#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w6v s ALA 2 N 0.00 0.24 -0.28 -5.12 0.00 -1.26 -5.02 121.76 110.32 1w6v s ALA 2 Ca 0.00 -0.14 -0.15 0.00 0.00 0.00 0.00 51.96 51.67 1w6v s ALA 2 Cb 0.00 -0.05 -0.03 0.00 0.00 0.00 0.00 23.12 23.03 1w6v s ALA 2 CO 0.00 0.05 0.38 -1.21 0.00 0.00 0.00 175.76 174.99 1w6v s GLU 3 N -0.12 3.97 0.00 0.00 0.41 -1.26 -4.91 118.70 116.80 1w6v s GLU 3 Ca 0.01 0.01 0.05 0.00 -0.41 0.00 0.00 54.97 54.63 1w6v s GLU 3 Cb -0.01 -3.67 0.11 0.00 -1.78 0.00 0.00 34.13 28.78 1w6v s GLU 3 CO -0.00 -0.31 0.97 0.41 -0.49 0.00 0.00 175.26 175.84 1w6v n GLY 4 N 4.70 1.60 0.00 -1.39 0.00 -1.26 -4.89 105.19 103.94 1w6v n GLY 4 Ca -0.08 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.77 1w6v n GLY 4 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w6v n GLY 5 N 0.09 1.40 7.00 -0.02 0.00 -1.26 -5.03 105.19 107.38 1w6v n GLY 5 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1w6v n GLY 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w6v n ALA 6 N -3.00 0.00 -1.99 4.61 0.00 -1.26 -4.78 120.51 114.09 1w6v n ALA 6 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.22 1w6v n ALA 6 Cb 0.00 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.53 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 -1.82 3.94 0.42 0.00 0.00 -1.26 -5.06 121.76 117.98 1w6v s ALA 7 Ca 0.00 -1.66 -0.25 0.00 0.00 0.00 0.00 51.96 50.05 1w6v s ALA 7 Cb 0.00 -1.94 -0.08 0.00 0.00 0.00 0.00 23.12 21.10 1w6v s ALA 7 CO 0.00 -1.12 1.22 0.34 0.00 0.00 0.00 175.76 176.20 1w6v s ASP 8 N -4.62 6.30 0.21 0.00 2.15 -1.26 -4.77 116.67 114.68 1w6v s ASP 8 Ca 0.63 2.46 -0.17 0.00 0.43 0.00 0.00 52.55 55.89 1w6v s ASP 8 Cb -0.07 -2.62 0.21 0.00 -0.30 0.00 0.00 42.92 40.14 1w6v s ASP 8 CO 0.41 -0.84 1.58 -0.07 -0.17 0.00 0.00 175.17 176.08 1w6v h LEU 9 N 2.44 -1.14 -0.89 -1.34 -0.00 -1.96 0.57 115.31 112.99 1w6v h LEU 9 Ca -0.49 0.26 -0.10 0.00 -0.00 0.00 0.00 57.88 57.54 1w6v h LEU 9 Cb 1.25 0.61 -0.01 0.00 -0.00 0.00 0.00 40.66 42.50 1w6v h LEU 9 CO 0.62 -0.29 -0.30 -0.78 -0.00 0.00 0.00 178.44 177.68 1w6v h ASP 10 N -0.08 0.47 -0.20 -0.43 3.58 -1.91 -2.36 116.42 115.48 1w6v h ASP 10 Ca 0.30 -0.17 -0.03 0.00 0.42 0.00 0.00 57.03 57.55 1w6v h ASP 10 Cb 0.58 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 41.49 1w6v h ASP 10 CO -0.81 0.75 -0.01 0.74 -2.88 0.00 0.00 179.24 177.04 1w6v h THR 11 N 0.40 1.26 0.12 2.25 2.02 -1.37 -2.75 112.91 114.83 1w6v h THR 11 Ca 0.05 -0.90 0.02 0.00 0.77 0.00 0.00 66.41 66.35 1w6v h THR 11 Cb 0.73 1.46 -0.03 0.00 -1.74 0.00 0.00 68.15 68.57 1w6v h THR 11 CO 0.06 0.27 -0.22 1.56 0.37 0.00 0.00 175.52 177.56 1w6v h GLN 12 N 0.11 -0.41 -0.38 6.66 4.20 0.54 0.41 115.11 126.25 1w6v h GLN 12 Ca 0.06 0.03 0.06 0.00 0.06 0.00 0.00 58.65 58.85 1w6v h GLN 12 Cb 0.41 0.09 -0.08 0.00 0.30 0.00 0.00 27.48 28.20 1w6v h GLN 12 CO 0.01 -0.27 -0.50 0.00 -0.67 0.00 0.00 178.83 177.40 1w6v h ARG 13 N -0.42 -0.38 -0.26 1.46 3.08 -1.46 -1.90 114.38 114.51 1w6v h ARG 13 Ca 0.03 0.03 -0.05 0.00 0.07 0.00 0.00 59.98 60.05 1w6v h ARG 13 Cb 0.44 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.57 1w6v h ARG 13 CO -0.12 -0.25 -0.03 0.77 -1.07 0.00 0.00 179.97 179.26 1w6v h SER 14 N -0.39 0.48 0.18 7.04 0.02 -1.15 0.27 113.55 119.99 1w6v h SER 14 Ca 0.10 -0.34 -0.09 0.00 -0.84 0.00 0.00 61.79 60.61 1w6v h SER 14 Cb 0.60 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.00 1w6v h SER 14 CO -0.57 0.70 -0.34 -0.78 -1.14 0.00 0.00 176.83 174.70 1w6v h ASP 15 N 0.24 0.25 0.34 3.07 3.58 -0.07 -0.68 116.42 123.14 1w6v h ASP 15 Ca 0.07 -0.09 -0.33 0.00 0.42 0.00 0.00 57.03 57.10 1w6v h ASP 15 Cb 0.48 -0.07 0.02 0.00 1.72 0.00 0.00 39.33 41.48 1w6v h ASP 15 CO 0.02 0.58 -1.54 0.40 -2.88 0.00 0.00 179.24 175.82 1w6v h ILE 16 N 0.21 1.19 -0.55 2.25 1.08 -1.19 -3.17 117.51 117.33 1w6v h ILE 16 Ca 0.03 -2.72 0.03 0.00 -0.39 0.00 0.00 64.86 61.80 1w6v h ILE 16 Cb 0.71 2.89 -0.03 0.00 -3.07 0.00 0.00 36.82 37.32 1w6v h ILE 16 CO 0.05 0.84 0.36 0.00 -0.69 0.00 0.00 178.15 178.71 1w6v h ALA 17 N 0.28 1.71 -0.27 1.87 0.00 -0.04 0.24 119.26 123.05 1w6v h ALA 17 Ca -0.26 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.56 1w6v h ALA 17 Cb 2.09 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 19.68 1w6v h ALA 17 CO 0.21 0.24 -0.09 1.15 0.00 0.00 0.00 179.25 180.76 1w6v h THR 18 N 0.65 1.21 0.00 0.00 2.02 -1.21 -2.68 112.91 112.90 1w6v h THR 18 Ca 0.22 -0.90 0.00 0.00 0.77 0.00 0.00 66.41 66.50 1w6v h THR 18 Cb 0.07 1.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.58 1w6v h THR 18 CO -0.06 0.29 -0.39 0.18 0.37 0.00 0.00 175.52 175.92 1w6v n LEU 19 N -4.24 0.57 0.12 2.58 4.77 0.79 -2.51 117.00 119.07 1w6v n LEU 19 Ca 0.01 0.28 0.08 0.00 -0.03 0.00 0.00 56.01 56.35 1w6v n LEU 19 Cb 0.29 -0.27 0.03 0.00 -2.33 0.00 0.00 43.42 41.13 1w6v n LEU 19 CO 0.39 -0.03 0.21 -0.07 -1.33 0.00 0.00 177.39 176.57 1w6v h LEU 20 N 0.00 0.00 -0.95 2.23 3.38 -1.03 -3.29 115.31 115.65 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 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1w6v h LEU 20 CO 0.00 0.16 -0.39 2.29 0.09 0.00 0.00 178.44 180.59 1w6v n LYS 21 N -2.88 1.21 -1.67 1.13 -0.00 -1.09 -4.90 118.16 109.95 1w6v n LYS 21 Ca -0.01 -0.95 -0.45 0.00 -0.00 0.00 0.00 58.31 56.90 1w6v n LYS 21 Cb 0.62 -1.48 -0.03 0.00 -0.00 0.00 0.00 35.03 34.14 1w6v n LYS 21 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 1w6v n THR 22 N -0.06 0.90 -2.25 0.58 -1.04 -1.05 -4.93 114.28 106.43 1w6v n THR 22 Ca 0.10 -0.23 -0.42 0.00 -2.04 0.00 0.00 64.05 61.47 1w6v n THR 22 Cb 0.45 -1.46 -0.03 0.00 -1.82 0.00 0.00 70.33 67.47 1w6v n THR 22 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1w6v s SER 23 N 0.31 6.93 0.25 8.00 0.01 -1.26 -5.02 113.70 122.92 1w6v s SER 23 Ca 0.69 2.31 0.09 0.00 1.31 0.00 0.00 55.95 60.34 1w6v s SER 23 Cb -0.66 -2.60 -0.04 0.00 0.21 0.00 0.00 66.02 62.93 1w6v s SER 23 CO 0.49 -0.53 0.05 -1.48 0.41 0.00 0.00 173.24 172.18 1w6v s LEU 24 N 0.37 3.39 0.00 2.44 0.05 -1.26 -5.12 118.68 118.55 1w6v s LEU 24 Ca 0.59 -0.50 0.00 0.00 0.05 0.00 0.00 54.13 54.26 1w6v s LEU 24 Cb -0.35 -1.93 0.00 0.00 -2.05 0.00 0.00 46.19 41.86 1w6v s LEU 24 CO 0.34 -0.00 0.00 0.54 -0.55 0.00 0.00 176.35 176.68 1w6v n ARG 25 N -0.90 3.47 -0.13 1.48 5.12 -1.26 -5.03 116.66 119.41 1w6v n ARG 25 Ca -0.07 0.00 0.03 0.00 -1.93 0.00 0.00 57.85 55.88 1w6v n ARG 25 Cb 0.58 0.00 0.04 0.00 -1.16 0.00 0.00 32.46 31.92 1w6v n ARG 25 CO 0.00 0.00 0.00 0.36 -1.93 0.00 0.00 177.63 176.06 1w6v n LYS 26 N 0.00 1.19 -0.35 5.56 2.85 -1.26 -4.75 118.16 121.41 1w6v n LYS 26 Ca 0.00 -1.46 0.05 0.00 -1.05 0.00 0.00 58.31 55.85 1w6v n LYS 26 Cb 0.00 -0.91 0.07 0.00 -0.65 0.00 0.00 35.03 33.53 1w6v n LYS 26 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1w6v n GLY 27 N -0.53 2.52 3.96 2.58 0.00 -1.26 -4.60 105.19 107.86 1w6v n GLY 27 Ca 0.04 -0.55 -0.23 0.00 0.00 0.00 0.00 46.02 45.29 1w6v n GLY 27 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1w6v s ASP 28 N -1.89 5.18 -0.10 1.61 1.01 -1.26 -4.96 116.67 116.26 1w6v s ASP 28 Ca 0.16 0.14 0.03 0.00 0.71 0.00 0.00 52.55 53.59 1w6v s ASP 28 Cb 0.14 -0.98 -0.00 0.00 1.01 0.00 0.00 42.92 43.09 1w6v s ASP 28 CO 0.01 -1.24 -0.22 -0.89 0.21 0.00 0.00 175.17 173.04 1w6v s THR 29 N -2.89 2.28 0.21 -1.27 2.01 -1.26 -2.36 115.64 112.36 1w6v s THR 29 Ca 0.58 -0.95 0.09 0.00 0.31 0.00 0.00 61.69 61.72 1w6v s THR 29 Cb -0.10 -1.89 -0.04 0.00 0.01 0.00 0.00 72.50 70.48 1w6v s THR 29 CO 0.40 0.55 -0.09 0.26 -0.69 0.00 0.00 174.62 175.06 1w6v s TRP 30 N 0.27 2.61 -0.15 4.92 0.52 0.90 -4.09 118.94 123.94 1w6v s TRP 30 Ca -0.15 -0.23 -0.02 0.00 0.02 0.00 0.00 56.10 55.71 1w6v s TRP 30 Cb -0.17 -1.24 -0.02 0.00 -1.15 0.00 0.00 33.47 30.89 1w6v s TRP 30 CO 0.08 0.55 -0.08 0.71 0.02 0.00 0.00 176.95 178.23 1w6v s TYR 31 N -1.89 2.93 0.10 -1.98 1.51 0.20 0.20 117.35 118.42 1w6v s TYR 31 Ca 0.26 -0.45 -0.22 0.00 -1.01 0.00 0.00 57.07 55.65 1w6v s TYR 31 Cb -0.08 -1.91 -0.07 0.00 -0.11 0.00 0.00 41.96 39.79 1w6v s TYR 31 CO 0.16 -0.12 0.67 -1.17 -1.11 0.00 0.00 175.55 173.98 1w6v s LEU 32 N 0.37 4.54 0.09 -1.29 2.96 0.79 -0.94 118.68 125.20 1w6v s LEU 32 Ca -0.07 1.42 0.04 0.00 -0.22 0.00 0.00 54.13 55.29 1w6v s LEU 32 Cb -0.15 -3.08 -0.03 0.00 0.50 0.00 0.00 46.19 43.43 1w6v s LEU 32 CO 0.04 0.21 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.48 1w6v s VAL 33 N -0.93 0.94 0.40 1.68 1.01 0.64 -4.49 120.40 119.65 1w6v s VAL 33 Ca 0.33 -1.54 -0.25 0.00 0.00 0.00 0.00 61.98 60.51 1w6v s VAL 33 Cb -0.21 -1.25 -0.09 0.00 0.00 0.00 0.00 36.38 34.83 1w6v s VAL 33 CO 0.22 -0.49 1.16 -0.62 0.00 0.00 0.00 175.10 175.36 1w6v s ASP 34 N -2.26 6.57 0.19 3.32 2.15 -1.26 -0.13 116.67 125.25 1w6v s ASP 34 Ca 0.03 2.31 -0.02 0.00 0.43 0.00 0.00 52.55 55.30 1w6v s ASP 34 Cb -0.05 -2.61 0.10 0.00 -0.30 0.00 0.00 42.92 40.07 1w6v s ASP 34 CO 0.00 -0.64 1.48 0.77 -0.17 0.00 0.00 175.17 176.62 1w6v h SER 35 N 2.67 0.55 1.30 -0.34 4.64 -1.77 -2.61 113.55 117.99 1w6v h SER 35 Ca -0.49 -0.32 -0.14 0.00 -0.47 0.00 0.00 61.79 60.37 1w6v h SER 35 Cb 1.23 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 63.14 1w6v h SER 35 CO 0.63 1.03 -0.71 0.03 -0.87 0.00 0.00 176.83 176.94 1w6v h ARG 36 N 0.36 0.00 -0.20 4.77 2.47 -1.89 0.02 114.38 119.91 1w6v h ARG 36 Ca -0.01 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.68 1w6v h ARG 36 Cb 1.16 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.48 1w6v h ARG 36 CO 0.11 0.63 0.01 2.35 0.56 0.00 0.00 179.97 183.63 1w6v h TRP 37 N 0.00 0.37 -0.49 3.04 7.01 -1.88 0.14 115.95 124.14 1w6v h TRP 37 Ca -0.02 -0.06 -0.09 0.00 2.11 0.00 0.00 58.89 60.83 1w6v h TRP 37 Cb 1.51 -0.10 -0.02 0.00 -2.10 0.00 0.00 29.16 28.46 1w6v h TRP 37 CO 0.00 0.53 -0.04 0.35 -2.79 0.00 0.00 178.44 176.48 1w6v h PHE 38 N 0.11 0.91 0.00 2.65 3.04 -1.33 -0.05 116.94 122.26 1w6v h PHE 38 Ca 0.06 -0.15 -0.07 0.00 3.98 0.00 0.00 57.97 61.79 1w6v h PHE 38 Cb 0.37 -0.24 -0.01 0.00 2.56 0.00 0.00 35.95 38.63 1w6v h PHE 38 CO 0.03 0.85 -0.34 0.87 -2.02 0.00 0.00 178.31 177.70 1w6v h LYS 39 N 0.77 0.00 -0.24 1.11 1.57 -0.72 0.30 116.57 119.37 1w6v h LYS 39 Ca 0.14 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.88 1w6v h LYS 39 Cb 0.53 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 1w6v h LYS 39 CO 0.03 0.34 -0.03 0.37 -0.57 0.00 0.00 179.45 179.60 1w6v h GLN 40 N 0.00 0.44 -0.86 3.15 5.75 -0.11 -2.80 115.11 120.67 1w6v h GLN 40 Ca -0.00 -0.15 0.01 0.00 -0.15 0.00 0.00 58.65 58.36 1w6v h GLN 40 Cb 0.62 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 29.09 1w6v h GLN 40 CO 0.04 0.64 0.57 2.35 -2.65 0.00 0.00 178.83 179.78 1w6v h TRP 41 N 0.19 1.07 -0.89 3.99 7.01 -0.25 -1.79 115.95 125.29 1w6v h TRP 41 Ca 0.06 0.03 0.08 0.00 2.11 0.00 0.00 58.89 61.17 1w6v h TRP 41 Cb 0.46 -0.36 -0.06 0.00 -2.10 0.00 0.00 29.16 27.10 1w6v h TRP 41 CO 0.04 0.67 0.57 0.87 -2.79 0.00 0.00 178.44 177.80 1w6v h LYS 42 N 1.15 0.91 0.03 2.65 1.57 -0.29 0.40 116.57 122.99 1w6v h LYS 42 Ca 0.32 -0.05 -0.26 0.00 -1.87 0.00 0.00 60.65 58.78 1w6v h LYS 42 Cb -0.12 -0.21 0.01 0.00 0.08 0.00 0.00 32.23 32.00 1w6v h LYS 42 CO -0.07 0.60 -1.06 0.87 -0.57 0.00 0.00 179.45 179.22 1w6v h LYS 43 N 0.94 0.54 -0.24 3.15 1.57 -1.20 0.61 116.57 121.94 1w6v h LYS 43 Ca 0.40 -0.63 -0.12 0.00 -1.87 0.00 0.00 60.65 58.42 1w6v h LYS 43 Cb 0.30 0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.79 1w6v h LYS 43 CO -0.16 1.24 -0.37 -0.92 -0.57 0.00 0.00 179.45 178.68 1w6v h TYR 44 N 0.29 0.64 0.00 -1.35 3.20 -0.44 -2.73 116.97 116.57 1w6v h TYR 44 Ca -0.12 -0.17 -0.07 0.00 3.14 0.00 0.00 58.73 61.51 1w6v h TYR 44 Cb 1.71 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 39.83 1w6v h TYR 44 CO 0.09 0.84 -1.15 -0.24 -1.64 0.00 0.00 178.16 176.05 1w6v h VAL 45 N 0.46 0.20 0.00 1.81 3.04 -0.25 0.54 116.25 122.04 1w6v h VAL 45 Ca 0.05 -1.39 0.00 0.00 -1.01 0.00 0.00 66.70 64.34 1w6v h VAL 45 Cb 0.85 1.71 0.00 0.00 -2.01 0.00 0.00 31.29 31.85 1w6v h VAL 45 CO 0.07 0.11 0.00 0.61 -1.01 0.00 0.00 177.57 177.35 1w6v n GLY 46 N 1.26 0.95 0.14 3.17 0.00 -0.05 -4.63 105.19 106.04 1w6v n GLY 46 Ca -0.04 -0.56 -0.15 0.00 0.00 0.00 0.00 46.02 45.27 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 0.59 -2.66 1.61 3.04 -0.15 -3.39 116.94 115.98 1w6v h PHE 47 Ca 0.00 -0.36 -0.54 0.00 3.98 0.00 0.00 57.97 61.05 1w6v h PHE 47 Cb 0.54 -0.05 -0.06 0.00 2.56 0.00 0.00 35.95 38.94 1w6v h PHE 47 CO 0.00 1.21 1.11 -0.51 -2.02 0.00 0.00 178.31 178.10 1w6v s ASP 48 N -7.13 6.07 0.48 0.41 1.01 -1.10 -4.86 116.67 111.56 1w6v s ASP 48 Ca -0.05 0.11 0.20 0.00 0.71 0.00 0.00 52.55 53.52 1w6v s ASP 48 Cb 0.08 -2.55 1.22 0.00 1.01 0.00 0.00 42.92 42.68 1w6v s ASP 48 CO 0.88 -1.79 1.96 0.28 0.21 0.00 0.00 175.17 176.70 1w6v h SER 49 N 11.11 0.20 0.21 0.27 0.02 -1.93 0.01 113.55 123.45 1w6v h SER 49 Ca -0.27 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.69 1w6v h SER 49 Cb 1.09 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.60 1w6v h SER 49 CO 1.21 0.11 -0.72 -2.67 -1.14 0.00 0.00 176.83 173.61 1w6v n TRP 50 N -4.43 0.00 -3.42 3.45 2.14 -1.26 -4.65 117.44 109.28 1w6v n TRP 50 Ca 0.12 0.00 -0.28 0.00 2.07 0.00 0.00 57.50 59.41 1w6v n TRP 50 Cb 0.56 -0.10 -0.11 0.00 -0.81 0.00 0.00 31.31 30.85 1w6v n TRP 50 CO 0.00 0.00 0.00 0.34 2.07 0.00 0.00 177.69 180.10 1w6v s ASP 51 N -2.93 2.00 0.00 -0.67 -1.08 -0.02 -4.86 116.67 109.12 1w6v s ASP 51 Ca 0.11 -2.73 0.00 0.00 -0.52 0.00 0.00 52.55 49.41 1w6v s ASP 51 Cb 0.17 -0.42 0.00 0.00 -1.46 0.00 0.00 42.92 41.21 1w6v s ASP 51 CO 0.76 -0.22 0.67 2.29 0.52 0.00 0.00 175.17 179.18 1w6v n LYS 52 N 3.30 0.00 0.00 4.34 2.85 -1.19 -4.07 118.16 123.38 1w6v n LYS 52 Ca 0.23 -0.57 0.07 0.00 -1.05 0.00 0.00 58.31 56.98 1w6v n LYS 52 Cb 0.44 -0.35 0.32 0.00 -0.65 0.00 0.00 35.03 34.79 1w6v n LYS 52 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 177.40 179.83 1w6v n TYR 53 N 0.00 0.00 -0.45 5.58 4.11 -1.26 -1.74 117.16 123.40 1w6v n TYR 53 Ca 0.00 0.00 0.10 0.00 -0.00 0.00 0.00 57.90 58.00 1w6v n TYR 53 Cb 0.59 -0.38 0.30 0.00 -0.00 0.00 0.00 39.34 39.85 1w6v n TYR 53 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.86 177.90 1w6v n GLN 54 N -1.38 3.10 -1.65 -3.48 6.02 -1.25 -4.91 117.38 113.83 1w6v n GLN 54 Ca 0.05 -2.64 -0.43 0.00 -0.01 0.00 0.00 57.00 53.97 1w6v n GLN 54 Cb 0.13 -1.64 -0.03 0.00 1.02 0.00 0.00 30.24 29.72 1w6v n GLN 54 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.06 177.46 1w6v s MET 55 N -1.36 3.52 -0.57 -1.09 1.75 -0.71 -0.61 119.30 120.23 1w6v s MET 55 Ca 0.45 2.23 0.00 0.00 -1.25 0.00 0.00 55.69 57.12 1w6v s MET 55 Cb 0.26 -4.29 0.00 0.00 2.84 0.00 0.00 34.83 33.64 1w6v s MET 55 CO 0.26 -1.67 0.00 0.41 -0.65 0.00 0.00 175.02 173.38 1w6v n GLY 56 N 5.29 0.79 3.83 2.11 0.00 0.19 -4.99 105.19 112.41 1w6v n GLY 56 Ca 0.26 -0.70 -0.35 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.83 6.90 0.00 1.61 -1.08 0.22 -4.94 116.67 116.56 1w6v s ASP 57 Ca 0.00 1.22 0.28 0.00 -0.52 0.00 0.00 52.55 53.53 1w6v s ASP 57 Cb 0.00 -2.34 1.04 0.00 -1.46 0.00 0.00 42.92 40.16 1w6v s ASP 57 CO 0.00 0.04 1.78 0.00 0.52 0.00 0.00 175.17 177.51 1w6v n GLN 58 N 0.63 0.17 0.26 4.34 10.64 -1.26 -2.15 117.38 130.00 1w6v n GLN 58 Ca -0.03 -0.05 0.15 0.00 -1.83 0.00 0.00 57.00 55.24 1w6v n GLN 58 Cb 0.52 -1.50 0.52 0.00 -0.86 0.00 0.00 30.24 28.92 1w6v n GLN 58 CO 0.00 0.00 0.00 -0.91 -1.83 0.00 0.00 177.06 174.32 1w6v h ASN 59 N 0.12 0.00 0.00 2.61 2.35 -1.92 -3.29 115.58 115.46 1w6v h ASN 59 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1w6v h ASN 59 Cb 0.46 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.83 1w6v h ASN 59 CO 0.00 0.03 0.00 1.33 -1.65 0.00 0.00 177.43 177.14 1w6v n VAL 60 N -3.12 0.47 -1.82 2.81 0.24 -1.05 -5.02 118.33 110.84 1w6v n VAL 60 Ca 0.01 -0.53 -0.43 0.00 -2.04 0.00 0.00 64.34 61.36 1w6v n VAL 60 Cb 0.38 0.85 -0.03 0.00 -1.47 0.00 0.00 33.84 33.57 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 -0.47 1.57 -0.42 6.34 1.13 -0.91 -4.47 117.35 120.12 1w6v s TYR 61 Ca 0.00 0.18 -0.24 0.00 -1.41 0.00 0.00 57.07 55.60 1w6v s TYR 61 Cb 0.00 -4.05 0.02 0.00 -1.10 0.00 0.00 41.96 36.83 1w6v s TYR 61 CO 0.00 -4.19 0.82 -1.25 -2.51 0.00 0.00 175.55 168.42 1w6v s PRO 62 N 5.00 3.58 0.00 -3.49 0.05 -1.26 -5.04 135.00 133.84 1w6v s PRO 62 Ca 0.85 0.13 0.00 0.00 0.05 0.00 0.00 61.00 62.03 1w6v s PRO 62 Cb -0.34 -3.88 0.00 0.00 0.05 0.00 0.00 34.50 30.33 1w6v s PRO 62 CO 0.35 -1.03 0.00 0.41 0.05 0.00 0.00 177.00 176.78 1w6v n GLY 63 N 4.78 -1.59 3.72 0.56 0.00 -1.26 -4.88 105.19 106.52 1w6v n GLY 63 Ca 0.04 -1.15 -0.43 0.00 0.00 0.00 0.00 46.02 44.48 1w6v n GLY 63 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1w6v n PRO 64 N 0.00 2.43 -1.74 1.61 -0.04 -1.18 -4.79 135.00 131.29 1w6v n PRO 64 Ca 0.00 0.86 -0.43 0.00 -0.04 0.00 0.00 63.50 63.89 1w6v n PRO 64 Cb 0.00 -2.57 -0.03 0.00 -0.04 0.00 0.00 33.50 30.86 1w6v n PRO 64 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1w6v s ILE 65 N -0.35 3.17 -0.28 0.52 1.01 0.70 -4.55 121.20 121.41 1w6v s ILE 65 Ca 0.62 0.17 -0.10 0.00 0.00 0.00 0.00 60.65 61.35 1w6v s ILE 65 Cb -0.54 -3.22 -0.03 0.00 0.01 0.00 0.00 42.46 38.67 1w6v s ILE 65 CO 0.53 -0.14 0.15 -0.62 0.00 0.00 0.00 174.94 174.86 1w6v s ASP 66 N 7.50 5.64 -0.14 3.58 2.15 -1.26 -1.39 116.67 132.76 1w6v s ASP 66 Ca 0.93 -0.22 0.12 0.00 0.43 0.00 0.00 52.55 53.81 1w6v s ASP 66 Cb -0.30 -2.03 0.59 0.00 -0.30 0.00 0.00 42.92 40.88 1w6v s ASP 66 CO 0.35 -0.09 1.43 0.59 -0.17 0.00 0.00 175.17 177.27 1w6v n ASN 67 N 5.01 4.23 -0.73 -0.34 4.13 -1.26 -4.23 115.26 122.06 1w6v n ASN 67 Ca -0.15 -2.55 0.00 0.00 1.68 0.00 0.00 54.58 53.56 1w6v n ASN 67 Cb 0.51 -0.58 0.00 0.00 -1.54 0.00 0.00 39.78 38.17 1w6v n ASN 67 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1w6v n SER 68 N 0.61 1.88 -0.01 6.41 7.64 -1.26 -1.81 113.62 127.07 1w6v n SER 68 Ca 0.20 -1.97 0.03 0.00 1.01 0.00 0.00 58.87 58.15 1w6v n SER 68 Cb 0.86 -0.49 -0.07 0.00 -1.01 0.00 0.00 64.21 63.50 1w6v n SER 68 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1w6v n GLY 69 N 0.24 -0.40 0.15 0.23 0.00 -1.26 -4.64 105.19 99.50 1w6v n GLY 69 Ca 0.00 -0.20 -0.18 0.00 0.00 0.00 0.00 46.02 45.64 1w6v n GLY 69 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1w6v n LEU 70 N -1.89 2.68 -4.76 0.99 7.99 -1.04 -4.91 117.00 116.06 1w6v n LEU 70 Ca -0.04 -0.02 -0.36 0.00 -0.01 0.00 0.00 56.01 55.59 1w6v n LEU 70 Cb 0.32 -0.77 0.03 0.00 -0.11 0.00 0.00 43.42 42.90 1w6v n LEU 70 CO 0.18 0.79 0.83 -0.76 -1.51 0.00 0.00 177.39 176.92 1w6v s LEU 71 N -6.55 3.64 0.00 2.23 1.43 -0.75 -1.29 118.68 117.39 1w6v s LEU 71 Ca -0.31 2.34 0.00 0.00 -1.03 0.00 0.00 54.13 55.13 1w6v s LEU 71 Cb 0.09 -4.59 0.00 0.00 0.03 0.00 0.00 46.19 41.72 1w6v s LEU 71 CO 0.50 -1.59 0.00 0.29 0.23 0.00 0.00 176.35 175.78 1w6v n LYS 72 N -1.66 -0.21 -3.16 1.70 5.02 0.58 -4.75 118.16 115.68 1w6v n LYS 72 Ca 0.13 0.00 -0.45 0.00 -2.02 0.00 0.00 58.31 55.97 1w6v n LYS 72 Cb 0.50 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.47 1w6v n LYS 72 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1w6v s ASP 73 N -1.27 6.29 0.00 4.39 1.01 -1.26 -4.50 116.67 121.33 1w6v s ASP 73 Ca 0.00 -1.71 0.00 0.00 0.71 0.00 0.00 52.55 51.55 1w6v s ASP 73 Cb 0.00 -2.28 0.00 0.00 1.01 0.00 0.00 42.92 41.65 1w6v s ASP 73 CO 0.00 -1.00 0.00 0.61 0.21 0.00 0.00 175.17 174.99 1w6v n GLY 74 N 5.13 2.19 3.71 0.21 0.00 -1.26 -5.06 105.19 110.11 1w6v n GLY 74 Ca -0.05 -0.64 -0.40 0.00 0.00 0.00 0.00 46.02 44.92 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 -0.26 7.04 -0.05 1.61 1.11 -1.26 -4.92 116.67 119.93 1w6v s ASP 75 Ca 0.00 1.26 0.11 0.00 0.18 0.00 0.00 52.55 54.10 1w6v s ASP 75 Cb 0.00 -2.45 0.40 0.00 1.07 0.00 0.00 42.92 41.94 1w6v s ASP 75 CO 0.00 -0.19 1.26 0.00 1.18 0.00 0.00 175.17 177.42 1w6v n ALA 76 N 4.06 2.77 -0.02 5.23 0.00 -1.26 -3.06 120.51 128.22 1w6v n ALA 76 Ca 0.01 -0.85 0.00 0.00 0.00 0.00 0.00 53.44 52.60 1w6v n ALA 76 Cb 0.51 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.95 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 0.56 1.33 -4.56 0.00 1.13 -1.26 -4.72 117.38 109.85 1w6v n GLN 77 Ca 0.14 -1.07 -0.33 0.00 -1.94 0.00 0.00 57.00 53.80 1w6v n GLN 77 Cb 0.51 -0.99 -0.16 0.00 0.11 0.00 0.00 30.24 29.71 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 -0.58 3.20 0.21 1.08 0.01 -1.17 -5.07 113.70 111.38 1w6v s SER 78 Ca 0.00 -0.59 -0.08 0.00 1.31 0.00 0.00 55.95 56.59 1w6v s SER 78 Cb 0.00 -1.47 -0.07 0.00 0.21 0.00 0.00 66.02 64.69 1w6v s SER 78 CO 0.00 0.07 0.51 -0.76 0.41 0.00 0.00 173.24 173.46 1w6v s LEU 79 N 0.89 4.19 0.57 2.44 1.43 -1.26 -0.31 118.68 126.63 1w6v s LEU 79 Ca -0.05 0.83 -0.18 0.00 -1.03 0.00 0.00 54.13 53.70 1w6v s LEU 79 Cb -0.15 -3.59 -0.04 0.00 0.03 0.00 0.00 46.19 42.44 1w6v s LEU 79 CO -0.03 -0.04 1.10 -0.54 0.23 0.00 0.00 176.35 177.07 1w6v s LYS 80 N -2.79 3.27 0.36 1.70 1.02 -0.41 -4.72 119.74 118.17 1w6v s LYS 80 Ca 0.46 1.47 0.19 0.00 0.02 0.00 0.00 55.97 58.11 1w6v s LYS 80 Cb -0.11 -2.01 0.33 0.00 -0.52 0.00 0.00 37.83 35.52 1w6v s LYS 80 CO 0.22 -0.89 1.57 0.93 -0.92 0.00 0.00 175.35 176.27 1w6v h GLU 81 N 0.86 0.00 -0.16 1.68 5.08 -1.98 -3.23 114.58 116.84 1w6v h GLU 81 Ca -0.49 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.87 1w6v h GLU 81 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1w6v h GLU 81 CO 0.57 0.32 0.00 0.72 -1.00 0.00 0.00 179.01 179.61 1w6v n HIS 82 N -3.23 0.20 -2.02 4.33 8.25 -1.26 -4.94 115.22 116.54 1w6v n HIS 82 Ca 0.02 -0.10 -0.42 0.00 -0.26 0.00 0.00 57.72 56.97 1w6v n HIS 82 Cb 0.62 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.70 1w6v n HIS 82 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1w6v s LEU 83 N -1.52 4.38 0.00 2.41 1.43 -1.22 -5.04 118.68 119.12 1w6v s LEU 83 Ca 0.31 2.61 0.02 0.00 -1.03 0.00 0.00 54.13 56.04 1w6v s LEU 83 Cb 0.16 -3.61 0.02 0.00 0.03 0.00 0.00 46.19 42.79 1w6v s LEU 83 CO 0.25 -0.71 0.18 -0.38 0.23 0.00 0.00 176.35 175.91 1w6v n ILE 84 N 2.87 0.00 0.00 -0.59 2.08 -1.26 -5.06 119.36 117.40 1w6v n ILE 84 Ca 0.09 -2.12 0.00 0.00 0.56 0.00 0.00 62.75 61.28 1w6v n ILE 84 Cb 0.40 0.20 0.00 0.00 -0.75 0.00 0.00 39.64 39.49 1w6v n ILE 84 CO 0.00 0.00 0.00 -0.67 0.56 0.00 0.00 176.55 176.44 1w6v n ASP 85 N -1.55 0.00 0.31 4.38 2.03 -1.26 -3.54 116.55 116.92 1w6v n ASP 85 Ca -0.11 0.00 0.06 0.00 0.52 0.00 0.00 54.79 55.26 1w6v n ASP 85 Cb 0.59 0.00 0.32 0.00 -0.72 0.00 0.00 41.12 41.31 1w6v n ASP 85 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 1w6v h GLU 86 N 0.00 0.00 0.03 -0.67 -0.00 -1.51 0.63 114.58 113.06 1w6v h GLU 86 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 1w6v h GLU 86 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 28.75 1w6v h GLU 86 CO 0.00 0.00 -0.02 -0.07 -0.00 0.00 0.00 179.01 178.92 1w6v h LEU 87 N 0.00 -0.06 0.00 3.06 3.38 -1.98 -3.38 115.31 116.32 1w6v h LEU 87 Ca 0.00 0.01 -0.43 0.00 0.09 0.00 0.00 57.88 57.54 1w6v h LEU 87 Cb 1.40 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 42.11 1w6v h LEU 87 CO 0.00 -0.04 -2.44 0.47 0.09 0.00 0.00 178.44 176.52 1w6v n ASP 88 N -5.12 1.81 -2.29 -0.43 9.92 0.18 -4.89 116.55 115.73 1w6v n ASP 88 Ca -0.07 0.31 -0.11 0.00 -0.53 0.00 0.00 54.79 54.39 1w6v n ASP 88 Cb 0.06 -0.76 -0.04 0.00 -0.64 0.00 0.00 41.12 39.74 1w6v n ASP 88 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1w6v n TYR 89 N -4.15 -0.54 -3.89 1.24 0.18 0.75 -2.93 117.16 107.81 1w6v n TYR 89 Ca -0.51 -1.61 -0.11 0.00 1.88 0.00 0.00 57.90 57.56 1w6v n TYR 89 Cb 0.86 0.19 -0.12 0.00 -0.38 0.00 0.00 39.34 39.90 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 -2.77 0.06 -0.12 -3.48 1.01 0.82 -1.07 121.20 115.64 1w6v s ILE 90 Ca 0.23 -0.47 -0.02 0.00 0.00 0.00 0.00 60.65 60.39 1w6v s ILE 90 Cb 0.01 -0.25 -0.03 0.00 0.01 0.00 0.00 42.46 42.20 1w6v s ILE 90 CO 0.16 -0.26 -0.05 -0.76 0.00 0.00 0.00 174.94 174.03 1w6v s LEU 91 N -0.81 3.21 0.12 2.97 1.43 -1.26 -0.26 118.68 124.08 1w6v s LEU 91 Ca -0.09 -0.09 0.09 0.00 -1.03 0.00 0.00 54.13 53.01 1w6v s LEU 91 Cb -0.05 -1.74 -0.04 0.00 0.03 0.00 0.00 46.19 44.39 1w6v s LEU 91 CO 0.00 0.24 -0.22 -0.76 0.23 0.00 0.00 176.35 175.85 1w6v s LEU 92 N -0.07 2.33 1.07 1.79 2.01 -0.12 -4.90 118.68 120.80 1w6v s LEU 92 Ca 0.01 -0.74 -0.13 0.00 0.01 0.00 0.00 54.13 53.29 1w6v s LEU 92 Cb -0.13 -0.94 0.23 0.00 0.01 0.00 0.00 46.19 45.35 1w6v s LEU 92 CO 0.03 0.06 1.06 -2.16 1.01 0.00 0.00 176.35 176.36 1w6v s PRO 93 N -2.13 -0.16 0.26 1.29 0.04 -1.26 0.59 135.00 133.63 1w6v s PRO 93 Ca 0.10 0.68 -0.07 0.00 0.04 0.00 0.00 61.00 61.75 1w6v s PRO 93 Cb -0.09 -1.66 0.47 0.00 0.04 0.00 0.00 34.50 33.26 1w6v s PRO 93 CO 0.05 -3.17 1.60 1.15 0.04 0.00 0.00 177.00 176.68 1w6v h THR 94 N -2.22 0.21 -0.12 1.26 2.02 -1.94 -0.06 112.91 112.06 1w6v h THR 94 Ca -0.57 -0.02 -0.16 0.00 0.77 0.00 0.00 66.41 66.43 1w6v h THR 94 Cb 1.33 0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.89 1w6v h THR 94 CO 0.54 0.01 -0.59 -0.33 0.37 0.00 0.00 175.52 175.52 1w6v h GLU 95 N 0.05 0.41 0.54 6.66 4.39 -1.96 -0.01 114.58 124.66 1w6v h GLU 95 Ca 0.45 -0.27 -0.02 0.00 0.34 0.00 0.00 59.36 59.85 1w6v h GLU 95 Cb 0.78 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.46 1w6v h GLU 95 CO -0.79 0.88 -0.39 0.78 -1.16 0.00 0.00 179.01 178.33 1w6v h GLY 96 N 1.24 -1.13 0.08 -3.84 0.00 -1.38 -0.22 103.07 97.82 1w6v h GLY 96 Ca -0.00 0.48 0.08 0.00 0.00 0.00 0.00 47.33 47.89 1w6v h GLY 96 CO 0.10 -0.37 -0.18 -0.25 0.00 0.00 0.00 176.54 175.84 1w6v h TRP 97 N -0.89 -0.45 -1.02 5.60 2.91 -1.22 -0.49 115.95 120.38 1w6v h TRP 97 Ca -0.07 0.04 0.25 0.00 1.13 0.00 0.00 58.89 60.24 1w6v h TRP 97 Cb 0.73 0.25 -0.10 0.00 -0.51 0.00 0.00 29.16 29.54 1w6v h TRP 97 CO -0.11 -0.26 0.65 -0.91 -1.03 0.00 0.00 178.44 176.77 1w6v h ASN 98 N -0.11 0.53 0.06 2.65 2.35 -0.74 0.26 115.58 120.58 1w6v h ASN 98 Ca 0.19 0.10 -0.00 0.00 -0.55 0.00 0.00 56.30 56.03 1w6v h ASN 98 Cb 0.40 0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.78 1w6v h ASN 98 CO -0.45 0.11 -0.03 0.11 -1.65 0.00 0.00 177.43 175.52 1w6v h LYS 99 N 0.47 -0.08 -0.97 0.81 1.57 0.57 0.94 116.57 119.88 1w6v h LYS 99 Ca 0.60 0.01 0.07 0.00 -1.87 0.00 0.00 60.65 59.46 1w6v h LYS 99 Cb 1.38 0.02 -0.07 0.00 0.08 0.00 0.00 32.23 33.64 1w6v h LYS 99 CO -0.34 0.46 0.62 -0.07 -0.57 0.00 0.00 179.45 179.55 1w6v h LEU 100 N -0.71 0.97 -0.73 2.94 -0.00 -0.49 0.19 115.31 117.48 1w6v h LEU 100 Ca -0.01 0.01 -0.13 0.00 -0.00 0.00 0.00 57.88 57.75 1w6v h LEU 100 Cb 0.58 -0.19 -0.02 0.00 -0.00 0.00 0.00 40.66 41.03 1w6v h LEU 100 CO 0.01 0.61 -0.62 0.58 -0.00 0.00 0.00 178.44 179.02 1w6v h VAL 101 N 1.09 1.43 0.00 1.22 2.07 -0.52 0.75 116.25 122.30 1w6v h VAL 101 Ca 0.43 -2.08 -0.11 0.00 0.82 0.00 0.00 66.70 65.75 1w6v h VAL 101 Cb 0.23 2.11 -0.02 0.00 -1.52 0.00 0.00 31.29 32.09 1w6v h VAL 101 CO -0.17 0.60 -0.69 -1.28 0.02 0.00 0.00 177.57 176.05 1w6v h SER 102 N 0.05 0.00 0.09 0.57 0.87 0.11 0.13 113.55 115.37 1w6v h SER 102 Ca -0.01 0.00 -0.19 0.00 -1.23 0.00 0.00 61.79 60.36 1w6v h SER 102 Cb 1.10 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.06 1w6v h SER 102 CO 0.08 0.50 -0.96 -0.50 -0.53 0.00 0.00 176.83 175.42 1w6v h TRP 103 N 0.00 0.34 0.00 2.24 6.55 -0.59 -3.43 115.95 121.06 1w6v h TRP 103 Ca -0.04 -0.25 0.00 0.00 0.95 0.00 0.00 58.89 59.56 1w6v h TRP 103 Cb 1.41 -0.01 0.00 0.00 -0.86 0.00 0.00 29.16 29.70 1w6v h TRP 103 CO 0.00 1.38 0.00 0.66 -1.05 0.00 0.00 178.44 179.43 1w6v n TYR 104 N -4.17 0.00 -1.37 0.49 4.01 0.25 -4.66 117.16 111.71 1w6v n TYR 104 Ca -0.20 -0.16 0.17 0.00 -0.16 0.00 0.00 57.90 57.54 1w6v n TYR 104 Cb 0.78 -0.02 -0.07 0.00 -0.31 0.00 0.00 39.34 39.72 1w6v n TYR 104 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1w6v n THR 105 N -0.16 -0.14 -3.34 -0.72 -2.24 0.46 -3.12 114.28 105.01 1w6v n THR 105 Ca 0.00 0.52 -0.29 0.00 -2.27 0.00 0.00 64.05 62.00 1w6v n THR 105 Cb 0.33 -0.96 -0.04 0.00 -2.10 0.00 0.00 70.33 67.57 1w6v n THR 105 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1w6v s LEU 106 N -6.87 4.07 0.55 3.22 0.20 -1.26 -0.22 118.68 118.37 1w6v s LEU 106 Ca 0.00 0.76 -0.18 0.00 0.69 0.00 0.00 54.13 55.40 1w6v s LEU 106 Cb 0.00 -3.57 -0.06 0.00 -0.43 0.00 0.00 46.19 42.13 1w6v s LEU 106 CO 0.00 -0.18 1.06 -0.32 -0.29 0.00 0.00 176.35 176.62 1w6v s MET 107 N -3.42 3.49 0.27 1.98 -2.45 -0.48 -4.57 119.30 114.12 1w6v s MET 107 Ca 0.45 1.33 -0.30 0.00 -1.25 0.00 0.00 55.69 55.92 1w6v s MET 107 Cb -0.11 -2.05 -0.11 0.00 1.25 0.00 0.00 34.83 33.82 1w6v s MET 107 CO 0.28 -0.69 1.49 -1.83 1.05 0.00 0.00 175.02 175.33 1w6v s GLU 108 N -3.63 4.21 0.00 4.11 -1.05 -1.26 -2.05 118.70 119.03 1w6v s GLU 108 Ca 0.66 2.40 0.00 0.00 -0.15 0.00 0.00 54.97 57.89 1w6v s GLU 108 Cb -0.17 -3.08 0.00 0.00 -0.44 0.00 0.00 34.13 30.44 1w6v s GLU 108 CO 0.29 -0.49 0.00 0.41 0.95 0.00 0.00 175.26 176.42 1w6v n GLY 109 N 2.11 0.71 3.77 -3.83 0.00 -1.26 -5.00 105.19 101.69 1w6v n GLY 109 Ca 0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.01 2.35 -0.02 1.61 -0.21 -0.87 -4.98 119.66 117.53 1w6v s GLN 110 Ca 0.00 -1.68 -0.04 0.00 0.02 0.00 0.00 55.36 53.66 1w6v s GLN 110 Cb 0.00 -2.14 0.00 0.00 1.00 0.00 0.00 33.01 31.87 1w6v s GLN 110 CO 0.00 -0.07 0.09 -1.21 -2.12 0.00 0.00 175.29 171.98 1w6v s GLU 111 N -3.94 0.25 0.06 2.91 2.02 -1.26 -4.90 118.70 113.83 1w6v s GLU 111 Ca 0.42 -0.13 -0.32 0.00 0.02 0.00 0.00 54.97 54.96 1w6v s GLU 111 Cb 0.00 0.11 -0.11 0.00 0.10 0.00 0.00 34.13 34.23 1w6v s GLU 111 CO 0.24 -0.05 1.88 -2.30 0.02 0.00 0.00 175.26 175.05 1w6v n PRO 112 N 2.35 2.66 -2.70 0.39 -0.02 -1.26 -4.91 135.00 131.52 1w6v n PRO 112 Ca -0.17 0.97 -0.43 0.00 -2.02 0.00 0.00 63.50 61.85 1w6v n PRO 112 Cb 0.58 -2.87 -0.03 0.00 -0.02 0.00 0.00 33.50 31.15 1w6v n PRO 112 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1w6v s ILE 113 N 3.47 4.23 -0.19 4.25 1.09 -1.26 -4.98 121.20 127.81 1w6v s ILE 113 Ca 0.86 0.74 -0.18 0.00 -1.10 0.00 0.00 60.65 60.98 1w6v s ILE 113 Cb -0.52 -4.60 -0.03 0.00 -1.06 0.00 0.00 42.46 36.24 1w6v s ILE 113 CO 0.42 -1.14 0.48 0.00 -0.10 0.00 0.00 174.94 174.60 1w6v s ALA 114 N 4.38 3.54 -0.10 9.38 0.00 -1.26 -0.15 121.76 137.55 1w6v s ALA 114 Ca 0.39 -0.42 0.01 0.00 0.00 0.00 0.00 51.96 51.94 1w6v s ALA 114 Cb -0.09 -2.75 0.02 0.00 0.00 0.00 0.00 23.12 20.30 1w6v s ALA 114 CO 0.25 -0.37 -0.11 0.50 0.00 0.00 0.00 175.76 176.03 1w6v s ARG 115 N 1.46 1.82 1.14 0.00 3.00 0.13 -4.94 118.95 121.56 1w6v s ARG 115 Ca 0.23 -0.40 -0.16 0.00 -1.00 0.00 0.00 55.73 54.39 1w6v s ARG 115 Cb -0.15 -1.66 0.26 0.00 0.00 0.00 0.00 34.95 33.40 1w6v s ARG 115 CO 0.09 -0.13 1.08 0.15 0.00 0.00 0.00 175.30 176.49 1w6v s LYS 116 N 1.23 -0.73 0.56 5.12 1.02 -1.26 -0.07 119.74 125.60 1w6v s LYS 116 Ca -0.03 0.23 -0.20 0.00 0.02 0.00 0.00 55.97 55.99 1w6v s LYS 116 Cb -0.14 -1.63 -0.05 0.00 -0.52 0.00 0.00 37.83 35.49 1w6v s LYS 116 CO -0.04 -3.45 1.18 0.08 -0.92 0.00 0.00 175.35 172.21 1w6v s VAL 117 N -2.90 2.84 0.47 3.17 1.01 -0.99 -4.69 120.40 119.31 1w6v s VAL 117 Ca 0.68 0.54 -0.23 0.00 0.00 0.00 0.00 61.98 62.97 1w6v s VAL 117 Cb -0.15 -3.23 -0.07 0.00 0.00 0.00 0.00 36.38 32.93 1w6v s VAL 117 CO 0.57 -0.09 1.25 0.68 0.00 0.00 0.00 175.10 177.51 1w6v s VAL 118 N -1.63 2.70 -2.53 2.92 -7.23 -1.26 -4.85 120.40 108.51 1w6v s VAL 118 Ca 0.74 0.55 0.23 0.00 -1.81 0.00 0.00 61.98 61.69 1w6v s VAL 118 Cb -0.28 -3.29 0.40 0.00 0.56 0.00 0.00 36.38 33.76 1w6v s VAL 118 CO 0.32 0.02 1.44 -1.84 -0.31 0.00 0.00 175.10 174.73 1w6v n GLU 119 N -0.47 2.19 0.00 4.82 0.28 -1.26 -4.86 120.64 121.35 1w6v n GLU 119 Ca 0.07 -1.77 0.13 0.00 -0.16 0.00 0.00 57.16 55.43 1w6v n GLU 119 Cb 0.46 -1.47 0.41 0.00 1.43 0.00 0.00 31.44 32.28 1w6v n GLU 119 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97