#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 -3.50 1.61 7.64 -1.26 -4.99 113.62 113.12 2jwl n SER 20 Ca 0.00 0.32 -0.07 0.00 1.01 0.00 0.00 58.87 60.13 2jwl n SER 20 Cb 0.00 -0.36 -0.08 0.00 -1.01 0.00 0.00 64.21 62.76 2jwl n SER 20 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2jwl s VAL 21 N -0.73 -0.70 0.04 0.44 1.01 -1.26 -5.00 120.40 114.21 2jwl s VAL 21 Ca 0.00 0.05 -0.00 0.00 0.00 0.00 0.00 61.98 62.03 2jwl s VAL 21 Cb 0.00 -0.78 0.01 0.00 0.00 0.00 0.00 36.38 35.61 2jwl s VAL 21 CO 0.00 -0.01 0.02 -2.65 0.00 0.00 0.00 175.10 172.46 2jwl n PRO 22 N 5.39 0.43 -3.77 2.72 -0.02 -1.26 -2.89 135.00 135.60 2jwl n PRO 22 Ca -0.06 -0.03 -0.36 0.00 -2.02 0.00 0.00 63.50 61.03 2jwl n PRO 22 Cb 0.50 -0.06 -0.12 0.00 -0.02 0.00 0.00 33.50 33.79 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 -0.46 4.32 -0.12 -1.45 1.01 -0.22 -3.06 120.40 120.42 2jwl s VAL 23 Ca 0.01 -0.17 0.02 0.00 0.00 0.00 0.00 61.98 61.84 2jwl s VAL 23 Cb -0.00 -3.02 -0.00 0.00 0.00 0.00 0.00 36.38 33.36 2jwl s VAL 23 CO 0.01 0.34 -0.19 -0.63 0.00 0.00 0.00 175.10 174.63 2jwl s ILE 24 N 1.58 2.44 -0.16 2.22 1.09 -0.04 -2.16 121.20 126.17 2jwl s ILE 24 Ca 0.06 -0.88 0.00 0.00 -1.10 0.00 0.00 60.65 58.74 2jwl s ILE 24 Cb -0.15 -1.98 -0.00 0.00 -1.06 0.00 0.00 42.46 39.27 2jwl s ILE 24 CO 0.04 0.54 -0.15 -0.22 -0.10 0.00 0.00 174.94 175.04 2jwl s LEU 25 N 0.43 2.46 -0.11 2.97 0.20 -0.65 -0.01 118.68 123.97 2jwl s LEU 25 Ca -0.14 -0.48 0.02 0.00 0.69 0.00 0.00 54.13 54.22 2jwl s LEU 25 Cb -0.17 -1.56 -0.01 0.00 -0.43 0.00 0.00 46.19 44.02 2jwl s LEU 25 CO 0.06 0.08 -0.19 -1.61 -0.29 0.00 0.00 176.35 174.40 2jwl s GLU 26 N 0.86 3.12 -0.53 1.98 0.41 0.10 -1.78 118.70 122.87 2jwl s GLU 26 Ca -0.04 -0.78 -0.23 0.00 -0.41 0.00 0.00 54.97 53.50 2jwl s GLU 26 Cb -0.15 -2.44 0.04 0.00 -1.78 0.00 0.00 34.13 29.80 2jwl s GLU 26 CO -0.01 0.24 0.86 0.08 -0.49 0.00 0.00 175.26 175.94 2jwl s VAL 27 N 0.22 4.52 -0.29 2.63 1.01 -0.09 -1.13 120.40 127.28 2jwl s VAL 27 Ca -0.12 0.16 0.21 0.00 0.00 0.00 0.00 61.98 62.23 2jwl s VAL 27 Cb -0.16 -4.46 0.11 0.00 0.00 0.00 0.00 36.38 31.87 2jwl s VAL 27 CO 0.06 -0.99 1.25 0.00 0.00 0.00 0.00 175.10 175.43 2jwl h ALA 28 N 9.20 0.70 -3.00 5.51 0.00 -1.69 -2.64 119.26 127.34 2jwl h ALA 28 Ca -0.26 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2jwl h ALA 28 Cb 1.08 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2jwl h ALA 28 CO 1.04 0.15 0.00 0.41 0.00 0.00 0.00 179.25 180.85 2jwl n GLY 29 N 1.18 0.04 3.02 0.00 0.00 -1.21 -4.89 105.19 103.34 2jwl n GLY 29 Ca 0.01 0.53 -0.33 0.00 0.00 0.00 0.00 46.02 46.23 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 2.78 3.33 0.00 -0.61 -1.09 -1.26 -4.63 121.20 119.72 2jwl s ILE 30 Ca 0.00 -3.38 0.00 0.00 -2.23 0.00 0.00 60.65 55.04 2jwl s ILE 30 Cb 0.00 -3.19 0.00 0.00 -1.58 0.00 0.00 42.46 37.69 2jwl s ILE 30 CO 0.00 -0.90 0.00 0.61 -1.23 0.00 0.00 174.94 173.42 2jwl n GLY 31 N 3.00 0.23 3.61 6.18 0.00 -1.26 -5.07 105.19 111.89 2jwl n GLY 31 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.98 3.46 0.04 1.61 3.01 -1.26 -4.22 119.74 121.40 2jwl s LYS 32 Ca 0.00 -0.42 -0.00 0.00 -1.01 0.00 0.00 55.97 54.53 2jwl s LYS 32 Cb 0.00 -2.94 -0.03 0.00 -1.01 0.00 0.00 37.83 33.85 2jwl s LYS 32 CO 0.00 0.45 -0.03 0.71 0.51 0.00 0.00 175.35 176.99 2jwl s TYR 33 N -0.17 0.47 0.01 3.18 1.51 -0.84 -1.82 117.35 119.69 2jwl s TYR 33 Ca 0.05 -0.88 0.06 0.00 -1.01 0.00 0.00 57.07 55.30 2jwl s TYR 33 Cb -0.12 -0.34 -0.02 0.00 -0.11 0.00 0.00 41.96 41.37 2jwl s TYR 33 CO 0.02 -0.30 -0.20 0.00 -1.11 0.00 0.00 175.55 173.96 2jwl s ALA 34 N -3.08 1.65 -0.03 3.71 0.00 -0.29 -1.54 121.76 122.17 2jwl s ALA 34 Ca -0.00 -0.91 0.02 0.00 0.00 0.00 0.00 51.96 51.07 2jwl s ALA 34 Cb 0.02 -0.38 0.01 0.00 0.00 0.00 0.00 23.12 22.77 2jwl s ALA 34 CO -0.07 0.39 -0.08 0.96 0.00 0.00 0.00 175.76 176.96 2jwl s ILE 35 N -0.59 0.77 -0.28 0.00 -4.36 -0.04 0.02 121.20 116.71 2jwl s ILE 35 Ca 0.07 -0.33 -0.05 0.00 -0.26 0.00 0.00 60.65 60.09 2jwl s ILE 35 Cb -0.08 -0.70 0.02 0.00 1.25 0.00 0.00 42.46 42.95 2jwl s ILE 35 CO 0.00 0.25 0.03 -0.55 0.24 0.00 0.00 174.94 174.91 2jwl s SER 36 N 0.37 4.87 -0.35 4.36 0.15 0.99 -0.01 113.70 124.08 2jwl s SER 36 Ca -0.06 -0.85 -0.05 0.00 0.70 0.00 0.00 55.95 55.69 2jwl s SER 36 Cb -0.10 -1.80 0.05 0.00 -1.71 0.00 0.00 66.02 62.46 2jwl s SER 36 CO 0.01 -0.19 0.11 -0.63 1.20 0.00 0.00 173.24 173.74 2jwl s ILE 37 N 1.41 3.62 -1.49 6.45 1.01 0.19 -0.86 121.20 131.54 2jwl s ILE 37 Ca 0.01 -1.30 -0.04 0.00 0.00 0.00 0.00 60.65 59.32 2jwl s ILE 37 Cb -0.17 -3.11 0.03 0.00 0.01 0.00 0.00 42.46 39.22 2jwl s ILE 37 CO -0.00 -0.24 0.43 0.61 0.00 0.00 0.00 174.94 175.74 2jwl n GLY 38 N 4.76 -0.25 0.99 6.18 0.00 -1.14 -1.05 105.19 114.68 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 -1.95 3.11 3.71 -0.02 0.00 -1.26 -4.82 105.19 103.95 2jwl n GLY 39 Ca -0.23 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.40 2jwl n GLY 39 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jwl s GLU 40 N -0.35 4.33 -0.16 1.61 2.02 -0.21 -5.06 118.70 120.88 2jwl s GLU 40 Ca 0.00 0.55 -0.06 0.00 0.02 0.00 0.00 54.97 55.49 2jwl s GLU 40 Cb 0.00 -3.47 -0.04 0.00 0.10 0.00 0.00 34.13 30.72 2jwl s GLU 40 CO 0.00 0.06 0.04 0.50 0.02 0.00 0.00 175.26 175.87 2jwl s ARG 41 N 0.93 3.76 -0.13 1.61 3.00 -1.26 0.57 118.95 127.43 2jwl s ARG 41 Ca 0.28 -0.38 0.02 0.00 -1.00 0.00 0.00 55.73 54.66 2jwl s ARG 41 Cb -0.16 -3.09 -0.00 0.00 0.00 0.00 0.00 34.95 31.70 2jwl s ARG 41 CO 0.12 0.35 -0.20 -0.65 0.00 0.00 0.00 175.30 174.92 2jwl s GLN 42 N 0.12 3.13 0.20 5.12 -0.21 0.99 -4.98 119.66 124.03 2jwl s GLN 42 Ca 0.03 -0.82 0.10 0.00 0.02 0.00 0.00 55.36 54.70 2jwl s GLN 42 Cb -0.13 -2.45 -0.04 0.00 1.00 0.00 0.00 33.01 31.39 2jwl s GLN 42 CO 0.01 0.10 -0.17 -2.00 -2.12 0.00 0.00 175.29 171.12 2jwl s GLU 43 N 0.56 1.79 0.00 2.91 2.12 -1.26 -0.86 118.70 123.96 2jwl s GLU 43 Ca -0.12 -1.45 0.00 0.00 0.36 0.00 0.00 54.97 53.76 2jwl s GLU 43 Cb -0.17 -1.98 0.00 0.00 0.26 0.00 0.00 34.13 32.25 2jwl s GLU 43 CO 0.04 0.40 0.00 0.41 -0.54 0.00 0.00 175.26 175.57 2jwl n GLY 44 N 0.01 0.49 3.84 -1.50 0.00 -1.22 -5.03 105.19 101.78 2jwl n GLY 44 Ca -0.11 -0.87 -0.33 0.00 0.00 0.00 0.00 46.02 44.71 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 4.17 0.59 0.99 1.43 -0.59 -4.92 118.68 120.35 2jwl s LEU 45 Ca 0.00 1.24 -0.00 0.00 -1.03 0.00 0.00 54.13 54.33 2jwl s LEU 45 Cb 0.00 -3.83 0.05 0.00 0.03 0.00 0.00 46.19 42.44 2jwl s LEU 45 CO 0.00 -0.10 0.84 0.42 0.23 0.00 0.00 176.35 177.74 2jwl s THR 46 N -1.80 2.55 0.10 5.49 -4.23 -1.26 -1.98 115.64 114.50 2jwl s THR 46 Ca 0.49 -0.58 -0.17 0.00 -1.18 0.00 0.00 61.69 60.24 2jwl s THR 46 Cb -0.12 -2.97 -0.07 0.00 1.34 0.00 0.00 72.50 70.68 2jwl s THR 46 CO 0.19 0.00 1.52 -0.08 -0.54 0.00 0.00 174.62 175.71 2jwl h GLU 47 N -0.10 0.53 -0.62 3.99 4.81 -1.99 0.90 114.58 122.10 2jwl h GLU 47 Ca -0.42 -0.18 -0.06 0.00 -0.13 0.00 0.00 59.36 58.57 2jwl h GLU 47 Cb 1.30 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.61 2jwl h GLU 47 CO 0.53 0.69 0.16 1.49 -0.73 0.00 0.00 179.01 181.15 2jwl h GLU 48 N 0.31 0.96 -0.18 1.92 4.81 -1.96 -2.26 114.58 118.19 2jwl h GLU 48 Ca 0.08 -0.21 -0.19 0.00 -0.13 0.00 0.00 59.36 58.91 2jwl h GLU 48 Cb 0.47 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.71 2jwl h GLU 48 CO 0.02 0.85 -0.66 1.98 -0.73 0.00 0.00 179.01 180.47 2jwl h MET 49 N 0.92 0.67 -0.46 1.92 4.05 -1.93 -2.63 114.93 117.48 2jwl h MET 49 Ca 0.20 -0.49 -0.03 0.00 -0.28 0.00 0.00 59.70 59.10 2jwl h MET 49 Cb 0.32 0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 31.18 2jwl h MET 49 CO -0.00 1.11 0.17 -0.24 0.23 0.00 0.00 176.91 178.18 2jwl h VAL 50 N 0.49 1.18 0.09 -5.77 3.04 -0.59 -1.92 116.25 112.77 2jwl h VAL 50 Ca -0.02 -0.58 -0.00 0.00 -1.01 0.00 0.00 66.70 65.09 2jwl h VAL 50 Cb 1.25 0.65 0.00 0.00 -2.01 0.00 0.00 31.29 31.18 2jwl h VAL 50 CO 0.13 0.22 -0.04 0.74 -1.01 0.00 0.00 177.57 177.61 2jwl h THR 51 N 0.66 1.04 -0.39 3.17 2.02 -1.32 -0.67 112.91 117.44 2jwl h THR 51 Ca 0.16 -0.50 0.08 0.00 0.77 0.00 0.00 66.41 66.92 2jwl h THR 51 Cb 0.16 1.37 -0.08 0.00 -1.74 0.00 0.00 68.15 67.85 2jwl h THR 51 CO -0.01 0.12 -0.18 -0.61 0.37 0.00 0.00 175.52 175.21 2jwl h GLN 52 N -0.35 -0.10 -0.24 6.66 4.15 -1.11 0.67 115.11 124.78 2jwl h GLN 52 Ca -0.01 0.01 -0.03 0.00 0.77 0.00 0.00 58.65 59.39 2jwl h GLN 52 Cb 0.30 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.00 2jwl h GLN 52 CO 0.02 -0.07 0.04 -0.07 -1.93 0.00 0.00 178.83 176.82 2jwl h LEU 53 N -0.11 0.39 -0.73 -2.39 3.38 -1.34 -1.57 115.31 112.94 2jwl h LEU 53 Ca 0.19 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 57.92 2jwl h LEU 53 Cb 0.40 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.01 2jwl h LEU 53 CO -0.46 0.55 0.47 0.28 0.09 0.00 0.00 178.44 179.37 2jwl h SER 54 N 0.21 0.79 -0.39 -0.43 0.02 -0.66 -1.09 113.55 112.00 2jwl h SER 54 Ca 0.07 -0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 60.95 2jwl h SER 54 Cb 0.33 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.67 2jwl h SER 54 CO 0.00 0.55 -0.01 -0.09 -1.14 0.00 0.00 176.83 176.15 2jwl h ARG 55 N 0.93 0.69 -0.54 3.45 1.12 -0.81 -1.98 114.38 117.23 2jwl h ARG 55 Ca 0.28 -0.22 -0.08 0.00 -1.11 0.00 0.00 59.98 58.84 2jwl h ARG 55 Cb -0.03 -0.06 -0.02 0.00 -0.01 0.00 0.00 29.97 29.84 2jwl h ARG 55 CO -0.09 0.79 0.01 0.37 -3.11 0.00 0.00 179.97 177.94 2jwl h GLN 56 N 0.51 0.93 -0.22 0.20 4.15 -1.00 -1.66 115.11 118.02 2jwl h GLN 56 Ca 0.11 -0.27 -0.15 0.00 0.77 0.00 0.00 58.65 59.11 2jwl h GLN 56 Cb 0.48 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.07 2jwl h GLN 56 CO 0.02 0.91 -0.49 0.93 -1.93 0.00 0.00 178.83 178.28 2jwl h GLU 57 N 0.86 0.59 -0.04 1.69 3.07 -1.14 -2.87 114.58 116.74 2jwl h GLU 57 Ca 0.16 -0.34 -0.15 0.00 -0.50 0.00 0.00 59.36 58.53 2jwl h GLU 57 Cb 0.50 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.42 2jwl h GLU 57 CO 0.02 0.94 -0.65 0.35 -1.40 0.00 0.00 179.01 178.28 2jwl h PHE 58 N 0.47 0.22 0.00 4.33 3.57 -1.17 -1.80 116.94 122.56 2jwl h PHE 58 Ca 0.02 -0.09 -0.07 0.00 3.53 0.00 0.00 57.97 61.36 2jwl h PHE 58 Cb 1.02 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.71 2jwl h PHE 58 CO 0.04 0.77 -0.35 0.22 -2.23 0.00 0.00 178.31 176.76 2jwl h ASP 59 N 0.12 0.00 0.32 0.41 3.58 -1.24 -3.18 116.42 116.43 2jwl h ASP 59 Ca -0.01 0.00 -0.33 0.00 0.42 0.00 0.00 57.03 57.11 2jwl h ASP 59 Cb 1.17 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.22 2jwl h ASP 59 CO 0.10 0.35 -1.64 0.50 -2.88 0.00 0.00 179.24 175.67 2jwl h LYS 60 N 0.00 0.33 -4.47 0.28 3.64 -1.41 -3.45 116.57 111.50 2jwl h LYS 60 Ca -0.00 -0.57 -0.56 0.00 -1.27 0.00 0.00 60.65 58.25 2jwl h LYS 60 Cb 0.92 0.21 -0.36 0.00 -0.41 0.00 0.00 32.23 32.59 2jwl h LYS 60 CO 0.05 1.22 -0.82 -0.51 -2.27 0.00 0.00 179.45 177.12 2jwl s ASP 61 N -7.15 2.40 0.11 4.20 1.11 -0.69 -5.02 116.67 111.63 2jwl s ASP 61 Ca -0.12 -0.39 0.24 0.00 0.18 0.00 0.00 52.55 52.45 2jwl s ASP 61 Cb 0.06 -1.00 0.25 0.00 1.07 0.00 0.00 42.92 43.30 2jwl s ASP 61 CO 0.86 -0.08 1.23 0.78 1.18 0.00 0.00 175.17 179.15 2jwl h ASN 62 N 8.02 0.00 -0.45 0.27 4.21 -1.86 -3.35 115.58 122.41 2jwl h ASN 62 Ca -0.34 -0.24 -0.01 0.00 1.21 0.00 0.00 56.30 56.93 2jwl h ASN 62 Cb 1.14 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 38.34 2jwl h ASN 62 CO 0.47 0.12 0.01 -0.46 -1.29 0.00 0.00 177.43 176.27 2jwl n ASN 63 N -2.11 5.00 -4.64 5.81 6.94 -1.26 -4.98 115.26 120.02 2jwl n ASN 63 Ca 0.03 -2.98 -0.43 0.00 -0.02 0.00 0.00 54.58 51.18 2jwl n ASN 63 Cb 0.45 -0.63 -0.03 0.00 -2.36 0.00 0.00 39.78 37.21 2jwl n ASN 63 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 2jwl s THR 64 N -2.81 3.67 -0.02 5.53 -4.23 -1.26 -4.96 115.64 111.57 2jwl s THR 64 Ca 0.50 0.77 -0.30 0.00 -1.18 0.00 0.00 61.69 61.48 2jwl s THR 64 Cb 0.39 -3.62 -0.06 0.00 1.34 0.00 0.00 72.50 70.55 2jwl s THR 64 CO 0.13 -0.20 1.63 -0.22 -0.54 0.00 0.00 174.62 175.42 2jwl s LEU 65 N 4.83 4.33 -0.17 4.79 2.96 -1.26 -4.88 118.68 129.28 2jwl s LEU 65 Ca 0.72 2.29 -0.05 0.00 -0.22 0.00 0.00 54.13 56.87 2jwl s LEU 65 Cb -0.28 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 42.84 2jwl s LEU 65 CO 0.29 -0.90 0.00 -0.36 -1.32 0.00 0.00 176.35 174.06 2jwl s PHE 66 N 3.54 3.09 -0.00 5.38 0.08 -1.26 -1.05 117.98 127.76 2jwl s PHE 66 Ca 0.73 -0.23 0.02 0.00 0.12 0.00 0.00 56.93 57.56 2jwl s PHE 66 Cb -0.35 -2.02 -0.01 0.00 -0.57 0.00 0.00 43.02 40.07 2jwl s PHE 66 CO 0.30 -0.03 -0.06 -0.48 -0.10 0.00 0.00 175.22 174.85 2jwl s LEU 67 N 0.53 2.02 -0.09 -0.37 0.05 -0.92 -5.02 118.68 114.89 2jwl s LEU 67 Ca -0.01 -0.12 0.03 0.00 0.05 0.00 0.00 54.13 54.08 2jwl s LEU 67 Cb -0.14 -0.29 0.00 0.00 -2.05 0.00 0.00 46.19 43.71 2jwl s LEU 67 CO 0.02 0.06 -0.20 -0.69 -0.55 0.00 0.00 176.35 174.99 2jwl s VAL 68 N -0.18 1.74 0.02 1.48 1.01 -1.26 -1.64 120.40 121.56 2jwl s VAL 68 Ca 0.02 -0.84 0.01 0.00 0.00 0.00 0.00 61.98 61.17 2jwl s VAL 68 Cb -0.03 -1.52 -0.01 0.00 0.00 0.00 0.00 36.38 34.82 2jwl s VAL 68 CO -0.00 0.49 -0.05 -0.83 0.00 0.00 0.00 175.10 174.71 2jwl s GLY 69 N 0.44 0.30 0.22 4.51 0.00 -0.73 -5.01 107.32 107.03 2jwl s GLY 69 Ca -0.17 -0.48 0.10 0.00 0.00 0.00 0.00 44.72 44.18 2jwl s GLY 69 CO 0.07 -0.51 -0.20 -0.32 0.00 0.00 0.00 173.10 172.14 2jwl s GLY 70 N -0.98 1.65 0.70 0.20 0.00 -1.26 -0.91 107.32 106.71 2jwl s GLY 70 Ca -0.08 -1.68 -0.11 0.00 0.00 0.00 0.00 44.72 42.85 2jwl s GLY 70 CO -0.00 -1.75 1.08 0.00 0.00 0.00 0.00 173.10 172.43 2jwl s ALA 71 N -2.22 2.93 0.46 3.20 0.00 -1.00 -4.94 121.76 120.19 2jwl s ALA 71 Ca 0.23 -0.37 0.12 0.00 0.00 0.00 0.00 51.96 51.94 2jwl s ALA 71 Cb -0.05 -2.99 1.06 0.00 0.00 0.00 0.00 23.12 21.13 2jwl s ALA 71 CO 0.10 -1.11 2.08 0.87 0.00 0.00 0.00 175.76 177.70 2jwl h LYS 72 N -0.61 0.30 -0.00 0.00 6.56 -1.98 -1.44 116.57 119.40 2jwl h LYS 72 Ca -0.45 -0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.12 2jwl h LYS 72 Cb 1.25 -0.07 0.00 0.00 -0.57 0.00 0.00 32.23 32.85 2jwl h LYS 72 CO 0.64 0.20 -0.09 0.39 -2.06 0.00 0.00 179.45 178.52 2jwl n GLU 73 N -4.49 0.68 -3.13 3.15 1.02 -1.26 -4.86 120.64 111.75 2jwl n GLU 73 Ca 0.02 -0.21 -0.39 0.00 -0.02 0.00 0.00 57.16 56.56 2jwl n GLU 73 Cb 0.14 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.01 2jwl n GLU 73 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2jwl s VAL 74 N -2.46 4.71 0.37 2.62 1.01 -0.54 -5.02 120.40 121.08 2jwl s VAL 74 Ca 0.29 1.41 -0.26 0.00 0.00 0.00 0.00 61.98 63.43 2jwl s VAL 74 Cb 0.20 -4.00 -0.09 0.00 0.00 0.00 0.00 36.38 32.49 2jwl s VAL 74 CO 0.47 0.47 1.13 -2.16 0.00 0.00 0.00 175.10 175.00 2jwl s PRO 75 N -0.62 4.23 0.37 2.72 0.04 -1.26 -4.85 135.00 135.62 2jwl s PRO 75 Ca 0.33 1.76 0.05 0.00 0.04 0.00 0.00 61.00 63.18 2jwl s PRO 75 Cb -0.20 -2.77 0.71 0.00 0.04 0.00 0.00 34.50 32.28 2jwl s PRO 75 CO 0.21 -0.15 1.98 -0.92 0.04 0.00 0.00 177.00 178.16 2jwl h TYR 76 N 2.89 0.60 -0.40 0.56 3.20 -1.97 -1.72 116.97 120.13 2jwl h TYR 76 Ca -0.48 -0.01 0.11 0.00 3.14 0.00 0.00 58.73 61.48 2jwl h TYR 76 Cb 1.22 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 39.29 2jwl h TYR 76 CO 0.57 0.45 0.28 0.93 -1.64 0.00 0.00 178.16 178.74 2jwl h GLU 77 N 0.61 0.04 -0.03 1.82 4.39 -2.00 -0.30 114.58 119.11 2jwl h GLU 77 Ca 0.15 -0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.66 2jwl h GLU 77 Cb 0.07 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.71 2jwl h GLU 77 CO -0.02 0.03 -0.82 0.93 -1.16 0.00 0.00 179.01 177.97 2jwl h GLU 78 N 0.05 0.34 -0.76 2.33 4.39 -1.69 -2.50 114.58 116.72 2jwl h GLU 78 Ca 0.19 -0.32 -0.05 0.00 0.34 0.00 0.00 59.36 59.52 2jwl h GLU 78 Cb 0.69 0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 29.38 2jwl h GLU 78 CO -0.01 0.99 0.27 0.28 -1.16 0.00 0.00 179.01 179.38 2jwl h VAL 79 N 0.21 1.26 -0.17 3.13 2.07 -1.06 -0.47 116.25 121.21 2jwl h VAL 79 Ca -0.05 -0.87 -0.00 0.00 0.82 0.00 0.00 66.70 66.60 2jwl h VAL 79 Cb 1.42 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 31.57 2jwl h VAL 79 CO 0.14 0.35 0.11 0.40 0.02 0.00 0.00 177.57 178.58 2jwl h ILE 80 N 1.12 1.07 -0.66 4.57 1.08 -1.29 -1.03 117.51 122.37 2jwl h ILE 80 Ca 0.25 -0.18 0.08 0.00 -0.39 0.00 0.00 64.86 64.62 2jwl h ILE 80 Cb 0.27 0.88 -0.06 0.00 -3.07 0.00 0.00 36.82 34.83 2jwl h ILE 80 CO -0.01 0.07 0.33 0.11 -0.69 0.00 0.00 178.15 177.96 2jwl h LYS 81 N 0.21 0.57 -0.15 2.37 6.56 -1.00 0.28 116.57 125.40 2jwl h LYS 81 Ca 0.06 -0.03 0.02 0.00 -1.06 0.00 0.00 60.65 59.63 2jwl h LYS 81 Cb 0.02 -0.13 -0.02 0.00 -0.57 0.00 0.00 32.23 31.54 2jwl h LYS 81 CO -0.01 0.38 0.05 0.00 -2.06 0.00 0.00 179.45 177.80 2jwl h ALA 82 N 1.38 0.16 -0.73 3.86 0.00 -0.61 0.15 119.26 123.47 2jwl h ALA 82 Ca 0.31 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 2jwl h ALA 82 Cb 0.29 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 2jwl h ALA 82 CO -0.23 -0.40 0.43 -0.07 0.00 0.00 0.00 179.25 178.98 2jwl h LEU 83 N 0.12 0.89 -0.75 0.00 3.38 -0.55 -1.78 115.31 116.61 2jwl h LEU 83 Ca 0.07 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2jwl h LEU 83 Cb 0.04 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.53 2jwl h LEU 83 CO -0.07 0.69 0.42 -1.13 0.09 0.00 0.00 178.44 178.44 2jwl h ASN 84 N 1.01 0.93 -0.64 -0.43 -0.73 0.53 -1.75 115.58 114.50 2jwl h ASN 84 Ca 0.26 -0.09 -0.07 0.00 1.87 0.00 0.00 56.30 58.27 2jwl h ASN 84 Cb -0.02 -0.24 -0.03 0.00 0.27 0.00 0.00 38.32 38.31 2jwl h ASN 84 CO -0.05 0.75 0.12 -0.07 -0.37 0.00 0.00 177.43 177.82 2jwl h LEU 85 N 1.03 1.02 -0.63 0.34 3.38 0.09 -1.18 115.31 119.35 2jwl h LEU 85 Ca 0.26 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 2jwl h LEU 85 Cb 0.02 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.48 2jwl h LEU 85 CO -0.04 1.00 0.18 -0.07 0.09 0.00 0.00 178.44 179.60 2jwl h LEU 86 N 1.01 0.94 -0.83 1.67 -0.00 -1.07 -2.45 115.31 114.58 2jwl h LEU 86 Ca 0.20 -0.22 -0.05 0.00 -0.00 0.00 0.00 57.88 57.81 2jwl h LEU 86 Cb 0.41 -0.25 -0.03 0.00 -0.00 0.00 0.00 40.66 40.79 2jwl h LEU 86 CO 0.01 0.91 0.27 -0.74 -0.00 0.00 0.00 178.44 178.89 2jwl h HIS 87 N 0.92 1.17 -0.97 1.13 2.76 -1.02 0.88 115.15 120.02 2jwl h HIS 87 Ca 0.20 -0.10 0.04 0.00 -2.20 0.00 0.00 60.37 58.31 2jwl h HIS 87 Cb 0.32 -0.35 -0.06 0.00 1.55 0.00 0.00 27.41 28.88 2jwl h HIS 87 CO 0.02 0.90 0.63 1.25 -1.30 0.00 0.00 177.93 179.43 2jwl h LEU 88 N 1.10 1.04 -1.14 0.26 6.46 -0.78 -1.02 115.31 121.23 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 0.25 -0.24 0.00 0.00 -0.73 0.00 0.00 40.66 39.94 2jwl h LEU 88 CO -0.02 0.71 0.00 0.00 -0.62 0.00 0.00 178.44 178.52 2jwl n ALA 89 N -2.38 2.46 -3.15 1.25 0.00 -0.96 -4.93 120.51 112.81 2jwl n ALA 89 Ca 0.13 -0.55 -0.15 0.00 0.00 0.00 0.00 53.44 52.88 2jwl n ALA 89 Cb 0.11 -1.00 0.06 0.00 0.00 0.00 0.00 19.45 18.61 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 1.03 -0.08 0.09 0.00 0.00 -0.39 -4.92 105.19 100.93 2jwl n GLY 90 Ca 0.12 -0.06 -0.11 0.00 0.00 0.00 0.00 46.02 45.97 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 1.56 -0.61 -0.61 -0.00 0.27 -5.01 119.36 111.16 2jwl n ILE 91 Ca -0.07 -0.79 0.00 0.00 -0.00 0.00 0.00 62.75 61.89 2jwl n ILE 91 Cb 0.57 -0.97 0.00 0.00 -0.00 0.00 0.00 39.64 39.24 2jwl n ILE 91 CO 0.00 0.00 0.00 0.29 -0.00 0.00 0.00 176.55 176.84