#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w6v n ALA 2 N 0.00 0.50 -2.53 3.04 0.00 -1.26 -4.95 120.51 115.31 1w6v n ALA 2 Ca 0.00 -2.04 -0.04 0.00 0.00 0.00 0.00 53.44 51.36 1w6v n ALA 2 Cb 0.00 0.40 -0.03 0.00 0.00 0.00 0.00 19.45 19.82 1w6v n ALA 2 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1w6v n GLU 3 N -2.72 -4.87 -0.18 0.00 -0.58 -1.26 -4.18 120.64 106.86 1w6v n GLU 3 Ca 0.17 3.61 -0.08 0.00 -0.42 0.00 0.00 57.16 60.44 1w6v n GLU 3 Cb 0.60 -5.02 0.02 0.00 -0.57 0.00 0.00 31.44 26.47 1w6v n GLU 3 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 1w6v h GLY 4 N 4.19 0.83 -4.50 0.62 0.00 -1.96 -3.42 103.07 98.83 1w6v h GLY 4 Ca -0.41 -0.43 -0.60 0.00 0.00 0.00 0.00 47.33 45.89 1w6v h GLY 4 CO 0.01 0.41 -0.52 -0.32 0.00 0.00 0.00 176.54 176.12 1w6v s GLY 5 N -3.02 1.97 0.00 4.60 0.00 -1.26 -4.99 107.32 104.63 1w6v s GLY 5 Ca -0.13 -0.97 0.00 0.00 0.00 0.00 0.00 44.72 43.62 1w6v s GLY 5 CO 0.77 -0.96 0.00 0.00 0.00 0.00 0.00 173.10 172.92 1w6v n ALA 6 N 0.02 0.00 -2.90 3.20 0.00 -1.26 -4.92 120.51 114.66 1w6v n ALA 6 Ca -0.07 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.15 1w6v n ALA 6 Cb 0.52 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.94 1w6v n ALA 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1w6v s ALA 7 N -1.46 3.77 0.57 0.00 0.00 -1.26 -4.93 121.76 118.45 1w6v s ALA 7 Ca 0.00 -1.28 -0.18 0.00 0.00 0.00 0.00 51.96 50.50 1w6v s ALA 7 Cb 0.00 -1.54 -0.04 0.00 0.00 0.00 0.00 23.12 21.54 1w6v s ALA 7 CO 0.00 0.30 1.12 0.34 0.00 0.00 0.00 175.76 177.52 1w6v s ASP 8 N -3.77 5.59 0.30 0.00 -1.08 -1.26 -4.74 116.67 111.71 1w6v s ASP 8 Ca 0.33 2.10 -0.02 0.00 -0.52 0.00 0.00 52.55 54.45 1w6v s ASP 8 Cb -0.09 -2.57 0.45 0.00 -1.46 0.00 0.00 42.92 39.25 1w6v s ASP 8 CO 0.27 -1.30 1.96 -0.07 0.52 0.00 0.00 175.17 176.55 1w6v h LEU 9 N 0.88 0.93 -1.65 -1.34 3.38 -1.91 0.48 115.31 116.07 1w6v h LEU 9 Ca -0.49 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.42 1w6v h LEU 9 Cb 1.25 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 1w6v h LEU 9 CO 0.56 0.69 -0.03 -0.78 0.09 0.00 0.00 178.44 178.97 1w6v h ASP 10 N 1.09 0.16 0.01 -0.43 1.82 -1.92 -1.47 116.42 115.68 1w6v h ASP 10 Ca 0.29 -0.02 -0.01 0.00 -0.39 0.00 0.00 57.03 56.91 1w6v h ASP 10 Cb -0.10 -0.04 0.00 0.00 0.68 0.00 0.00 39.33 39.87 1w6v h ASP 10 CO -0.06 0.23 -0.04 0.74 -1.61 0.00 0.00 179.24 178.50 1w6v h THR 11 N 0.18 1.79 0.15 2.25 2.02 -1.34 -3.28 112.91 114.67 1w6v h THR 11 Ca 0.04 -2.36 0.01 0.00 0.77 0.00 0.00 66.41 64.87 1w6v h THR 11 Cb 0.17 3.39 -0.04 0.00 -1.74 0.00 0.00 68.15 69.94 1w6v h THR 11 CO 0.01 0.61 -0.45 1.56 0.37 0.00 0.00 175.52 177.62 1w6v h GLN 12 N -0.97 -0.65 -0.92 6.66 4.20 0.87 0.38 115.11 124.68 1w6v h GLN 12 Ca -0.01 0.04 0.06 0.00 0.06 0.00 0.00 58.65 58.81 1w6v h GLN 12 Cb 1.03 0.15 -0.06 0.00 0.30 0.00 0.00 27.48 28.90 1w6v h GLN 12 CO 0.01 -0.43 0.60 0.07 -0.67 0.00 0.00 178.83 178.40 1w6v h ARG 13 N -0.67 1.04 0.08 1.46 -0.00 -1.61 -1.57 114.38 113.11 1w6v h ARG 13 Ca -0.01 -0.06 -0.26 0.00 -0.00 0.00 0.00 59.98 59.64 1w6v h ARG 13 Cb 0.66 -0.24 0.01 0.00 -0.00 0.00 0.00 29.97 30.41 1w6v h ARG 13 CO -0.22 0.69 -1.13 1.03 -0.00 0.00 0.00 179.97 180.34 1w6v h SER 14 N 1.07 0.61 -0.31 0.08 0.87 -1.48 -1.07 113.55 113.32 1w6v h SER 14 Ca 0.39 -0.56 -0.15 0.00 -1.23 0.00 0.00 61.79 60.24 1w6v h SER 14 Cb 0.15 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 61.92 1w6v h SER 14 CO -0.14 1.39 -0.38 -0.78 -0.53 0.00 0.00 176.83 176.39 1w6v h ASP 15 N 0.20 0.87 0.40 6.23 1.82 0.05 -1.97 116.42 124.01 1w6v h ASP 15 Ca -0.13 -0.49 -0.13 0.00 -0.39 0.00 0.00 57.03 55.89 1w6v h ASP 15 Cb 1.81 -0.25 -0.01 0.00 0.68 0.00 0.00 39.33 41.56 1w6v h ASP 15 CO 0.20 1.18 -0.56 0.40 -1.61 0.00 0.00 179.24 178.85 1w6v h ILE 16 N 0.57 1.38 -0.06 2.25 1.08 -1.35 -2.14 117.51 119.24 1w6v h ILE 16 Ca 0.04 -1.89 -0.02 0.00 -0.39 0.00 0.00 64.86 62.60 1w6v h ILE 16 Cb 0.97 1.96 -0.01 0.00 -3.07 0.00 0.00 36.82 36.68 1w6v h ILE 16 CO 0.09 0.55 -0.06 0.00 -0.69 0.00 0.00 178.15 178.05 1w6v h ALA 17 N 1.29 1.78 0.00 1.87 0.00 -0.84 0.23 119.26 123.60 1w6v h ALA 17 Ca -0.00 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 1w6v h ALA 17 Cb 1.03 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1w6v h ALA 17 CO 0.08 0.16 -0.35 1.15 0.00 0.00 0.00 179.25 180.30 1w6v h THR 18 N 0.09 0.84 0.00 0.00 2.02 -0.70 -2.72 112.91 112.45 1w6v h THR 18 Ca 0.02 -1.42 0.00 0.00 0.77 0.00 0.00 66.41 65.78 1w6v h THR 18 Cb 0.17 1.87 0.00 0.00 -1.74 0.00 0.00 68.15 68.45 1w6v h THR 18 CO 0.01 0.34 -0.46 -0.07 0.37 0.00 0.00 175.52 175.71 1w6v h LEU 19 N 0.00 0.00 0.00 2.58 3.38 -0.27 -2.21 115.31 118.79 1w6v h LEU 19 Ca -0.00 -0.06 -0.17 0.00 0.09 0.00 0.00 57.88 57.73 1w6v h LEU 19 Cb 0.85 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.57 1w6v h LEU 19 CO 0.04 0.03 -1.16 -0.07 0.09 0.00 0.00 178.44 177.38 1w6v h LEU 20 N 0.00 0.00 -0.53 1.67 3.38 -1.10 -3.12 115.31 115.62 1w6v h LEU 20 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1w6v h LEU 20 Cb 0.88 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.63 1w6v h LEU 20 CO 0.00 0.67 -0.31 2.29 0.09 0.00 0.00 178.44 181.18 1w6v n LYS 21 N -3.06 0.83 -2.57 1.13 -0.00 -1.09 -4.88 118.16 108.51 1w6v n LYS 21 Ca -0.06 -0.53 -0.40 0.00 -0.00 0.00 0.00 58.31 57.32 1w6v n LYS 21 Cb 0.85 -1.49 -0.05 0.00 -0.00 0.00 0.00 35.03 34.35 1w6v n LYS 21 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 1w6v s THR 22 N -2.53 3.78 0.44 0.58 2.01 -0.84 -5.00 115.64 114.08 1w6v s THR 22 Ca 0.23 1.71 -0.25 0.00 0.31 0.00 0.00 61.69 63.69 1w6v s THR 22 Cb 0.19 -4.09 -0.09 0.00 0.01 0.00 0.00 72.50 68.52 1w6v s THR 22 CO 0.54 0.38 1.31 -1.20 -0.69 0.00 0.00 174.62 174.96 1w6v n SER 23 N 1.61 2.69 0.00 3.53 7.64 -1.26 -4.94 113.62 122.90 1w6v n SER 23 Ca -0.00 1.10 -0.03 0.00 1.01 0.00 0.00 58.87 60.95 1w6v n SER 23 Cb 0.46 -1.53 -0.11 0.00 -1.01 0.00 0.00 64.21 62.03 1w6v n SER 23 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1w6v n LEU 24 N 0.03 0.76 -2.06 -3.43 -0.00 -1.26 -5.05 117.00 105.99 1w6v n LEU 24 Ca 0.07 0.34 0.00 0.00 -0.00 0.00 0.00 56.01 56.42 1w6v n LEU 24 Cb 0.40 0.13 0.00 0.00 -0.00 0.00 0.00 43.42 43.96 1w6v n LEU 24 CO 0.59 0.23 -0.41 0.54 -0.00 0.00 0.00 177.39 178.34 1w6v n ARG 25 N -2.90 -4.42 -1.67 1.47 3.00 -1.26 -4.37 116.66 106.52 1w6v n ARG 25 Ca -0.13 3.27 -0.43 0.00 -0.01 0.00 0.00 57.85 60.55 1w6v n ARG 25 Cb 0.91 -3.94 -0.03 0.00 0.00 0.00 0.00 32.46 29.41 1w6v n ARG 25 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 1w6v s LYS 26 N -0.89 3.45 0.00 5.56 1.02 -1.26 -0.59 119.74 127.03 1w6v s LYS 26 Ca 0.00 2.15 0.00 0.00 0.02 0.00 0.00 55.97 58.14 1w6v s LYS 26 Cb 0.00 -4.29 0.00 0.00 -0.52 0.00 0.00 37.83 33.02 1w6v s LYS 26 CO 0.00 -1.74 0.00 0.41 -0.92 0.00 0.00 175.35 173.10 1w6v n GLY 27 N 5.36 0.96 3.06 -3.33 0.00 -1.26 -5.07 105.19 104.91 1w6v n GLY 27 Ca 0.26 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.08 1w6v n GLY 27 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1w6v n ASP 28 N 0.00 0.67 -3.96 1.61 -0.08 0.24 -4.86 116.55 110.17 1w6v n ASP 28 Ca 0.00 -1.69 -0.29 0.00 -1.51 0.00 0.00 54.79 51.30 1w6v n ASP 28 Cb 0.00 -0.63 -0.16 0.00 2.34 0.00 0.00 41.12 42.66 1w6v n ASP 28 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 1w6v s THR 29 N -2.76 1.34 0.33 5.18 2.01 -1.26 -2.13 115.64 118.35 1w6v s THR 29 Ca 0.55 -0.61 0.08 0.00 0.31 0.00 0.00 61.69 62.02 1w6v s THR 29 Cb -0.02 -1.37 -0.03 0.00 0.01 0.00 0.00 72.50 71.09 1w6v s THR 29 CO 0.38 0.32 0.26 0.26 -0.69 0.00 0.00 174.62 175.14 1w6v s TRP 30 N 1.56 2.89 -0.04 4.92 0.52 0.13 -4.02 118.94 124.90 1w6v s TRP 30 Ca 0.03 -0.30 0.06 0.00 0.02 0.00 0.00 56.10 55.91 1w6v s TRP 30 Cb -0.14 -1.75 -0.01 0.00 -1.15 0.00 0.00 33.47 30.42 1w6v s TRP 30 CO -0.09 0.23 -0.22 0.71 0.02 0.00 0.00 176.95 177.60 1w6v s TYR 31 N -2.31 2.10 0.49 -1.98 2.02 0.82 0.54 117.35 119.02 1w6v s TYR 31 Ca 0.40 -0.52 -0.19 0.00 -0.37 0.00 0.00 57.07 56.40 1w6v s TYR 31 Cb -0.05 -1.37 -0.09 0.00 -0.40 0.00 0.00 41.96 40.05 1w6v s TYR 31 CO 0.26 -0.12 0.99 -0.51 -1.57 0.00 0.00 175.55 174.59 1w6v s LEU 32 N -0.30 3.75 0.00 -1.29 1.02 0.42 -0.02 118.68 122.27 1w6v s LEU 32 Ca 0.02 1.69 0.01 0.00 0.02 0.00 0.00 54.13 55.87 1w6v s LEU 32 Cb -0.11 -4.53 -0.01 0.00 0.02 0.00 0.00 46.19 41.57 1w6v s LEU 32 CO 0.01 -0.59 -0.03 -0.69 0.02 0.00 0.00 176.35 175.07 1w6v s VAL 33 N -2.36 0.26 0.33 -1.59 1.01 0.13 -4.63 120.40 113.54 1w6v s VAL 33 Ca 0.62 -0.31 -0.28 0.00 0.00 0.00 0.00 61.98 62.01 1w6v s VAL 33 Cb -0.11 -0.25 -0.10 0.00 0.00 0.00 0.00 36.38 35.92 1w6v s VAL 33 CO 0.24 -0.04 1.18 1.51 0.00 0.00 0.00 175.10 177.99 1w6v s ASP 34 N -0.37 6.92 0.51 3.32 -4.77 -1.26 0.75 116.67 121.77 1w6v s ASP 34 Ca -0.02 2.42 0.30 0.00 -3.30 0.00 0.00 52.55 51.95 1w6v s ASP 34 Cb -0.03 -2.63 1.26 0.00 -1.09 0.00 0.00 42.92 40.43 1w6v s ASP 34 CO -0.00 -0.40 1.95 0.77 0.70 0.00 0.00 175.17 178.19 1w6v h SER 35 N 3.36 0.00 -0.15 2.11 4.64 -1.69 -3.04 113.55 118.78 1w6v h SER 35 Ca -0.48 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 60.63 1w6v h SER 35 Cb 1.22 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.32 1w6v h SER 35 CO 0.65 0.10 -0.73 0.03 -0.87 0.00 0.00 176.83 176.02 1w6v h ARG 36 N 0.00 0.76 -0.15 4.77 3.08 -1.91 0.32 114.38 121.25 1w6v h ARG 36 Ca -0.00 -0.62 -0.01 0.00 0.07 0.00 0.00 59.98 59.42 1w6v h ARG 36 Cb 0.55 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.72 1w6v h ARG 36 CO 0.01 1.23 0.05 2.35 -1.07 0.00 0.00 179.97 182.54 1w6v h TRP 37 N 0.48 0.24 -0.51 3.04 7.01 -1.89 0.18 115.95 124.51 1w6v h TRP 37 Ca -0.05 -0.02 -0.03 0.00 2.11 0.00 0.00 58.89 60.90 1w6v h TRP 37 Cb 1.36 -0.07 -0.02 0.00 -2.10 0.00 0.00 29.16 28.33 1w6v h TRP 37 CO 0.09 0.33 0.20 0.35 -2.79 0.00 0.00 178.44 176.62 1w6v h PHE 38 N 0.08 0.78 -0.34 2.65 3.04 -1.48 0.23 116.94 121.90 1w6v h PHE 38 Ca 0.05 -0.06 -0.04 0.00 3.98 0.00 0.00 57.97 61.90 1w6v h PHE 38 Cb 0.20 -0.23 -0.02 0.00 2.56 0.00 0.00 35.95 38.46 1w6v h PHE 38 CO -0.01 0.65 0.05 0.87 -2.02 0.00 0.00 178.31 177.86 1w6v h LYS 39 N 0.69 0.50 -0.41 1.11 1.57 -0.13 0.29 116.57 120.18 1w6v h LYS 39 Ca 0.17 -0.09 -0.05 0.00 -1.87 0.00 0.00 60.65 58.81 1w6v h LYS 39 Cb 0.20 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 1w6v h LYS 39 CO -0.01 0.49 0.06 0.37 -0.57 0.00 0.00 179.45 179.78 1w6v h GLN 40 N 0.49 0.69 -0.82 3.15 5.75 -0.47 -2.88 115.11 121.02 1w6v h GLN 40 Ca 0.11 -0.19 0.03 0.00 -0.15 0.00 0.00 58.65 58.45 1w6v h GLN 40 Cb 0.24 -0.08 -0.05 0.00 1.07 0.00 0.00 27.48 28.66 1w6v h GLN 40 CO 0.00 0.74 0.53 2.35 -2.65 0.00 0.00 178.83 179.80 1w6v h TRP 41 N 0.54 1.00 -0.87 3.99 7.01 0.44 -2.50 115.95 125.56 1w6v h TRP 41 Ca 0.12 0.03 0.12 0.00 2.11 0.00 0.00 58.89 61.27 1w6v h TRP 41 Cb 0.39 -0.33 -0.08 0.00 -2.10 0.00 0.00 29.16 27.03 1w6v h TRP 41 CO 0.03 0.58 0.50 0.87 -2.79 0.00 0.00 178.44 177.63 1w6v h LYS 42 N 1.04 0.76 -0.06 2.65 1.57 -0.26 0.28 116.57 122.56 1w6v h LYS 42 Ca 0.32 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 59.05 1w6v h LYS 42 Cb -0.02 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.12 1w6v h LYS 42 CO -0.10 0.50 0.02 0.87 -0.57 0.00 0.00 179.45 180.17 1w6v h LYS 43 N 0.78 0.08 -0.54 3.15 1.57 -1.40 0.16 116.57 120.37 1w6v h LYS 43 Ca 0.44 -0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 59.13 1w6v h LYS 43 Cb 0.50 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.77 1w6v h LYS 43 CO -0.29 0.23 0.01 -0.92 -0.57 0.00 0.00 179.45 177.91 1w6v h TYR 44 N -0.08 1.02 0.00 -1.35 3.20 -0.80 -2.25 116.97 116.71 1w6v h TYR 44 Ca 0.02 -0.17 -0.04 0.00 3.14 0.00 0.00 58.73 61.68 1w6v h TYR 44 Cb 0.18 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.17 1w6v h TYR 44 CO -0.02 0.93 -1.12 1.55 -1.64 0.00 0.00 178.16 177.87 1w6v n VAL 45 N -4.29 0.73 -1.64 1.81 3.14 0.88 -0.02 118.33 118.94 1w6v n VAL 45 Ca 0.02 -0.58 0.00 0.00 -2.96 0.00 0.00 64.34 60.82 1w6v n VAL 45 Cb 0.32 -0.41 0.00 0.00 -1.06 0.00 0.00 33.84 32.69 1w6v n VAL 45 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1w6v n GLY 46 N 1.23 0.82 0.19 7.55 0.00 0.23 -4.63 105.19 110.59 1w6v n GLY 46 Ca -0.02 -0.63 -0.18 0.00 0.00 0.00 0.00 46.02 45.19 1w6v n GLY 46 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1w6v h PHE 47 N 0.00 0.93 -3.41 1.61 3.04 -1.07 -3.42 116.94 114.62 1w6v h PHE 47 Ca 0.00 -0.46 -0.60 0.00 3.98 0.00 0.00 57.97 60.89 1w6v h PHE 47 Cb 0.76 -0.13 -0.10 0.00 2.56 0.00 0.00 35.95 39.05 1w6v h PHE 47 CO 0.00 1.28 0.22 0.34 -2.02 0.00 0.00 178.31 178.14 1w6v s ASP 48 N -7.04 6.69 0.39 0.41 -1.08 -1.23 -4.94 116.67 109.87 1w6v s ASP 48 Ca -0.11 0.84 0.26 0.00 -0.52 0.00 0.00 52.55 53.02 1w6v s ASP 48 Cb 0.07 -2.37 1.42 0.00 -1.46 0.00 0.00 42.92 40.58 1w6v s ASP 48 CO 0.89 -0.37 1.80 0.28 0.52 0.00 0.00 175.17 178.29 1w6v h SER 49 N 7.68 0.00 -0.00 -0.34 0.02 -1.94 0.32 113.55 119.29 1w6v h SER 49 Ca -0.28 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 1w6v h SER 49 Cb 1.12 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.66 1w6v h SER 49 CO 0.80 0.00 -0.75 -2.67 -1.14 0.00 0.00 176.83 173.06 1w6v n TRP 50 N -2.42 0.00 -3.55 3.45 4.27 -1.26 -4.72 117.44 113.21 1w6v n TRP 50 Ca -0.02 0.00 -0.27 0.00 -3.89 0.00 0.00 57.50 53.32 1w6v n TRP 50 Cb 0.04 0.00 -0.09 0.00 -1.36 0.00 0.00 31.31 29.90 1w6v n TRP 50 CO 0.00 0.00 0.00 -3.47 -2.29 0.00 0.00 177.69 171.93 1w6v n ASP 51 N -1.27 3.14 -0.57 -0.67 -0.08 0.10 -4.72 116.55 112.49 1w6v n ASP 51 Ca 0.04 -3.29 0.06 0.00 -1.51 0.00 0.00 54.79 50.10 1w6v n ASP 51 Cb 0.27 -0.69 0.18 0.00 2.34 0.00 0.00 41.12 43.23 1w6v n ASP 51 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1w6v n LYS 52 N 1.30 1.42 0.10 -0.67 4.01 -1.26 -4.47 118.16 118.59 1w6v n LYS 52 Ca 0.26 -3.08 -0.00 0.00 -0.51 0.00 0.00 58.31 54.98 1w6v n LYS 52 Cb 0.40 -1.49 -0.03 0.00 -0.51 0.00 0.00 35.03 33.41 1w6v n LYS 52 CO 0.00 0.00 0.00 1.88 -1.11 0.00 0.00 177.40 178.17 1w6v h TYR 53 N 0.83 0.00 -0.09 2.13 -1.99 -1.84 -3.15 116.97 112.86 1w6v h TYR 53 Ca -0.01 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.72 1w6v h TYR 53 Cb 1.06 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.79 1w6v h TYR 53 CO 0.59 0.63 0.00 1.04 -0.00 0.00 0.00 178.16 180.43 1w6v n GLN 54 N -3.20 2.22 -1.89 4.88 1.13 -1.26 -4.84 117.38 114.43 1w6v n GLN 54 Ca -0.01 -1.78 -0.42 0.00 -1.94 0.00 0.00 57.00 52.84 1w6v n GLN 54 Cb 0.80 -1.47 -0.03 0.00 0.11 0.00 0.00 30.24 29.66 1w6v n GLN 54 CO 0.00 0.00 0.00 1.41 -1.44 0.00 0.00 177.06 177.03 1w6v s MET 55 N -1.92 3.89 0.00 -1.09 1.75 -0.85 -0.73 119.30 120.35 1w6v s MET 55 Ca 0.32 2.12 0.00 0.00 -1.25 0.00 0.00 55.69 56.87 1w6v s MET 55 Cb 0.20 -4.11 0.00 0.00 2.84 0.00 0.00 34.83 33.77 1w6v s MET 55 CO 0.31 -1.20 0.00 0.41 -0.65 0.00 0.00 175.02 173.89 1w6v n GLY 56 N 4.65 0.79 3.81 2.11 0.00 0.97 -5.00 105.19 112.52 1w6v n GLY 56 Ca 0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.88 1w6v n GLY 56 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1w6v s ASP 57 N -2.61 7.07 0.27 1.61 -1.08 0.09 -4.95 116.67 117.06 1w6v s ASP 57 Ca 0.00 1.62 0.20 0.00 -0.52 0.00 0.00 52.55 53.84 1w6v s ASP 57 Cb 0.00 -2.50 0.10 0.00 -1.46 0.00 0.00 42.92 39.06 1w6v s ASP 57 CO 0.00 -0.16 1.29 0.06 0.52 0.00 0.00 175.17 176.87 1w6v h GLN 58 N 2.67 0.00 -0.17 4.34 3.07 -1.95 -3.27 115.11 119.80 1w6v h GLN 58 Ca -0.48 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.25 1w6v h GLN 58 Cb 1.19 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.74 1w6v h GLN 58 CO 0.64 0.18 0.07 -0.91 0.09 0.00 0.00 178.83 178.90 1w6v h ASN 59 N 0.00 0.20 -0.45 0.06 2.35 -1.92 -2.29 115.58 113.53 1w6v h ASN 59 Ca -0.03 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 1w6v h ASN 59 Cb 1.20 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 39.52 1w6v h ASN 59 CO 0.02 0.19 0.00 1.33 -1.65 0.00 0.00 177.43 177.32 1w6v n VAL 60 N -4.47 0.85 -1.66 2.81 0.24 -1.23 -4.94 118.33 109.92 1w6v n VAL 60 Ca -0.00 -0.92 -0.42 0.00 -2.04 0.00 0.00 64.34 60.95 1w6v n VAL 60 Cb 0.11 0.63 -0.03 0.00 -1.47 0.00 0.00 33.84 33.08 1w6v n VAL 60 CO 0.00 0.00 0.00 -0.72 -2.14 0.00 0.00 176.83 173.97 1w6v s TYR 61 N -1.06 1.25 -0.39 6.34 1.13 -0.87 -4.49 117.35 119.26 1w6v s TYR 61 Ca 0.33 -0.38 -0.23 0.00 -1.41 0.00 0.00 57.07 55.38 1w6v s TYR 61 Cb 0.18 -4.22 0.01 0.00 -1.10 0.00 0.00 41.96 36.83 1w6v s TYR 61 CO 0.23 -5.47 0.77 -1.25 -2.51 0.00 0.00 175.55 167.32 1w6v s PRO 62 N 4.65 3.63 0.00 -3.49 0.05 -1.26 -5.05 135.00 133.53 1w6v s PRO 62 Ca 0.90 0.14 0.00 0.00 0.05 0.00 0.00 61.00 62.09 1w6v s PRO 62 Cb -0.42 -3.85 0.00 0.00 0.05 0.00 0.00 34.50 30.28 1w6v s PRO 62 CO 0.41 -0.93 0.00 0.41 0.05 0.00 0.00 177.00 176.94 1w6v n GLY 63 N 4.70 -1.68 3.76 0.56 0.00 -1.26 -4.92 105.19 106.36 1w6v n GLY 63 Ca 0.02 -1.01 -0.41 0.00 0.00 0.00 0.00 46.02 44.62 1w6v n GLY 63 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1w6v s PRO 64 N 0.00 4.25 0.11 1.61 0.02 -1.20 -4.77 135.00 135.02 1w6v s PRO 64 Ca 0.00 2.36 -0.31 0.00 0.02 0.00 0.00 61.00 63.07 1w6v s PRO 64 Cb 0.00 -3.06 -0.10 0.00 0.02 0.00 0.00 34.50 31.36 1w6v s PRO 64 CO 0.00 -0.40 1.88 0.42 -0.33 0.00 0.00 177.00 178.57 1w6v s ILE 65 N -0.55 2.59 -0.33 2.83 1.01 0.07 -4.49 121.20 122.33 1w6v s ILE 65 Ca 0.55 0.00 0.00 0.00 0.00 0.00 0.00 60.65 61.21 1w6v s ILE 65 Cb -0.43 -3.00 0.08 0.00 0.01 0.00 0.00 42.46 39.12 1w6v s ILE 65 CO 0.50 -0.00 0.05 -0.62 0.00 0.00 0.00 174.94 174.87 1w6v s ASP 66 N 3.11 4.89 -0.04 3.58 2.15 -1.26 -1.03 116.67 128.06 1w6v s ASP 66 Ca 0.83 -1.74 0.16 0.00 0.43 0.00 0.00 52.55 52.23 1w6v s ASP 66 Cb -0.46 -1.70 0.53 0.00 -0.30 0.00 0.00 42.92 40.99 1w6v s ASP 66 CO 0.38 -0.36 1.42 0.59 -0.17 0.00 0.00 175.17 177.03 1w6v n ASN 67 N 4.48 3.39 -0.13 -0.34 3.02 -1.26 -4.40 115.26 120.02 1w6v n ASN 67 Ca -0.06 -2.17 0.10 0.00 -0.03 0.00 0.00 54.58 52.42 1w6v n ASN 67 Cb 0.42 -0.44 0.45 0.00 -0.61 0.00 0.00 39.78 39.60 1w6v n ASN 67 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1w6v h SER 68 N 3.21 0.48 0.99 6.41 0.02 -1.91 0.15 113.55 122.90 1w6v h SER 68 Ca 0.00 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1w6v h SER 68 Cb 0.96 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.41 1w6v h SER 68 CO 0.09 0.29 0.00 1.23 -1.14 0.00 0.00 176.83 177.30 1w6v h GLY 69 N 0.53 0.00 0.63 -3.77 0.00 -1.99 -2.72 103.07 95.75 1w6v h GLY 69 Ca 0.30 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.30 1w6v h GLY 69 CO -0.09 0.00 -1.96 1.04 0.00 0.00 0.00 176.54 175.53 1w6v n LEU 70 N -2.48 0.92 -4.78 3.11 4.77 0.41 -4.93 117.00 114.02 1w6v n LEU 70 Ca 0.02 0.26 -0.36 0.00 -0.03 0.00 0.00 56.01 55.90 1w6v n LEU 70 Cb 0.30 0.07 -0.05 0.00 -2.33 0.00 0.00 43.42 41.41 1w6v n LEU 70 CO 0.24 0.49 0.71 -0.76 -1.33 0.00 0.00 177.39 176.75 1w6v s LEU 71 N -6.05 4.16 1.04 2.23 1.43 -0.42 -0.62 118.68 120.45 1w6v s LEU 71 Ca -0.09 1.97 -0.14 0.00 -1.03 0.00 0.00 54.13 54.84 1w6v s LEU 71 Cb 0.07 -4.18 0.21 0.00 0.03 0.00 0.00 46.19 42.32 1w6v s LEU 71 CO 0.81 -0.41 1.11 -0.54 0.23 0.00 0.00 176.35 177.55 1w6v s LYS 72 N -2.47 0.08 -0.65 1.70 1.02 0.23 -4.68 119.74 114.98 1w6v s LYS 72 Ca 0.57 0.33 -0.27 0.00 0.02 0.00 0.00 55.97 56.61 1w6v s LYS 72 Cb -0.20 -1.71 0.01 0.00 -0.52 0.00 0.00 37.83 35.40 1w6v s LYS 72 CO 0.26 -2.92 1.53 -0.51 -0.92 0.00 0.00 175.35 172.78 1w6v s ASP 73 N -3.64 5.83 0.00 2.83 1.01 -1.26 -3.19 116.67 118.25 1w6v s ASP 73 Ca 0.67 0.02 0.00 0.00 0.71 0.00 0.00 52.55 53.95 1w6v s ASP 73 Cb -0.16 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.22 1w6v s ASP 73 CO 0.57 -2.00 0.00 0.61 0.21 0.00 0.00 175.17 174.56 1w6v n GLY 74 N 5.47 2.40 3.26 0.21 0.00 -1.26 -5.04 105.19 110.22 1w6v n GLY 74 Ca 0.12 -0.69 -0.32 0.00 0.00 0.00 0.00 46.02 45.13 1w6v n GLY 74 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1w6v s ASP 75 N -0.14 3.28 0.00 1.61 1.11 -1.19 -4.97 116.67 116.37 1w6v s ASP 75 Ca 0.00 -0.50 0.22 0.00 0.18 0.00 0.00 52.55 52.45 1w6v s ASP 75 Cb 0.00 -1.35 0.86 0.00 1.07 0.00 0.00 42.92 43.50 1w6v s ASP 75 CO 0.00 0.18 1.61 0.00 1.18 0.00 0.00 175.17 178.14 1w6v n ALA 76 N 3.41 2.54 0.03 5.23 0.00 -1.26 -2.85 120.51 127.61 1w6v n ALA 76 Ca -0.19 -0.47 0.02 0.00 0.00 0.00 0.00 53.44 52.80 1w6v n ALA 76 Cb 0.53 -1.13 0.03 0.00 0.00 0.00 0.00 19.45 18.88 1w6v n ALA 76 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1w6v n GLN 77 N 0.19 1.43 -4.55 0.00 1.13 -1.26 -4.70 117.38 109.61 1w6v n GLN 77 Ca 0.17 -1.25 -0.31 0.00 -1.94 0.00 0.00 57.00 53.67 1w6v n GLN 77 Cb 0.31 -1.08 -0.17 0.00 0.11 0.00 0.00 30.24 29.42 1w6v n GLN 77 CO 0.00 0.00 0.00 -1.12 -1.44 0.00 0.00 177.06 174.50 1w6v s SER 78 N -0.69 2.78 0.36 1.08 0.01 -1.22 -5.05 113.70 110.97 1w6v s SER 78 Ca 0.06 -0.52 -0.15 0.00 1.31 0.00 0.00 55.95 56.66 1w6v s SER 78 Cb 0.03 -1.27 -0.09 0.00 0.21 0.00 0.00 66.02 64.91 1w6v s SER 78 CO 0.05 0.05 0.77 -0.76 0.41 0.00 0.00 173.24 173.76 1w6v s LEU 79 N 0.92 3.99 0.83 2.44 2.01 -1.26 0.78 118.68 128.39 1w6v s LEU 79 Ca -0.07 1.31 -0.12 0.00 0.01 0.00 0.00 54.13 55.26 1w6v s LEU 79 Cb -0.15 -4.13 0.09 0.00 0.01 0.00 0.00 46.19 42.01 1w6v s LEU 79 CO -0.02 -0.28 1.13 -0.54 1.01 0.00 0.00 176.35 177.66 1w6v s LYS 80 N -3.22 1.78 -0.01 1.70 1.02 0.21 -4.59 119.74 116.64 1w6v s LYS 80 Ca 0.55 0.34 -0.21 0.00 0.02 0.00 0.00 55.97 56.66 1w6v s LYS 80 Cb -0.10 -1.91 -0.21 0.00 -0.52 0.00 0.00 37.83 35.09 1w6v s LYS 80 CO 0.20 -1.76 1.14 0.93 -0.92 0.00 0.00 175.35 174.94 1w6v h GLU 81 N -1.19 0.32 -0.00 1.68 4.39 -1.98 -3.33 114.58 114.47 1w6v h GLU 81 Ca -0.48 -0.28 0.00 0.00 0.34 0.00 0.00 59.36 58.94 1w6v h GLU 81 Cb 1.31 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 30.02 1w6v h GLU 81 CO 0.63 0.95 -0.00 0.72 -1.16 0.00 0.00 179.01 180.14 1w6v n HIS 82 N -4.41 0.00 -1.70 4.33 8.25 -1.26 -4.86 115.22 115.57 1w6v n HIS 82 Ca -0.09 0.00 -0.44 0.00 -0.26 0.00 0.00 57.72 56.93 1w6v n HIS 82 Cb 0.53 -0.01 -0.03 0.00 1.12 0.00 0.00 29.99 31.61 1w6v n HIS 82 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1w6v n LEU 83 N -0.86 3.65 -4.47 2.41 4.32 -1.25 -5.00 117.00 115.79 1w6v n LEU 83 Ca 0.23 1.12 -0.23 0.00 -0.02 0.00 0.00 56.01 57.10 1w6v n LEU 83 Cb 0.15 -1.51 -0.09 0.00 -1.62 0.00 0.00 43.42 40.35 1w6v n LEU 83 CO 0.18 -0.13 -0.23 -0.63 -1.22 0.00 0.00 177.39 175.37 1w6v s ILE 84 N 0.38 0.79 0.00 -0.08 1.01 -1.26 -5.04 121.20 116.99 1w6v s ILE 84 Ca 0.70 -2.00 0.00 0.00 0.00 0.00 0.00 60.65 59.35 1w6v s ILE 84 Cb -0.58 -2.52 0.00 0.00 0.01 0.00 0.00 42.46 39.36 1w6v s ILE 84 CO 0.44 0.00 0.00 -0.67 0.00 0.00 0.00 174.94 174.71 1w6v n ASP 85 N -1.01 0.00 0.25 3.58 2.03 -1.26 -2.23 116.55 117.90 1w6v n ASP 85 Ca -0.04 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.27 1w6v n ASP 85 Cb 0.66 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.06 1w6v n ASP 85 CO 0.00 0.00 0.00 -1.84 -1.92 0.00 0.00 177.20 173.44 1w6v n GLU 86 N 0.00 0.02 -0.11 -0.67 -0.00 0.38 0.57 120.64 120.83 1w6v n GLU 86 Ca 0.00 0.71 -0.09 0.00 -0.00 0.00 0.00 57.16 57.79 1w6v n GLU 86 Cb 0.00 -2.35 -0.01 0.00 -0.00 0.00 0.00 31.44 29.08 1w6v n GLU 86 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.13 177.06 1w6v h LEU 87 N 0.00 0.43 0.00 -1.84 3.38 -1.99 -3.40 115.31 111.89 1w6v h LEU 87 Ca 0.00 -0.05 -0.12 0.00 0.09 0.00 0.00 57.88 57.80 1w6v h LEU 87 Cb 1.71 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 42.34 1w6v h LEU 87 CO 0.00 0.35 -1.41 -0.67 0.09 0.00 0.00 178.44 176.81 1w6v n ASP 88 N -4.80 1.76 -1.03 -0.43 -0.08 0.19 -4.94 116.55 107.22 1w6v n ASP 88 Ca -0.00 0.04 0.00 0.00 -1.51 0.00 0.00 54.79 53.31 1w6v n ASP 88 Cb 0.05 -0.17 0.00 0.00 2.34 0.00 0.00 41.12 43.34 1w6v n ASP 88 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1w6v n TYR 89 N -3.07 0.00 -3.86 -0.67 0.18 -0.18 -2.51 117.16 107.05 1w6v n TYR 89 Ca -0.14 0.00 -0.09 0.00 1.88 0.00 0.00 57.90 59.55 1w6v n TYR 89 Cb 0.61 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 39.51 1w6v n TYR 89 CO 0.00 0.00 0.00 0.42 -2.08 0.00 0.00 176.86 175.20 1w6v s ILE 90 N -1.85 0.09 0.09 -3.48 1.01 0.23 -0.47 121.20 116.81 1w6v s ILE 90 Ca 0.00 -1.15 0.10 0.00 0.00 0.00 0.00 60.65 59.60 1w6v s ILE 90 Cb 0.00 -1.57 -0.03 0.00 0.01 0.00 0.00 42.46 40.87 1w6v s ILE 90 CO 0.00 -0.39 -0.27 -0.76 0.00 0.00 0.00 174.94 173.52 1w6v s LEU 91 N -2.90 2.25 0.15 2.97 2.01 -1.26 0.20 118.68 122.10 1w6v s LEU 91 Ca 0.11 -0.68 0.09 0.00 0.01 0.00 0.00 54.13 53.66 1w6v s LEU 91 Cb 0.03 -1.24 -0.04 0.00 0.01 0.00 0.00 46.19 44.95 1w6v s LEU 91 CO -0.05 0.21 -0.20 -0.76 1.01 0.00 0.00 176.35 176.56 1w6v s LEU 92 N -1.68 2.40 1.10 1.79 2.01 0.97 -4.91 118.68 120.35 1w6v s LEU 92 Ca 0.13 -0.81 -0.12 0.00 0.01 0.00 0.00 54.13 53.33 1w6v s LEU 92 Cb -0.10 -0.89 0.24 0.00 0.01 0.00 0.00 46.19 45.45 1w6v s LEU 92 CO 0.04 0.01 1.05 -2.16 1.01 0.00 0.00 176.35 176.31 1w6v s PRO 93 N -2.52 -0.37 0.26 1.29 0.04 -1.26 -0.13 135.00 132.31 1w6v s PRO 93 Ca 0.14 0.84 -0.06 0.00 0.04 0.00 0.00 61.00 61.96 1w6v s PRO 93 Cb -0.07 -1.62 0.47 0.00 0.04 0.00 0.00 34.50 33.32 1w6v s PRO 93 CO 0.06 -3.36 1.61 1.15 0.04 0.00 0.00 177.00 176.50 1w6v h THR 94 N -2.36 0.23 -0.50 1.26 2.02 -1.94 0.17 112.91 111.79 1w6v h THR 94 Ca -0.58 -0.02 -0.11 0.00 0.77 0.00 0.00 66.41 66.47 1w6v h THR 94 Cb 1.32 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 67.88 1w6v h THR 94 CO 0.51 0.01 -0.13 -0.33 0.37 0.00 0.00 175.52 175.95 1w6v h GLU 95 N 0.06 0.94 0.09 6.66 4.39 -1.95 0.20 114.58 124.96 1w6v h GLU 95 Ca 0.44 -0.34 -0.00 0.00 0.34 0.00 0.00 59.36 59.80 1w6v h GLU 95 Cb 0.79 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.37 1w6v h GLU 95 CO -0.77 1.00 -0.04 0.78 -1.16 0.00 0.00 179.01 178.82 1w6v h GLY 96 N 0.95 -0.12 0.97 -3.84 0.00 -1.35 0.14 103.07 99.82 1w6v h GLY 96 Ca 0.13 0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.51 1w6v h GLY 96 CO 0.05 -0.05 0.06 -0.25 0.00 0.00 0.00 176.54 176.36 1w6v h TRP 97 N -0.31 0.12 -0.98 5.60 2.91 -1.10 -1.77 115.95 120.41 1w6v h TRP 97 Ca -0.01 0.00 0.19 0.00 1.13 0.00 0.00 58.89 60.21 1w6v h TRP 97 Cb 0.26 -0.04 -0.09 0.00 -0.51 0.00 0.00 29.16 28.78 1w6v h TRP 97 CO -0.01 0.07 0.61 -0.91 -1.03 0.00 0.00 178.44 177.18 1w6v h ASN 98 N 0.14 0.68 0.03 2.65 2.35 -0.32 0.21 115.58 121.32 1w6v h ASN 98 Ca 0.04 0.08 -0.00 0.00 -0.55 0.00 0.00 56.30 55.87 1w6v h ASN 98 Cb -0.00 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.32 1w6v h ASN 98 CO -0.02 0.25 -0.01 0.11 -1.65 0.00 0.00 177.43 176.11 1w6v h LYS 99 N 0.67 -0.04 -0.10 0.81 1.57 -0.07 0.32 116.57 119.73 1w6v h LYS 99 Ca 0.55 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 59.24 1w6v h LYS 99 Cb 0.98 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.28 1w6v h LYS 99 CO -0.32 0.26 -0.34 -0.07 -0.57 0.00 0.00 179.45 178.42 1w6v h LEU 100 N -0.34 0.19 0.00 2.94 3.38 -0.48 0.26 115.31 121.27 1w6v h LEU 100 Ca -0.00 -0.07 -0.10 0.00 0.09 0.00 0.00 57.88 57.80 1w6v h LEU 100 Cb 0.32 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1w6v h LEU 100 CO 0.01 0.53 -0.51 0.58 0.09 0.00 0.00 178.44 179.14 1w6v h VAL 101 N 0.17 0.82 0.07 1.22 2.07 -0.52 1.00 116.25 121.07 1w6v h VAL 101 Ca 0.02 -2.16 -0.25 0.00 0.82 0.00 0.00 66.70 65.13 1w6v h VAL 101 Cb 0.68 2.40 0.00 0.00 -1.52 0.00 0.00 31.29 32.85 1w6v h VAL 101 CO 0.05 0.47 -1.11 -1.28 0.02 0.00 0.00 177.57 175.72 1w6v h SER 102 N 0.00 0.45 0.02 0.57 0.87 0.14 -0.84 113.55 114.76 1w6v h SER 102 Ca -0.01 -0.42 -0.10 0.00 -1.23 0.00 0.00 61.79 60.03 1w6v h SER 102 Cb 1.38 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 63.19 1w6v h SER 102 CO 0.06 1.28 -0.52 -0.50 -0.53 0.00 0.00 176.83 176.62 1w6v h TRP 103 N 0.13 0.10 0.00 2.24 6.55 -0.55 -3.42 115.95 120.99 1w6v h TRP 103 Ca -0.11 -0.07 0.00 0.00 0.95 0.00 0.00 58.89 59.66 1w6v h TRP 103 Cb 1.80 -0.00 0.00 0.00 -0.86 0.00 0.00 29.16 30.09 1w6v h TRP 103 CO 0.06 1.20 0.00 0.66 -1.05 0.00 0.00 178.44 179.31 1w6v n TYR 104 N -4.45 0.00 -1.58 0.49 4.01 0.30 -4.98 117.16 110.94 1w6v n TYR 104 Ca -0.17 -0.16 0.03 0.00 -0.16 0.00 0.00 57.90 57.43 1w6v n TYR 104 Cb 0.60 -0.02 -0.01 0.00 -0.31 0.00 0.00 39.34 39.61 1w6v n TYR 104 CO 0.00 0.00 0.00 -2.37 -0.46 0.00 0.00 176.86 174.03 1w6v n THR 105 N -0.16 0.00 -4.05 -0.72 5.66 -0.32 -3.21 114.28 111.48 1w6v n THR 105 Ca 0.00 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.71 1w6v n THR 105 Cb 0.30 -0.07 -0.06 0.00 -1.55 0.00 0.00 70.33 68.95 1w6v n THR 105 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 1w6v s LEU 106 N 0.00 3.84 0.76 1.09 0.20 -1.26 -0.75 118.68 122.56 1w6v s LEU 106 Ca 0.00 -0.03 -0.14 0.00 0.69 0.00 0.00 54.13 54.65 1w6v s LEU 106 Cb 0.00 -2.49 0.05 0.00 -0.43 0.00 0.00 46.19 43.32 1w6v s LEU 106 CO 0.00 0.13 1.17 -0.04 -0.29 0.00 0.00 176.35 177.32 1w6v s MET 107 N -2.66 2.06 0.23 1.98 -1.94 -0.20 -4.59 119.30 114.18 1w6v s MET 107 Ca 0.30 1.59 -0.30 0.00 -1.71 0.00 0.00 55.69 55.58 1w6v s MET 107 Cb -0.11 -1.84 -0.09 0.00 2.01 0.00 0.00 34.83 34.80 1w6v s MET 107 CO 0.23 -1.86 1.09 -1.83 -0.01 0.00 0.00 175.02 172.64 1w6v s GLU 108 N -4.18 4.63 0.00 2.03 1.03 -1.26 -2.93 118.70 118.02 1w6v s GLU 108 Ca 0.70 1.75 0.00 0.00 0.03 0.00 0.00 54.97 57.45 1w6v s GLU 108 Cb -0.25 -3.24 0.00 0.00 -0.80 0.00 0.00 34.13 29.84 1w6v s GLU 108 CO 0.48 0.16 0.00 0.41 -1.33 0.00 0.00 175.26 174.98 1w6v n GLY 109 N 1.64 0.75 3.60 -3.83 0.00 -1.26 -5.03 105.19 101.06 1w6v n GLY 109 Ca 0.01 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1w6v n GLY 109 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1w6v s GLN 110 N -0.49 1.92 0.07 1.61 -0.21 -1.15 -4.96 119.66 116.46 1w6v s GLN 110 Ca 0.00 -2.07 0.01 0.00 0.02 0.00 0.00 55.36 53.32 1w6v s GLN 110 Cb 0.00 -1.61 -0.04 0.00 1.00 0.00 0.00 33.01 32.37 1w6v s GLN 110 CO 0.00 -0.03 -0.05 -1.21 -2.12 0.00 0.00 175.29 171.88 1w6v s GLU 111 N -3.70 0.70 0.22 2.91 2.02 -1.26 -4.91 118.70 114.67 1w6v s GLU 111 Ca 0.35 -1.22 -0.30 0.00 0.02 0.00 0.00 54.97 53.82 1w6v s GLU 111 Cb 0.09 -0.02 -0.09 0.00 0.10 0.00 0.00 34.13 34.20 1w6v s GLU 111 CO 0.18 -0.05 1.39 -2.14 0.02 0.00 0.00 175.26 174.65 1w6v s PRO 112 N -3.61 4.32 -0.48 0.39 0.02 -1.26 -4.96 135.00 129.42 1w6v s PRO 112 Ca 0.07 2.20 -0.19 0.00 0.02 0.00 0.00 61.00 63.10 1w6v s PRO 112 Cb 0.05 -3.15 0.05 0.00 0.02 0.00 0.00 34.50 31.47 1w6v s PRO 112 CO -0.06 -0.36 0.57 0.42 -0.33 0.00 0.00 177.00 177.24 1w6v s ILE 113 N 0.10 4.93 -0.16 2.83 1.09 -1.26 -5.01 121.20 123.73 1w6v s ILE 113 Ca 0.59 -0.41 -0.16 0.00 -1.10 0.00 0.00 60.65 59.56 1w6v s ILE 113 Cb -0.40 -4.22 -0.04 0.00 -1.06 0.00 0.00 42.46 36.74 1w6v s ILE 113 CO 0.40 -0.68 0.39 0.00 -0.10 0.00 0.00 174.94 174.95 1w6v s ALA 114 N 2.49 3.54 -0.18 9.38 0.00 -1.26 -0.44 121.76 135.30 1w6v s ALA 114 Ca 0.15 -0.38 0.01 0.00 0.00 0.00 0.00 51.96 51.73 1w6v s ALA 114 Cb -0.18 -2.56 0.02 0.00 0.00 0.00 0.00 23.12 20.39 1w6v s ALA 114 CO 0.13 -0.08 -0.20 0.50 0.00 0.00 0.00 175.76 176.12 1w6v s ARG 115 N 0.82 3.01 0.71 0.00 6.06 0.19 -4.94 118.95 124.79 1w6v s ARG 115 Ca 0.21 -0.82 -0.14 0.00 -2.50 0.00 0.00 55.73 52.47 1w6v s ARG 115 Cb -0.14 -2.57 0.03 0.00 0.06 0.00 0.00 34.95 32.32 1w6v s ARG 115 CO 0.07 -0.19 1.13 0.15 -2.50 0.00 0.00 175.30 173.96 1w6v s LYS 116 N 1.25 2.48 0.54 5.12 3.01 -1.26 0.21 119.74 131.09 1w6v s LYS 116 Ca 0.04 1.43 -0.22 0.00 -1.01 0.00 0.00 55.97 56.21 1w6v s LYS 116 Cb -0.13 -1.91 -0.05 0.00 -1.01 0.00 0.00 37.83 34.73 1w6v s LYS 116 CO -0.12 -1.51 1.36 0.08 0.51 0.00 0.00 175.35 175.68 1w6v s VAL 117 N -2.38 2.06 0.58 3.17 1.01 -0.90 -4.82 120.40 119.12 1w6v s VAL 117 Ca 0.67 0.05 -0.19 0.00 0.00 0.00 0.00 61.98 62.51 1w6v s VAL 117 Cb -0.22 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 33.10 1w6v s VAL 117 CO 0.45 -0.00 1.17 0.68 0.00 0.00 0.00 175.10 177.41 1w6v s VAL 118 N -1.30 2.85 -1.31 2.92 -7.23 -1.26 -4.67 120.40 110.41 1w6v s VAL 118 Ca 0.71 0.52 0.23 0.00 -1.81 0.00 0.00 61.98 61.64 1w6v s VAL 118 Cb -0.41 -3.20 -0.04 0.00 0.56 0.00 0.00 36.38 33.30 1w6v s VAL 118 CO 0.48 -0.12 1.20 -0.62 -0.31 0.00 0.00 175.10 175.73 1w6v n GLU 119 N -1.53 0.35 0.00 4.82 1.02 -1.26 -4.89 120.64 119.15 1w6v n GLU 119 Ca 0.13 -0.26 0.00 0.00 -0.02 0.00 0.00 57.16 57.01 1w6v n GLU 119 Cb 0.50 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.43 1w6v n GLU 119 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31