#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 0.70 -3.26 1.61 3.41 -1.26 -5.00 113.62 109.82 2jwl n SER 20 Ca 0.00 0.15 -0.05 0.00 -0.26 0.00 0.00 58.87 58.71 2jwl n SER 20 Cb 0.00 -0.59 -0.04 0.00 -0.26 0.00 0.00 64.21 63.32 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 -1.67 -0.75 0.63 -3.33 1.01 -1.26 -5.11 120.40 109.93 2jwl s VAL 21 Ca -0.10 -0.29 -0.05 0.00 0.00 0.00 0.00 61.98 61.54 2jwl s VAL 21 Cb 0.01 -0.69 0.07 0.00 0.00 0.00 0.00 36.38 35.78 2jwl s VAL 21 CO 0.15 -0.21 0.16 -2.65 0.00 0.00 0.00 175.10 172.55 2jwl n PRO 22 N 4.93 0.62 -4.23 2.72 -0.02 -1.26 -3.81 135.00 133.96 2jwl n PRO 22 Ca 0.06 -0.27 -0.34 0.00 -2.02 0.00 0.00 63.50 60.93 2jwl n PRO 22 Cb 0.51 -1.07 -0.14 0.00 -0.02 0.00 0.00 33.50 32.79 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 -1.83 3.31 -0.12 -1.45 1.01 0.17 -3.46 120.40 118.03 2jwl s VAL 23 Ca 0.13 -0.54 0.02 0.00 0.00 0.00 0.00 61.98 61.58 2jwl s VAL 23 Cb -0.02 -2.46 -0.01 0.00 0.00 0.00 0.00 36.38 33.89 2jwl s VAL 23 CO 0.11 0.47 -0.18 -0.63 0.00 0.00 0.00 175.10 174.86 2jwl s ILE 24 N 1.00 2.57 -0.16 2.22 1.09 -0.17 -2.06 121.20 125.68 2jwl s ILE 24 Ca -0.00 -0.83 -0.00 0.00 -1.10 0.00 0.00 60.65 58.72 2jwl s ILE 24 Cb -0.15 -2.04 -0.00 0.00 -1.06 0.00 0.00 42.46 39.21 2jwl s ILE 24 CO -0.00 0.54 -0.14 -0.22 -0.10 0.00 0.00 174.94 175.01 2jwl s LEU 25 N 0.45 2.52 -0.10 2.97 0.20 -0.57 0.03 118.68 124.17 2jwl s LEU 25 Ca -0.13 -0.46 0.02 0.00 0.69 0.00 0.00 54.13 54.26 2jwl s LEU 25 Cb -0.17 -1.58 -0.01 0.00 -0.43 0.00 0.00 46.19 44.01 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 0.85 3.10 -0.73 1.98 0.41 0.10 -0.93 118.70 123.48 2jwl s GLU 26 Ca -0.04 -0.79 -0.21 0.00 -0.41 0.00 0.00 54.97 53.52 2jwl s GLU 26 Cb -0.15 -2.43 0.10 0.00 -1.78 0.00 0.00 34.13 29.86 2jwl s GLU 26 CO -0.00 0.25 0.96 0.08 -0.49 0.00 0.00 175.26 176.06 2jwl s VAL 27 N 0.21 4.56 -0.16 2.63 1.01 0.25 -0.88 120.40 128.02 2jwl s VAL 27 Ca -0.12 -0.88 0.27 0.00 0.00 0.00 0.00 61.98 61.25 2jwl s VAL 27 Cb -0.16 -4.67 0.35 0.00 0.00 0.00 0.00 36.38 31.89 2jwl s VAL 27 CO 0.06 -1.41 1.78 0.00 0.00 0.00 0.00 175.10 175.54 2jwl h ALA 28 N 9.25 0.99 -3.00 5.51 0.00 -1.66 -2.54 119.26 127.80 2jwl h ALA 28 Ca -0.15 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.73 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 1.14 0.04 0.00 0.41 0.00 0.00 0.00 179.25 180.84 2jwl n GLY 29 N 0.58 0.03 3.04 0.00 0.00 -1.20 -4.90 105.19 102.75 2jwl n GLY 29 Ca 0.02 0.53 -0.34 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 2.76 3.27 0.00 -0.61 -1.09 -1.26 -4.61 121.20 119.66 2jwl s ILE 30 Ca 0.00 -3.09 0.00 0.00 -2.23 0.00 0.00 60.65 55.33 2jwl s ILE 30 Cb 0.00 -3.18 0.00 0.00 -1.58 0.00 0.00 42.46 37.70 2jwl s ILE 30 CO 0.00 -0.84 0.00 0.61 -1.23 0.00 0.00 174.94 173.48 2jwl n GLY 31 N 3.35 0.50 3.59 6.18 0.00 -1.26 -5.06 105.19 112.50 2jwl n GLY 31 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.84 3.73 0.07 1.61 3.01 -1.26 -4.24 119.74 121.81 2jwl s LYS 32 Ca 0.00 -0.42 0.01 0.00 -1.01 0.00 0.00 55.97 54.55 2jwl s LYS 32 Cb 0.00 -3.04 -0.03 0.00 -1.01 0.00 0.00 37.83 33.74 2jwl s LYS 32 CO 0.00 0.32 -0.06 0.71 0.51 0.00 0.00 175.35 176.83 2jwl s TYR 33 N 0.18 0.70 0.01 3.18 1.51 -0.86 -1.75 117.35 120.32 2jwl s TYR 33 Ca 0.02 -0.78 0.07 0.00 -1.01 0.00 0.00 57.07 55.36 2jwl s TYR 33 Cb -0.13 -0.43 -0.02 0.00 -0.11 0.00 0.00 41.96 41.27 2jwl s TYR 33 CO 0.02 -0.17 -0.21 0.00 -1.11 0.00 0.00 175.55 174.07 2jwl s ALA 34 N -2.79 1.78 -0.04 3.71 0.00 -0.06 -1.73 121.76 122.62 2jwl s ALA 34 Ca 0.02 -0.97 0.02 0.00 0.00 0.00 0.00 51.96 51.03 2jwl s ALA 34 Cb -0.00 -0.42 0.01 0.00 0.00 0.00 0.00 23.12 22.71 2jwl s ALA 34 CO -0.04 0.42 -0.10 0.96 0.00 0.00 0.00 175.76 177.00 2jwl s ILE 35 N -0.60 0.93 -0.29 0.00 -4.36 -0.04 0.01 121.20 116.86 2jwl s ILE 35 Ca 0.08 -0.40 -0.04 0.00 -0.26 0.00 0.00 60.65 60.02 2jwl s ILE 35 Cb -0.08 -0.84 0.02 0.00 1.25 0.00 0.00 42.46 42.81 2jwl s ILE 35 CO 0.00 0.30 0.03 -0.55 0.24 0.00 0.00 174.94 174.95 2jwl s SER 36 N 0.41 4.87 -0.32 4.36 0.15 0.11 -0.11 113.70 123.17 2jwl s SER 36 Ca -0.08 -0.89 -0.03 0.00 0.70 0.00 0.00 55.95 55.65 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 0.02 -0.20 0.05 -0.63 1.20 0.00 0.00 173.24 173.68 2jwl s ILE 37 N 1.40 3.29 -1.51 6.45 1.01 0.14 -1.00 121.20 130.99 2jwl s ILE 37 Ca 0.00 -1.34 -0.07 0.00 0.00 0.00 0.00 60.65 59.25 2jwl s ILE 37 Cb -0.18 -2.90 0.05 0.00 0.01 0.00 0.00 42.46 39.44 2jwl s ILE 37 CO -0.00 -0.17 0.56 0.61 0.00 0.00 0.00 174.94 175.94 2jwl n GLY 38 N 4.69 -0.31 1.22 6.18 0.00 -1.22 -1.06 105.19 114.69 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 -1.80 3.12 3.69 -0.02 0.00 -1.26 -5.03 105.19 103.89 2jwl n GLY 39 Ca -0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.38 4.32 -0.16 1.61 2.12 -0.23 -5.06 118.70 120.92 2jwl s GLU 40 Ca 0.00 0.64 -0.06 0.00 0.36 0.00 0.00 54.97 55.91 2jwl s GLU 40 Cb 0.00 -3.50 -0.04 0.00 0.26 0.00 0.00 34.13 30.86 2jwl s GLU 40 CO 0.00 -0.03 0.04 0.50 -0.54 0.00 0.00 175.26 175.23 2jwl s ARG 41 N 1.19 3.77 -0.13 4.30 3.00 -1.26 0.28 118.95 130.11 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 -3.11 -0.00 0.00 0.00 0.00 0.00 34.95 31.68 2jwl s ARG 41 CO 0.13 0.35 -0.19 -0.65 0.00 0.00 0.00 175.30 174.94 2jwl s GLN 42 N 0.13 3.15 0.22 5.12 -0.21 0.85 -4.97 119.66 123.94 2jwl s GLN 42 Ca 0.04 -0.80 0.11 0.00 0.02 0.00 0.00 55.36 54.72 2jwl s GLN 42 Cb -0.12 -2.49 -0.04 0.00 1.00 0.00 0.00 33.01 31.35 2jwl s GLN 42 CO 0.01 0.08 -0.16 -2.00 -2.12 0.00 0.00 175.29 171.11 2jwl s GLU 43 N 0.61 1.81 0.00 2.91 2.12 -1.26 -0.86 118.70 124.04 2jwl s GLU 43 Ca -0.10 -1.49 0.00 0.00 0.36 0.00 0.00 54.97 53.74 2jwl s GLU 43 Cb -0.16 -1.96 0.00 0.00 0.26 0.00 0.00 34.13 32.26 2jwl s GLU 43 CO 0.03 0.39 0.00 0.41 -0.54 0.00 0.00 175.26 175.55 2jwl n GLY 44 N -0.13 0.44 3.84 -1.50 0.00 -1.23 -5.03 105.19 101.58 2jwl n GLY 44 Ca -0.10 -0.90 -0.34 0.00 0.00 0.00 0.00 46.02 44.69 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 0.62 0.99 1.43 -0.70 -4.92 118.68 120.27 2jwl s LEU 45 Ca 0.00 1.25 0.00 0.00 -1.03 0.00 0.00 54.13 54.35 2jwl s LEU 45 Cb 0.00 -3.84 0.07 0.00 0.03 0.00 0.00 46.19 42.45 2jwl s LEU 45 CO 0.00 -0.10 0.87 0.42 0.23 0.00 0.00 176.35 177.77 2jwl s THR 46 N -1.80 2.44 0.07 5.49 -4.23 -1.26 -2.02 115.64 114.31 2jwl s THR 46 Ca 0.49 -0.61 -0.20 0.00 -1.18 0.00 0.00 61.69 60.19 2jwl s THR 46 Cb -0.12 -2.83 -0.11 0.00 1.34 0.00 0.00 72.50 70.78 2jwl s THR 46 CO 0.19 0.00 1.46 -0.33 -0.54 0.00 0.00 174.62 175.40 2jwl h GLU 47 N -0.20 0.38 -0.78 3.99 5.08 -1.99 0.16 114.58 121.22 2jwl h GLU 47 Ca -0.40 -0.14 -0.03 0.00 -1.00 0.00 0.00 59.36 57.78 2jwl h GLU 47 Cb 1.29 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 30.48 2jwl h GLU 47 CO 0.48 0.63 0.36 1.49 -1.00 0.00 0.00 179.01 180.97 2jwl h GLU 48 N 0.10 1.13 -0.22 2.33 4.81 -1.96 -2.06 114.58 118.70 2jwl h GLU 48 Ca 0.05 -0.17 -0.18 0.00 -0.13 0.00 0.00 59.36 58.93 2jwl h GLU 48 Cb 0.48 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.67 2jwl h GLU 48 CO 0.02 0.88 -0.55 1.98 -0.73 0.00 0.00 179.01 180.61 2jwl h MET 49 N 1.11 0.76 -0.57 1.92 4.05 -1.93 -2.60 114.93 117.68 2jwl h MET 49 Ca 0.27 -0.53 0.02 0.00 -0.28 0.00 0.00 59.70 59.18 2jwl h MET 49 Cb 0.14 0.08 -0.03 0.00 -0.80 0.00 0.00 31.60 30.99 2jwl h MET 49 CO -0.03 1.15 0.38 -0.24 0.23 0.00 0.00 176.91 178.40 2jwl h VAL 50 N 0.50 1.10 0.11 -5.77 3.04 -0.44 -1.74 116.25 113.03 2jwl h VAL 50 Ca -0.01 -0.24 -0.01 0.00 -1.01 0.00 0.00 66.70 65.44 2jwl h VAL 50 Cb 1.17 0.33 0.00 0.00 -2.01 0.00 0.00 31.29 30.78 2jwl h VAL 50 CO 0.12 0.13 -0.05 0.74 -1.01 0.00 0.00 177.57 177.50 2jwl h THR 51 N 0.71 1.01 -0.36 3.17 2.02 -1.29 -0.53 112.91 117.63 2jwl h THR 51 Ca 0.22 -0.43 0.08 0.00 0.77 0.00 0.00 66.41 67.05 2jwl h THR 51 Cb 0.02 1.29 -0.08 0.00 -1.74 0.00 0.00 68.15 67.64 2jwl h THR 51 CO -0.06 0.11 -0.20 -0.61 0.37 0.00 0.00 175.52 175.12 2jwl h GLN 52 N -0.34 -0.14 -0.18 6.66 4.15 -0.99 0.15 115.11 124.41 2jwl h GLN 52 Ca -0.01 0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.39 2jwl h GLN 52 Cb 0.28 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.00 2jwl h GLN 52 CO 0.02 -0.10 0.02 -0.07 -1.93 0.00 0.00 178.83 176.78 2jwl h LEU 53 N -0.15 0.28 -0.69 -2.39 3.38 -1.32 -1.14 115.31 113.28 2jwl h LEU 53 Ca 0.18 -0.27 0.03 0.00 0.09 0.00 0.00 57.88 57.91 2jwl h LEU 53 Cb 0.43 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.06 2jwl h LEU 53 CO -0.45 0.48 0.43 0.28 0.09 0.00 0.00 178.44 179.27 2jwl h SER 54 N 0.08 0.70 -0.39 -0.43 0.02 -0.68 -0.96 113.55 111.90 2jwl h SER 54 Ca 0.05 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.93 2jwl h SER 54 Cb 0.32 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 2jwl h SER 54 CO 0.00 0.49 -0.03 0.03 -1.14 0.00 0.00 176.83 176.18 2jwl h ARG 55 N 0.84 0.70 -0.68 3.45 2.47 -0.65 -1.66 114.38 118.85 2jwl h ARG 55 Ca 0.28 -0.24 -0.07 0.00 -1.26 0.00 0.00 59.98 58.69 2jwl h ARG 55 Cb 0.03 -0.06 -0.03 0.00 -1.65 0.00 0.00 29.97 28.26 2jwl h ARG 55 CO -0.11 0.82 0.16 0.37 0.56 0.00 0.00 179.97 181.76 2jwl h GLN 56 N 0.52 1.09 -0.28 0.04 4.15 -0.89 -1.07 115.11 118.67 2jwl h GLN 56 Ca 0.11 -0.26 -0.16 0.00 0.77 0.00 0.00 58.65 59.11 2jwl h GLN 56 Cb 0.52 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 28.06 2jwl h GLN 56 CO 0.03 0.97 -0.46 0.93 -1.93 0.00 0.00 178.83 178.36 2jwl h GLU 57 N 1.03 0.73 -0.04 1.69 3.07 -1.11 -2.78 114.58 117.17 2jwl h GLU 57 Ca 0.21 -0.41 -0.13 0.00 -0.50 0.00 0.00 59.36 58.53 2jwl h GLU 57 Cb 0.37 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.30 2jwl h GLU 57 CO 0.00 1.04 -0.57 0.35 -1.40 0.00 0.00 179.01 178.43 2jwl h PHE 58 N 0.58 0.16 0.00 4.33 3.57 -1.09 -1.70 116.94 122.80 2jwl h PHE 58 Ca 0.03 -0.06 -0.09 0.00 3.53 0.00 0.00 57.97 61.38 2jwl h PHE 58 Cb 1.02 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.72 2jwl h PHE 58 CO 0.05 0.67 -0.45 0.22 -2.23 0.00 0.00 178.31 176.57 2jwl h ASP 59 N 0.10 0.00 0.47 0.41 3.58 -1.13 -3.19 116.42 116.67 2jwl h ASP 59 Ca -0.00 0.00 -0.30 0.00 0.42 0.00 0.00 57.03 57.14 2jwl h ASP 59 Cb 1.04 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.08 2jwl h ASP 59 CO 0.08 0.45 -1.51 0.50 -2.88 0.00 0.00 179.24 175.88 2jwl h LYS 60 N 0.00 0.23 -4.15 0.28 3.64 -1.37 -3.44 116.57 111.76 2jwl h LYS 60 Ca -0.00 -0.40 -0.57 0.00 -1.27 0.00 0.00 60.65 58.41 2jwl h LYS 60 Cb 1.06 0.15 -0.38 0.00 -0.41 0.00 0.00 32.23 32.65 2jwl h LYS 60 CO 0.06 1.09 -0.79 -0.51 -2.27 0.00 0.00 179.45 177.03 2jwl s ASP 61 N -6.95 3.10 0.28 4.20 1.11 -0.65 -5.01 116.67 112.76 2jwl s ASP 61 Ca -0.08 -0.81 0.24 0.00 0.18 0.00 0.00 52.55 52.08 2jwl s ASP 61 Cb 0.07 -0.95 0.41 0.00 1.07 0.00 0.00 42.92 43.52 2jwl s ASP 61 CO 0.85 -0.21 1.51 0.78 1.18 0.00 0.00 175.17 179.28 2jwl h ASN 62 N 8.09 0.00 -0.48 0.27 4.21 -1.85 -3.30 115.58 122.52 2jwl h ASN 62 Ca -0.22 -0.04 0.00 0.00 1.21 0.00 0.00 56.30 57.25 2jwl h ASN 62 Cb 1.10 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.30 2jwl h ASN 62 CO 0.40 0.02 0.00 -3.20 -1.29 0.00 0.00 177.43 173.36 2jwl n ASN 63 N -2.63 5.08 -4.65 5.81 5.15 -1.26 -4.98 115.26 117.78 2jwl n ASN 63 Ca 0.04 -2.93 -0.43 0.00 -0.60 0.00 0.00 54.58 50.66 2jwl n ASN 63 Cb 0.49 -0.63 -0.03 0.00 -0.53 0.00 0.00 39.78 39.08 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 -2.72 3.71 -0.05 -0.44 -4.23 -1.24 -4.94 115.64 105.72 2jwl s THR 64 Ca 0.50 0.84 -0.29 0.00 -1.18 0.00 0.00 61.69 61.55 2jwl s THR 64 Cb 0.39 -3.60 -0.07 0.00 1.34 0.00 0.00 72.50 70.56 2jwl s THR 64 CO 0.14 -0.14 1.95 -0.22 -0.54 0.00 0.00 174.62 175.82 2jwl s LEU 65 N 4.34 4.16 -0.23 4.79 1.98 -1.26 -4.86 118.68 127.60 2jwl s LEU 65 Ca 0.71 2.36 -0.08 0.00 -2.89 0.00 0.00 54.13 54.22 2jwl s LEU 65 Cb -0.29 -3.53 -0.04 0.00 0.66 0.00 0.00 46.19 42.99 2jwl s LEU 65 CO 0.27 -1.25 0.09 -0.36 -1.89 0.00 0.00 176.35 173.21 2jwl s PHE 66 N 5.30 3.17 -0.00 5.38 0.08 -1.26 -0.65 117.98 129.99 2jwl s PHE 66 Ca 0.88 -0.14 0.02 0.00 0.12 0.00 0.00 56.93 57.81 2jwl s PHE 66 Cb -0.38 -2.21 -0.00 0.00 -0.57 0.00 0.00 43.02 39.85 2jwl s PHE 66 CO 0.38 -0.14 -0.06 -0.48 -0.10 0.00 0.00 175.22 174.82 2jwl s LEU 67 N 1.21 2.02 -0.02 -0.37 0.05 -0.88 -5.01 118.68 115.68 2jwl s LEU 67 Ca 0.05 -0.12 0.05 0.00 0.05 0.00 0.00 54.13 54.17 2jwl s LEU 67 Cb -0.14 -0.29 -0.01 0.00 -2.05 0.00 0.00 46.19 43.69 2jwl s LEU 67 CO 0.04 0.06 -0.18 0.54 -0.55 0.00 0.00 176.35 176.27 2jwl s VAL 68 N -0.17 1.42 0.02 1.48 0.11 -1.26 -1.52 120.40 120.48 2jwl s VAL 68 Ca 0.02 -0.76 0.01 0.00 -2.93 0.00 0.00 61.98 58.32 2jwl s VAL 68 Cb -0.02 -1.19 -0.01 0.00 -1.53 0.00 0.00 36.38 33.62 2jwl s VAL 68 CO -0.00 0.40 -0.04 -0.83 -3.33 0.00 0.00 175.10 171.31 2jwl s GLY 69 N -0.33 0.25 0.18 6.54 0.00 -0.10 -4.98 107.32 108.88 2jwl s GLY 69 Ca 0.05 -0.46 0.10 0.00 0.00 0.00 0.00 44.72 44.41 2jwl s GLY 69 CO -0.00 -0.50 -0.22 -0.32 0.00 0.00 0.00 173.10 172.06 2jwl s GLY 70 N -1.03 1.58 0.69 0.20 0.00 -1.26 -0.58 107.32 106.92 2jwl s GLY 70 Ca -0.09 -1.58 -0.11 0.00 0.00 0.00 0.00 44.72 42.94 2jwl s GLY 70 CO -0.00 -1.62 1.07 0.00 0.00 0.00 0.00 173.10 172.55 2jwl s ALA 71 N -1.81 2.95 0.45 3.20 0.00 -0.96 -4.93 121.76 120.66 2jwl s ALA 71 Ca 0.19 -0.34 0.12 0.00 0.00 0.00 0.00 51.96 51.93 2jwl s ALA 71 Cb -0.07 -3.00 1.00 0.00 0.00 0.00 0.00 23.12 21.05 2jwl s ALA 71 CO 0.09 -1.06 2.03 0.87 0.00 0.00 0.00 175.76 177.69 2jwl h LYS 72 N -0.58 0.15 -0.00 0.00 6.56 -1.97 -2.16 116.57 118.56 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 -0.03 0.00 0.00 -0.57 0.00 0.00 32.23 32.88 2jwl h LYS 72 CO 0.63 0.21 -0.13 0.39 -2.06 0.00 0.00 179.45 178.49 2jwl n GLU 73 N -4.40 0.69 -3.00 3.15 4.71 -1.26 -4.87 120.64 115.66 2jwl n GLU 73 Ca -0.01 -0.26 -0.40 0.00 -0.01 0.00 0.00 57.16 56.48 2jwl n GLU 73 Cb 0.18 -1.49 -0.05 0.00 -1.01 0.00 0.00 31.44 29.06 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 -2.49 4.64 0.31 2.62 1.01 -0.82 -5.02 120.40 120.65 2jwl s VAL 74 Ca 0.28 1.62 -0.29 0.00 0.00 0.00 0.00 61.98 63.59 2jwl s VAL 74 Cb 0.20 -4.11 -0.10 0.00 0.00 0.00 0.00 36.38 32.37 2jwl s VAL 74 CO 0.48 0.41 1.17 -2.16 0.00 0.00 0.00 175.10 175.01 2jwl s PRO 75 N -0.37 4.50 0.33 2.72 0.04 -1.26 -4.88 135.00 136.07 2jwl s PRO 75 Ca 0.37 1.95 0.01 0.00 0.04 0.00 0.00 61.00 63.37 2jwl s PRO 75 Cb -0.21 -3.11 0.55 0.00 0.04 0.00 0.00 34.50 31.77 2jwl s PRO 75 CO 0.23 0.04 1.96 -0.92 0.04 0.00 0.00 177.00 178.35 2jwl h TYR 76 N 3.57 0.84 -0.53 0.56 3.20 -1.96 -1.78 116.97 120.87 2jwl h TYR 76 Ca -0.48 -0.01 0.12 0.00 3.14 0.00 0.00 58.73 61.51 2jwl h TYR 76 Cb 1.22 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 39.19 2jwl h TYR 76 CO 0.57 0.58 0.37 0.93 -1.64 0.00 0.00 178.16 178.97 2jwl h GLU 77 N 0.87 0.18 0.01 1.82 4.39 -2.00 0.52 114.58 120.36 2jwl h GLU 77 Ca 0.23 -0.01 -0.19 0.00 0.34 0.00 0.00 59.36 59.72 2jwl h GLU 77 Cb 0.00 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.59 2jwl h GLU 77 CO -0.04 0.12 -0.89 1.49 -1.16 0.00 0.00 179.01 178.53 2jwl h GLU 78 N 0.18 0.06 -0.64 2.33 4.57 -1.71 -2.48 114.58 116.88 2jwl h GLU 78 Ca 0.25 -0.07 -0.07 0.00 -1.18 0.00 0.00 59.36 58.28 2jwl h GLU 78 Cb 0.74 0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.33 2jwl h GLU 78 CO -0.04 0.90 0.12 0.28 -1.18 0.00 0.00 179.01 179.09 2jwl h VAL 79 N 0.03 1.26 -0.34 0.32 2.07 -0.82 -0.39 116.25 118.38 2jwl h VAL 79 Ca -0.02 -1.00 0.00 0.00 0.82 0.00 0.00 66.70 66.50 2jwl h VAL 79 Cb 1.55 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 31.97 2jwl h VAL 79 CO 0.12 0.37 0.22 0.40 0.02 0.00 0.00 177.57 178.71 2jwl h ILE 80 N 0.97 1.09 -0.58 4.57 1.08 -1.23 -1.04 117.51 122.38 2jwl h ILE 80 Ca 0.20 -0.18 0.06 0.00 -0.39 0.00 0.00 64.86 64.54 2jwl h ILE 80 Cb 0.42 0.60 -0.05 0.00 -3.07 0.00 0.00 36.82 34.72 2jwl h ILE 80 CO 0.01 0.09 0.30 0.11 -0.69 0.00 0.00 178.15 177.97 2jwl h LYS 81 N 0.46 0.54 -0.26 2.37 6.56 -1.03 0.14 116.57 125.35 2jwl h LYS 81 Ca 0.13 -0.03 0.01 0.00 -1.06 0.00 0.00 60.65 59.70 2jwl h LYS 81 Cb -0.04 -0.12 -0.02 0.00 -0.57 0.00 0.00 32.23 31.48 2jwl h LYS 81 CO -0.03 0.36 0.14 0.00 -2.06 0.00 0.00 179.45 177.86 2jwl h ALA 82 N 1.32 0.31 -0.80 3.86 0.00 -0.54 -0.14 119.26 123.28 2jwl h ALA 82 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2jwl h ALA 82 Cb 0.19 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 2jwl h ALA 82 CO -0.19 -0.25 0.51 -0.07 0.00 0.00 0.00 179.25 179.25 2jwl h LEU 83 N 0.29 0.93 -0.72 0.00 3.38 -0.68 -1.81 115.31 116.71 2jwl h LEU 83 Ca 0.10 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2jwl h LEU 83 Cb 0.01 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 2jwl h LEU 83 CO -0.06 0.69 0.45 -1.13 0.09 0.00 0.00 178.44 178.48 2jwl h ASN 84 N 1.09 0.85 -0.63 -0.43 -0.73 0.24 -1.50 115.58 114.46 2jwl h ASN 84 Ca 0.29 -0.05 -0.08 0.00 1.87 0.00 0.00 56.30 58.33 2jwl h ASN 84 Cb -0.09 -0.21 -0.03 0.00 0.27 0.00 0.00 38.32 38.26 2jwl h ASN 84 CO -0.06 0.64 0.07 -0.07 -0.37 0.00 0.00 177.43 177.65 2jwl h LEU 85 N 0.98 1.04 -0.57 0.34 3.38 -0.24 -1.18 115.31 119.06 2jwl h LEU 85 Ca 0.26 -0.26 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 2jwl h LEU 85 Cb -0.06 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.39 2jwl h LEU 85 CO -0.05 1.05 0.16 -0.07 0.09 0.00 0.00 178.44 179.62 2jwl h LEU 86 N 1.00 0.84 -0.73 1.67 -0.00 -1.08 -2.44 115.31 114.57 2jwl h LEU 86 Ca 0.19 -0.22 -0.03 0.00 -0.00 0.00 0.00 57.88 57.82 2jwl h LEU 86 Cb 0.47 -0.22 -0.03 0.00 -0.00 0.00 0.00 40.66 40.88 2jwl h LEU 86 CO 0.02 0.84 0.32 -0.74 -0.00 0.00 0.00 178.44 178.88 2jwl h HIS 87 N 0.80 1.08 -0.90 1.13 2.76 -1.04 0.10 115.15 119.09 2jwl h HIS 87 Ca 0.18 -0.07 0.07 0.00 -2.20 0.00 0.00 60.37 58.35 2jwl h HIS 87 Cb 0.31 -0.33 -0.06 0.00 1.55 0.00 0.00 27.41 28.88 2jwl h HIS 87 CO 0.02 0.81 0.58 1.25 -1.30 0.00 0.00 177.93 179.30 2jwl h LEU 88 N 1.03 0.89 -1.48 0.26 6.46 -0.86 -0.67 115.31 120.94 2jwl h LEU 88 Ca 0.25 0.01 0.00 0.00 -0.12 0.00 0.00 57.88 58.01 2jwl h LEU 88 Cb 0.17 -0.18 0.00 0.00 -0.73 0.00 0.00 40.66 39.91 2jwl h LEU 88 CO -0.03 0.57 0.00 0.00 -0.62 0.00 0.00 178.44 178.36 2jwl n ALA 89 N -2.40 2.45 -3.17 1.25 0.00 -0.95 -4.94 120.51 112.75 2jwl n ALA 89 Ca 0.14 -0.70 -0.15 0.00 0.00 0.00 0.00 53.44 52.72 2jwl n ALA 89 Cb 0.21 -0.97 0.06 0.00 0.00 0.00 0.00 19.45 18.75 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 1.12 -0.12 0.12 0.00 0.00 -0.26 -4.89 105.19 101.17 2jwl n GLY 90 Ca 0.13 -0.04 -0.17 0.00 0.00 0.00 0.00 46.02 45.95 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 -3.85 1.59 -0.73 -0.61 -0.00 0.31 -5.01 119.36 111.07 2jwl n ILE 91 Ca -0.08 -0.66 0.00 0.00 -0.00 0.00 0.00 62.75 62.01 2jwl n ILE 91 Cb 0.57 -1.36 0.00 0.00 -0.00 0.00 0.00 39.64 38.85 2jwl n ILE 91 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.55 177.72