114.94 122.41 2wwb s ASN 91 Ca 0.90 0.86 -0.12 0.00 0.42 0.00 0.00 52.86 54.92 2wwb s ASN 91 Cb -0.47 -2.21 0.08 0.00 -1.45 0.00 0.00 41.25 37.20 2wwb s ASN 91 CO 0.43 -0.36 1.75 0.11 -3.72 0.00 0.00 177.10 175.32 2wwb h LYS 92 N 1.09 0.87 -0.68 0.43 1.79 -2.00 -3.20 116.57 114.87 2wwb h LYS 92 Ca -0.48 -0.13 -0.04 0.00 -2.18 0.00 0.00 60.65 57.82 2wwb h LYS 92 Cb 1.20 -0.15 -0.03 0.00 -1.58 0.00 0.00 32.23 31.66 2wwb h LYS 92 CO 0.64 0.71 0.27 -0.92 -1.08 0.00 0.00 179.45 179.07 2wwb h TYR 93 N 0.83 1.04 -0.01 -1.35 3.20 -2.00 -2.84 116.97 115.84 2wwb h TYR 93 Ca 0.21 -0.08 -0.11 0.00 3.14 0.00 0.00 58.73 61.89 2wwb h TYR 93 Cb 0.14 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.08 2wwb h TYR 93 CO 0.00 0.81 -0.50 1.96 -1.64 0.00 0.00 178.16 178.79 2wwb h GLN 94 N 0.97 0.02 -0.41 1.82 4.20 -1.98 -2.06 115.11 117.68 2wwb h GLN 94 Ca 0.23 -0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.84 2wwb h GLN 94 Cb 0.21 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.98 2wwb h GLN 94 CO -0.02 0.52 -0.06 0.82 -0.67 0.00 0.00 178.83 179.42 2wwb h ILE 95 N 0.02 1.27 -0.56 2.54 2.04 -1.55 -1.34 117.51 119.93 2wwb h ILE 95 Ca -0.00 -1.13 -0.01 0.00 1.00 0.00 0.00 64.86 64.72 2wwb h ILE 95 Cb 0.90 1.18 -0.03 0.00 -0.74 0.00 0.00 36.82 38.13 2wwb h ILE 95 CO 0.07 0.38 0.33 0.50 0.00 0.00 0.00 178.15 179.43 2wwb h LYS 96 N 0.58 0.77 -0.29 2.37 1.63 -1.25 -2.21 116.57 118.17 2wwb h LYS 96 Ca 0.11 -0.08 -0.13 0.00 -0.85 0.00 0.00 60.65 59.70 2wwb h LYS 96 Cb 0.57 -0.16 -0.00 0.00 -0.60 0.00 0.00 32.23 32.04 2wwb h LYS 96 CO 0.03 0.57 -0.34 -0.22 -3.45 0.00 0.00 179.45 176.04 2wwb h LYS 97 N 0.76 0.74 -0.41 1.90 3.64 -1.35 -2.92 116.57 118.93 2wwb h LYS 97 Ca 0.20 -0.41 -0.11 0.00 -1.27 0.00 0.00 60.65 59.06 2wwb h LYS 97 Cb 0.01 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 2wwb h LYS 97 CO -0.04 1.03 -0.18 0.00 -2.27 0.00 0.00 179.45 178.00 2wwb h ALA 98 N 0.70 0.57 -0.15 5.00 0.00 -1.14 -2.53 119.26 121.71 2wwb h ALA 98 Ca 0.04 -0.36 -0.09 0.00 0.00 0.00 0.00 54.91 54.50 2wwb h ALA 98 Cb 0.92 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2wwb h ALA 98 CO 0.08 0.51 -0.31 0.28 0.00 0.00 0.00 179.25 179.82 2wwb h VAL 99 N 0.65 1.27 -0.88 0.00 2.07 -1.49 -2.10 116.25 115.77 2wwb h VAL 99 Ca 0.09 -1.29 -0.02 0.00 0.82 0.00 0.00 66.70 66.30 2wwb h VAL 99 Cb 0.73 1.50 -0.04 0.00 -1.52 0.00 0.00 31.29 31.96 2wwb h VAL 99 CO 0.06 0.39 0.46 0.50 0.02 0.00 0.00 177.57 179.00 2wwb h LYS 100 N 0.25 1.24 -0.15 1.57 3.11 -1.29 -2.12 116.57 119.19 2wwb h LYS 100 Ca 0.03 -0.16 0.00 0.00 -2.81 0.00 0.00 60.65 57.71 2wwb h LYS 100 Cb 0.68 -0.24 0.00 0.00 -1.00 0.00 0.00 32.23 31.67 2wwb h LYS 100 CO 0.05 0.93 0.00 0.39 -2.81 0.00 0.00 179.45 178.01 2wwb n GLU 101 N -4.33 2.35 0.00 1.90 1.02 -0.98 -1.08 120.64 119.53 2wwb n GLU 101 Ca 0.09 -1.99 0.03 0.00 -0.02 0.00 0.00 57.16 55.27 2wwb n GLU 101 Cb 0.11 -1.48 -0.00 0.00 -0.02 0.00 0.00 31.44 30.05 2wwb n GLU 101 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2wwb n LEU 102 N 1.32 0.86 0.00 -4.62 4.77 -0.82 -4.79 117.00 113.72 2wwb n LEU 102 Ca 0.16 -0.75 0.00 0.00 -0.03 0.00 0.00 56.01 55.39 2wwb n LEU 102 Cb 0.59 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.68 2wwb n LEU 102 CO 0.15 0.19 0.03 -1.22 -1.33 0.00 0.00 177.39 175.21 2wwb n TYR 103 N -0.39 0.00 -3.40 -1.77 4.02 -0.80 -5.05 117.16 109.76 2wwb n TYR 103 Ca 0.02 0.00 -0.15 0.00 -0.01 0.00 0.00 57.90 57.76 2wwb n TYR 103 Cb 0.11 0.06 0.02 0.00 -0.02 0.00 0.00 39.34 39.51 2wwb n TYR 103 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 176.86 173.94 2wwb n GLU 104 N 0.00 -1.47 -2.52 -0.72 4.07 -0.24 -4.99 120.64 114.77 2wwb n GLU 104 Ca 0.00 0.98 -0.13 0.00 -0.06 0.00 0.00 57.16 57.95 2wwb n GLU 104 Cb 0.34 -4.66 0.02 0.00 -0.06 0.00 0.00 31.44 27.07 2wwb n GLU 104 CO 0.00 0.00 0.00 1.33 -0.06 0.00 0.00 177.13 178.40 2wwb n VAL 105 N -2.80 0.00 -4.33 6.31 0.24 -1.23 -4.99 118.33 111.53 2wwb n VAL 105 Ca -0.10 -1.19 -0.18 0.00 -2.04 0.00 0.00 64.34 60.83 2wwb n VAL 105 Cb 0.58 -0.45 -0.10 0.00 -1.47 0.00 0.00 33.84 32.39 2wwb n VAL 105 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2wwb s ASP 106 N -2.96 2.49 -0.14 -1.34 3.68 -1.26 -4.92 116.67 112.23 2wwb s ASP 106 Ca 0.26 -1.00 -0.06 0.00 2.13 0.00 0.00 52.55 53.87 2wwb s ASP 106 Cb -0.02 -0.12 -0.04 0.00 -1.45 0.00 0.00 42.92 41.29 2wwb s ASP 106 CO 0.16 -0.17 0.09 -0.69 0.13 0.00 0.00 175.17 174.69 2wwb s VAL 107 N -2.92 5.06 -0.30 1.11 1.01 -1.26 -2.23 120.40 120.88 2wwb s VAL 107 Ca 0.21 0.05 0.12 0.00 0.00 0.00 0.00 61.98 62.36 2wwb s VAL 107 Cb -0.01 -3.23 0.29 0.00 0.00 0.00 0.00 36.38 33.43 2wwb s VAL 107 CO 0.06 0.55 1.21 0.18 0.00 0.00 0.00 175.10 177.10 2wwb n LEU 108 N 2.65 2.81 0.00 3.92 4.77 -0.36 -4.93 117.00 125.85 2wwb n LEU 108 Ca -0.18 -2.54 0.00 0.00 -0.03 0.00 0.00 56.01 53.25 2wwb n LEU 108 Cb 0.54 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 2wwb n LEU 108 CO 0.32 0.65 0.00 1.17 -1.33 0.00 0.00 177.39 178.21 2wwb n LYS 109 N -0.50 0.00 -5.23 3.23 4.81 -1.24 -4.90 118.16 114.34 2wwb n LYS 109 Ca 0.12 0.00 -0.32 0.00 -0.87 0.00 0.00 58.31 57.25 2wwb n LYS 109 Cb 0.56 0.00 -0.16 0.00 0.02 0.00 0.00 35.03 35.45 2wwb n LYS 109 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2wwb s VAL 110 N -0.33 2.17 -0.06 3.15 1.01 -1.26 -1.28 120.40 123.79 2wwb s VAL 110 Ca 0.00 -1.03 -0.15 0.00 0.00 0.00 0.00 61.98 60.80 2wwb s VAL 110 Cb 0.00 -1.79 0.03 0.00 0.00 0.00 0.00 36.38 34.62 2wwb s VAL 110 CO 0.00 0.57 0.35 0.54 0.00 0.00 0.00 175.10 176.56 2wwb s ASN 111 N -0.23 -0.28 -0.00 3.32 6.03 -0.89 -5.02 114.94 117.87 2wwb s ASN 111 Ca -0.01 0.36 -0.02 0.00 -1.03 0.00 0.00 52.86 52.16 2wwb s ASN 111 Cb -0.13 0.49 -0.00 0.00 -3.03 0.00 0.00 41.25 38.58 2wwb s ASN 111 CO 0.03 -0.33 0.04 0.42 -2.03 0.00 0.00 177.10 175.23 2wwb s THR 112 N -0.73 0.05 0.29 0.54 -4.23 -1.26 -1.08 115.64 109.22 2wwb s THR 112 Ca -0.08 -0.44 -0.14 0.00 -1.18 0.00 0.00 61.69 59.84 2wwb s THR 112 Cb -0.04 -0.21 0.01 0.00 1.34 0.00 0.00 72.50 73.61 2wwb s THR 112 CO 0.03 -0.24 0.60 -0.76 -0.54 0.00 0.00 174.62 173.71 2wwb s LEU 113 N -0.74 0.19 0.64 4.79 1.43 -0.71 -5.03 118.68 119.25 2wwb s LEU 113 Ca -0.08 -0.95 -0.10 0.00 -1.03 0.00 0.00 54.13 51.98 2wwb s LEU 113 Cb -0.05 2.20 -0.00 0.00 0.03 0.00 0.00 46.19 48.36 2wwb s LEU 113 CO -0.00 -1.32 1.01 -0.69 0.23 0.00 0.00 176.35 175.58 2wwb s VAL 114 N -3.56 3.88 0.03 -1.59 1.01 -1.26 -1.22 120.40 117.69 2wwb s VAL 114 Ca 0.19 0.42 -0.06 0.00 0.00 0.00 0.00 61.98 62.53 2wwb s VAL 114 Cb -0.03 -3.58 -0.01 0.00 0.00 0.00 0.00 36.38 32.76 2wwb s VAL 114 CO 0.10 -0.71 0.11 -0.60 0.00 0.00 0.00 175.10 174.01 2wwb s ARG 115 N -5.19 0.59 0.00 2.72 3.52 -1.26 -4.63 118.95 114.71 2wwb s ARG 115 Ca 0.56 -0.70 0.12 0.00 -0.13 0.00 0.00 55.73 55.58 2wwb s ARG 115 Cb -0.11 0.24 0.73 0.00 -1.56 0.00 0.00 34.95 34.25 2wwb s ARG 115 CO 0.50 -0.15 1.19 -0.35 -0.81 0.00 0.00 175.30 175.68 2wwb n PRO 116 N 0.83 0.37 0.14 5.12 -0.04 -1.26 -1.34 135.00 138.81 2wwb n PRO 116 Ca -0.19 0.02 0.13 0.00 -0.04 0.00 0.00 63.50 63.41 2wwb n PRO 116 Cb 0.58 -1.50 0.42 0.00 -0.04 0.00 0.00 33.50 32.96 2wwb n PRO 116 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 2wwb h ASN 117 N 0.00 0.00 0.00 3.54 -0.00 -2.03 -3.47 115.58 113.61 2wwb h ASN 117 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.30 2wwb h ASN 117 Cb 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.33 2wwb h ASN 117 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 177.43 178.04 2wwb n GLY 118 N 0.86 2.43 3.77 1.57 0.00 -0.45 -4.97 105.19 108.41 2wwb n GLY 118 Ca 0.04 -0.53 -0.40 0.00 0.00 0.00 0.00 46.02 45.12 2wwb n GLY 118 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2wwb s THR 119 N -0.25 2.22 -0.23 2.61 -1.32 -1.26 -4.73 115.64 112.68 2wwb s THR 119 Ca 0.00 0.21 -0.20 0.00 -1.21 0.00 0.00 61.69 60.49 2wwb s THR 119 Cb 0.00 -3.13 -0.02 0.00 -1.51 0.00 0.00 72.50 67.83 2wwb s THR 119 CO 0.00 0.04 0.61 -0.75 -2.21 0.00 0.00 174.62 172.31 2wwb s LYS 120 N -2.15 4.15 0.23 7.08 2.20 -0.42 -4.02 119.74 126.80 2wwb s LYS 120 Ca 0.54 0.54 -0.30 0.00 -0.36 0.00 0.00 55.97 56.40 2wwb s LYS 120 Cb -0.44 -3.62 -0.09 0.00 -1.51 0.00 0.00 37.83 32.17 2wwb s LYS 120 CO 0.58 -0.33 1.23 -1.59 -0.36 0.00 0.00 175.35 174.89 2wwb s LYS 121 N 2.21 4.46 -0.13 4.03 -2.85 -0.36 -0.91 119.74 126.20 2wwb s LYS 121 Ca 0.26 1.97 -0.01 0.00 -1.00 0.00 0.00 55.97 57.20 2wwb s LYS 121 Cb -0.16 -3.19 0.03 0.00 -2.06 0.00 0.00 37.83 32.46 2wwb s LYS 121 CO 0.09 -0.10 -0.04 0.00 0.10 0.00 0.00 175.35 175.39 2wwb s ALA 122 N -0.37 1.24 -0.32 0.59 0.00 0.11 -1.74 121.76 121.28 2wwb s ALA 122 Ca 0.52 -0.59 -0.08 0.00 0.00 0.00 0.00 51.96 51.81 2wwb s ALA 122 Cb -0.35 -0.99 0.01 0.00 0.00 0.00 0.00 23.12 21.80 2wwb s ALA 122 CO 0.40 -0.63 0.13 -0.47 0.00 0.00 0.00 175.76 175.19 2wwb s TYR 123 N 1.74 3.18 -0.22 0.00 6.04 -0.24 -0.76 117.35 127.10 2wwb s TYR 123 Ca 0.03 -0.91 0.01 0.00 0.04 0.00 0.00 57.07 56.24 2wwb s TYR 123 Cb -0.14 -2.32 0.05 0.00 -1.04 0.00 0.00 41.96 38.52 2wwb s TYR 123 CO -0.07 -0.57 -0.08 0.08 -1.54 0.00 0.00 175.55 173.36 2wwb s VAL 124 N 1.53 1.62 0.19 3.14 1.01 -0.50 -2.09 120.40 125.30 2wwb s VAL 124 Ca 0.03 -1.14 -0.11 0.00 0.00 0.00 0.00 61.98 60.76 2wwb s VAL 124 Cb -0.18 -1.79 -0.07 0.00 0.00 0.00 0.00 36.38 34.35 2wwb s VAL 124 CO 0.04 0.04 0.54 -0.60 0.00 0.00 0.00 175.10 175.12 2wwb s ARG 125 N 1.38 3.85 0.13 2.72 3.52 -0.41 -1.37 118.95 128.77 2wwb s ARG 125 Ca -0.04 0.33 0.04 0.00 -0.13 0.00 0.00 55.73 55.93 2wwb s ARG 125 Cb -0.18 -2.76 -0.04 0.00 -1.56 0.00 0.00 34.95 30.42 2wwb s ARG 125 CO -0.07 0.38 -0.10 -0.51 -0.81 0.00 0.00 175.30 174.19 2wwb s LEU 126 N -2.50 2.49 0.74 -0.88 1.43 -0.07 -1.23 118.68 118.66 2wwb s LEU 126 Ca 0.44 -0.95 -0.15 0.00 -1.03 0.00 0.00 54.13 52.44 2wwb s LEU 126 Cb -0.12 -0.34 0.03 0.00 0.03 0.00 0.00 46.19 45.78 2wwb s LEU 126 CO 0.20 -0.30 1.09 0.41 0.23 0.00 0.00 176.35 177.98 2wwb n THR 127 N 0.06 2.92 -0.26 5.49 -1.04 -0.94 -4.74 114.28 115.77 2wwb n THR 127 Ca -0.12 -0.34 -0.06 0.00 -2.04 0.00 0.00 64.05 61.49 2wwb n THR 127 Cb 0.60 -1.20 0.07 0.00 -1.82 0.00 0.00 70.33 67.98 2wwb n THR 127 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2wwb h ALA 128 N -0.34 1.01 0.00 2.41 0.00 -1.94 -3.25 119.26 117.15 2wwb h ALA 128 Ca -0.48 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.21 2wwb h ALA 128 Cb 1.32 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2wwb h ALA 128 CO 0.47 0.66 0.00 -0.25 0.00 0.00 0.00 179.25 180.13 2wwb n ASP 129 N -4.25 0.55 0.03 0.00 8.00 -1.26 -3.56 116.55 116.06 2wwb n ASP 129 Ca 0.06 0.57 -0.11 0.00 0.71 0.00 0.00 54.79 56.02 2wwb n ASP 129 Cb 0.23 -0.71 -0.06 0.00 -0.02 0.00 0.00 41.12 40.56 2wwb n ASP 129 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 2wwb h TYR 130 N 0.00 -0.02 -3.54 1.24 3.20 -1.94 -3.50 116.97 112.41 2wwb h TYR 130 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2wwb h TYR 130 Cb 0.58 0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.86 2wwb h TYR 130 CO 0.00 -0.02 -0.68 -3.47 -1.64 0.00 0.00 178.16 172.36 2wwb n ASP 131 N -5.11 -7.03 -0.82 -2.11 4.64 -1.23 -4.94 116.55 99.95 2wwb n ASP 131 Ca -0.06 1.08 0.11 0.00 -1.38 0.00 0.00 54.79 54.54 2wwb n ASP 131 Cb 0.05 -3.89 0.07 0.00 -1.04 0.00 0.00 41.12 36.31 2wwb n ASP 131 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2wwb n ALA 132 N 1.32 2.67 -0.08 -1.67 0.00 -1.26 -4.14 120.51 117.35 2wwb n ALA 132 Ca 0.00 -0.67 -0.19 0.00 0.00 0.00 0.00 53.44 52.58 2wwb n ALA 132 Cb 0.00 -0.76 -0.12 0.00 0.00 0.00 0.00 19.45 18.57 2wwb n ALA 132 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2wwb h LEU 133 N 4.00 0.05 -0.71 0.00 6.46 -1.93 -2.92 115.31 120.26 2wwb h LEU 133 Ca 0.00 -0.70 -0.14 0.00 -0.12 0.00 0.00 57.88 56.92 2wwb h LEU 133 Cb 0.90 -0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 40.80 2wwb h LEU 133 CO 0.00 1.36 -0.55 -0.78 -0.62 0.00 0.00 178.44 177.85 2wwb h ASP 134 N -0.91 0.30 -0.01 1.25 3.58 -1.95 -3.13 116.42 115.54 2wwb h ASP 134 Ca -0.24 -0.16 0.00 0.00 0.42 0.00 0.00 57.03 57.05 2wwb h ASP 134 Cb 1.27 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 42.24 2wwb h ASP 134 CO -0.11 0.79 -0.11 0.00 -2.88 0.00 0.00 179.24 176.92 2wwb n ILE 135 N -3.92 0.00 0.69 2.25 3.06 -1.26 -2.09 119.36 118.10 2wwb n ILE 135 Ca -0.02 -0.40 0.12 0.00 -2.50 0.00 0.00 62.75 59.95 2wwb n ILE 135 Cb 0.58 1.25 0.14 0.00 0.54 0.00 0.00 39.64 42.16 2wwb n ILE 135 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2wwb n ALA 136 N 0.80 2.44 -0.02 1.51 0.00 -1.10 -3.79 120.51 120.35 2wwb n ALA 136 Ca 0.14 -0.82 0.01 0.00 0.00 0.00 0.00 53.44 52.77 2wwb n ALA 136 Cb 0.53 -0.82 0.03 0.00 0.00 0.00 0.00 19.45 19.19 2wwb n ALA 136 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2wwb n ASN 137 N 1.38 2.09 -0.43 0.00 5.15 -1.00 -3.98 115.26 118.47 2wwb n ASN 137 Ca 0.16 -1.90 0.04 0.00 -0.60 0.00 0.00 54.58 52.29 2wwb n ASN 137 Cb 0.59 -0.05 0.08 0.00 -0.53 0.00 0.00 39.78 39.88 2wwb n ASN 137 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 2wwb n ARG 138 N -0.23 1.60 0.00 1.20 0.63 -0.89 -5.02 116.66 113.95 2wwb n ARG 138 Ca 0.02 -1.49 0.00 0.00 -0.92 0.00 0.00 57.85 55.46 2wwb n ARG 138 Cb 0.26 -1.19 0.00 0.00 0.45 0.00 0.00 32.46 31.98 2wwb n ARG 138 CO 0.00 0.00 0.00 0.44 -2.51 0.00 0.00 177.63 175.56