#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wlv s VAL 2 N 0.00 0.87 0.17 -1.45 1.01 -1.26 -1.46 120.40 118.28 2wlv s VAL 2 Ca 0.00 -0.38 0.08 0.00 0.00 0.00 0.00 61.98 61.68 2wlv s VAL 2 Cb 0.00 -0.78 -0.04 0.00 0.00 0.00 0.00 36.38 35.55 2wlv s VAL 2 CO 0.00 0.28 -0.07 0.00 0.00 0.00 0.00 175.10 175.30 2wlv s GLN 3 N 0.34 2.15 -0.31 2.72 -2.07 0.16 -4.92 119.66 117.73 2wlv s GLN 3 Ca -0.06 -1.20 0.01 0.00 -1.82 0.00 0.00 55.36 52.29 2wlv s GLN 3 Cb -0.11 -2.22 0.09 0.00 -1.09 0.00 0.00 33.01 29.68 2wlv s GLN 3 CO 0.01 0.45 0.06 -1.58 -1.32 0.00 0.00 175.29 172.91 2wlv s HIS 4 N -1.64 2.56 -0.12 9.60 2.46 -1.26 -0.84 115.29 126.05 2wlv s HIS 4 Ca 0.25 -2.21 0.01 0.00 0.47 0.00 0.00 55.06 53.58 2wlv s HIS 4 Cb -0.09 -2.15 0.02 0.00 -0.13 0.00 0.00 32.58 30.23 2wlv s HIS 4 CO 0.16 -0.89 -0.13 0.14 -2.47 0.00 0.00 174.74 171.55 2wlv s VAL 5 N 1.32 1.41 -0.60 0.89 -7.23 -0.78 -4.87 120.40 110.54 2wlv s VAL 5 Ca 0.08 -0.55 -0.15 0.00 -1.81 0.00 0.00 61.98 59.55 2wlv s VAL 5 Cb -0.18 -1.32 0.02 0.00 0.56 0.00 0.00 36.38 35.46 2wlv s VAL 5 CO -0.16 0.43 0.56 0.61 -0.31 0.00 0.00 175.10 176.23 2wlv n GLY 6 N 4.56 -0.62 3.75 2.32 0.00 -1.26 -2.56 105.19 111.37 2wlv n GLY 6 Ca -0.17 0.75 0.00 0.00 0.00 0.00 0.00 46.02 46.60 2wlv n GLY 6 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wlv n GLY 7 N -0.96 0.64 3.19 -0.02 0.00 -1.26 -4.96 105.19 101.82 2wlv n GLY 7 Ca -0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.51 2wlv n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wlv s THR 8 N -2.13 1.92 -0.08 2.61 2.01 -1.06 -5.12 115.64 113.78 2wlv s THR 8 Ca 0.00 -0.94 -0.20 0.00 0.31 0.00 0.00 61.69 60.86 2wlv s THR 8 Cb 0.00 -1.66 -0.04 0.00 0.01 0.00 0.00 72.50 70.81 2wlv s THR 8 CO 0.00 0.53 0.58 -0.31 -0.69 0.00 0.00 174.62 174.73 2wlv s TYR 9 N 0.39 3.56 0.14 4.92 2.02 -1.26 -1.87 117.35 125.24 2wlv s TYR 9 Ca -0.18 1.07 0.00 0.00 -0.37 0.00 0.00 57.07 57.59 2wlv s TYR 9 Cb -0.18 -2.66 -0.04 0.00 -0.40 0.00 0.00 41.96 38.68 2wlv s TYR 9 CO 0.08 0.16 0.01 0.95 -1.57 0.00 0.00 175.55 175.18 2wlv s THR 10 N 0.60 0.41 0.26 -0.71 -4.23 -0.02 -4.96 115.64 106.99 2wlv s THR 10 Ca 0.31 -1.93 -0.29 0.00 -1.18 0.00 0.00 61.69 58.60 2wlv s THR 10 Cb -0.16 -1.99 -0.09 0.00 1.34 0.00 0.00 72.50 71.59 2wlv s THR 10 CO 0.14 -0.56 0.97 -2.28 -0.54 0.00 0.00 174.62 172.35 2wlv s HIS 11 N -3.83 3.87 -0.07 3.99 2.46 -1.26 -0.67 115.29 119.78 2wlv s HIS 11 Ca 0.21 1.86 0.00 0.00 0.47 0.00 0.00 55.06 57.61 2wlv s HIS 11 Cb 0.07 -3.02 0.02 0.00 -0.13 0.00 0.00 32.58 29.52 2wlv s HIS 11 CO 0.01 0.25 -0.06 -1.50 -2.47 0.00 0.00 174.74 170.97 2wlv s ILE 12 N -1.24 0.72 0.76 0.89 2.07 -0.54 -4.87 121.20 118.99 2wlv s ILE 12 Ca 0.43 -0.17 -0.12 0.00 -1.41 0.00 0.00 60.65 59.38 2wlv s ILE 12 Cb -0.26 -0.75 0.05 0.00 0.13 0.00 0.00 42.46 41.63 2wlv s ILE 12 CO 0.32 0.29 1.12 -2.16 -1.91 0.00 0.00 174.94 172.60 2wlv s PRO 13 N 1.27 2.22 0.41 3.50 0.04 -1.26 -0.02 135.00 141.16 2wlv s PRO 13 Ca -0.05 1.34 -0.25 0.00 0.04 0.00 0.00 61.00 62.08 2wlv s PRO 13 Cb -0.14 -1.88 -0.10 0.00 0.04 0.00 0.00 34.50 32.42 2wlv s PRO 13 CO -0.02 -1.70 1.16 1.28 0.04 0.00 0.00 177.00 177.77 2wlv n LEU 14 N -3.24 3.41 -4.76 -3.56 4.77 -1.26 -4.62 117.00 107.74 2wlv n LEU 14 Ca 0.10 1.08 -0.34 0.00 -0.03 0.00 0.00 56.01 56.83 2wlv n LEU 14 Cb 0.52 -1.44 0.05 0.00 -2.33 0.00 0.00 43.42 40.22 2wlv n LEU 14 CO 0.51 -0.99 0.76 -0.94 -1.33 0.00 0.00 177.39 175.40 2wlv s SER 15 N -0.61 5.04 0.37 -1.43 1.04 -1.26 -4.83 113.70 112.01 2wlv s SER 15 Ca 0.62 2.10 0.09 0.00 0.48 0.00 0.00 55.95 59.23 2wlv s SER 15 Cb -0.54 -2.56 0.82 0.00 0.10 0.00 0.00 66.02 63.84 2wlv s SER 15 CO 0.58 -1.68 1.91 -0.65 0.98 0.00 0.00 173.24 174.37 2wlv h PRO 16 N 0.17 0.66 -0.47 4.02 0.11 -1.99 -0.73 132.00 133.77 2wlv h PRO 16 Ca -0.47 -0.04 0.06 0.00 0.11 0.00 0.00 66.00 65.66 2wlv h PRO 16 Cb 1.26 -0.15 -0.05 0.00 0.11 0.00 0.00 31.00 32.17 2wlv h PRO 16 CO 0.54 0.44 0.16 0.00 -0.21 0.00 0.00 178.00 178.92 2wlv h ARG 17 N 0.68 0.32 -0.30 1.05 2.47 -1.99 0.10 114.38 116.72 2wlv h ARG 17 Ca 0.39 -0.02 -0.05 0.00 -1.26 0.00 0.00 59.98 59.04 2wlv h ARG 17 Cb 0.57 -0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 28.80 2wlv h ARG 17 CO -0.15 0.21 -0.00 1.15 0.56 0.00 0.00 179.97 181.74 2wlv h THR 18 N 0.33 1.26 -0.67 2.04 2.02 -1.53 -1.31 112.91 115.04 2wlv h THR 18 Ca 0.22 -0.94 -0.06 0.00 0.77 0.00 0.00 66.41 66.40 2wlv h THR 18 Cb 0.23 1.29 -0.03 0.00 -1.74 0.00 0.00 68.15 67.90 2wlv h THR 18 CO -0.23 0.30 0.18 -0.07 0.37 0.00 0.00 175.52 176.07 2wlv h LEU 19 N 0.31 1.01 -0.93 2.58 3.38 -1.09 -1.76 115.31 118.81 2wlv h LEU 19 Ca 0.08 -0.22 -0.10 0.00 0.09 0.00 0.00 57.88 57.73 2wlv h LEU 19 Cb 0.44 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 2wlv h LEU 19 CO 0.02 0.97 -0.28 0.78 0.09 0.00 0.00 178.44 180.01 2wlv h ASN 20 N 1.00 0.45 -0.74 -0.43 2.35 -0.90 -1.79 115.58 115.53 2wlv h ASN 20 Ca 0.21 -0.16 -0.04 0.00 -0.55 0.00 0.00 56.30 55.76 2wlv h ASN 20 Cb 0.34 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 38.55 2wlv h ASN 20 CO -0.00 0.72 0.31 0.00 -1.65 0.00 0.00 177.43 176.81 2wlv h ALA 21 N 1.31 0.96 -0.36 -0.83 0.00 -0.88 -1.14 119.26 118.32 2wlv h ALA 21 Ca 0.05 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2wlv h ALA 21 Cb 0.70 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2wlv h ALA 21 CO 0.05 0.57 0.23 2.35 0.00 0.00 0.00 179.25 182.45 2wlv h TRP 22 N 1.06 0.47 -0.25 0.00 -0.00 -0.94 -0.69 115.95 115.60 2wlv h TRP 22 Ca 0.25 0.01 0.04 0.00 -0.00 0.00 0.00 58.89 59.18 2wlv h TRP 22 Cb 0.19 -0.16 -0.04 0.00 -0.00 0.00 0.00 29.16 29.16 2wlv h TRP 22 CO 0.02 0.31 0.03 0.28 -0.00 0.00 0.00 178.44 179.08 2wlv h VAL 23 N 0.48 0.86 -0.57 2.65 2.07 -1.03 -0.93 116.25 119.78 2wlv h VAL 23 Ca 0.13 -0.04 0.03 0.00 0.82 0.00 0.00 66.70 67.64 2wlv h VAL 23 Cb -0.03 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 30.44 2wlv h VAL 23 CO -0.03 0.02 0.35 0.11 0.02 0.00 0.00 177.57 178.04 2wlv h LYS 24 N 0.11 0.67 -0.40 1.57 1.79 -0.95 -1.13 116.57 118.23 2wlv h LYS 24 Ca 0.12 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.55 2wlv h LYS 24 Cb 0.13 -0.15 -0.02 0.00 -1.58 0.00 0.00 32.23 30.61 2wlv h LYS 24 CO -0.17 0.44 0.26 1.25 -1.08 0.00 0.00 179.45 180.15 2wlv h LEU 25 N 0.69 0.46 -0.63 2.94 5.85 -0.70 -1.41 115.31 122.50 2wlv h LEU 25 Ca 0.23 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.91 2wlv h LEU 25 Cb 0.02 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 2wlv h LEU 25 CO -0.10 0.34 0.32 0.58 -0.34 0.00 0.00 178.44 179.24 2wlv h VAL 26 N 0.54 1.21 -0.00 1.05 2.07 -0.87 -3.18 116.25 117.07 2wlv h VAL 26 Ca 0.14 -0.58 0.00 0.00 0.82 0.00 0.00 66.70 67.08 2wlv h VAL 26 Cb -0.05 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 2wlv h VAL 26 CO -0.03 0.24 -0.24 -1.84 0.02 0.00 0.00 177.57 175.72 2wlv n GLU 27 N -4.51 0.47 -0.04 1.57 0.28 -0.45 -1.45 120.64 116.51 2wlv n GLU 27 Ca 0.04 -0.22 -0.09 0.00 -0.16 0.00 0.00 57.16 56.73 2wlv n GLU 27 Cb 0.11 -1.50 -0.03 0.00 1.43 0.00 0.00 31.44 31.46 2wlv n GLU 27 CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 2wlv h GLU 28 N 0.54 0.11 0.00 3.44 4.57 -1.24 -3.24 114.58 118.76 2wlv h GLU 28 Ca 0.00 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 2wlv h GLU 28 Cb 0.45 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.02 2wlv h GLU 28 CO 0.00 0.07 0.00 1.63 -1.18 0.00 0.00 179.01 179.53 2wlv n LYS 29 N -5.09 -0.03 -2.28 1.92 4.76 -1.26 -5.05 118.16 111.13 2wlv n LYS 29 Ca -0.03 -0.72 -0.03 0.00 -2.87 0.00 0.00 58.31 54.66 2wlv n LYS 29 Cb 0.09 -0.98 0.00 0.00 -1.84 0.00 0.00 35.03 32.30 2wlv n LYS 29 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2wlv n LYS 30 N -0.12 -1.17 -3.54 1.97 5.02 -0.88 -4.25 118.16 115.20 2wlv n LYS 30 Ca 0.00 1.31 -0.19 0.00 -2.02 0.00 0.00 58.31 57.41 2wlv n LYS 30 Cb 0.07 -3.84 0.07 0.00 -0.02 0.00 0.00 35.03 31.31 2wlv n LYS 30 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2wlv n PHE 31 N -0.67 -2.19 -0.96 2.13 3.72 -0.53 -4.97 117.46 114.01 2wlv n PHE 31 Ca 0.05 0.92 -0.31 0.00 -0.05 0.00 0.00 57.45 58.06 2wlv n PHE 31 Cb 0.32 -4.86 0.14 0.00 -0.94 0.00 0.00 39.48 34.15 2wlv n PHE 31 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2wlv s GLY 32 N -4.22 1.66 0.55 1.37 0.00 -1.26 -4.29 107.32 101.13 2wlv s GLY 32 Ca 0.08 0.33 0.27 0.00 0.00 0.00 0.00 44.72 45.40 2wlv s GLY 32 CO 0.76 0.75 1.97 0.00 0.00 0.00 0.00 173.10 176.58 2wlv h ALA 33 N -1.62 2.44 -0.24 3.20 0.00 -1.95 -1.02 119.26 120.07 2wlv h ALA 33 Ca -0.46 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.50 2wlv h ALA 33 Cb 1.26 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 2wlv h ALA 33 CO 0.48 -0.71 0.30 1.05 0.00 0.00 0.00 179.25 180.37 2wlv h GLU 34 N 0.00 0.00 0.00 0.00 9.09 -1.95 -2.11 114.58 119.61 2wlv h GLU 34 Ca 0.26 0.00 -0.02 0.00 0.05 0.00 0.00 59.36 59.65 2wlv h GLU 34 Cb 1.11 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.20 2wlv h GLU 34 CO -0.00 0.00 -0.10 -0.39 0.05 0.00 0.00 179.01 178.57 2wlv h VAL 35 N 0.00 0.58 0.30 -1.06 -1.51 -1.47 -2.42 116.25 110.67 2wlv h VAL 35 Ca 0.11 -0.43 -0.01 0.00 -1.23 0.00 0.00 66.70 65.14 2wlv h VAL 35 Cb 0.72 1.28 0.00 0.00 -2.13 0.00 0.00 31.29 31.16 2wlv h VAL 35 CO -0.00 0.10 -0.14 0.58 -1.23 0.00 0.00 177.57 176.87 2wlv h VAL 36 N 0.00 0.38 -0.64 7.19 2.07 -1.61 0.26 116.25 123.91 2wlv h VAL 36 Ca -0.00 -0.81 -0.03 0.00 0.82 0.00 0.00 66.70 66.68 2wlv h VAL 36 Cb 0.27 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 30.64 2wlv h VAL 36 CO 0.01 0.09 0.29 1.55 0.02 0.00 0.00 177.57 179.54 2wlv h PRO 37 N -1.01 0.91 -0.43 1.57 0.13 -1.75 -2.26 132.00 129.17 2wlv h PRO 37 Ca -0.04 -0.13 0.00 0.00 -0.87 0.00 0.00 66.00 64.97 2wlv h PRO 37 Cb 0.46 -0.17 -0.02 0.00 0.13 0.00 0.00 31.00 31.40 2wlv h PRO 37 CO 0.07 0.72 0.28 0.78 -0.23 0.00 0.00 178.00 179.62 2wlv h GLY 38 N 0.99 0.60 0.94 1.56 0.00 -1.44 -2.35 103.07 103.38 2wlv h GLY 38 Ca 0.22 -0.22 0.02 0.00 0.00 0.00 0.00 47.33 47.35 2wlv h GLY 38 CO -0.03 0.22 0.55 -2.75 0.00 0.00 0.00 176.54 174.53 2wlv h PHE 39 N 0.58 1.04 -0.35 5.60 3.57 -0.64 -0.21 116.94 126.53 2wlv h PHE 39 Ca 0.16 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.74 2wlv h PHE 39 Cb -0.07 -0.35 -0.05 0.00 2.79 0.00 0.00 35.95 38.28 2wlv h PHE 39 CO -0.05 0.63 0.06 1.96 -2.23 0.00 0.00 178.31 178.68 2wlv h GLN 40 N 1.10 0.17 -0.26 1.11 1.08 -0.96 -0.81 115.11 116.54 2wlv h GLN 40 Ca 0.32 -0.01 -0.14 0.00 -1.45 0.00 0.00 58.65 57.37 2wlv h GLN 40 Cb -0.06 -0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 27.33 2wlv h GLN 40 CO -0.09 0.11 -0.39 0.00 -0.95 0.00 0.00 178.83 177.51 2wlv h ALA 41 N 1.27 0.39 0.00 3.87 0.00 -1.03 -2.85 119.26 120.92 2wlv h ALA 41 Ca 0.17 -0.45 -0.06 0.00 0.00 0.00 0.00 54.91 54.57 2wlv h ALA 41 Cb 0.20 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2wlv h ALA 41 CO -0.23 0.49 -0.28 -0.07 0.00 0.00 0.00 179.25 179.15 2wlv h LEU 42 N 0.45 0.00 -2.46 0.00 3.38 -0.75 -2.79 115.31 113.14 2wlv h LEU 42 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2wlv h LEU 42 Cb 0.98 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.73 2wlv h LEU 42 CO 0.09 0.28 0.00 -1.54 0.09 0.00 0.00 178.44 177.36 2wlv n SER 43 N -3.63 3.64 -4.75 -0.43 3.41 -0.34 -4.97 113.62 106.56 2wlv n SER 43 Ca -0.01 -2.00 -0.42 0.00 -0.26 0.00 0.00 58.87 56.19 2wlv n SER 43 Cb 0.41 -0.32 -0.01 0.00 -0.26 0.00 0.00 64.21 64.03 2wlv n SER 43 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2wlv n GLU 44 N 1.57 2.74 -1.11 4.33 0.00 -1.06 -1.84 120.64 125.26 2wlv n GLU 44 Ca 0.21 0.97 -0.04 0.00 0.00 0.00 0.00 57.16 58.30 2wlv n GLU 44 Cb 0.62 -2.76 -0.02 0.00 0.00 0.00 0.00 31.44 29.29 2wlv n GLU 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2wlv n GLY 45 N 2.00 0.63 3.89 8.31 0.00 -1.26 -4.96 105.19 113.81 2wlv n GLY 45 Ca 0.08 -0.32 -0.30 0.00 0.00 0.00 0.00 46.02 45.48 2wlv n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wlv s THR 47 N -2.07 3.84 0.29 0.00 -4.23 -1.26 -4.31 115.64 107.89 2wlv s THR 47 Ca 0.46 0.19 0.03 0.00 -1.18 0.00 0.00 61.69 61.19 2wlv s THR 47 Cb -0.11 -3.54 0.28 0.00 1.34 0.00 0.00 72.50 70.47 2wlv s THR 47 CO 0.28 -0.59 1.75 -0.65 -0.54 0.00 0.00 174.62 174.87 2wlv h PRO 48 N -0.24 0.61 -0.56 3.99 0.11 -1.84 -1.29 132.00 132.78 2wlv h PRO 48 Ca -0.45 -0.04 0.09 0.00 0.11 0.00 0.00 66.00 65.71 2wlv h PRO 48 Cb 1.24 -0.14 -0.07 0.00 0.11 0.00 0.00 31.00 32.15 2wlv h PRO 48 CO 0.62 0.41 0.17 -0.92 -0.21 0.00 0.00 178.00 178.06 2wlv h TYR 49 N 0.63 0.29 -0.56 0.65 3.20 -1.91 0.38 116.97 119.66 2wlv h TYR 49 Ca 0.54 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 62.40 2wlv h TYR 49 Cb 0.87 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 39.07 2wlv h TYR 49 CO -0.06 0.06 0.19 -0.44 -1.64 0.00 0.00 178.16 176.27 2wlv h ASP 50 N 0.33 0.81 -0.73 -2.11 3.32 -1.64 -1.51 116.42 114.89 2wlv h ASP 50 Ca 0.28 -0.20 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 2wlv h ASP 50 Cb 0.35 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.66 2wlv h ASP 50 CO -0.31 0.79 0.43 0.40 -1.72 0.00 0.00 179.24 178.82 2wlv h ILE 51 N 0.78 1.21 -0.57 0.35 2.04 -0.86 -1.29 117.51 119.18 2wlv h ILE 51 Ca 0.18 -0.49 -0.02 0.00 1.00 0.00 0.00 64.86 65.54 2wlv h ILE 51 Cb 0.26 0.22 -0.03 0.00 -0.74 0.00 0.00 36.82 36.53 2wlv h ILE 51 CO -0.01 0.22 0.26 0.78 0.00 0.00 0.00 178.15 179.41 2wlv h ASN 52 N 0.99 0.73 -0.66 1.72 2.35 -0.66 -0.81 115.58 119.24 2wlv h ASN 52 Ca 0.26 -0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 2wlv h ASN 52 Cb -0.01 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.14 2wlv h ASN 52 CO -0.05 0.63 0.42 1.56 -1.65 0.00 0.00 177.43 178.34 2wlv h GLN 53 N 0.81 0.88 -0.54 0.81 4.20 -0.53 0.09 115.11 120.83 2wlv h GLN 53 Ca 0.20 -0.06 0.04 0.00 0.06 0.00 0.00 58.65 58.89 2wlv h GLN 53 Cb 0.10 -0.19 -0.04 0.00 0.30 0.00 0.00 27.48 27.64 2wlv h GLN 53 CO -0.02 0.60 0.28 0.52 -0.67 0.00 0.00 178.83 179.54 2wlv h MET 54 N 0.90 0.53 -0.46 1.46 2.86 -0.53 -1.12 114.93 118.57 2wlv h MET 54 Ca 0.24 -0.03 -0.06 0.00 -2.06 0.00 0.00 59.70 57.79 2wlv h MET 54 Cb -0.07 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.45 2wlv h MET 54 CO -0.05 0.35 0.07 -0.07 1.06 0.00 0.00 176.91 178.27 2wlv h LEU 55 N 0.55 0.74 -1.42 1.22 3.38 -0.93 -2.85 115.31 116.00 2wlv h LEU 55 Ca 0.23 -0.27 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 2wlv h LEU 55 Cb 0.12 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 2wlv h LEU 55 CO -0.15 0.82 -0.15 0.78 0.09 0.00 0.00 178.44 179.84 2wlv h ASN 56 N 0.64 0.19 0.45 -0.43 2.35 -0.72 -1.32 115.58 116.73 2wlv h ASN 56 Ca 0.14 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.85 2wlv h ASN 56 Cb 0.40 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.72 2wlv h ASN 56 CO 0.01 0.36 0.00 0.00 -1.65 0.00 0.00 177.43 176.15 2wlv n VAL 58 N -2.29 1.99 0.55 0.00 0.24 -0.54 -4.81 118.33 113.47 2wlv n VAL 58 Ca 0.01 -2.81 0.09 0.00 -2.04 0.00 0.00 64.34 59.59 2wlv n VAL 58 Cb 0.15 -0.18 0.38 0.00 -1.47 0.00 0.00 33.84 32.72 2wlv n VAL 58 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2wlv n GLY 59 N -1.14 -1.12 0.00 7.63 0.00 -0.71 -1.58 105.19 108.28 2wlv n GLY 59 Ca 0.17 -0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.28 2wlv n GLY 59 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2wlv n ASP 60 N -1.63 0.00 -3.91 1.61 5.75 -1.26 -3.79 116.55 113.32 2wlv n ASP 60 Ca 0.04 -0.18 -0.43 0.00 -0.01 0.00 0.00 54.79 54.21 2wlv n ASP 60 Cb 0.21 -0.24 0.01 0.00 -1.03 0.00 0.00 41.12 40.07 2wlv n ASP 60 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 2wlv n HIS 61 N -1.24 2.39 0.22 2.11 8.25 -0.61 -4.85 115.22 121.49 2wlv n HIS 61 Ca 0.13 -2.59 0.08 0.00 -0.26 0.00 0.00 57.72 55.08 2wlv n HIS 61 Cb 0.17 -1.32 0.53 0.00 1.12 0.00 0.00 29.99 30.49 2wlv n HIS 61 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 2wlv h GLN 62 N 5.20 0.00 -0.28 -0.41 1.08 -1.83 -0.91 115.11 117.96 2wlv h GLN 62 Ca 0.29 0.00 0.05 0.00 -1.45 0.00 0.00 58.65 57.54 2wlv h GLN 62 Cb 0.55 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 27.94 2wlv h GLN 62 CO 1.34 0.24 0.02 0.00 -0.95 0.00 0.00 178.83 179.48 2wlv h ALA 63 N 1.76 0.27 -0.68 3.87 0.00 -1.94 -0.39 119.26 122.15 2wlv h ALA 63 Ca -0.00 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 2wlv h ALA 63 Cb 0.54 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 2wlv h ALA 63 CO 0.03 -0.39 0.30 0.00 0.00 0.00 0.00 179.25 179.18 2wlv h ALA 64 N 1.23 0.88 -0.82 0.00 0.00 -1.83 -2.71 119.26 116.02 2wlv h ALA 64 Ca 0.13 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2wlv h ALA 64 Cb 0.17 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 2wlv h ALA 64 CO -0.21 0.48 0.49 0.52 0.00 0.00 0.00 179.25 180.53 2wlv h MET 65 N 0.96 1.11 -0.45 0.00 2.07 -0.79 -0.04 114.93 117.78 2wlv h MET 65 Ca 0.23 -0.10 -0.10 0.00 -2.07 0.00 0.00 59.70 57.66 2wlv h MET 65 Cb 0.17 -0.23 -0.02 0.00 -1.87 0.00 0.00 31.60 29.65 2wlv h MET 65 CO -0.02 0.78 -0.14 1.96 1.07 0.00 0.00 176.91 180.56 2wlv h GLN 66 N 1.13 0.83 -0.37 1.72 4.20 -0.97 0.53 115.11 122.19 2wlv h GLN 66 Ca 0.29 -0.30 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 2wlv h GLN 66 Cb -0.05 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 2wlv h GLN 66 CO -0.06 0.92 0.11 0.82 -0.67 0.00 0.00 178.83 179.95 2wlv h ILE 67 N 0.74 1.22 -0.79 2.54 2.04 -1.08 -1.90 117.51 120.28 2wlv h ILE 67 Ca 0.12 -0.71 -0.04 0.00 1.00 0.00 0.00 64.86 65.22 2wlv h ILE 67 Cb 0.64 0.99 -0.03 0.00 -0.74 0.00 0.00 36.82 37.68 2wlv h ILE 67 CO 0.04 0.25 0.32 0.40 0.00 0.00 0.00 178.15 179.16 2wlv h ILE 68 N 0.44 1.26 -0.80 -0.67 2.04 -0.83 -2.77 117.51 116.18 2wlv h ILE 68 Ca 0.12 -0.81 -0.02 0.00 1.00 0.00 0.00 64.86 65.15 2wlv h ILE 68 Cb 0.27 0.32 -0.04 0.00 -0.74 0.00 0.00 36.82 36.63 2wlv h ILE 68 CO -0.00 0.33 0.44 -0.09 0.00 0.00 0.00 178.15 178.83 2wlv h ARG 69 N 1.14 1.11 -0.66 2.37 9.65 -0.68 0.15 114.38 127.47 2wlv h ARG 69 Ca 0.26 -0.13 -0.04 0.00 -1.10 0.00 0.00 59.98 58.97 2wlv h ARG 69 Cb 0.21 -0.22 -0.03 0.00 -1.39 0.00 0.00 29.97 28.54 2wlv h ARG 69 CO -0.02 0.82 0.25 1.49 2.80 0.00 0.00 179.97 185.31 2wlv h GLU 70 N 1.11 0.99 -0.30 0.20 4.81 -1.16 0.01 114.58 120.24 2wlv h GLU 70 Ca 0.28 -0.19 -0.02 0.00 -0.13 0.00 0.00 59.36 59.31 2wlv h GLU 70 Cb 0.03 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.24 2wlv h GLU 70 CO -0.04 0.84 0.12 0.82 -0.73 0.00 0.00 179.01 180.01 2wlv h ILE 71 N 0.93 1.18 -0.49 2.32 1.08 -1.18 -1.64 117.51 119.72 2wlv h ILE 71 Ca 0.22 -0.56 0.09 0.00 -0.39 0.00 0.00 64.86 64.22 2wlv h ILE 71 Cb 0.22 0.98 -0.08 0.00 -3.07 0.00 0.00 36.82 34.88 2wlv h ILE 71 CO -0.02 0.19 -0.01 0.40 -0.69 0.00 0.00 178.15 178.02 2wlv h ILE 72 N 0.34 0.60 -0.55 -0.67 2.04 -0.63 -0.29 117.51 118.36 2wlv h ILE 72 Ca 0.10 -0.03 -0.03 0.00 1.00 0.00 0.00 64.86 65.90 2wlv h ILE 72 Cb 0.19 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 2wlv h ILE 72 CO -0.01 0.02 0.21 0.78 0.00 0.00 0.00 178.15 179.15 2wlv h ASN 73 N 0.10 0.72 -0.15 1.72 2.35 -0.81 0.15 115.58 119.66 2wlv h ASN 73 Ca 0.24 -0.09 -0.01 0.00 -0.55 0.00 0.00 56.30 55.89 2wlv h ASN 73 Cb 0.37 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.55 2wlv h ASN 73 CO -0.42 0.66 0.06 -0.33 -1.65 0.00 0.00 177.43 175.75 2wlv h GLU 74 N 0.78 0.23 -0.26 0.81 5.08 -0.64 -1.90 114.58 118.69 2wlv h GLU 74 Ca 0.19 -0.04 -0.12 0.00 -1.00 0.00 0.00 59.36 58.39 2wlv h GLU 74 Cb 0.17 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 2wlv h GLU 74 CO -0.02 0.32 -0.33 0.93 -1.00 0.00 0.00 179.01 178.91 2wlv h GLU 75 N 0.08 0.55 -0.58 2.33 4.39 -0.71 -1.12 114.58 119.52 2wlv h GLU 75 Ca 0.05 -0.25 -0.10 0.00 0.34 0.00 0.00 59.36 59.41 2wlv h GLU 75 Cb 0.18 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.80 2wlv h GLU 75 CO -0.00 0.81 -0.02 0.00 -1.16 0.00 0.00 179.01 178.63 2wlv h ALA 76 N 1.18 0.86 -0.22 3.43 0.00 -0.69 -0.33 119.26 123.49 2wlv h ALA 76 Ca 0.05 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.60 2wlv h ALA 76 Cb 0.80 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2wlv h ALA 76 CO 0.07 0.66 -0.04 0.00 0.00 0.00 0.00 179.25 179.94 2wlv h ALA 77 N 1.03 0.30 -0.15 0.00 0.00 -1.15 -1.10 119.26 118.19 2wlv h ALA 77 Ca 0.16 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 54.87 2wlv h ALA 77 Cb 0.57 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 2wlv h ALA 77 CO 0.03 0.08 -0.11 0.93 0.00 0.00 0.00 179.25 180.18 2wlv h GLU 78 N 0.16 -0.12 -0.84 0.00 5.08 -1.10 -0.99 114.58 116.77 2wlv h GLU 78 Ca 0.06 0.01 0.13 0.00 -1.00 0.00 0.00 59.36 58.55 2wlv h GLU 78 Cb 0.48 0.03 -0.09 0.00 0.50 0.00 0.00 28.75 29.67 2wlv h GLU 78 CO 0.02 -0.08 0.45 2.35 -1.00 0.00 0.00 179.01 180.75 2wlv h TRP 79 N -0.12 0.80 -0.42 4.33 2.91 -0.85 0.46 115.95 123.06 2wlv h TRP 79 Ca 0.09 0.03 -0.12 0.00 1.13 0.00 0.00 58.89 60.03 2wlv h TRP 79 Cb 0.26 -0.23 -0.01 0.00 -0.51 0.00 0.00 29.16 28.67 2wlv h TRP 79 CO -0.25 0.24 -0.22 -0.44 -1.03 0.00 0.00 178.44 176.75 2wlv h ASP 80 N 0.68 0.86 -0.31 2.65 3.32 -0.81 -2.14 116.42 120.67 2wlv h ASP 80 Ca 0.44 -0.31 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 2wlv h ASP 80 Cb 0.55 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 2wlv h ASP 80 CO -0.32 1.04 0.14 0.58 -1.72 0.00 0.00 179.24 178.96 2wlv h VAL 81 N 0.73 1.16 0.00 -1.35 2.07 0.41 -2.56 116.25 116.71 2wlv h VAL 81 Ca 0.10 -0.48 0.00 0.00 0.82 0.00 0.00 66.70 67.14 2wlv h VAL 81 Cb 0.75 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 2wlv h VAL 81 CO 0.06 0.17 0.00 0.00 0.02 0.00 0.00 177.57 177.82 2wlv n GLN 82 N -4.76 0.15 -3.18 1.57 6.02 -0.48 -4.03 117.38 112.68 2wlv n GLN 82 Ca -0.02 0.18 -0.19 0.00 -0.01 0.00 0.00 57.00 56.96 2wlv n GLN 82 Cb 0.11 -1.50 -0.04 0.00 1.02 0.00 0.00 30.24 29.84 2wlv n GLN 82 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 2wlv n HIS 83 N -1.33 0.34 0.01 1.08 8.25 -0.84 -5.05 115.22 117.67 2wlv n HIS 83 Ca 0.06 -3.80 0.19 0.00 -0.26 0.00 0.00 57.72 53.91 2wlv n HIS 83 Cb 0.12 -0.42 0.38 0.00 1.12 0.00 0.00 29.99 31.19 2wlv n HIS 83 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2wlv h PRO 84 N 3.14 0.00 0.00 -0.41 0.13 -1.69 -3.46 132.00 129.70 2wlv h PRO 84 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 2wlv h PRO 84 Cb 0.93 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.06 2wlv h PRO 84 CO 0.51 0.00 0.00 -0.89 -0.23 0.00 0.00 178.00 177.39 2wlv n ILE 85 N -3.07 0.00 1.02 -3.56 5.41 -1.26 -5.04 119.36 112.87 2wlv n ILE 85 Ca 0.13 0.00 0.12 0.00 1.00 0.00 0.00 62.75 64.00 2wlv n ILE 85 Cb 1.20 0.00 0.18 0.00 -0.71 0.00 0.00 39.64 40.32 2wlv n ILE 85 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 2wlv n PRO 86 N 0.00 0.11 0.00 0.38 -0.02 -1.26 -4.98 135.00 129.23 2wlv n PRO 86 Ca 0.00 -0.07 0.00 0.00 -2.02 0.00 0.00 63.50 61.41 2wlv n PRO 86 Cb 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 2wlv n PRO 86 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wlv n GLY 87 N 1.48 0.38 3.77 -1.23 0.00 -1.26 -4.81 105.19 103.52 2wlv n GLY 87 Ca 0.06 -1.16 -0.40 0.00 0.00 0.00 0.00 46.02 44.52 2wlv n GLY 87 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2wlv s PRO 88 N 0.00 4.22 -0.32 1.61 0.04 -1.26 -5.14 135.00 134.15 2wlv s PRO 88 Ca 0.00 2.12 -0.09 0.00 0.04 0.00 0.00 61.00 63.07 2wlv s PRO 88 Cb 0.00 -2.93 0.00 0.00 0.04 0.00 0.00 34.50 31.61 2wlv s PRO 88 CO 0.00 -0.27 0.15 -1.17 0.04 0.00 0.00 177.00 175.75 2wlv s LEU 89 N -2.06 4.19 0.57 -3.56 2.96 -1.26 -5.07 118.68 114.46 2wlv s LEU 89 Ca 0.52 -0.66 -0.19 0.00 -0.22 0.00 0.00 54.13 53.58 2wlv s LEU 89 Cb -0.37 -1.98 -0.04 0.00 0.50 0.00 0.00 46.19 44.29 2wlv s LEU 89 CO 0.49 -0.23 1.18 -2.84 -1.32 0.00 0.00 176.35 173.62 2wlv s PRO 90 N 1.58 3.12 0.27 0.98 0.02 -1.26 -4.93 135.00 134.78 2wlv s PRO 90 Ca 0.04 1.74 -0.03 0.00 0.02 0.00 0.00 61.00 62.76 2wlv s PRO 90 Cb -0.18 -1.96 0.56 0.00 0.02 0.00 0.00 34.50 32.94 2wlv s PRO 90 CO 0.06 -1.06 1.64 0.00 -0.33 0.00 0.00 177.00 177.30 2wlv h ALA 91 N 1.00 0.99 0.00 -1.55 0.00 -2.04 -2.69 119.26 114.98 2wlv h ALA 91 Ca -0.50 0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.60 2wlv h ALA 91 Cb 1.28 0.39 -0.02 0.00 0.00 0.00 0.00 17.79 19.44 2wlv h ALA 91 CO 0.56 -0.44 0.06 0.41 0.00 0.00 0.00 179.25 179.84 2wlv n GLY 92 N -1.41 1.67 3.64 0.00 0.00 -1.26 -4.95 105.19 102.87 2wlv n GLY 92 Ca 0.17 -0.30 -0.10 0.00 0.00 0.00 0.00 46.02 45.79 2wlv n GLY 92 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2wlv s GLN 93 N 1.69 0.76 0.15 1.61 2.00 -1.02 -5.14 119.66 119.70 2wlv s GLN 93 Ca 0.17 1.08 -0.31 0.00 -2.00 0.00 0.00 55.36 54.31 2wlv s GLN 93 Cb 0.08 0.27 -0.08 0.00 0.80 0.00 0.00 33.01 34.08 2wlv s GLN 93 CO 0.00 -0.12 1.32 -1.17 -0.50 0.00 0.00 175.29 174.82 2wlv s LEU 94 N 0.99 4.39 0.94 3.68 2.96 -1.26 -4.87 118.68 125.52 2wlv s LEU 94 Ca -0.05 2.31 -0.10 0.00 -0.22 0.00 0.00 54.13 56.06 2wlv s LEU 94 Cb -0.05 -3.60 0.16 0.00 0.50 0.00 0.00 46.19 43.20 2wlv s LEU 94 CO -0.09 -0.56 1.13 0.00 -1.32 0.00 0.00 176.35 175.50 2wlv s ARG 95 N 0.51 0.83 0.38 1.98 1.70 -1.26 -4.99 118.95 118.10 2wlv s ARG 95 Ca 0.60 1.41 -0.26 0.00 -0.47 0.00 0.00 55.73 57.01 2wlv s ARG 95 Cb -0.35 -1.72 -0.09 0.00 -0.57 0.00 0.00 34.95 32.22 2wlv s ARG 95 CO 0.34 -2.72 1.20 -1.21 -1.08 0.00 0.00 175.30 171.83 2wlv s GLU 96 N -4.65 4.14 0.31 3.89 0.41 -1.26 -4.97 118.70 116.57 2wlv s GLU 96 Ca 0.67 1.93 -0.29 0.00 -0.41 0.00 0.00 54.97 56.87 2wlv s GLU 96 Cb -0.23 -2.79 -0.10 0.00 -1.78 0.00 0.00 34.13 29.24 2wlv s GLU 96 CO 0.59 -0.28 1.17 -1.25 -0.49 0.00 0.00 175.26 175.00 2wlv s PRO 97 N -2.14 4.50 0.51 0.39 0.04 -1.26 -5.04 135.00 132.00 2wlv s PRO 97 Ca 0.55 1.94 0.06 0.00 0.04 0.00 0.00 61.00 63.59 2wlv s PRO 97 Cb -0.33 -3.11 0.04 0.00 0.04 0.00 0.00 34.50 31.15 2wlv s PRO 97 CO 0.42 0.04 0.70 1.03 0.04 0.00 0.00 177.00 179.23 2wlv s ARG 98 N -1.64 2.56 0.25 4.56 1.81 -1.26 -4.92 118.95 120.32 2wlv s ARG 98 Ca 0.47 -1.22 -0.02 0.00 -1.72 0.00 0.00 55.73 53.23 2wlv s ARG 98 Cb -0.34 -2.64 0.51 0.00 -0.45 0.00 0.00 34.95 32.02 2wlv s ARG 98 CO 0.45 -0.59 1.73 0.78 -0.68 0.00 0.00 175.30 176.99 2wlv h GLY 99 N 0.33 1.25 2.00 -3.53 0.00 -1.92 -0.01 103.07 101.19 2wlv h GLY 99 Ca -0.38 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 46.77 2wlv h GLY 99 CO 0.45 -0.10 0.00 1.48 0.00 0.00 0.00 176.54 178.37 2wlv h SER 100 N 0.49 0.00 0.04 0.19 4.64 -1.95 -1.70 113.55 115.26 2wlv h SER 100 Ca 0.44 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.59 2wlv h SER 100 Cb 0.68 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.79 2wlv h SER 100 CO -0.41 0.00 -0.72 0.44 -0.87 0.00 0.00 176.83 175.27 2wlv h ASP 101 N 0.00 0.56 -0.85 4.97 3.32 -1.38 -0.63 116.42 122.42 2wlv h ASP 101 Ca 0.00 -0.81 0.03 0.00 0.02 0.00 0.00 57.03 56.27 2wlv h ASP 101 Cb 0.56 -0.17 -0.05 0.00 0.22 0.00 0.00 39.33 39.89 2wlv h ASP 101 CO 0.00 1.31 0.56 0.40 -1.72 0.00 0.00 179.24 179.78 2wlv h ILE 102 N -0.11 1.16 0.00 0.35 2.04 -0.86 -2.17 117.51 117.92 2wlv h ILE 102 Ca -0.10 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.39 2wlv h ILE 102 Cb 1.45 -0.01 0.00 0.00 -0.74 0.00 0.00 36.82 37.52 2wlv h ILE 102 CO 0.14 0.20 0.00 0.00 0.00 0.00 0.00 178.15 178.49 2wlv n ALA 103 N -2.41 2.40 -1.26 1.87 0.00 -0.67 -4.66 120.51 115.78 2wlv n ALA 103 Ca 0.11 -0.15 -0.08 0.00 0.00 0.00 0.00 53.44 53.32 2wlv n ALA 103 Cb 0.09 -1.43 -0.04 0.00 0.00 0.00 0.00 19.45 18.07 2wlv n ALA 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wlv n GLY 104 N 0.79 1.01 0.10 0.00 0.00 -0.82 -4.91 105.19 101.36 2wlv n GLY 104 Ca 0.16 -0.66 -0.19 0.00 0.00 0.00 0.00 46.02 45.33 2wlv n GLY 104 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2wlv h THR 105 N 0.00 0.92 -0.52 2.61 2.02 -1.38 -3.40 112.91 113.16 2wlv h THR 105 Ca -0.17 -2.07 0.00 0.00 0.77 0.00 0.00 66.41 64.93 2wlv h THR 105 Cb 0.56 2.12 0.00 0.00 -1.74 0.00 0.00 68.15 69.09 2wlv h THR 105 CO 0.25 0.31 0.00 0.35 0.37 0.00 0.00 175.52 176.80 2wlv n THR 106 N -4.47 0.88 -4.33 3.16 -2.24 -0.80 -4.95 114.28 101.52 2wlv n THR 106 Ca -0.27 -0.94 -0.26 0.00 -2.27 0.00 0.00 64.05 60.31 2wlv n THR 106 Cb 0.61 0.61 -0.13 0.00 -2.10 0.00 0.00 70.33 69.33 2wlv n THR 106 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2wlv s SER 107 N -1.07 2.86 0.50 3.42 1.04 -1.26 -4.84 113.70 114.35 2wlv s SER 107 Ca 0.37 -0.71 -0.01 0.00 0.48 0.00 0.00 55.95 56.08 2wlv s SER 107 Cb 0.20 -0.17 0.01 0.00 0.10 0.00 0.00 66.02 66.15 2wlv s SER 107 CO 0.26 0.11 0.74 0.42 0.98 0.00 0.00 173.24 175.75 2wlv s THR 108 N -1.13 3.64 0.38 2.02 -4.23 -1.26 -4.77 115.64 110.28 2wlv s THR 108 Ca 0.10 -0.43 0.06 0.00 -1.18 0.00 0.00 61.69 60.24 2wlv s THR 108 Cb -0.10 -3.37 0.21 0.00 1.34 0.00 0.00 72.50 70.58 2wlv s THR 108 CO 0.05 -0.29 1.96 1.62 -0.54 0.00 0.00 174.62 177.43 2wlv h VAL 109 N 0.21 1.15 -0.69 2.29 3.04 -1.99 -0.89 116.25 119.36 2wlv h VAL 109 Ca -0.45 -0.52 -0.06 0.00 -1.01 0.00 0.00 66.70 64.65 2wlv h VAL 109 Cb 1.26 0.80 -0.03 0.00 -2.01 0.00 0.00 31.29 31.31 2wlv h VAL 109 CO 0.57 0.19 0.19 -0.33 -1.01 0.00 0.00 177.57 177.18 2wlv h GLU 110 N 0.48 1.09 -0.38 4.17 3.07 -1.99 -1.00 114.58 120.03 2wlv h GLU 110 Ca 0.12 -0.25 -0.04 0.00 -0.50 0.00 0.00 59.36 58.69 2wlv h GLU 110 Cb 0.16 -0.15 -0.02 0.00 -0.84 0.00 0.00 28.75 27.91 2wlv h GLU 110 CO -0.01 0.95 0.08 0.93 -1.40 0.00 0.00 179.01 179.57 2wlv h GLU 111 N 1.04 0.62 -0.26 2.33 5.08 -1.80 -1.81 114.58 119.77 2wlv h GLU 111 Ca 0.22 -0.16 0.03 0.00 -1.00 0.00 0.00 59.36 58.46 2wlv h GLU 111 Cb 0.34 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 2wlv h GLU 111 CO -0.00 0.66 0.07 1.96 -1.00 0.00 0.00 179.01 180.70 2wlv h GLN 112 N 0.47 0.18 -0.79 2.33 4.20 -0.89 -1.50 115.11 119.11 2wlv h GLN 112 Ca 0.12 -0.01 -0.04 0.00 0.06 0.00 0.00 58.65 58.78 2wlv h GLN 112 Cb 0.33 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 28.03 2wlv h GLN 112 CO 0.00 0.12 0.33 0.82 -0.67 0.00 0.00 178.83 179.43 2wlv h ILE 113 N 0.18 1.26 -0.43 2.54 2.04 -1.06 -1.10 117.51 120.94 2wlv h ILE 113 Ca 0.12 -0.78 0.00 0.00 1.00 0.00 0.00 64.86 65.20 2wlv h ILE 113 Cb 0.11 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 36.46 2wlv h ILE 113 CO -0.14 0.32 0.28 -0.61 0.00 0.00 0.00 178.15 178.00 2wlv h GLN 114 N 1.14 0.57 -0.76 2.37 4.15 -0.75 -0.93 115.11 120.90 2wlv h GLN 114 Ca 0.27 -0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.63 2wlv h GLN 114 Cb 0.18 -0.13 -0.04 0.00 0.21 0.00 0.00 27.48 27.71 2wlv h GLN 114 CO -0.03 0.38 0.39 -1.49 -1.93 0.00 0.00 178.83 176.15 2wlv h TRP 115 N 0.58 1.07 -0.06 3.99 6.55 -0.95 -0.32 115.95 126.80 2wlv h TRP 115 Ca 0.16 -0.04 -0.13 0.00 0.95 0.00 0.00 58.89 59.83 2wlv h TRP 115 Cb -0.06 -0.34 -0.01 0.00 -0.86 0.00 0.00 29.16 27.89 2wlv h TRP 115 CO -0.04 0.77 -0.53 0.52 -1.05 0.00 0.00 178.44 178.10 2wlv h MET 116 N 1.06 0.18 -0.01 0.49 2.86 -0.75 0.21 114.93 118.96 2wlv h MET 116 Ca 0.26 -0.11 0.00 0.00 -2.06 0.00 0.00 59.70 57.80 2wlv h MET 116 Cb 0.08 0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.75 2wlv h MET 116 CO -0.04 0.67 -0.06 1.19 1.06 0.00 0.00 176.91 179.73 2wlv n PHE 117 N -3.92 0.00 -2.03 -0.22 3.72 -0.39 -4.64 117.46 109.98 2wlv n PHE 117 Ca -0.02 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.00 2wlv n PHE 117 Cb 0.56 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 39.11 2wlv n PHE 117 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 2wlv s ARG 118 N -0.80 3.59 0.40 -1.08 1.70 -0.14 -4.91 118.95 117.71 2wlv s ARG 118 Ca 0.07 2.05 0.21 0.00 -0.47 0.00 0.00 55.73 57.59 2wlv s ARG 118 Cb 0.06 -2.45 0.39 0.00 -0.57 0.00 0.00 34.95 32.38 2wlv s ARG 118 CO 0.12 -0.77 1.61 -1.00 -1.08 0.00 0.00 175.30 174.18 2wlv h PRO 119 N 2.01 0.00 -4.51 3.89 0.13 -1.94 -3.21 132.00 128.37 2wlv h PRO 119 Ca -0.50 0.00 -0.73 0.00 -0.87 0.00 0.00 66.00 63.90 2wlv h PRO 119 Cb 1.27 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.18 2wlv h PRO 119 CO 0.60 0.19 0.34 -0.65 -0.23 0.00 0.00 178.00 178.25 2wlv s GLN 120 N -3.21 3.41 -0.89 0.86 -0.21 -1.26 -4.51 119.66 113.85 2wlv s GLN 120 Ca 0.05 -1.85 -0.04 0.00 0.02 0.00 0.00 55.36 53.54 2wlv s GLN 120 Cb 0.07 -4.53 -0.03 0.00 1.00 0.00 0.00 33.01 29.52 2wlv s GLN 120 CO 0.68 -1.53 0.79 0.09 -2.12 0.00 0.00 175.29 173.19 2wlv n ASN 121 N 5.61 -7.01 -4.66 5.90 3.02 -1.26 -4.95 115.26 111.90 2wlv n ASN 121 Ca 0.09 -0.44 -0.34 0.00 -0.03 0.00 0.00 54.58 53.86 2wlv n ASN 121 Cb 0.46 -4.92 0.11 0.00 -0.61 0.00 0.00 39.78 34.82 2wlv n ASN 121 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2wlv n PRO 122 N -2.57 0.34 -4.04 3.52 -0.04 -1.21 -4.99 135.00 126.01 2wlv n PRO 122 Ca -0.05 0.19 -0.31 0.00 -0.04 0.00 0.00 63.50 63.28 2wlv n PRO 122 Cb 0.56 -2.37 -0.16 0.00 -0.04 0.00 0.00 33.50 31.49 2wlv n PRO 122 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2wlv s VAL 123 N -1.98 1.78 -1.41 0.52 1.01 0.06 -5.00 120.40 115.38 2wlv s VAL 123 Ca 0.74 -0.97 -0.13 0.00 0.00 0.00 0.00 61.98 61.61 2wlv s VAL 123 Cb -0.31 -1.76 0.07 0.00 0.00 0.00 0.00 36.38 34.38 2wlv s VAL 123 CO 0.50 0.30 2.11 -0.81 0.00 0.00 0.00 175.10 177.20 2wlv n PRO 124 N 4.66 3.04 0.01 2.72 -0.04 -1.26 -3.25 135.00 140.89 2wlv n PRO 124 Ca -0.17 -2.86 0.01 0.00 -0.04 0.00 0.00 63.50 60.45 2wlv n PRO 124 Cb 0.48 -3.22 0.34 0.00 -0.04 0.00 0.00 33.50 31.05 2wlv n PRO 124 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 2wlv h VAL 125 N 4.06 1.17 -0.35 0.52 -1.51 -1.90 -0.98 116.25 117.27 2wlv h VAL 125 Ca 0.52 -0.62 -0.02 0.00 -1.23 0.00 0.00 66.70 65.35 2wlv h VAL 125 Cb 0.66 0.86 -0.02 0.00 -2.13 0.00 0.00 31.29 30.66 2wlv h VAL 125 CO 1.80 0.22 0.15 1.23 -1.23 0.00 0.00 177.57 179.74 2wlv h GLY 126 N 0.75 0.55 1.60 5.19 0.00 -1.86 -1.52 103.07 107.78 2wlv h GLY 126 Ca 0.11 -0.29 -0.12 0.00 0.00 0.00 0.00 47.33 47.03 2wlv h GLY 126 CO 0.00 0.27 -0.41 3.43 0.00 0.00 0.00 176.54 179.83 2wlv h ASN 127 N 0.41 0.47 -0.09 0.19 2.35 -1.56 -0.38 115.58 116.97 2wlv h ASN 127 Ca 0.12 -0.21 -0.00 0.00 -0.55 0.00 0.00 56.30 55.66 2wlv h ASN 127 Cb 0.16 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 38.39 2wlv h ASN 127 CO -0.01 0.83 0.05 0.40 -1.65 0.00 0.00 177.43 177.04 2wlv h ILE 128 N 0.37 1.09 -0.70 2.81 2.04 -1.16 -2.13 117.51 119.83 2wlv h ILE 128 Ca 0.03 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.65 2wlv h ILE 128 Cb 0.88 1.09 -0.03 0.00 -0.74 0.00 0.00 36.82 38.02 2wlv h ILE 128 CO 0.07 0.08 0.44 0.22 0.00 0.00 0.00 178.15 178.96 2wlv h TYR 129 N 0.04 0.90 -0.99 1.37 3.20 -1.13 -1.98 116.97 118.39 2wlv h TYR 129 Ca 0.03 0.01 0.12 0.00 3.14 0.00 0.00 58.73 62.03 2wlv h TYR 129 Cb 0.08 -0.30 -0.08 0.00 1.54 0.00 0.00 36.73 37.97 2wlv h TYR 129 CO -0.04 0.59 0.62 0.00 -1.64 0.00 0.00 178.16 177.69 2wlv h ARG 130 N 0.95 0.94 -0.65 1.82 3.08 -0.91 -0.25 114.38 119.37 2wlv h ARG 130 Ca 0.25 -0.06 -0.08 0.00 0.07 0.00 0.00 59.98 60.17 2wlv h ARG 130 Cb -0.06 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 29.75 2wlv h ARG 130 CO -0.05 0.62 0.11 0.00 -1.07 0.00 0.00 179.97 179.58 2wlv h ARG 131 N 0.97 1.06 -0.47 0.04 3.08 -0.68 -0.87 114.38 117.50 2wlv h ARG 131 Ca 0.48 -0.27 -0.01 0.00 0.07 0.00 0.00 59.98 60.25 2wlv h ARG 131 Cb 0.49 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.39 2wlv h ARG 131 CO -0.25 0.97 0.25 -1.49 -1.07 0.00 0.00 179.97 178.38 2wlv h TRP 132 N 0.99 0.65 -0.82 3.04 6.55 -0.81 -2.55 115.95 123.01 2wlv h TRP 132 Ca 0.20 -0.02 -0.04 0.00 0.95 0.00 0.00 58.89 59.98 2wlv h TRP 132 Cb 0.42 -0.21 -0.04 0.00 -0.86 0.00 0.00 29.16 28.48 2wlv h TRP 132 CO 0.03 0.50 0.36 0.82 -1.05 0.00 0.00 178.44 179.10 2wlv h ILE 133 N 0.62 1.26 -0.57 1.49 1.08 -0.88 -1.86 117.51 118.64 2wlv h ILE 133 Ca 0.16 -0.78 0.06 0.00 -0.39 0.00 0.00 64.86 63.92 2wlv h ILE 133 Cb 0.07 0.24 -0.05 0.00 -3.07 0.00 0.00 36.82 34.01 2wlv h ILE 133 CO -0.02 0.33 0.28 -0.61 -0.69 0.00 0.00 178.15 177.43 2wlv h GLN 134 N 1.18 0.51 -0.58 2.37 4.15 -0.90 0.24 115.11 122.08 2wlv h GLN 134 Ca 0.28 -0.03 0.03 0.00 0.77 0.00 0.00 58.65 59.70 2wlv h GLN 134 Cb 0.17 -0.11 -0.04 0.00 0.21 0.00 0.00 27.48 27.71 2wlv h GLN 134 CO -0.03 0.34 0.35 0.82 -1.93 0.00 0.00 178.83 178.38 2wlv h ILE 135 N 0.52 1.06 -0.54 2.39 2.04 -1.07 -0.32 117.51 121.59 2wlv h ILE 135 Ca 0.26 -0.24 -0.02 0.00 1.00 0.00 0.00 64.86 65.86 2wlv h ILE 135 Cb 0.21 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.57 2wlv h ILE 135 CO -0.20 0.13 0.24 1.23 0.00 0.00 0.00 178.15 179.55 2wlv h GLY 136 N 0.69 0.84 1.05 5.37 0.00 -0.52 -2.09 103.07 108.41 2wlv h GLY 136 Ca 0.24 -0.43 -0.07 0.00 0.00 0.00 0.00 47.33 47.07 2wlv h GLY 136 CO -0.10 0.41 0.15 1.41 0.00 0.00 0.00 176.54 178.40 2wlv h LEU 137 N 0.72 1.01 -1.00 3.11 3.38 -0.22 0.10 115.31 122.40 2wlv h LEU 137 Ca 0.18 -0.24 0.07 0.00 0.09 0.00 0.00 57.88 57.98 2wlv h LEU 137 Cb 0.15 -0.27 -0.07 0.00 0.09 0.00 0.00 40.66 40.56 2wlv h LEU 137 CO -0.02 0.99 0.65 1.56 0.09 0.00 0.00 178.44 181.71 2wlv h GLN 138 N 0.98 1.13 -0.42 1.13 4.20 -0.91 -1.03 115.11 120.19 2wlv h GLN 138 Ca 0.20 -0.07 -0.13 0.00 0.06 0.00 0.00 58.65 58.71 2wlv h GLN 138 Cb 0.38 -0.26 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 2wlv h GLN 138 CO 0.00 0.75 -0.26 -0.22 -0.67 0.00 0.00 178.83 178.43 2wlv h LYS 139 N 1.17 0.89 -0.54 1.46 3.64 -0.87 -2.28 116.57 120.03 2wlv h LYS 139 Ca 0.44 -0.40 0.04 0.00 -1.27 0.00 0.00 60.65 59.46 2wlv h LYS 139 Cb 0.19 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.94 2wlv h LYS 139 CO -0.18 1.04 0.29 0.00 -2.27 0.00 0.00 179.45 178.34 2wlv h VAL 141 N 0.57 1.05 -0.13 0.00 2.07 -1.01 -0.92 116.25 117.88 2wlv h VAL 141 Ca 0.24 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.54 2wlv h VAL 141 Cb 0.12 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 2wlv h VAL 141 CO -0.15 0.11 0.06 0.03 0.02 0.00 0.00 177.57 177.64 2wlv h ARG 142 N 0.61 0.19 0.00 1.57 3.08 -0.98 -3.32 114.38 115.53 2wlv h ARG 142 Ca 0.21 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.21 2wlv h ARG 142 Cb 0.03 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.04 2wlv h ARG 142 CO -0.10 0.25 -0.30 0.52 -1.07 0.00 0.00 179.97 179.28 2wlv h MET 143 N 0.07 0.00 0.00 0.04 2.86 -0.58 -3.52 114.93 113.81 2wlv h MET 143 Ca 0.04 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 2wlv h MET 143 Cb 0.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.79 2wlv h MET 143 CO -0.01 0.07 0.00 0.66 1.06 0.00 0.00 176.91 178.70