#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wdi s ILE 2 N 0.00 4.87 0.13 3.17 -1.09 -0.06 -4.82 121.20 123.40 2wdi s ILE 2 Ca 0.00 1.16 0.01 0.00 -2.23 0.00 0.00 60.65 59.59 2wdi s ILE 2 Cb 0.00 -3.88 -0.04 0.00 -1.58 0.00 0.00 42.46 36.95 2wdi s ILE 2 CO 0.00 0.49 -0.00 0.00 -1.23 0.00 0.00 174.94 174.19 2wdi s GLN 3 N -0.61 0.94 0.24 2.79 -2.07 -1.26 0.36 119.66 120.05 2wdi s GLN 3 Ca 0.29 -1.43 -0.31 0.00 -1.82 0.00 0.00 55.36 52.09 2wdi s GLN 3 Cb -0.18 -0.07 -0.12 0.00 -1.09 0.00 0.00 33.01 31.55 2wdi s GLN 3 CO 0.17 -0.13 1.68 -0.35 -1.32 0.00 0.00 175.29 175.34 2wdi n PRO 4 N -0.12 2.76 0.00 9.60 -0.04 -1.26 -1.46 135.00 144.48 2wdi n PRO 4 Ca -0.08 0.99 0.00 0.00 -0.04 0.00 0.00 63.50 64.37 2wdi n PRO 4 Cb 0.62 -2.82 0.00 0.00 -0.04 0.00 0.00 33.50 31.27 2wdi n PRO 4 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2wdi n GLN 5 N 3.35 0.00 -2.65 0.54 -0.06 -1.09 -4.95 117.38 112.53 2wdi n GLN 5 Ca 0.13 0.00 -0.37 0.00 -2.00 0.00 0.00 57.00 54.77 2wdi n GLN 5 Cb 0.35 0.00 -0.05 0.00 -4.06 0.00 0.00 30.24 26.48 2wdi n GLN 5 CO 0.00 0.00 0.00 0.99 -0.20 0.00 0.00 177.06 177.85 2wdi s THR 6 N -2.10 3.94 -0.09 1.69 2.01 -0.53 -4.77 115.64 115.78 2wdi s THR 6 Ca 0.00 1.54 -0.11 0.00 0.31 0.00 0.00 61.69 63.43 2wdi s THR 6 Cb 0.00 -3.83 -0.05 0.00 0.01 0.00 0.00 72.50 68.64 2wdi s THR 6 CO 0.00 0.07 0.25 -0.31 -0.69 0.00 0.00 174.62 173.94 2wdi s TYR 7 N -1.64 3.61 -0.05 4.92 1.51 -1.26 -0.67 117.35 123.77 2wdi s TYR 7 Ca 0.54 0.68 0.03 0.00 -1.01 0.00 0.00 57.07 57.32 2wdi s TYR 7 Cb -0.21 -2.14 0.00 0.00 -0.11 0.00 0.00 41.96 39.51 2wdi s TYR 7 CO 0.26 0.60 -0.14 -0.51 -1.11 0.00 0.00 175.55 174.65 2wdi s LEU 8 N -0.72 1.80 0.26 -1.29 2.01 0.69 -4.78 118.68 116.65 2wdi s LEU 8 Ca 0.18 -0.29 -0.30 0.00 0.01 0.00 0.00 54.13 53.73 2wdi s LEU 8 Cb -0.14 -0.82 -0.09 0.00 0.01 0.00 0.00 46.19 45.15 2wdi s LEU 8 CO 0.07 0.09 1.06 -0.70 1.01 0.00 0.00 176.35 177.88 2wdi s GLU 9 N 0.27 4.69 -0.17 1.70 2.56 0.40 -0.49 118.70 127.66 2wdi s GLU 9 Ca -0.07 1.72 -0.12 0.00 0.00 0.00 0.00 54.97 56.50 2wdi s GLU 9 Cb -0.12 -3.22 -0.05 0.00 2.00 0.00 0.00 34.13 32.74 2wdi s GLU 9 CO 0.02 0.28 0.21 0.14 -0.56 0.00 0.00 175.26 175.36 2wdi s VAL 10 N -1.08 5.36 -2.30 3.70 -7.23 -1.10 -0.16 120.40 117.59 2wdi s VAL 10 Ca 0.44 0.38 0.20 0.00 -1.81 0.00 0.00 61.98 61.19 2wdi s VAL 10 Cb -0.30 -3.55 0.44 0.00 0.56 0.00 0.00 36.38 33.53 2wdi s VAL 10 CO 0.38 0.43 1.46 0.00 -0.31 0.00 0.00 175.10 177.06 2wdi n ALA 11 N 3.42 2.47 -3.50 1.32 0.00 0.34 -4.89 120.51 119.66 2wdi n ALA 11 Ca -0.14 -0.73 -0.03 0.00 0.00 0.00 0.00 53.44 52.53 2wdi n ALA 11 Cb 0.52 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.98 2wdi n ALA 11 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2wdi n ASP 12 N 0.81 1.12 -2.23 0.00 3.85 -1.26 0.27 116.55 119.11 2wdi n ASP 12 Ca 0.17 -1.21 -0.27 0.00 -0.71 0.00 0.00 54.79 52.77 2wdi n ASP 12 Cb 0.43 -0.01 0.02 0.00 -1.35 0.00 0.00 41.12 40.22 2wdi n ASP 12 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.20 175.73 2wdi n ASN 13 N -2.06 5.37 0.00 -1.12 6.94 -1.26 -4.72 115.26 118.40 2wdi n ASN 13 Ca -0.00 -3.75 0.10 0.00 -0.02 0.00 0.00 54.58 50.91 2wdi n ASN 13 Cb 0.07 -0.49 0.58 0.00 -2.36 0.00 0.00 39.78 37.58 2wdi n ASN 13 CO 0.00 0.00 0.00 0.41 -1.03 0.00 0.00 177.26 176.64 2wdi n THR 14 N -0.67 0.00 0.00 5.53 -1.04 -1.26 -4.82 114.28 112.02 2wdi n THR 14 Ca 0.46 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.47 2wdi n THR 14 Cb 0.81 -0.57 0.00 0.00 -1.82 0.00 0.00 70.33 68.75 2wdi n THR 14 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2wdi n GLY 15 N 0.40 2.70 3.74 3.41 0.00 -1.26 -2.41 105.19 111.77 2wdi n GLY 15 Ca 0.15 -0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 2wdi n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdi s ALA 16 N -1.46 3.58 -0.20 4.61 0.00 -1.26 -0.21 121.76 126.82 2wdi s ALA 16 Ca 0.00 1.19 0.03 0.00 0.00 0.00 0.00 51.96 53.18 2wdi s ALA 16 Cb 0.00 -3.52 -0.14 0.00 0.00 0.00 0.00 23.12 19.46 2wdi s ALA 16 CO 0.00 -0.62 -0.16 -2.13 0.00 0.00 0.00 175.76 172.85 2wdi n ARG 17 N 2.78 0.60 -3.73 0.00 3.00 -0.69 -4.74 116.66 113.87 2wdi n ARG 17 Ca 0.07 0.10 -0.13 0.00 -0.00 0.00 0.00 57.85 57.90 2wdi n ARG 17 Cb 0.42 -1.41 -0.14 0.00 0.00 0.00 0.00 32.46 31.33 2wdi n ARG 17 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 2wdi s LYS 18 N -2.40 0.16 0.24 -0.14 1.02 -0.92 -2.70 119.74 115.00 2wdi s LYS 18 Ca -0.25 0.48 0.08 0.00 0.02 0.00 0.00 55.97 56.30 2wdi s LYS 18 Cb 0.07 -0.14 -0.05 0.00 -0.52 0.00 0.00 37.83 37.18 2wdi s LYS 18 CO 0.49 -0.17 -0.13 0.96 -0.92 0.00 0.00 175.35 175.58 2wdi s ILE 19 N 1.25 1.88 -0.08 2.17 -4.36 0.35 -1.92 121.20 120.49 2wdi s ILE 19 Ca -0.09 -2.23 0.04 0.00 -0.26 0.00 0.00 60.65 58.11 2wdi s ILE 19 Cb -0.11 -2.22 0.00 0.00 1.25 0.00 0.00 42.46 41.38 2wdi s ILE 19 CO -0.08 -0.47 -0.21 -0.32 0.24 0.00 0.00 174.94 174.11 2wdi s MET 20 N -3.64 2.54 0.71 0.37 -2.45 -0.86 0.25 119.30 116.22 2wdi s MET 20 Ca 0.26 -0.74 -0.16 0.00 -1.25 0.00 0.00 55.69 53.80 2wdi s MET 20 Cb -0.00 -1.99 0.01 0.00 1.25 0.00 0.00 34.83 34.10 2wdi s MET 20 CO 0.10 0.17 1.13 0.00 1.05 0.00 0.00 175.02 177.47 2wdi n ILE 22 N -2.41 0.00 -3.57 0.00 2.08 -0.18 -2.66 119.36 112.62 2wdi n ILE 22 Ca 0.14 0.00 -0.17 0.00 0.56 0.00 0.00 62.75 63.28 2wdi n ILE 22 Cb 0.49 -0.34 -0.07 0.00 -0.75 0.00 0.00 39.64 38.98 2wdi n ILE 22 CO 0.00 0.00 0.00 -0.60 0.56 0.00 0.00 176.55 176.51 2wdi s ARG 23 N -1.45 0.98 -0.42 0.38 6.06 -1.14 -4.76 118.95 118.60 2wdi s ARG 23 Ca 0.00 0.17 -0.06 0.00 -2.50 0.00 0.00 55.73 53.34 2wdi s ARG 23 Cb 0.00 0.46 0.11 0.00 0.06 0.00 0.00 34.95 35.58 2wdi s ARG 23 CO 0.00 -0.30 0.25 0.54 -2.50 0.00 0.00 175.30 173.29 2wdi s VAL 24 N -1.22 3.68 -0.22 7.11 0.11 -1.26 -1.30 120.40 127.28 2wdi s VAL 24 Ca -0.11 -1.86 -0.28 0.00 -2.93 0.00 0.00 61.98 56.79 2wdi s VAL 24 Cb -0.01 -3.44 -0.04 0.00 -1.53 0.00 0.00 36.38 31.36 2wdi s VAL 24 CO 0.09 -0.67 2.03 -0.76 -3.33 0.00 0.00 175.10 172.46 2wdi s LEU 25 N 1.25 3.59 0.00 2.54 1.43 -0.94 -4.58 118.68 121.97 2wdi s LEU 25 Ca 0.06 1.78 0.00 0.00 -1.03 0.00 0.00 54.13 54.94 2wdi s LEU 25 Cb -0.24 -3.52 0.00 0.00 0.03 0.00 0.00 46.19 42.46 2wdi s LEU 25 CO -0.02 -1.75 0.00 0.29 0.23 0.00 0.00 176.35 175.10 2wdi n LYS 26 N 8.46 0.00 -0.27 1.70 5.02 -1.26 -4.55 118.16 127.25 2wdi n LYS 26 Ca 0.26 0.00 -0.05 0.00 -2.02 0.00 0.00 58.31 56.50 2wdi n LYS 26 Cb 0.45 0.00 0.05 0.00 -0.02 0.00 0.00 35.03 35.51 2wdi n LYS 26 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wdi n GLY 27 N 0.00 -1.41 0.00 0.72 0.00 -1.26 -4.69 105.19 98.55 2wdi n GLY 27 Ca 0.00 -0.46 0.03 0.00 0.00 0.00 0.00 46.02 45.59 2wdi n GLY 27 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wdi n SER 28 N -0.69 0.00 -2.67 1.61 3.41 -1.26 -4.07 113.62 109.96 2wdi n SER 28 Ca 0.02 -1.05 -0.04 0.00 -0.26 0.00 0.00 58.87 57.54 2wdi n SER 28 Cb 0.11 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.10 2wdi n SER 28 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2wdi n ASN 29 N -0.66 -1.33 -4.70 4.04 0.23 -1.26 -5.14 115.26 106.43 2wdi n ASN 29 Ca 0.05 -1.92 -0.42 0.00 -0.53 0.00 0.00 54.58 51.76 2wdi n ASN 29 Cb 0.02 1.09 -0.03 0.00 -2.08 0.00 0.00 39.78 38.79 2wdi n ASN 29 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2wdi s ALA 30 N 0.07 3.59 0.00 -2.53 0.00 -1.26 -4.95 121.76 116.68 2wdi s ALA 30 Ca 0.11 1.04 0.00 0.00 0.00 0.00 0.00 51.96 53.11 2wdi s ALA 30 Cb 0.18 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.73 2wdi s ALA 30 CO -0.07 -0.74 0.57 1.63 0.00 0.00 0.00 175.76 177.15 2wdi n LYS 31 N 4.52 0.00 -2.24 0.00 4.76 -1.26 -4.85 118.16 119.10 2wdi n LYS 31 Ca 0.12 0.16 -0.11 0.00 -2.87 0.00 0.00 58.31 55.61 2wdi n LYS 31 Cb 0.43 -1.09 0.02 0.00 -1.84 0.00 0.00 35.03 32.55 2wdi n LYS 31 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 2wdi n TYR 32 N -0.97 -2.05 -3.75 2.13 4.01 -1.26 -4.76 117.16 110.50 2wdi n TYR 32 Ca 0.00 -1.09 -0.13 0.00 -0.16 0.00 0.00 57.90 56.52 2wdi n TYR 32 Cb 0.00 -0.26 -0.13 0.00 -0.31 0.00 0.00 39.34 38.65 2wdi n TYR 32 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2wdi s ALA 33 N -2.36 -0.54 0.16 -0.72 0.00 0.16 -4.93 121.76 113.53 2wdi s ALA 33 Ca 0.25 0.84 0.00 0.00 0.00 0.00 0.00 51.96 53.05 2wdi s ALA 33 Cb -0.02 -0.52 -0.00 0.00 0.00 0.00 0.00 23.12 22.58 2wdi s ALA 33 CO 0.16 -0.16 0.02 -2.37 0.00 0.00 0.00 175.76 173.40 2wdi n THR 34 N 3.75 0.00 -1.63 0.00 5.66 -1.26 -0.88 114.28 119.91 2wdi n THR 34 Ca -0.21 -0.83 -0.54 0.00 -3.05 0.00 0.00 64.05 59.43 2wdi n THR 34 Cb 0.55 0.21 -0.06 0.00 -1.55 0.00 0.00 70.33 69.47 2wdi n THR 34 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 2wdi n VAL 35 N -0.40 0.11 -0.15 1.08 0.31 -1.26 -0.61 118.33 117.42 2wdi n VAL 35 Ca -0.06 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.25 2wdi n VAL 35 Cb 0.22 -0.97 0.00 0.00 -0.91 0.00 0.00 33.84 32.18 2wdi n VAL 35 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2wdi n GLY 36 N 3.13 0.92 3.90 2.92 0.00 -0.62 -4.84 105.19 110.59 2wdi n GLY 36 Ca 0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 2wdi n GLY 36 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2wdi s ASP 37 N -2.84 6.47 0.04 1.61 1.01 0.22 -4.84 116.67 118.34 2wdi s ASP 37 Ca 0.00 0.63 0.02 0.00 0.71 0.00 0.00 52.55 53.91 2wdi s ASP 37 Cb 0.00 -2.11 -0.04 0.00 1.01 0.00 0.00 42.92 41.78 2wdi s ASP 37 CO 0.00 -0.08 0.05 -0.69 0.21 0.00 0.00 175.17 174.66 2wdi s VAL 38 N -1.88 4.41 0.09 -1.27 1.01 -1.26 -1.48 120.40 120.02 2wdi s VAL 38 Ca 0.42 -0.65 -0.01 0.00 0.00 0.00 0.00 61.98 61.74 2wdi s VAL 38 Cb -0.11 -3.05 -0.04 0.00 0.00 0.00 0.00 36.38 33.17 2wdi s VAL 38 CO 0.27 0.25 0.00 0.27 0.00 0.00 0.00 175.10 175.90 2wdi s ILE 39 N -1.24 0.23 -0.01 2.22 -4.36 0.59 -2.21 121.20 116.42 2wdi s ILE 39 Ca 0.24 -1.87 -0.03 0.00 -0.26 0.00 0.00 60.65 58.74 2wdi s ILE 39 Cb -0.12 -1.77 -0.04 0.00 1.25 0.00 0.00 42.46 41.78 2wdi s ILE 39 CO 0.16 -0.75 0.18 -0.69 0.24 0.00 0.00 174.94 174.08 2wdi s VAL 40 N -3.94 5.40 0.33 8.37 1.01 -0.42 -1.23 120.40 129.91 2wdi s VAL 40 Ca 0.15 -0.17 -0.05 0.00 0.00 0.00 0.00 61.98 61.92 2wdi s VAL 40 Cb 0.07 -3.52 0.02 0.00 0.00 0.00 0.00 36.38 32.96 2wdi s VAL 40 CO -0.04 0.33 0.51 0.00 0.00 0.00 0.00 175.10 175.90 2wdi n ALA 41 N 0.97 -0.66 -3.82 5.51 0.00 0.07 -1.01 120.51 121.57 2wdi n ALA 41 Ca -0.11 -1.37 -0.26 0.00 0.00 0.00 0.00 53.44 51.70 2wdi n ALA 41 Cb 0.53 1.10 -0.17 0.00 0.00 0.00 0.00 19.45 20.91 2wdi n ALA 41 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2wdi s SER 42 N -2.92 2.09 -0.11 0.00 0.15 0.40 -2.30 113.70 111.01 2wdi s SER 42 Ca 0.23 -0.30 -0.29 0.00 0.70 0.00 0.00 55.95 56.28 2wdi s SER 42 Cb -0.02 -0.83 -0.05 0.00 -1.71 0.00 0.00 66.02 63.40 2wdi s SER 42 CO 0.16 -0.09 1.78 -0.69 1.20 0.00 0.00 173.24 175.60 2wdi s VAL 43 N 1.50 3.43 -0.18 4.45 1.01 -0.78 -2.03 120.40 127.81 2wdi s VAL 43 Ca 0.01 0.50 -0.15 0.00 0.00 0.00 0.00 61.98 62.35 2wdi s VAL 43 Cb -0.13 -3.39 -0.09 0.00 0.00 0.00 0.00 36.38 32.77 2wdi s VAL 43 CO -0.06 -0.12 -0.12 0.29 0.00 0.00 0.00 175.10 175.09 2wdi n LYS 44 N 7.58 0.51 -4.79 2.72 4.76 -0.81 -0.04 118.16 128.10 2wdi n LYS 44 Ca 0.20 0.45 -0.30 0.00 -2.87 0.00 0.00 58.31 55.79 2wdi n LYS 44 Cb 0.43 -1.64 -0.14 0.00 -1.84 0.00 0.00 35.03 31.85 2wdi n LYS 44 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 2wdi s GLU 45 N -2.43 1.78 0.27 1.97 -1.05 -0.98 -4.68 118.70 113.58 2wdi s GLU 45 Ca -0.24 -1.13 -0.15 0.00 -0.15 0.00 0.00 54.97 53.30 2wdi s GLU 45 Cb 0.05 -2.00 0.01 0.00 -0.44 0.00 0.00 34.13 31.75 2wdi s GLU 45 CO 0.39 0.51 0.56 0.00 0.95 0.00 0.00 175.26 177.67 2wdi s ALA 46 N -0.86 -0.49 0.73 -0.84 0.00 -1.26 -1.71 121.76 117.33 2wdi s ALA 46 Ca 0.13 -0.74 -0.08 0.00 0.00 0.00 0.00 51.96 51.26 2wdi s ALA 46 Cb -0.10 0.99 0.07 0.00 0.00 0.00 0.00 23.12 24.08 2wdi s ALA 46 CO 0.03 -0.91 1.05 0.42 0.00 0.00 0.00 175.76 176.36 2wdi s ILE 47 N -3.86 2.21 0.00 0.00 1.09 0.71 -4.85 121.20 116.50 2wdi s ILE 47 Ca 0.19 -0.22 0.00 0.00 -1.10 0.00 0.00 60.65 59.52 2wdi s ILE 47 Cb -0.02 -2.99 0.00 0.00 -1.06 0.00 0.00 42.46 38.39 2wdi s ILE 47 CO 0.09 0.00 0.31 -2.65 -0.10 0.00 0.00 174.94 172.59 2wdi n PRO 48 N -3.02 0.00 -0.71 2.79 -0.02 -1.26 -4.00 135.00 128.78 2wdi n PRO 48 Ca 0.08 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.48 2wdi n PRO 48 Cb 0.61 -0.79 -0.12 0.00 -0.02 0.00 0.00 33.50 33.18 2wdi n PRO 48 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2wdi n ARG 49 N -0.42 1.42 -2.54 -0.52 5.12 -1.26 -4.89 116.66 113.55 2wdi n ARG 49 Ca 0.00 -0.70 -0.32 0.00 -1.93 0.00 0.00 57.85 54.90 2wdi n ARG 49 Cb 0.00 -1.84 -0.05 0.00 -1.16 0.00 0.00 32.46 29.41 2wdi n ARG 49 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 2wdi s GLY 50 N 2.28 2.19 0.00 -0.13 0.00 -1.26 -4.89 107.32 105.51 2wdi s GLY 50 Ca 0.47 0.28 0.00 0.00 0.00 0.00 0.00 44.72 45.46 2wdi s GLY 50 CO 0.00 0.56 0.75 0.00 0.00 0.00 0.00 173.10 174.40 2wdi n ALA 51 N -1.24 2.31 -3.64 3.20 0.00 -1.01 -4.56 120.51 115.57 2wdi n ALA 51 Ca 0.07 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.43 2wdi n ALA 51 Cb 0.54 -1.00 -0.07 0.00 0.00 0.00 0.00 19.45 18.92 2wdi n ALA 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2wdi s VAL 52 N -1.81 0.00 0.33 0.00 0.11 -1.22 -5.04 120.40 112.78 2wdi s VAL 52 Ca 0.00 0.00 0.07 0.00 -2.93 0.00 0.00 61.98 59.12 2wdi s VAL 52 Cb 0.00 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 33.84 2wdi s VAL 52 CO 0.00 0.00 0.43 -0.54 -3.33 0.00 0.00 175.10 171.66 2wdi s LYS 53 N 0.87 3.03 0.37 1.54 3.01 -1.26 -4.41 119.74 122.89 2wdi s LYS 53 Ca -0.04 -1.08 -0.27 0.00 -1.01 0.00 0.00 55.97 53.57 2wdi s LYS 53 Cb -0.05 -2.74 -0.10 0.00 -1.01 0.00 0.00 37.83 33.94 2wdi s LYS 53 CO -0.11 0.07 1.36 -1.21 0.51 0.00 0.00 175.35 175.98 2wdi s GLU 54 N -4.13 4.12 0.00 1.68 2.02 -1.26 -3.09 118.70 118.04 2wdi s GLU 54 Ca 0.44 2.30 0.00 0.00 0.02 0.00 0.00 54.97 57.73 2wdi s GLU 54 Cb -0.09 -2.92 0.00 0.00 0.10 0.00 0.00 34.13 31.23 2wdi s GLU 54 CO 0.30 -0.42 0.00 0.41 0.02 0.00 0.00 175.26 175.57 2wdi n GLY 55 N 0.66 0.65 3.79 -1.39 0.00 0.95 -4.99 105.19 104.86 2wdi n GLY 55 Ca 0.02 -0.75 -0.29 0.00 0.00 0.00 0.00 46.02 44.99 2wdi n GLY 55 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2wdi s ASP 56 N -2.76 5.57 -0.97 1.61 -0.00 -1.18 -4.90 116.67 114.04 2wdi s ASP 56 Ca 0.00 -0.03 -0.12 0.00 -0.00 0.00 0.00 52.55 52.41 2wdi s ASP 56 Cb 0.00 -1.50 0.24 0.00 -0.00 0.00 0.00 42.92 41.67 2wdi s ASP 56 CO 0.00 0.15 0.95 -0.69 -0.00 0.00 0.00 175.17 175.58 2wdi s VAL 57 N -1.48 5.76 0.59 -1.27 1.01 -1.26 -1.86 120.40 121.88 2wdi s VAL 57 Ca 0.30 -2.90 -0.03 0.00 0.00 0.00 0.00 61.98 59.35 2wdi s VAL 57 Cb -0.12 -4.55 0.03 0.00 0.00 0.00 0.00 36.38 31.74 2wdi s VAL 57 CO 0.23 -1.13 0.86 0.68 0.00 0.00 0.00 175.10 175.74 2wdi s VAL 58 N -0.40 3.13 0.13 2.92 -7.23 -0.97 -4.84 120.40 113.14 2wdi s VAL 58 Ca 0.25 -0.31 0.07 0.00 -1.81 0.00 0.00 61.98 60.18 2wdi s VAL 58 Cb -0.10 -3.24 -0.04 0.00 0.56 0.00 0.00 36.38 33.57 2wdi s VAL 58 CO -0.08 -0.22 -0.06 -0.75 -0.31 0.00 0.00 175.10 173.68 2wdi s LYS 59 N -4.93 2.26 0.09 4.82 2.20 -1.26 -0.75 119.74 122.17 2wdi s LYS 59 Ca 0.55 -1.05 -0.25 0.00 -0.36 0.00 0.00 55.97 54.86 2wdi s LYS 59 Cb -0.10 -2.34 0.08 0.00 -1.51 0.00 0.00 37.83 33.96 2wdi s LYS 59 CO 0.42 0.49 0.70 0.00 -0.36 0.00 0.00 175.35 176.60 2wdi s ALA 60 N -1.43 -1.69 0.05 3.13 0.00 -0.37 -0.85 121.76 120.61 2wdi s ALA 60 Ca 0.24 0.73 0.05 0.00 0.00 0.00 0.00 51.96 52.98 2wdi s ALA 60 Cb -0.10 0.65 -0.04 0.00 0.00 0.00 0.00 23.12 23.63 2wdi s ALA 60 CO 0.16 -0.71 -0.06 0.54 0.00 0.00 0.00 175.76 175.70 2wdi s VAL 61 N -3.32 3.68 -0.07 0.00 0.11 -0.34 -0.30 120.40 120.15 2wdi s VAL 61 Ca 0.01 -0.96 -0.23 0.00 -2.93 0.00 0.00 61.98 57.87 2wdi s VAL 61 Cb -0.01 -2.67 -0.04 0.00 -1.53 0.00 0.00 36.38 32.13 2wdi s VAL 61 CO -0.10 0.25 0.69 -0.69 -3.33 0.00 0.00 175.10 171.92 2wdi s VAL 62 N -1.14 5.05 -0.32 2.04 1.01 -0.55 -1.17 120.40 125.32 2wdi s VAL 62 Ca 0.20 1.42 0.06 0.00 0.00 0.00 0.00 61.98 63.66 2wdi s VAL 62 Cb -0.11 -4.03 -0.05 0.00 0.00 0.00 0.00 36.38 32.19 2wdi s VAL 62 CO 0.12 0.25 0.29 1.33 0.00 0.00 0.00 175.10 177.09 2wdi n VAL 63 N 3.78 0.00 -3.61 2.92 0.24 -0.61 -1.59 118.33 119.46 2wdi n VAL 63 Ca -0.01 -0.38 -0.16 0.00 -2.04 0.00 0.00 64.34 61.75 2wdi n VAL 63 Cb 0.51 1.01 -0.07 0.00 -1.47 0.00 0.00 33.84 33.83 2wdi n VAL 63 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 2wdi s ARG 64 N -1.43 0.88 0.07 7.34 0.52 -1.16 -2.95 118.95 122.22 2wdi s ARG 64 Ca 0.03 0.48 0.03 0.00 -0.52 0.00 0.00 55.73 55.75 2wdi s ARG 64 Cb 0.04 0.42 -0.03 0.00 0.52 0.00 0.00 34.95 35.90 2wdi s ARG 64 CO 0.22 -0.21 -0.08 0.95 0.02 0.00 0.00 175.30 176.19 2wdi s THR 65 N -0.54 0.71 -0.52 0.02 -4.23 -1.21 -2.18 115.64 107.70 2wdi s THR 65 Ca -0.06 -1.46 0.24 0.00 -1.18 0.00 0.00 61.69 59.22 2wdi s THR 65 Cb -0.03 -1.11 0.18 0.00 1.34 0.00 0.00 72.50 72.88 2wdi s THR 65 CO 0.05 -0.55 1.45 0.50 -0.54 0.00 0.00 174.62 175.54 2wdi h LYS 66 N 3.84 0.00 -4.89 3.99 1.63 -1.71 -2.65 116.57 116.79 2wdi h LYS 66 Ca -0.36 0.00 -0.68 0.00 -0.85 0.00 0.00 60.65 58.75 2wdi h LYS 66 Cb 1.19 0.00 -0.18 0.00 -0.60 0.00 0.00 32.23 32.63 2wdi h LYS 66 CO 0.50 0.00 0.23 0.21 -3.45 0.00 0.00 179.45 176.95 2wdi s LYS 67 N -3.21 3.07 -0.20 1.90 2.47 -1.26 -4.64 119.74 117.86 2wdi s LYS 67 Ca 0.06 -1.20 -0.21 0.00 -1.56 0.00 0.00 55.97 53.06 2wdi s LYS 67 Cb 0.10 -4.26 -0.09 0.00 -1.46 0.00 0.00 37.83 32.11 2wdi s LYS 67 CO 0.69 -1.62 0.70 -0.85 0.16 0.00 0.00 175.35 174.44 2wdi n GLU 68 N 6.69 0.00 -2.87 4.03 0.00 -1.26 -4.69 120.64 122.55 2wdi n GLU 68 Ca -0.08 0.00 -0.42 0.00 0.00 0.00 0.00 57.16 56.67 2wdi n GLU 68 Cb 0.43 -0.68 -0.04 0.00 0.00 0.00 0.00 31.44 31.15 2wdi n GLU 68 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 2wdi s ILE 69 N 1.21 4.87 -0.22 3.84 1.01 0.17 -4.87 121.20 127.21 2wdi s ILE 69 Ca 0.47 1.68 -0.18 0.00 0.00 0.00 0.00 60.65 62.63 2wdi s ILE 69 Cb -0.67 -4.16 -0.03 0.00 0.01 0.00 0.00 42.46 37.61 2wdi s ILE 69 CO 0.36 0.02 0.49 -0.75 0.00 0.00 0.00 174.94 175.07 2wdi s LYS 70 N 2.13 4.15 0.42 2.79 2.20 -1.26 -1.65 119.74 128.53 2wdi s LYS 70 Ca 0.39 0.34 -0.15 0.00 -0.36 0.00 0.00 55.97 56.20 2wdi s LYS 70 Cb -0.17 -3.59 -0.08 0.00 -1.51 0.00 0.00 37.83 32.49 2wdi s LYS 70 CO 0.13 -0.19 0.85 1.03 -0.36 0.00 0.00 175.35 176.81 2wdi s ARG 71 N 1.78 3.93 0.33 4.03 1.81 0.44 -4.96 118.95 126.31 2wdi s ARG 71 Ca 0.22 0.74 0.26 0.00 -1.72 0.00 0.00 55.73 55.23 2wdi s ARG 71 Cb -0.15 -2.30 1.05 0.00 -0.45 0.00 0.00 34.95 33.10 2wdi s ARG 71 CO 0.09 -0.06 1.78 -1.00 -0.68 0.00 0.00 175.30 175.43 2wdi h PRO 72 N 1.46 0.00 0.00 3.54 0.13 -1.98 -2.01 132.00 133.14 2wdi h PRO 72 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2wdi h PRO 72 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2wdi h PRO 72 CO 0.63 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 178.00 2wdi n ASP 73 N -2.45 0.00 0.00 1.44 5.68 -1.26 -4.89 116.55 115.08 2wdi n ASP 73 Ca 0.02 -0.28 0.00 0.00 -0.50 0.00 0.00 54.79 54.03 2wdi n ASP 73 Cb 0.26 -0.22 0.00 0.00 -1.14 0.00 0.00 41.12 40.02 2wdi n ASP 73 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wdi n GLY 74 N 1.00 0.48 3.86 6.12 0.00 -0.75 -5.07 105.19 110.82 2wdi n GLY 74 Ca 0.15 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.96 2wdi n GLY 74 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wdi s SER 75 N -2.65 5.06 0.05 1.61 1.04 -1.26 -4.94 113.70 112.61 2wdi s SER 75 Ca 0.00 -0.70 -0.09 0.00 0.48 0.00 0.00 55.95 55.64 2wdi s SER 75 Cb 0.00 -0.67 0.00 0.00 0.10 0.00 0.00 66.02 65.45 2wdi s SER 75 CO 0.00 -0.56 0.19 0.00 0.98 0.00 0.00 173.24 173.85 2wdi s ALA 76 N -2.44 -0.30 0.06 5.32 0.00 -1.26 -0.42 121.76 122.72 2wdi s ALA 76 Ca 0.46 -0.38 0.06 0.00 0.00 0.00 0.00 51.96 52.10 2wdi s ALA 76 Cb -0.03 0.32 -0.03 0.00 0.00 0.00 0.00 23.12 23.38 2wdi s ALA 76 CO 0.27 -0.39 -0.18 -1.50 0.00 0.00 0.00 175.76 173.96 2wdi s ILE 77 N -2.85 1.42 -0.10 0.00 1.10 -0.66 -4.97 121.20 115.14 2wdi s ILE 77 Ca -0.03 -1.22 -0.05 0.00 -0.51 0.00 0.00 60.65 58.85 2wdi s ILE 77 Cb 0.00 -1.27 0.05 0.00 0.15 0.00 0.00 42.46 41.39 2wdi s ILE 77 CO -0.05 0.02 0.22 -0.60 -2.11 0.00 0.00 174.94 172.42 2wdi s ARG 78 N -1.40 0.16 0.25 3.50 3.52 -1.26 0.42 118.95 124.14 2wdi s ARG 78 Ca 0.04 0.53 0.06 0.00 -0.13 0.00 0.00 55.73 56.23 2wdi s ARG 78 Cb -0.09 -0.13 -0.03 0.00 -1.56 0.00 0.00 34.95 33.14 2wdi s ARG 78 CO 0.02 -0.19 0.31 -0.06 -0.81 0.00 0.00 175.30 174.57 2wdi s PHE 79 N 1.48 3.33 -1.74 5.12 0.40 -1.00 -4.98 117.98 120.59 2wdi s PHE 79 Ca -0.07 -0.06 0.18 0.00 -0.60 0.00 0.00 56.93 56.38 2wdi s PHE 79 Cb -0.11 -1.54 1.00 0.00 0.51 0.00 0.00 43.02 42.88 2wdi s PHE 79 CO -0.08 0.44 1.51 -0.25 0.70 0.00 0.00 175.22 177.54 2wdi n ASP 80 N -1.35 0.00 -3.93 1.36 8.00 -1.26 -4.11 116.55 115.27 2wdi n ASP 80 Ca -0.08 -0.29 -0.08 0.00 0.71 0.00 0.00 54.79 55.04 2wdi n ASP 80 Cb 0.57 -0.13 -0.04 0.00 -0.02 0.00 0.00 41.12 41.50 2wdi n ASP 80 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 2wdi s ASP 81 N -2.26 -0.16 -0.44 -2.24 3.84 -1.26 -4.96 116.67 109.19 2wdi s ASP 81 Ca 0.22 -0.79 -0.09 0.00 -0.00 0.00 0.00 52.55 51.89 2wdi s ASP 81 Cb 0.12 0.65 0.09 0.00 -1.38 0.00 0.00 42.92 42.41 2wdi s ASP 81 CO 0.24 -1.24 0.29 0.20 -0.00 0.00 0.00 175.17 174.66 2wdi s ASN 82 N -2.97 5.68 0.29 2.11 -0.87 -1.26 -3.32 114.94 114.59 2wdi s ASN 82 Ca 0.17 -1.64 0.10 0.00 -1.57 0.00 0.00 52.86 49.92 2wdi s ASN 82 Cb -0.03 -2.00 -0.05 0.00 -0.02 0.00 0.00 41.25 39.15 2wdi s ASN 82 CO 0.08 -0.60 -0.00 0.00 -2.57 0.00 0.00 177.10 174.01 2wdi s ALA 83 N 1.41 3.17 0.14 0.60 0.00 -0.93 -0.45 121.76 125.70 2wdi s ALA 83 Ca 0.04 -1.76 -0.11 0.00 0.00 0.00 0.00 51.96 50.13 2wdi s ALA 83 Cb -0.24 -0.64 0.00 0.00 0.00 0.00 0.00 23.12 22.25 2wdi s ALA 83 CO 0.01 0.20 0.30 0.00 0.00 0.00 0.00 175.76 176.27 2wdi s ALA 84 N -2.40 -0.30 -0.04 0.00 0.00 0.77 -1.57 121.76 118.23 2wdi s ALA 84 Ca 0.33 -0.62 0.07 0.00 0.00 0.00 0.00 51.96 51.74 2wdi s ALA 84 Cb -0.04 0.73 -0.01 0.00 0.00 0.00 0.00 23.12 23.79 2wdi s ALA 84 CO 0.20 -0.63 -0.24 0.08 0.00 0.00 0.00 175.76 175.16 2wdi s VAL 85 N -3.90 1.96 0.05 0.00 1.01 -0.32 -0.51 120.40 118.69 2wdi s VAL 85 Ca 0.11 -1.04 -0.30 0.00 0.00 0.00 0.00 61.98 60.75 2wdi s VAL 85 Cb 0.03 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.72 2wdi s VAL 85 CO -0.05 0.55 1.02 -0.63 0.00 0.00 0.00 175.10 175.99 2wdi s ILE 86 N -0.37 4.57 0.15 2.22 1.09 -1.26 -1.20 121.20 126.39 2wdi s ILE 86 Ca 0.03 1.94 0.06 0.00 -1.10 0.00 0.00 60.65 61.59 2wdi s ILE 86 Cb -0.11 -4.24 -0.04 0.00 -1.06 0.00 0.00 42.46 37.00 2wdi s ILE 86 CO 0.01 0.21 0.01 -0.63 -0.10 0.00 0.00 174.94 174.44 2wdi s ILE 87 N 0.64 3.88 0.24 2.92 -1.09 -0.03 -1.73 121.20 126.03 2wdi s ILE 87 Ca 0.51 -1.26 0.05 0.00 -2.23 0.00 0.00 60.65 57.72 2wdi s ILE 87 Cb -0.23 -2.92 -0.03 0.00 -1.58 0.00 0.00 42.46 37.69 2wdi s ILE 87 CO 0.29 -0.04 0.34 0.54 -1.23 0.00 0.00 174.94 174.84 2wdi s ASN 88 N -2.77 6.25 0.58 3.58 4.22 0.28 -3.98 114.94 123.10 2wdi s ASN 88 Ca 0.27 0.04 0.37 0.00 -2.14 0.00 0.00 52.86 51.40 2wdi s ASN 88 Cb -0.10 -1.82 1.34 0.00 1.28 0.00 0.00 41.25 41.95 2wdi s ASN 88 CO 0.19 -0.07 1.51 0.78 -2.04 0.00 0.00 177.10 177.47 2wdi h ASN 89 N 1.21 0.00 -0.49 3.54 4.21 -1.97 1.88 115.58 123.97 2wdi h ASN 89 Ca -0.52 0.00 -0.11 0.00 1.21 0.00 0.00 56.30 56.88 2wdi h ASN 89 Cb 1.23 0.00 -0.07 0.00 -1.12 0.00 0.00 38.32 38.36 2wdi h ASN 89 CO 0.61 0.00 0.15 0.00 -1.29 0.00 0.00 177.43 176.90 2wdi n GLN 90 N -3.63 3.14 -1.77 0.81 3.00 -1.26 -4.90 117.38 112.77 2wdi n GLN 90 Ca 0.30 -2.17 -0.21 0.00 -0.01 0.00 0.00 57.00 54.92 2wdi n GLN 90 Cb 1.60 -1.97 -0.07 0.00 0.00 0.00 0.00 30.24 29.80 2wdi n GLN 90 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 2wdi n LEU 91 N 0.09 -1.60 -4.77 1.08 7.99 0.64 -5.00 117.00 115.43 2wdi n LEU 91 Ca 0.26 0.40 -0.31 0.00 -0.01 0.00 0.00 56.01 56.35 2wdi n LEU 91 Cb 1.04 -2.86 -0.07 0.00 -0.11 0.00 0.00 43.42 41.43 2wdi n LEU 91 CO 0.29 -0.90 -0.26 -1.61 -1.51 0.00 0.00 177.39 173.40 2wdi s GLU 92 N -4.02 2.95 0.51 3.23 2.02 -1.22 -4.72 118.70 117.46 2wdi s GLU 92 Ca 0.00 -0.61 -0.23 0.00 0.02 0.00 0.00 54.97 54.16 2wdi s GLU 92 Cb 0.00 -2.78 -0.06 0.00 0.10 0.00 0.00 34.13 31.40 2wdi s GLU 92 CO 0.00 0.60 1.32 -1.25 0.02 0.00 0.00 175.26 175.95 2wdi s PRO 93 N -2.11 3.37 0.00 0.39 0.04 -1.26 0.10 135.00 135.54 2wdi s PRO 93 Ca 0.26 2.15 0.24 0.00 0.04 0.00 0.00 61.00 63.70 2wdi s PRO 93 Cb -0.12 -2.36 0.26 0.00 0.04 0.00 0.00 34.50 32.32 2wdi s PRO 93 CO 0.18 -0.98 1.25 0.54 0.04 0.00 0.00 177.00 178.03 2wdi n ARG 94 N -0.76 0.78 -2.45 4.56 1.74 -0.71 -4.78 116.66 115.04 2wdi n ARG 94 Ca 0.09 -0.58 -0.16 0.00 -0.77 0.00 0.00 57.85 56.43 2wdi n ARG 94 Cb 0.45 -1.49 0.06 0.00 -1.02 0.00 0.00 32.46 30.47 2wdi n ARG 94 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wdi n GLY 95 N 1.42 1.62 0.00 -0.13 0.00 -1.26 -4.87 105.19 101.96 2wdi n GLY 95 Ca 0.09 -2.16 0.00 0.00 0.00 0.00 0.00 46.02 43.95 2wdi n GLY 95 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wdi n THR 96 N -2.14 0.00 -3.43 2.61 -2.24 -1.26 -5.01 114.28 102.81 2wdi n THR 96 Ca 0.13 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 2wdi n THR 96 Cb 0.47 1.05 0.00 0.00 -2.10 0.00 0.00 70.33 69.75 2wdi n THR 96 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2wdi n ARG 97 N -0.58 1.63 0.00 -0.78 5.12 -1.26 -5.07 116.66 115.72 2wdi n ARG 97 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 2wdi n ARG 97 Cb 0.01 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.31 2wdi n ARG 97 CO 0.00 0.00 0.00 1.55 -1.93 0.00 0.00 177.63 177.25 2wdi n VAL 98 N 0.00 0.00 -4.44 1.55 3.14 -1.26 -4.47 118.33 112.86 2wdi n VAL 98 Ca 0.00 0.00 -0.23 0.00 -2.96 0.00 0.00 64.34 61.15 2wdi n VAL 98 Cb 0.00 0.00 -0.10 0.00 -1.06 0.00 0.00 33.84 32.68 2wdi n VAL 98 CO 0.00 0.00 0.00 -0.36 -6.46 0.00 0.00 176.83 170.01 2wdi s PHE 99 N -0.78 2.15 0.38 1.45 0.08 0.75 -4.36 117.98 117.65 2wdi s PHE 99 Ca 0.00 -0.39 0.00 0.00 0.12 0.00 0.00 56.93 56.66 2wdi s PHE 99 Cb 0.00 -0.94 0.00 0.00 -0.57 0.00 0.00 43.02 41.51 2wdi s PHE 99 CO 0.00 0.63 0.00 0.41 -0.10 0.00 0.00 175.22 176.16 2wdi n GLY 100 N -0.54 -2.32 3.46 4.36 0.00 -1.26 -4.81 105.19 104.08 2wdi n GLY 100 Ca -0.06 -1.17 -0.29 0.00 0.00 0.00 0.00 46.02 44.50 2wdi n GLY 100 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2wdi s PRO 101 N -2.75 -1.59 -0.07 1.61 0.02 -1.26 -4.27 135.00 126.68 2wdi s PRO 101 Ca 0.00 0.40 -0.24 0.00 0.02 0.00 0.00 61.00 61.18 2wdi s PRO 101 Cb 0.00 -1.51 0.05 0.00 0.02 0.00 0.00 34.50 33.06 2wdi s PRO 101 CO 0.00 -4.06 0.55 0.14 -0.33 0.00 0.00 177.00 173.30 2wdi s VAL 102 N -2.53 0.02 0.21 3.83 -7.23 -1.10 -4.88 120.40 108.71 2wdi s VAL 102 Ca 0.69 -0.15 -0.30 0.00 -1.81 0.00 0.00 61.98 60.41 2wdi s VAL 102 Cb -0.18 -0.85 -0.08 0.00 0.56 0.00 0.00 36.38 35.83 2wdi s VAL 102 CO 0.60 -0.08 0.96 0.00 -0.31 0.00 0.00 175.10 176.27 2wdi s ALA 103 N -0.96 3.32 -1.23 1.32 0.00 -1.15 -1.75 121.76 121.31 2wdi s ALA 103 Ca -0.10 0.63 0.04 0.00 0.00 0.00 0.00 51.96 52.54 2wdi s ALA 103 Cb -0.02 -3.24 0.20 0.00 0.00 0.00 0.00 23.12 20.06 2wdi s ALA 103 CO 0.07 0.11 1.05 2.89 0.00 0.00 0.00 175.76 179.87 2wdi n ARG 104 N 1.84 0.03 0.30 0.00 1.85 -0.65 -1.43 116.66 118.61 2wdi n ARG 104 Ca -0.01 0.33 0.18 0.00 -1.00 0.00 0.00 57.85 57.36 2wdi n ARG 104 Cb 0.47 -1.50 0.96 0.00 -1.05 0.00 0.00 32.46 31.34 2wdi n ARG 104 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 2wdi h GLU 105 N 0.00 0.00 -0.47 2.89 3.07 -1.90 -0.55 114.58 117.61 2wdi h GLU 105 Ca 0.00 0.00 0.01 0.00 -0.50 0.00 0.00 59.36 58.87 2wdi h GLU 105 Cb 0.06 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 27.94 2wdi h GLU 105 CO 0.00 0.03 0.30 -0.07 -1.40 0.00 0.00 179.01 177.87 2wdi h LEU 106 N 0.00 0.49 0.36 1.33 3.38 -1.57 0.12 115.31 119.43 2wdi h LEU 106 Ca -0.00 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2wdi h LEU 106 Cb 0.19 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2wdi h LEU 106 CO 0.00 0.35 -0.17 -0.09 0.09 0.00 0.00 178.44 178.62 2wdi h ARG 107 N 0.60 -0.47 -0.91 1.13 2.43 -1.32 0.45 114.38 116.29 2wdi h ARG 107 Ca 0.18 0.03 0.23 0.00 -0.81 0.00 0.00 59.98 59.61 2wdi h ARG 107 Cb -0.02 0.11 -0.13 0.00 -0.42 0.00 0.00 29.97 29.51 2wdi h ARG 107 CO -0.07 -0.26 0.41 0.93 -1.51 0.00 0.00 179.97 179.47 2wdi h GLU 108 N -0.57 0.39 0.00 0.20 5.08 -1.29 0.57 114.58 118.95 2wdi h GLU 108 Ca -0.05 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 2wdi h GLU 108 Cb 0.43 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.59 2wdi h GLU 108 CO 0.08 0.26 0.00 1.63 -1.00 0.00 0.00 179.01 179.98 2wdi n LYS 109 N -5.04 0.00 -0.47 2.33 4.76 0.41 -4.93 118.16 115.22 2wdi n LYS 109 Ca 0.23 0.09 0.00 0.00 -2.87 0.00 0.00 58.31 55.75 2wdi n LYS 109 Cb 0.67 -1.51 0.00 0.00 -1.84 0.00 0.00 35.03 32.36 2wdi n LYS 109 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2wdi n GLY 110 N 0.99 1.51 2.57 0.72 0.00 0.20 -5.04 105.19 106.14 2wdi n GLY 110 Ca 0.06 -0.19 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 2wdi n GLY 110 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2wdi n PHE 111 N -1.48 3.33 0.24 1.61 3.72 -0.51 -4.95 117.46 119.42 2wdi n PHE 111 Ca 0.00 -3.77 -0.14 0.00 -0.05 0.00 0.00 57.45 53.48 2wdi n PHE 111 Cb 0.11 -0.72 -0.08 0.00 -0.94 0.00 0.00 39.48 37.85 2wdi n PHE 111 CO 0.00 0.00 0.00 0.52 -0.05 0.00 0.00 176.76 177.23 2wdi h MET 112 N 4.44 -0.76 -0.99 -1.08 2.86 -1.89 -3.00 114.93 114.51 2wdi h MET 112 Ca 0.20 0.05 0.19 0.00 -2.06 0.00 0.00 59.70 58.08 2wdi h MET 112 Cb 0.64 0.17 -0.10 0.00 0.06 0.00 0.00 31.60 32.38 2wdi h MET 112 CO 0.96 -0.51 0.61 0.87 1.06 0.00 0.00 176.91 179.90 2wdi h LYS 113 N -0.79 0.68 0.68 1.72 1.57 -2.00 -2.01 116.57 116.43 2wdi h LYS 113 Ca -0.05 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.65 2wdi h LYS 113 Cb 0.68 -0.15 0.01 0.00 0.08 0.00 0.00 32.23 32.84 2wdi h LYS 113 CO -0.04 0.45 -0.33 0.82 -0.57 0.00 0.00 179.45 179.78 2wdi h ILE 114 N 0.70 0.24 -0.55 1.86 1.08 -1.97 -0.46 117.51 118.41 2wdi h ILE 114 Ca 0.55 -0.19 0.11 0.00 -0.39 0.00 0.00 64.86 64.95 2wdi h ILE 114 Cb 0.94 0.29 -0.10 0.00 -3.07 0.00 0.00 36.82 34.88 2wdi h ILE 114 CO -0.33 0.02 -0.14 0.58 -0.69 0.00 0.00 178.15 177.59 2wdi h VAL 115 N -1.06 0.44 -0.34 1.67 2.07 -1.26 0.58 116.25 118.36 2wdi h VAL 115 Ca -0.09 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.38 2wdi h VAL 115 Cb 0.73 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 2wdi h VAL 115 CO 0.15 0.00 0.01 0.77 0.02 0.00 0.00 177.57 178.53 2wdi h SER 116 N -0.01 0.57 -0.33 0.57 4.64 -1.39 -2.85 113.55 114.76 2wdi h SER 116 Ca 0.26 -0.30 -0.01 0.00 -0.47 0.00 0.00 61.79 61.27 2wdi h SER 116 Cb 0.41 -0.15 -0.02 0.00 -0.31 0.00 0.00 62.40 62.32 2wdi h SER 116 CO -0.57 0.73 0.17 0.25 -0.87 0.00 0.00 176.83 176.54 2wdi h LEU 117 N 0.40 0.45 -9.69 5.97 6.46 -0.07 -3.44 115.31 115.39 2wdi h LEU 117 Ca 0.10 -0.03 -0.56 0.00 -0.12 0.00 0.00 57.88 57.26 2wdi h LEU 117 Cb 0.42 -0.11 0.09 0.00 -0.73 0.00 0.00 40.66 40.33 2wdi h LEU 117 CO 0.01 0.39 0.72 0.00 -0.62 0.00 0.00 178.44 178.95 2wdi n ALA 118 N -2.48 1.76 0.76 1.25 0.00 0.19 -4.64 120.51 117.35 2wdi n ALA 118 Ca 0.02 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.85 2wdi n ALA 118 Cb 0.12 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.21 2wdi n ALA 118 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2wdi n PRO 119 N 1.98 0.76 0.00 0.00 -0.04 -1.26 -4.71 135.00 131.73 2wdi n PRO 119 Ca 0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 2wdi n PRO 119 Cb 0.34 -1.35 0.00 0.00 -0.04 0.00 0.00 33.50 32.45 2wdi n PRO 119 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2wdi n GLU 120 N 0.19 0.00 -3.95 0.54 2.13 -1.26 -4.90 120.64 113.38 2wdi n GLU 120 Ca 0.00 0.00 -0.34 0.00 0.66 0.00 0.00 57.16 57.48 2wdi n GLU 120 Cb 0.22 0.00 -0.14 0.00 0.27 0.00 0.00 31.44 31.78 2wdi n GLU 120 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2wdi s VAL 121 N -0.08 2.81 -1.50 6.31 1.01 -1.26 -2.71 120.40 124.97 2wdi s VAL 121 Ca 0.00 -1.28 0.12 0.00 0.00 0.00 0.00 61.98 60.82 2wdi s VAL 121 Cb 0.00 -2.54 0.10 0.00 0.00 0.00 0.00 36.38 33.93 2wdi s VAL 121 CO 0.00 0.03 0.88 0.18 0.00 0.00 0.00 175.10 176.19