#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 -3.43 1.61 3.41 -1.26 -4.97 113.62 108.98 2jwl n SER 20 Ca 0.00 0.41 -0.07 0.00 -0.26 0.00 0.00 58.87 58.95 2jwl n SER 20 Cb 0.00 -0.38 -0.07 0.00 -0.26 0.00 0.00 64.21 63.50 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 -0.87 -0.68 0.10 -3.33 1.01 -1.26 -5.01 120.40 110.35 2jwl s VAL 21 Ca 0.00 0.02 -0.01 0.00 0.00 0.00 0.00 61.98 61.99 2jwl s VAL 21 Cb 0.00 -0.80 0.02 0.00 0.00 0.00 0.00 36.38 35.60 2jwl s VAL 21 CO 0.00 -0.04 0.04 -2.65 0.00 0.00 0.00 175.10 172.44 2jwl n PRO 22 N 5.38 0.49 -3.76 2.72 -0.02 -1.26 -2.90 135.00 135.65 2jwl n PRO 22 Ca -0.05 -0.06 -0.37 0.00 -2.02 0.00 0.00 63.50 61.00 2jwl n PRO 22 Cb 0.50 -0.15 -0.13 0.00 -0.02 0.00 0.00 33.50 33.70 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 -0.54 4.21 -0.14 -1.45 1.01 -0.52 -3.07 120.40 119.90 2jwl s VAL 23 Ca 0.03 -0.27 -0.00 0.00 0.00 0.00 0.00 61.98 61.73 2jwl s VAL 23 Cb -0.00 -3.00 -0.01 0.00 0.00 0.00 0.00 36.38 33.36 2jwl s VAL 23 CO 0.02 0.30 -0.14 -0.63 0.00 0.00 0.00 175.10 174.65 2jwl s ILE 24 N 1.59 2.91 -0.14 2.22 1.09 0.07 -2.02 121.20 126.92 2jwl s ILE 24 Ca 0.06 -0.70 0.01 0.00 -1.10 0.00 0.00 60.65 58.91 2jwl s ILE 24 Cb -0.15 -2.23 -0.00 0.00 -1.06 0.00 0.00 42.46 39.02 2jwl s ILE 24 CO 0.03 0.52 -0.16 -0.22 -0.10 0.00 0.00 174.94 175.01 2jwl s LEU 25 N 0.59 2.46 -0.11 2.97 0.20 -0.70 0.25 118.68 124.34 2jwl s LEU 25 Ca -0.08 -0.46 0.03 0.00 0.69 0.00 0.00 54.13 54.31 2jwl s LEU 25 Cb -0.16 -1.55 -0.01 0.00 -0.43 0.00 0.00 46.19 44.05 2jwl s LEU 25 CO 0.03 0.11 -0.20 -1.61 -0.29 0.00 0.00 176.35 174.39 2jwl s GLU 26 N 0.68 3.14 -0.76 1.98 0.41 0.57 -1.27 118.70 123.45 2jwl s GLU 26 Ca -0.08 -0.81 -0.21 0.00 -0.41 0.00 0.00 54.97 53.46 2jwl s GLU 26 Cb -0.16 -2.42 0.09 0.00 -1.78 0.00 0.00 34.13 29.87 2jwl s GLU 26 CO 0.02 0.21 1.03 0.08 -0.49 0.00 0.00 175.26 176.11 2jwl s VAL 27 N 0.31 4.47 -0.11 2.63 1.01 0.18 -1.39 120.40 127.50 2jwl s VAL 27 Ca -0.15 -0.83 0.27 0.00 0.00 0.00 0.00 61.98 61.27 2jwl s VAL 27 Cb -0.17 -4.72 0.32 0.00 0.00 0.00 0.00 36.38 31.81 2jwl s VAL 27 CO 0.07 -1.48 1.78 0.00 0.00 0.00 0.00 175.10 175.48 2jwl h ALA 28 N 9.30 0.98 -3.00 5.51 0.00 -1.63 -2.60 119.26 127.83 2jwl h ALA 28 Ca -0.11 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2jwl h ALA 28 Cb 1.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2jwl h ALA 28 CO 1.16 0.09 0.00 0.41 0.00 0.00 0.00 179.25 180.91 2jwl n GLY 29 N 0.53 -0.00 3.00 0.00 0.00 -1.19 -4.89 105.19 102.64 2jwl n GLY 29 Ca 0.02 0.55 -0.32 0.00 0.00 0.00 0.00 46.02 46.26 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 2.82 3.30 0.00 -0.61 -1.09 -1.26 -4.63 121.20 119.73 2jwl s ILE 30 Ca 0.00 -3.62 0.00 0.00 -2.23 0.00 0.00 60.65 54.80 2jwl s ILE 30 Cb 0.00 -3.16 0.00 0.00 -1.58 0.00 0.00 42.46 37.72 2jwl s ILE 30 CO 0.00 -0.93 0.00 0.61 -1.23 0.00 0.00 174.94 173.39 2jwl n GLY 31 N 2.72 0.28 3.57 6.18 0.00 -1.26 -5.07 105.19 111.61 2jwl n GLY 31 Ca 0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.96 3.73 0.06 1.61 3.01 -1.26 -4.22 119.74 121.71 2jwl s LYS 32 Ca 0.00 -0.43 0.00 0.00 -1.01 0.00 0.00 55.97 54.53 2jwl s LYS 32 Cb 0.00 -3.03 -0.03 0.00 -1.01 0.00 0.00 37.83 33.76 2jwl s LYS 32 CO 0.00 0.30 -0.05 0.71 0.51 0.00 0.00 175.35 176.83 2jwl s TYR 33 N 0.23 0.59 0.00 3.18 1.51 -0.85 -1.64 117.35 120.37 2jwl s TYR 33 Ca 0.00 -0.83 0.07 0.00 -1.01 0.00 0.00 57.07 55.31 2jwl s TYR 33 Cb -0.13 -0.38 -0.02 0.00 -0.11 0.00 0.00 41.96 41.31 2jwl s TYR 33 CO 0.02 -0.23 -0.21 0.00 -1.11 0.00 0.00 175.55 174.02 2jwl s ALA 34 N -2.93 1.76 -0.04 3.71 0.00 -0.49 -1.63 121.76 122.15 2jwl s ALA 34 Ca 0.01 -0.96 0.02 0.00 0.00 0.00 0.00 51.96 51.03 2jwl s ALA 34 Cb 0.01 -0.41 0.01 0.00 0.00 0.00 0.00 23.12 22.72 2jwl s ALA 34 CO -0.05 0.42 -0.09 0.96 0.00 0.00 0.00 175.76 177.00 2jwl s ILE 35 N -0.59 0.84 -0.28 0.00 -4.36 -0.07 -0.32 121.20 116.42 2jwl s ILE 35 Ca 0.08 -0.35 -0.05 0.00 -0.26 0.00 0.00 60.65 60.08 2jwl s ILE 35 Cb -0.08 -0.77 0.02 0.00 1.25 0.00 0.00 42.46 42.87 2jwl s ILE 35 CO 0.00 0.27 0.03 -0.55 0.24 0.00 0.00 174.94 174.93 2jwl s SER 36 N 0.48 4.84 -0.34 4.36 0.15 0.14 0.07 113.70 123.39 2jwl s SER 36 Ca -0.08 -0.85 -0.06 0.00 0.70 0.00 0.00 55.95 55.67 2jwl s SER 36 Cb -0.12 -1.79 0.05 0.00 -1.71 0.00 0.00 66.02 62.45 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 3.63 -1.50 6.45 1.01 0.23 -0.75 121.20 131.69 2jwl s ILE 37 Ca 0.01 -1.27 -0.04 0.00 0.00 0.00 0.00 60.65 59.34 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 -0.23 0.41 0.61 0.00 0.00 0.00 174.94 175.73 2jwl n GLY 38 N 4.77 -0.25 0.93 6.18 0.00 -1.14 -0.99 105.19 114.69 2jwl n GLY 38 Ca -0.12 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.97 3.07 3.70 -0.02 0.00 -1.26 -4.84 105.19 103.86 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 -0.29 4.33 -0.15 1.61 2.12 -0.16 -5.06 118.70 121.09 2jwl s GLU 40 Ca 0.00 0.60 -0.05 0.00 0.36 0.00 0.00 54.97 55.88 2jwl s GLU 40 Cb 0.00 -3.48 -0.04 0.00 0.26 0.00 0.00 34.13 30.87 2jwl s GLU 40 CO 0.00 0.02 0.02 0.50 -0.54 0.00 0.00 175.26 175.26 2jwl s ARG 41 N 1.04 3.67 -0.13 4.30 3.00 -1.26 0.76 118.95 130.33 2jwl s ARG 41 Ca 0.30 -0.40 0.02 0.00 -1.00 0.00 0.00 55.73 54.64 2jwl s ARG 41 Cb -0.16 -3.04 -0.00 0.00 0.00 0.00 0.00 34.95 31.75 2jwl s ARG 41 CO 0.12 0.37 -0.19 -0.65 0.00 0.00 0.00 175.30 174.95 2jwl s GLN 42 N 0.07 3.15 0.19 5.12 -0.21 0.11 -4.98 119.66 123.12 2jwl s GLN 42 Ca 0.03 -0.80 0.10 0.00 0.02 0.00 0.00 55.36 54.71 2jwl s GLN 42 Cb -0.13 -2.48 -0.04 0.00 1.00 0.00 0.00 33.01 31.36 2jwl s GLN 42 CO 0.02 0.10 -0.15 -2.00 -2.12 0.00 0.00 175.29 171.13 2jwl s GLU 43 N 0.59 1.84 0.00 2.91 2.12 -1.26 -0.89 118.70 124.01 2jwl s GLU 43 Ca -0.11 -1.40 0.00 0.00 0.36 0.00 0.00 54.97 53.82 2jwl s GLU 43 Cb -0.16 -2.02 0.00 0.00 0.26 0.00 0.00 34.13 32.21 2jwl s GLU 43 CO 0.03 0.41 0.00 0.41 -0.54 0.00 0.00 175.26 175.58 2jwl n GLY 44 N 0.05 0.53 3.85 -1.50 0.00 -1.23 -5.03 105.19 101.86 2jwl n GLY 44 Ca -0.11 -0.83 -0.33 0.00 0.00 0.00 0.00 46.02 44.75 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 0.68 0.99 1.43 -0.65 -4.93 118.68 120.37 2jwl s LEU 45 Ca 0.00 1.18 -0.01 0.00 -1.03 0.00 0.00 54.13 54.27 2jwl s LEU 45 Cb 0.00 -3.81 0.10 0.00 0.03 0.00 0.00 46.19 42.51 2jwl s LEU 45 CO 0.00 -0.10 0.94 0.42 0.23 0.00 0.00 176.35 177.84 2jwl s THR 46 N -1.81 2.28 0.07 5.49 -4.23 -1.26 -2.01 115.64 114.16 2jwl s THR 46 Ca 0.49 -0.59 -0.18 0.00 -1.18 0.00 0.00 61.69 60.23 2jwl s THR 46 Cb -0.12 -2.69 -0.11 0.00 1.34 0.00 0.00 72.50 70.91 2jwl s THR 46 CO 0.19 0.00 1.39 -0.08 -0.54 0.00 0.00 174.62 175.58 2jwl h GLU 47 N -0.38 0.51 -0.66 3.99 4.81 -1.99 0.39 114.58 121.25 2jwl h GLU 47 Ca -0.38 -0.27 -0.05 0.00 -0.13 0.00 0.00 59.36 58.53 2jwl h GLU 47 Cb 1.28 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.64 2jwl h GLU 47 CO 0.45 0.84 0.21 1.49 -0.73 0.00 0.00 179.01 181.27 2jwl h GLU 48 N 0.20 1.01 -0.20 1.92 4.81 -1.96 -2.14 114.58 118.21 2jwl h GLU 48 Ca 0.04 -0.20 -0.09 0.00 -0.13 0.00 0.00 59.36 58.97 2jwl h GLU 48 Cb 0.74 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 29.97 2jwl h GLU 48 CO 0.05 0.86 -0.24 0.52 -0.73 0.00 0.00 179.01 179.47 2jwl h MET 49 N 0.97 0.52 -0.77 1.92 2.86 -1.94 -2.52 114.93 115.97 2jwl h MET 49 Ca 0.22 -0.29 0.06 0.00 -2.06 0.00 0.00 59.70 57.63 2jwl h MET 49 Cb 0.27 0.02 -0.05 0.00 0.06 0.00 0.00 31.60 31.90 2jwl h MET 49 CO -0.01 0.88 0.50 -0.24 1.06 0.00 0.00 176.91 179.10 2jwl h VAL 50 N 0.19 1.04 0.12 -2.22 3.04 -0.73 -1.52 116.25 116.16 2jwl h VAL 50 Ca 0.03 -0.28 -0.01 0.00 -1.01 0.00 0.00 66.70 65.43 2jwl h VAL 50 Cb 0.81 0.14 0.00 0.00 -2.01 0.00 0.00 31.29 30.23 2jwl h VAL 50 CO 0.06 0.15 -0.06 0.74 -1.01 0.00 0.00 177.57 177.45 2jwl h THR 51 N 0.83 1.00 -0.42 3.17 2.02 -1.31 -0.82 112.91 117.38 2jwl h THR 51 Ca 0.33 -0.44 0.09 0.00 0.77 0.00 0.00 66.41 67.15 2jwl h THR 51 Cb 0.23 1.28 -0.08 0.00 -1.74 0.00 0.00 68.15 67.84 2jwl h THR 51 CO -0.11 0.11 -0.13 -0.61 0.37 0.00 0.00 175.52 175.15 2jwl h GLN 52 N -0.36 -0.03 -0.22 6.66 4.15 -0.95 0.48 115.11 124.83 2jwl h GLN 52 Ca -0.02 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.38 2jwl h GLN 52 Cb 0.30 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.98 2jwl h GLN 52 CO 0.03 -0.02 0.03 -0.07 -1.93 0.00 0.00 178.83 176.87 2jwl h LEU 53 N -0.03 0.36 -0.73 -2.39 3.38 -1.27 -1.44 115.31 113.18 2jwl h LEU 53 Ca 0.20 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 57.93 2jwl h LEU 53 Cb 0.34 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 2jwl h LEU 53 CO -0.45 0.53 0.48 0.28 0.09 0.00 0.00 178.44 179.37 2jwl h SER 54 N 0.17 0.81 -0.34 -0.43 0.02 -0.70 -1.30 113.55 111.77 2jwl h SER 54 Ca 0.07 -0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 60.94 2jwl h SER 54 Cb 0.33 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.66 2jwl h SER 54 CO 0.00 0.57 -0.04 0.03 -1.14 0.00 0.00 176.83 176.26 2jwl h ARG 55 N 0.95 0.63 -0.64 3.45 2.47 -0.85 -1.70 114.38 118.69 2jwl h ARG 55 Ca 0.28 -0.22 -0.07 0.00 -1.26 0.00 0.00 59.98 58.70 2jwl h ARG 55 Cb -0.06 -0.05 -0.03 0.00 -1.65 0.00 0.00 29.97 28.18 2jwl h ARG 55 CO -0.08 0.78 0.12 0.37 0.56 0.00 0.00 179.97 181.72 2jwl h GLN 56 N 0.43 1.04 -0.21 0.04 4.15 -1.01 -1.13 115.11 118.42 2jwl h GLN 56 Ca 0.09 -0.26 -0.16 0.00 0.77 0.00 0.00 58.65 59.09 2jwl h GLN 56 Cb 0.52 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.07 2jwl h GLN 56 CO 0.03 0.95 -0.52 0.93 -1.93 0.00 0.00 178.83 178.28 2jwl h GLU 57 N 0.98 0.59 -0.03 1.69 3.07 -1.19 -2.86 114.58 116.83 2jwl h GLU 57 Ca 0.20 -0.36 -0.14 0.00 -0.50 0.00 0.00 59.36 58.55 2jwl h GLU 57 Cb 0.40 0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.33 2jwl h GLU 57 CO 0.01 0.97 -0.64 0.35 -1.40 0.00 0.00 179.01 178.30 2jwl h PHE 58 N 0.46 0.17 0.00 4.33 3.57 -1.09 -1.80 116.94 122.58 2jwl h PHE 58 Ca 0.01 -0.07 -0.08 0.00 3.53 0.00 0.00 57.97 61.37 2jwl h PHE 58 Cb 1.07 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.77 2jwl h PHE 58 CO 0.05 0.73 -0.37 0.22 -2.23 0.00 0.00 178.31 176.70 2jwl h ASP 59 N 0.09 0.00 0.31 0.41 3.58 -1.15 -3.18 116.42 116.49 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 1.14 0.00 0.01 0.00 1.72 0.00 0.00 39.33 42.20 2jwl h ASP 59 CO 0.09 0.37 -1.62 0.11 -2.88 0.00 0.00 179.24 175.31 2jwl h LYS 60 N 0.00 0.36 -4.41 0.28 6.56 -1.39 -3.44 116.57 114.52 2jwl h LYS 60 Ca -0.00 -0.61 -0.57 0.00 -1.06 0.00 0.00 60.65 58.41 2jwl h LYS 60 Cb 0.95 0.23 -0.37 0.00 -0.57 0.00 0.00 32.23 32.47 2jwl h LYS 60 CO 0.05 1.25 -0.81 -0.51 -2.06 0.00 0.00 179.45 177.37 2jwl s ASP 61 N -7.21 2.69 0.25 0.86 1.11 -0.69 -5.01 116.67 108.67 2jwl s ASP 61 Ca -0.12 -0.54 0.22 0.00 0.18 0.00 0.00 52.55 52.29 2jwl s ASP 61 Cb 0.06 -1.03 0.06 0.00 1.07 0.00 0.00 42.92 43.08 2jwl s ASP 61 CO 0.87 -0.12 1.16 0.78 1.18 0.00 0.00 175.17 179.04 2jwl h ASN 62 N 8.09 0.00 -0.55 0.27 4.21 -1.86 -3.34 115.58 122.40 2jwl h ASN 62 Ca -0.31 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.20 2jwl h ASN 62 Cb 1.12 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 38.32 2jwl h ASN 62 CO 0.46 0.07 0.00 -3.20 -1.29 0.00 0.00 177.43 173.47 2jwl n ASN 63 N -2.81 5.53 -4.64 5.81 5.15 -1.26 -4.95 115.26 118.09 2jwl n ASN 63 Ca 0.00 -2.89 -0.43 0.00 -0.60 0.00 0.00 54.58 50.66 2jwl n ASN 63 Cb 0.58 -0.68 -0.03 0.00 -0.53 0.00 0.00 39.78 39.12 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 -2.69 3.68 0.02 -0.44 -4.23 -1.25 -4.96 115.64 105.77 2jwl s THR 64 Ca 0.52 0.78 -0.30 0.00 -1.18 0.00 0.00 61.69 61.50 2jwl s THR 64 Cb 0.40 -3.65 -0.07 0.00 1.34 0.00 0.00 72.50 70.51 2jwl s THR 64 CO 0.15 -0.24 1.62 -0.22 -0.54 0.00 0.00 174.62 175.39 2jwl s LEU 65 N 5.00 4.35 -0.17 4.79 2.96 -1.26 -4.90 118.68 129.45 2jwl s LEU 65 Ca 0.72 2.36 -0.04 0.00 -0.22 0.00 0.00 54.13 56.95 2jwl s LEU 65 Cb -0.26 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 42.85 2jwl s LEU 65 CO 0.29 -0.87 -0.03 -0.36 -1.32 0.00 0.00 176.35 174.05 2jwl s PHE 66 N 3.02 3.02 -0.01 5.38 0.08 -1.26 -1.44 117.98 126.77 2jwl s PHE 66 Ca 0.72 -0.35 0.02 0.00 0.12 0.00 0.00 56.93 57.44 2jwl s PHE 66 Cb -0.37 -1.98 -0.00 0.00 -0.57 0.00 0.00 43.02 40.10 2jwl s PHE 66 CO 0.31 -0.09 -0.07 -0.48 -0.10 0.00 0.00 175.22 174.79 2jwl s LEU 67 N 0.51 1.98 -0.03 -0.37 0.05 -0.86 -5.01 118.68 114.95 2jwl s LEU 67 Ca -0.03 -0.12 0.05 0.00 0.05 0.00 0.00 54.13 54.07 2jwl s LEU 67 Cb -0.14 -0.36 -0.01 0.00 -2.05 0.00 0.00 46.19 43.63 2jwl s LEU 67 CO 0.03 0.08 -0.17 0.54 -0.55 0.00 0.00 176.35 176.27 2jwl s VAL 68 N -0.11 1.40 0.02 1.48 0.11 -1.26 -1.73 120.40 120.32 2jwl s VAL 68 Ca 0.02 -0.72 0.01 0.00 -2.93 0.00 0.00 61.98 58.36 2jwl s VAL 68 Cb -0.03 -1.19 -0.01 0.00 -1.53 0.00 0.00 36.38 33.61 2jwl s VAL 68 CO -0.00 0.40 -0.05 -0.83 -3.33 0.00 0.00 175.10 171.29 2jwl s GLY 69 N -0.14 0.30 0.20 6.54 0.00 -0.39 -4.99 107.32 108.84 2jwl s GLY 69 Ca 0.00 -0.48 0.11 0.00 0.00 0.00 0.00 44.72 44.36 2jwl s GLY 69 CO 0.01 -0.51 -0.23 -0.32 0.00 0.00 0.00 173.10 172.05 2jwl s GLY 70 N -0.98 1.71 0.67 0.20 0.00 -1.26 -0.64 107.32 107.01 2jwl s GLY 70 Ca -0.07 -1.66 -0.11 0.00 0.00 0.00 0.00 44.72 42.88 2jwl s GLY 70 CO -0.00 -1.69 1.05 0.00 0.00 0.00 0.00 173.10 172.46 2jwl s ALA 71 N -1.79 3.00 0.46 3.20 0.00 -0.98 -4.93 121.76 120.72 2jwl s ALA 71 Ca 0.21 -0.33 0.12 0.00 0.00 0.00 0.00 51.96 51.96 2jwl s ALA 71 Cb -0.07 -2.98 1.05 0.00 0.00 0.00 0.00 23.12 21.12 2jwl s ALA 71 CO 0.10 -0.98 2.07 0.87 0.00 0.00 0.00 175.76 177.82 2jwl h LYS 72 N -0.50 0.20 -0.00 0.00 6.56 -1.97 -1.96 116.57 118.89 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 1.24 -0.04 0.00 0.00 -0.57 0.00 0.00 32.23 32.86 2jwl h LYS 72 CO 0.63 0.18 -0.08 0.39 -2.06 0.00 0.00 179.45 178.51 2jwl n GLU 73 N -4.46 0.75 -3.21 3.15 4.71 -1.26 -4.85 120.64 115.46 2jwl n GLU 73 Ca -0.01 -0.23 -0.39 0.00 -0.01 0.00 0.00 57.16 56.53 2jwl n GLU 73 Cb 0.12 -1.50 -0.06 0.00 -1.01 0.00 0.00 31.44 29.00 2jwl n GLU 73 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 2jwl s VAL 74 N -2.41 5.00 0.43 2.62 1.01 -0.74 -5.03 120.40 121.27 2jwl s VAL 74 Ca 0.31 1.20 -0.25 0.00 0.00 0.00 0.00 61.98 63.24 2jwl s VAL 74 Cb 0.20 -3.92 -0.08 0.00 0.00 0.00 0.00 36.38 32.59 2jwl s VAL 74 CO 0.46 0.38 1.24 -2.16 0.00 0.00 0.00 175.10 175.01 2jwl s PRO 75 N 0.12 3.88 0.39 2.72 0.04 -1.26 -4.86 135.00 136.03 2jwl s PRO 75 Ca 0.31 1.99 0.06 0.00 0.04 0.00 0.00 61.00 63.40 2jwl s PRO 75 Cb -0.17 -2.62 0.78 0.00 0.04 0.00 0.00 34.50 32.53 2jwl s PRO 75 CO 0.16 -0.51 2.02 -0.92 0.04 0.00 0.00 177.00 177.79 2jwl h TYR 76 N 2.44 0.56 -0.34 0.56 3.20 -1.97 -1.71 116.97 119.71 2jwl h TYR 76 Ca -0.49 0.00 0.08 0.00 3.14 0.00 0.00 58.73 61.46 2jwl h TYR 76 Cb 1.25 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 39.32 2jwl h TYR 76 CO 0.53 0.39 0.24 0.93 -1.64 0.00 0.00 178.16 178.61 2jwl h GLU 77 N 0.59 0.09 -0.07 1.82 4.39 -2.00 -0.52 114.58 118.87 2jwl h GLU 77 Ca 0.15 -0.01 -0.18 0.00 0.34 0.00 0.00 59.36 59.67 2jwl h GLU 77 Cb -0.00 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 2jwl h GLU 77 CO -0.03 0.06 -0.73 0.93 -1.16 0.00 0.00 179.01 178.08 2jwl h GLU 78 N 0.09 0.39 -0.69 2.33 3.07 -1.68 -2.28 114.58 115.80 2jwl h GLU 78 Ca 0.16 -0.32 -0.04 0.00 -0.50 0.00 0.00 59.36 58.66 2jwl h GLU 78 Cb 0.52 0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 28.47 2jwl h GLU 78 CO -0.01 0.96 0.28 0.28 -1.40 0.00 0.00 179.01 179.11 2jwl h VAL 79 N 0.26 1.24 -0.45 3.13 2.07 -1.11 -0.14 116.25 121.26 2jwl h VAL 79 Ca -0.03 -0.77 -0.00 0.00 0.82 0.00 0.00 66.70 66.72 2jwl h VAL 79 Cb 1.31 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 2jwl h VAL 79 CO 0.12 0.31 0.26 0.40 0.02 0.00 0.00 177.57 178.69 2jwl h ILE 80 N 0.99 1.15 -0.59 4.57 1.08 -1.28 -0.96 117.51 122.47 2jwl h ILE 80 Ca 0.23 -0.36 0.04 0.00 -0.39 0.00 0.00 64.86 64.39 2jwl h ILE 80 Cb 0.21 0.57 -0.05 0.00 -3.07 0.00 0.00 36.82 34.48 2jwl h ILE 80 CO -0.02 0.15 0.32 0.11 -0.69 0.00 0.00 178.15 178.03 2jwl h LYS 81 N 0.60 0.60 -0.34 2.37 6.56 -0.93 0.21 116.57 125.64 2jwl h LYS 81 Ca 0.16 -0.04 0.01 0.00 -1.06 0.00 0.00 60.65 59.73 2jwl h LYS 81 Cb 0.02 -0.14 -0.02 0.00 -0.57 0.00 0.00 32.23 31.52 2jwl h LYS 81 CO -0.03 0.40 0.21 0.00 -2.06 0.00 0.00 179.45 177.97 2jwl h ALA 82 N 1.30 0.43 -0.94 3.86 0.00 -0.52 -1.12 119.26 122.26 2jwl h ALA 82 Ca 0.25 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.17 2jwl h ALA 82 Cb 0.12 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 2jwl h ALA 82 CO -0.15 -0.13 0.62 -0.07 0.00 0.00 0.00 179.25 179.52 2jwl h LEU 83 N 0.43 1.06 -0.81 0.00 3.38 -0.64 -1.74 115.31 116.99 2jwl h LEU 83 Ca 0.13 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 2jwl h LEU 83 Cb -0.02 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.43 2jwl h LEU 83 CO -0.05 0.75 0.44 0.78 0.09 0.00 0.00 178.44 180.46 2jwl h ASN 84 N 1.24 1.02 -0.72 -0.43 4.21 -0.22 -1.68 115.58 119.00 2jwl h ASN 84 Ca 0.36 -0.10 -0.07 0.00 1.21 0.00 0.00 56.30 57.70 2jwl h ASN 84 Cb -0.09 -0.26 -0.03 0.00 -1.12 0.00 0.00 38.32 36.82 2jwl h ASN 84 CO -0.09 0.83 0.19 -0.07 -1.29 0.00 0.00 177.43 177.00 2jwl h LEU 85 N 1.13 1.08 -0.56 1.61 3.38 -0.36 0.38 115.31 121.96 2jwl h LEU 85 Ca 0.29 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 2jwl h LEU 85 Cb 0.04 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 2jwl h LEU 85 CO -0.05 1.02 0.14 -0.07 0.09 0.00 0.00 178.44 179.58 2jwl h LEU 86 N 1.08 0.85 -0.79 1.67 -0.00 -1.14 -2.02 115.31 114.97 2jwl h LEU 86 Ca 0.23 -0.23 -0.06 0.00 -0.00 0.00 0.00 57.88 57.82 2jwl h LEU 86 Cb 0.35 -0.22 -0.03 0.00 -0.00 0.00 0.00 40.66 40.76 2jwl h LEU 86 CO -0.00 0.85 0.23 -0.74 -0.00 0.00 0.00 178.44 178.78 2jwl h HIS 87 N 0.80 1.18 -0.95 1.13 2.76 -0.99 0.23 115.15 119.31 2jwl h HIS 87 Ca 0.18 -0.12 0.02 0.00 -2.20 0.00 0.00 60.37 58.25 2jwl h HIS 87 Cb 0.33 -0.34 -0.05 0.00 1.55 0.00 0.00 27.41 28.90 2jwl h HIS 87 CO 0.02 0.93 0.63 1.25 -1.30 0.00 0.00 177.93 179.46 2jwl h LEU 88 N 1.09 1.06 -1.37 0.26 6.46 -0.50 -1.32 115.31 121.00 2jwl h LEU 88 Ca 0.24 -0.02 0.00 0.00 -0.12 0.00 0.00 57.88 57.98 2jwl h LEU 88 Cb 0.30 -0.25 0.00 0.00 -0.73 0.00 0.00 40.66 39.98 2jwl h LEU 88 CO -0.01 0.75 0.00 0.00 -0.62 0.00 0.00 178.44 178.56 2jwl n ALA 89 N -2.39 2.44 -3.22 1.25 0.00 -0.80 -4.93 120.51 112.86 2jwl n ALA 89 Ca 0.12 -0.65 -0.16 0.00 0.00 0.00 0.00 53.44 52.75 2jwl n ALA 89 Cb 0.06 -0.97 0.06 0.00 0.00 0.00 0.00 19.45 18.60 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 1.09 -0.16 0.11 0.00 0.00 -0.50 -4.89 105.19 100.84 2jwl n GLY 90 Ca 0.13 -0.01 -0.14 0.00 0.00 0.00 0.00 46.02 46.00 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 -3.96 1.55 -1.15 -0.61 -0.00 0.75 -5.00 119.36 110.94 2jwl n ILE 91 Ca -0.08 -0.72 0.00 0.00 -0.00 0.00 0.00 62.75 61.94 2jwl n ILE 91 Cb 0.58 -1.12 0.00 0.00 -0.00 0.00 0.00 39.64 39.10 2jwl n ILE 91 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.55 177.72