#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jwl n SER 20 N 0.00 0.00 -3.51 1.61 3.41 -1.26 -4.97 113.62 108.90 2jwl n SER 20 Ca 0.00 0.39 -0.08 0.00 -0.26 0.00 0.00 58.87 58.92 2jwl n SER 20 Cb 0.00 -0.40 -0.09 0.00 -0.26 0.00 0.00 64.21 63.47 2jwl n SER 20 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2jwl s VAL 21 N -0.80 -0.64 0.11 -3.33 1.01 -1.26 -5.00 120.40 110.49 2jwl s VAL 21 Ca 0.00 0.06 -0.01 0.00 0.00 0.00 0.00 61.98 62.03 2jwl s VAL 21 Cb 0.00 -0.74 0.02 0.00 0.00 0.00 0.00 36.38 35.66 2jwl s VAL 21 CO 0.00 -0.01 0.04 -2.65 0.00 0.00 0.00 175.10 172.48 2jwl n PRO 22 N 5.38 0.37 -3.76 2.72 -0.02 -1.26 -2.89 135.00 135.54 2jwl n PRO 22 Ca -0.06 -0.07 -0.36 0.00 -2.02 0.00 0.00 63.50 60.98 2jwl n PRO 22 Cb 0.50 -0.17 -0.13 0.00 -0.02 0.00 0.00 33.50 33.68 2jwl n PRO 22 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2jwl s VAL 23 N -0.59 4.26 -0.13 -1.45 1.01 -0.50 -3.08 120.40 119.91 2jwl s VAL 23 Ca 0.03 -0.20 0.01 0.00 0.00 0.00 0.00 61.98 61.83 2jwl s VAL 23 Cb -0.01 -2.99 -0.01 0.00 0.00 0.00 0.00 36.38 33.38 2jwl s VAL 23 CO 0.03 0.34 -0.17 -0.63 0.00 0.00 0.00 175.10 174.66 2jwl s ILE 24 N 1.61 2.62 -0.15 2.22 1.09 -0.06 -2.10 121.20 126.43 2jwl s ILE 24 Ca 0.06 -0.81 0.00 0.00 -1.10 0.00 0.00 60.65 58.81 2jwl s ILE 24 Cb -0.15 -2.08 -0.00 0.00 -1.06 0.00 0.00 42.46 39.17 2jwl s ILE 24 CO 0.03 0.53 -0.15 -0.22 -0.10 0.00 0.00 174.94 175.03 2jwl s LEU 25 N 0.49 2.49 -0.11 2.97 0.20 -0.67 0.14 118.68 124.19 2jwl s LEU 25 Ca -0.12 -0.46 0.02 0.00 0.69 0.00 0.00 54.13 54.26 2jwl s LEU 25 Cb -0.16 -1.57 -0.01 0.00 -0.43 0.00 0.00 46.19 44.02 2jwl s LEU 25 CO 0.05 0.09 -0.18 -0.70 -0.29 0.00 0.00 176.35 175.32 2jwl s GLU 26 N 0.79 3.19 -0.74 1.98 2.56 0.78 -1.11 118.70 126.16 2jwl s GLU 26 Ca -0.06 -0.77 -0.20 0.00 0.00 0.00 0.00 54.97 53.94 2jwl s GLU 26 Cb -0.15 -2.47 0.10 0.00 2.00 0.00 0.00 34.13 33.61 2jwl s GLU 26 CO 0.00 0.22 0.95 0.08 -0.56 0.00 0.00 175.26 175.95 2jwl s VAL 27 N 0.28 4.63 -0.10 3.70 1.01 0.24 -1.14 120.40 129.02 2jwl s VAL 27 Ca -0.13 -1.01 0.28 0.00 0.00 0.00 0.00 61.98 61.13 2jwl s VAL 27 Cb -0.16 -4.66 0.35 0.00 0.00 0.00 0.00 36.38 31.91 2jwl s VAL 27 CO 0.07 -1.38 1.82 0.00 0.00 0.00 0.00 175.10 175.61 2jwl h ALA 28 N 9.16 0.99 -3.00 5.51 0.00 -1.65 -2.47 119.26 127.80 2jwl h ALA 28 Ca -0.13 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2jwl h ALA 28 Cb 1.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2jwl h ALA 28 CO 1.12 0.04 0.00 0.41 0.00 0.00 0.00 179.25 180.82 2jwl n GLY 29 N 0.47 0.01 3.02 0.00 0.00 -1.20 -4.89 105.19 102.59 2jwl n GLY 29 Ca 0.02 0.54 -0.33 0.00 0.00 0.00 0.00 46.02 46.25 2jwl n GLY 29 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jwl s ILE 30 N 2.81 3.23 0.00 -0.61 -1.09 -1.26 -4.63 121.20 119.65 2jwl s ILE 30 Ca 0.00 -3.35 0.00 0.00 -2.23 0.00 0.00 60.65 55.07 2jwl s ILE 30 Cb 0.00 -3.14 0.00 0.00 -1.58 0.00 0.00 42.46 37.74 2jwl s ILE 30 CO 0.00 -0.88 0.00 0.61 -1.23 0.00 0.00 174.94 173.44 2jwl n GLY 31 N 3.05 0.21 3.61 6.18 0.00 -1.26 -5.07 105.19 111.91 2jwl n GLY 31 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 2jwl n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jwl s LYS 32 N -0.97 3.79 0.05 1.61 3.01 -1.26 -4.04 119.74 121.93 2jwl s LYS 32 Ca 0.00 -0.39 0.00 0.00 -1.01 0.00 0.00 55.97 54.58 2jwl s LYS 32 Cb 0.00 -3.10 -0.03 0.00 -1.01 0.00 0.00 37.83 33.69 2jwl s LYS 32 CO 0.00 0.33 -0.04 0.71 0.51 0.00 0.00 175.35 176.86 2jwl s TYR 33 N 0.19 0.55 0.01 3.18 1.51 -0.84 -1.70 117.35 120.24 2jwl s TYR 33 Ca 0.03 -0.85 0.07 0.00 -1.01 0.00 0.00 57.07 55.31 2jwl s TYR 33 Cb -0.13 -0.37 -0.02 0.00 -0.11 0.00 0.00 41.96 41.33 2jwl s TYR 33 CO 0.01 -0.26 -0.21 0.00 -1.11 0.00 0.00 175.55 173.99 2jwl s ALA 34 N -2.99 1.75 -0.04 3.71 0.00 -0.29 -1.61 121.76 122.29 2jwl s ALA 34 Ca 0.01 -0.97 0.02 0.00 0.00 0.00 0.00 51.96 51.02 2jwl s ALA 34 Cb 0.01 -0.40 0.01 0.00 0.00 0.00 0.00 23.12 22.74 2jwl s ALA 34 CO -0.06 0.42 -0.09 0.96 0.00 0.00 0.00 175.76 176.99 2jwl s ILE 35 N -0.61 0.82 -0.29 0.00 -4.36 0.04 -0.15 121.20 116.65 2jwl s ILE 35 Ca 0.08 -0.35 -0.05 0.00 -0.26 0.00 0.00 60.65 60.07 2jwl s ILE 35 Cb -0.08 -0.76 0.02 0.00 1.25 0.00 0.00 42.46 42.89 2jwl s ILE 35 CO 0.00 0.27 0.04 -0.55 0.24 0.00 0.00 174.94 174.94 2jwl s SER 36 N 0.43 4.93 -0.35 4.36 0.15 0.12 0.06 113.70 123.39 2jwl s SER 36 Ca -0.07 -0.90 -0.06 0.00 0.70 0.00 0.00 55.95 55.62 2jwl s SER 36 Cb -0.11 -1.80 0.05 0.00 -1.71 0.00 0.00 66.02 62.45 2jwl s SER 36 CO 0.01 -0.21 0.13 -0.63 1.20 0.00 0.00 173.24 173.74 2jwl s ILE 37 N 1.41 3.72 -1.49 6.45 1.01 0.21 -0.88 121.20 131.63 2jwl s ILE 37 Ca 0.00 -1.28 -0.04 0.00 0.00 0.00 0.00 60.65 59.33 2jwl s ILE 37 Cb -0.18 -3.17 0.03 0.00 0.01 0.00 0.00 42.46 39.15 2jwl s ILE 37 CO 0.00 -0.27 0.42 0.61 0.00 0.00 0.00 174.94 175.71 2jwl n GLY 38 N 4.79 -0.25 1.03 6.18 0.00 -1.14 -1.00 105.19 114.80 2jwl n GLY 38 Ca -0.11 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2jwl n GLY 38 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jwl n GLY 39 N -1.96 3.09 3.70 -0.02 0.00 -1.26 -4.83 105.19 103.91 2jwl n GLY 39 Ca -0.24 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.39 2jwl n GLY 39 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2jwl s GLU 40 N -0.32 4.32 -0.16 1.61 2.12 -0.17 -5.06 118.70 121.03 2jwl s GLU 40 Ca 0.00 0.61 -0.06 0.00 0.36 0.00 0.00 54.97 55.88 2jwl s GLU 40 Cb 0.00 -3.49 -0.04 0.00 0.26 0.00 0.00 34.13 30.86 2jwl s GLU 40 CO 0.00 -0.01 0.04 0.50 -0.54 0.00 0.00 175.26 175.25 2jwl s ARG 41 N 1.13 3.75 -0.13 4.30 3.00 -1.26 0.68 118.95 130.42 2jwl s ARG 41 Ca 0.30 -0.37 0.02 0.00 -1.00 0.00 0.00 55.73 54.68 2jwl s ARG 41 Cb -0.16 -3.10 0.00 0.00 0.00 0.00 0.00 34.95 31.69 2jwl s ARG 41 CO 0.12 0.36 -0.20 -0.65 0.00 0.00 0.00 175.30 174.93 2jwl s GLN 42 N 0.09 3.11 0.21 5.12 -0.21 0.11 -4.98 119.66 123.11 2jwl s GLN 42 Ca 0.04 -0.82 0.10 0.00 0.02 0.00 0.00 55.36 54.70 2jwl s GLN 42 Cb -0.12 -2.45 -0.04 0.00 1.00 0.00 0.00 33.01 31.39 2jwl s GLN 42 CO 0.01 0.08 -0.15 -2.00 -2.12 0.00 0.00 175.29 171.11 2jwl s GLU 43 N 0.62 1.85 0.00 2.91 2.12 -1.26 -0.78 118.70 124.15 2jwl s GLU 43 Ca -0.11 -1.45 0.00 0.00 0.36 0.00 0.00 54.97 53.77 2jwl s GLU 43 Cb -0.16 -1.99 0.00 0.00 0.26 0.00 0.00 34.13 32.23 2jwl s GLU 43 CO 0.03 0.40 0.00 0.41 -0.54 0.00 0.00 175.26 175.56 2jwl n GLY 44 N -0.10 0.51 3.85 -1.50 0.00 -1.23 -5.03 105.19 101.68 2jwl n GLY 44 Ca -0.10 -0.86 -0.33 0.00 0.00 0.00 0.00 46.02 44.73 2jwl n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jwl s LEU 45 N 0.00 4.16 0.59 0.99 1.43 -0.63 -4.93 118.68 120.29 2jwl s LEU 45 Ca 0.00 1.20 -0.01 0.00 -1.03 0.00 0.00 54.13 54.30 2jwl s LEU 45 Cb 0.00 -3.83 0.04 0.00 0.03 0.00 0.00 46.19 42.43 2jwl s LEU 45 CO 0.00 -0.11 0.84 0.42 0.23 0.00 0.00 176.35 177.73 2jwl s THR 46 N -1.82 2.55 0.10 5.49 -4.23 -1.26 -1.98 115.64 114.48 2jwl s THR 46 Ca 0.49 -0.58 -0.17 0.00 -1.18 0.00 0.00 61.69 60.26 2jwl s THR 46 Cb -0.12 -2.97 -0.05 0.00 1.34 0.00 0.00 72.50 70.69 2jwl s THR 46 CO 0.19 0.00 1.54 -0.08 -0.54 0.00 0.00 174.62 175.73 2jwl h GLU 47 N -0.11 0.58 -0.63 3.99 4.81 -1.99 0.20 114.58 121.42 2jwl h GLU 47 Ca -0.42 -0.19 -0.06 0.00 -0.13 0.00 0.00 59.36 58.56 2jwl h GLU 47 Cb 1.30 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.60 2jwl h GLU 47 CO 0.53 0.71 0.16 1.49 -0.73 0.00 0.00 179.01 181.17 2jwl h GLU 48 N 0.37 0.99 -0.19 1.92 4.81 -1.95 -2.30 114.58 118.22 2jwl h GLU 48 Ca 0.09 -0.22 -0.20 0.00 -0.13 0.00 0.00 59.36 58.91 2jwl h GLU 48 Cb 0.46 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.70 2jwl h GLU 48 CO 0.02 0.87 -0.66 1.98 -0.73 0.00 0.00 179.01 180.50 2jwl h MET 49 N 0.94 0.73 -0.57 1.92 4.05 -1.92 -2.68 114.93 117.40 2jwl h MET 49 Ca 0.20 -0.52 0.00 0.00 -0.28 0.00 0.00 59.70 59.10 2jwl h MET 49 Cb 0.33 0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 31.19 2jwl h MET 49 CO -0.00 1.14 0.37 -0.24 0.23 0.00 0.00 176.91 178.42 2jwl h VAL 50 N 0.53 1.15 0.07 -5.77 3.04 -0.38 -1.55 116.25 113.34 2jwl h VAL 50 Ca -0.02 -0.28 -0.00 0.00 -1.01 0.00 0.00 66.70 65.39 2jwl h VAL 50 Cb 1.26 0.32 0.00 0.00 -2.01 0.00 0.00 31.29 30.85 2jwl h VAL 50 CO 0.13 0.15 -0.03 0.74 -1.01 0.00 0.00 177.57 177.55 2jwl h THR 51 N 0.77 1.07 -0.36 3.17 2.02 -1.31 -0.34 112.91 117.94 2jwl h THR 51 Ca 0.21 -0.48 0.08 0.00 0.77 0.00 0.00 66.41 66.99 2jwl h THR 51 Cb -0.08 1.39 -0.08 0.00 -1.74 0.00 0.00 68.15 67.64 2jwl h THR 51 CO -0.04 0.12 -0.18 -0.61 0.37 0.00 0.00 175.52 175.17 2jwl h GLN 52 N -0.30 -0.12 -0.16 6.66 4.15 -1.07 0.78 115.11 125.06 2jwl h GLN 52 Ca -0.01 0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.40 2jwl h GLN 52 Cb 0.26 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.98 2jwl h GLN 52 CO 0.02 -0.08 0.02 -0.07 -1.93 0.00 0.00 178.83 176.79 2jwl h LEU 53 N -0.12 0.25 -0.71 -2.39 3.38 -1.27 -1.30 115.31 113.15 2jwl h LEU 53 Ca 0.18 -0.27 0.04 0.00 0.09 0.00 0.00 57.88 57.92 2jwl h LEU 53 Cb 0.40 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.04 2jwl h LEU 53 CO -0.44 0.46 0.44 0.28 0.09 0.00 0.00 178.44 179.27 2jwl h SER 54 N 0.04 0.71 -0.37 -0.43 0.02 -0.68 -0.79 113.55 112.04 2jwl h SER 54 Ca 0.05 0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 60.94 2jwl h SER 54 Cb 0.32 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 2jwl h SER 54 CO 0.00 0.48 -0.03 -0.09 -1.14 0.00 0.00 176.83 176.06 2jwl h ARG 55 N 0.84 0.68 -0.59 3.45 1.12 -0.80 -2.09 114.38 116.99 2jwl h ARG 55 Ca 0.29 -0.23 -0.08 0.00 -1.11 0.00 0.00 59.98 58.86 2jwl h ARG 55 Cb 0.06 -0.05 -0.02 0.00 -0.01 0.00 0.00 29.97 29.94 2jwl h ARG 55 CO -0.13 0.80 0.07 0.37 -3.11 0.00 0.00 179.97 177.97 2jwl h GLN 56 N 0.49 0.97 -0.28 0.20 4.15 -0.89 -1.70 115.11 118.06 2jwl h GLN 56 Ca 0.10 -0.26 -0.15 0.00 0.77 0.00 0.00 58.65 59.12 2jwl h GLN 56 Cb 0.51 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 28.08 2jwl h GLN 56 CO 0.03 0.91 -0.43 0.93 -1.93 0.00 0.00 178.83 178.33 2jwl h GLU 57 N 0.91 0.70 -0.04 1.69 3.07 -1.09 -2.77 114.58 117.05 2jwl h GLU 57 Ca 0.18 -0.38 -0.14 0.00 -0.50 0.00 0.00 59.36 58.52 2jwl h GLU 57 Cb 0.44 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.35 2jwl h GLU 57 CO 0.01 1.00 -0.59 0.35 -1.40 0.00 0.00 179.01 178.38 2jwl h PHE 58 N 0.57 0.18 0.00 4.33 3.57 -1.19 -1.69 116.94 122.70 2jwl h PHE 58 Ca 0.04 -0.07 -0.10 0.00 3.53 0.00 0.00 57.97 61.37 2jwl h PHE 58 Cb 0.98 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.67 2jwl h PHE 58 CO 0.05 0.70 -0.47 0.22 -2.23 0.00 0.00 178.31 176.58 2jwl h ASP 59 N 0.10 0.00 0.49 0.41 3.58 -1.24 -3.18 116.42 116.58 2jwl h ASP 59 Ca -0.01 0.00 -0.30 0.00 0.42 0.00 0.00 57.03 57.15 2jwl h ASP 59 Cb 1.08 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.12 2jwl h ASP 59 CO 0.09 0.47 -1.49 0.50 -2.88 0.00 0.00 179.24 175.92 2jwl h LYS 60 N 0.00 0.23 -4.24 0.28 3.64 -1.39 -3.44 116.57 111.65 2jwl h LYS 60 Ca -0.00 -0.39 -0.56 0.00 -1.27 0.00 0.00 60.65 58.43 2jwl h LYS 60 Cb 1.07 0.15 -0.37 0.00 -0.41 0.00 0.00 32.23 32.66 2jwl h LYS 60 CO 0.06 1.09 -0.80 -0.51 -2.27 0.00 0.00 179.45 177.02 2jwl s ASP 61 N -6.94 2.81 0.30 4.20 1.11 -0.65 -5.01 116.67 112.49 2jwl s ASP 61 Ca -0.08 -0.64 0.23 0.00 0.18 0.00 0.00 52.55 52.24 2jwl s ASP 61 Cb 0.07 -0.95 0.15 0.00 1.07 0.00 0.00 42.92 43.26 2jwl s ASP 61 CO 0.85 -0.17 1.29 0.78 1.18 0.00 0.00 175.17 179.11 2jwl h ASN 62 N 8.11 0.00 -0.56 0.27 4.21 -1.85 -3.32 115.58 122.44 2jwl h ASN 62 Ca -0.26 -0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.25 2jwl h ASN 62 Cb 1.11 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.31 2jwl h ASN 62 CO 0.42 0.00 0.00 -3.20 -1.29 0.00 0.00 177.43 173.36 2jwl n ASN 63 N -2.84 5.58 -4.64 5.81 5.15 -1.26 -4.96 115.26 118.09 2jwl n ASN 63 Ca 0.02 -2.92 -0.43 0.00 -0.60 0.00 0.00 54.58 50.65 2jwl n ASN 63 Cb 0.54 -0.67 -0.03 0.00 -0.53 0.00 0.00 39.78 39.09 2jwl n ASN 63 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2jwl s THR 64 N -2.74 3.76 -0.03 -0.44 -4.23 -1.25 -4.96 115.64 105.76 2jwl s THR 64 Ca 0.54 0.89 -0.30 0.00 -1.18 0.00 0.00 61.69 61.64 2jwl s THR 64 Cb 0.41 -3.68 -0.06 0.00 1.34 0.00 0.00 72.50 70.51 2jwl s THR 64 CO 0.16 -0.19 1.67 -0.22 -0.54 0.00 0.00 174.62 175.50 2jwl s LEU 65 N 4.52 4.34 -0.21 4.79 2.96 -1.26 -4.89 118.68 128.92 2jwl s LEU 65 Ca 0.69 2.30 -0.07 0.00 -0.22 0.00 0.00 54.13 56.83 2jwl s LEU 65 Cb -0.27 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.85 2jwl s LEU 65 CO 0.27 -0.93 0.07 -0.36 -1.32 0.00 0.00 176.35 174.08 2jwl s PHE 66 N 3.87 3.16 -0.01 5.38 0.08 -1.26 -1.41 117.98 127.79 2jwl s PHE 66 Ca 0.75 -0.15 0.02 0.00 0.12 0.00 0.00 56.93 57.67 2jwl s PHE 66 Cb -0.35 -2.16 -0.00 0.00 -0.57 0.00 0.00 43.02 39.94 2jwl s PHE 66 CO 0.31 -0.09 -0.08 -0.48 -0.10 0.00 0.00 175.22 174.78 2jwl s LEU 67 N 0.97 1.95 -0.04 -0.37 0.05 -0.89 -5.02 118.68 115.33 2jwl s LEU 67 Ca 0.04 -0.14 0.05 0.00 0.05 0.00 0.00 54.13 54.12 2jwl s LEU 67 Cb -0.14 -0.42 -0.01 0.00 -2.05 0.00 0.00 46.19 43.58 2jwl s LEU 67 CO 0.03 0.08 -0.17 0.54 -0.55 0.00 0.00 176.35 176.28 2jwl s VAL 68 N -0.09 1.45 0.02 1.48 0.11 -1.26 -1.67 120.40 120.44 2jwl s VAL 68 Ca 0.02 -0.73 0.01 0.00 -2.93 0.00 0.00 61.98 58.35 2jwl s VAL 68 Cb -0.04 -1.23 -0.02 0.00 -1.53 0.00 0.00 36.38 33.56 2jwl s VAL 68 CO -0.00 0.41 -0.06 -0.83 -3.33 0.00 0.00 175.10 171.30 2jwl s GLY 69 N -0.05 0.36 0.19 6.54 0.00 -0.27 -4.99 107.32 109.10 2jwl s GLY 69 Ca -0.02 -0.53 0.11 0.00 0.00 0.00 0.00 44.72 44.27 2jwl s GLY 69 CO 0.02 -0.56 -0.22 -0.32 0.00 0.00 0.00 173.10 172.01 2jwl s GLY 70 N -1.05 1.62 0.72 0.20 0.00 -1.26 -0.59 107.32 106.96 2jwl s GLY 70 Ca -0.07 -1.60 -0.11 0.00 0.00 0.00 0.00 44.72 42.94 2jwl s GLY 70 CO -0.00 -1.63 1.10 0.00 0.00 0.00 0.00 173.10 172.57 2jwl s ALA 71 N -1.76 2.85 0.49 3.20 0.00 -0.93 -4.93 121.76 120.68 2jwl s ALA 71 Ca 0.19 -0.36 0.18 0.00 0.00 0.00 0.00 51.96 51.97 2jwl s ALA 71 Cb -0.07 -3.02 1.24 0.00 0.00 0.00 0.00 23.12 21.26 2jwl s ALA 71 CO 0.09 -1.21 2.09 0.87 0.00 0.00 0.00 175.76 177.60 2jwl h LYS 72 N -0.71 0.00 -0.01 0.00 6.56 -1.97 -2.36 116.57 118.08 2jwl h LYS 72 Ca -0.45 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.14 2jwl h LYS 72 Cb 1.26 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.92 2jwl h LYS 72 CO 0.64 0.09 -0.09 0.39 -2.06 0.00 0.00 179.45 178.42 2jwl n GLU 73 N -4.28 1.00 -3.31 3.15 4.71 -1.26 -4.88 120.64 115.77 2jwl n GLU 73 Ca -0.03 -0.43 -0.38 0.00 -0.01 0.00 0.00 57.16 56.31 2jwl n GLU 73 Cb 0.17 -1.49 -0.06 0.00 -1.01 0.00 0.00 31.44 29.05 2jwl n GLU 73 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 2jwl s VAL 74 N -2.29 4.96 0.37 2.62 0.11 -0.89 -5.02 120.40 120.26 2jwl s VAL 74 Ca 0.33 1.09 -0.27 0.00 -2.93 0.00 0.00 61.98 60.20 2jwl s VAL 74 Cb 0.20 -3.85 -0.09 0.00 -1.53 0.00 0.00 36.38 31.11 2jwl s VAL 74 CO 0.43 0.46 1.23 -2.16 -3.33 0.00 0.00 175.10 171.73 2jwl s PRO 75 N -0.40 4.16 0.30 1.54 0.04 -1.26 -4.89 135.00 134.49 2jwl s PRO 75 Ca 0.28 2.01 -0.02 0.00 0.04 0.00 0.00 61.00 63.31 2jwl s PRO 75 Cb -0.17 -2.84 0.45 0.00 0.04 0.00 0.00 34.50 31.97 2jwl s PRO 75 CO 0.15 -0.28 1.97 -0.92 0.04 0.00 0.00 177.00 177.96 2jwl h TYR 76 N 2.94 1.03 -0.47 0.56 3.20 -1.97 -1.78 116.97 120.49 2jwl h TYR 76 Ca -0.49 0.02 0.11 0.00 3.14 0.00 0.00 58.73 61.52 2jwl h TYR 76 Cb 1.23 -0.35 -0.02 0.00 1.54 0.00 0.00 36.73 39.13 2jwl h TYR 76 CO 0.55 0.65 0.33 0.93 -1.64 0.00 0.00 178.16 178.98 2jwl h GLU 77 N 1.11 0.12 0.01 1.82 5.08 -2.00 0.24 114.58 120.95 2jwl h GLU 77 Ca 0.30 -0.01 -0.19 0.00 -1.00 0.00 0.00 59.36 58.47 2jwl h GLU 77 Cb -0.13 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 2jwl h GLU 77 CO -0.07 0.08 -0.87 1.49 -1.00 0.00 0.00 179.01 178.65 2jwl h GLU 78 N 0.12 0.08 -0.65 2.33 4.57 -1.70 -2.44 114.58 116.89 2jwl h GLU 78 Ca 0.22 -0.09 -0.08 0.00 -1.18 0.00 0.00 59.36 58.23 2jwl h GLU 78 Cb 0.72 0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 29.32 2jwl h GLU 78 CO -0.03 0.89 0.08 0.28 -1.18 0.00 0.00 179.01 179.06 2jwl h VAL 79 N 0.04 1.26 -0.42 0.32 2.07 -0.88 -0.78 116.25 117.86 2jwl h VAL 79 Ca -0.03 -1.07 -0.00 0.00 0.82 0.00 0.00 66.70 66.42 2jwl h VAL 79 Cb 1.51 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.94 2jwl h VAL 79 CO 0.12 0.40 0.24 0.40 0.02 0.00 0.00 177.57 178.75 2jwl h ILE 80 N 1.01 1.14 -0.60 4.57 1.08 -1.26 -1.29 117.51 122.16 2jwl h ILE 80 Ca 0.19 -0.34 0.06 0.00 -0.39 0.00 0.00 64.86 64.39 2jwl h ILE 80 Cb 0.47 0.61 -0.06 0.00 -3.07 0.00 0.00 36.82 34.78 2jwl h ILE 80 CO 0.02 0.15 0.30 0.11 -0.69 0.00 0.00 178.15 178.03 2jwl h LYS 81 N 0.55 0.54 -0.29 2.37 1.79 -1.03 0.13 116.57 120.63 2jwl h LYS 81 Ca 0.15 -0.03 0.01 0.00 -2.18 0.00 0.00 60.65 58.60 2jwl h LYS 81 Cb 0.02 -0.12 -0.02 0.00 -1.58 0.00 0.00 32.23 30.53 2jwl h LYS 81 CO -0.03 0.36 0.16 0.00 -1.08 0.00 0.00 179.45 178.87 2jwl h ALA 82 N 1.34 0.36 -0.80 3.86 0.00 -0.63 -0.30 119.26 123.10 2jwl h ALA 82 Ca 0.28 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2jwl h ALA 82 Cb 0.22 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 2jwl h ALA 82 CO -0.20 -0.21 0.51 -0.07 0.00 0.00 0.00 179.25 179.28 2jwl h LEU 83 N 0.34 0.93 -0.70 0.00 3.38 -0.65 -1.84 115.31 116.77 2jwl h LEU 83 Ca 0.12 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 2jwl h LEU 83 Cb 0.01 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 2jwl h LEU 83 CO -0.06 0.69 0.43 -1.13 0.09 0.00 0.00 178.44 178.46 2jwl h ASN 84 N 1.09 0.84 -0.57 -0.43 -0.73 0.23 -1.63 115.58 114.38 2jwl h ASN 84 Ca 0.29 -0.05 -0.09 0.00 1.87 0.00 0.00 56.30 58.32 2jwl h ASN 84 Cb -0.10 -0.21 -0.02 0.00 0.27 0.00 0.00 38.32 38.26 2jwl h ASN 84 CO -0.06 0.64 0.03 -0.07 -0.37 0.00 0.00 177.43 177.60 2jwl h LEU 85 N 0.96 0.99 -0.58 0.34 3.38 -0.29 -1.16 115.31 118.94 2jwl h LEU 85 Ca 0.25 -0.26 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 2jwl h LEU 85 Cb -0.05 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.41 2jwl h LEU 85 CO -0.05 1.03 0.16 -0.07 0.09 0.00 0.00 178.44 179.60 2jwl h LEU 86 N 0.94 0.87 -0.79 1.67 -0.00 -1.10 -2.28 115.31 114.62 2jwl h LEU 86 Ca 0.17 -0.22 -0.05 0.00 -0.00 0.00 0.00 57.88 57.78 2jwl h LEU 86 Cb 0.51 -0.23 -0.03 0.00 -0.00 0.00 0.00 40.66 40.91 2jwl h LEU 86 CO 0.02 0.86 0.26 -0.74 -0.00 0.00 0.00 178.44 178.84 2jwl h HIS 87 N 0.83 1.20 -0.92 1.13 2.76 -1.07 0.13 115.15 119.22 2jwl h HIS 87 Ca 0.19 -0.11 0.04 0.00 -2.20 0.00 0.00 60.37 58.28 2jwl h HIS 87 Cb 0.32 -0.35 -0.05 0.00 1.55 0.00 0.00 27.41 28.87 2jwl h HIS 87 CO 0.02 0.93 0.60 1.25 -1.30 0.00 0.00 177.93 179.43 2jwl h LEU 88 N 1.12 0.98 -1.29 0.26 6.46 -0.81 -1.08 115.31 120.96 2jwl h LEU 88 Ca 0.25 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 58.00 2jwl h LEU 88 Cb 0.28 -0.22 0.00 0.00 -0.73 0.00 0.00 40.66 39.98 2jwl h LEU 88 CO -0.01 0.67 0.00 0.00 -0.62 0.00 0.00 178.44 178.48 2jwl n ALA 89 N -2.39 2.46 -3.16 1.25 0.00 -0.89 -4.93 120.51 112.84 2jwl n ALA 89 Ca 0.12 -0.61 -0.15 0.00 0.00 0.00 0.00 53.44 52.80 2jwl n ALA 89 Cb 0.11 -0.99 0.06 0.00 0.00 0.00 0.00 19.45 18.63 2jwl n ALA 89 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jwl n GLY 90 N 1.08 -0.11 0.11 0.00 0.00 -0.41 -4.87 105.19 101.01 2jwl n GLY 90 Ca 0.13 -0.04 -0.15 0.00 0.00 0.00 0.00 46.02 45.96 2jwl n GLY 90 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2jwl n ILE 91 N -3.81 1.58 -1.35 -0.61 -0.00 0.41 -5.01 119.36 110.58 2jwl n ILE 91 Ca -0.08 -0.72 0.00 0.00 -0.00 0.00 0.00 62.75 61.95 2jwl n ILE 91 Cb 0.57 -1.19 0.00 0.00 -0.00 0.00 0.00 39.64 39.03 2jwl n ILE 91 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.55 177.72