#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vpw s PRO 2 N 0.00 -0.10 -0.31 3.17 0.02 -1.26 -4.95 135.00 131.57 2vpw s PRO 2 Ca 0.00 -0.04 0.02 0.00 0.02 0.00 0.00 61.00 61.01 2vpw s PRO 2 Cb 0.00 -1.73 0.09 0.00 0.02 0.00 0.00 34.50 32.89 2vpw s PRO 2 CO 0.00 -2.97 0.04 1.03 -0.33 0.00 0.00 177.00 174.77 2vpw s ARG 3 N -5.47 1.35 0.24 5.54 0.52 -1.25 -4.22 118.95 115.66 2vpw s ARG 3 Ca 0.70 -1.54 -0.30 0.00 -0.52 0.00 0.00 55.73 54.07 2vpw s ARG 3 Cb -0.10 -2.81 -0.09 0.00 0.52 0.00 0.00 34.95 32.47 2vpw s ARG 3 CO 0.55 -0.89 1.22 0.71 0.02 0.00 0.00 175.30 176.91 2vpw s TYR 4 N 1.15 3.35 0.24 -0.53 1.51 0.66 -0.33 117.35 123.40 2vpw s TYR 4 Ca 0.07 1.43 -0.10 0.00 -1.01 0.00 0.00 57.07 57.47 2vpw s TYR 4 Cb -0.19 -3.49 -0.01 0.00 -0.11 0.00 0.00 41.96 38.17 2vpw s TYR 4 CO -0.12 -1.34 0.39 0.00 -1.11 0.00 0.00 175.55 173.37 2vpw s ALA 5 N -0.46 0.11 -0.01 3.71 0.00 -0.35 -4.89 121.76 119.86 2vpw s ALA 5 Ca 0.51 -1.08 0.00 0.00 0.00 0.00 0.00 51.96 51.39 2vpw s ALA 5 Cb -0.35 1.15 0.01 0.00 0.00 0.00 0.00 23.12 23.93 2vpw s ALA 5 CO 0.41 -0.79 -0.01 1.41 0.00 0.00 0.00 175.76 176.78 2vpw s MET 6 N -4.05 0.16 -0.06 0.00 1.75 -0.54 -2.20 119.30 114.37 2vpw s MET 6 Ca 0.27 0.01 0.04 0.00 -1.25 0.00 0.00 55.69 54.75 2vpw s MET 6 Cb 0.01 -0.25 0.00 0.00 2.84 0.00 0.00 34.83 37.43 2vpw s MET 6 CO 0.10 -0.04 -0.18 0.00 -0.65 0.00 0.00 175.02 174.25 2vpw s ALA 7 N 0.40 1.63 -0.10 4.11 0.00 0.23 -0.23 121.76 127.80 2vpw s ALA 7 Ca -0.04 -0.70 0.03 0.00 0.00 0.00 0.00 51.96 51.25 2vpw s ALA 7 Cb -0.06 -0.59 0.01 0.00 0.00 0.00 0.00 23.12 22.48 2vpw s ALA 7 CO -0.01 0.25 -0.19 0.42 0.00 0.00 0.00 175.76 176.23 2vpw s ILE 8 N 0.24 1.71 -0.23 0.00 1.01 0.21 0.80 121.20 124.94 2vpw s ILE 8 Ca -0.09 -0.80 -0.24 0.00 0.00 0.00 0.00 60.65 59.52 2vpw s ILE 8 Cb -0.14 -1.52 -0.01 0.00 0.01 0.00 0.00 42.46 40.80 2vpw s ILE 8 CO 0.04 0.48 0.79 -0.62 0.00 0.00 0.00 174.94 175.64 2vpw s ASP 9 N 0.63 6.80 0.00 3.58 -1.08 0.76 0.50 116.67 127.87 2vpw s ASP 9 Ca -0.13 1.00 0.26 0.00 -0.52 0.00 0.00 52.55 53.15 2vpw s ASP 9 Cb -0.16 -2.42 0.72 0.00 -1.46 0.00 0.00 42.92 39.60 2vpw s ASP 9 CO 0.04 -0.47 1.54 0.18 0.52 0.00 0.00 175.17 176.98 2vpw n LEU 10 N 5.84 1.05 0.16 -1.34 4.77 -0.25 -2.13 117.00 125.10 2vpw n LEU 10 Ca 0.04 -0.28 0.12 0.00 -0.03 0.00 0.00 56.01 55.87 2vpw n LEU 10 Cb 0.48 -0.12 0.12 0.00 -2.33 0.00 0.00 43.42 41.57 2vpw n LEU 10 CO 0.47 0.20 0.51 0.77 -1.33 0.00 0.00 177.39 178.00 2vpw h SER 11 N 1.22 0.00 0.00 -1.43 4.64 -1.71 -3.28 113.55 112.99 2vpw h SER 11 Ca 0.00 -0.01 -0.19 0.00 -0.47 0.00 0.00 61.79 61.11 2vpw h SER 11 Cb 0.52 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.57 2vpw h SER 11 CO 0.00 0.01 -1.95 0.18 -0.87 0.00 0.00 176.83 174.19 2vpw n LEU 12 N -2.84 0.00 -4.73 5.97 4.77 -1.20 -4.99 117.00 113.99 2vpw n LEU 12 Ca 0.03 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.59 2vpw n LEU 12 Cb 0.53 0.26 -0.03 0.00 -2.33 0.00 0.00 43.42 41.85 2vpw n LEU 12 CO 0.36 0.26 1.31 0.00 -1.33 0.00 0.00 177.39 177.99 2vpw n VAL 14 N 3.49 0.68 -2.85 0.00 0.24 -1.26 -4.71 118.33 113.92 2vpw n VAL 14 Ca 0.13 -0.84 -0.18 0.00 -2.04 0.00 0.00 64.34 61.41 2vpw n VAL 14 Cb 0.36 0.69 0.03 0.00 -1.47 0.00 0.00 33.84 33.45 2vpw n VAL 14 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2vpw n GLY 15 N -0.02 -0.30 3.48 7.63 0.00 -1.26 -4.96 105.19 109.75 2vpw n GLY 15 Ca 0.04 -0.04 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 2vpw n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vpw n ALA 17 N 7.00 1.08 -0.13 0.00 0.00 -1.26 -4.37 120.51 122.83 2vpw n ALA 17 Ca -0.02 -0.03 -0.09 0.00 0.00 0.00 0.00 53.44 53.30 2vpw n ALA 17 Cb 0.46 -2.27 -0.01 0.00 0.00 0.00 0.00 19.45 17.63 2vpw n ALA 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2vpw h ALA 18 N 6.13 0.50 -0.65 0.00 0.00 -1.91 -0.56 119.26 122.78 2vpw h ALA 18 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2vpw h ALA 18 Cb 0.02 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2vpw h ALA 18 CO 0.54 0.06 0.41 0.00 0.00 0.00 0.00 179.25 180.26 2vpw h ALA 20 N 1.22 1.03 0.01 0.00 0.00 -1.63 -0.45 119.26 119.44 2vpw h ALA 20 Ca 0.24 -0.24 -0.27 0.00 0.00 0.00 0.00 54.91 54.64 2vpw h ALA 20 Cb -0.06 -0.26 0.02 0.00 0.00 0.00 0.00 17.79 17.49 2vpw h ALA 20 CO -0.05 0.64 -1.06 0.28 0.00 0.00 0.00 179.25 179.06 2vpw h VAL 21 N 1.01 1.29 -0.50 0.00 2.07 -0.77 -2.22 116.25 117.12 2vpw h VAL 21 Ca 0.21 -2.28 0.03 0.00 0.82 0.00 0.00 66.70 65.48 2vpw h VAL 21 Cb 0.35 2.41 -0.03 0.00 -1.52 0.00 0.00 31.29 32.49 2vpw h VAL 21 CO 0.00 0.70 0.29 0.00 0.02 0.00 0.00 177.57 178.58 2vpw h ALA 22 N 0.42 0.64 0.16 1.67 0.00 -0.34 -0.59 119.26 121.22 2vpw h ALA 22 Ca -0.13 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2vpw h ALA 22 Cb 1.71 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.37 2vpw h ALA 22 CO 0.21 -0.02 -0.08 0.00 0.00 0.00 0.00 179.25 179.36 2vpw h LYS 24 N -0.34 0.26 0.00 0.00 1.79 -1.00 0.26 116.57 117.53 2vpw h LYS 24 Ca -0.02 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.42 2vpw h LYS 24 Cb 0.27 -0.06 -0.00 0.00 -1.58 0.00 0.00 32.23 30.86 2vpw h LYS 24 CO 0.04 0.17 -0.06 0.52 -1.08 0.00 0.00 179.45 179.03 2vpw h MET 25 N 0.26 0.00 -0.84 3.15 2.86 -0.67 -2.52 114.93 117.18 2vpw h MET 25 Ca 0.72 0.00 0.08 0.00 -2.06 0.00 0.00 59.70 58.44 2vpw h MET 25 Cb 1.65 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 33.24 2vpw h MET 25 CO -0.64 0.49 0.50 1.49 1.06 0.00 0.00 176.91 179.81 2vpw h GLU 26 N -1.00 0.84 -0.13 1.72 4.57 0.43 -3.00 114.58 118.01 2vpw h GLU 26 Ca -0.01 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 2vpw h GLU 26 Cb 0.52 -0.19 0.00 0.00 -0.16 0.00 0.00 28.75 28.92 2vpw h GLU 26 CO -0.01 0.56 0.00 0.09 -1.18 0.00 0.00 179.01 178.47 2vpw n ASN 27 N -4.69 3.01 -2.17 1.04 5.03 0.86 -4.96 115.26 113.38 2vpw n ASN 27 Ca 0.13 -1.96 -0.18 0.00 0.87 0.00 0.00 54.58 53.44 2vpw n ASN 27 Cb 0.23 -0.07 -0.03 0.00 -1.02 0.00 0.00 39.78 38.89 2vpw n ASN 27 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 2vpw n GLU 28 N 1.30 -1.74 -1.62 3.52 1.02 -0.96 -4.87 120.64 117.28 2vpw n GLU 28 Ca 0.16 0.92 -0.52 0.00 -0.02 0.00 0.00 57.16 57.70 2vpw n GLU 28 Cb 0.58 -5.48 -0.06 0.00 -0.02 0.00 0.00 31.44 26.46 2vpw n GLU 28 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2vpw n VAL 29 N -3.36 0.38 -0.57 2.62 0.31 -1.13 -4.91 118.33 111.67 2vpw n VAL 29 Ca -0.20 -0.15 -0.30 0.00 -0.01 0.00 0.00 64.34 63.68 2vpw n VAL 29 Cb 0.64 -1.64 0.22 0.00 -0.91 0.00 0.00 33.84 32.15 2vpw n VAL 29 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2vpw n PRO 30 N 6.81 -1.71 -0.09 5.55 -0.04 -1.26 -4.93 135.00 139.33 2vpw n PRO 30 Ca 0.29 -0.46 -0.05 0.00 -0.04 0.00 0.00 63.50 63.24 2vpw n PRO 30 Cb 0.23 -2.17 -0.04 0.00 -0.04 0.00 0.00 33.50 31.48 2vpw n PRO 30 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 2vpw h PRO 31 N -2.36 -0.11 -0.11 0.54 0.11 -2.00 -3.14 132.00 124.93 2vpw h PRO 31 Ca -0.55 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.57 2vpw h PRO 31 Cb 1.31 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.45 2vpw h PRO 31 CO 0.45 -0.07 0.00 0.41 -0.21 0.00 0.00 178.00 178.58 2vpw n GLY 32 N -1.13 -0.49 3.30 -0.55 0.00 -1.26 -4.79 105.19 100.27 2vpw n GLY 32 Ca -0.01 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.85 2vpw n GLY 32 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2vpw s VAL 33 N -1.85 0.90 -0.16 1.61 -7.23 -1.19 -5.16 120.40 107.32 2vpw s VAL 33 Ca 0.00 -2.02 -0.09 0.00 -1.81 0.00 0.00 61.98 58.06 2vpw s VAL 33 Cb 0.00 -2.28 0.05 0.00 0.56 0.00 0.00 36.38 34.72 2vpw s VAL 33 CO 0.00 -0.36 0.38 -0.36 -0.31 0.00 0.00 175.10 174.45 2vpw s PHE 34 N -3.51 -0.54 -0.38 2.82 0.40 -1.26 -4.70 117.98 110.80 2vpw s PHE 34 Ca 0.27 1.18 0.22 0.00 -0.60 0.00 0.00 56.93 58.01 2vpw s PHE 34 Cb 0.06 0.22 0.26 0.00 0.51 0.00 0.00 43.02 44.06 2vpw s PHE 34 CO 0.07 -0.31 1.49 -0.91 0.70 0.00 0.00 175.22 176.26 2vpw h ASN 35 N 6.95 0.00 -3.64 1.36 -0.26 -1.94 -3.46 115.58 114.59 2vpw h ASN 35 Ca -0.36 0.00 -0.20 0.00 -0.56 0.00 0.00 56.30 55.18 2vpw h ASN 35 Cb 1.18 0.00 -0.28 0.00 -1.06 0.00 0.00 38.32 38.16 2vpw h ASN 35 CO 0.30 0.03 -0.54 -0.22 -1.06 0.00 0.00 177.43 175.95 2vpw s LEU 36 N -6.06 1.08 0.21 1.61 2.96 -1.26 -3.94 118.68 113.28 2vpw s LEU 36 Ca 0.05 0.35 -0.10 0.00 -0.22 0.00 0.00 54.13 54.21 2vpw s LEU 36 Cb 0.06 0.53 -0.01 0.00 0.50 0.00 0.00 46.19 47.27 2vpw s LEU 36 CO 0.70 -0.09 0.36 -1.66 -1.32 0.00 0.00 176.35 174.34 2vpw s TRP 37 N 0.52 0.49 -0.07 5.38 -2.14 -0.90 -4.78 118.94 117.43 2vpw s TRP 37 Ca -0.04 -0.82 0.05 0.00 2.66 0.00 0.00 56.10 57.95 2vpw s TRP 37 Cb -0.05 -0.00 -0.00 0.00 -3.10 0.00 0.00 33.47 30.31 2vpw s TRP 37 CO -0.03 -0.85 -0.23 0.42 -2.66 0.00 0.00 176.95 173.61 2vpw s ILE 38 N -4.02 1.94 -0.01 0.66 -1.09 -1.26 0.25 121.20 117.66 2vpw s ILE 38 Ca 0.23 -0.98 0.01 0.00 -2.23 0.00 0.00 60.65 57.68 2vpw s ILE 38 Cb 0.02 -1.66 -0.04 0.00 -1.58 0.00 0.00 42.46 39.20 2vpw s ILE 38 CO 0.06 0.54 0.01 -0.60 -1.23 0.00 0.00 174.94 173.72 2vpw s ARG 39 N 0.09 2.84 -0.05 2.79 3.52 0.18 -4.89 118.95 123.43 2vpw s ARG 39 Ca -0.10 -0.57 0.00 0.00 -0.13 0.00 0.00 55.73 54.93 2vpw s ARG 39 Cb -0.15 -2.71 0.02 0.00 -1.56 0.00 0.00 34.95 30.56 2vpw s ARG 39 CO 0.06 0.64 -0.03 -2.00 -0.81 0.00 0.00 175.30 173.16 2vpw s GLU 40 N -1.49 0.70 -0.01 5.12 2.12 -1.26 0.26 118.70 124.14 2vpw s GLU 40 Ca 0.19 -0.03 0.01 0.00 0.36 0.00 0.00 54.97 55.50 2vpw s GLU 40 Cb -0.12 -0.82 0.01 0.00 0.26 0.00 0.00 34.13 33.46 2vpw s GLU 40 CO 0.10 -0.14 -0.03 1.03 -0.54 0.00 0.00 175.26 175.67 2vpw s ARG 41 N 1.19 0.33 0.09 4.30 0.52 0.00 -4.99 118.95 120.40 2vpw s ARG 41 Ca -0.07 -0.09 0.02 0.00 -0.52 0.00 0.00 55.73 55.07 2vpw s ARG 41 Cb -0.14 -0.37 -0.04 0.00 0.52 0.00 0.00 34.95 34.93 2vpw s ARG 41 CO -0.02 0.02 0.19 -1.83 0.02 0.00 0.00 175.30 173.69 2vpw s GLU 42 N 0.21 3.28 -0.18 3.54 -1.05 -1.26 -0.88 118.70 122.37 2vpw s GLU 42 Ca -0.02 -0.56 -0.01 0.00 -0.15 0.00 0.00 54.97 54.23 2vpw s GLU 42 Cb -0.05 -2.93 0.05 0.00 -0.44 0.00 0.00 34.13 30.76 2vpw s GLU 42 CO -0.00 0.57 -0.03 0.08 0.95 0.00 0.00 175.26 176.83 2vpw s VAL 43 N -1.55 0.97 0.00 1.83 1.01 0.51 -5.00 120.40 118.17 2vpw s VAL 43 Ca 0.33 -0.64 0.00 0.00 0.00 0.00 0.00 61.98 61.67 2vpw s VAL 43 Cb -0.12 -1.24 0.00 0.00 0.00 0.00 0.00 36.38 35.02 2vpw s VAL 43 CO 0.26 0.02 0.00 0.61 0.00 0.00 0.00 175.10 176.00 2vpw n GLY 44 N 4.91 1.64 2.76 4.51 0.00 -1.26 -1.55 105.19 116.19 2vpw n GLY 44 Ca -0.11 -1.91 -0.19 0.00 0.00 0.00 0.00 46.02 43.81 2vpw n GLY 44 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2vpw n GLU 45 N 1.74 -0.46 -0.26 1.61 -0.58 -1.25 -4.70 120.64 116.74 2vpw n GLU 45 Ca 0.00 -1.68 0.25 0.00 -0.42 0.00 0.00 57.16 55.31 2vpw n GLU 45 Cb 0.00 -0.75 0.45 0.00 -0.57 0.00 0.00 31.44 30.57 2vpw n GLU 45 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2vpw n TYR 46 N -2.91 0.79 -0.07 -0.32 4.02 -1.26 -2.95 117.16 114.45 2vpw n TYR 46 Ca 0.12 0.79 0.04 0.00 -0.01 0.00 0.00 57.90 58.84 2vpw n TYR 46 Cb 0.42 -1.22 0.10 0.00 -0.02 0.00 0.00 39.34 38.62 2vpw n TYR 46 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 2vpw n PRO 47 N -4.56 2.52 -2.72 -0.72 -0.04 -1.26 -4.64 135.00 123.58 2vpw n PRO 47 Ca 0.28 -1.78 -0.07 0.00 -0.04 0.00 0.00 63.50 61.89 2vpw n PRO 47 Cb 1.00 -1.19 0.06 0.00 -0.04 0.00 0.00 33.50 33.32 2vpw n PRO 47 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2vpw n ASN 48 N 0.29 -2.39 -4.25 3.54 3.02 -1.15 -5.12 115.26 109.19 2vpw n ASN 48 Ca 0.08 -2.85 -0.38 0.00 -0.03 0.00 0.00 54.58 51.40 2vpw n ASN 48 Cb 0.36 1.50 -0.12 0.00 -0.61 0.00 0.00 39.78 40.91 2vpw n ASN 48 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2vpw s LEU 49 N -0.58 4.61 -0.01 3.41 2.96 -1.20 -3.93 118.68 123.94 2vpw s LEU 49 Ca 0.30 -1.34 0.04 0.00 -0.22 0.00 0.00 54.13 52.90 2vpw s LEU 49 Cb 0.23 -1.88 -0.03 0.00 0.50 0.00 0.00 46.19 45.00 2vpw s LEU 49 CO -0.19 -0.40 -0.11 -0.69 -1.32 0.00 0.00 176.35 173.64 2vpw s VAL 50 N 1.37 3.32 -0.09 1.68 1.01 -0.60 -4.97 120.40 122.12 2vpw s VAL 50 Ca 0.00 -0.82 0.03 0.00 0.00 0.00 0.00 61.98 61.19 2vpw s VAL 50 Cb -0.21 -2.39 0.01 0.00 0.00 0.00 0.00 36.38 33.78 2vpw s VAL 50 CO 0.02 0.45 -0.19 -0.69 0.00 0.00 0.00 175.10 174.68 2vpw s VAL 51 N -0.90 1.71 -0.18 2.92 1.01 -1.26 -0.37 120.40 123.33 2vpw s VAL 51 Ca 0.15 -0.81 -0.03 0.00 0.00 0.00 0.00 61.98 61.29 2vpw s VAL 51 Cb -0.11 -1.51 -0.02 0.00 0.00 0.00 0.00 36.38 34.75 2vpw s VAL 51 CO 0.05 0.48 -0.06 -0.70 0.00 0.00 0.00 175.10 174.88 2vpw s GLU 52 N 0.53 3.48 -0.19 2.72 2.12 -0.06 -4.89 118.70 122.41 2vpw s GLU 52 Ca -0.16 -0.60 -0.06 0.00 0.36 0.00 0.00 54.97 54.51 2vpw s GLU 52 Cb -0.17 -2.91 -0.03 0.00 0.26 0.00 0.00 34.13 31.27 2vpw s GLU 52 CO 0.06 0.02 0.04 -0.06 -0.54 0.00 0.00 175.26 174.78 2vpw s PHE 53 N 0.92 3.15 -0.18 5.30 0.40 -1.26 -0.82 117.98 125.49 2vpw s PHE 53 Ca -0.01 -0.14 -0.04 0.00 -0.60 0.00 0.00 56.93 56.13 2vpw s PHE 53 Cb -0.15 -2.09 0.08 0.00 0.51 0.00 0.00 43.02 41.37 2vpw s PHE 53 CO 0.01 -0.02 0.16 0.50 0.70 0.00 0.00 175.22 176.57 2vpw s ARG 54 N 0.67 0.12 0.26 0.44 3.52 0.14 -4.87 118.95 119.23 2vpw s ARG 54 Ca 0.02 0.14 -0.30 0.00 -0.13 0.00 0.00 55.73 55.46 2vpw s ARG 54 Cb -0.14 -1.33 -0.09 0.00 -1.56 0.00 0.00 34.95 31.83 2vpw s ARG 54 CO 0.02 -0.62 1.03 -2.14 -0.81 0.00 0.00 175.30 172.78 2vpw s PRO 55 N 2.25 4.73 -0.05 5.12 0.02 -1.26 -0.65 135.00 145.16 2vpw s PRO 55 Ca 0.05 1.67 0.03 0.00 0.02 0.00 0.00 61.00 62.76 2vpw s PRO 55 Cb -0.15 -3.23 0.01 0.00 0.02 0.00 0.00 34.50 31.14 2vpw s PRO 55 CO -0.10 0.33 -0.12 -1.21 -0.33 0.00 0.00 177.00 175.56 2vpw s GLU 56 N -1.26 1.54 0.08 5.54 2.02 0.14 -4.93 118.70 121.83 2vpw s GLU 56 Ca 0.43 -0.42 -0.27 0.00 0.02 0.00 0.00 54.97 54.73 2vpw s GLU 56 Cb -0.29 -1.32 0.08 0.00 0.10 0.00 0.00 34.13 32.70 2vpw s GLU 56 CO 0.37 0.09 0.95 1.14 0.02 0.00 0.00 175.26 177.83 2vpw s GLN 57 N 0.44 1.00 0.07 1.61 -2.07 -1.26 -2.12 119.66 117.32 2vpw s GLN 57 Ca -0.10 -0.49 -0.27 0.00 -1.82 0.00 0.00 55.36 52.68 2vpw s GLN 57 Cb -0.13 0.38 -0.15 0.00 -1.09 0.00 0.00 33.01 32.02 2vpw s GLN 57 CO 0.03 -0.45 0.65 0.00 -1.32 0.00 0.00 175.29 174.20 2vpw n LEU 59 N 1.37 2.87 -3.77 0.00 4.77 -1.26 -4.93 117.00 116.05 2vpw n LEU 59 Ca 0.15 -1.02 -0.32 0.00 -0.03 0.00 0.00 56.01 54.80 2vpw n LEU 59 Cb 0.13 -0.05 0.02 0.00 -2.33 0.00 0.00 43.42 41.19 2vpw n LEU 59 CO 0.47 0.51 -0.10 1.41 -1.33 0.00 0.00 177.39 178.34 2vpw n HIS 60 N 1.21 -1.89 -1.68 -1.77 8.25 -1.26 0.28 115.22 118.36 2vpw n HIS 60 Ca 0.16 0.49 -0.40 0.00 -0.26 0.00 0.00 57.72 57.70 2vpw n HIS 60 Cb 0.56 -3.14 0.02 0.00 1.12 0.00 0.00 29.99 28.55 2vpw n HIS 60 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2vpw h GLU 62 N 1.79 0.00 -2.26 0.00 4.81 0.26 -3.26 114.58 115.92 2vpw h GLU 62 Ca -0.48 0.00 -0.60 0.00 -0.13 0.00 0.00 59.36 58.15 2vpw h GLU 62 Cb 1.31 0.00 -0.42 0.00 0.63 0.00 0.00 28.75 30.27 2vpw h GLU 62 CO 0.58 0.58 -0.62 -1.71 -0.73 0.00 0.00 179.01 177.11 2vpw n ASN 63 N -3.34 3.46 -4.61 1.04 5.15 0.40 -5.01 115.26 112.34 2vpw n ASN 63 Ca 0.01 -3.37 -0.43 0.00 -0.60 0.00 0.00 54.58 50.19 2vpw n ASN 63 Cb 0.72 -0.68 -0.02 0.00 -0.53 0.00 0.00 39.78 39.27 2vpw n ASN 63 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 2vpw s PRO 64 N -2.30 3.62 0.00 1.20 0.04 -1.23 -4.24 135.00 132.08 2vpw s PRO 64 Ca 0.38 1.41 0.14 0.00 0.04 0.00 0.00 61.00 62.97 2vpw s PRO 64 Cb 0.13 -4.07 0.62 0.00 0.04 0.00 0.00 34.50 31.22 2vpw s PRO 64 CO -0.03 -1.51 1.42 -0.35 0.04 0.00 0.00 177.00 176.57 2vpw n PRO 65 N 7.96 0.05 0.00 0.56 -0.04 -1.26 -2.08 135.00 140.19 2vpw n PRO 65 Ca 0.19 0.24 0.14 0.00 -0.04 0.00 0.00 63.50 64.03 2vpw n PRO 65 Cb 0.46 -1.50 0.57 0.00 -0.04 0.00 0.00 33.50 32.99 2vpw n PRO 65 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2vpw n VAL 67 N -1.22 0.65 0.33 0.00 0.31 -0.89 -4.50 118.33 113.01 2vpw n VAL 67 Ca 0.11 0.36 0.08 0.00 -0.01 0.00 0.00 64.34 64.89 2vpw n VAL 67 Cb 0.30 -1.90 0.44 0.00 -0.91 0.00 0.00 33.84 31.77 2vpw n VAL 67 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 2vpw h PRO 68 N -0.45 0.00 -0.05 5.55 0.13 -1.73 -1.26 132.00 134.19 2vpw h PRO 68 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2vpw h PRO 68 Cb 0.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.41 2vpw h PRO 68 CO 0.00 0.00 0.00 1.55 -0.23 0.00 0.00 178.00 179.32 2vpw n VAL 69 N -2.70 0.04 -3.21 1.56 3.14 -1.26 -4.83 118.33 111.08 2vpw n VAL 69 Ca -0.01 -0.33 -0.39 0.00 -2.96 0.00 0.00 64.34 60.65 2vpw n VAL 69 Cb 0.66 0.70 -0.06 0.00 -1.06 0.00 0.00 33.84 34.08 2vpw n VAL 69 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2vpw h PRO 71 N 7.40 0.51 0.00 0.00 0.13 -1.89 -3.43 132.00 134.73 2vpw h PRO 71 Ca -0.34 -0.32 -0.21 0.00 -0.87 0.00 0.00 66.00 64.27 2vpw h PRO 71 Cb 1.15 0.04 0.04 0.00 0.13 0.00 0.00 31.00 32.36 2vpw h PRO 71 CO 0.75 0.93 0.07 2.41 -0.23 0.00 0.00 178.00 181.93 2vpw n THR 72 N -3.95 0.00 -1.41 1.56 -1.04 -1.26 -4.99 114.28 103.18 2vpw n THR 72 Ca -0.03 -0.66 -0.08 0.00 -2.04 0.00 0.00 64.05 61.24 2vpw n THR 72 Cb 0.60 -1.26 0.20 0.00 -1.82 0.00 0.00 70.33 68.05 2vpw n THR 72 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2vpw n GLY 73 N 1.49 4.82 0.34 3.41 0.00 -1.26 -4.76 105.19 109.21 2vpw n GLY 73 Ca 0.07 -1.20 0.02 0.00 0.00 0.00 0.00 46.02 44.91 2vpw n GLY 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vpw h ALA 74 N 1.03 1.26 -1.95 4.61 0.00 -1.82 -3.39 119.26 118.99 2vpw h ALA 74 Ca 0.29 -0.01 -0.57 0.00 0.00 0.00 0.00 54.91 54.62 2vpw h ALA 74 Cb 1.87 -0.24 -0.07 0.00 0.00 0.00 0.00 17.79 19.35 2vpw h ALA 74 CO 0.51 0.30 0.83 0.45 0.00 0.00 0.00 179.25 181.34 2vpw s SER 75 N -5.78 6.90 0.04 0.00 0.15 -1.26 0.39 113.70 114.14 2vpw s SER 75 Ca -0.12 0.99 -0.07 0.00 0.70 0.00 0.00 55.95 57.44 2vpw s SER 75 Cb 0.19 -2.54 -0.00 0.00 -1.71 0.00 0.00 66.02 61.96 2vpw s SER 75 CO 0.80 -0.89 0.15 -0.72 1.20 0.00 0.00 173.24 173.77 2vpw s TYR 76 N 3.68 0.13 -0.17 3.44 -0.85 -0.65 -4.82 117.35 118.11 2vpw s TYR 76 Ca 0.45 -0.41 -0.04 0.00 -0.52 0.00 0.00 57.07 56.55 2vpw s TYR 76 Cb -0.12 -0.09 -0.02 0.00 0.38 0.00 0.00 41.96 42.11 2vpw s TYR 76 CO 0.16 -0.40 -0.03 -1.14 -1.52 0.00 0.00 175.55 172.62 2vpw s GLN 77 N -2.67 3.61 0.75 -3.49 0.74 -1.26 -0.34 119.66 117.00 2vpw s GLN 77 Ca -0.04 -0.54 -0.11 0.00 0.05 0.00 0.00 55.36 54.72 2vpw s GLN 77 Cb -0.01 -2.96 0.04 0.00 1.10 0.00 0.00 33.01 31.19 2vpw s GLN 77 CO -0.05 0.13 1.09 0.99 -0.55 0.00 0.00 175.29 176.90 2vpw s THR 78 N 0.65 3.39 -0.28 -0.34 2.01 0.10 -4.95 115.64 116.23 2vpw s THR 78 Ca -0.02 0.45 0.27 0.00 0.31 0.00 0.00 61.69 62.70 2vpw s THR 78 Cb -0.14 -3.27 0.30 0.00 0.01 0.00 0.00 72.50 69.39 2vpw s THR 78 CO 0.02 -0.59 1.81 0.50 -0.69 0.00 0.00 174.62 175.67 2vpw h LYS 79 N -0.89 0.00 -0.13 4.92 1.63 -1.96 -2.62 116.57 117.52 2vpw h LYS 79 Ca -0.46 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.34 2vpw h LYS 79 Cb 1.25 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.88 2vpw h LYS 79 CO 0.60 0.00 0.00 -0.25 -3.45 0.00 0.00 179.45 176.35 2vpw n ASP 80 N -2.52 2.99 0.00 4.20 9.92 -1.26 -4.27 116.55 125.61 2vpw n ASP 80 Ca 0.02 -1.93 0.00 0.00 -0.53 0.00 0.00 54.79 52.34 2vpw n ASP 80 Cb 0.25 -0.07 0.00 0.00 -0.64 0.00 0.00 41.12 40.66 2vpw n ASP 80 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2vpw n GLY 81 N 1.28 1.14 3.85 0.44 0.00 -0.99 -0.25 105.19 110.67 2vpw n GLY 81 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 2vpw n GLY 81 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vpw s LEU 82 N 0.00 4.42 -0.25 0.99 1.43 -1.26 -4.72 118.68 119.28 2vpw s LEU 82 Ca 0.00 0.68 -0.08 0.00 -1.03 0.00 0.00 54.13 53.70 2vpw s LEU 82 Cb 0.00 -2.31 -0.03 0.00 0.03 0.00 0.00 46.19 43.88 2vpw s LEU 82 CO 0.00 0.36 0.09 -0.69 0.23 0.00 0.00 176.35 176.33 2vpw s VAL 83 N -0.96 4.46 0.32 -1.59 1.01 -1.26 0.03 120.40 122.41 2vpw s VAL 83 Ca 0.19 -0.12 0.04 0.00 0.00 0.00 0.00 61.98 62.09 2vpw s VAL 83 Cb -0.14 -3.09 -0.03 0.00 0.00 0.00 0.00 36.38 33.12 2vpw s VAL 83 CO 0.08 0.33 0.19 -0.76 0.00 0.00 0.00 175.10 174.94 2vpw s LEU 84 N 1.60 1.71 -0.07 3.92 1.43 0.53 -4.83 118.68 122.97 2vpw s LEU 84 Ca 0.06 -1.63 0.02 0.00 -1.03 0.00 0.00 54.13 51.55 2vpw s LEU 84 Cb -0.15 0.29 0.01 0.00 0.03 0.00 0.00 46.19 46.37 2vpw s LEU 84 CO 0.05 -0.95 -0.12 -0.69 0.23 0.00 0.00 176.35 174.86 2vpw s VAL 85 N -3.53 1.11 -0.64 -1.59 1.01 -1.26 -1.64 120.40 113.86 2vpw s VAL 85 Ca 0.36 -0.46 -0.20 0.00 0.00 0.00 0.00 61.98 61.67 2vpw s VAL 85 Cb 0.04 -1.02 0.09 0.00 0.00 0.00 0.00 36.38 35.49 2vpw s VAL 85 CO 0.20 0.35 0.84 -0.62 0.00 0.00 0.00 175.10 175.87 2vpw s ASP 86 N 0.72 6.20 0.29 3.32 -1.08 0.16 -4.87 116.67 121.41 2vpw s ASP 86 Ca -0.14 -1.28 0.15 0.00 -0.52 0.00 0.00 52.55 50.76 2vpw s ASP 86 Cb -0.16 -2.36 0.82 0.00 -1.46 0.00 0.00 42.92 39.77 2vpw s ASP 86 CO 0.03 -1.25 1.40 -2.65 0.52 0.00 0.00 175.17 173.22 2vpw n PRO 87 N 6.92 0.10 0.26 4.34 -0.02 -1.26 -0.72 135.00 144.61 2vpw n PRO 87 Ca -0.05 0.58 0.16 0.00 -2.02 0.00 0.00 63.50 62.16 2vpw n PRO 87 Cb 0.44 -1.99 0.57 0.00 -0.02 0.00 0.00 33.50 32.50 2vpw n PRO 87 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2vpw h LYS 88 N 0.00 0.00 0.00 -0.52 1.57 -1.96 -2.87 116.57 112.79 2vpw h LYS 88 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2vpw h LYS 88 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.64 2vpw h LYS 88 CO 0.00 0.00 -0.66 1.63 -0.57 0.00 0.00 179.45 179.85 2vpw n LYS 89 N -3.03 2.96 -2.11 3.15 5.02 0.10 -5.00 118.16 119.26 2vpw n LYS 89 Ca 0.01 -0.02 -0.42 0.00 -2.02 0.00 0.00 58.31 55.87 2vpw n LYS 89 Cb 0.35 -1.05 -0.03 0.00 -0.02 0.00 0.00 35.03 34.28 2vpw n LYS 89 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2vpw n ILE 91 N 4.14 0.50 -3.67 0.00 -5.35 -1.26 -4.87 119.36 108.84 2vpw n ILE 91 Ca 0.13 -0.75 -0.23 0.00 -0.27 0.00 0.00 62.75 61.63 2vpw n ILE 91 Cb 0.42 0.91 0.05 0.00 -1.74 0.00 0.00 39.64 39.27 2vpw n ILE 91 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2vpw n ALA 92 N 0.89 -1.78 0.16 -1.28 0.00 -1.26 -4.86 120.51 112.38 2vpw n ALA 92 Ca 0.13 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.68 2vpw n ALA 92 Cb 0.44 -3.01 0.09 0.00 0.00 0.00 0.00 19.45 16.96 2vpw n ALA 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2vpw n GLY 94 N 1.15 0.48 0.32 0.00 0.00 -1.26 -4.91 105.19 100.96 2vpw n GLY 94 Ca 0.02 -0.30 -0.08 0.00 0.00 0.00 0.00 46.02 45.66 2vpw n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vpw h ALA 95 N 0.00 0.90 -0.08 4.61 0.00 -1.92 -1.28 119.26 121.48 2vpw h ALA 95 Ca 0.00 -0.26 -0.10 0.00 0.00 0.00 0.00 54.91 54.55 2vpw h ALA 95 Cb 0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2vpw h ALA 95 CO 0.00 0.65 -0.40 0.00 0.00 0.00 0.00 179.25 179.50 2vpw h ILE 97 N 0.15 1.36 -0.95 0.00 2.04 -1.81 0.61 117.51 118.91 2vpw h ILE 97 Ca 0.01 -1.22 0.12 0.00 1.00 0.00 0.00 64.86 64.77 2vpw h ILE 97 Cb 0.79 1.97 -0.08 0.00 -0.74 0.00 0.00 36.82 38.76 2vpw h ILE 97 CO 0.06 0.34 0.58 0.00 0.00 0.00 0.00 178.15 179.13 2vpw h ALA 98 N 0.58 1.43 0.00 1.87 0.00 -0.92 -2.89 119.26 119.33 2vpw h ALA 98 Ca 0.01 0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.81 2vpw h ALA 98 Cb 0.59 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2vpw h ALA 98 CO 0.02 0.16 -0.74 0.00 0.00 0.00 0.00 179.25 178.69 2vpw h ALA 99 N 1.53 0.56 -2.26 0.00 0.00 -1.09 -3.45 119.26 114.55 2vpw h ALA 99 Ca 0.48 -0.65 -0.56 0.00 0.00 0.00 0.00 54.91 54.18 2vpw h ALA 99 Cb 0.50 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2vpw h ALA 99 CO -0.28 0.87 0.87 0.00 0.00 0.00 0.00 179.25 180.71 2vpw n PRO 101 N 6.07 1.03 -0.08 0.00 -0.02 -1.26 -3.98 135.00 136.76 2vpw n PRO 101 Ca 0.14 -0.04 0.04 0.00 -2.02 0.00 0.00 63.50 61.62 2vpw n PRO 101 Cb 0.45 -1.25 0.08 0.00 -0.02 0.00 0.00 33.50 32.76 2vpw n PRO 101 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2vpw n TYR 102 N -0.71 0.13 -4.19 6.00 4.02 -1.26 -4.97 117.16 116.19 2vpw n TYR 102 Ca 0.12 -0.69 -0.36 0.00 -0.01 0.00 0.00 57.90 56.97 2vpw n TYR 102 Cb 0.06 -0.10 -0.02 0.00 -0.02 0.00 0.00 39.34 39.26 2vpw n TYR 102 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 2vpw n ASP 103 N -0.67 -3.53 0.06 7.72 8.00 -1.26 -4.87 116.55 122.02 2vpw n ASP 103 Ca 0.08 -0.98 0.12 0.00 0.71 0.00 0.00 54.79 54.72 2vpw n ASP 103 Cb 0.45 -2.90 0.19 0.00 -0.02 0.00 0.00 41.12 38.84 2vpw n ASP 103 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2vpw n ALA 104 N -4.42 2.88 -2.45 2.24 0.00 -1.26 -4.93 120.51 112.56 2vpw n ALA 104 Ca 0.07 -0.23 -0.26 0.00 0.00 0.00 0.00 53.44 53.02 2vpw n ALA 104 Cb 0.49 -1.19 -0.11 0.00 0.00 0.00 0.00 19.45 18.64 2vpw n ALA 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2vpw s ARG 105 N -3.16 1.63 0.21 0.00 0.52 -1.26 -4.37 118.95 112.52 2vpw s ARG 105 Ca 0.07 -1.58 -0.06 0.00 -0.52 0.00 0.00 55.73 53.64 2vpw s ARG 105 Cb 0.13 -1.85 -0.03 0.00 0.52 0.00 0.00 34.95 33.72 2vpw s ARG 105 CO 0.71 0.38 0.26 1.52 0.02 0.00 0.00 175.30 178.20 2vpw s TYR 106 N -1.94 0.81 -0.30 -0.53 -0.85 -0.58 -4.94 117.35 109.02 2vpw s TYR 106 Ca 0.24 -1.09 -0.20 0.00 -0.52 0.00 0.00 57.07 55.50 2vpw s TYR 106 Cb -0.07 -0.25 -0.01 0.00 0.38 0.00 0.00 41.96 42.01 2vpw s TYR 106 CO 0.12 -0.77 0.62 -1.17 -1.52 0.00 0.00 175.55 172.83 2vpw s LEU 107 N -3.09 4.15 0.43 -3.49 2.96 -1.26 0.05 118.68 118.42 2vpw s LEU 107 Ca 0.31 0.42 -0.22 0.00 -0.22 0.00 0.00 54.13 54.42 2vpw s LEU 107 Cb 0.04 -2.80 -0.10 0.00 0.50 0.00 0.00 46.19 43.83 2vpw s LEU 107 CO 0.10 -0.47 0.99 -2.28 -1.32 0.00 0.00 176.35 173.37 2vpw s HIS 108 N 2.59 3.27 -1.21 5.38 5.65 0.18 -4.92 115.29 126.23 2vpw s HIS 108 Ca 0.25 1.63 0.11 0.00 0.25 0.00 0.00 55.06 57.30 2vpw s HIS 108 Cb -0.15 -2.96 0.52 0.00 -1.18 0.00 0.00 32.58 28.81 2vpw s HIS 108 CO 0.12 -0.34 1.31 -2.30 -0.65 0.00 0.00 174.74 172.87 2vpw n PRO 109 N -0.48 0.08 0.00 2.88 -0.02 -1.26 -2.46 135.00 133.74 2vpw n PRO 109 Ca 0.07 0.24 0.15 0.00 -2.02 0.00 0.00 63.50 61.94 2vpw n PRO 109 Cb 0.52 -1.50 0.91 0.00 -0.02 0.00 0.00 33.50 33.42 2vpw n PRO 109 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2vpw n ALA 110 N -1.39 2.68 0.00 3.55 0.00 -1.26 -4.88 120.51 119.20 2vpw n ALA 110 Ca 0.04 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.29 2vpw n ALA 110 Cb 0.11 -1.50 0.00 0.00 0.00 0.00 0.00 19.45 18.06 2vpw n ALA 110 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2vpw n GLY 111 N 0.97 0.89 3.25 0.00 0.00 -1.03 -5.08 105.19 104.19 2vpw n GLY 111 Ca 0.23 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.11 2vpw n GLY 111 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2vpw s TYR 112 N -2.00 1.28 0.14 1.61 -0.85 -1.24 -4.35 117.35 111.94 2vpw s TYR 112 Ca 0.00 -1.22 -0.11 0.00 -0.52 0.00 0.00 57.07 55.22 2vpw s TYR 112 Cb 0.00 -0.71 -0.06 0.00 0.38 0.00 0.00 41.96 41.57 2vpw s TYR 112 CO 0.00 -0.43 0.49 0.08 -1.52 0.00 0.00 175.55 174.17 2vpw s VAL 113 N -3.90 4.97 0.33 -3.49 1.01 -1.26 -0.65 120.40 117.42 2vpw s VAL 113 Ca 0.34 0.58 0.04 0.00 0.00 0.00 0.00 61.98 62.94 2vpw s VAL 113 Cb 0.07 -3.67 -0.03 0.00 0.00 0.00 0.00 36.38 32.74 2vpw s VAL 113 CO 0.10 0.19 0.17 -0.55 0.00 0.00 0.00 175.10 175.01 2vpw s SER 114 N -1.90 1.80 0.00 3.32 0.15 0.11 -4.84 113.70 112.34 2vpw s SER 114 Ca 0.38 -1.61 0.00 0.00 0.70 0.00 0.00 55.95 55.42 2vpw s SER 114 Cb -0.14 0.44 0.00 0.00 -1.71 0.00 0.00 66.02 64.61 2vpw s SER 114 CO 0.19 -0.93 0.00 2.29 1.20 0.00 0.00 173.24 176.00 2vpw n LYS 115 N -0.65 0.00 -1.54 5.44 2.85 -1.26 -1.52 118.16 121.47 2vpw n LYS 115 Ca 0.01 0.00 -0.52 0.00 -1.05 0.00 0.00 58.31 56.75 2vpw n LYS 115 Cb 0.64 0.00 -0.05 0.00 -0.65 0.00 0.00 35.03 34.97 2vpw n LYS 115 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2vpw n THR 117 N 1.54 0.51 -1.70 0.00 -1.04 -1.26 -4.82 114.28 107.52 2vpw n THR 117 Ca 0.17 -0.76 -0.11 0.00 -2.04 0.00 0.00 64.05 61.32 2vpw n THR 117 Cb 0.19 0.89 -0.03 0.00 -1.82 0.00 0.00 70.33 69.56 2vpw n THR 117 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 2vpw n PHE 118 N 0.82 -0.82 -3.73 -1.42 3.72 -1.26 -2.08 117.46 112.69 2vpw n PHE 118 Ca 0.12 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.28 2vpw n PHE 118 Cb 0.42 -2.38 0.02 0.00 -0.94 0.00 0.00 39.48 36.60 2vpw n PHE 118 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2vpw h ALA 120 N 0.80 1.91 -0.83 0.00 0.00 -1.85 0.16 119.26 119.45 2vpw h ALA 120 Ca -0.63 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.28 2vpw h ALA 120 Cb 1.36 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.99 2vpw h ALA 120 CO 0.56 -0.10 0.51 1.12 0.00 0.00 0.00 179.25 181.33 2vpw h HIS 121 N 0.60 1.09 -0.00 0.00 2.07 -1.87 -1.77 115.15 115.26 2vpw h HIS 121 Ca 0.38 -0.00 -0.18 0.00 -2.85 0.00 0.00 60.37 57.72 2vpw h HIS 121 Cb 0.64 -0.36 -0.02 0.00 2.57 0.00 0.00 27.41 30.25 2vpw h HIS 121 CO -0.00 0.73 -0.83 0.00 -3.07 0.00 0.00 177.93 174.76 2vpw h ARG 122 N 1.14 0.10 -0.52 5.12 3.08 -1.18 -3.25 114.38 118.87 2vpw h ARG 122 Ca 0.30 -0.11 -0.09 0.00 0.07 0.00 0.00 59.98 60.15 2vpw h ARG 122 Cb -0.05 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.01 2vpw h ARG 122 CO -0.06 0.87 -0.04 -0.07 -1.07 0.00 0.00 179.97 179.60 2vpw h LEU 123 N 0.06 0.90 -0.74 3.04 3.38 -0.15 0.37 115.31 122.16 2vpw h LEU 123 Ca -0.02 -0.25 -0.10 0.00 0.09 0.00 0.00 57.88 57.59 2vpw h LEU 123 Cb 1.44 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.93 2vpw h LEU 123 CO 0.12 0.98 -0.16 -0.08 0.09 0.00 0.00 178.44 179.39 2vpw h GLU 124 N 0.84 0.80 -0.90 1.13 4.81 -1.45 -2.22 114.58 117.59 2vpw h GLU 124 Ca 0.15 -0.29 -0.27 0.00 -0.13 0.00 0.00 59.36 58.82 2vpw h GLU 124 Cb 0.55 -0.05 -0.16 0.00 0.63 0.00 0.00 28.75 29.71 2vpw h GLU 124 CO 0.03 0.90 0.35 0.36 -0.73 0.00 0.00 179.01 179.92 2vpw n LYS 125 N -4.14 2.64 -1.23 1.92 0.00 -0.95 -4.90 118.16 111.50 2vpw n LYS 125 Ca 0.01 -2.37 -0.07 0.00 -0.00 0.00 0.00 58.31 55.87 2vpw n LYS 125 Cb 0.40 -1.98 -0.03 0.00 -0.00 0.00 0.00 35.03 33.42 2vpw n LYS 125 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2vpw n GLY 126 N -0.37 0.94 3.90 2.58 0.00 -0.83 -5.04 105.19 106.37 2vpw n GLY 126 Ca 0.38 -0.71 -0.20 0.00 0.00 0.00 0.00 46.02 45.50 2vpw n GLY 126 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vpw s LYS 127 N -2.66 2.76 0.18 1.61 1.02 0.13 -4.99 119.74 117.79 2vpw s LYS 127 Ca 0.00 -1.30 -0.01 0.00 0.02 0.00 0.00 55.97 54.68 2vpw s LYS 127 Cb 0.00 -2.54 -0.04 0.00 -0.52 0.00 0.00 37.83 34.73 2vpw s LYS 127 CO 0.00 -0.01 0.37 0.14 -0.92 0.00 0.00 175.35 174.93 2vpw s VAL 128 N -2.33 5.22 0.66 3.17 -7.23 -1.26 -3.80 120.40 114.83 2vpw s VAL 128 Ca 0.45 -0.34 -0.17 0.00 -1.81 0.00 0.00 61.98 60.11 2vpw s VAL 128 Cb -0.06 -3.71 -0.01 0.00 0.56 0.00 0.00 36.38 33.15 2vpw s VAL 128 CO 0.28 -0.12 1.13 -2.65 -0.31 0.00 0.00 175.10 173.44 2vpw n PRO 129 N -0.48 0.89 -0.19 4.82 -0.02 -1.26 -4.74 135.00 134.02 2vpw n PRO 129 Ca -0.05 0.36 -0.00 0.00 -2.02 0.00 0.00 63.50 61.79 2vpw n PRO 129 Cb 0.53 -2.36 0.09 0.00 -0.02 0.00 0.00 33.50 31.74 2vpw n PRO 129 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2vpw h ALA 130 N 0.30 0.59 -0.91 3.55 0.00 -1.94 -0.12 119.26 120.73 2vpw h ALA 130 Ca -0.49 0.16 0.10 0.00 0.00 0.00 0.00 54.91 54.67 2vpw h ALA 130 Cb 1.35 0.25 -0.08 0.00 0.00 0.00 0.00 17.79 19.31 2vpw h ALA 130 CO 0.51 -0.37 0.55 0.00 0.00 0.00 0.00 179.25 179.95 2vpw h VAL 132 N 0.92 1.28 0.48 0.00 2.07 -1.42 -3.30 116.25 116.29 2vpw h VAL 132 Ca 0.44 -1.39 -0.02 0.00 0.82 0.00 0.00 66.70 66.54 2vpw h VAL 132 Cb 0.37 1.36 0.00 0.00 -1.52 0.00 0.00 31.29 31.51 2vpw h VAL 132 CO -0.24 0.46 -0.23 -0.08 0.02 0.00 0.00 177.57 177.50 2vpw h GLU 133 N 0.62 -0.63 -6.07 1.57 4.81 -1.07 -3.39 114.58 110.42 2vpw h GLU 133 Ca 0.08 0.04 -0.57 0.00 -0.13 0.00 0.00 59.36 58.78 2vpw h GLU 133 Cb 0.81 0.14 -0.10 0.00 0.63 0.00 0.00 28.75 30.23 2vpw h GLU 133 CO 0.07 -0.33 0.89 -0.08 -0.73 0.00 0.00 179.01 178.83 2vpw s THR 134 N -4.46 3.92 -0.29 0.32 -1.32 -0.89 -4.86 115.64 108.06 2vpw s THR 134 Ca -0.13 0.17 -0.05 0.00 -1.21 0.00 0.00 61.69 60.47 2vpw s THR 134 Cb 0.02 -4.84 0.19 0.00 -1.51 0.00 0.00 72.50 66.36 2vpw s THR 134 CO 0.45 -1.72 0.88 0.00 -2.21 0.00 0.00 174.62 172.03 2vpw h PRO 136 N 7.53 0.49 0.00 0.00 0.11 -1.95 -2.45 132.00 135.72 2vpw h PRO 136 Ca -0.06 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.02 2vpw h PRO 136 Cb 1.18 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2vpw h PRO 136 CO -0.01 0.32 -0.05 0.25 -0.21 0.00 0.00 178.00 178.31 2vpw n THR 137 N -4.95 0.05 -3.71 -1.15 -2.24 -1.26 -4.93 114.28 96.10 2vpw n THR 137 Ca 0.13 -0.03 -0.26 0.00 -2.27 0.00 0.00 64.05 61.62 2vpw n THR 137 Cb 0.35 -0.44 0.06 0.00 -2.10 0.00 0.00 70.33 68.20 2vpw n THR 137 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2vpw n TYR 138 N -1.57 -2.63 0.35 4.78 4.02 -0.92 -4.92 117.16 116.27 2vpw n TYR 138 Ca 0.07 0.97 0.11 0.00 -0.01 0.00 0.00 57.90 59.04 2vpw n TYR 138 Cb 0.35 -4.65 0.02 0.00 -0.02 0.00 0.00 39.34 35.04 2vpw n TYR 138 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2vpw s ARG 140 N -3.29 3.71 0.05 0.00 1.70 -1.26 -0.17 118.95 119.70 2vpw s ARG 140 Ca 0.01 0.13 0.02 0.00 -0.47 0.00 0.00 55.73 55.42 2vpw s ARG 140 Cb 0.13 -3.11 -0.03 0.00 -0.57 0.00 0.00 34.95 31.37 2vpw s ARG 140 CO 0.80 0.65 -0.07 0.95 -1.08 0.00 0.00 175.30 176.55 2vpw s THR 141 N -1.23 0.50 0.08 4.99 -4.23 0.24 -4.94 115.64 111.06 2vpw s THR 141 Ca 0.26 -1.20 -0.02 0.00 -1.18 0.00 0.00 61.69 59.55 2vpw s THR 141 Cb -0.14 -0.75 -0.03 0.00 1.34 0.00 0.00 72.50 72.92 2vpw s THR 141 CO 0.14 -0.48 0.04 0.12 -0.54 0.00 0.00 174.62 173.90 2vpw s PHE 142 N -1.78 0.58 -5.00 3.99 5.36 -1.26 0.78 117.98 120.64 2vpw s PHE 142 Ca -0.07 -1.05 0.00 0.00 -0.96 0.00 0.00 56.93 54.85 2vpw s PHE 142 Cb -0.07 -0.36 0.00 0.00 -0.34 0.00 0.00 43.02 42.24 2vpw s PHE 142 CO -0.01 -0.46 0.00 0.41 -1.46 0.00 0.00 175.22 173.70 2vpw n GLY 143 N 0.01 -0.90 3.66 13.12 0.00 -0.93 -2.98 105.19 117.17 2vpw n GLY 143 Ca -0.11 -1.33 -0.39 0.00 0.00 0.00 0.00 46.02 44.19 2vpw n GLY 143 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2vpw s ASP 144 N -4.00 6.49 0.47 1.61 2.15 -1.26 -1.22 116.67 120.91 2vpw s ASP 144 Ca 0.00 0.58 0.24 0.00 0.43 0.00 0.00 52.55 53.80 2vpw s ASP 144 Cb 0.00 -2.26 1.18 0.00 -0.30 0.00 0.00 42.92 41.54 2vpw s ASP 144 CO 0.00 -0.14 1.96 0.25 -0.17 0.00 0.00 175.17 177.07 2vpw h LEU 145 N 7.89 0.00 0.00 -1.34 5.85 -1.03 -2.50 115.31 124.19 2vpw h LEU 145 Ca -0.34 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.38 2vpw h LEU 145 Cb 1.16 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.19 2vpw h LEU 145 CO 0.72 0.19 -0.19 -0.62 -0.34 0.00 0.00 178.44 178.21 2vpw n GLU 146 N -3.68 0.09 -3.52 1.25 1.02 -1.26 -4.66 120.64 109.89 2vpw n GLU 146 Ca -0.01 0.05 -0.40 0.00 -0.02 0.00 0.00 57.16 56.78 2vpw n GLU 146 Cb 0.32 -1.58 -0.10 0.00 -0.02 0.00 0.00 31.44 30.05 2vpw n GLU 146 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2vpw s ASP 147 N -3.45 6.07 0.27 1.62 2.15 -0.94 -4.91 116.67 117.48 2vpw s ASP 147 Ca 0.12 -0.35 0.18 0.00 0.43 0.00 0.00 52.55 52.92 2vpw s ASP 147 Cb 0.17 -2.14 0.96 0.00 -0.30 0.00 0.00 42.92 41.60 2vpw s ASP 147 CO 0.60 -0.23 1.53 -2.65 -0.17 0.00 0.00 175.17 174.26 2vpw n PRO 148 N 5.14 0.11 0.03 4.34 -0.02 -1.26 -1.57 135.00 141.77 2vpw n PRO 148 Ca -0.12 0.61 0.09 0.00 -2.02 0.00 0.00 63.50 62.06 2vpw n PRO 148 Cb 0.50 -1.89 -0.10 0.00 -0.02 0.00 0.00 33.50 31.99 2vpw n PRO 148 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2vpw n GLU 149 N -2.12 0.64 -1.39 -0.52 -0.58 -1.26 -4.41 120.64 111.01 2vpw n GLU 149 Ca -0.01 -0.04 -0.34 0.00 -0.42 0.00 0.00 57.16 56.34 2vpw n GLU 149 Cb 0.04 -1.65 0.10 0.00 -0.57 0.00 0.00 31.44 29.36 2vpw n GLU 149 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2vpw s SER 150 N -4.97 4.07 0.34 1.62 1.04 -0.61 -4.77 113.70 110.42 2vpw s SER 150 Ca -0.05 2.41 0.03 0.00 0.48 0.00 0.00 55.95 58.82 2vpw s SER 150 Cb 0.12 -2.59 0.65 0.00 0.10 0.00 0.00 66.02 64.29 2vpw s SER 150 CO 0.85 -2.35 1.96 -0.65 0.98 0.00 0.00 173.24 174.04 2vpw h PRO 151 N -0.34 0.84 -0.47 4.02 0.11 -1.90 -2.15 132.00 132.11 2vpw h PRO 151 Ca -0.48 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 65.50 2vpw h PRO 151 Cb 1.30 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 2vpw h PRO 151 CO 0.49 0.55 -0.02 0.28 -0.21 0.00 0.00 178.00 179.09 2vpw h VAL 152 N 0.86 1.26 -0.66 3.15 2.07 -1.80 -0.91 116.25 120.23 2vpw h VAL 152 Ca 0.31 -1.09 0.03 0.00 0.82 0.00 0.00 66.70 66.77 2vpw h VAL 152 Cb 0.13 1.04 -0.04 0.00 -1.52 0.00 0.00 31.29 30.89 2vpw h VAL 152 CO -0.09 0.38 0.40 0.00 0.02 0.00 0.00 177.57 178.28 2vpw h ALA 153 N 0.91 0.86 0.01 1.67 0.00 -1.72 0.21 119.26 121.21 2vpw h ALA 153 Ca 0.13 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2vpw h ALA 153 Cb 0.53 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2vpw h ALA 153 CO 0.03 0.14 -0.00 0.87 0.00 0.00 0.00 179.25 180.29 2vpw h LYS 154 N 0.78 -0.01 -0.40 0.00 1.79 -1.26 -0.49 116.57 116.97 2vpw h LYS 154 Ca 0.27 0.00 0.08 0.00 -2.18 0.00 0.00 60.65 58.82 2vpw h LYS 154 Cb 0.05 0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 30.64 2vpw h LYS 154 CO -0.12 0.25 -0.04 0.00 -1.08 0.00 0.00 179.45 178.46 2vpw h ALA 155 N 0.71 0.32 -0.38 3.86 0.00 -0.80 0.20 119.26 123.17 2vpw h ALA 155 Ca -0.00 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2vpw h ALA 155 Cb 0.27 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2vpw h ALA 155 CO 0.00 -0.42 0.16 -0.07 0.00 0.00 0.00 179.25 178.92 2vpw h LEU 156 N 0.06 0.51 -1.40 0.00 3.38 -0.93 -1.64 115.31 115.29 2vpw h LEU 156 Ca 0.19 -0.15 0.06 0.00 0.09 0.00 0.00 57.88 58.07 2vpw h LEU 156 Cb 0.29 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 2vpw h LEU 156 CO -0.36 0.52 0.46 0.11 0.09 0.00 0.00 178.44 179.25 2vpw h LYS 157 N 0.46 0.73 -0.01 1.13 1.57 -0.18 -2.72 116.57 117.55 2vpw h LYS 157 Ca 0.13 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2vpw h LYS 157 Cb 0.16 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.30 2vpw h LYS 157 CO -0.01 0.48 -0.15 0.00 -0.57 0.00 0.00 179.45 179.20 2vpw n ALA 158 N -2.45 2.87 -1.77 3.86 0.00 0.62 -4.94 120.51 118.70 2vpw n ALA 158 Ca 0.10 -0.45 -0.38 0.00 0.00 0.00 0.00 53.44 52.71 2vpw n ALA 158 Cb 0.20 -1.11 -0.01 0.00 0.00 0.00 0.00 19.45 18.53 2vpw n ALA 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2vpw s ALA 159 N -2.27 3.13 0.07 0.00 0.00 -0.67 -4.96 121.76 117.06 2vpw s ALA 159 Ca 0.30 1.02 -0.12 0.00 0.00 0.00 0.00 51.96 53.16 2vpw s ALA 159 Cb 0.20 -3.40 -0.25 0.00 0.00 0.00 0.00 23.12 19.67 2vpw s ALA 159 CO 0.44 -0.62 1.16 1.49 0.00 0.00 0.00 175.76 178.22 2vpw h GLU 160 N 2.52 0.57 -3.70 0.00 4.57 -1.91 -3.47 114.58 113.16 2vpw h GLU 160 Ca -0.49 -0.72 -0.11 0.00 -1.18 0.00 0.00 59.36 56.86 2vpw h GLU 160 Cb 1.24 0.23 -0.16 0.00 -0.16 0.00 0.00 28.75 29.90 2vpw h GLU 160 CO 0.62 1.31 -0.42 -0.98 -1.18 0.00 0.00 179.01 178.36 2vpw s ARG 161 N -3.05 0.71 -0.05 1.92 1.70 -1.26 -4.95 118.95 113.98 2vpw s ARG 161 Ca -0.08 -0.77 0.02 0.00 -0.47 0.00 0.00 55.73 54.43 2vpw s ARG 161 Cb 0.06 0.29 0.01 0.00 -0.57 0.00 0.00 34.95 34.75 2vpw s ARG 161 CO 0.92 -0.21 -0.10 0.08 -1.08 0.00 0.00 175.30 174.91 2vpw s VAL 162 N -3.01 0.97 0.13 4.99 1.01 -1.26 -1.59 120.40 121.64 2vpw s VAL 162 Ca -0.02 -0.40 0.01 0.00 0.00 0.00 0.00 61.98 61.58 2vpw s VAL 162 Cb 0.01 -0.89 -0.04 0.00 0.00 0.00 0.00 36.38 35.45 2vpw s VAL 162 CO -0.06 0.31 -0.02 -1.81 0.00 0.00 0.00 175.10 173.52 2vpw s ASP 163 N 0.61 1.04 0.00 3.32 1.01 0.43 -4.96 116.67 118.12 2vpw s ASP 163 Ca -0.12 -1.10 -0.11 0.00 0.71 0.00 0.00 52.55 51.93 2vpw s ASP 163 Cb -0.14 0.13 0.01 0.00 1.01 0.00 0.00 42.92 43.93 2vpw s ASP 163 CO 0.02 -0.55 0.22 0.54 0.21 0.00 0.00 175.17 175.62 2vpw s VAL 164 N -3.71 0.07 0.42 -1.27 0.11 -1.26 -0.45 120.40 114.32 2vpw s VAL 164 Ca 0.18 -0.62 -0.22 0.00 -2.93 0.00 0.00 61.98 58.40 2vpw s VAL 164 Cb 0.06 -0.57 -0.10 0.00 -1.53 0.00 0.00 36.38 34.24 2vpw s VAL 164 CO -0.00 -0.34 0.97 -0.76 -3.33 0.00 0.00 175.10 171.63 2vpw s LEU 165 N -1.45 3.99 -0.43 2.54 1.43 -1.26 -4.13 118.68 119.36 2vpw s LEU 165 Ca -0.13 1.76 -0.05 0.00 -1.03 0.00 0.00 54.13 54.69 2vpw s LEU 165 Cb -0.06 -4.46 0.01 0.00 0.03 0.00 0.00 46.19 41.71 2vpw s LEU 165 CO 0.02 -0.39 0.29 0.54 0.23 0.00 0.00 176.35 177.03 2vpw n ARG 166 N -0.50 -0.70 0.28 1.70 1.74 -1.26 -4.77 116.66 113.14 2vpw n ARG 166 Ca 0.07 0.16 0.15 0.00 -0.77 0.00 0.00 57.85 57.46 2vpw n ARG 166 Cb 0.53 -0.89 0.78 0.00 -1.02 0.00 0.00 32.46 31.86 2vpw n ARG 166 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 2vpw h PRO 167 N 0.42 0.00 0.00 5.56 0.13 -2.03 -2.72 132.00 133.36 2vpw h PRO 167 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 2vpw h PRO 167 Cb 0.65 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.78 2vpw h PRO 167 CO 0.19 0.08 0.00 -0.85 -0.23 0.00 0.00 178.00 177.19 2vpw n GLU 168 N -3.40 0.34 -1.91 0.86 0.00 -1.26 -4.36 120.64 110.91 2vpw n GLU 168 Ca -0.01 0.06 -0.26 0.00 0.00 0.00 0.00 57.16 56.94 2vpw n GLU 168 Cb 0.24 -1.50 0.18 0.00 0.00 0.00 0.00 31.44 30.36 2vpw n GLU 168 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 2vpw n GLN 169 N -1.28 -1.01 -2.42 3.44 1.13 -1.03 -4.95 117.38 111.26 2vpw n GLN 169 Ca 0.11 -2.05 -0.23 0.00 -1.94 0.00 0.00 57.00 52.89 2vpw n GLN 169 Cb 0.19 -1.16 0.01 0.00 0.11 0.00 0.00 30.24 29.38 2vpw n GLN 169 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2vpw n GLY 170 N -2.99 5.43 0.05 1.08 0.00 -1.26 -4.76 105.19 102.74 2vpw n GLY 170 Ca 0.16 -2.52 0.13 0.00 0.00 0.00 0.00 46.02 43.79 2vpw n GLY 170 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2vpw n THR 171 N -0.48 0.27 -3.40 2.61 -2.24 -1.26 -4.69 114.28 105.09 2vpw n THR 171 Ca 0.35 -0.14 -0.12 0.00 -2.27 0.00 0.00 64.05 61.88 2vpw n THR 171 Cb 0.74 -0.48 0.00 0.00 -2.10 0.00 0.00 70.33 68.50 2vpw n THR 171 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2vpw n ARG 172 N -1.86 -1.42 -1.55 -0.78 1.74 -1.26 -0.45 116.66 111.09 2vpw n ARG 172 Ca 0.06 1.14 -0.36 0.00 -0.77 0.00 0.00 57.85 57.92 2vpw n ARG 172 Cb 0.38 -4.20 0.08 0.00 -1.02 0.00 0.00 32.46 27.71 2vpw n ARG 172 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 2vpw n PRO 173 N -2.24 0.84 -1.40 5.56 -0.02 -1.26 0.17 135.00 136.65 2vpw n PRO 173 Ca -0.14 0.35 -0.14 0.00 -2.02 0.00 0.00 63.50 61.55 2vpw n PRO 173 Cb 0.59 -2.48 0.10 0.00 -0.02 0.00 0.00 33.50 31.69 2vpw n PRO 173 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2vpw n LYS 174 N -2.22 2.72 -3.76 -0.52 5.02 0.14 -4.72 118.16 114.82 2vpw n LYS 174 Ca 0.15 -3.72 -0.27 0.00 -2.02 0.00 0.00 58.31 52.45 2vpw n LYS 174 Cb 0.49 -2.03 -0.17 0.00 -0.02 0.00 0.00 35.03 33.30 2vpw n LYS 174 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2vpw s LEU 175 N -3.47 1.12 -0.14 -0.35 2.96 -1.19 -1.47 118.68 116.15 2vpw s LEU 175 Ca 0.47 -0.65 -0.04 0.00 -0.22 0.00 0.00 54.13 53.69 2vpw s LEU 175 Cb 0.41 -0.61 -0.03 0.00 0.50 0.00 0.00 46.19 46.45 2vpw s LEU 175 CO -0.00 -0.27 0.02 -0.36 -1.32 0.00 0.00 176.35 174.43 2vpw s PHE 176 N 1.85 3.19 -0.21 5.38 0.40 0.68 -4.73 117.98 124.54 2vpw s PHE 176 Ca 0.00 0.06 -0.08 0.00 -0.60 0.00 0.00 56.93 56.32 2vpw s PHE 176 Cb -0.16 -1.93 -0.04 0.00 0.51 0.00 0.00 43.02 41.40 2vpw s PHE 176 CO -0.07 0.27 0.08 0.71 0.70 0.00 0.00 175.22 176.91 2vpw s TYR 177 N -0.19 3.22 0.04 0.36 1.51 0.40 -0.62 117.35 122.07 2vpw s TYR 177 Ca 0.06 -0.01 -0.00 0.00 -1.01 0.00 0.00 57.07 56.11 2vpw s TYR 177 Cb -0.12 -2.14 -0.04 0.00 -0.11 0.00 0.00 41.96 39.54 2vpw s TYR 177 CO 0.02 0.03 0.18 -0.51 -1.11 0.00 0.00 175.55 174.16 2vpw s LEU 178 N 0.75 4.27 -1.54 -1.29 1.43 0.18 -0.43 118.68 122.05 2vpw s LEU 178 Ca 0.04 0.25 -0.01 0.00 -1.03 0.00 0.00 54.13 53.38 2vpw s LEU 178 Cb -0.13 -2.77 0.01 0.00 0.03 0.00 0.00 46.19 43.32 2vpw s LEU 178 CO 0.02 0.20 0.07 0.59 0.23 0.00 0.00 176.35 177.46 2vpw n ASN 179 N 0.53 0.71 -4.57 2.29 5.03 -0.62 -1.09 115.26 117.53 2vpw n ASN 179 Ca -0.07 -1.24 -0.48 0.00 0.87 0.00 0.00 54.58 53.65 2vpw n ASN 179 Cb 0.52 -1.78 -0.04 0.00 -1.02 0.00 0.00 39.78 37.45 2vpw n ASN 179 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2vpw n ALA 180 N -4.55 -0.88 -0.34 5.41 0.00 -1.26 -3.85 120.51 115.04 2vpw n ALA 180 Ca -0.31 0.46 -0.01 0.00 0.00 0.00 0.00 53.44 53.57 2vpw n ALA 180 Cb 0.69 -2.00 0.12 0.00 0.00 0.00 0.00 19.45 18.27 2vpw n ALA 180 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2vpw h PRO 181 N 3.04 1.11 -6.31 0.00 0.13 -1.88 -3.43 132.00 124.67 2vpw h PRO 181 Ca -0.42 -0.07 -0.54 0.00 -0.87 0.00 0.00 66.00 64.10 2vpw h PRO 181 Cb 1.35 -0.25 -0.04 0.00 0.13 0.00 0.00 31.00 32.19 2vpw h PRO 181 CO 0.68 0.73 0.15 0.45 -0.23 0.00 0.00 178.00 179.78 2vpw s SER 182 N -5.92 7.21 0.50 1.44 0.15 -1.26 -4.95 113.70 110.87 2vpw s SER 182 Ca -0.13 1.45 0.20 0.00 0.70 0.00 0.00 55.95 58.17 2vpw s SER 182 Cb 0.18 -2.46 1.26 0.00 -1.71 0.00 0.00 66.02 63.29 2vpw s SER 182 CO 0.80 0.05 2.02 0.11 1.20 0.00 0.00 173.24 177.42 2vpw h LYS 183 N 5.50 0.12 -0.01 5.44 1.57 -2.02 0.60 116.57 127.77 2vpw h LYS 183 Ca -0.44 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 2vpw h LYS 183 Cb 1.21 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.49 2vpw h LYS 183 CO 0.70 0.08 -0.03 1.63 -0.57 0.00 0.00 179.45 181.26 2vpw n LYS 184 N -4.44 1.17 0.00 3.15 5.02 -1.26 -5.03 118.16 116.77 2vpw n LYS 184 Ca 0.07 -0.42 0.00 0.00 -2.02 0.00 0.00 58.31 55.94 2vpw n LYS 184 Cb 0.43 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.95 2vpw n LYS 184 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2vpw n GLY 185 N 1.14 -1.79 3.70 0.72 0.00 0.20 -4.93 105.19 104.23 2vpw n GLY 185 Ca 0.20 -2.01 -0.43 0.00 0.00 0.00 0.00 46.02 43.77 2vpw n GLY 185 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2vpw n LEU 186 N 0.00 3.59 -4.76 0.99 4.77 -1.26 -4.50 117.00 115.82 2vpw n LEU 186 Ca 0.00 1.19 -0.41 0.00 -0.03 0.00 0.00 56.01 56.76 2vpw n LEU 186 Cb 0.00 -1.49 -0.02 0.00 -2.33 0.00 0.00 43.42 39.58 2vpw n LEU 186 CO 0.00 -0.39 1.02 -0.89 -1.33 0.00 0.00 177.39 175.80 2vpw s THR 187 N -0.76 2.70 0.15 -5.08 2.01 -1.26 -5.06 115.64 108.33 2vpw s THR 187 Ca 0.59 0.66 0.07 0.00 0.31 0.00 0.00 61.69 63.32 2vpw s THR 187 Cb -0.58 -3.42 -0.04 0.00 0.01 0.00 0.00 72.50 68.47 2vpw s THR 187 CO 0.58 0.14 -0.16 -0.13 -0.69 0.00 0.00 174.62 174.36 2vpw s ARG 188 N -1.28 1.17 0.33 4.92 0.52 -1.26 -5.02 118.95 118.33 2vpw s ARG 188 Ca 0.53 -1.34 0.09 0.00 -0.52 0.00 0.00 55.73 54.49 2vpw s ARG 188 Cb -0.40 -1.15 0.58 0.00 0.52 0.00 0.00 34.95 34.50 2vpw s ARG 188 CO 0.50 0.23 1.77 1.49 0.02 0.00 0.00 175.30 179.30 2vpw h GLU 189 N 3.37 0.15 0.00 3.54 4.81 -1.97 -2.66 114.58 121.82 2vpw h GLU 189 Ca -0.41 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 58.74 2vpw h GLU 189 Cb 1.20 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.57 2vpw h GLU 189 CO 0.51 0.50 -0.08 0.66 -0.73 0.00 0.00 179.01 179.87 2vpw h SER 190 N 0.13 0.00 -0.16 1.04 4.64 -1.98 -0.27 113.55 116.95 2vpw h SER 190 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2vpw h SER 190 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 2vpw h SER 190 CO 0.05 0.08 0.00 -0.62 -0.87 0.00 0.00 176.83 175.47 2vpw n GLU 191 N -4.13 1.42 -2.89 4.77 -0.58 -1.00 -4.81 120.64 113.42 2vpw n GLU 191 Ca -0.03 -0.65 -0.19 0.00 -0.42 0.00 0.00 57.16 55.88 2vpw n GLU 191 Cb 0.16 -1.20 0.03 0.00 -0.57 0.00 0.00 31.44 29.86 2vpw n GLU 191 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2vpw s VAL 192 N -1.79 2.77 0.00 2.62 1.01 -0.11 -4.86 120.40 120.03 2vpw s VAL 192 Ca 0.18 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.27 2vpw s VAL 192 Cb 0.09 -2.88 0.00 0.00 0.00 0.00 0.00 36.38 33.59 2vpw s VAL 192 CO 0.13 0.00 0.00 1.41 0.00 0.00 0.00 175.10 176.64 2vpw n HIS 193 N -2.08 0.00 0.00 5.22 8.25 -1.26 -5.05 115.22 120.30 2vpw n HIS 193 Ca 0.09 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.55 2vpw n HIS 193 Cb 0.60 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.71 2vpw n HIS 193 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56