#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wmp n SER 10 N 0.00 3.56 0.00 0.00 2.88 -1.26 -4.87 113.62 113.93 1wmp n SER 10 Ca 0.00 1.14 0.08 0.00 -1.33 0.00 0.00 58.87 58.76 1wmp n SER 10 Cb 0.00 -1.54 0.37 0.00 -0.75 0.00 0.00 64.21 62.29 1wmp n SER 10 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1wmp n PRO 11 N 2.29 0.09 -0.34 -1.46 -0.02 -1.26 -2.25 135.00 132.06 1wmp n PRO 11 Ca 0.10 0.19 0.07 0.00 -2.02 0.00 0.00 63.50 61.84 1wmp n PRO 11 Cb 0.35 -1.50 0.23 0.00 -0.02 0.00 0.00 33.50 32.56 1wmp n PRO 11 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1wmp n PHE 12 N -1.42 0.81 -1.19 6.00 3.72 -1.26 -4.81 117.46 119.31 1wmp n PHE 12 Ca 0.05 -0.62 -0.32 0.00 -0.05 0.00 0.00 57.45 56.51 1wmp n PHE 12 Cb 0.17 -0.14 0.11 0.00 -0.94 0.00 0.00 39.48 38.68 1wmp n PHE 12 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 1wmp s ARG 13 N -1.62 1.88 0.49 -1.08 1.70 -0.95 -4.77 118.95 114.59 1wmp s ARG 13 Ca 0.35 1.50 -0.21 0.00 -0.47 0.00 0.00 55.73 56.90 1wmp s ARG 13 Cb 0.22 -1.83 -0.07 0.00 -0.57 0.00 0.00 34.95 32.70 1wmp s ARG 13 CO 0.17 -1.98 1.10 -0.51 -1.08 0.00 0.00 175.30 173.00 1wmp s LEU 14 N -5.79 3.88 0.34 -1.89 1.43 -1.26 -4.97 118.68 110.42 1wmp s LEU 14 Ca 0.68 2.10 -0.29 0.00 -1.03 0.00 0.00 54.13 55.59 1wmp s LEU 14 Cb -0.23 -4.46 -0.11 0.00 0.03 0.00 0.00 46.19 41.42 1wmp s LEU 14 CO 0.52 -0.93 1.39 0.00 0.23 0.00 0.00 176.35 177.56 1wmp s ALA 15 N -1.78 3.54 0.44 4.21 0.00 -1.26 -5.01 121.76 121.90 1wmp s ALA 15 Ca 0.67 1.40 0.02 0.00 0.00 0.00 0.00 51.96 54.05 1wmp s ALA 15 Cb -0.22 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.36 1wmp s ALA 15 CO 0.26 -0.82 0.64 -1.54 0.00 0.00 0.00 175.76 174.30 1wmp s SER 16 N -0.27 5.78 0.33 0.00 1.04 -1.26 -4.38 113.70 114.95 1wmp s SER 16 Ca 0.51 0.11 0.06 0.00 0.48 0.00 0.00 55.95 57.12 1wmp s SER 16 Cb -0.43 -1.34 0.60 0.00 0.10 0.00 0.00 66.02 64.95 1wmp s SER 16 CO 0.56 -0.70 1.83 0.00 0.98 0.00 0.00 173.24 175.91 1wmp h ALA 17 N 0.47 1.32 -0.55 5.32 0.00 -1.94 -2.63 119.26 121.24 1wmp h ALA 17 Ca -0.45 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.12 1wmp h ALA 17 Cb 1.26 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1wmp h ALA 17 CO 0.55 0.46 0.07 0.78 0.00 0.00 0.00 179.25 181.11 1wmp h GLY 18 N 0.90 0.99 1.10 0.00 0.00 -1.98 -1.18 103.07 102.90 1wmp h GLY 18 Ca 0.07 -0.67 -0.01 0.00 0.00 0.00 0.00 47.33 46.71 1wmp h GLY 18 CO 0.03 0.62 0.51 0.83 0.00 0.00 0.00 176.54 178.53 1wmp h GLU 19 N 0.81 1.18 -0.37 4.80 5.08 -1.86 0.30 114.58 124.52 1wmp h GLU 19 Ca 0.17 -0.11 -0.15 0.00 -1.00 0.00 0.00 59.36 58.26 1wmp h GLU 19 Cb 0.43 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 1wmp h GLU 19 CO 0.01 0.84 -0.34 0.82 -1.00 0.00 0.00 179.01 179.34 1wmp h ILE 20 N 1.20 1.28 -0.60 3.13 2.04 -1.30 -0.56 117.51 122.69 1wmp h ILE 20 Ca 0.31 -1.51 -0.05 0.00 1.00 0.00 0.00 64.86 64.61 1wmp h ILE 20 Cb -0.03 1.42 -0.03 0.00 -0.74 0.00 0.00 36.82 37.44 1wmp h ILE 20 CO -0.06 0.50 0.17 0.28 0.00 0.00 0.00 178.15 179.05 1wmp h SER 21 N 0.68 0.84 -0.48 1.72 0.02 -0.62 -1.21 113.55 114.51 1wmp h SER 21 Ca 0.06 -0.14 -0.07 0.00 -0.84 0.00 0.00 61.79 60.80 1wmp h SER 21 Cb 0.93 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 63.23 1wmp h SER 21 CO 0.09 0.80 0.04 -0.08 -1.14 0.00 0.00 176.83 176.54 1wmp h GLU 22 N 0.88 0.81 -0.89 3.45 4.57 -0.15 -1.17 114.58 122.09 1wmp h GLU 22 Ca 0.20 -0.24 -0.01 0.00 -1.18 0.00 0.00 59.36 58.13 1wmp h GLU 22 Cb 0.27 -0.08 -0.04 0.00 -0.16 0.00 0.00 28.75 28.73 1wmp h GLU 22 CO -0.01 0.84 0.52 0.28 -1.18 0.00 0.00 179.01 179.47 1wmp h VAL 23 N 0.68 1.25 -0.39 0.32 2.07 -0.64 0.04 116.25 119.57 1wmp h VAL 23 Ca 0.14 -0.56 -0.01 0.00 0.82 0.00 0.00 66.70 67.09 1wmp h VAL 23 Cb 0.45 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.20 1wmp h VAL 23 CO 0.02 0.27 0.22 -0.61 0.02 0.00 0.00 177.57 177.48 1wmp h GLN 24 N 1.23 0.55 -0.36 1.57 4.15 -0.84 -1.17 115.11 120.24 1wmp h GLN 24 Ca 0.32 -0.06 -0.04 0.00 0.77 0.00 0.00 58.65 59.64 1wmp h GLN 24 Cb -0.03 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.53 1wmp h GLN 24 CO -0.06 0.44 0.08 0.78 -1.93 0.00 0.00 178.83 178.15 1wmp h GLY 25 N 0.51 0.62 0.79 2.39 0.00 -0.67 -0.80 103.07 105.91 1wmp h GLY 25 Ca 0.14 -0.39 0.03 0.00 0.00 0.00 0.00 47.33 47.10 1wmp h GLY 25 CO -0.02 0.36 0.07 -2.22 0.00 0.00 0.00 176.54 174.73 1wmp h ILE 26 N 0.43 0.93 -0.28 2.60 2.04 -0.85 0.04 117.51 122.41 1wmp h ILE 26 Ca 0.11 -0.06 -0.01 0.00 1.00 0.00 0.00 64.86 65.90 1wmp h ILE 26 Cb 0.31 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 1wmp h ILE 26 CO 0.00 0.03 0.12 -0.07 0.00 0.00 0.00 178.15 178.24 1wmp h LEU 27 N 0.16 0.38 0.09 1.44 3.38 -1.12 -1.29 115.31 118.35 1wmp h LEU 27 Ca 0.10 -0.14 0.01 0.00 0.09 0.00 0.00 57.88 57.94 1wmp h LEU 27 Cb 0.08 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1wmp h LEU 27 CO -0.11 0.42 -0.14 0.03 0.09 0.00 0.00 178.44 178.72 1wmp h ARG 28 N 0.31 -0.28 -0.08 1.13 3.08 -0.88 0.32 114.38 117.99 1wmp h ARG 28 Ca 0.10 0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.16 1wmp h ARG 28 Cb 0.15 0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.26 1wmp h ARG 28 CO -0.01 -0.18 0.05 1.15 -1.07 0.00 0.00 179.97 179.90 1wmp h THR 29 N -0.29 1.02 -0.00 2.04 2.02 -0.92 0.15 112.91 116.93 1wmp h THR 29 Ca 0.02 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.15 1wmp h THR 29 Cb 0.30 0.91 0.00 0.00 -1.74 0.00 0.00 68.15 67.62 1wmp h THR 29 CO -0.08 0.03 -0.01 0.00 0.37 0.00 0.00 175.52 175.82 1wmp n ALA 30 N -2.53 2.65 -1.13 6.16 0.00 -0.50 -4.88 120.51 120.28 1wmp n ALA 30 Ca -0.02 -0.23 -0.05 0.00 0.00 0.00 0.00 53.44 53.15 1wmp n ALA 30 Cb 0.09 -1.45 -0.02 0.00 0.00 0.00 0.00 19.45 18.07 1wmp n ALA 30 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wmp n GLY 31 N 1.10 0.73 0.38 0.00 0.00 0.51 -4.90 105.19 103.01 1wmp n GLY 31 Ca 0.21 -0.61 0.12 0.00 0.00 0.00 0.00 46.02 45.74 1wmp n GLY 31 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wmp n LEU 32 N -0.52 1.50 -2.90 0.99 4.77 0.05 -4.46 117.00 116.42 1wmp n LEU 32 Ca -0.05 -0.49 -0.27 0.00 -0.03 0.00 0.00 56.01 55.18 1wmp n LEU 32 Cb 0.18 -0.06 -0.04 0.00 -2.33 0.00 0.00 43.42 41.17 1wmp n LEU 32 CO 0.07 0.28 0.15 -0.11 -1.33 0.00 0.00 177.39 176.45 1wmp n LEU 33 N -0.28 4.51 -4.68 2.23 7.94 -1.19 -4.92 117.00 120.62 1wmp n LEU 33 Ca 0.12 -5.65 -0.29 0.00 -1.11 0.00 0.00 56.01 49.08 1wmp n LEU 33 Cb 0.40 -0.55 0.19 0.00 0.53 0.00 0.00 43.42 43.99 1wmp n LEU 33 CO 0.26 2.35 0.65 -0.83 -1.11 0.00 0.00 177.39 178.70 1wmp s GLY 34 N -3.48 1.57 0.45 -3.96 0.00 -1.26 -4.84 107.32 95.80 1wmp s GLY 34 Ca 0.49 -0.54 0.23 0.00 0.00 0.00 0.00 44.72 44.89 1wmp s GLY 34 CO -0.14 0.13 1.85 -2.55 0.00 0.00 0.00 173.10 172.39 1wmp h PRO 35 N -2.01 0.26 -0.00 2.90 0.11 -1.99 0.16 132.00 131.43 1wmp h PRO 35 Ca -0.52 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.57 1wmp h PRO 35 Cb 1.32 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1wmp h PRO 35 CO 0.53 0.17 -0.27 -0.85 -0.21 0.00 0.00 178.00 177.37 1wmp n GLU 36 N -4.45 0.36 -3.14 1.05 0.00 -1.26 -4.92 120.64 108.28 1wmp n GLU 36 Ca 0.20 -0.17 -0.33 0.00 0.00 0.00 0.00 57.16 56.87 1wmp n GLU 36 Cb 0.83 -1.50 -0.06 0.00 0.00 0.00 0.00 31.44 30.71 1wmp n GLU 36 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 1wmp s LYS 37 N -2.76 4.02 -0.01 3.44 -0.14 0.04 -1.00 119.74 123.33 1wmp s LYS 37 Ca 0.19 0.68 -0.03 0.00 -1.36 0.00 0.00 55.97 55.45 1wmp s LYS 37 Cb 0.19 -2.48 -0.00 0.00 -1.68 0.00 0.00 37.83 33.85 1wmp s LYS 37 CO 0.58 0.19 0.07 1.03 -0.76 0.00 0.00 175.35 176.45 1wmp s ARG 38 N -2.87 0.24 -0.46 1.68 1.81 0.12 -4.85 118.95 114.62 1wmp s ARG 38 Ca 0.53 -0.18 -0.21 0.00 -1.72 0.00 0.00 55.73 54.14 1wmp s ARG 38 Cb -0.11 0.10 0.03 0.00 -0.45 0.00 0.00 34.95 34.52 1wmp s ARG 38 CO 0.18 -0.04 0.71 0.42 -0.68 0.00 0.00 175.30 175.88 1wmp s ILE 39 N -0.66 4.74 -0.54 1.52 1.01 0.53 0.10 121.20 127.91 1wmp s ILE 39 Ca -0.07 0.11 0.24 0.00 0.00 0.00 0.00 60.65 60.93 1wmp s ILE 39 Cb -0.05 -4.29 0.14 0.00 0.01 0.00 0.00 42.46 38.28 1wmp s ILE 39 CO 0.00 -0.72 1.41 0.00 0.00 0.00 0.00 174.94 175.64 1wmp h ALA 40 N 8.97 0.73 -1.61 9.38 0.00 -1.23 -3.38 119.26 132.11 1wmp h ALA 40 Ca -0.26 0.00 0.06 0.00 0.00 0.00 0.00 54.91 54.72 1wmp h ALA 40 Cb 1.09 0.00 -0.26 0.00 0.00 0.00 0.00 17.79 18.62 1wmp h ALA 40 CO 0.94 0.00 0.44 -0.47 0.00 0.00 0.00 179.25 180.16 1wmp s TYR 41 N -3.20 -0.50 -0.13 0.00 5.04 -1.21 -4.67 117.35 112.69 1wmp s TYR 41 Ca 0.06 1.18 -0.06 0.00 -2.44 0.00 0.00 57.07 55.82 1wmp s TYR 41 Cb 0.11 0.36 0.06 0.00 0.35 0.00 0.00 41.96 42.84 1wmp s TYR 41 CO 0.70 -0.24 0.28 -1.17 -1.34 0.00 0.00 175.55 173.78 1wmp s LEU 42 N 0.34 -0.03 0.01 6.97 0.20 -1.26 -0.92 118.68 123.99 1wmp s LEU 42 Ca 0.02 0.63 -0.19 0.00 0.69 0.00 0.00 54.13 55.28 1wmp s LEU 42 Cb -0.05 0.83 0.04 0.00 -0.43 0.00 0.00 46.19 46.58 1wmp s LEU 42 CO -0.07 -0.21 0.42 -0.83 -0.29 0.00 0.00 176.35 175.38 1wmp s GLY 43 N 1.88 -0.29 0.25 7.98 0.00 -0.56 -4.61 107.32 111.97 1wmp s GLY 43 Ca -0.04 0.49 -0.30 0.00 0.00 0.00 0.00 44.72 44.87 1wmp s GLY 43 CO -0.09 0.23 0.98 0.54 0.00 0.00 0.00 173.10 174.76 1wmp s VAL 44 N -1.86 3.91 0.14 1.40 0.11 -1.26 -0.06 120.40 122.78 1wmp s VAL 44 Ca -0.09 1.92 -0.25 0.00 -2.93 0.00 0.00 61.98 60.63 1wmp s VAL 44 Cb -0.02 -4.22 -0.08 0.00 -1.53 0.00 0.00 36.38 30.53 1wmp s VAL 44 CO 0.02 0.46 0.77 -0.76 -3.33 0.00 0.00 175.10 172.26 1wmp s LEU 45 N -1.25 4.57 0.63 2.54 1.43 0.09 -4.86 118.68 121.84 1wmp s LEU 45 Ca 0.42 1.60 -0.15 0.00 -1.03 0.00 0.00 54.13 54.97 1wmp s LEU 45 Cb -0.28 -3.27 -0.02 0.00 0.03 0.00 0.00 46.19 42.66 1wmp s LEU 45 CO 0.35 0.19 1.08 -1.81 0.23 0.00 0.00 176.35 176.38 1wmp s ASP 46 N -0.99 5.47 0.45 2.29 1.01 -1.26 -4.72 116.67 118.92 1wmp s ASP 46 Ca 0.36 1.88 -0.25 0.00 0.71 0.00 0.00 52.55 55.25 1wmp s ASP 46 Cb -0.23 -2.54 -0.08 0.00 1.01 0.00 0.00 42.92 41.09 1wmp s ASP 46 CO 0.25 -1.38 1.36 -2.84 0.21 0.00 0.00 175.17 172.77 1wmp s PRO 47 N -4.15 3.70 0.72 8.23 0.02 -1.26 -4.99 135.00 137.27 1wmp s PRO 47 Ca 0.65 2.26 -0.11 0.00 0.02 0.00 0.00 61.00 63.81 1wmp s PRO 47 Cb -0.18 -2.61 0.02 0.00 0.02 0.00 0.00 34.50 31.76 1wmp s PRO 47 CO 0.40 -0.75 1.08 0.00 -0.33 0.00 0.00 177.00 177.40 1wmp s ALA 48 N -1.26 2.66 -0.03 -1.55 0.00 -1.26 -4.95 121.76 115.37 1wmp s ALA 48 Ca 0.61 -0.18 -0.30 0.00 0.00 0.00 0.00 51.96 52.09 1wmp s ALA 48 Cb -0.40 -3.09 -0.07 0.00 0.00 0.00 0.00 23.12 19.56 1wmp s ALA 48 CO 0.51 -1.29 1.86 1.03 0.00 0.00 0.00 175.76 177.87 1wmp s ARG 49 N -5.21 4.04 0.00 0.00 1.81 -1.26 -4.67 118.95 113.67 1wmp s ARG 49 Ca 0.59 2.36 0.00 0.00 -1.72 0.00 0.00 55.73 56.95 1wmp s ARG 49 Cb -0.13 -4.12 0.00 0.00 -0.45 0.00 0.00 34.95 30.26 1wmp s ARG 49 CO 0.53 -1.05 0.00 0.41 -0.68 0.00 0.00 175.30 174.52 1wmp n GLY 50 N 4.53 1.68 0.00 -3.53 0.00 -1.26 -4.98 105.19 101.63 1wmp n GLY 50 Ca 0.20 -0.36 0.05 0.00 0.00 0.00 0.00 46.02 45.90 1wmp n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wmp n ALA 51 N 0.00 1.50 0.17 4.61 0.00 -1.26 -2.93 120.51 122.60 1wmp n ALA 51 Ca 0.00 -0.04 0.14 0.00 0.00 0.00 0.00 53.44 53.54 1wmp n ALA 51 Cb 0.00 -1.17 0.71 0.00 0.00 0.00 0.00 19.45 18.99 1wmp n ALA 51 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1wmp h GLY 52 N 1.74 0.00 -7.46 0.00 0.00 -1.96 -3.35 103.07 92.05 1wmp h GLY 52 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 47.33 46.94 1wmp h GLY 52 CO 0.00 0.00 1.19 -1.35 0.00 0.00 0.00 176.54 176.38 1wmp s SER 53 N -6.53 5.38 0.46 0.19 1.04 -1.15 -4.94 113.70 108.15 1wmp s SER 53 Ca -0.05 -1.59 -0.24 0.00 0.48 0.00 0.00 55.95 54.54 1wmp s SER 53 Cb 0.17 -2.58 -0.08 0.00 0.10 0.00 0.00 66.02 63.63 1wmp s SER 53 CO 0.66 -2.67 1.31 -0.62 0.98 0.00 0.00 173.24 172.90 1wmp n GLU 54 N 8.43 1.93 -2.54 4.02 -0.58 -1.26 -4.26 120.64 126.38 1wmp n GLU 54 Ca 0.44 0.69 -0.05 0.00 -0.42 0.00 0.00 57.16 57.82 1wmp n GLU 54 Cb 0.47 -2.47 -0.04 0.00 -0.57 0.00 0.00 31.44 28.82 1wmp n GLU 54 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1wmp n ALA 55 N -0.41 -3.70 -2.08 0.62 0.00 -1.26 -4.90 120.51 108.78 1wmp n ALA 55 Ca 0.07 2.28 -0.41 0.00 0.00 0.00 0.00 53.44 55.38 1wmp n ALA 55 Cb 0.41 -4.46 -0.03 0.00 0.00 0.00 0.00 19.45 15.37 1wmp n ALA 55 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1wmp s GLU 56 N -0.73 4.49 -0.56 0.00 1.03 -1.26 -4.98 118.70 116.69 1wmp s GLU 56 Ca -0.27 1.85 -0.23 0.00 0.03 0.00 0.00 54.97 56.36 1wmp s GLU 56 Cb 0.02 -3.25 0.05 0.00 -0.80 0.00 0.00 34.13 30.15 1wmp s GLU 56 CO 0.76 -0.09 0.87 0.34 -1.33 0.00 0.00 175.26 175.81 1wmp s ASP 57 N 0.18 6.27 -0.24 0.83 2.15 -1.26 -4.98 116.67 119.63 1wmp s ASP 57 Ca 0.53 -0.63 -0.28 0.00 0.43 0.00 0.00 52.55 52.59 1wmp s ASP 57 Cb -0.32 -2.40 -0.05 0.00 -0.30 0.00 0.00 42.92 39.85 1wmp s ASP 57 CO 0.36 -1.19 2.23 0.54 -0.17 0.00 0.00 175.17 176.94 1wmp n ARG 58 N 7.19 1.89 -4.63 4.34 5.12 -1.26 -4.95 116.66 124.36 1wmp n ARG 58 Ca -0.02 0.50 -0.30 0.00 -1.93 0.00 0.00 57.85 56.10 1wmp n ARG 58 Cb 0.46 -3.22 -0.13 0.00 -1.16 0.00 0.00 32.46 28.42 1wmp n ARG 58 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 1wmp s ARG 59 N 6.44 1.99 0.06 5.56 0.52 -1.26 -0.97 118.95 131.30 1wmp s ARG 59 Ca 1.01 -1.03 0.09 0.00 -0.52 0.00 0.00 55.73 55.29 1wmp s ARG 59 Cb -0.35 -2.15 -0.03 0.00 0.52 0.00 0.00 34.95 32.94 1wmp s ARG 59 CO 0.35 0.53 -0.26 -0.06 0.02 0.00 0.00 175.30 175.89 1wmp s PHE 60 N -0.94 2.24 -0.15 -0.53 0.40 0.63 -0.73 117.98 118.90 1wmp s PHE 60 Ca 0.15 -0.40 -0.04 0.00 -0.60 0.00 0.00 56.93 56.03 1wmp s PHE 60 Cb -0.10 -1.31 -0.03 0.00 0.51 0.00 0.00 43.02 42.08 1wmp s PHE 60 CO 0.06 0.16 -0.01 0.50 0.70 0.00 0.00 175.22 176.63 1wmp s ARG 61 N -1.40 3.59 -0.01 0.44 3.52 0.91 -0.86 118.95 125.14 1wmp s ARG 61 Ca 0.11 -0.46 0.02 0.00 -0.13 0.00 0.00 55.73 55.27 1wmp s ARG 61 Cb -0.10 -2.95 -0.00 0.00 -1.56 0.00 0.00 34.95 30.34 1wmp s ARG 61 CO 0.03 0.35 -0.06 0.08 -0.81 0.00 0.00 175.30 174.89 1wmp s VAL 62 N 0.09 0.47 -0.29 7.11 1.01 0.82 -1.49 120.40 128.11 1wmp s VAL 62 Ca 0.01 -0.23 -0.07 0.00 0.00 0.00 0.00 61.98 61.69 1wmp s VAL 62 Cb -0.13 -0.41 0.00 0.00 0.00 0.00 0.00 36.38 35.84 1wmp s VAL 62 CO 0.02 0.14 0.09 -0.36 0.00 0.00 0.00 175.10 174.99 1wmp s PHE 63 N -0.00 3.14 -0.27 5.22 0.08 -0.09 -0.41 117.98 125.65 1wmp s PHE 63 Ca 0.01 -0.84 -0.09 0.00 0.12 0.00 0.00 56.93 56.12 1wmp s PHE 63 Cb -0.04 -2.26 -0.03 0.00 -0.57 0.00 0.00 43.02 40.11 1wmp s PHE 63 CO -0.00 -0.53 0.13 0.42 -0.10 0.00 0.00 175.22 175.13 1wmp s ILE 64 N 1.53 4.73 0.20 0.64 1.01 0.84 -0.69 121.20 129.46 1wmp s ILE 64 Ca 0.03 -0.07 -0.02 0.00 0.00 0.00 0.00 60.65 60.60 1wmp s ILE 64 Cb -0.17 -3.25 -0.05 0.00 0.01 0.00 0.00 42.46 39.00 1wmp s ILE 64 CO 0.03 0.27 0.41 -2.28 0.00 0.00 0.00 174.94 173.37 1wmp s HIS 65 N 1.67 3.48 -0.27 3.97 5.65 0.28 -0.95 115.29 129.12 1wmp s HIS 65 Ca 0.06 0.41 0.02 0.00 0.25 0.00 0.00 55.06 55.80 1wmp s HIS 65 Cb -0.16 -1.91 0.07 0.00 -1.18 0.00 0.00 32.58 29.41 1wmp s HIS 65 CO 0.07 0.36 -0.04 0.34 -0.65 0.00 0.00 174.74 174.82 1wmp s ASP 66 N -3.05 4.20 0.00 9.88 -1.08 -1.26 0.16 116.67 125.52 1wmp s ASP 66 Ca 0.39 -1.46 0.05 0.00 -0.52 0.00 0.00 52.55 51.01 1wmp s ASP 66 Cb -0.11 -1.33 0.24 0.00 -1.46 0.00 0.00 42.92 40.25 1wmp s ASP 66 CO 0.28 -0.27 0.97 1.33 0.52 0.00 0.00 175.17 178.01 1wmp n VAL 67 N 4.54 0.93 1.03 1.11 0.24 -0.17 -1.22 118.33 124.78 1wmp n VAL 67 Ca -0.09 0.23 0.12 0.00 -2.04 0.00 0.00 64.34 62.56 1wmp n VAL 67 Cb 0.43 -1.16 0.15 0.00 -1.47 0.00 0.00 33.84 31.80 1wmp n VAL 67 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1wmp n SER 68 N -1.27 0.77 0.00 -1.34 2.88 -1.26 -4.82 113.62 108.57 1wmp n SER 68 Ca 0.02 -0.59 0.00 0.00 -1.33 0.00 0.00 58.87 56.98 1wmp n SER 68 Cb 0.04 0.45 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 1wmp n SER 68 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wmp n GLY 69 N 1.48 0.63 3.76 0.46 0.00 -0.36 -5.02 105.19 106.13 1wmp n GLY 69 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 1wmp n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wmp s ALA 70 N -2.18 2.92 0.22 4.61 0.00 -1.26 -4.87 121.76 121.21 1wmp s ALA 70 Ca 0.00 1.30 -0.31 0.00 0.00 0.00 0.00 51.96 52.95 1wmp s ALA 70 Cb 0.00 -3.54 -0.15 0.00 0.00 0.00 0.00 23.12 19.43 1wmp s ALA 70 CO 0.00 -1.23 1.09 0.54 0.00 0.00 0.00 175.76 176.16 1wmp n ARG 71 N -0.78 1.24 -1.58 0.00 1.74 -1.26 -4.32 116.66 111.70 1wmp n ARG 71 Ca 0.09 0.44 -0.30 0.00 -0.77 0.00 0.00 57.85 57.31 1wmp n ARG 71 Cb 0.45 -1.87 0.19 0.00 -1.02 0.00 0.00 32.46 30.21 1wmp n ARG 71 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1wmp s PRO 72 N -0.89 0.13 0.04 5.56 0.04 -1.25 -4.77 135.00 133.85 1wmp s PRO 72 Ca 0.67 -0.16 -0.00 0.00 0.04 0.00 0.00 61.00 61.54 1wmp s PRO 72 Cb -0.78 -1.76 -0.03 0.00 0.04 0.00 0.00 34.50 31.96 1wmp s PRO 72 CO 0.55 -2.79 -0.03 -0.65 0.04 0.00 0.00 177.00 174.12 1wmp s GLN 73 N -5.62 0.46 -0.26 4.56 -0.21 -0.13 0.01 119.66 118.48 1wmp s GLN 73 Ca 0.71 -0.91 -0.02 0.00 0.02 0.00 0.00 55.36 55.15 1wmp s GLN 73 Cb -0.08 0.16 0.03 0.00 1.00 0.00 0.00 33.01 34.11 1wmp s GLN 73 CO 0.54 -0.08 -0.03 -2.00 -2.12 0.00 0.00 175.29 171.60 1wmp s GLU 74 N -2.67 2.84 -0.06 2.91 2.12 -0.17 -0.11 118.70 123.56 1wmp s GLU 74 Ca -0.05 -0.98 0.05 0.00 0.36 0.00 0.00 54.97 54.35 1wmp s GLU 74 Cb -0.01 -3.07 -0.00 0.00 0.26 0.00 0.00 34.13 31.31 1wmp s GLU 74 CO -0.05 -0.43 -0.21 0.08 -0.54 0.00 0.00 175.26 174.11 1wmp s VAL 75 N 1.35 1.76 -0.16 3.70 1.01 0.45 -0.95 120.40 127.56 1wmp s VAL 75 Ca 0.00 -0.88 -0.04 0.00 0.00 0.00 0.00 61.98 61.07 1wmp s VAL 75 Cb -0.17 -1.51 -0.03 0.00 0.00 0.00 0.00 36.38 34.67 1wmp s VAL 75 CO -0.03 0.49 -0.04 -0.89 0.00 0.00 0.00 175.10 174.64 1wmp s THR 76 N 0.12 3.83 0.08 3.92 2.01 0.03 -0.13 115.64 125.51 1wmp s THR 76 Ca -0.09 -0.38 0.07 0.00 0.31 0.00 0.00 61.69 61.61 1wmp s THR 76 Cb -0.14 -2.68 -0.03 0.00 0.01 0.00 0.00 72.50 69.65 1wmp s THR 76 CO 0.05 0.49 -0.19 0.68 -0.69 0.00 0.00 174.62 174.95 1wmp s VAL 77 N 0.46 1.54 -0.39 3.82 -7.23 -0.04 -0.23 120.40 118.33 1wmp s VAL 77 Ca -0.04 -1.38 -0.13 0.00 -1.81 0.00 0.00 61.98 58.62 1wmp s VAL 77 Cb -0.14 -1.40 0.02 0.00 0.56 0.00 0.00 36.38 35.42 1wmp s VAL 77 CO 0.03 -0.03 0.25 -0.55 -0.31 0.00 0.00 175.10 174.49 1wmp s SER 78 N -1.66 5.92 0.48 4.85 0.15 -0.05 -0.27 113.70 123.12 1wmp s SER 78 Ca 0.05 -0.94 0.28 0.00 0.70 0.00 0.00 55.95 56.03 1wmp s SER 78 Cb -0.10 -2.09 0.92 0.00 -1.71 0.00 0.00 66.02 63.04 1wmp s SER 78 CO 0.03 -0.41 1.82 0.58 1.20 0.00 0.00 173.24 176.46 1wmp h VAL 79 N 5.75 0.16 -0.18 4.45 2.07 -1.34 0.16 116.25 127.33 1wmp h VAL 79 Ca -0.26 -0.87 -0.06 0.00 0.82 0.00 0.00 66.70 66.32 1wmp h VAL 79 Cb 1.11 1.75 -0.00 0.00 -1.52 0.00 0.00 31.29 32.63 1wmp h VAL 79 CO 0.70 0.07 -0.13 0.74 0.02 0.00 0.00 177.57 178.97 1wmp h THR 80 N 0.00 1.32 -0.00 2.57 2.02 -1.91 -3.28 112.91 113.63 1wmp h THR 80 Ca -0.00 -1.25 0.00 0.00 0.77 0.00 0.00 66.41 65.93 1wmp h THR 80 Cb 0.74 1.75 0.00 0.00 -1.74 0.00 0.00 68.15 68.90 1wmp h THR 80 CO 0.01 0.37 -0.87 0.59 0.37 0.00 0.00 175.52 175.99 1wmp n ASN 81 N -4.54 1.00 -2.33 4.18 3.02 -1.20 -4.99 115.26 110.41 1wmp n ASN 81 Ca -0.05 -0.92 -0.14 0.00 -0.03 0.00 0.00 54.58 53.44 1wmp n ASN 81 Cb 0.35 0.83 0.05 0.00 -0.61 0.00 0.00 39.78 40.39 1wmp n ASN 81 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wmp n GLY 82 N 1.49 0.05 3.32 7.41 0.00 0.54 -5.03 105.19 112.97 1wmp n GLY 82 Ca 0.05 -0.12 -0.17 0.00 0.00 0.00 0.00 46.02 45.78 1wmp n GLY 82 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1wmp s THR 83 N -3.18 0.83 -0.42 2.61 -4.23 -0.95 -4.93 115.64 105.37 1wmp s THR 83 Ca 0.34 -2.01 -0.18 0.00 -1.18 0.00 0.00 61.69 58.67 1wmp s THR 83 Cb -0.15 -2.43 0.02 0.00 1.34 0.00 0.00 72.50 71.28 1wmp s THR 83 CO 0.42 -0.22 0.47 -0.69 -0.54 0.00 0.00 174.62 174.06 1wmp s VAL 84 N -3.56 5.05 0.08 2.29 1.01 -1.26 -0.87 120.40 123.14 1wmp s VAL 84 Ca 0.31 -0.27 -0.19 0.00 0.00 0.00 0.00 61.98 61.83 1wmp s VAL 84 Cb 0.07 -4.06 -0.09 0.00 0.00 0.00 0.00 36.38 32.29 1wmp s VAL 84 CO 0.10 -0.44 1.52 0.40 0.00 0.00 0.00 175.10 176.68 1wmp h ILE 85 N 5.75 1.25 -2.72 2.22 1.08 -0.94 -3.47 117.51 120.67 1wmp h ILE 85 Ca -0.26 -0.84 -0.02 0.00 -0.39 0.00 0.00 64.86 63.34 1wmp h ILE 85 Cb 1.11 1.38 -0.14 0.00 -3.07 0.00 0.00 36.82 36.10 1wmp h ILE 85 CO 0.81 0.26 0.23 -0.94 -0.69 0.00 0.00 178.15 177.82 1wmp s SER 86 N -5.86 -0.57 -0.23 1.72 1.04 -1.01 -4.99 113.70 103.80 1wmp s SER 86 Ca -0.14 0.16 -0.03 0.00 0.48 0.00 0.00 55.95 56.42 1wmp s SER 86 Cb 0.07 0.57 0.12 0.00 0.10 0.00 0.00 66.02 66.88 1wmp s SER 86 CO 0.73 -0.86 0.33 0.00 0.98 0.00 0.00 173.24 174.42 1wmp s ALA 87 N -3.13 -0.84 -0.10 5.32 0.00 -1.26 -0.79 121.76 120.96 1wmp s ALA 87 Ca -0.01 0.74 -0.01 0.00 0.00 0.00 0.00 51.96 52.68 1wmp s ALA 87 Cb -0.01 -1.54 -0.03 0.00 0.00 0.00 0.00 23.12 21.55 1wmp s ALA 87 CO -0.08 -1.21 -0.05 0.08 0.00 0.00 0.00 175.76 174.50 1wmp s VAL 88 N 2.48 3.82 0.08 0.00 1.01 -0.12 -4.94 120.40 122.73 1wmp s VAL 88 Ca 0.10 -0.41 -0.30 0.00 0.00 0.00 0.00 61.98 61.36 1wmp s VAL 88 Cb -0.15 -2.61 -0.06 0.00 0.00 0.00 0.00 36.38 33.56 1wmp s VAL 88 CO -0.14 0.56 1.10 -0.70 0.00 0.00 0.00 175.10 175.92 1wmp s GLU 89 N -0.37 4.52 -0.11 2.72 2.12 -1.26 -0.99 118.70 125.33 1wmp s GLU 89 Ca 0.06 1.65 -0.12 0.00 0.36 0.00 0.00 54.97 56.91 1wmp s GLU 89 Cb -0.12 -3.36 -0.05 0.00 0.26 0.00 0.00 34.13 30.86 1wmp s GLU 89 CO 0.02 -0.09 0.28 -0.51 -0.54 0.00 0.00 175.26 174.43 1wmp s LEU 90 N 0.60 4.34 -0.80 2.70 1.43 0.10 -4.93 118.68 122.12 1wmp s LEU 90 Ca 0.54 0.62 -0.08 0.00 -1.03 0.00 0.00 54.13 54.18 1wmp s LEU 90 Cb -0.27 -2.35 0.21 0.00 0.03 0.00 0.00 46.19 43.81 1wmp s LEU 90 CO 0.30 0.24 0.70 -0.62 0.23 0.00 0.00 176.35 177.20 1wmp s ASP 91 N -0.32 6.20 0.42 2.29 3.68 -1.26 -3.96 116.67 123.73 1wmp s ASP 91 Ca 0.18 -3.00 0.15 0.00 2.13 0.00 0.00 52.55 52.00 1wmp s ASP 91 Cb -0.14 -2.05 1.03 0.00 -1.45 0.00 0.00 42.92 40.31 1wmp s ASP 91 CO 0.06 -0.42 1.94 0.71 0.13 0.00 0.00 175.17 177.59 1wmp h THR 92 N 4.71 0.83 0.00 1.71 1.35 -1.94 0.12 112.91 119.69 1wmp h THR 92 Ca 0.08 -0.15 -0.01 0.00 -0.55 0.00 0.00 66.41 65.79 1wmp h THR 92 Cb 0.96 0.36 -0.00 0.00 -1.73 0.00 0.00 68.15 67.74 1wmp h THR 92 CO 0.78 0.08 -0.02 0.00 -0.25 0.00 0.00 175.52 176.11 1wmp h ALA 93 N 1.66 1.06 0.00 6.62 0.00 -1.91 0.22 119.26 126.91 1wmp h ALA 93 Ca 0.34 -0.02 -0.26 0.00 0.00 0.00 0.00 54.91 54.97 1wmp h ALA 93 Cb 0.74 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.49 1wmp h ALA 93 CO -0.11 0.03 -1.86 0.00 0.00 0.00 0.00 179.25 177.31 1wmp n ALA 94 N -2.13 1.09 1.00 0.00 0.00 -0.11 -4.69 120.51 115.68 1wmp n ALA 94 Ca -0.01 -0.97 0.12 0.00 0.00 0.00 0.00 53.44 52.58 1wmp n ALA 94 Cb 0.19 0.10 0.24 0.00 0.00 0.00 0.00 19.45 19.98 1wmp n ALA 94 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1wmp n THR 95 N -4.32 0.11 0.00 0.00 -2.24 -0.36 -4.91 114.28 102.55 1wmp n THR 95 Ca -0.37 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 60.94 1wmp n THR 95 Cb 0.72 1.07 0.00 0.00 -2.10 0.00 0.00 70.33 70.03 1wmp n THR 95 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wmp n GLY 96 N 1.32 2.25 3.85 3.38 0.00 0.78 -4.34 105.19 112.44 1wmp n GLY 96 Ca 0.16 -1.89 -0.31 0.00 0.00 0.00 0.00 46.02 43.99 1wmp n GLY 96 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wmp s GLU 97 N -3.09 3.29 0.66 1.61 0.41 -0.16 -4.27 118.70 117.15 1wmp s GLU 97 Ca 0.00 0.78 -0.11 0.00 -0.41 0.00 0.00 54.97 55.24 1wmp s GLU 97 Cb 0.00 -2.04 -0.00 0.00 -1.78 0.00 0.00 34.13 30.30 1wmp s GLU 97 CO 0.00 -0.80 1.05 -0.51 -0.49 0.00 0.00 175.26 174.51 1wmp s LEU 98 N -5.33 3.05 0.74 1.80 1.43 -1.26 -3.94 118.68 115.18 1wmp s LEU 98 Ca 0.56 1.18 -0.16 0.00 -1.03 0.00 0.00 54.13 54.68 1wmp s LEU 98 Cb -0.12 -4.06 -0.02 0.00 0.03 0.00 0.00 46.19 42.03 1wmp s LEU 98 CO 0.54 -1.15 0.65 -2.65 0.23 0.00 0.00 176.35 173.96 1wmp n PRO 99 N -2.87 0.29 -2.42 1.29 -0.02 -1.26 -4.80 135.00 125.21 1wmp n PRO 99 Ca 0.06 0.15 -0.41 0.00 -2.02 0.00 0.00 63.50 61.28 1wmp n PRO 99 Cb 0.56 -1.94 -0.04 0.00 -0.02 0.00 0.00 33.50 32.06 1wmp n PRO 99 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1wmp s VAL 100 N -1.94 3.53 0.23 -1.45 1.01 -0.38 -4.92 120.40 116.49 1wmp s VAL 100 Ca 0.67 1.39 -0.18 0.00 0.00 0.00 0.00 61.98 63.86 1wmp s VAL 100 Cb -0.34 -3.89 -0.08 0.00 0.00 0.00 0.00 36.38 32.07 1wmp s VAL 100 CO 0.57 0.27 0.71 -0.76 0.00 0.00 0.00 175.10 175.89 1wmp s LEU 101 N -0.78 4.31 0.42 3.92 1.43 -1.26 -4.86 118.68 121.85 1wmp s LEU 101 Ca 0.49 1.36 0.09 0.00 -1.03 0.00 0.00 54.13 55.04 1wmp s LEU 101 Cb -0.32 -3.62 0.88 0.00 0.03 0.00 0.00 46.19 43.16 1wmp s LEU 101 CO 0.39 0.01 2.02 -0.08 0.23 0.00 0.00 176.35 178.92 1wmp h GLU 102 N 3.28 0.38 0.00 1.70 4.81 -1.96 -1.34 114.58 121.44 1wmp h GLU 102 Ca -0.48 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 58.66 1wmp h GLU 102 Cb 1.19 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.49 1wmp h GLU 102 CO 0.65 0.32 -0.23 1.05 -0.73 0.00 0.00 179.01 180.07 1wmp h GLU 103 N 0.38 0.00 -0.18 1.92 4.11 -2.01 -2.93 114.58 115.87 1wmp h GLU 103 Ca 0.10 0.00 -0.20 0.00 0.07 0.00 0.00 59.36 59.32 1wmp h GLU 103 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1wmp h GLU 103 CO -0.01 0.23 -0.69 0.93 0.07 0.00 0.00 179.01 179.55 1wmp h GLU 104 N 0.00 0.73 -0.94 1.06 5.08 -1.64 -2.96 114.58 115.91 1wmp h GLU 104 Ca -0.00 -0.55 0.11 0.00 -1.00 0.00 0.00 59.36 57.92 1wmp h GLU 104 Cb 0.58 0.10 -0.07 0.00 0.50 0.00 0.00 28.75 29.85 1wmp h GLU 104 CO 0.03 1.16 0.60 0.74 -1.00 0.00 0.00 179.01 180.55 1wmp h PHE 105 N 0.52 1.03 -0.46 4.33 0.04 -1.42 -1.93 116.94 119.06 1wmp h PHE 105 Ca -0.03 0.03 -0.04 0.00 2.80 0.00 0.00 57.97 60.74 1wmp h PHE 105 Cb 1.29 -0.33 -0.02 0.00 2.20 0.00 0.00 35.95 39.09 1wmp h PHE 105 CO 0.07 0.45 0.14 0.93 -0.60 0.00 0.00 178.31 179.30 1wmp h GLU 106 N 0.93 0.72 -0.17 1.51 5.08 -1.55 -3.03 114.58 118.08 1wmp h GLU 106 Ca 0.45 -0.16 0.05 0.00 -1.00 0.00 0.00 59.36 58.70 1wmp h GLU 106 Cb 0.45 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 1wmp h GLU 106 CO -0.21 0.69 0.14 -0.39 -1.00 0.00 0.00 179.01 178.24 1wmp h VAL 107 N 0.61 0.70 0.44 3.13 -1.51 -1.19 -2.98 116.25 115.46 1wmp h VAL 107 Ca 0.15 0.00 -0.02 0.00 -1.23 0.00 0.00 66.70 65.60 1wmp h VAL 107 Cb 0.27 0.89 0.00 0.00 -2.13 0.00 0.00 31.29 30.33 1wmp h VAL 107 CO -0.00 0.00 -0.21 0.58 -1.23 0.00 0.00 177.57 176.70 1wmp h VAL 108 N 0.00 0.57 -0.46 7.19 2.07 -1.46 -0.15 116.25 124.01 1wmp h VAL 108 Ca 0.08 -0.03 -0.05 0.00 0.82 0.00 0.00 66.70 67.52 1wmp h VAL 108 Cb 0.36 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 1wmp h VAL 108 CO -0.00 0.01 0.07 -0.08 0.02 0.00 0.00 177.57 177.58 1wmp h GLU 109 N -0.61 0.71 -0.31 1.57 4.81 -1.68 -2.31 114.58 116.77 1wmp h GLU 109 Ca -0.06 -0.15 -0.07 0.00 -0.13 0.00 0.00 59.36 58.95 1wmp h GLU 109 Cb 0.46 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 1wmp h GLU 109 CO 0.10 0.68 -0.08 1.96 -0.73 0.00 0.00 179.01 180.93 1wmp h GLN 110 N 0.68 0.61 0.14 1.92 4.20 -1.44 -2.71 115.11 118.51 1wmp h GLN 110 Ca 0.15 -0.24 -0.01 0.00 0.06 0.00 0.00 58.65 58.61 1wmp h GLN 110 Cb 0.32 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.07 1wmp h GLN 110 CO 0.00 0.80 -0.07 -0.07 -0.67 0.00 0.00 178.83 178.83 1wmp h LEU 111 N 0.38 -0.16 -1.49 1.46 3.38 -0.89 -3.04 115.31 114.96 1wmp h LEU 111 Ca 0.08 -0.16 0.14 0.00 0.09 0.00 0.00 57.88 58.02 1wmp h LEU 111 Cb 0.58 0.04 -0.05 0.00 0.09 0.00 0.00 40.66 41.31 1wmp h LEU 111 CO 0.03 0.07 0.51 -0.07 0.09 0.00 0.00 178.44 179.08 1wmp h LEU 112 N -0.39 0.49 -2.13 1.67 3.38 -1.47 -1.27 115.31 115.58 1wmp h LEU 112 Ca -0.02 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1wmp h LEU 112 Cb 0.31 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1wmp h LEU 112 CO 0.03 0.26 0.06 0.00 0.09 0.00 0.00 178.44 178.88 1wmp h ALA 113 N 1.63 1.05 -0.15 1.53 0.00 -1.36 -0.66 119.26 121.31 1wmp h ALA 113 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1wmp h ALA 113 Cb 0.73 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1wmp h ALA 113 CO -0.14 -0.05 0.00 0.25 0.00 0.00 0.00 179.25 179.31 1wmp n THR 114 N -2.67 0.74 -3.25 0.00 -2.24 -0.49 -4.91 114.28 101.47 1wmp n THR 114 Ca -0.02 -0.87 -0.39 0.00 -2.27 0.00 0.00 64.05 60.50 1wmp n THR 114 Cb 0.11 0.67 -0.07 0.00 -2.10 0.00 0.00 70.33 68.93 1wmp n THR 114 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1wmp s ASP 115 N -0.88 6.51 0.25 3.42 -1.08 -0.25 -4.97 116.67 119.67 1wmp s ASP 115 Ca 0.12 0.61 -0.03 0.00 -0.52 0.00 0.00 52.55 52.73 1wmp s ASP 115 Cb 0.07 -2.29 0.47 0.00 -1.46 0.00 0.00 42.92 39.71 1wmp s ASP 115 CO 0.09 -0.22 1.78 -0.33 0.52 0.00 0.00 175.17 177.01 1wmp h GLU 116 N 7.66 0.66 -0.35 4.34 4.39 -1.93 0.31 114.58 129.66 1wmp h GLU 116 Ca -0.32 -0.04 -0.00 0.00 0.34 0.00 0.00 59.36 59.34 1wmp h GLU 116 Cb 1.15 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 29.63 1wmp h GLU 116 CO 0.73 0.44 0.21 0.00 -1.16 0.00 0.00 179.01 179.23 1wmp h ARG 117 N 0.68 0.47 -0.28 2.33 3.08 -1.94 0.11 114.38 118.83 1wmp h ARG 117 Ca 0.43 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.42 1wmp h ARG 117 Cb 0.53 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 1wmp h ARG 117 CO -0.31 0.35 0.09 2.35 -1.07 0.00 0.00 179.97 181.37 1wmp h TRP 118 N 0.46 0.46 -0.50 3.04 2.91 -1.64 -1.72 115.95 118.95 1wmp h TRP 118 Ca 0.13 -0.05 -0.04 0.00 1.13 0.00 0.00 58.89 60.06 1wmp h TRP 118 Cb -0.00 -0.13 -0.02 0.00 -0.51 0.00 0.00 29.16 28.49 1wmp h TRP 118 CO -0.04 0.49 0.16 -0.07 -1.03 0.00 0.00 178.44 177.95 1wmp h LEU 119 N 0.30 0.67 -0.39 0.65 3.38 -0.74 -1.44 115.31 117.73 1wmp h LEU 119 Ca 0.09 -0.09 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 1wmp h LEU 119 Cb 0.24 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1wmp h LEU 119 CO -0.00 0.63 -0.16 0.11 0.09 0.00 0.00 178.44 179.11 1wmp h LYS 120 N 0.72 0.80 -0.56 1.13 1.57 -0.59 0.13 116.57 119.77 1wmp h LYS 120 Ca 0.17 -0.34 0.01 0.00 -1.87 0.00 0.00 60.65 58.62 1wmp h LYS 120 Cb 0.20 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.45 1wmp h LYS 120 CO -0.01 0.96 0.37 0.00 -0.57 0.00 0.00 179.45 180.20 1wmp h ALA 121 N 0.82 0.71 -0.44 3.86 0.00 -0.91 -0.91 119.26 122.38 1wmp h ALA 121 Ca 0.09 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 1wmp h ALA 121 Cb 0.70 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1wmp h ALA 121 CO 0.05 0.14 -0.12 -0.07 0.00 0.00 0.00 179.25 179.25 1wmp h LEU 122 N 0.75 0.87 -0.52 0.00 3.38 -1.10 -2.94 115.31 115.74 1wmp h LEU 122 Ca 0.21 -0.37 0.03 0.00 0.09 0.00 0.00 57.88 57.84 1wmp h LEU 122 Cb -0.08 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.40 1wmp h LEU 122 CO -0.05 1.03 0.30 0.00 0.09 0.00 0.00 178.44 179.81 1wmp h ALA 123 N 0.86 0.67 -0.01 1.53 0.00 -0.40 0.60 119.26 122.50 1wmp h ALA 123 Ca 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1wmp h ALA 123 Cb 0.66 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1wmp h ALA 123 CO 0.05 -0.01 0.01 0.00 0.00 0.00 0.00 179.25 179.30 1wmp h ALA 124 N 1.25 1.91 -0.09 0.00 0.00 -1.10 0.88 119.26 122.10 1wmp h ALA 124 Ca 0.22 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1wmp h ALA 124 Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1wmp h ALA 124 CO -0.11 -0.02 0.00 0.54 0.00 0.00 0.00 179.25 179.66 1wmp n ARG 125 N -4.38 2.08 -3.60 0.00 1.74 -0.40 -4.95 116.66 107.15 1wmp n ARG 125 Ca -0.03 -1.58 -0.23 0.00 -0.77 0.00 0.00 57.85 55.24 1wmp n ARG 125 Cb 0.10 -1.47 0.08 0.00 -1.02 0.00 0.00 32.46 30.15 1wmp n ARG 125 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1wmp n ASN 126 N 0.88 -5.54 -4.42 0.55 3.02 0.30 -4.98 115.26 105.07 1wmp n ASN 126 Ca 0.17 -0.57 -0.35 0.00 -0.03 0.00 0.00 54.58 53.79 1wmp n ASN 126 Cb 0.49 -4.95 -0.13 0.00 -0.61 0.00 0.00 39.78 34.58 1wmp n ASN 126 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1wmp s LEU 127 N -7.16 3.16 -0.13 3.41 1.43 -0.18 -5.01 118.68 114.19 1wmp s LEU 127 Ca 0.50 -0.24 -0.29 0.00 -1.03 0.00 0.00 54.13 53.06 1wmp s LEU 127 Cb -0.22 -1.80 -0.03 0.00 0.03 0.00 0.00 46.19 44.17 1wmp s LEU 127 CO 0.74 0.06 1.46 -0.62 0.23 0.00 0.00 176.35 178.22 1wmp s ASP 128 N 1.03 6.76 0.55 2.29 2.15 -1.26 -4.41 116.67 123.79 1wmp s ASP 128 Ca 0.01 1.89 0.31 0.00 0.43 0.00 0.00 52.55 55.19 1wmp s ASP 128 Cb -0.14 -2.54 1.47 0.00 -0.30 0.00 0.00 42.92 41.41 1wmp s ASP 128 CO 0.01 -0.89 1.87 1.62 -0.17 0.00 0.00 175.17 177.61 1wmp h VAL 129 N 5.61 0.48 0.00 1.11 3.04 -1.95 0.19 116.25 124.73 1wmp h VAL 129 Ca -0.32 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.37 1wmp h VAL 129 Cb 1.14 0.55 0.00 0.00 -2.01 0.00 0.00 31.29 30.97 1wmp h VAL 129 CO 0.97 0.00 0.00 0.77 -1.01 0.00 0.00 177.57 178.30 1wmp h SER 130 N 0.00 0.00 -0.06 3.17 4.64 -1.99 -2.80 113.55 116.51 1wmp h SER 130 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 1wmp h SER 130 Cb 1.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.69 1wmp h SER 130 CO -0.00 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.25 1wmp n LYS 131 N -2.30 1.74 -3.35 4.77 5.02 0.66 -4.91 118.16 119.80 1wmp n LYS 131 Ca 0.03 -1.70 -0.43 0.00 -2.02 0.00 0.00 58.31 54.19 1wmp n LYS 131 Cb 0.29 -1.38 -0.09 0.00 -0.02 0.00 0.00 35.03 33.84 1wmp n LYS 131 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1wmp s VAL 132 N -1.57 5.12 0.26 -0.18 1.01 -1.06 -0.45 120.40 123.52 1wmp s VAL 132 Ca 0.24 -0.38 -0.20 0.00 0.00 0.00 0.00 61.98 61.64 1wmp s VAL 132 Cb 0.16 -4.01 -0.09 0.00 0.00 0.00 0.00 36.38 32.45 1wmp s VAL 132 CO 0.24 -0.39 0.76 -0.13 0.00 0.00 0.00 175.10 175.58 1wmp s ARG 133 N 2.06 4.25 -0.18 2.72 1.81 0.14 -4.89 118.95 124.87 1wmp s ARG 133 Ca 0.11 0.90 0.01 0.00 -1.72 0.00 0.00 55.73 55.03 1wmp s ARG 133 Cb -0.17 -2.77 0.01 0.00 -0.45 0.00 0.00 34.95 31.57 1wmp s ARG 133 CO 0.13 0.33 -0.18 0.08 -0.68 0.00 0.00 175.30 174.98 1wmp s VAL 134 N -1.63 2.27 -0.41 3.52 1.01 -1.26 -0.75 120.40 123.15 1wmp s VAL 134 Ca 0.46 -0.88 -0.27 0.00 0.00 0.00 0.00 61.98 61.30 1wmp s VAL 134 Cb -0.16 -1.96 0.02 0.00 0.00 0.00 0.00 36.38 34.29 1wmp s VAL 134 CO 0.20 0.53 1.00 0.00 0.00 0.00 0.00 175.10 176.83 1wmp s ALA 135 N 1.19 3.31 -0.31 5.51 0.00 0.29 -4.79 121.76 126.96 1wmp s ALA 135 Ca 0.02 -0.50 -0.28 0.00 0.00 0.00 0.00 51.96 51.20 1wmp s ALA 135 Cb -0.14 -3.67 0.01 0.00 0.00 0.00 0.00 23.12 19.32 1wmp s ALA 135 CO -0.09 -1.88 1.01 -2.14 0.00 0.00 0.00 175.76 172.66 1wmp s PRO 136 N 3.82 4.04 0.19 0.00 0.02 -1.26 -2.40 135.00 139.41 1wmp s PRO 136 Ca 0.41 0.96 0.11 0.00 0.02 0.00 0.00 61.00 62.50 1wmp s PRO 136 Cb -0.10 -3.73 -0.04 0.00 0.02 0.00 0.00 34.50 30.64 1wmp s PRO 136 CO 0.24 -0.85 -0.19 -0.51 -0.33 0.00 0.00 177.00 175.36 1wmp s LEU 137 N 3.48 2.60 0.84 -5.54 1.43 0.57 -4.95 118.68 117.11 1wmp s LEU 137 Ca 0.42 -0.78 -0.11 0.00 -1.03 0.00 0.00 54.13 52.64 1wmp s LEU 137 Cb -0.13 -1.32 0.10 0.00 0.03 0.00 0.00 46.19 44.87 1wmp s LEU 137 CO 0.14 0.12 1.10 -0.94 0.23 0.00 0.00 176.35 177.00 1wmp s SER 138 N -2.72 3.86 0.58 2.29 1.04 -1.26 -0.37 113.70 117.12 1wmp s SER 138 Ca 0.22 1.80 0.32 0.00 0.48 0.00 0.00 55.95 58.76 1wmp s SER 138 Cb -0.08 -2.44 1.36 0.00 0.10 0.00 0.00 66.02 64.96 1wmp s SER 138 CO 0.11 -2.44 1.68 0.00 0.98 0.00 0.00 173.24 173.57 1wmp h ALA 139 N -1.41 2.76 0.00 5.32 0.00 -1.92 -3.41 119.26 120.60 1wmp h ALA 139 Ca -0.45 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1wmp h ALA 139 Cb 1.25 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1wmp h ALA 139 CO 0.50 -1.32 0.00 0.41 0.00 0.00 0.00 179.25 178.84 1wmp n GLY 140 N -1.66 0.57 2.83 0.00 0.00 -1.26 -4.79 105.19 100.87 1wmp n GLY 140 Ca 0.19 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.03 1wmp n GLY 140 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1wmp n VAL 141 N 0.00 0.00 -3.72 1.61 0.24 -1.23 -4.49 118.33 110.74 1wmp n VAL 141 Ca 0.00 -2.09 -0.26 0.00 -2.04 0.00 0.00 64.34 59.95 1wmp n VAL 141 Cb 0.00 0.94 -0.17 0.00 -1.47 0.00 0.00 33.84 33.14 1wmp n VAL 141 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 1wmp s PHE 142 N -3.07 0.81 0.00 6.34 5.36 -1.26 -4.86 117.98 121.30 1wmp s PHE 142 Ca 0.28 -0.60 0.00 0.00 -0.96 0.00 0.00 56.93 55.66 1wmp s PHE 142 Cb 0.01 -0.92 0.00 0.00 -0.34 0.00 0.00 43.02 41.78 1wmp s PHE 142 CO 0.20 -0.52 0.00 -0.85 -1.46 0.00 0.00 175.22 172.59 1wmp n GLU 143 N 5.11 0.00 -0.80 10.12 0.28 -1.26 -4.97 120.64 129.12 1wmp n GLU 143 Ca -0.08 0.00 -0.32 0.00 -0.16 0.00 0.00 57.16 56.60 1wmp n GLU 143 Cb 0.48 0.00 -0.08 0.00 1.43 0.00 0.00 31.44 33.27 1wmp n GLU 143 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 1wmp n TYR 144 N -1.39 0.56 -0.20 -1.84 0.53 -1.26 -4.81 117.16 108.76 1wmp n TYR 144 Ca 0.00 0.38 -0.04 0.00 -1.02 0.00 0.00 57.90 57.21 1wmp n TYR 144 Cb 0.00 -1.39 0.06 0.00 -1.03 0.00 0.00 39.34 36.98 1wmp n TYR 144 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1wmp h ALA 145 N 6.04 0.77 -0.45 -0.72 0.00 -2.04 -2.35 119.26 120.51 1wmp h ALA 145 Ca -0.05 -0.01 0.13 0.00 0.00 0.00 0.00 54.91 54.99 1wmp h ALA 145 Cb 0.83 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 1wmp h ALA 145 CO 0.72 0.06 0.64 1.05 0.00 0.00 0.00 179.25 181.73 1wmp h GLU 146 N 0.68 0.00 -2.04 0.00 4.11 -2.06 -1.95 114.58 113.32 1wmp h GLU 146 Ca 0.24 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 59.55 1wmp h GLU 146 Cb 0.06 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.26 1wmp h GLU 146 CO -0.12 0.00 -0.24 0.39 0.07 0.00 0.00 179.01 179.11 1wmp n GLU 147 N -3.37 1.62 -1.52 1.06 1.02 -0.88 -4.88 120.64 113.69 1wmp n GLU 147 Ca 0.09 -0.67 -0.26 0.00 -0.02 0.00 0.00 57.16 56.29 1wmp n GLU 147 Cb 0.82 -1.70 -0.15 0.00 -0.02 0.00 0.00 31.44 30.38 1wmp n GLU 147 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1wmp n ARG 148 N 2.24 0.25 -3.16 3.49 0.63 -0.74 -2.35 116.66 117.01 1wmp n ARG 148 Ca 0.29 -0.19 -0.15 0.00 -0.92 0.00 0.00 57.85 56.88 1wmp n ARG 148 Cb 0.76 -2.00 -0.02 0.00 0.45 0.00 0.00 32.46 31.65 1wmp n ARG 148 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1wmp n GLY 149 N 6.08 -0.47 3.84 5.14 0.00 -1.26 -4.89 105.19 113.63 1wmp n GLY 149 Ca 0.59 0.03 -0.36 0.00 0.00 0.00 0.00 46.02 46.28 1wmp n GLY 149 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wmp s ARG 150 N -5.74 3.96 -0.65 1.61 0.52 -0.99 -4.90 118.95 112.76 1wmp s ARG 150 Ca 0.28 0.46 -0.24 0.00 -0.52 0.00 0.00 55.73 55.70 1wmp s ARG 150 Cb -0.16 -3.04 0.05 0.00 0.52 0.00 0.00 34.95 32.32 1wmp s ARG 150 CO 0.34 0.56 1.04 0.50 0.02 0.00 0.00 175.30 177.76 1wmp s ARG 151 N -1.67 3.21 0.18 3.54 3.52 -1.26 -5.00 118.95 121.47 1wmp s ARG 151 Ca 0.33 -0.49 0.10 0.00 -0.13 0.00 0.00 55.73 55.55 1wmp s ARG 151 Cb -0.16 -4.16 -0.04 0.00 -1.56 0.00 0.00 34.95 29.03 1wmp s ARG 151 CO 0.18 -1.80 -0.18 0.42 -0.81 0.00 0.00 175.30 173.11 1wmp s ILE 152 N 4.48 2.73 0.04 4.11 1.01 -1.26 -1.77 121.20 130.53 1wmp s ILE 152 Ca 0.28 -1.85 0.03 0.00 0.00 0.00 0.00 60.65 59.12 1wmp s ILE 152 Cb -0.13 -2.33 -0.02 0.00 0.01 0.00 0.00 42.46 39.99 1wmp s ILE 152 CO 0.14 -0.10 -0.10 -0.76 0.00 0.00 0.00 174.94 174.12 1wmp s LEU 153 N -2.71 2.20 0.10 2.97 1.43 -0.46 -4.00 118.68 118.21 1wmp s LEU 153 Ca 0.22 -0.47 0.04 0.00 -1.03 0.00 0.00 54.13 52.90 1wmp s LEU 153 Cb -0.08 -0.37 -0.04 0.00 0.03 0.00 0.00 46.19 45.73 1wmp s LEU 153 CO 0.12 -0.07 0.05 -0.13 0.23 0.00 0.00 176.35 176.54 1wmp s ARG 154 N -1.26 2.71 -0.06 1.70 0.52 0.50 -0.81 118.95 122.25 1wmp s ARG 154 Ca -0.04 -0.81 0.04 0.00 -0.52 0.00 0.00 55.73 54.40 1wmp s ARG 154 Cb -0.08 -2.61 0.00 0.00 0.52 0.00 0.00 34.95 32.78 1wmp s ARG 154 CO 0.01 0.53 -0.17 0.20 0.02 0.00 0.00 175.30 175.89 1wmp s GLY 155 N -2.50 0.96 -0.06 -3.53 0.00 0.18 -0.32 107.32 102.05 1wmp s GLY 155 Ca 0.28 -0.67 0.05 0.00 0.00 0.00 0.00 44.72 44.38 1wmp s GLY 155 CO 0.20 -0.23 -0.21 1.08 0.00 0.00 0.00 173.10 173.95 1wmp s LEU 156 N 0.24 2.34 0.08 0.66 1.43 -1.01 -2.45 118.68 119.98 1wmp s LEU 156 Ca -0.09 -0.39 -0.13 0.00 -1.03 0.00 0.00 54.13 52.50 1wmp s LEU 156 Cb -0.14 -1.45 -0.06 0.00 0.03 0.00 0.00 46.19 44.57 1wmp s LEU 156 CO 0.04 0.28 0.46 0.00 0.23 0.00 0.00 176.35 177.35 1wmp s ALA 157 N -0.33 3.67 -0.01 4.21 0.00 -1.26 -0.55 121.76 127.48 1wmp s ALA 157 Ca 0.02 -0.25 -0.00 0.00 0.00 0.00 0.00 51.96 51.73 1wmp s ALA 157 Cb -0.13 -2.39 0.01 0.00 0.00 0.00 0.00 23.12 20.62 1wmp s ALA 157 CO 0.02 0.51 0.03 -0.06 0.00 0.00 0.00 175.76 176.25 1wmp s PHE 158 N -1.34 -0.01 -0.14 0.00 0.08 0.07 -1.06 117.98 115.59 1wmp s PHE 158 Ca 0.32 0.09 -0.18 0.00 0.12 0.00 0.00 56.93 57.29 1wmp s PHE 158 Cb -0.15 -0.09 -0.04 0.00 -0.57 0.00 0.00 43.02 42.17 1wmp s PHE 158 CO 0.17 -0.05 0.46 0.08 -0.10 0.00 0.00 175.22 175.79 1wmp s VAL 159 N 0.46 5.19 -0.39 -0.44 1.01 -0.29 0.29 120.40 126.23 1wmp s VAL 159 Ca -0.04 0.90 -0.02 0.00 0.00 0.00 0.00 61.98 62.82 1wmp s VAL 159 Cb -0.05 -3.80 0.10 0.00 0.00 0.00 0.00 36.38 32.63 1wmp s VAL 159 CO -0.01 0.30 0.16 -1.58 0.00 0.00 0.00 175.10 173.97 1wmp s GLN 160 N 0.83 2.04 0.32 2.72 0.74 0.40 -4.24 119.66 122.47 1wmp s GLN 160 Ca 0.24 -1.73 0.02 0.00 0.05 0.00 0.00 55.36 53.95 1wmp s GLN 160 Cb -0.15 -3.49 0.60 0.00 1.10 0.00 0.00 33.01 31.07 1wmp s GLN 160 CO 0.09 -0.99 1.92 -0.44 -0.55 0.00 0.00 175.29 175.33 1wmp h ASP 161 N 8.01 0.83 -5.21 6.67 3.32 -1.90 -3.44 116.42 124.70 1wmp h ASP 161 Ca -0.14 0.01 -0.09 0.00 0.02 0.00 0.00 57.03 56.83 1wmp h ASP 161 Cb 1.05 -0.17 -0.13 0.00 0.22 0.00 0.00 39.33 40.30 1wmp h ASP 161 CO 0.66 0.53 -0.29 0.72 -1.72 0.00 0.00 179.24 179.14 1wmp s PHE 162 N -5.83 0.25 0.31 4.55 -0.71 -1.26 -5.04 117.98 110.25 1wmp s PHE 162 Ca -0.11 -0.62 0.06 0.00 -1.04 0.00 0.00 56.93 55.22 1wmp s PHE 162 Cb 0.20 0.00 0.87 0.00 -1.21 0.00 0.00 43.02 42.88 1wmp s PHE 162 CO 0.79 -0.69 1.61 -1.00 -1.34 0.00 0.00 175.22 174.59 1wmp h PRO 163 N 2.55 0.11 -0.57 1.99 0.13 -2.02 0.51 132.00 134.71 1wmp h PRO 163 Ca -0.32 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 1wmp h PRO 163 Cb 1.23 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1wmp h PRO 163 CO 0.49 0.08 0.00 0.39 -0.23 0.00 0.00 178.00 178.73 1wmp n GLU 164 N -5.30 2.59 -2.92 0.86 1.02 -1.26 -4.95 120.64 110.68 1wmp n GLU 164 Ca 0.26 -1.96 -0.35 0.00 -0.02 0.00 0.00 57.16 55.10 1wmp n GLU 164 Cb 0.84 -1.56 -0.07 0.00 -0.02 0.00 0.00 31.44 30.64 1wmp n GLU 164 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1wmp s ASP 165 N -0.89 7.04 -0.68 1.62 2.15 0.17 -5.01 116.67 121.07 1wmp s ASP 165 Ca 0.36 1.60 -0.21 0.00 0.43 0.00 0.00 52.55 54.73 1wmp s ASP 165 Cb 0.21 -2.50 0.09 0.00 -0.30 0.00 0.00 42.92 40.42 1wmp s ASP 165 CO 0.21 -0.18 0.90 -0.55 -0.17 0.00 0.00 175.17 175.38 1wmp s SER 166 N -1.95 6.24 0.56 -0.34 0.15 -1.26 -4.88 113.70 112.22 1wmp s SER 166 Ca 0.54 -1.28 0.25 0.00 0.70 0.00 0.00 55.95 56.16 1wmp s SER 166 Cb -0.13 -2.38 1.55 0.00 -1.71 0.00 0.00 66.02 63.35 1wmp s SER 166 CO 0.18 -1.29 2.11 0.00 1.20 0.00 0.00 173.24 175.45 1wmp h ALA 167 N 9.34 1.95 -0.09 5.45 0.00 -1.95 -2.34 119.26 131.62 1wmp h ALA 167 Ca -0.23 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.70 1wmp h ALA 167 Cb 1.07 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 1wmp h ALA 167 CO 1.14 -0.27 0.20 -1.49 0.00 0.00 0.00 179.25 178.84 1wmp h TRP 168 N 0.00 0.00 0.00 0.00 4.06 -1.91 0.26 115.95 118.37 1wmp h TRP 168 Ca 0.09 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.04 1wmp h TRP 168 Cb 0.43 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.59 1wmp h TRP 168 CO 0.00 0.00 0.00 0.00 -3.56 0.00 0.00 178.44 174.88 1wmp n ALA 169 N -2.13 2.15 -3.12 1.49 0.00 -0.88 -4.17 120.51 113.86 1wmp n ALA 169 Ca -0.00 -0.04 -0.25 0.00 0.00 0.00 0.00 53.44 53.14 1wmp n ALA 169 Cb 0.29 -1.43 -0.05 0.00 0.00 0.00 0.00 19.45 18.25 1wmp n ALA 169 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1wmp n HIS 170 N -1.88 2.94 -2.24 0.00 8.25 0.92 -4.48 115.22 118.72 1wmp n HIS 170 Ca 0.05 -3.97 -0.37 0.00 -0.26 0.00 0.00 57.72 53.18 1wmp n HIS 170 Cb 0.34 -0.48 -0.01 0.00 1.12 0.00 0.00 29.99 30.96 1wmp n HIS 170 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1wmp s PRO 171 N -2.88 3.67 -0.83 -0.41 0.04 -1.26 -1.14 135.00 132.20 1wmp s PRO 171 Ca 0.44 1.76 -0.07 0.00 0.04 0.00 0.00 61.00 63.18 1wmp s PRO 171 Cb 0.25 -2.34 0.21 0.00 0.04 0.00 0.00 34.50 32.66 1wmp s PRO 171 CO -0.10 -0.62 0.72 0.08 0.04 0.00 0.00 177.00 177.13 1wmp s VAL 172 N -1.57 4.76 0.97 -0.36 1.01 -0.22 -4.32 120.40 120.67 1wmp s VAL 172 Ca 0.65 -3.15 -0.12 0.00 0.00 0.00 0.00 61.98 59.36 1wmp s VAL 172 Cb -0.28 -3.96 0.17 0.00 0.00 0.00 0.00 36.38 32.31 1wmp s VAL 172 CO 0.34 -1.02 1.10 -0.62 0.00 0.00 0.00 175.10 174.90 1wmp s ASP 173 N 0.95 2.89 -0.21 3.32 -1.08 -1.26 -3.90 116.67 117.38 1wmp s ASP 173 Ca 0.22 1.14 0.00 0.00 -0.52 0.00 0.00 52.55 53.39 1wmp s ASP 173 Cb -0.12 -1.78 0.00 0.00 -1.46 0.00 0.00 42.92 39.55 1wmp s ASP 173 CO -0.08 -2.96 0.00 0.61 0.52 0.00 0.00 175.17 173.26 1wmp n GLY 174 N -1.39 0.42 2.83 2.66 0.00 -1.26 -4.32 105.19 104.14 1wmp n GLY 174 Ca 0.06 -0.10 -0.14 0.00 0.00 0.00 0.00 46.02 45.83 1wmp n GLY 174 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1wmp s LEU 175 N -0.46 1.50 -0.14 0.99 2.96 -1.25 -0.39 118.68 121.89 1wmp s LEU 175 Ca 0.00 0.00 -0.26 0.00 -0.22 0.00 0.00 54.13 53.66 1wmp s LEU 175 Cb 0.00 -0.09 0.06 0.00 0.50 0.00 0.00 46.19 46.67 1wmp s LEU 175 CO 0.00 -0.06 0.63 0.54 -1.32 0.00 0.00 176.35 176.14 1wmp s VAL 176 N 0.58 0.01 0.08 1.68 0.11 -0.44 -4.57 120.40 117.84 1wmp s VAL 176 Ca -0.05 -0.05 0.04 0.00 -2.93 0.00 0.00 61.98 58.99 1wmp s VAL 176 Cb -0.08 -0.92 -0.03 0.00 -1.53 0.00 0.00 36.38 33.82 1wmp s VAL 176 CO -0.01 -0.03 -0.11 0.00 -3.33 0.00 0.00 175.10 171.62 1wmp s ALA 177 N -0.49 1.05 -0.05 1.54 0.00 -1.03 0.07 121.76 122.85 1wmp s ALA 177 Ca -0.06 -1.05 0.05 0.00 0.00 0.00 0.00 51.96 50.90 1wmp s ALA 177 Cb -0.03 -0.01 -0.02 0.00 0.00 0.00 0.00 23.12 23.06 1wmp s ALA 177 CO 0.05 0.04 -0.20 0.71 0.00 0.00 0.00 175.76 176.36 1wmp s TYR 178 N -1.85 2.54 -0.01 0.00 2.02 0.10 -0.65 117.35 119.50 1wmp s TYR 178 Ca 0.00 -0.38 0.02 0.00 -0.37 0.00 0.00 57.07 56.35 1wmp s TYR 178 Cb -0.07 -1.59 -0.01 0.00 -0.40 0.00 0.00 41.96 39.90 1wmp s TYR 178 CO 0.01 0.02 -0.07 0.14 -1.57 0.00 0.00 175.55 174.07 1wmp s VAL 179 N -0.53 0.57 -0.57 0.71 -7.23 0.01 -1.89 120.40 111.48 1wmp s VAL 179 Ca 0.07 -0.31 -0.21 0.00 -1.81 0.00 0.00 61.98 59.72 1wmp s VAL 179 Cb -0.11 -0.48 0.07 0.00 0.56 0.00 0.00 36.38 36.41 1wmp s VAL 179 CO 0.01 0.16 0.80 -0.62 -0.31 0.00 0.00 175.10 175.14 1wmp s ASP 180 N -0.15 6.23 0.59 4.85 -1.08 0.06 -1.36 116.67 125.82 1wmp s ASP 180 Ca 0.02 -0.89 0.37 0.00 -0.52 0.00 0.00 52.55 51.54 1wmp s ASP 180 Cb -0.03 -2.36 1.80 0.00 -1.46 0.00 0.00 42.92 40.88 1wmp s ASP 180 CO -0.00 -1.14 2.15 -0.37 0.52 0.00 0.00 175.17 176.33 1wmp h VAL 181 N 5.94 0.07 0.03 1.11 -1.51 -1.65 0.17 116.25 120.41 1wmp h VAL 181 Ca -0.28 -0.32 -0.27 0.00 -1.23 0.00 0.00 66.70 64.61 1wmp h VAL 181 Cb 1.08 1.29 -0.03 0.00 -2.13 0.00 0.00 31.29 31.50 1wmp h VAL 181 CO 1.07 0.02 -1.45 -0.37 -1.23 0.00 0.00 177.57 175.60 1wmp h VAL 182 N 0.00 0.84 0.00 7.19 -1.51 -1.88 -3.34 116.25 117.55 1wmp h VAL 182 Ca -0.00 -2.22 0.00 0.00 -1.23 0.00 0.00 66.70 63.25 1wmp h VAL 182 Cb 0.29 2.29 0.00 0.00 -2.13 0.00 0.00 31.29 31.74 1wmp h VAL 182 CO 0.00 0.46 0.00 -1.54 -1.23 0.00 0.00 177.57 175.26 1wmp n SER 183 N -4.20 0.00 -3.58 4.19 3.41 -1.22 -4.89 113.62 107.33 1wmp n SER 183 Ca -0.32 0.28 -0.22 0.00 -0.26 0.00 0.00 58.87 58.34 1wmp n SER 183 Cb 0.78 -0.42 0.05 0.00 -0.26 0.00 0.00 64.21 64.35 1wmp n SER 183 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1wmp n LYS 184 N -1.42 -3.39 -3.88 4.33 5.02 0.55 -5.01 118.16 114.35 1wmp n LYS 184 Ca 0.09 0.64 -0.11 0.00 -2.02 0.00 0.00 58.31 56.91 1wmp n LYS 184 Cb 0.30 -5.08 -0.12 0.00 -0.02 0.00 0.00 35.03 30.12 1wmp n LYS 184 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1wmp s GLU 185 N -5.59 0.26 -0.52 1.97 -1.05 -1.01 -4.98 118.70 107.77 1wmp s GLU 185 Ca 0.23 -0.17 -0.27 0.00 -0.15 0.00 0.00 54.97 54.62 1wmp s GLU 185 Cb -0.06 0.11 0.03 0.00 -0.44 0.00 0.00 34.13 33.77 1wmp s GLU 185 CO 0.80 -0.05 1.05 0.08 0.95 0.00 0.00 175.26 178.09 1wmp s VAL 186 N -0.66 4.27 0.22 1.83 1.01 -1.26 -0.76 120.40 125.05 1wmp s VAL 186 Ca -0.07 0.75 0.09 0.00 0.00 0.00 0.00 61.98 62.75 1wmp s VAL 186 Cb -0.04 -4.58 -0.09 0.00 0.00 0.00 0.00 36.38 31.67 1wmp s VAL 186 CO 0.00 -1.09 1.50 0.71 0.00 0.00 0.00 175.10 176.22 1wmp h THR 187 N 6.12 1.53 -2.21 3.92 1.35 -1.74 -3.47 112.91 118.41 1wmp h THR 187 Ca -0.25 -2.53 -0.07 0.00 -0.55 0.00 0.00 66.41 63.01 1wmp h THR 187 Cb 1.07 2.37 -0.19 0.00 -1.73 0.00 0.00 68.15 69.66 1wmp h THR 187 CO 1.11 0.72 0.09 -0.13 -0.25 0.00 0.00 175.52 177.06 1wmp s ARG 188 N -3.33 0.96 -0.21 4.72 0.52 -1.18 -5.00 118.95 115.43 1wmp s ARG 188 Ca -0.01 0.23 -0.03 0.00 -0.52 0.00 0.00 55.73 55.40 1wmp s ARG 188 Cb 0.12 0.45 0.07 0.00 0.52 0.00 0.00 34.95 36.11 1wmp s ARG 188 CO 0.78 -0.28 0.07 0.08 0.02 0.00 0.00 175.30 175.97 1wmp s VAL 189 N -1.07 0.35 -0.24 3.52 1.01 -1.26 -0.73 120.40 121.97 1wmp s VAL 189 Ca -0.10 -0.59 -0.10 0.00 0.00 0.00 0.00 61.98 61.19 1wmp s VAL 189 Cb -0.01 -0.99 -0.05 0.00 0.00 0.00 0.00 36.38 35.33 1wmp s VAL 189 CO 0.08 -0.34 0.15 -0.63 0.00 0.00 0.00 175.10 174.36 1wmp s ILE 190 N 1.93 5.28 -0.34 2.22 1.01 0.11 -4.99 121.20 126.41 1wmp s ILE 190 Ca 0.02 0.15 0.02 0.00 0.00 0.00 0.00 60.65 60.84 1wmp s ILE 190 Cb -0.17 -3.47 0.10 0.00 0.01 0.00 0.00 42.46 38.94 1wmp s ILE 190 CO -0.14 0.34 0.09 -0.62 0.00 0.00 0.00 174.94 174.61 1wmp s ASP 191 N 1.13 4.41 0.00 3.58 -1.08 -1.26 -1.33 116.67 122.13 1wmp s ASP 191 Ca 0.07 -2.02 0.29 0.00 -0.52 0.00 0.00 52.55 50.37 1wmp s ASP 191 Cb -0.14 -1.31 1.40 0.00 -1.46 0.00 0.00 42.92 41.42 1wmp s ASP 191 CO 0.05 -0.38 1.94 0.35 0.52 0.00 0.00 175.17 177.65 1wmp n THR 192 N 4.40 0.01 0.00 1.71 -2.24 0.47 -4.98 114.28 113.65 1wmp n THR 192 Ca 0.02 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 1wmp n THR 192 Cb 0.41 0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.68 1wmp n THR 192 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wmp n GLY 193 N 1.08 4.36 3.73 3.38 0.00 -1.23 -5.03 105.19 111.48 1wmp n GLY 193 Ca 0.21 -1.44 -0.41 0.00 0.00 0.00 0.00 46.02 44.37 1wmp n GLY 193 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wmp s VAL 194 N -2.08 4.44 -0.02 1.61 1.01 -1.26 -4.25 120.40 119.85 1wmp s VAL 194 Ca 0.00 1.99 0.05 0.00 0.00 0.00 0.00 61.98 64.02 1wmp s VAL 194 Cb 0.00 -4.27 -0.01 0.00 0.00 0.00 0.00 36.38 32.10 1wmp s VAL 194 CO 0.00 0.29 -0.16 -0.36 0.00 0.00 0.00 175.10 174.86 1wmp s PHE 195 N 0.11 1.53 0.36 5.22 0.40 -1.26 -5.03 117.98 119.31 1wmp s PHE 195 Ca 0.48 -0.34 -0.28 0.00 -0.60 0.00 0.00 56.93 56.19 1wmp s PHE 195 Cb -0.24 -1.01 -0.11 0.00 0.51 0.00 0.00 43.02 42.17 1wmp s PHE 195 CO 0.30 -0.07 1.44 -2.30 0.70 0.00 0.00 175.22 175.29 1wmp n PRO 196 N 2.84 2.52 -2.88 0.24 -0.02 -1.26 -4.68 135.00 131.76 1wmp n PRO 196 Ca -0.16 0.88 -0.42 0.00 -2.02 0.00 0.00 63.50 61.79 1wmp n PRO 196 Cb 0.54 -2.58 -0.04 0.00 -0.02 0.00 0.00 33.50 31.40 1wmp n PRO 196 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1wmp s VAL 197 N -1.02 4.85 -0.09 -1.45 1.01 -1.26 -4.84 120.40 117.59 1wmp s VAL 197 Ca 0.55 1.63 -0.40 0.00 0.00 0.00 0.00 61.98 63.76 1wmp s VAL 197 Cb -0.51 -4.14 -0.18 0.00 0.00 0.00 0.00 36.38 31.56 1wmp s VAL 197 CO 0.62 -0.03 1.37 -2.65 0.00 0.00 0.00 175.10 174.42 1wmp n PRO 198 N 5.63 0.64 0.04 2.72 -0.02 -1.26 -4.89 135.00 137.85 1wmp n PRO 198 Ca 0.05 0.23 -0.19 0.00 -2.02 0.00 0.00 63.50 61.57 1wmp n PRO 198 Cb 0.48 -1.82 -0.12 0.00 -0.02 0.00 0.00 33.50 32.02 1wmp n PRO 198 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wmp h ALA 199 N 4.65 0.01 -2.98 3.55 0.00 -1.84 -3.41 119.26 119.25 1wmp h ALA 199 Ca -0.48 -0.65 -0.56 0.00 0.00 0.00 0.00 54.91 53.22 1wmp h ALA 199 Cb 1.37 0.07 0.14 0.00 0.00 0.00 0.00 17.79 19.37 1wmp h ALA 199 CO 0.80 0.44 0.54 0.39 0.00 0.00 0.00 179.25 181.43 1wmp n GLU 200 N -4.08 1.60 -2.89 0.00 1.02 -1.26 -5.00 120.64 110.01 1wmp n GLU 200 Ca -0.12 0.59 -0.25 0.00 -0.02 0.00 0.00 57.16 57.36 1wmp n GLU 200 Cb 0.79 -2.51 0.01 0.00 -0.02 0.00 0.00 31.44 29.71 1wmp n GLU 200 CO 0.00 0.00 0.00 -3.38 1.18 0.00 0.00 177.13 174.93 1wmp s HIS 201 N -1.31 3.34 -0.31 -0.32 -3.43 -1.26 -4.73 115.29 107.27 1wmp s HIS 201 Ca 0.72 0.43 0.11 0.00 -0.80 0.00 0.00 55.06 55.52 1wmp s HIS 201 Cb -0.42 -2.31 0.46 0.00 -1.43 0.00 0.00 32.58 28.88 1wmp s HIS 201 CO 0.49 -0.34 1.14 0.41 -2.00 0.00 0.00 174.74 174.45 1wmp n GLY 202 N -2.14 4.92 3.46 -1.38 0.00 -1.26 -5.00 105.19 103.78 1wmp n GLY 202 Ca 0.01 -2.22 -0.43 0.00 0.00 0.00 0.00 46.02 43.38 1wmp n GLY 202 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1wmp s ASN 203 N -3.60 6.29 0.00 1.61 0.01 -1.26 -4.78 114.94 113.20 1wmp s ASN 203 Ca 0.43 -1.23 0.16 0.00 -0.71 0.00 0.00 52.86 51.51 1wmp s ASN 203 Cb 0.39 -2.43 0.96 0.00 0.41 0.00 0.00 41.25 40.58 1wmp s ASN 203 CO -0.02 -1.38 1.37 0.00 -1.51 0.00 0.00 177.10 175.56 1wmp n TYR 204 N 7.58 0.00 0.43 2.20 0.18 -1.26 -1.99 117.16 124.29 1wmp n TYR 204 Ca 0.04 0.00 0.05 0.00 1.88 0.00 0.00 57.90 59.87 1wmp n TYR 204 Cb 0.47 0.00 0.04 0.00 -0.38 0.00 0.00 39.34 39.46 1wmp n TYR 204 CO 0.00 0.00 0.00 0.25 -2.08 0.00 0.00 176.86 175.03 1wmp n THR 205 N -0.97 0.00 -2.74 -3.48 -2.24 -1.26 -4.76 114.28 98.83 1wmp n THR 205 Ca 0.12 -0.49 -0.42 0.00 -2.27 0.00 0.00 64.05 60.99 1wmp n THR 205 Cb 0.06 1.20 -0.03 0.00 -2.10 0.00 0.00 70.33 69.46 1wmp n THR 205 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1wmp s ASP 206 N -0.92 7.06 0.43 3.42 -1.08 -0.84 -4.94 116.67 119.80 1wmp s ASP 206 Ca 0.11 1.32 0.20 0.00 -0.52 0.00 0.00 52.55 53.66 1wmp s ASP 206 Cb 0.08 -2.51 1.14 0.00 -1.46 0.00 0.00 42.92 40.17 1wmp s ASP 206 CO 0.14 -0.56 1.83 -0.65 0.52 0.00 0.00 175.17 176.46 1wmp h PRO 207 N 7.41 0.34 0.00 4.34 0.11 -1.89 1.00 132.00 143.31 1wmp h PRO 207 Ca -0.23 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.85 1wmp h PRO 207 Cb 1.09 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.12 1wmp h PRO 207 CO 0.92 0.23 -0.04 1.05 -0.21 0.00 0.00 178.00 179.95 1wmp h GLU 208 N 0.35 0.00 0.00 1.05 4.11 -1.92 0.45 114.58 118.63 1wmp h GLU 208 Ca 0.50 0.00 -0.38 0.00 0.07 0.00 0.00 59.36 59.56 1wmp h GLU 208 Cb 1.34 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.52 1wmp h GLU 208 CO -0.19 0.04 -2.42 -0.11 0.07 0.00 0.00 179.01 176.40 1wmp n LEU 209 N -3.32 2.77 0.09 3.06 7.94 0.24 -4.48 117.00 123.31 1wmp n LEU 209 Ca -0.02 -0.13 -0.04 0.00 -1.11 0.00 0.00 56.01 54.71 1wmp n LEU 209 Cb 0.17 -0.78 -0.02 0.00 0.53 0.00 0.00 43.42 43.32 1wmp n LEU 209 CO 0.25 0.89 0.27 0.71 -1.11 0.00 0.00 177.39 178.41 1wmp h THR 210 N 0.00 1.56 -0.61 1.96 1.35 -1.17 -3.50 112.91 112.49 1wmp h THR 210 Ca -0.56 -2.94 0.01 0.00 -0.55 0.00 0.00 66.41 62.37 1wmp h THR 210 Cb 1.89 2.61 -0.00 0.00 -1.73 0.00 0.00 68.15 70.92 1wmp h THR 210 CO -0.08 0.83 -0.02 0.61 -0.25 0.00 0.00 175.52 176.61 1wmp n GLY 211 N 1.03 -1.82 3.75 5.82 0.00 0.16 -4.72 105.19 109.40 1wmp n GLY 211 Ca -0.00 -1.32 -0.41 0.00 0.00 0.00 0.00 46.02 44.28 1wmp n GLY 211 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1wmp s PRO 212 N -0.18 4.20 0.37 1.61 0.02 -1.26 -4.87 135.00 134.90 1wmp s PRO 212 Ca 0.00 2.43 -0.26 0.00 0.02 0.00 0.00 61.00 63.19 1wmp s PRO 212 Cb 0.00 -3.07 -0.09 0.00 0.02 0.00 0.00 34.50 31.37 1wmp s PRO 212 CO 0.00 -0.51 1.13 -0.51 -0.33 0.00 0.00 177.00 176.78 1wmp s LEU 213 N -0.55 4.26 0.53 -5.54 1.02 -1.26 -4.98 118.68 112.16 1wmp s LEU 213 Ca 0.60 2.26 -0.22 0.00 0.02 0.00 0.00 54.13 56.79 1wmp s LEU 213 Cb -0.44 -3.98 -0.05 0.00 0.02 0.00 0.00 46.19 41.74 1wmp s LEU 213 CO 0.46 -0.52 1.38 -0.13 0.02 0.00 0.00 176.35 177.57 1wmp s ARG 214 N -2.17 3.21 0.00 1.70 0.52 -1.26 -4.92 118.95 116.04 1wmp s ARG 214 Ca 0.54 2.29 0.00 0.00 -0.52 0.00 0.00 55.73 58.04 1wmp s ARG 214 Cb -0.29 -2.32 0.00 0.00 0.52 0.00 0.00 34.95 32.86 1wmp s ARG 214 CO 0.36 -1.15 0.86 0.25 0.02 0.00 0.00 175.30 175.65 1wmp n THR 215 N -0.90 0.74 0.78 0.02 -2.24 -1.26 -4.74 114.28 106.69 1wmp n THR 215 Ca 0.10 -0.78 0.13 0.00 -2.27 0.00 0.00 64.05 61.22 1wmp n THR 215 Cb 0.44 0.64 0.34 0.00 -2.10 0.00 0.00 70.33 69.66 1wmp n THR 215 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1wmp n THR 216 N -0.37 0.24 -2.72 4.28 -2.24 -1.26 -4.84 114.28 107.37 1wmp n THR 216 Ca 0.00 -0.15 -0.43 0.00 -2.27 0.00 0.00 64.05 61.20 1wmp n THR 216 Cb 0.27 -0.22 -0.03 0.00 -2.10 0.00 0.00 70.33 68.25 1wmp n THR 216 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1wmp s GLN 217 N -3.08 3.74 0.44 -0.78 -0.21 -1.26 -5.02 119.66 113.49 1wmp s GLN 217 Ca 0.10 0.51 -0.18 0.00 0.02 0.00 0.00 55.36 55.81 1wmp s GLN 217 Cb 0.15 -3.86 -0.10 0.00 1.00 0.00 0.00 33.01 30.20 1wmp s GLN 217 CO 0.65 -1.16 0.92 0.15 -2.12 0.00 0.00 175.29 173.73 1wmp s LYS 218 N 3.90 4.10 0.52 2.91 -0.14 -1.26 -5.02 119.74 124.75 1wmp s LYS 218 Ca 0.42 0.98 -0.21 0.00 -1.36 0.00 0.00 55.97 55.80 1wmp s LYS 218 Cb -0.10 -2.21 -0.06 0.00 -1.68 0.00 0.00 37.83 33.78 1wmp s LYS 218 CO 0.25 -0.08 1.19 -1.25 -0.76 0.00 0.00 175.35 174.70 1wmp s PRO 219 N -3.44 3.43 -0.24 -1.68 0.04 -1.26 -5.02 135.00 126.82 1wmp s PRO 219 Ca 0.60 1.81 0.02 0.00 0.04 0.00 0.00 61.00 63.47 1wmp s PRO 219 Cb -0.09 -2.20 0.05 0.00 0.04 0.00 0.00 34.50 32.30 1wmp s PRO 219 CO 0.20 -0.83 -0.13 0.42 0.04 0.00 0.00 177.00 176.70 1wmp s ILE 220 N -1.58 2.17 -0.29 0.56 1.01 -1.26 -5.09 121.20 116.71 1wmp s ILE 220 Ca 0.70 -1.49 -0.15 0.00 0.00 0.00 0.00 60.65 59.71 1wmp s ILE 220 Cb -0.29 -2.21 -0.03 0.00 0.01 0.00 0.00 42.46 39.94 1wmp s ILE 220 CO 0.34 0.08 0.37 -0.55 0.00 0.00 0.00 174.94 175.19 1wmp s SER 221 N 1.14 6.23 -0.27 3.58 0.15 -1.26 -5.04 113.70 118.23 1wmp s SER 221 Ca -0.06 0.12 -0.00 0.00 0.70 0.00 0.00 55.95 56.70 1wmp s SER 221 Cb -0.19 -2.21 0.04 0.00 -1.71 0.00 0.00 66.02 61.96 1wmp s SER 221 CO -0.07 -0.24 -0.06 -0.63 1.20 0.00 0.00 173.24 173.45 1wmp s ILE 222 N 2.07 2.67 0.13 6.45 1.01 -1.26 -5.10 121.20 127.17 1wmp s ILE 222 Ca 0.14 -1.33 -0.00 0.00 0.00 0.00 0.00 60.65 59.45 1wmp s ILE 222 Cb -0.16 -2.47 -0.04 0.00 0.01 0.00 0.00 42.46 39.80 1wmp s ILE 222 CO 0.11 0.04 0.04 0.42 0.00 0.00 0.00 174.94 175.54 1wmp s THR 223 N 1.23 0.23 -0.38 2.92 -4.23 -1.26 -4.18 115.64 109.97 1wmp s THR 223 Ca -0.04 -1.92 0.01 0.00 -1.18 0.00 0.00 61.69 58.56 1wmp s THR 223 Cb -0.19 -2.03 0.13 0.00 1.34 0.00 0.00 72.50 71.75 1wmp s THR 223 CO -0.04 -0.50 0.19 -1.10 -0.54 0.00 0.00 174.62 172.63 1wmp s GLN 224 N -4.01 0.97 0.55 3.99 -0.21 -1.26 -4.97 119.66 114.72 1wmp s GLN 224 Ca 0.23 -1.59 0.28 0.00 0.02 0.00 0.00 55.36 54.29 1wmp s GLN 224 Cb 0.07 -2.04 1.45 0.00 1.00 0.00 0.00 33.01 33.50 1wmp s GLN 224 CO 0.01 -1.12 1.96 -1.00 -2.12 0.00 0.00 175.29 173.03 1wmp h PRO 225 N 7.20 0.00 -0.39 2.91 0.13 -2.04 -0.33 132.00 139.49 1wmp h PRO 225 Ca -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 1wmp h PRO 225 Cb 0.96 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.09 1wmp h PRO 225 CO 0.44 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.60 1wmp n GLU 226 N -4.16 3.13 0.00 0.86 1.02 -1.26 -5.09 120.64 115.14 1wmp n GLU 226 Ca 0.11 -2.56 0.00 0.00 -0.02 0.00 0.00 57.16 54.69 1wmp n GLU 226 Cb 0.67 -1.64 0.00 0.00 -0.02 0.00 0.00 31.44 30.45 1wmp n GLU 226 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1wmp n GLY 227 N 0.29 -1.33 3.78 0.62 0.00 -0.13 -4.96 105.19 103.45 1wmp n GLY 227 Ca 0.19 -1.54 -0.31 0.00 0.00 0.00 0.00 46.02 44.36 1wmp n GLY 227 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wmp s PRO 228 N -1.12 2.31 0.00 1.61 0.04 -1.26 -4.88 135.00 131.69 1wmp s PRO 228 Ca 0.00 1.06 0.26 0.00 0.04 0.00 0.00 61.00 62.35 1wmp s PRO 228 Cb 0.00 -1.91 0.61 0.00 0.04 0.00 0.00 34.50 33.24 1wmp s PRO 228 CO 0.00 -1.58 1.48 0.43 0.04 0.00 0.00 177.00 177.37 1wmp n SER 229 N -3.46 0.95 -4.90 6.66 7.64 -1.26 -4.89 113.62 114.35 1wmp n SER 229 Ca 0.08 -0.76 -0.23 0.00 1.01 0.00 0.00 58.87 58.97 1wmp n SER 229 Cb 0.53 0.22 -0.03 0.00 -1.01 0.00 0.00 64.21 63.92 1wmp n SER 229 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1wmp s PHE 230 N -2.65 3.32 0.07 1.43 -0.12 -1.26 -4.59 117.98 114.19 1wmp s PHE 230 Ca 0.20 -0.02 0.09 0.00 -0.05 0.00 0.00 56.93 57.15 1wmp s PHE 230 Cb 0.19 -1.54 -0.03 0.00 -0.63 0.00 0.00 43.02 41.01 1wmp s PHE 230 CO 0.58 0.49 -0.23 0.95 -0.05 0.00 0.00 175.22 176.96 1wmp s THR 231 N -1.94 1.86 -0.17 -4.49 -4.23 -0.30 -4.97 115.64 101.40 1wmp s THR 231 Ca 0.33 -1.42 0.01 0.00 -1.18 0.00 0.00 61.69 59.43 1wmp s THR 231 Cb -0.09 -1.64 0.02 0.00 1.34 0.00 0.00 72.50 72.13 1wmp s THR 231 CO 0.27 0.14 -0.17 -0.69 -0.54 0.00 0.00 174.62 173.63 1wmp s VAL 232 N -0.94 1.86 0.18 2.29 1.01 -1.26 -2.10 120.40 121.44 1wmp s VAL 232 Ca 0.09 -0.87 0.07 0.00 0.00 0.00 0.00 61.98 61.27 1wmp s VAL 232 Cb -0.10 -1.73 -0.04 0.00 0.00 0.00 0.00 36.38 34.51 1wmp s VAL 232 CO 0.03 0.46 -0.14 0.42 0.00 0.00 0.00 175.10 175.87 1wmp s THR 233 N 1.36 1.59 -2.05 3.92 -4.23 -0.19 -4.71 115.64 111.32 1wmp s THR 233 Ca 0.04 -2.11 0.00 0.00 -1.18 0.00 0.00 61.69 58.44 1wmp s THR 233 Cb -0.13 -1.93 0.00 0.00 1.34 0.00 0.00 72.50 71.77 1wmp s THR 233 CO -0.11 -0.59 0.00 0.61 -0.54 0.00 0.00 174.62 173.99 1wmp n GLY 234 N -0.20 1.08 4.12 3.99 0.00 -1.26 0.09 105.19 113.02 1wmp n GLY 234 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1wmp n GLY 234 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wmp n GLY 235 N -0.61 1.76 0.39 -0.02 0.00 -1.26 -4.42 105.19 101.03 1wmp n GLY 235 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1wmp n GLY 235 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1wmp n ASN 236 N 1.16 0.00 -4.62 1.61 6.94 -1.08 -5.00 115.26 114.28 1wmp n ASN 236 Ca 0.00 -1.59 -0.39 0.00 -0.02 0.00 0.00 54.58 52.58 1wmp n ASN 236 Cb 0.00 -0.12 -0.09 0.00 -2.36 0.00 0.00 39.78 37.21 1wmp n ASN 236 CO 0.00 0.00 0.00 -2.28 -1.03 0.00 0.00 177.26 173.95 1wmp s HIS 237 N 0.00 3.28 -0.07 -2.53 2.46 0.11 -1.26 115.29 117.28 1wmp s HIS 237 Ca 0.00 0.41 -0.00 0.00 0.47 0.00 0.00 55.06 55.94 1wmp s HIS 237 Cb 0.00 -2.51 -0.03 0.00 -0.13 0.00 0.00 32.58 29.90 1wmp s HIS 237 CO 0.00 -0.15 -0.04 0.42 -2.47 0.00 0.00 174.74 172.51 1wmp s ILE 238 N 1.77 3.97 -0.05 0.89 -1.09 0.81 -1.02 121.20 126.48 1wmp s ILE 238 Ca 0.14 -0.40 0.00 0.00 -2.23 0.00 0.00 60.65 58.17 1wmp s ILE 238 Cb -0.15 -2.65 0.02 0.00 -1.58 0.00 0.00 42.46 38.10 1wmp s ILE 238 CO 0.09 0.59 -0.02 -1.61 -1.23 0.00 0.00 174.94 172.75 1wmp s GLU 239 N -0.89 0.70 -0.27 2.79 2.02 -0.89 -1.48 118.70 120.68 1wmp s GLU 239 Ca 0.13 -0.01 -0.11 0.00 0.02 0.00 0.00 54.97 55.00 1wmp s GLU 239 Cb -0.11 -0.85 0.10 0.00 0.10 0.00 0.00 34.13 33.37 1wmp s GLU 239 CO 0.02 -0.17 0.60 -0.46 0.02 0.00 0.00 175.26 175.28 1wmp s TRP 240 N 1.30 -1.11 -1.36 1.61 -0.00 -0.41 -1.15 118.94 117.82 1wmp s TRP 240 Ca -0.05 2.05 -0.21 0.00 -0.00 0.00 0.00 56.10 57.89 1wmp s TRP 240 Cb -0.13 0.63 0.03 0.00 -0.00 0.00 0.00 33.47 33.99 1wmp s TRP 240 CO -0.02 -0.57 0.40 0.39 -0.00 0.00 0.00 176.95 177.15 1wmp n GLU 241 N 5.03 -0.51 0.00 5.86 -0.58 -1.26 0.42 120.64 129.59 1wmp n GLU 241 Ca -0.15 0.07 0.00 0.00 -0.42 0.00 0.00 57.16 56.66 1wmp n GLU 241 Cb 0.52 -2.92 0.00 0.00 -0.57 0.00 0.00 31.44 28.47 1wmp n GLU 241 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1wmp n LYS 242 N -4.89 0.00 -2.96 3.49 5.02 -1.26 -4.94 118.16 112.61 1wmp n LYS 242 Ca -0.20 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.76 1wmp n LYS 242 Cb 0.62 -0.98 -0.07 0.00 -0.02 0.00 0.00 35.03 34.59 1wmp n LYS 242 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1wmp s TRP 243 N -1.97 3.36 -0.07 2.13 0.52 0.17 0.48 118.94 123.54 1wmp s TRP 243 Ca 0.00 1.44 -0.04 0.00 0.02 0.00 0.00 56.10 57.52 1wmp s TRP 243 Cb 0.00 -2.71 0.03 0.00 -1.15 0.00 0.00 33.47 29.64 1wmp s TRP 243 CO 0.00 -0.00 0.18 0.45 0.02 0.00 0.00 176.95 177.60 1wmp s SER 244 N -2.19 -0.17 0.09 2.95 0.15 -0.28 -1.29 113.70 112.96 1wmp s SER 244 Ca 0.58 0.37 -0.27 0.00 0.70 0.00 0.00 55.95 57.33 1wmp s SER 244 Cb -0.10 0.29 0.08 0.00 -1.71 0.00 0.00 66.02 64.58 1wmp s SER 244 CO 0.15 -0.13 1.04 -1.48 1.20 0.00 0.00 173.24 174.02 1wmp s LEU 245 N 0.87 -0.16 -0.08 3.45 2.34 -0.55 -0.35 118.68 124.19 1wmp s LEU 245 Ca -0.06 -0.30 0.05 0.00 0.06 0.00 0.00 54.13 53.88 1wmp s LEU 245 Cb -0.08 1.95 -0.00 0.00 -0.56 0.00 0.00 46.19 47.49 1wmp s LEU 245 CO -0.05 -0.72 -0.24 -1.81 -1.06 0.00 0.00 176.35 172.47 1wmp s ASP 246 N -2.89 3.06 -0.46 1.48 1.01 0.06 -0.14 116.67 118.79 1wmp s ASP 246 Ca 0.12 -0.54 -0.16 0.00 0.71 0.00 0.00 52.55 52.68 1wmp s ASP 246 Cb 0.00 -1.18 0.06 0.00 1.01 0.00 0.00 42.92 42.80 1wmp s ASP 246 CO -0.00 0.19 0.41 0.68 0.21 0.00 0.00 175.17 176.65 1wmp s VAL 247 N 0.15 5.18 0.53 -1.27 -7.23 -0.39 -0.04 120.40 117.33 1wmp s VAL 247 Ca -0.13 -0.84 0.06 0.00 -1.81 0.00 0.00 61.98 59.25 1wmp s VAL 247 Cb -0.16 -4.10 0.05 0.00 0.56 0.00 0.00 36.38 32.73 1wmp s VAL 247 CO 0.07 -0.54 0.73 -0.83 -0.31 0.00 0.00 175.10 174.22 1wmp s GLY 248 N 2.35 1.84 -0.13 2.32 0.00 0.28 -4.81 107.32 109.16 1wmp s GLY 248 Ca 0.06 -1.74 -0.08 0.00 0.00 0.00 0.00 44.72 42.96 1wmp s GLY 248 CO 0.09 -1.41 0.32 -0.12 0.00 0.00 0.00 173.10 171.98 1wmp s PHE 249 N -2.62 -0.44 -0.02 1.90 5.36 -1.26 -0.95 117.98 119.95 1wmp s PHE 249 Ca 0.59 0.99 0.05 0.00 -0.96 0.00 0.00 56.93 57.60 1wmp s PHE 249 Cb -0.08 0.15 -0.01 0.00 -0.34 0.00 0.00 43.02 42.73 1wmp s PHE 249 CO 0.37 -0.27 -0.15 0.34 -1.46 0.00 0.00 175.22 174.05 1wmp s ASP 250 N 1.13 1.85 0.57 6.13 2.15 0.29 -4.89 116.67 123.90 1wmp s ASP 250 Ca -0.08 -0.29 0.26 0.00 0.43 0.00 0.00 52.55 52.88 1wmp s ASP 250 Cb -0.08 -0.30 1.62 0.00 -0.30 0.00 0.00 42.92 43.87 1wmp s ASP 250 CO -0.09 0.17 2.16 1.62 -0.17 0.00 0.00 175.17 178.87 1wmp h VAL 251 N 4.91 0.62 0.00 1.11 3.04 -1.86 0.54 116.25 124.62 1wmp h VAL 251 Ca -0.35 0.00 -0.17 0.00 -1.01 0.00 0.00 66.70 65.18 1wmp h VAL 251 Cb 1.16 0.93 -0.02 0.00 -2.01 0.00 0.00 31.29 31.34 1wmp h VAL 251 CO 0.48 0.00 -0.99 -0.09 -1.01 0.00 0.00 177.57 175.96 1wmp h ARG 252 N 0.00 0.00 0.00 4.17 2.43 -1.88 0.19 114.38 119.29 1wmp h ARG 252 Ca 0.05 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1wmp h ARG 252 Cb 0.24 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 1wmp h ARG 252 CO -0.00 0.80 -0.61 0.93 -1.51 0.00 0.00 179.97 179.58 1wmp h GLU 253 N -1.00 0.00 0.00 0.20 5.08 -1.84 -3.13 114.58 113.90 1wmp h GLU 253 Ca -0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 1wmp h GLU 253 Cb 1.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.36 1wmp h GLU 253 CO -0.15 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.27 1wmp n GLY 254 N 1.16 0.54 3.73 -3.84 0.00 0.19 -4.63 105.19 102.34 1wmp n GLY 254 Ca 0.02 -1.12 -0.42 0.00 0.00 0.00 0.00 46.02 44.50 1wmp n GLY 254 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wmp s VAL 255 N 0.00 3.30 -0.06 1.61 1.01 -1.26 -0.55 120.40 124.45 1wmp s VAL 255 Ca 0.00 1.01 0.02 0.00 0.00 0.00 0.00 61.98 63.01 1wmp s VAL 255 Cb 0.00 -3.65 0.01 0.00 0.00 0.00 0.00 36.38 32.75 1wmp s VAL 255 CO 0.00 0.12 -0.11 -0.69 0.00 0.00 0.00 175.10 174.42 1wmp s VAL 256 N 0.53 1.04 -0.15 2.92 1.01 -0.12 -4.65 120.40 120.97 1wmp s VAL 256 Ca 0.60 -0.42 -0.11 0.00 0.00 0.00 0.00 61.98 62.04 1wmp s VAL 256 Cb -0.36 -0.96 -0.05 0.00 0.00 0.00 0.00 36.38 35.01 1wmp s VAL 256 CO 0.35 0.33 0.21 -0.76 0.00 0.00 0.00 175.10 175.23 1wmp s LEU 257 N 0.71 4.28 0.08 3.92 1.43 -0.38 0.10 118.68 128.81 1wmp s LEU 257 Ca -0.14 0.44 0.09 0.00 -1.03 0.00 0.00 54.13 53.49 1wmp s LEU 257 Cb -0.16 -2.23 -0.03 0.00 0.03 0.00 0.00 46.19 43.80 1wmp s LEU 257 CO 0.03 0.21 -0.24 -1.00 0.23 0.00 0.00 176.35 175.58 1wmp s HIS 258 N 0.01 2.40 -1.40 0.29 3.76 0.94 -0.62 115.29 120.67 1wmp s HIS 258 Ca 0.14 -0.35 -0.02 0.00 -0.15 0.00 0.00 55.06 54.67 1wmp s HIS 258 Cb -0.12 -1.36 0.00 0.00 1.11 0.00 0.00 32.58 32.21 1wmp s HIS 258 CO 0.03 0.25 0.40 0.09 -0.85 0.00 0.00 174.74 174.66 1wmp n ASN 259 N 1.33 -0.57 -4.66 1.40 3.02 0.17 -0.76 115.26 115.19 1wmp n ASN 259 Ca -0.17 -1.04 -0.42 0.00 -0.03 0.00 0.00 54.58 52.91 1wmp n ASN 259 Cb 0.52 -2.88 -0.03 0.00 -0.61 0.00 0.00 39.78 36.78 1wmp n ASN 259 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1wmp s ILE 260 N -3.97 3.73 0.06 2.41 1.01 0.47 -4.11 121.20 120.81 1wmp s ILE 260 Ca 0.04 0.91 -0.01 0.00 0.00 0.00 0.00 60.65 61.59 1wmp s ILE 260 Cb -0.02 -3.58 -0.04 0.00 0.01 0.00 0.00 42.46 38.83 1wmp s ILE 260 CO 0.90 -0.08 -0.02 0.00 0.00 0.00 0.00 174.94 175.74 1wmp s ALA 261 N 3.82 0.57 -0.07 9.38 0.00 0.53 -1.35 121.76 134.64 1wmp s ALA 261 Ca 0.69 -1.24 0.02 0.00 0.00 0.00 0.00 51.96 51.42 1wmp s ALA 261 Cb -0.31 0.32 0.02 0.00 0.00 0.00 0.00 23.12 23.15 1wmp s ALA 261 CO 0.26 -0.38 -0.12 0.12 0.00 0.00 0.00 175.76 175.65 1wmp s PHE 262 N -3.92 1.48 -0.57 0.00 2.19 0.79 -1.12 117.98 116.83 1wmp s PHE 262 Ca 0.09 -0.58 -0.27 0.00 0.33 0.00 0.00 56.93 56.49 1wmp s PHE 262 Cb 0.08 -1.11 0.00 0.00 -1.31 0.00 0.00 43.02 40.69 1wmp s PHE 262 CO -0.09 -0.32 1.54 0.50 1.83 0.00 0.00 175.22 178.68 1wmp s ARG 263 N 0.84 3.14 -0.74 10.12 6.06 0.18 -0.90 118.95 137.64 1wmp s ARG 263 Ca -0.11 0.52 -0.07 0.00 -2.50 0.00 0.00 55.73 53.57 1wmp s ARG 263 Cb -0.15 -4.20 0.19 0.00 0.06 0.00 0.00 34.95 30.85 1wmp s ARG 263 CO 0.02 -2.13 0.61 0.34 -2.50 0.00 0.00 175.30 171.64 1wmp s ASP 264 N 5.36 5.90 1.31 -2.12 2.15 -0.01 -4.89 116.67 124.37 1wmp s ASP 264 Ca 0.57 -2.94 0.00 0.00 0.43 0.00 0.00 52.55 50.60 1wmp s ASP 264 Cb -0.12 -1.99 0.00 0.00 -0.30 0.00 0.00 42.92 40.51 1wmp s ASP 264 CO 0.24 -0.41 0.00 0.61 -0.17 0.00 0.00 175.17 175.44 1wmp n GLY 265 N 3.46 2.11 0.08 2.66 0.00 -1.26 -3.08 105.19 109.16 1wmp n GLY 265 Ca 0.12 -0.15 -0.06 0.00 0.00 0.00 0.00 46.02 45.93 1wmp n GLY 265 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1wmp h ASP 266 N 0.00 0.00 -3.13 1.61 3.04 -2.01 -3.47 116.42 112.47 1wmp h ASP 266 Ca 0.00 0.00 -0.65 0.00 -3.24 0.00 0.00 57.03 53.14 1wmp h ASP 266 Cb 0.00 0.00 -0.09 0.00 -1.04 0.00 0.00 39.33 38.20 1wmp h ASP 266 CO 0.00 0.93 -0.58 0.00 -2.04 0.00 0.00 179.24 177.55 1wmp s ARG 267 N -2.70 3.01 -0.51 4.15 1.70 -1.18 -5.07 118.95 118.36 1wmp s ARG 267 Ca -0.01 -0.56 -0.18 0.00 -0.47 0.00 0.00 55.73 54.51 1wmp s ARG 267 Cb 0.09 -2.82 0.07 0.00 -0.57 0.00 0.00 34.95 31.72 1wmp s ARG 267 CO 0.82 0.62 0.59 -1.17 -1.08 0.00 0.00 175.30 175.07 1wmp s LEU 268 N -2.00 5.19 -0.18 -1.89 1.98 -1.26 -0.83 118.68 119.70 1wmp s LEU 268 Ca 0.26 -1.10 -0.20 0.00 -2.89 0.00 0.00 54.13 50.20 1wmp s LEU 268 Cb -0.12 -2.37 -0.03 0.00 0.66 0.00 0.00 46.19 44.33 1wmp s LEU 268 CO 0.17 -0.88 0.58 -0.13 -1.89 0.00 0.00 176.35 174.20 1wmp s ARG 269 N 2.42 4.24 0.50 1.98 0.52 -0.08 -4.85 118.95 123.67 1wmp s ARG 269 Ca 0.12 0.54 -0.20 0.00 -0.52 0.00 0.00 55.73 55.67 1wmp s ARG 269 Cb -0.21 -3.55 -0.08 0.00 0.52 0.00 0.00 34.95 31.64 1wmp s ARG 269 CO 0.10 -0.14 1.08 -1.25 0.02 0.00 0.00 175.30 175.10 1wmp s PRO 270 N 1.58 3.68 0.12 3.54 0.04 -1.26 -0.15 135.00 142.56 1wmp s PRO 270 Ca 0.27 1.48 0.00 0.00 0.04 0.00 0.00 61.00 62.79 1wmp s PRO 270 Cb -0.16 -2.12 0.00 0.00 0.04 0.00 0.00 34.50 32.27 1wmp s PRO 270 CO 0.11 -0.55 0.00 -0.89 0.04 0.00 0.00 177.00 175.71 1wmp n ILE 271 N -0.98 0.49 -4.09 0.56 5.41 -0.45 -0.18 119.36 120.12 1wmp n ILE 271 Ca 0.10 0.16 -0.23 0.00 1.00 0.00 0.00 62.75 63.78 1wmp n ILE 271 Cb 0.52 -1.12 -0.17 0.00 -0.71 0.00 0.00 39.64 38.16 1wmp n ILE 271 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 1wmp s ILE 272 N -2.00 0.72 0.12 1.39 1.01 -1.10 -1.18 121.20 120.16 1wmp s ILE 272 Ca 0.00 -0.17 -0.10 0.00 0.00 0.00 0.00 60.65 60.38 1wmp s ILE 272 Cb 0.00 -0.75 -0.16 0.00 0.01 0.00 0.00 42.46 41.57 1wmp s ILE 272 CO 0.00 0.29 1.32 -1.13 0.00 0.00 0.00 174.94 175.42 1wmp h ASN 273 N 7.62 0.82 -3.15 3.58 -1.24 -0.58 0.14 115.58 122.76 1wmp h ASN 273 Ca -0.31 -0.56 -0.07 0.00 0.71 0.00 0.00 56.30 56.08 1wmp h ASN 273 Cb 1.15 -0.24 -0.24 0.00 0.73 0.00 0.00 38.32 39.71 1wmp h ASN 273 CO 0.41 1.35 -0.18 -0.60 -1.29 0.00 0.00 177.43 177.12 1wmp s ARG 274 N -3.64 0.51 -0.06 6.67 3.52 -1.12 -0.66 118.95 124.18 1wmp s ARG 274 Ca -0.09 0.95 0.03 0.00 -0.13 0.00 0.00 55.73 56.49 1wmp s ARG 274 Cb 0.09 0.04 0.01 0.00 -1.56 0.00 0.00 34.95 33.53 1wmp s ARG 274 CO 0.89 -0.15 -0.14 0.00 -0.81 0.00 0.00 175.30 175.08 1wmp s ALA 275 N 1.47 1.38 0.06 6.12 0.00 0.21 -0.59 121.76 130.42 1wmp s ALA 275 Ca -0.10 -0.52 -0.26 0.00 0.00 0.00 0.00 51.96 51.08 1wmp s ALA 275 Cb -0.07 -0.55 0.08 0.00 0.00 0.00 0.00 23.12 22.58 1wmp s ALA 275 CO -0.15 0.17 0.73 -1.54 0.00 0.00 0.00 175.76 174.97 1wmp s SER 276 N 0.44 -0.50 -0.84 0.00 1.04 -0.84 -1.25 113.70 111.76 1wmp s SER 276 Ca -0.12 0.10 -0.23 0.00 0.48 0.00 0.00 55.95 56.19 1wmp s SER 276 Cb -0.14 0.50 0.07 0.00 0.10 0.00 0.00 66.02 66.55 1wmp s SER 276 CO 0.04 -0.78 1.20 -0.63 0.98 0.00 0.00 173.24 174.05 1wmp s ILE 277 N -3.11 4.18 -0.02 -1.02 -1.09 -1.26 0.81 121.20 119.69 1wmp s ILE 277 Ca 0.01 -0.58 0.32 0.00 -2.23 0.00 0.00 60.65 58.17 1wmp s ILE 277 Cb -0.01 -4.86 0.36 0.00 -1.58 0.00 0.00 42.46 36.37 1wmp s ILE 277 CO -0.08 -1.69 1.93 0.00 -1.23 0.00 0.00 174.94 173.87 1wmp h ALA 278 N 9.56 1.00 -2.19 9.38 0.00 -1.34 -3.44 119.26 132.23 1wmp h ALA 278 Ca -0.05 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.88 1wmp h ALA 278 Cb 1.04 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.65 1wmp h ALA 278 CO 1.25 0.00 0.36 -2.00 0.00 0.00 0.00 179.25 178.86 1wmp s GLU 279 N -3.60 0.93 -0.12 0.00 2.56 -1.20 -4.60 118.70 112.66 1wmp s GLU 279 Ca 0.02 -0.07 -0.05 0.00 0.00 0.00 0.00 54.97 54.86 1wmp s GLU 279 Cb 0.09 0.44 0.06 0.00 2.00 0.00 0.00 34.13 36.72 1wmp s GLU 279 CO 0.49 -0.35 0.25 1.41 -0.56 0.00 0.00 175.26 176.50 1wmp s MET 280 N -2.23 0.15 -0.04 4.30 -2.45 -1.26 -0.85 119.30 116.92 1wmp s MET 280 Ca -0.02 0.69 0.06 0.00 -1.25 0.00 0.00 55.69 55.17 1wmp s MET 280 Cb -0.01 -0.07 -0.01 0.00 1.25 0.00 0.00 34.83 35.99 1wmp s MET 280 CO -0.02 -0.26 -0.22 0.54 1.05 0.00 0.00 175.02 176.11 1wmp s VAL 281 N 2.17 1.75 -0.55 10.11 0.11 0.71 -1.83 120.40 132.86 1wmp s VAL 281 Ca -0.01 -0.92 0.04 0.00 -2.93 0.00 0.00 61.98 58.16 1wmp s VAL 281 Cb -0.12 -1.47 0.14 0.00 -1.53 0.00 0.00 36.38 33.40 1wmp s VAL 281 CO -0.08 0.49 0.33 -0.69 -3.33 0.00 0.00 175.10 171.82 1wmp s VAL 282 N -0.25 2.39 0.03 2.04 1.01 0.11 -0.46 120.40 125.27 1wmp s VAL 282 Ca 0.01 -3.44 -0.23 0.00 0.00 0.00 0.00 61.98 58.32 1wmp s VAL 282 Cb -0.11 -2.63 -0.06 0.00 0.00 0.00 0.00 36.38 33.58 1wmp s VAL 282 CO 0.01 -0.89 0.69 -2.16 0.00 0.00 0.00 175.10 172.75 1wmp s PRO 283 N -0.51 4.42 -0.10 2.72 0.04 -1.20 -1.87 135.00 138.51 1wmp s PRO 283 Ca 0.20 0.92 -0.10 0.00 0.04 0.00 0.00 61.00 62.07 1wmp s PRO 283 Cb -0.18 -3.35 -0.05 0.00 0.04 0.00 0.00 34.50 30.96 1wmp s PRO 283 CO -0.05 0.34 0.21 0.71 0.04 0.00 0.00 177.00 178.25 1wmp s TYR 284 N -0.18 3.61 -0.41 0.56 1.51 -1.02 -1.26 117.35 120.16 1wmp s TYR 284 Ca 0.35 0.64 0.06 0.00 -1.01 0.00 0.00 57.07 57.10 1wmp s TYR 284 Cb -0.20 -2.06 0.65 0.00 -0.11 0.00 0.00 41.96 40.24 1wmp s TYR 284 CO 0.21 0.66 1.82 0.41 -1.11 0.00 0.00 175.55 177.53 1wmp n GLY 285 N 2.12 4.50 3.54 0.71 0.00 0.52 -4.90 105.19 111.67 1wmp n GLY 285 Ca -0.18 -1.11 -0.41 0.00 0.00 0.00 0.00 46.02 44.32 1wmp n GLY 285 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1wmp s ASP 286 N -1.52 6.20 0.00 1.61 2.15 -1.26 -4.80 116.67 119.06 1wmp s ASP 286 Ca 0.54 -0.27 0.12 0.00 0.43 0.00 0.00 52.55 53.37 1wmp s ASP 286 Cb 0.46 -2.21 0.64 0.00 -0.30 0.00 0.00 42.92 41.51 1wmp s ASP 286 CO 0.09 -0.40 1.28 -0.81 -0.17 0.00 0.00 175.17 175.15 1wmp n PRO 287 N 5.48 0.22 -1.73 4.34 -0.04 -1.26 -3.24 135.00 138.76 1wmp n PRO 287 Ca -0.08 0.14 -0.42 0.00 -0.04 0.00 0.00 63.50 63.09 1wmp n PRO 287 Cb 0.49 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.44 1wmp n PRO 287 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1wmp n SER 288 N -1.23 3.46 0.30 3.54 2.88 -1.26 -4.65 113.62 116.66 1wmp n SER 288 Ca 0.06 1.17 0.20 0.00 -1.33 0.00 0.00 58.87 58.97 1wmp n SER 288 Cb 0.09 -1.55 1.07 0.00 -0.75 0.00 0.00 64.21 63.07 1wmp n SER 288 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1wmp h PRO 289 N 4.06 0.00 0.00 -1.46 0.13 -1.99 0.44 132.00 133.19 1wmp h PRO 289 Ca -0.47 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.60 1wmp h PRO 289 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 1wmp h PRO 289 CO 0.74 0.00 -0.30 0.82 -0.23 0.00 0.00 178.00 179.03 1wmp h ILE 290 N 0.00 0.73 0.00 -3.56 1.08 -1.94 -3.38 117.51 110.45 1wmp h ILE 290 Ca 0.00 -1.31 0.00 0.00 -0.39 0.00 0.00 64.86 63.16 1wmp h ILE 290 Cb 0.02 1.84 0.00 0.00 -3.07 0.00 0.00 36.82 35.61 1wmp h ILE 290 CO 0.00 0.29 0.00 0.54 -0.69 0.00 0.00 178.15 178.29 1wmp n ARG 291 N -3.48 0.16 0.00 2.37 1.74 -0.40 -4.85 116.66 112.20 1wmp n ARG 291 Ca -0.00 -0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.04 1wmp n ARG 291 Cb 0.47 -0.41 0.00 0.00 -1.02 0.00 0.00 32.46 31.50 1wmp n ARG 291 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1wmp n SER 292 N -0.03 0.00 -0.00 0.55 3.41 0.14 -0.30 113.62 117.38 1wmp n SER 292 Ca 0.00 0.46 0.10 0.00 -0.26 0.00 0.00 58.87 59.18 1wmp n SER 292 Cb 0.16 -0.46 -0.10 0.00 -0.26 0.00 0.00 64.21 63.54 1wmp n SER 292 CO 0.00 0.00 0.00 -2.67 -0.16 0.00 0.00 175.04 172.21 1wmp n TRP 293 N -1.46 0.02 -1.76 7.33 4.27 -1.26 -4.96 117.44 119.61 1wmp n TRP 293 Ca 0.00 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.19 1wmp n TRP 293 Cb 0.00 -0.13 -0.03 0.00 -1.36 0.00 0.00 31.31 29.79 1wmp n TRP 293 CO 0.00 0.00 0.00 -1.14 -2.29 0.00 0.00 177.69 174.26 1wmp s GLN 294 N -3.11 3.75 -0.26 -2.67 0.74 0.58 -3.51 119.66 115.20 1wmp s GLN 294 Ca 0.05 2.22 -0.06 0.00 0.05 0.00 0.00 55.36 57.62 1wmp s GLN 294 Cb 0.16 -4.20 0.13 0.00 1.10 0.00 0.00 33.01 30.20 1wmp s GLN 294 CO 0.87 -1.38 0.53 -0.80 -0.55 0.00 0.00 175.29 173.95 1wmp s ASN 295 N 5.56 -0.72 -0.15 6.67 0.01 -1.26 -2.43 114.94 122.62 1wmp s ASN 295 Ca 0.88 1.04 -0.10 0.00 -0.71 0.00 0.00 52.86 53.97 1wmp s ASN 295 Cb -0.36 1.81 -0.05 0.00 0.41 0.00 0.00 41.25 43.07 1wmp s ASN 295 CO 0.36 -0.24 0.19 -0.31 -1.51 0.00 0.00 177.10 175.59 1wmp s TYR 296 N 2.75 3.50 -0.84 2.20 1.51 -0.78 -4.37 117.35 121.33 1wmp s TYR 296 Ca 0.04 0.49 0.01 0.00 -1.01 0.00 0.00 57.07 56.60 1wmp s TYR 296 Cb -0.13 -2.14 0.24 0.00 -0.11 0.00 0.00 41.96 39.81 1wmp s TYR 296 CO -0.17 0.44 0.85 1.19 -1.11 0.00 0.00 175.55 176.75 1wmp n PHE 297 N 2.95 3.65 -0.28 2.71 3.01 -1.26 0.05 117.46 128.30 1wmp n PHE 297 Ca -0.16 -3.92 0.09 0.00 1.01 0.00 0.00 57.45 54.47 1wmp n PHE 297 Cb 0.53 -0.94 0.23 0.00 -0.01 0.00 0.00 39.48 39.30 1wmp n PHE 297 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 1wmp h ASP 298 N 5.33 -0.04 0.12 4.37 5.19 -1.75 0.39 116.42 130.03 1wmp h ASP 298 Ca 0.18 0.18 -0.01 0.00 -0.62 0.00 0.00 57.03 56.76 1wmp h ASP 298 Cb 0.73 0.25 0.00 0.00 0.18 0.00 0.00 39.33 40.49 1wmp h ASP 298 CO 0.91 -0.11 -0.06 0.74 -3.12 0.00 0.00 179.24 177.60 1wmp h THR 299 N 0.22 0.94 -0.25 0.35 2.02 -1.85 0.91 112.91 115.25 1wmp h THR 299 Ca 0.49 -1.27 -0.16 0.00 0.77 0.00 0.00 66.41 66.24 1wmp h THR 299 Cb 0.92 1.61 0.00 0.00 -1.74 0.00 0.00 68.15 68.93 1wmp h THR 299 CO -0.61 0.26 -0.45 1.23 0.37 0.00 0.00 175.52 176.32 1wmp h GLY 300 N -0.87 0.82 0.49 2.16 0.00 -1.75 -2.82 103.07 101.10 1wmp h GLY 300 Ca -0.02 -0.95 -0.36 0.00 0.00 0.00 0.00 47.33 46.01 1wmp h GLY 300 CO 0.03 0.85 -2.08 1.18 0.00 0.00 0.00 176.54 176.51 1wmp n GLU 301 N -4.14 0.70 -0.10 4.80 1.02 0.13 -4.62 120.64 118.43 1wmp n GLU 301 Ca -0.05 0.22 -0.10 0.00 -0.02 0.00 0.00 57.16 57.21 1wmp n GLU 301 Cb 0.57 -1.67 -0.16 0.00 -0.02 0.00 0.00 31.44 30.16 1wmp n GLU 301 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1wmp n TYR 302 N -3.26 0.05 -1.70 -0.32 4.02 -1.14 -1.24 117.16 113.55 1wmp n TYR 302 Ca -0.32 0.02 -0.00 0.00 -0.01 0.00 0.00 57.90 57.59 1wmp n TYR 302 Cb 1.05 -1.01 0.00 0.00 -0.02 0.00 0.00 39.34 39.36 1wmp n TYR 302 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1wmp n LEU 303 N -2.77 -3.01 0.24 7.72 4.77 0.30 -4.82 117.00 119.44 1wmp n LEU 303 Ca -0.32 0.23 0.10 0.00 -0.03 0.00 0.00 56.01 55.99 1wmp n LEU 303 Cb 1.15 -1.39 0.66 0.00 -2.33 0.00 0.00 43.42 41.51 1wmp n LEU 303 CO 0.43 -0.53 1.08 -0.37 -1.33 0.00 0.00 177.39 176.67 1wmp h VAL 304 N 0.50 0.95 -0.17 4.08 -1.51 -1.47 -2.08 116.25 116.55 1wmp h VAL 304 Ca 0.00 0.00 -0.07 0.00 -1.23 0.00 0.00 66.70 65.40 1wmp h VAL 304 Cb 0.01 0.97 -0.01 0.00 -2.13 0.00 0.00 31.29 30.13 1wmp h VAL 304 CO 0.02 0.00 -0.20 1.23 -1.23 0.00 0.00 177.57 177.39 1wmp h GLY 305 N 0.00 0.31 1.75 5.19 0.00 -0.77 -2.90 103.07 106.65 1wmp h GLY 305 Ca 0.02 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.12 1wmp h GLY 305 CO -0.00 0.20 0.09 -1.61 0.00 0.00 0.00 176.54 175.22 1wmp h GLN 306 N 0.27 0.32 -0.47 4.80 4.15 -0.76 -2.85 115.11 120.57 1wmp h GLN 306 Ca 0.05 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.41 1wmp h GLN 306 Cb 0.51 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 28.12 1wmp h GLN 306 CO 0.03 0.28 0.02 0.66 -1.93 0.00 0.00 178.83 177.90 1wmp n TYR 307 N -4.43 1.70 -1.74 3.99 4.01 -1.10 -5.00 117.16 114.59 1wmp n TYR 307 Ca 0.00 -0.85 -0.42 0.00 -0.16 0.00 0.00 57.90 56.48 1wmp n TYR 307 Cb 0.13 -0.46 -0.01 0.00 -0.31 0.00 0.00 39.34 38.68 1wmp n TYR 307 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1wmp n ALA 308 N 0.10 2.10 -2.06 -0.72 0.00 -1.08 -2.68 120.51 116.18 1wmp n ALA 308 Ca 0.27 0.36 -0.31 0.00 0.00 0.00 0.00 53.44 53.76 1wmp n ALA 308 Cb 1.11 -2.39 -0.04 0.00 0.00 0.00 0.00 19.45 18.13 1wmp n ALA 308 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1wmp s ASN 309 N 0.13 6.59 -0.31 0.00 0.01 0.18 -4.94 114.94 116.60 1wmp s ASN 309 Ca 0.59 1.31 -0.27 0.00 -0.71 0.00 0.00 52.86 53.78 1wmp s ASN 309 Cb -0.52 -2.40 0.01 0.00 0.41 0.00 0.00 41.25 38.75 1wmp s ASN 309 CO 0.56 -0.44 0.96 -0.44 -1.51 0.00 0.00 177.10 176.23 1wmp s SER 310 N -3.01 6.83 -0.21 -1.22 0.01 -1.26 -4.27 113.70 110.58 1wmp s SER 310 Ca 0.54 0.90 -0.29 0.00 1.31 0.00 0.00 55.95 58.42 1wmp s SER 310 Cb -0.10 -2.49 0.01 0.00 0.21 0.00 0.00 66.02 63.64 1wmp s SER 310 CO 0.29 -0.77 1.02 -0.76 0.41 0.00 0.00 173.24 173.43 1wmp s LEU 311 N 3.37 4.12 -0.01 2.44 1.43 0.07 -4.99 118.68 125.12 1wmp s LEU 311 Ca 0.40 1.39 -0.30 0.00 -1.03 0.00 0.00 54.13 54.59 1wmp s LEU 311 Cb -0.13 -3.53 -0.03 0.00 0.03 0.00 0.00 46.19 42.53 1wmp s LEU 311 CO 0.14 -0.63 1.01 -1.61 0.23 0.00 0.00 176.35 175.49 1wmp s GLU 312 N 2.99 4.52 0.11 1.70 0.41 -1.26 -4.89 118.70 122.28 1wmp s GLU 312 Ca 0.44 1.46 -0.31 0.00 -0.41 0.00 0.00 54.97 56.15 1wmp s GLU 312 Cb -0.16 -3.46 -0.08 0.00 -1.78 0.00 0.00 34.13 28.66 1wmp s GLU 312 CO 0.08 -0.12 1.35 -1.17 -0.49 0.00 0.00 175.26 174.91 1wmp s LEU 313 N 1.19 4.37 0.00 1.80 2.96 -1.26 -1.45 118.68 126.29 1wmp s LEU 313 Ca 0.52 2.28 0.00 0.00 -0.22 0.00 0.00 54.13 56.71 1wmp s LEU 313 Cb -0.22 -3.59 0.00 0.00 0.50 0.00 0.00 46.19 42.89 1wmp s LEU 313 CO 0.27 -0.61 0.00 0.61 -1.32 0.00 0.00 176.35 175.29 1wmp n GLY 314 N 3.36 0.86 1.17 7.98 0.00 -0.48 -4.83 105.19 113.25 1wmp n GLY 314 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1wmp n GLY 314 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wmp h ASP 316 N 0.00 0.63 -3.22 0.00 3.32 -1.57 -3.45 116.42 112.13 1wmp h ASP 316 Ca 0.00 -0.93 -0.54 0.00 0.02 0.00 0.00 57.03 55.58 1wmp h ASP 316 Cb 0.00 -0.21 -0.37 0.00 0.22 0.00 0.00 39.33 38.97 1wmp h ASP 316 CO 0.00 1.74 -0.80 0.00 -1.72 0.00 0.00 179.24 178.45 1wmp s LEU 318 N 1.66 3.70 0.00 0.00 2.96 -1.26 -1.38 118.68 124.36 1wmp s LEU 318 Ca 0.04 0.13 0.00 0.00 -0.22 0.00 0.00 54.13 54.08 1wmp s LEU 318 Cb -0.13 -1.99 0.00 0.00 0.50 0.00 0.00 46.19 44.56 1wmp s LEU 318 CO -0.08 0.33 0.00 0.61 -1.32 0.00 0.00 176.35 175.89 1wmp n GLY 319 N 1.71 -0.77 3.48 7.98 0.00 -1.26 -4.83 105.19 111.51 1wmp n GLY 319 Ca -0.16 -2.07 -0.43 0.00 0.00 0.00 0.00 46.02 43.36 1wmp n GLY 319 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1wmp s ASP 320 N -4.00 6.28 -0.11 1.61 -1.08 -1.26 -4.95 116.67 113.16 1wmp s ASP 320 Ca 0.00 -1.11 -0.05 0.00 -0.52 0.00 0.00 52.55 50.87 1wmp s ASP 320 Cb 0.00 -2.46 -0.04 0.00 -1.46 0.00 0.00 42.92 38.96 1wmp s ASP 320 CO 0.00 -1.47 0.08 -0.63 0.52 0.00 0.00 175.17 173.67 1wmp s ILE 321 N 4.27 4.95 -0.18 4.11 1.09 -1.26 -4.66 121.20 129.51 1wmp s ILE 321 Ca 0.29 -0.00 -0.02 0.00 -1.10 0.00 0.00 60.65 59.82 1wmp s ILE 321 Cb -0.11 -3.13 -0.01 0.00 -1.06 0.00 0.00 42.46 38.15 1wmp s ILE 321 CO 0.06 0.61 -0.08 -0.89 -0.10 0.00 0.00 174.94 174.53 1wmp s THR 322 N -0.93 3.19 0.22 2.92 2.01 -0.18 -4.97 115.64 117.90 1wmp s THR 322 Ca 0.14 -0.58 0.05 0.00 0.31 0.00 0.00 61.69 61.61 1wmp s THR 322 Cb -0.12 -2.41 -0.03 0.00 0.01 0.00 0.00 72.50 69.95 1wmp s THR 322 CO 0.03 0.47 0.31 -0.31 -0.69 0.00 0.00 174.62 174.43 1wmp s TYR 323 N 1.03 3.39 -0.04 4.92 2.02 -1.26 -1.41 117.35 125.99 1wmp s TYR 323 Ca -0.00 -0.01 0.03 0.00 -0.37 0.00 0.00 57.07 56.72 1wmp s TYR 323 Cb -0.15 -1.56 0.00 0.00 -0.40 0.00 0.00 41.96 39.86 1wmp s TYR 323 CO -0.01 0.47 -0.12 -0.51 -1.57 0.00 0.00 175.55 173.81 1wmp s LEU 324 N -3.76 1.78 -0.62 -1.29 1.43 -0.78 -5.01 118.68 110.43 1wmp s LEU 324 Ca 0.34 -0.26 0.02 0.00 -1.03 0.00 0.00 54.13 53.20 1wmp s LEU 324 Cb -0.09 -0.73 0.15 0.00 0.03 0.00 0.00 46.19 45.55 1wmp s LEU 324 CO 0.28 0.08 0.40 -0.44 0.23 0.00 0.00 176.35 176.90 1wmp s SER 325 N 0.26 4.81 0.69 2.29 0.01 -1.26 -2.16 113.70 118.34 1wmp s SER 325 Ca -0.06 -3.18 -0.15 0.00 1.31 0.00 0.00 55.95 53.87 1wmp s SER 325 Cb -0.11 -1.72 0.02 0.00 0.21 0.00 0.00 66.02 64.41 1wmp s SER 325 CO 0.02 -0.24 1.17 -2.16 0.41 0.00 0.00 173.24 172.43 1wmp s PRO 326 N -0.53 2.47 -0.05 12.44 0.04 -1.25 -4.62 135.00 143.51 1wmp s PRO 326 Ca 0.19 1.62 0.04 0.00 0.04 0.00 0.00 61.00 62.89 1wmp s PRO 326 Cb -0.19 -1.89 -0.02 0.00 0.04 0.00 0.00 34.50 32.44 1wmp s PRO 326 CO -0.05 -1.55 -0.16 0.08 0.04 0.00 0.00 177.00 175.36 1wmp s VAL 327 N -2.08 2.90 0.34 -0.36 1.01 -1.26 -0.94 120.40 120.00 1wmp s VAL 327 Ca 0.72 -0.78 0.04 0.00 0.00 0.00 0.00 61.98 61.95 1wmp s VAL 327 Cb -0.26 -2.13 -0.06 0.00 0.00 0.00 0.00 36.38 33.94 1wmp s VAL 327 CO 0.42 0.58 0.07 0.27 0.00 0.00 0.00 175.10 176.45 1wmp s ILE 328 N -0.60 1.07 0.07 2.22 -4.36 0.02 -4.88 121.20 114.74 1wmp s ILE 328 Ca 0.09 -2.00 -0.01 0.00 -0.26 0.00 0.00 60.65 58.47 1wmp s ILE 328 Cb -0.11 -2.70 -0.04 0.00 1.25 0.00 0.00 42.46 40.86 1wmp s ILE 328 CO 0.01 0.00 0.23 -0.55 0.24 0.00 0.00 174.94 174.87 1wmp s SER 329 N -3.51 6.37 0.58 4.36 0.15 -1.26 0.34 113.70 120.72 1wmp s SER 329 Ca 0.34 0.31 0.02 0.00 0.70 0.00 0.00 55.95 57.31 1wmp s SER 329 Cb 0.07 -1.98 0.10 0.00 -1.71 0.00 0.00 66.02 62.51 1wmp s SER 329 CO 0.15 0.16 0.69 -0.90 1.20 0.00 0.00 173.24 174.54 1wmp n ASP 330 N 0.30 1.18 0.03 5.45 3.85 -0.45 -4.87 116.55 122.02 1wmp n ASP 330 Ca -0.05 -1.94 0.02 0.00 -0.71 0.00 0.00 54.79 52.12 1wmp n ASP 330 Cb 0.51 -0.43 0.12 0.00 -1.35 0.00 0.00 41.12 39.97 1wmp n ASP 330 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1wmp n ALA 331 N -2.80 1.07 0.12 2.12 0.00 -1.26 -2.15 120.51 117.60 1wmp n ALA 331 Ca -0.12 0.03 0.04 0.00 0.00 0.00 0.00 53.44 53.39 1wmp n ALA 331 Cb 0.44 -1.07 0.07 0.00 0.00 0.00 0.00 19.45 18.89 1wmp n ALA 331 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1wmp n PHE 332 N -1.62 0.15 -0.36 0.00 3.72 -1.26 -0.35 117.46 117.74 1wmp n PHE 332 Ca 0.00 -0.23 0.00 0.00 -0.05 0.00 0.00 57.45 57.17 1wmp n PHE 332 Cb 0.02 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 38.55 1wmp n PHE 332 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1wmp n GLY 333 N 0.32 0.73 3.75 1.37 0.00 -0.92 -4.97 105.19 105.47 1wmp n GLY 333 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 1wmp n GLY 333 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1wmp s ASN 334 N -2.64 7.24 0.27 1.61 0.01 -1.26 -4.41 114.94 115.75 1wmp s ASN 334 Ca 0.00 1.48 -0.29 0.00 -0.71 0.00 0.00 52.86 53.33 1wmp s ASN 334 Cb 0.00 -2.47 -0.09 0.00 0.41 0.00 0.00 41.25 39.09 1wmp s ASN 334 CO 0.00 0.04 1.18 -2.16 -1.51 0.00 0.00 177.10 174.65 1wmp s PRO 335 N -0.19 4.53 -0.11 -0.60 0.04 -1.26 -1.35 135.00 136.06 1wmp s PRO 335 Ca 0.38 1.94 0.00 0.00 0.04 0.00 0.00 61.00 63.36 1wmp s PRO 335 Cb -0.21 -3.17 0.02 0.00 0.04 0.00 0.00 34.50 31.18 1wmp s PRO 335 CO 0.23 0.03 -0.09 0.50 0.04 0.00 0.00 177.00 177.72 1wmp s ARG 336 N -1.22 1.60 0.10 4.56 3.52 0.15 -4.91 118.95 122.75 1wmp s ARG 336 Ca 0.48 -0.30 -0.20 0.00 -0.13 0.00 0.00 55.73 55.58 1wmp s ARG 336 Cb -0.34 -1.58 -0.07 0.00 -1.56 0.00 0.00 34.95 31.39 1wmp s ARG 336 CO 0.43 -0.22 0.62 -2.00 -0.81 0.00 0.00 175.30 173.32 1wmp s GLU 337 N 1.52 4.26 -0.80 5.12 2.12 -1.26 -0.80 118.70 128.85 1wmp s GLU 337 Ca 0.02 0.81 -0.07 0.00 0.36 0.00 0.00 54.97 56.08 1wmp s GLU 337 Cb -0.13 -3.20 0.21 0.00 0.26 0.00 0.00 34.13 31.26 1wmp s GLU 337 CO -0.06 0.60 0.69 0.42 -0.54 0.00 0.00 175.26 176.37 1wmp s ILE 338 N -1.16 4.75 0.14 -3.70 1.01 -0.12 -4.99 121.20 117.14 1wmp s ILE 338 Ca 0.32 -3.02 -0.33 0.00 0.00 0.00 0.00 60.65 57.61 1wmp s ILE 338 Cb -0.20 -3.97 -0.13 0.00 0.01 0.00 0.00 42.46 38.17 1wmp s ILE 338 CO 0.20 -1.01 1.65 -1.14 0.00 0.00 0.00 174.94 174.65 1wmp n ARG 339 N 3.34 2.30 -3.91 2.79 0.63 -1.26 -1.93 116.66 118.61 1wmp n ARG 339 Ca 0.14 0.83 -0.29 0.00 -0.92 0.00 0.00 57.85 57.61 1wmp n ARG 339 Cb 0.41 -2.63 0.02 0.00 0.45 0.00 0.00 32.46 30.71 1wmp n ARG 339 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1wmp n ASN 340 N 3.99 -4.18 0.18 6.15 3.02 -1.25 -4.18 115.26 118.99 1wmp n ASN 340 Ca 0.17 -0.80 0.13 0.00 -0.03 0.00 0.00 54.58 54.05 1wmp n ASN 340 Cb 0.30 -3.81 0.32 0.00 -0.61 0.00 0.00 39.78 35.98 1wmp n ASN 340 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 1wmp h GLY 341 N -2.03 0.00 -6.14 7.41 0.00 -1.08 0.23 103.07 101.46 1wmp h GLY 341 Ca -0.59 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.18 1wmp h GLY 341 CO 0.67 0.00 -0.83 -0.42 0.00 0.00 0.00 176.54 175.96 1wmp s ILE 342 N -3.23 1.36 -0.12 2.60 1.01 -0.92 -4.43 121.20 117.47 1wmp s ILE 342 Ca 0.07 -0.55 -0.07 0.00 0.00 0.00 0.00 60.65 60.11 1wmp s ILE 342 Cb 0.08 -1.27 -0.04 0.00 0.01 0.00 0.00 42.46 41.24 1wmp s ILE 342 CO 0.61 0.42 0.12 0.00 0.00 0.00 0.00 174.94 176.09 1wmp s MET 344 N -0.91 0.37 -0.03 0.00 -1.94 -0.50 -1.06 119.30 115.22 1wmp s MET 344 Ca 0.14 0.07 -0.30 0.00 -1.71 0.00 0.00 55.69 53.90 1wmp s MET 344 Cb -0.12 -0.56 0.11 0.00 2.01 0.00 0.00 34.83 36.27 1wmp s MET 344 CO 0.03 -0.15 0.93 -3.38 -0.01 0.00 0.00 175.02 172.45 1wmp s HIS 345 N 1.13 -0.32 0.16 -0.03 -3.43 -0.56 -1.01 115.29 111.22 1wmp s HIS 345 Ca -0.08 0.19 0.06 0.00 -0.80 0.00 0.00 55.06 54.43 1wmp s HIS 345 Cb -0.13 0.54 -0.04 0.00 -1.43 0.00 0.00 32.58 31.51 1wmp s HIS 345 CO -0.02 -0.50 0.06 -1.83 -2.00 0.00 0.00 174.74 170.46 1wmp s GLU 346 N -3.03 2.66 -0.02 -0.38 -1.05 -1.26 0.79 118.70 116.41 1wmp s GLU 346 Ca 0.06 -0.96 -0.12 0.00 -0.15 0.00 0.00 54.97 53.80 1wmp s GLU 346 Cb -0.01 -2.52 0.02 0.00 -0.44 0.00 0.00 34.13 31.18 1wmp s GLU 346 CO -0.08 0.48 0.25 -1.83 0.95 0.00 0.00 175.26 175.02 1wmp s GLU 347 N -2.93 0.57 0.46 -4.83 -1.05 -0.43 -4.93 118.70 105.56 1wmp s GLU 347 Ca 0.29 -0.21 -0.25 0.00 -0.15 0.00 0.00 54.97 54.65 1wmp s GLU 347 Cb -0.10 0.25 -0.08 0.00 -0.44 0.00 0.00 34.13 33.76 1wmp s GLU 347 CO 0.21 -0.14 1.40 0.34 0.95 0.00 0.00 175.26 178.01 1wmp s ASP 348 N -1.20 5.82 -0.36 0.83 2.15 -1.26 -1.75 116.67 120.91 1wmp s ASP 348 Ca -0.13 2.85 0.14 0.00 0.43 0.00 0.00 52.55 55.84 1wmp s ASP 348 Cb -0.06 -2.65 0.45 0.00 -0.30 0.00 0.00 42.92 40.36 1wmp s ASP 348 CO 0.03 -1.20 1.01 1.87 -0.17 0.00 0.00 175.17 176.71 1wmp n TRP 349 N -0.31 1.96 -4.86 -5.34 -0.00 0.81 -4.81 117.44 104.88 1wmp n TRP 349 Ca 0.06 -2.88 0.00 0.00 -0.00 0.00 0.00 57.50 54.68 1wmp n TRP 349 Cb 0.43 -0.27 0.00 0.00 -0.00 0.00 0.00 31.31 31.46 1wmp n TRP 349 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1wmp n GLY 350 N -0.23 0.73 3.72 5.87 0.00 -1.26 -4.33 105.19 109.70 1wmp n GLY 350 Ca 0.20 -0.78 -0.41 0.00 0.00 0.00 0.00 46.02 45.03 1wmp n GLY 350 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wmp s ILE 351 N 0.00 4.26 -0.22 -0.61 1.01 -1.26 0.19 121.20 124.57 1wmp s ILE 351 Ca 0.00 1.77 -0.16 0.00 0.00 0.00 0.00 60.65 62.25 1wmp s ILE 351 Cb 0.00 -4.13 -0.18 0.00 0.01 0.00 0.00 42.46 38.16 1wmp s ILE 351 CO 0.00 0.22 0.08 -0.11 0.00 0.00 0.00 174.94 175.13 1wmp n LEU 352 N 3.18 2.05 -3.71 2.97 7.94 0.13 -4.57 117.00 125.00 1wmp n LEU 352 Ca 0.05 0.34 -0.14 0.00 -1.11 0.00 0.00 56.01 55.15 1wmp n LEU 352 Cb 0.48 -0.95 -0.09 0.00 0.53 0.00 0.00 43.42 43.39 1wmp n LEU 352 CO 0.53 0.47 0.13 0.00 -1.11 0.00 0.00 177.39 177.41 1wmp s ALA 353 N -2.43 -1.07 -0.23 1.96 0.00 -1.10 -4.97 121.76 113.90 1wmp s ALA 353 Ca -0.31 0.87 -0.24 0.00 0.00 0.00 0.00 51.96 52.29 1wmp s ALA 353 Cb 0.08 -0.27 0.06 0.00 0.00 0.00 0.00 23.12 22.99 1wmp s ALA 353 CO 0.59 -0.26 0.66 0.21 0.00 0.00 0.00 175.76 176.97 1wmp s LYS 354 N -0.65 0.80 -0.29 0.00 2.20 -1.26 -0.71 119.74 119.83 1wmp s LYS 354 Ca -0.07 0.85 -0.15 0.00 -0.36 0.00 0.00 55.97 56.24 1wmp s LYS 354 Cb -0.04 0.39 0.13 0.00 -1.51 0.00 0.00 37.83 36.80 1wmp s LYS 354 CO 0.04 -0.11 0.86 -1.58 -0.36 0.00 0.00 175.35 174.20 1wmp s HIS 355 N 0.20 -0.81 -0.38 4.03 2.46 0.21 -5.00 115.29 116.00 1wmp s HIS 355 Ca -0.01 1.55 -0.09 0.00 0.47 0.00 0.00 55.06 56.98 1wmp s HIS 355 Cb -0.04 0.49 0.05 0.00 -0.13 0.00 0.00 32.58 32.94 1wmp s HIS 355 CO 0.02 -0.40 0.19 -1.12 -2.47 0.00 0.00 174.74 170.96 1wmp s SER 356 N 1.80 5.58 -0.27 9.88 0.01 -1.26 -0.53 113.70 128.92 1wmp s SER 356 Ca -0.08 -1.20 -0.14 0.00 1.31 0.00 0.00 55.95 55.84 1wmp s SER 356 Cb -0.05 -1.97 -0.04 0.00 0.21 0.00 0.00 66.02 64.17 1wmp s SER 356 CO -0.17 -0.42 0.32 -0.62 0.41 0.00 0.00 173.24 172.77 1wmp s ASP 357 N 1.68 6.21 0.05 2.44 -1.08 -0.58 -4.98 116.67 120.41 1wmp s ASP 357 Ca 0.01 0.23 -0.24 0.00 -0.52 0.00 0.00 52.55 52.03 1wmp s ASP 357 Cb -0.20 -2.19 -0.17 0.00 -1.46 0.00 0.00 42.92 38.90 1wmp s ASP 357 CO 0.04 -0.14 1.59 0.25 0.52 0.00 0.00 175.17 177.43 1wmp h LEU 358 N 8.44 -0.00 -0.94 -1.34 5.85 -1.96 -0.04 115.31 125.32 1wmp h LEU 358 Ca -0.33 -0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.20 1wmp h LEU 358 Cb 1.17 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.16 1wmp h LEU 358 CO 0.63 0.16 0.34 -0.50 -0.34 0.00 0.00 178.44 178.72 1wmp h TRP 359 N -0.16 1.10 0.00 1.25 6.55 -1.98 -3.07 115.95 119.65 1wmp h TRP 359 Ca -0.00 -0.06 0.00 0.00 0.95 0.00 0.00 58.89 59.78 1wmp h TRP 359 Cb 0.16 -0.34 0.00 0.00 -0.86 0.00 0.00 29.16 28.12 1wmp h TRP 359 CO -0.02 0.82 -1.12 -1.13 -1.05 0.00 0.00 178.44 175.93 1wmp n SER 360 N -4.30 0.65 0.00 -3.49 3.41 -1.23 -4.95 113.62 103.71 1wmp n SER 360 Ca 0.07 0.14 0.00 0.00 -0.26 0.00 0.00 58.87 58.83 1wmp n SER 360 Cb 0.16 0.73 0.00 0.00 -0.26 0.00 0.00 64.21 64.84 1wmp n SER 360 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wmp n GLY 361 N 1.25 0.38 3.69 5.00 0.00 -0.03 -5.00 105.19 110.47 1wmp n GLY 361 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1wmp n GLY 361 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wmp s ILE 362 N -1.80 5.24 -0.20 -0.61 -1.09 -1.21 -4.92 121.20 116.61 1wmp s ILE 362 Ca 0.00 0.63 -0.06 0.00 -2.23 0.00 0.00 60.65 58.99 1wmp s ILE 362 Cb 0.00 -3.69 -0.03 0.00 -1.58 0.00 0.00 42.46 37.16 1wmp s ILE 362 CO 0.00 0.30 0.03 0.20 -1.23 0.00 0.00 174.94 174.24 1wmp s ASN 363 N 0.88 5.08 -0.06 3.58 0.01 -1.26 -1.52 114.94 121.65 1wmp s ASN 363 Ca 0.18 -0.13 0.03 0.00 -0.71 0.00 0.00 52.86 52.22 1wmp s ASN 363 Cb -0.14 -1.88 0.01 0.00 0.41 0.00 0.00 41.25 39.65 1wmp s ASN 363 CO 0.07 0.07 -0.13 -0.47 -1.51 0.00 0.00 177.10 175.13 1wmp s TYR 364 N 0.96 1.50 -0.07 2.20 6.14 0.31 -5.00 117.35 123.40 1wmp s TYR 364 Ca 0.02 -0.53 -0.04 0.00 0.64 0.00 0.00 57.07 57.16 1wmp s TYR 364 Cb -0.14 -1.08 0.03 0.00 0.42 0.00 0.00 41.96 41.19 1wmp s TYR 364 CO 0.02 -0.25 0.17 0.99 0.64 0.00 0.00 175.55 177.12 1wmp s THR 365 N 0.51 -0.03 0.01 4.34 2.01 -1.26 -0.62 115.64 120.61 1wmp s THR 365 Ca -0.12 0.10 0.03 0.00 0.31 0.00 0.00 61.69 62.00 1wmp s THR 365 Cb -0.15 -0.26 -0.01 0.00 0.01 0.00 0.00 72.50 72.10 1wmp s THR 365 CO 0.03 0.04 -0.09 -0.13 -0.69 0.00 0.00 174.62 173.79 1wmp s ARG 366 N 0.72 0.65 0.28 4.92 1.81 0.11 -4.85 118.95 122.60 1wmp s ARG 366 Ca -0.05 -0.44 -0.07 0.00 -1.72 0.00 0.00 55.73 53.45 1wmp s ARG 366 Cb -0.07 -0.60 -0.06 0.00 -0.45 0.00 0.00 34.95 33.77 1wmp s ARG 366 CO -0.04 0.15 0.57 1.03 -0.68 0.00 0.00 175.30 176.34 1wmp s ARG 367 N -0.59 3.70 0.27 3.54 1.81 -1.26 0.21 118.95 126.62 1wmp s ARG 367 Ca 0.00 0.14 0.07 0.00 -1.72 0.00 0.00 55.73 54.22 1wmp s ARG 367 Cb -0.05 -2.62 -0.03 0.00 -0.45 0.00 0.00 34.95 31.80 1wmp s ARG 367 CO 0.00 0.22 0.23 1.21 -0.68 0.00 0.00 175.30 176.28 1wmp s ASN 368 N -2.91 5.52 0.05 0.23 2.47 0.13 -4.43 114.94 115.99 1wmp s ASN 368 Ca 0.46 -0.29 -0.07 0.00 0.42 0.00 0.00 52.86 53.38 1wmp s ASN 368 Cb -0.11 -1.33 -0.01 0.00 -1.45 0.00 0.00 41.25 38.36 1wmp s ASN 368 CO 0.27 -0.12 0.12 -0.13 -3.72 0.00 0.00 177.10 173.53 1wmp s ARG 369 N -3.89 0.66 0.00 0.43 0.52 -1.26 -0.13 118.95 115.28 1wmp s ARG 369 Ca 0.35 -0.81 0.02 0.00 -0.52 0.00 0.00 55.73 54.77 1wmp s ARG 369 Cb -0.07 0.26 -0.01 0.00 0.52 0.00 0.00 34.95 35.65 1wmp s ARG 369 CO 0.26 -0.18 -0.06 -0.98 0.02 0.00 0.00 175.30 174.36 1wmp s ARG 370 N -2.95 0.45 -0.08 3.54 1.70 -0.71 -2.54 118.95 118.36 1wmp s ARG 370 Ca -0.02 -0.30 -0.18 0.00 -0.47 0.00 0.00 55.73 54.76 1wmp s ARG 370 Cb 0.01 -0.40 -0.05 0.00 -0.57 0.00 0.00 34.95 33.94 1wmp s ARG 370 CO -0.06 0.10 0.48 1.41 -1.08 0.00 0.00 175.30 176.15 1wmp s MET 371 N -0.40 4.26 -0.11 3.89 -2.45 0.19 -1.31 119.30 123.36 1wmp s MET 371 Ca -0.00 0.48 0.02 0.00 -1.25 0.00 0.00 55.69 54.94 1wmp s MET 371 Cb -0.04 -3.38 -0.01 0.00 1.25 0.00 0.00 34.83 32.65 1wmp s MET 371 CO -0.00 0.29 -0.18 0.08 1.05 0.00 0.00 175.02 176.27 1wmp s VAL 372 N 0.16 2.65 -0.11 10.11 1.01 0.24 -1.71 120.40 132.75 1wmp s VAL 372 Ca 0.26 -0.81 -0.01 0.00 0.00 0.00 0.00 61.98 61.42 1wmp s VAL 372 Cb -0.16 -2.07 0.03 0.00 0.00 0.00 0.00 36.38 34.18 1wmp s VAL 372 CO 0.12 0.54 -0.05 -0.63 0.00 0.00 0.00 175.10 175.08 1wmp s ILE 373 N 0.27 0.86 0.25 2.22 1.01 -0.82 -1.50 121.20 123.50 1wmp s ILE 373 Ca -0.13 -0.25 -0.12 0.00 0.00 0.00 0.00 60.65 60.15 1wmp s ILE 373 Cb -0.16 -0.96 -0.00 0.00 0.01 0.00 0.00 42.46 41.34 1wmp s ILE 373 CO 0.07 0.28 0.47 -0.94 0.00 0.00 0.00 174.94 174.82 1wmp s SER 374 N 1.77 -0.04 0.15 3.58 1.04 -0.22 -0.86 113.70 119.11 1wmp s SER 374 Ca 0.04 -0.97 -0.19 0.00 0.48 0.00 0.00 55.95 55.31 1wmp s SER 374 Cb -0.13 0.59 0.05 0.00 0.10 0.00 0.00 66.02 66.62 1wmp s SER 374 CO -0.07 -1.15 0.50 0.72 0.98 0.00 0.00 173.24 174.22 1wmp s PHE 375 N -3.96 -0.32 0.02 5.02 -0.71 -0.95 -0.56 117.98 116.52 1wmp s PHE 375 Ca 0.23 0.04 0.06 0.00 -1.04 0.00 0.00 56.93 56.22 1wmp s PHE 375 Cb -0.01 0.40 -0.02 0.00 -1.21 0.00 0.00 43.02 42.19 1wmp s PHE 375 CO 0.10 -0.80 -0.17 0.12 -1.34 0.00 0.00 175.22 173.12 1wmp s PHE 376 N -3.79 1.53 0.12 3.49 2.19 -1.26 -1.20 117.98 119.06 1wmp s PHE 376 Ca 0.03 -0.33 0.04 0.00 0.33 0.00 0.00 56.93 57.00 1wmp s PHE 376 Cb 0.00 -0.94 -0.04 0.00 -1.31 0.00 0.00 43.02 40.73 1wmp s PHE 376 CO -0.11 0.03 -0.10 -0.08 1.83 0.00 0.00 175.22 176.79 1wmp s THR 377 N -0.64 1.06 -0.13 0.12 -1.32 0.16 0.51 115.64 115.40 1wmp s THR 377 Ca 0.06 -1.89 0.01 0.00 -1.21 0.00 0.00 61.69 58.66 1wmp s THR 377 Cb -0.08 -1.65 0.02 0.00 -1.51 0.00 0.00 72.50 69.28 1wmp s THR 377 CO 0.01 -0.68 -0.17 -0.89 -2.21 0.00 0.00 174.62 170.68 1wmp s THR 378 N -3.00 1.67 -0.52 5.08 2.01 -1.09 -0.82 115.64 118.97 1wmp s THR 378 Ca 0.12 -0.73 0.03 0.00 0.31 0.00 0.00 61.69 61.43 1wmp s THR 378 Cb 0.01 -1.52 0.13 0.00 0.01 0.00 0.00 72.50 71.12 1wmp s THR 378 CO -0.00 0.48 0.26 -0.63 -0.69 0.00 0.00 174.62 174.04 1wmp s ILE 379 N 1.11 2.68 0.00 1.82 -1.09 0.86 -4.79 121.20 121.79 1wmp s ILE 379 Ca -0.03 -3.23 0.00 0.00 -2.23 0.00 0.00 60.65 55.16 1wmp s ILE 379 Cb -0.14 -2.85 0.00 0.00 -1.58 0.00 0.00 42.46 37.88 1wmp s ILE 379 CO -0.05 -0.79 0.00 0.61 -1.23 0.00 0.00 174.94 173.48 1wmp n GLY 380 N 3.21 2.32 0.12 6.18 0.00 -1.26 -1.80 105.19 113.96 1wmp n GLY 380 Ca 0.05 0.24 -0.00 0.00 0.00 0.00 0.00 46.02 46.31 1wmp n GLY 380 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 1wmp h ASN 381 N 0.00 0.00 -2.87 1.61 -1.07 -1.96 -3.47 115.58 107.82 1wmp h ASN 381 Ca 0.00 0.00 -0.53 0.00 0.07 0.00 0.00 56.30 55.84 1wmp h ASN 381 Cb 0.00 0.00 -0.02 0.00 -2.07 0.00 0.00 38.32 36.23 1wmp h ASN 381 CO 0.00 0.64 -0.30 -0.31 0.07 0.00 0.00 177.43 177.53 1wmp s TYR 382 N -2.92 3.48 -0.06 4.14 2.02 -0.75 -0.70 117.35 122.57 1wmp s TYR 382 Ca 0.03 0.37 0.01 0.00 -0.37 0.00 0.00 57.07 57.11 1wmp s TYR 382 Cb 0.08 -1.88 0.02 0.00 -0.40 0.00 0.00 41.96 39.78 1wmp s TYR 382 CO 0.76 0.34 -0.06 -0.51 -1.57 0.00 0.00 175.55 174.52 1wmp s ASP 383 N -3.21 1.34 -0.04 2.29 1.11 -0.53 -0.10 116.67 117.53 1wmp s ASP 383 Ca 0.39 -0.18 0.07 0.00 0.18 0.00 0.00 52.55 53.01 1wmp s ASP 383 Cb -0.11 -0.58 -0.01 0.00 1.07 0.00 0.00 42.92 43.29 1wmp s ASP 383 CO 0.29 -0.06 -0.25 -0.31 1.18 0.00 0.00 175.17 176.02 1wmp s TYR 384 N 1.06 2.38 -0.13 4.23 2.02 -0.00 -1.01 117.35 125.89 1wmp s TYR 384 Ca -0.08 -0.61 -0.02 0.00 -0.37 0.00 0.00 57.07 55.99 1wmp s TYR 384 Cb -0.14 -1.55 -0.02 0.00 -0.40 0.00 0.00 41.96 39.84 1wmp s TYR 384 CO -0.01 -0.14 -0.07 0.20 -1.57 0.00 0.00 175.55 173.96 1wmp s GLY 385 N -0.34 1.67 -0.24 0.71 0.00 0.12 -0.66 107.32 108.58 1wmp s GLY 385 Ca 0.02 -0.85 -0.03 0.00 0.00 0.00 0.00 44.72 43.86 1wmp s GLY 385 CO 0.02 -0.22 -0.03 -1.36 0.00 0.00 0.00 173.10 171.51 1wmp s PHE 386 N 0.13 3.02 -0.08 1.90 0.40 -0.34 0.05 117.98 123.06 1wmp s PHE 386 Ca -0.03 -1.19 0.04 0.00 -0.60 0.00 0.00 56.93 55.16 1wmp s PHE 386 Cb -0.14 -2.11 -0.00 0.00 0.51 0.00 0.00 43.02 41.28 1wmp s PHE 386 CO 0.03 -0.63 -0.21 0.71 0.70 0.00 0.00 175.22 175.82 1wmp s TYR 387 N 1.42 2.22 -0.09 0.36 1.51 -0.13 -2.23 117.35 120.40 1wmp s TYR 387 Ca 0.03 -0.81 0.01 0.00 -1.01 0.00 0.00 57.07 55.30 1wmp s TYR 387 Cb -0.16 -1.49 -0.02 0.00 -0.11 0.00 0.00 41.96 40.18 1wmp s TYR 387 CO -0.03 -0.31 -0.13 -1.58 -1.11 0.00 0.00 175.55 172.39 1wmp s TRP 388 N 0.24 2.78 -0.02 2.71 0.52 -0.04 -0.67 118.94 124.46 1wmp s TRP 388 Ca -0.13 -0.39 0.06 0.00 0.02 0.00 0.00 56.10 55.67 1wmp s TRP 388 Cb -0.16 -1.75 -0.01 0.00 -1.15 0.00 0.00 33.47 30.40 1wmp s TRP 388 CO 0.06 -0.00 -0.21 0.71 0.02 0.00 0.00 176.95 177.53 1wmp s TYR 389 N -0.18 1.89 -0.14 -1.98 2.02 0.23 -1.93 117.35 117.26 1wmp s TYR 389 Ca 0.00 -0.38 0.02 0.00 -0.37 0.00 0.00 57.07 56.34 1wmp s TYR 389 Cb -0.13 -1.22 0.01 0.00 -0.40 0.00 0.00 41.96 40.22 1wmp s TYR 389 CO 0.03 -0.05 -0.20 -0.51 -1.57 0.00 0.00 175.55 173.25 1wmp s LEU 390 N -0.43 2.01 0.21 -1.29 1.43 -0.70 -1.17 118.68 118.74 1wmp s LEU 390 Ca 0.07 -0.57 0.06 0.00 -1.03 0.00 0.00 54.13 52.66 1wmp s LEU 390 Cb -0.09 -1.36 -0.04 0.00 0.03 0.00 0.00 46.19 44.74 1wmp s LEU 390 CO -0.00 0.05 0.18 -0.31 0.23 0.00 0.00 176.35 176.50 1wmp s TYR 391 N 0.91 3.14 0.23 0.29 2.02 -0.36 0.53 117.35 124.12 1wmp s TYR 391 Ca -0.06 -0.07 -0.07 0.00 -0.37 0.00 0.00 57.07 56.51 1wmp s TYR 391 Cb -0.15 -1.45 0.32 0.00 -0.40 0.00 0.00 41.96 40.28 1wmp s TYR 391 CO -0.03 0.52 1.80 -0.07 -1.57 0.00 0.00 175.55 176.19 1wmp h LEU 392 N 1.86 0.54 0.00 -1.29 3.38 -1.82 -1.87 115.31 116.12 1wmp h LEU 392 Ca -0.48 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1wmp h LEU 392 Cb 1.22 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1wmp h LEU 392 CO 0.62 0.32 0.00 -0.90 0.09 0.00 0.00 178.44 178.57 1wmp n ASP 393 N -4.81 0.00 0.00 -0.43 5.75 -1.26 -4.79 116.55 111.01 1wmp n ASP 393 Ca 0.11 -0.79 0.00 0.00 -0.01 0.00 0.00 54.79 54.10 1wmp n ASP 393 Cb 0.25 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.34 1wmp n ASP 393 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1wmp n GLY 394 N 0.17 0.65 3.76 6.12 0.00 -0.70 -4.79 105.19 110.41 1wmp n GLY 394 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 1wmp n GLY 394 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wmp s THR 395 N -2.23 3.84 -0.07 2.61 2.01 -1.25 -4.46 115.64 116.09 1wmp s THR 395 Ca 0.00 1.72 0.04 0.00 0.31 0.00 0.00 61.69 63.76 1wmp s THR 395 Cb 0.00 -4.04 -0.02 0.00 0.01 0.00 0.00 72.50 68.45 1wmp s THR 395 CO 0.00 0.31 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.42 1wmp s ILE 396 N -1.33 2.63 -0.02 1.82 1.01 -0.17 -1.22 121.20 123.91 1wmp s ILE 396 Ca 0.46 -0.86 -0.07 0.00 0.00 0.00 0.00 60.65 60.18 1wmp s ILE 396 Cb -0.26 -2.01 0.01 0.00 0.01 0.00 0.00 42.46 40.20 1wmp s ILE 396 CO 0.33 0.57 0.16 -0.70 0.00 0.00 0.00 174.94 175.30 1wmp s GLU 397 N -0.29 0.40 0.08 2.79 2.12 -0.32 0.09 118.70 123.57 1wmp s GLU 397 Ca 0.01 -0.17 0.09 0.00 0.36 0.00 0.00 54.97 55.27 1wmp s GLU 397 Cb -0.13 0.17 -0.03 0.00 0.26 0.00 0.00 34.13 34.40 1wmp s GLU 397 CO 0.03 -0.09 -0.25 0.12 -0.54 0.00 0.00 175.26 174.53 1wmp s PHE 398 N -0.88 2.15 -0.11 5.30 5.36 -0.52 0.76 117.98 130.04 1wmp s PHE 398 Ca -0.10 -0.40 -0.05 0.00 -0.96 0.00 0.00 56.93 55.43 1wmp s PHE 398 Cb -0.05 -1.24 0.05 0.00 -0.34 0.00 0.00 43.02 41.44 1wmp s PHE 398 CO 0.01 0.19 0.24 -2.00 -1.46 0.00 0.00 175.22 172.20 1wmp s GLU 399 N -1.54 0.18 -0.14 10.12 2.12 0.15 -2.31 118.70 127.29 1wmp s GLU 399 Ca 0.11 0.55 -0.07 0.00 0.36 0.00 0.00 54.97 55.92 1wmp s GLU 399 Cb -0.10 -0.12 -0.04 0.00 0.26 0.00 0.00 34.13 34.13 1wmp s GLU 399 CO 0.03 -0.19 0.10 0.00 -0.54 0.00 0.00 175.26 174.67 1wmp s ALA 400 N 1.47 3.66 -0.24 6.30 0.00 0.23 -0.96 121.76 132.22 1wmp s ALA 400 Ca -0.07 -0.70 -0.00 0.00 0.00 0.00 0.00 51.96 51.19 1wmp s ALA 400 Cb -0.11 -1.92 0.03 0.00 0.00 0.00 0.00 23.12 21.13 1wmp s ALA 400 CO -0.08 0.45 -0.09 0.15 0.00 0.00 0.00 175.76 176.18 1wmp s LYS 401 N -0.48 2.70 -0.22 0.00 1.02 0.11 -2.55 119.74 120.31 1wmp s LYS 401 Ca 0.11 -1.06 -0.09 0.00 0.02 0.00 0.00 55.97 54.96 1wmp s LYS 401 Cb -0.12 -2.91 -0.04 0.00 -0.52 0.00 0.00 37.83 34.24 1wmp s LYS 401 CO 0.02 -0.42 0.11 0.00 -0.92 0.00 0.00 175.35 174.14 1wmp s ALA 402 N 1.26 3.48 0.00 5.17 0.00 0.08 0.16 121.76 131.92 1wmp s ALA 402 Ca -0.01 -0.85 0.00 0.00 0.00 0.00 0.00 51.96 51.09 1wmp s ALA 402 Cb -0.17 -2.13 0.00 0.00 0.00 0.00 0.00 23.12 20.82 1wmp s ALA 402 CO -0.06 -0.07 0.00 -2.37 0.00 0.00 0.00 175.76 173.27 1wmp n THR 403 N 4.03 0.00 0.00 0.00 5.66 -0.18 -1.08 114.28 122.71 1wmp n THR 403 Ca -0.16 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.84 1wmp n THR 403 Cb 0.52 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.30 1wmp n THR 403 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1wmp n GLY 404 N 0.00 0.13 3.35 1.09 0.00 -1.26 -1.45 105.19 107.05 1wmp n GLY 404 Ca 0.00 -1.92 -0.33 0.00 0.00 0.00 0.00 46.02 43.77 1wmp n GLY 404 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wmp s VAL 405 N 0.00 3.01 0.49 1.61 1.01 0.12 -1.17 120.40 125.47 1wmp s VAL 405 Ca 0.00 -0.67 -0.23 0.00 0.00 0.00 0.00 61.98 61.08 1wmp s VAL 405 Cb 0.00 -2.27 -0.06 0.00 0.00 0.00 0.00 36.38 34.05 1wmp s VAL 405 CO 0.00 0.52 1.26 0.68 0.00 0.00 0.00 175.10 177.56 1wmp s VAL 406 N 0.46 2.64 0.07 2.92 -7.23 -1.26 -4.17 120.40 113.83 1wmp s VAL 406 Ca -0.10 0.49 -0.31 0.00 -1.81 0.00 0.00 61.98 60.25 1wmp s VAL 406 Cb -0.16 -3.25 -0.06 0.00 0.56 0.00 0.00 36.38 33.47 1wmp s VAL 406 CO 0.05 0.00 1.29 0.12 -0.31 0.00 0.00 175.10 176.25 1wmp s PHE 407 N -1.42 3.29 0.44 2.82 5.36 -1.26 -5.00 117.98 122.22 1wmp s PHE 407 Ca 0.66 1.12 0.07 0.00 -0.96 0.00 0.00 56.93 57.82 1wmp s PHE 407 Cb -0.34 -3.54 -0.02 0.00 -0.34 0.00 0.00 43.02 38.78 1wmp s PHE 407 CO 0.41 -1.82 0.32 0.95 -1.46 0.00 0.00 175.22 173.63 1wmp s THR 408 N 1.27 2.32 0.20 0.12 -4.23 -1.26 -4.02 115.64 110.03 1wmp s THR 408 Ca 0.61 -1.49 -0.06 0.00 -1.18 0.00 0.00 61.69 59.57 1wmp s THR 408 Cb -0.32 -2.80 0.03 0.00 1.34 0.00 0.00 72.50 70.74 1wmp s THR 408 CO 0.29 0.00 0.38 -1.54 -0.54 0.00 0.00 174.62 173.21 1wmp n SER 409 N -1.50 -1.09 -4.88 3.99 3.41 -0.31 -4.89 113.62 108.35 1wmp n SER 409 Ca 0.01 -1.85 -0.30 0.00 -0.26 0.00 0.00 58.87 56.47 1wmp n SER 409 Cb 0.63 1.84 -0.03 0.00 -0.26 0.00 0.00 64.21 66.39 1wmp n SER 409 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1wmp s ALA 410 N -1.68 3.39 -0.36 7.33 0.00 -1.26 -0.14 121.76 129.05 1wmp s ALA 410 Ca 0.10 -0.27 -0.13 0.00 0.00 0.00 0.00 51.96 51.65 1wmp s ALA 410 Cb -0.02 -2.63 -0.01 0.00 0.00 0.00 0.00 23.12 20.45 1wmp s ALA 410 CO 0.07 0.02 0.25 0.12 0.00 0.00 0.00 175.76 176.22 1wmp s PHE 411 N -2.34 3.23 0.24 0.00 5.36 -0.01 -4.10 117.98 120.36 1wmp s PHE 411 Ca 0.50 -0.30 -0.31 0.00 -0.96 0.00 0.00 56.93 55.85 1wmp s PHE 411 Cb -0.10 -2.50 -0.14 0.00 -0.34 0.00 0.00 43.02 39.94 1wmp s PHE 411 CO 0.32 -0.41 1.36 -2.30 -1.46 0.00 0.00 175.22 172.73 1wmp n PRO 412 N 5.12 1.92 -1.71 10.12 -0.02 -1.26 -4.77 135.00 144.39 1wmp n PRO 412 Ca -0.12 0.68 -0.42 0.00 -2.02 0.00 0.00 63.50 61.62 1wmp n PRO 412 Cb 0.49 -2.31 -0.03 0.00 -0.02 0.00 0.00 33.50 31.63 1wmp n PRO 412 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1wmp n GLU 413 N 1.90 2.76 0.00 -0.52 2.13 -1.26 -1.37 120.64 124.28 1wmp n GLU 413 Ca 0.12 1.00 0.00 0.00 0.66 0.00 0.00 57.16 58.93 1wmp n GLU 413 Cb 0.31 -2.85 0.00 0.00 0.27 0.00 0.00 31.44 29.17 1wmp n GLU 413 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1wmp n GLY 414 N 3.98 0.35 3.32 8.31 0.00 -1.26 -4.99 105.19 114.91 1wmp n GLY 414 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1wmp n GLY 414 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wmp n GLY 415 N -2.00 -2.03 3.52 -0.02 0.00 -0.47 -5.06 105.19 99.13 1wmp n GLY 415 Ca 0.00 -1.74 -0.13 0.00 0.00 0.00 0.00 46.02 44.16 1wmp n GLY 415 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wmp s SER 416 N -3.72 -0.49 0.00 1.61 0.15 -1.26 -4.53 113.70 105.45 1wmp s SER 416 Ca 0.00 0.35 0.20 0.00 0.70 0.00 0.00 55.95 57.20 1wmp s SER 416 Cb 0.00 0.44 0.03 0.00 -1.71 0.00 0.00 66.02 64.79 1wmp s SER 416 CO 0.00 -0.59 1.03 0.47 1.20 0.00 0.00 173.24 175.35 1wmp n ASP 417 N 0.38 2.07 -0.09 5.45 8.00 -1.26 -4.47 116.55 126.64 1wmp n ASP 417 Ca -0.14 -1.54 0.01 0.00 0.71 0.00 0.00 54.79 53.84 1wmp n ASP 417 Cb 0.60 0.36 0.02 0.00 -0.02 0.00 0.00 41.12 42.07 1wmp n ASP 417 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1wmp n ASN 418 N 0.24 0.91 -3.80 -2.24 4.13 -1.26 -5.05 115.26 108.19 1wmp n ASN 418 Ca 0.09 -1.73 -0.13 0.00 1.68 0.00 0.00 54.58 54.49 1wmp n ASN 418 Cb 0.44 -0.09 -0.12 0.00 -1.54 0.00 0.00 39.78 38.47 1wmp n ASN 418 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1wmp s ILE 419 N -0.67 -0.00 0.24 2.41 1.01 -1.26 -1.23 121.20 121.69 1wmp s ILE 419 Ca 0.04 0.01 0.07 0.00 0.00 0.00 0.00 60.65 60.77 1wmp s ILE 419 Cb 0.04 -0.29 -0.04 0.00 0.01 0.00 0.00 42.46 42.18 1wmp s ILE 419 CO 0.00 0.00 0.14 -0.94 0.00 0.00 0.00 174.94 174.15 1wmp s SER 420 N 0.15 5.32 -0.21 3.58 1.04 -0.75 -4.57 113.70 118.25 1wmp s SER 420 Ca -0.00 -0.31 -0.13 0.00 0.48 0.00 0.00 55.95 55.99 1wmp s SER 420 Cb -0.02 -1.30 -0.05 0.00 0.10 0.00 0.00 66.02 64.76 1wmp s SER 420 CO -0.00 -0.01 0.26 -1.58 0.98 0.00 0.00 173.24 172.89 1wmp s GLN 421 N -3.66 4.14 -0.19 4.02 0.74 -1.26 -0.68 119.66 122.77 1wmp s GLN 421 Ca 0.32 -0.05 0.15 0.00 0.05 0.00 0.00 55.36 55.83 1wmp s GLN 421 Cb -0.08 -3.52 -0.24 0.00 1.10 0.00 0.00 33.01 30.28 1wmp s GLN 421 CO 0.24 0.06 0.08 1.28 -0.55 0.00 0.00 175.29 176.40 1wmp n LEU 422 N 4.22 0.57 -3.85 3.68 4.77 0.14 -4.55 117.00 121.99 1wmp n LEU 422 Ca -0.12 0.02 -0.08 0.00 -0.03 0.00 0.00 56.01 55.79 1wmp n LEU 422 Cb 0.52 0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.84 1wmp n LEU 422 CO 0.38 0.56 0.48 0.00 -1.33 0.00 0.00 177.39 177.48 1wmp s ALA 423 N -2.51 -0.81 -0.15 -1.18 0.00 -1.21 -4.80 121.76 111.11 1wmp s ALA 423 Ca -0.14 -0.65 -0.34 0.00 0.00 0.00 0.00 51.96 50.83 1wmp s ALA 423 Cb 0.07 0.77 -0.11 0.00 0.00 0.00 0.00 23.12 23.84 1wmp s ALA 423 CO 0.79 -0.99 1.94 -2.30 0.00 0.00 0.00 175.76 175.20 1wmp n PRO 424 N -0.50 1.95 -0.58 0.00 -0.02 -1.26 -1.07 135.00 133.52 1wmp n PRO 424 Ca -0.06 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 1wmp n PRO 424 Cb 0.60 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 1wmp n PRO 424 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wmp n GLY 425 N 4.76 0.96 3.60 -1.23 0.00 -1.26 -4.53 105.19 107.49 1wmp n GLY 425 Ca 0.26 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.90 1wmp n GLY 425 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1wmp s LEU 426 N 0.00 4.04 0.30 0.99 2.96 -0.23 -0.83 118.68 125.90 1wmp s LEU 426 Ca 0.00 0.04 0.08 0.00 -0.22 0.00 0.00 54.13 54.03 1wmp s LEU 426 Cb 0.00 -2.15 -0.04 0.00 0.50 0.00 0.00 46.19 44.50 1wmp s LEU 426 CO 0.00 -0.04 0.14 -0.83 -1.32 0.00 0.00 176.35 174.30 1wmp s GLY 427 N 1.63 1.70 -0.26 7.98 0.00 0.81 -0.68 107.32 118.50 1wmp s GLY 427 Ca 0.08 -1.65 -0.02 0.00 0.00 0.00 0.00 44.72 43.13 1wmp s GLY 427 CO 0.10 -1.64 0.09 0.00 0.00 0.00 0.00 173.10 171.65 1wmp s ALA 428 N -2.30 1.07 0.30 3.20 0.00 0.15 -1.16 121.76 123.01 1wmp s ALA 428 Ca 0.35 -1.15 -0.30 0.00 0.00 0.00 0.00 51.96 50.87 1wmp s ALA 428 Cb -0.05 -1.40 -0.12 0.00 0.00 0.00 0.00 23.12 21.55 1wmp s ALA 428 CO 0.23 -1.49 1.54 -2.30 0.00 0.00 0.00 175.76 173.75 1wmp n PRO 429 N 5.04 2.58 -1.83 0.00 -0.02 -1.26 -1.82 135.00 137.70 1wmp n PRO 429 Ca -0.05 0.92 -0.36 0.00 -2.02 0.00 0.00 63.50 61.98 1wmp n PRO 429 Cb 0.44 -2.67 0.05 0.00 -0.02 0.00 0.00 33.50 31.31 1wmp n PRO 429 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1wmp s PHE 430 N -0.21 2.25 0.19 6.00 0.08 -0.37 -4.85 117.98 121.07 1wmp s PHE 430 Ca 0.63 1.52 -0.22 0.00 0.12 0.00 0.00 56.93 58.98 1wmp s PHE 430 Cb -0.52 -3.54 0.08 0.00 -0.57 0.00 0.00 43.02 38.47 1wmp s PHE 430 CO 0.51 -2.48 1.03 -3.38 -0.10 0.00 0.00 175.22 170.81 1wmp s HIS 431 N -1.62 0.06 0.15 0.36 -3.43 -0.98 -0.36 115.29 109.47 1wmp s HIS 431 Ca 0.78 -0.47 0.04 0.00 -0.80 0.00 0.00 55.06 54.61 1wmp s HIS 431 Cb -0.32 0.70 -0.04 0.00 -1.43 0.00 0.00 32.58 31.49 1wmp s HIS 431 CO 0.37 -0.94 -0.08 -0.65 -2.00 0.00 0.00 174.74 171.44 1wmp s GLN 432 N -2.23 1.05 -0.29 -0.38 -0.21 -0.39 -0.35 119.66 116.86 1wmp s GLN 432 Ca 0.21 -1.46 0.01 0.00 0.02 0.00 0.00 55.36 54.15 1wmp s GLN 432 Cb -0.03 -0.53 0.09 0.00 1.00 0.00 0.00 33.01 33.54 1wmp s GLN 432 CO 0.05 0.03 0.04 -1.01 -2.12 0.00 0.00 175.29 172.28 1wmp s HIS 433 N -3.41 2.53 -0.15 0.91 3.76 0.12 -3.25 115.29 115.80 1wmp s HIS 433 Ca 0.17 -2.11 0.02 0.00 -0.15 0.00 0.00 55.06 52.99 1wmp s HIS 433 Cb 0.03 -2.03 0.01 0.00 1.11 0.00 0.00 32.58 31.71 1wmp s HIS 433 CO 0.01 -0.86 -0.20 0.42 -0.85 0.00 0.00 174.74 173.26 1wmp s ILE 434 N 1.34 2.22 0.22 0.60 1.01 0.40 -0.40 121.20 126.58 1wmp s ILE 434 Ca 0.05 -0.92 0.06 0.00 0.00 0.00 0.00 60.65 59.84 1wmp s ILE 434 Cb -0.18 -1.91 -0.04 0.00 0.01 0.00 0.00 42.46 40.34 1wmp s ILE 434 CO -0.14 0.54 0.18 -0.36 0.00 0.00 0.00 174.94 175.17 1wmp s PHE 435 N 0.92 3.15 -0.17 3.97 0.40 0.77 -0.21 117.98 126.80 1wmp s PHE 435 Ca -0.04 -0.07 -0.00 0.00 -0.60 0.00 0.00 56.93 56.22 1wmp s PHE 435 Cb -0.15 -1.45 0.04 0.00 0.51 0.00 0.00 43.02 41.97 1wmp s PHE 435 CO -0.04 0.52 -0.05 0.45 0.70 0.00 0.00 175.22 176.80 1wmp s SER 436 N -3.57 2.94 -0.22 1.36 0.15 -0.03 -1.76 113.70 112.58 1wmp s SER 436 Ca 0.32 -0.72 -0.15 0.00 0.70 0.00 0.00 55.95 56.10 1wmp s SER 436 Cb -0.09 -0.95 -0.04 0.00 -1.71 0.00 0.00 66.02 63.23 1wmp s SER 436 CO 0.25 -0.19 0.37 0.00 1.20 0.00 0.00 173.24 174.87 1wmp s ALA 437 N 1.60 3.56 -0.35 5.45 0.00 -0.02 -0.86 121.76 131.15 1wmp s ALA 437 Ca 0.00 -0.61 -0.13 0.00 0.00 0.00 0.00 51.96 51.22 1wmp s ALA 437 Cb -0.16 -2.62 -0.01 0.00 0.00 0.00 0.00 23.12 20.33 1wmp s ALA 437 CO -0.08 -0.36 0.25 0.50 0.00 0.00 0.00 175.76 176.08 1wmp s ARG 438 N 1.43 3.40 -0.36 0.00 3.52 0.24 -1.16 118.95 126.02 1wmp s ARG 438 Ca 0.17 -0.72 -0.00 0.00 -0.13 0.00 0.00 55.73 55.06 1wmp s ARG 438 Cb -0.15 -3.84 0.09 0.00 -1.56 0.00 0.00 34.95 29.50 1wmp s ARG 438 CO 0.08 -0.50 0.09 -0.51 -0.81 0.00 0.00 175.30 173.65 1wmp s LEU 439 N 1.71 4.71 -0.92 -0.88 1.43 0.14 -1.99 118.68 122.87 1wmp s LEU 439 Ca 0.06 -1.87 -0.24 0.00 -1.03 0.00 0.00 54.13 51.05 1wmp s LEU 439 Cb -0.18 -1.73 0.05 0.00 0.03 0.00 0.00 46.19 44.37 1wmp s LEU 439 CO 0.10 -0.41 1.37 -0.62 0.23 0.00 0.00 176.35 177.02 1wmp s ASP 440 N 1.38 6.40 0.70 2.29 -1.08 0.25 -0.20 116.67 126.41 1wmp s ASP 440 Ca 0.05 -1.19 -0.15 0.00 -0.52 0.00 0.00 52.55 50.74 1wmp s ASP 440 Cb -0.21 -2.55 0.02 0.00 -1.46 0.00 0.00 42.92 38.72 1wmp s ASP 440 CO -0.05 -1.57 1.15 -0.04 0.52 0.00 0.00 175.17 175.18 1wmp s MET 441 N 5.03 2.47 -0.41 4.34 -1.94 -1.02 0.08 119.30 127.86 1wmp s MET 441 Ca 0.41 1.54 0.08 0.00 -1.71 0.00 0.00 55.69 56.01 1wmp s MET 441 Cb -0.03 -1.90 0.35 0.00 2.01 0.00 0.00 34.83 35.26 1wmp s MET 441 CO -0.02 -1.53 1.29 0.00 -0.01 0.00 0.00 175.02 174.74 1wmp n ALA 442 N -2.61 0.46 -1.71 3.03 0.00 -0.33 -4.48 120.51 114.86 1wmp n ALA 442 Ca 0.12 -1.25 -0.36 0.00 0.00 0.00 0.00 53.44 51.95 1wmp n ALA 442 Cb 0.51 -1.08 -0.03 0.00 0.00 0.00 0.00 19.45 18.85 1wmp n ALA 442 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1wmp s ILE 443 N 0.20 3.12 -1.72 0.00 -1.09 -1.04 -2.21 121.20 118.45 1wmp s ILE 443 Ca 0.21 0.05 -0.00 0.00 -2.23 0.00 0.00 60.65 58.68 1wmp s ILE 443 Cb 0.35 -3.31 0.00 0.00 -1.58 0.00 0.00 42.46 37.92 1wmp s ILE 443 CO -0.08 -0.30 0.01 0.47 -1.23 0.00 0.00 174.94 173.81 1wmp n ASP 444 N 15.10 -5.75 0.00 3.58 8.00 0.75 -4.50 116.55 133.73 1wmp n ASP 444 Ca 0.32 -0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.82 1wmp n ASP 444 Cb 0.53 -4.79 0.00 0.00 -0.02 0.00 0.00 41.12 36.84 1wmp n ASP 444 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1wmp n GLY 445 N -1.00 2.00 0.07 0.44 0.00 -0.94 -4.88 105.19 100.89 1wmp n GLY 445 Ca -0.24 -2.09 0.13 0.00 0.00 0.00 0.00 46.02 43.82 1wmp n GLY 445 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1wmp n PHE 446 N -1.34 0.62 -2.48 1.61 3.72 -1.26 -4.22 117.46 114.12 1wmp n PHE 446 Ca 0.00 0.19 -0.39 0.00 -0.05 0.00 0.00 57.45 57.20 1wmp n PHE 446 Cb 0.00 -0.80 -0.03 0.00 -0.94 0.00 0.00 39.48 37.70 1wmp n PHE 446 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1wmp s THR 447 N -3.08 3.83 0.35 4.37 2.01 -1.26 -2.73 115.64 119.13 1wmp s THR 447 Ca 0.11 -0.63 0.05 0.00 0.31 0.00 0.00 61.69 61.53 1wmp s THR 447 Cb 0.14 -4.88 -0.07 0.00 0.01 0.00 0.00 72.50 67.70 1wmp s THR 447 CO 0.55 -1.77 0.03 0.20 -0.69 0.00 0.00 174.62 172.94 1wmp s ASN 448 N 5.42 2.91 0.10 3.53 0.01 -0.33 -4.12 114.94 122.45 1wmp s ASN 448 Ca 0.49 -1.36 -0.17 0.00 -0.71 0.00 0.00 52.86 51.11 1wmp s ASN 448 Cb -0.02 -0.20 0.03 0.00 0.41 0.00 0.00 41.25 41.48 1wmp s ASN 448 CO -0.07 -0.54 0.40 0.00 -1.51 0.00 0.00 177.10 175.38 1wmp s ARG 449 N -3.82 1.01 -0.05 -0.60 1.70 -0.47 -0.72 118.95 116.00 1wmp s ARG 449 Ca 0.36 -0.59 0.06 0.00 -0.47 0.00 0.00 55.73 55.08 1wmp s ARG 449 Cb 0.09 0.45 -0.02 0.00 -0.57 0.00 0.00 34.95 34.90 1wmp s ARG 449 CO 0.16 -0.38 -0.22 0.08 -1.08 0.00 0.00 175.30 173.87 1wmp s VAL 450 N -3.34 2.39 -0.04 4.99 1.01 -1.26 -1.22 120.40 122.93 1wmp s VAL 450 Ca 0.00 -0.96 0.06 0.00 0.00 0.00 0.00 61.98 61.07 1wmp s VAL 450 Cb 0.01 -1.88 -0.01 0.00 0.00 0.00 0.00 36.38 34.50 1wmp s VAL 450 CO -0.09 0.58 -0.21 -1.61 0.00 0.00 0.00 175.10 173.77 1wmp s GLU 451 N -0.42 2.05 -0.19 2.72 2.02 -0.07 -1.02 118.70 123.79 1wmp s GLU 451 Ca 0.04 -0.76 -0.18 0.00 0.02 0.00 0.00 54.97 54.09 1wmp s GLU 451 Cb -0.12 -1.82 -0.03 0.00 0.10 0.00 0.00 34.13 32.26 1wmp s GLU 451 CO 0.01 0.36 0.50 -2.00 0.02 0.00 0.00 175.26 174.15 1wmp s GLU 452 N -0.19 4.20 -0.20 1.61 2.12 -0.03 -0.64 118.70 125.57 1wmp s GLU 452 Ca -0.00 0.39 -0.04 0.00 0.36 0.00 0.00 54.97 55.67 1wmp s GLU 452 Cb -0.11 -3.55 -0.02 0.00 0.26 0.00 0.00 34.13 30.71 1wmp s GLU 452 CO 0.02 -0.10 -0.04 -2.00 -0.54 0.00 0.00 175.26 172.60 1wmp s GLU 453 N 1.49 3.48 0.06 4.30 2.12 0.24 -1.45 118.70 128.93 1wmp s GLU 453 Ca 0.23 -0.59 0.09 0.00 0.36 0.00 0.00 54.97 55.06 1wmp s GLU 453 Cb -0.15 -2.99 -0.03 0.00 0.26 0.00 0.00 34.13 31.21 1wmp s GLU 453 CO 0.09 -0.06 -0.23 -0.51 -0.54 0.00 0.00 175.26 174.02 1wmp s ASP 454 N 1.13 3.44 0.44 -1.70 1.01 -0.61 -1.62 116.67 118.76 1wmp s ASP 454 Ca 0.02 -0.55 -0.23 0.00 0.71 0.00 0.00 52.55 52.50 1wmp s ASP 454 Cb -0.15 -0.40 -0.08 0.00 1.01 0.00 0.00 42.92 43.30 1wmp s ASP 454 CO -0.00 0.25 1.11 -0.69 0.21 0.00 0.00 175.17 176.05 1wmp s VAL 455 N -0.89 3.40 -0.15 -1.27 1.01 0.42 -0.88 120.40 122.03 1wmp s VAL 455 Ca 0.13 1.05 0.00 0.00 0.00 0.00 0.00 61.98 63.16 1wmp s VAL 455 Cb -0.10 -3.53 0.03 0.00 0.00 0.00 0.00 36.38 32.77 1wmp s VAL 455 CO 0.04 -0.01 -0.13 -0.69 0.00 0.00 0.00 175.10 174.31 1wmp s VAL 456 N -1.61 1.50 0.43 2.92 1.01 0.48 -4.82 120.40 120.31 1wmp s VAL 456 Ca 0.61 -0.63 -0.17 0.00 0.00 0.00 0.00 61.98 61.80 1wmp s VAL 456 Cb -0.25 -1.44 -0.09 0.00 0.00 0.00 0.00 36.38 34.60 1wmp s VAL 456 CO 0.31 0.41 0.89 -0.13 0.00 0.00 0.00 175.10 176.58 1wmp s ARG 457 N 1.51 4.01 0.06 2.72 0.52 -1.26 0.20 118.95 126.71 1wmp s ARG 457 Ca 0.04 0.87 0.08 0.00 -0.52 0.00 0.00 55.73 56.20 1wmp s ARG 457 Cb -0.13 -2.25 -0.03 0.00 0.52 0.00 0.00 34.95 33.06 1wmp s ARG 457 CO -0.10 -0.08 -0.22 -0.65 0.02 0.00 0.00 175.30 174.27 1wmp s GLN 458 N -3.56 1.40 0.15 3.54 -0.21 -1.24 -4.85 119.66 114.88 1wmp s GLN 458 Ca 0.58 -1.01 -0.20 0.00 0.02 0.00 0.00 55.36 54.74 1wmp s GLN 458 Cb -0.10 -1.56 -0.07 0.00 1.00 0.00 0.00 33.01 32.28 1wmp s GLN 458 CO 0.23 0.39 0.67 0.99 -2.12 0.00 0.00 175.29 175.45 1wmp s THR 459 N -0.87 4.60 0.38 -0.19 2.01 -1.26 -4.87 115.64 115.44 1wmp s THR 459 Ca 0.08 1.33 -0.28 0.00 0.31 0.00 0.00 61.69 63.13 1wmp s THR 459 Cb -0.09 -3.93 -0.11 0.00 0.01 0.00 0.00 72.50 68.38 1wmp s THR 459 CO 0.02 0.41 1.45 -0.32 -0.69 0.00 0.00 174.62 175.50 1wmp s MET 460 N -1.46 4.11 0.00 4.92 1.75 -1.26 -4.83 119.30 122.54 1wmp s MET 460 Ca 0.36 2.50 0.00 0.00 -1.25 0.00 0.00 55.69 57.30 1wmp s MET 460 Cb -0.19 -2.96 0.00 0.00 2.84 0.00 0.00 34.83 34.52 1wmp s MET 460 CO 0.22 -0.50 0.00 0.41 -0.65 0.00 0.00 175.02 174.50 1wmp n GLY 461 N 0.52 -0.52 3.64 2.11 0.00 -0.12 -4.96 105.19 105.86 1wmp n GLY 461 Ca 0.01 -1.25 -0.51 0.00 0.00 0.00 0.00 46.02 44.27 1wmp n GLY 461 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1wmp n PRO 462 N 0.00 1.51 -0.14 1.61 -0.02 -1.26 0.66 135.00 137.37 1wmp n PRO 462 Ca 0.00 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 1wmp n PRO 462 Cb 0.00 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.23 1wmp n PRO 462 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wmp n GLY 463 N 3.27 1.71 2.68 -1.23 0.00 -1.26 -4.79 105.19 105.58 1wmp n GLY 463 Ca 0.20 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.14 1wmp n GLY 463 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1wmp n ASN 464 N 0.00 -1.49 -0.01 1.61 5.15 0.21 -5.00 115.26 115.73 1wmp n ASN 464 Ca 0.00 -2.79 0.14 0.00 -0.60 0.00 0.00 54.58 51.33 1wmp n ASN 464 Cb 0.00 0.97 0.58 0.00 -0.53 0.00 0.00 39.78 40.80 1wmp n ASN 464 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 1wmp h GLU 465 N 2.39 0.21 -0.01 1.20 3.07 -1.27 -0.07 114.58 120.10 1wmp h GLU 465 Ca -0.20 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.65 1wmp h GLU 465 Cb 1.23 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 29.09 1wmp h GLU 465 CO 0.07 0.14 -0.15 0.54 -1.40 0.00 0.00 179.01 178.21 1wmp n ARG 466 N -4.45 1.09 -2.67 2.33 1.74 -1.26 -4.59 116.66 108.86 1wmp n ARG 466 Ca 0.08 -0.61 -0.22 0.00 -0.77 0.00 0.00 57.85 56.33 1wmp n ARG 466 Cb 0.42 -1.49 0.01 0.00 -1.02 0.00 0.00 32.46 30.38 1wmp n ARG 466 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wmp n GLY 467 N 1.27 -0.51 0.00 -0.13 0.00 -0.71 -4.89 105.19 100.24 1wmp n GLY 467 Ca 0.15 0.05 0.09 0.00 0.00 0.00 0.00 46.02 46.31 1wmp n GLY 467 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1wmp n ASN 468 N -2.23 0.88 -4.77 1.61 6.94 -1.26 -4.85 115.26 111.58 1wmp n ASN 468 Ca -0.19 -0.41 -0.36 0.00 -0.02 0.00 0.00 54.58 53.59 1wmp n ASN 468 Cb 0.66 1.44 -0.01 0.00 -2.36 0.00 0.00 39.78 39.51 1wmp n ASN 468 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1wmp s ALA 469 N -2.96 2.91 -0.01 -2.53 0.00 -1.26 -5.06 121.76 112.85 1wmp s ALA 469 Ca -0.01 0.88 -0.20 0.00 0.00 0.00 0.00 51.96 52.63 1wmp s ALA 469 Cb 0.12 -3.36 0.04 0.00 0.00 0.00 0.00 23.12 19.92 1wmp s ALA 469 CO 0.72 -0.64 0.43 -0.59 0.00 0.00 0.00 175.76 175.69 1wmp s PHE 470 N -1.63 -0.33 0.00 0.00 -0.12 -1.26 -3.66 117.98 110.98 1wmp s PHE 470 Ca 0.66 0.50 0.00 0.00 -0.05 0.00 0.00 56.93 58.04 1wmp s PHE 470 Cb -0.26 0.21 0.00 0.00 -0.63 0.00 0.00 43.02 42.33 1wmp s PHE 470 CO 0.32 -0.49 0.00 0.45 -0.05 0.00 0.00 175.22 175.45 1wmp n SER 471 N 1.03 0.36 -3.68 1.98 2.88 0.13 -4.98 113.62 111.33 1wmp n SER 471 Ca -0.20 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.24 1wmp n SER 471 Cb 0.57 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.98 1wmp n SER 471 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wmp s ARG 472 N 1.43 1.01 0.01 -1.46 1.70 -1.26 -0.38 118.95 120.00 1wmp s ARG 472 Ca 0.00 -0.74 -0.02 0.00 -0.47 0.00 0.00 55.73 54.50 1wmp s ARG 472 Cb 0.00 0.44 -0.01 0.00 -0.57 0.00 0.00 34.95 34.81 1wmp s ARG 472 CO 0.00 -0.38 0.02 -1.59 -1.08 0.00 0.00 175.30 172.27 1wmp s LYS 473 N -3.74 0.27 -0.05 3.89 -2.85 -0.06 -4.80 119.74 112.40 1wmp s LYS 473 Ca 0.03 -0.40 0.04 0.00 -1.00 0.00 0.00 55.97 54.64 1wmp s LYS 473 Cb 0.02 0.10 0.00 0.00 -2.06 0.00 0.00 37.83 35.90 1wmp s LYS 473 CO -0.11 -0.05 -0.17 1.03 0.10 0.00 0.00 175.35 176.15 1wmp s ARG 474 N -1.05 1.87 -0.16 1.78 0.52 -1.26 -1.57 118.95 119.08 1wmp s ARG 474 Ca -0.12 -0.59 0.00 0.00 -0.52 0.00 0.00 55.73 54.51 1wmp s ARG 474 Cb -0.07 -1.59 0.02 0.00 0.52 0.00 0.00 34.95 33.84 1wmp s ARG 474 CO -0.00 0.20 -0.15 0.99 0.02 0.00 0.00 175.30 176.36 1wmp s THR 475 N 0.18 1.65 0.15 0.02 2.01 -0.53 -4.92 115.64 114.21 1wmp s THR 475 Ca -0.07 -0.71 -0.30 0.00 0.31 0.00 0.00 61.69 60.91 1wmp s THR 475 Cb -0.13 -1.56 -0.07 0.00 0.01 0.00 0.00 72.50 70.75 1wmp s THR 475 CO 0.03 0.44 1.14 -0.69 -0.69 0.00 0.00 174.62 174.85 1wmp s VAL 476 N 1.45 3.87 -0.44 3.82 1.01 -1.26 -0.85 120.40 128.00 1wmp s VAL 476 Ca 0.04 1.53 -0.23 0.00 0.00 0.00 0.00 61.98 63.33 1wmp s VAL 476 Cb -0.13 -3.98 0.02 0.00 0.00 0.00 0.00 36.38 32.29 1wmp s VAL 476 CO -0.11 0.23 0.76 -0.76 0.00 0.00 0.00 175.10 175.21 1wmp s LEU 477 N -0.01 4.29 -0.07 3.92 1.43 -0.19 -4.93 118.68 123.12 1wmp s LEU 477 Ca 0.52 -0.11 0.17 0.00 -1.03 0.00 0.00 54.13 53.69 1wmp s LEU 477 Cb -0.30 -2.92 -0.23 0.00 0.03 0.00 0.00 46.19 42.77 1wmp s LEU 477 CO 0.34 -0.87 0.45 0.35 0.23 0.00 0.00 176.35 176.84 1wmp n THR 478 N 6.05 1.15 -4.20 5.49 -2.24 -1.26 -4.28 114.28 114.99 1wmp n THR 478 Ca 0.02 -0.75 -0.18 0.00 -2.27 0.00 0.00 64.05 60.87 1wmp n THR 478 Cb 0.48 -0.56 -0.12 0.00 -2.10 0.00 0.00 70.33 68.03 1wmp n THR 478 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1wmp s ARG 479 N -2.79 0.82 0.41 -0.78 1.81 -1.26 -1.17 118.95 115.99 1wmp s ARG 479 Ca -0.07 -0.90 0.11 0.00 -1.72 0.00 0.00 55.73 53.16 1wmp s ARG 479 Cb 0.08 -0.82 0.94 0.00 -0.45 0.00 0.00 34.95 34.70 1wmp s ARG 479 CO 0.84 0.19 1.96 0.93 -0.68 0.00 0.00 175.30 178.53 1wmp h GLU 480 N 4.44 0.50 0.00 3.54 5.08 -1.60 0.05 114.58 126.59 1wmp h GLU 480 Ca -0.40 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 1wmp h GLU 480 Cb 1.19 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1wmp h GLU 480 CO 0.41 0.33 0.01 0.66 -1.00 0.00 0.00 179.01 179.42 1wmp h SER 481 N 0.52 0.00 -0.11 1.42 4.64 -1.86 0.02 113.55 118.17 1wmp h SER 481 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 1wmp h SER 481 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1wmp h SER 481 CO -0.10 0.00 0.00 -1.84 -0.87 0.00 0.00 176.83 174.02 1wmp n GLU 482 N -2.88 2.43 -0.92 4.77 0.28 -0.02 -4.66 120.64 119.63 1wmp n GLU 482 Ca -0.03 -2.19 -0.08 0.00 -0.16 0.00 0.00 57.16 54.71 1wmp n GLU 482 Cb 0.07 -1.37 0.24 0.00 1.43 0.00 0.00 31.44 31.81 1wmp n GLU 482 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1wmp n ALA 483 N -0.61 4.51 -3.63 -1.84 0.00 -0.01 -4.79 120.51 114.13 1wmp n ALA 483 Ca 0.11 -2.71 -0.39 0.00 0.00 0.00 0.00 53.44 50.45 1wmp n ALA 483 Cb 0.53 -1.06 -0.09 0.00 0.00 0.00 0.00 19.45 18.83 1wmp n ALA 483 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1wmp s VAL 484 N -3.12 4.01 0.18 0.00 1.01 -1.26 -1.52 120.40 119.69 1wmp s VAL 484 Ca 0.51 -2.32 0.07 0.00 0.00 0.00 0.00 61.98 60.23 1wmp s VAL 484 Cb 0.43 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 33.14 1wmp s VAL 484 CO 0.08 -0.82 0.05 -0.13 0.00 0.00 0.00 175.10 174.28 1wmp s ARG 485 N 0.70 2.58 0.14 2.72 1.81 0.12 -4.99 118.95 122.02 1wmp s ARG 485 Ca 0.11 -1.04 0.06 0.00 -1.72 0.00 0.00 55.73 53.14 1wmp s ARG 485 Cb -0.22 -2.45 -0.04 0.00 -0.45 0.00 0.00 34.95 31.79 1wmp s ARG 485 CO -0.03 0.46 0.04 -1.21 -0.68 0.00 0.00 175.30 173.88 1wmp s GLU 486 N -3.05 2.61 0.79 3.54 2.02 -1.26 -1.69 118.70 121.67 1wmp s GLU 486 Ca 0.29 -0.94 -0.11 0.00 0.02 0.00 0.00 54.97 54.23 1wmp s GLU 486 Cb -0.09 -2.51 0.06 0.00 0.10 0.00 0.00 34.13 31.69 1wmp s GLU 486 CO 0.20 0.49 1.10 0.00 0.02 0.00 0.00 175.26 177.08 1wmp s ALA 487 N -1.60 2.34 -0.49 5.21 0.00 -1.26 -4.93 121.76 121.03 1wmp s ALA 487 Ca 0.28 -0.24 0.07 0.00 0.00 0.00 0.00 51.96 52.07 1wmp s ALA 487 Cb -0.10 -3.09 0.19 0.00 0.00 0.00 0.00 23.12 20.11 1wmp s ALA 487 CO 0.20 -1.65 0.66 0.34 0.00 0.00 0.00 175.76 175.31 1wmp s ASP 488 N -3.98 -1.06 0.32 0.00 -1.08 -1.26 -5.02 116.67 104.58 1wmp s ASP 488 Ca 0.60 -1.74 0.04 0.00 -0.52 0.00 0.00 52.55 50.93 1wmp s ASP 488 Cb -0.14 1.61 0.64 0.00 -1.46 0.00 0.00 42.92 43.57 1wmp s ASP 488 CO 0.54 -0.09 1.89 0.00 0.52 0.00 0.00 175.17 178.03 1wmp h ALA 489 N 5.43 1.63 -0.66 3.66 0.00 -1.93 -1.95 119.26 125.44 1wmp h ALA 489 Ca 0.08 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.03 1wmp h ALA 489 Cb 1.10 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.64 1wmp h ALA 489 CO 0.07 0.18 0.43 -0.09 0.00 0.00 0.00 179.25 179.85 1wmp h ARG 490 N 0.90 0.74 -0.58 0.00 2.43 -1.99 -1.03 114.38 114.85 1wmp h ARG 490 Ca 0.42 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.55 1wmp h ARG 490 Cb 0.42 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 1wmp h ARG 490 CO -0.19 0.49 0.00 0.25 -1.51 0.00 0.00 179.97 179.02 1wmp n THR 491 N -4.46 2.13 -3.96 0.20 -2.24 -0.90 -4.94 114.28 100.10 1wmp n THR 491 Ca 0.08 -1.33 -0.30 0.00 -2.27 0.00 0.00 64.05 60.24 1wmp n THR 491 Cb 0.14 -0.02 0.01 0.00 -2.10 0.00 0.00 70.33 68.37 1wmp n THR 491 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wmp n GLY 492 N 0.79 -0.43 3.73 3.38 0.00 -0.39 -0.44 105.19 111.83 1wmp n GLY 492 Ca 0.25 0.17 -0.42 0.00 0.00 0.00 0.00 46.02 46.02 1wmp n GLY 492 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1wmp s ARG 493 N -6.60 4.26 0.24 1.61 3.52 -0.78 -4.55 118.95 116.65 1wmp s ARG 493 Ca 0.52 2.27 0.01 0.00 -0.13 0.00 0.00 55.73 58.40 1wmp s ARG 493 Cb -0.27 -3.16 -0.04 0.00 -1.56 0.00 0.00 34.95 29.93 1wmp s ARG 493 CO 0.86 -0.49 0.16 0.95 -0.81 0.00 0.00 175.30 175.97 1wmp s THR 494 N 0.68 0.07 -0.05 4.11 -4.23 -0.64 -4.72 115.64 110.86 1wmp s THR 494 Ca 0.64 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 59.18 1wmp s THR 494 Cb -0.41 -2.51 0.01 0.00 1.34 0.00 0.00 72.50 70.92 1wmp s THR 494 CO 0.36 0.00 -0.13 0.26 -0.54 0.00 0.00 174.62 174.57 1wmp s TRP 495 N -3.91 1.43 -0.18 3.99 0.51 -1.14 -0.60 118.94 119.04 1wmp s TRP 495 Ca 0.39 -0.47 -0.05 0.00 -2.12 0.00 0.00 56.10 53.85 1wmp s TRP 495 Cb 0.06 -1.02 -0.03 0.00 -0.81 0.00 0.00 33.47 31.67 1wmp s TRP 495 CO 0.16 -0.22 -0.01 0.42 -0.51 0.00 0.00 176.95 176.80 1wmp s ILE 496 N 0.42 4.07 -0.27 2.03 1.01 0.19 0.42 121.20 129.07 1wmp s ILE 496 Ca -0.10 -0.29 -0.09 0.00 0.00 0.00 0.00 60.65 60.17 1wmp s ILE 496 Cb -0.13 -2.81 -0.04 0.00 0.01 0.00 0.00 42.46 39.49 1wmp s ILE 496 CO 0.03 0.46 0.14 -0.63 0.00 0.00 0.00 174.94 174.94 1wmp s ILE 497 N 0.60 4.84 0.34 2.92 1.09 0.40 -0.89 121.20 130.50 1wmp s ILE 497 Ca -0.01 -0.03 0.04 0.00 -1.10 0.00 0.00 60.65 59.55 1wmp s ILE 497 Cb -0.14 -3.31 -0.05 0.00 -1.06 0.00 0.00 42.46 37.90 1wmp s ILE 497 CO 0.02 0.27 0.07 -0.94 -0.10 0.00 0.00 174.94 174.26 1wmp s SER 498 N 1.69 2.42 -0.30 3.58 1.04 -0.36 -0.83 113.70 120.94 1wmp s SER 498 Ca 0.07 -1.45 0.03 0.00 0.48 0.00 0.00 55.95 55.08 1wmp s SER 498 Cb -0.16 0.07 0.08 0.00 0.10 0.00 0.00 66.02 66.11 1wmp s SER 498 CO 0.08 -0.69 -0.04 0.21 0.98 0.00 0.00 173.24 173.78 1wmp s ASN 499 N -3.51 4.61 0.00 7.02 3.84 -0.73 -1.36 114.94 124.80 1wmp s ASN 499 Ca 0.33 -1.72 0.07 0.00 0.21 0.00 0.00 52.86 51.75 1wmp s ASN 499 Cb 0.07 -1.59 0.31 0.00 -0.55 0.00 0.00 41.25 39.49 1wmp s ASN 499 CO 0.15 -0.28 1.19 -0.81 -2.79 0.00 0.00 177.10 174.56 1wmp n PRO 500 N 4.36 0.02 -0.01 0.43 -0.04 -1.26 -2.21 135.00 136.31 1wmp n PRO 500 Ca -0.06 0.34 0.08 0.00 -0.04 0.00 0.00 63.50 63.82 1wmp n PRO 500 Cb 0.42 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.45 1wmp n PRO 500 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1wmp n GLU 501 N -1.45 1.19 -3.94 0.54 1.02 -1.26 -4.88 120.64 111.86 1wmp n GLU 501 Ca 0.02 -1.45 -0.28 0.00 -0.02 0.00 0.00 57.16 55.43 1wmp n GLU 501 Cb 0.08 -1.30 -0.17 0.00 -0.02 0.00 0.00 31.44 30.03 1wmp n GLU 501 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1wmp s SER 502 N -1.27 2.58 0.16 1.62 0.15 -0.94 -5.10 113.70 110.89 1wmp s SER 502 Ca 0.18 -0.49 0.10 0.00 0.70 0.00 0.00 55.95 56.45 1wmp s SER 502 Cb 0.13 -0.99 -0.04 0.00 -1.71 0.00 0.00 66.02 63.41 1wmp s SER 502 CO 0.19 -0.12 -0.20 -0.54 1.20 0.00 0.00 173.24 173.77 1wmp s LYS 503 N 1.60 1.67 0.90 5.44 1.02 -1.26 -0.87 119.74 128.24 1wmp s LYS 503 Ca 0.03 -1.35 -0.13 0.00 0.02 0.00 0.00 55.97 54.54 1wmp s LYS 503 Cb -0.14 -1.99 0.17 0.00 -0.52 0.00 0.00 37.83 35.35 1wmp s LYS 503 CO -0.09 0.44 1.25 0.54 -0.92 0.00 0.00 175.35 176.57 1wmp s ASN 504 N -2.44 3.56 0.30 2.83 2.20 0.45 -4.81 114.94 117.03 1wmp s ASN 504 Ca 0.20 0.28 0.20 0.00 -0.94 0.00 0.00 52.86 52.59 1wmp s ASN 504 Cb -0.09 -0.46 1.08 0.00 -2.00 0.00 0.00 41.25 39.78 1wmp s ASN 504 CO 0.10 -2.45 1.60 -2.11 -2.94 0.00 0.00 177.10 171.31 1wmp n ARG 505 N -3.54 0.13 -0.52 3.55 1.85 -1.26 -0.12 116.66 116.75 1wmp n ARG 505 Ca 0.14 0.63 0.07 0.00 -1.00 0.00 0.00 57.85 57.68 1wmp n ARG 505 Cb 0.60 -1.94 0.28 0.00 -1.05 0.00 0.00 32.46 30.34 1wmp n ARG 505 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1wmp n LEU 506 N -2.20 3.89 -3.62 2.89 4.77 -1.26 -4.90 117.00 116.58 1wmp n LEU 506 Ca -0.01 -1.97 -0.23 0.00 -0.03 0.00 0.00 56.01 53.77 1wmp n LEU 506 Cb 0.05 -0.53 0.07 0.00 -2.33 0.00 0.00 43.42 40.68 1wmp n LEU 506 CO 0.09 0.61 0.18 -3.20 -1.33 0.00 0.00 177.39 173.74 1wmp n ASN 507 N 0.71 -4.97 -4.22 -1.43 4.05 0.83 -5.00 115.26 105.23 1wmp n ASN 507 Ca 0.20 -0.61 -0.30 0.00 0.45 0.00 0.00 54.58 54.32 1wmp n ASN 507 Cb 0.76 -4.84 -0.16 0.00 1.23 0.00 0.00 39.78 36.77 1wmp n ASN 507 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 177.26 173.51 1wmp s GLU 508 N -6.14 2.30 0.12 1.20 2.56 -1.24 -4.87 118.70 112.64 1wmp s GLU 508 Ca 0.44 -0.81 -0.34 0.00 0.00 0.00 0.00 54.97 54.27 1wmp s GLU 508 Cb -0.20 -1.96 -0.14 0.00 2.00 0.00 0.00 34.13 33.83 1wmp s GLU 508 CO 0.75 0.33 1.62 -2.30 -0.56 0.00 0.00 175.26 175.10 1wmp n PRO 509 N 3.02 2.14 -1.91 4.30 -0.02 -1.26 -0.41 135.00 140.86 1wmp n PRO 509 Ca -0.18 0.77 -0.34 0.00 -2.02 0.00 0.00 63.50 61.73 1wmp n PRO 509 Cb 0.52 -2.55 0.04 0.00 -0.02 0.00 0.00 33.50 31.49 1wmp n PRO 509 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1wmp s VAL 510 N 1.41 2.95 0.20 -1.45 -7.23 -0.05 -4.81 120.40 111.42 1wmp s VAL 510 Ca 0.81 0.52 -0.22 0.00 -1.81 0.00 0.00 61.98 61.27 1wmp s VAL 510 Cb -0.69 -3.11 0.07 0.00 0.56 0.00 0.00 36.38 33.22 1wmp s VAL 510 CO 0.40 -0.20 0.99 -0.83 -0.31 0.00 0.00 175.10 175.16 1wmp s GLY 511 N -2.05 0.04 -0.01 2.32 0.00 -1.06 -1.78 107.32 104.78 1wmp s GLY 511 Ca 0.72 -0.24 0.03 0.00 0.00 0.00 0.00 44.72 45.22 1wmp s GLY 511 CO 0.36 1.45 -0.08 -0.19 0.00 0.00 0.00 173.10 174.64 1wmp s TYR 512 N -2.50 0.79 -0.21 1.90 1.51 -0.01 0.34 117.35 119.17 1wmp s TYR 512 Ca 0.18 -0.16 -0.07 0.00 -1.01 0.00 0.00 57.07 56.01 1wmp s TYR 512 Cb -0.02 -0.52 -0.04 0.00 -0.11 0.00 0.00 41.96 41.26 1wmp s TYR 512 CO 0.05 -0.03 0.07 0.21 -1.11 0.00 0.00 175.55 174.74 1wmp s LYS 513 N -0.11 3.83 -0.23 -0.62 2.20 0.11 -0.45 119.74 124.48 1wmp s LYS 513 Ca 0.02 -0.40 -0.21 0.00 -0.36 0.00 0.00 55.97 55.01 1wmp s LYS 513 Cb -0.04 -3.27 -0.02 0.00 -1.51 0.00 0.00 37.83 32.98 1wmp s LYS 513 CO -0.00 0.06 0.65 -1.17 -0.36 0.00 0.00 175.35 174.53 1wmp s LEU 514 N 0.96 4.10 -0.27 5.43 2.96 0.17 -1.02 118.68 131.00 1wmp s LEU 514 Ca 0.04 0.80 -0.07 0.00 -0.22 0.00 0.00 54.13 54.68 1wmp s LEU 514 Cb -0.14 -2.91 -0.01 0.00 0.50 0.00 0.00 46.19 43.63 1wmp s LEU 514 CO 0.03 -0.34 0.07 -1.00 -1.32 0.00 0.00 176.35 173.78 1wmp s HIS 515 N 2.27 3.11 0.35 5.38 3.76 0.62 -2.88 115.29 127.89 1wmp s HIS 515 Ca 0.28 -0.74 0.02 0.00 -0.15 0.00 0.00 55.06 54.47 1wmp s HIS 515 Cb -0.16 -2.24 -0.02 0.00 1.11 0.00 0.00 32.58 31.27 1wmp s HIS 515 CO 0.09 -0.49 0.53 0.00 -0.85 0.00 0.00 174.74 174.03 1wmp s ALA 516 N 1.55 3.80 -1.33 -1.40 0.00 -1.26 -2.39 121.76 120.72 1wmp s ALA 516 Ca 0.04 -1.04 0.28 0.00 0.00 0.00 0.00 51.96 51.24 1wmp s ALA 516 Cb -0.16 -2.01 1.05 0.00 0.00 0.00 0.00 23.12 21.99 1wmp s ALA 516 CO 0.03 -0.04 1.76 0.72 0.00 0.00 0.00 175.76 178.23 1wmp n HIS 517 N -1.76 0.00 -3.79 0.00 8.25 -1.26 -4.95 115.22 111.71 1wmp n HIS 517 Ca -0.04 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.15 1wmp n HIS 517 Cb 0.57 -0.28 0.04 0.00 1.12 0.00 0.00 29.99 31.44 1wmp n HIS 517 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1wmp n ASN 518 N -1.21 -4.80 -4.88 0.41 3.02 -1.26 -4.99 115.26 101.55 1wmp n ASN 518 Ca 0.10 -0.71 -0.30 0.00 -0.03 0.00 0.00 54.58 53.64 1wmp n ASN 518 Cb 0.31 -4.27 0.03 0.00 -0.61 0.00 0.00 39.78 35.23 1wmp n ASN 518 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1wmp s GLN 519 N -6.43 3.25 0.52 3.52 -1.52 -1.26 -4.96 119.66 112.78 1wmp s GLN 519 Ca 0.55 0.56 -0.23 0.00 -1.95 0.00 0.00 55.36 54.30 1wmp s GLN 519 Cb -0.27 -2.08 -0.06 0.00 -0.22 0.00 0.00 33.01 30.38 1wmp s GLN 519 CO 0.80 -0.75 1.36 -2.14 -0.25 0.00 0.00 175.29 174.31 1wmp s PRO 520 N -5.22 3.29 0.00 2.91 0.02 -1.26 -4.85 135.00 129.89 1wmp s PRO 520 Ca 0.56 2.25 0.00 0.00 0.02 0.00 0.00 61.00 63.82 1wmp s PRO 520 Cb -0.11 -2.35 0.00 0.00 0.02 0.00 0.00 34.50 32.06 1wmp s PRO 520 CO 0.52 -1.08 0.00 0.25 -0.33 0.00 0.00 177.00 176.36 1wmp n THR 521 N -0.83 0.00 -1.68 0.99 -2.24 -1.26 -4.57 114.28 104.70 1wmp n THR 521 Ca 0.09 0.00 -0.49 0.00 -2.27 0.00 0.00 64.05 61.39 1wmp n THR 521 Cb 0.44 -1.27 -0.05 0.00 -2.10 0.00 0.00 70.33 67.36 1wmp n THR 521 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1wmp n LEU 522 N 0.00 3.20 0.11 3.22 7.94 0.55 -4.88 117.00 127.14 1wmp n LEU 522 Ca 0.00 1.02 0.11 0.00 -1.11 0.00 0.00 56.01 56.02 1wmp n LEU 522 Cb 0.00 -1.36 0.01 0.00 0.53 0.00 0.00 43.42 42.60 1wmp n LEU 522 CO 0.00 -0.19 0.09 -0.07 -1.11 0.00 0.00 177.39 176.11 1wmp h LEU 523 N 7.98 0.00 -9.78 -1.96 3.38 -1.93 -3.46 115.31 109.54 1wmp h LEU 523 Ca -0.47 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 56.94 1wmp h LEU 523 Cb 1.27 0.00 0.18 0.00 0.09 0.00 0.00 40.66 42.20 1wmp h LEU 523 CO 0.93 0.05 -0.15 0.00 0.09 0.00 0.00 178.44 179.36 1wmp n ALA 524 N -2.19 -0.81 -1.71 1.53 0.00 -1.26 -4.90 120.51 111.17 1wmp n ALA 524 Ca -0.00 -0.18 -0.41 0.00 0.00 0.00 0.00 53.44 52.85 1wmp n ALA 524 Cb 0.57 -1.98 0.01 0.00 0.00 0.00 0.00 19.45 18.05 1wmp n ALA 524 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1wmp n ASP 525 N -0.82 2.72 0.27 0.00 -0.08 -1.26 -4.87 116.55 112.52 1wmp n ASP 525 Ca 0.12 1.12 0.18 0.00 -1.51 0.00 0.00 54.79 54.70 1wmp n ASP 525 Cb 0.49 -1.52 0.94 0.00 2.34 0.00 0.00 41.12 43.37 1wmp n ASP 525 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1wmp h PRO 526 N 2.17 0.00 -0.03 -0.67 0.11 -1.97 -1.33 132.00 130.27 1wmp h PRO 526 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1wmp h PRO 526 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1wmp h PRO 526 CO 0.60 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.80 1wmp n GLY 527 N -1.29 0.35 3.80 -0.55 0.00 -1.26 -4.72 105.19 101.53 1wmp n GLY 527 Ca -0.01 -0.52 -0.31 0.00 0.00 0.00 0.00 46.02 45.18 1wmp n GLY 527 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wmp s SER 528 N -1.97 5.19 0.16 1.61 1.04 -0.50 -4.96 113.70 114.26 1wmp s SER 528 Ca 0.35 1.70 -0.13 0.00 0.48 0.00 0.00 55.95 58.35 1wmp s SER 528 Cb 0.21 -2.51 0.05 0.00 0.10 0.00 0.00 66.02 63.87 1wmp s SER 528 CO 0.32 -1.57 1.71 -1.28 0.98 0.00 0.00 173.24 173.40 1wmp h SER 529 N -0.68 0.73 -0.40 7.02 0.87 -1.92 -2.84 113.55 116.33 1wmp h SER 529 Ca -0.44 -0.17 -0.03 0.00 -1.23 0.00 0.00 61.79 59.92 1wmp h SER 529 Cb 1.22 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.97 1wmp h SER 529 CO 0.55 0.70 0.17 -0.29 -0.53 0.00 0.00 176.83 177.44 1wmp h ILE 530 N 0.72 1.17 0.00 2.23 6.09 -1.92 -0.30 117.51 125.50 1wmp h ILE 530 Ca 0.18 -0.55 -0.06 0.00 -1.37 0.00 0.00 64.86 63.06 1wmp h ILE 530 Cb 0.20 0.65 -0.01 0.00 0.47 0.00 0.00 36.82 38.13 1wmp h ILE 530 CO -0.01 0.21 -0.27 0.00 -3.07 0.00 0.00 178.15 175.01 1wmp h ALA 531 N 1.55 1.32 0.06 0.18 0.00 -1.75 0.91 119.26 121.53 1wmp h ALA 531 Ca 0.16 -0.25 -0.11 0.00 0.00 0.00 0.00 54.91 54.71 1wmp h ALA 531 Cb 0.14 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1wmp h ALA 531 CO -0.01 0.34 -0.53 0.00 0.00 0.00 0.00 179.25 179.04 1wmp h ARG 532 N 0.00 0.12 0.00 0.00 3.08 -1.15 -2.63 114.38 113.80 1wmp h ARG 532 Ca -0.00 -0.21 -0.09 0.00 0.07 0.00 0.00 59.98 59.75 1wmp h ARG 532 Cb 0.56 0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.68 1wmp h ARG 532 CO 0.04 1.10 -0.43 0.00 -1.07 0.00 0.00 179.97 179.61 1wmp h ARG 533 N -0.73 0.00 -1.16 0.04 3.08 -1.02 -2.63 114.38 111.97 1wmp h ARG 533 Ca -0.11 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.37 1wmp h ARG 533 Cb 1.32 0.00 -0.42 0.00 0.08 0.00 0.00 29.97 30.94 1wmp h ARG 533 CO 0.03 0.43 -0.77 0.00 -1.07 0.00 0.00 179.97 178.59 1wmp n ALA 534 N -2.40 5.03 -0.04 0.04 0.00 0.30 -4.78 120.51 118.67 1wmp n ALA 534 Ca -0.01 -4.07 0.16 0.00 0.00 0.00 0.00 53.44 49.51 1wmp n ALA 534 Cb 0.48 -0.44 0.59 0.00 0.00 0.00 0.00 19.45 20.09 1wmp n ALA 534 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wmp h ALA 535 N 2.40 2.25 -0.47 0.00 0.00 -1.44 -0.36 119.26 121.63 1wmp h ALA 535 Ca 0.33 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.31 1wmp h ALA 535 Cb 1.21 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.95 1wmp h ALA 535 CO 0.81 -0.39 0.32 0.27 0.00 0.00 0.00 179.25 180.25 1wmp h PHE 536 N 0.20 0.28 0.00 0.00 -0.00 -1.87 -1.11 116.94 114.45 1wmp h PHE 536 Ca 0.26 0.01 0.00 0.00 -0.00 0.00 0.00 57.97 58.24 1wmp h PHE 536 Cb 0.77 -0.09 0.00 0.00 -0.00 0.00 0.00 35.95 36.63 1wmp h PHE 536 CO -0.00 0.14 0.00 0.00 -0.00 0.00 0.00 178.31 178.45 1wmp n ALA 537 N -2.54 2.37 0.77 12.09 0.00 -0.15 -3.15 120.51 129.91 1wmp n ALA 537 Ca 0.07 -0.14 0.12 0.00 0.00 0.00 0.00 53.44 53.48 1wmp n ALA 537 Cb 0.34 -1.41 0.16 0.00 0.00 0.00 0.00 19.45 18.54 1wmp n ALA 537 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1wmp n THR 538 N -1.11 0.14 -4.26 0.00 -2.24 -0.42 -0.33 114.28 106.06 1wmp n THR 538 Ca 0.16 -0.14 -0.17 0.00 -2.27 0.00 0.00 64.05 61.63 1wmp n THR 538 Cb 0.13 0.17 -0.13 0.00 -2.10 0.00 0.00 70.33 68.39 1wmp n THR 538 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1wmp s LYS 539 N -3.09 0.70 0.22 -0.78 -0.14 -1.19 -4.76 119.74 110.69 1wmp s LYS 539 Ca 0.08 -0.54 -0.00 0.00 -1.36 0.00 0.00 55.97 54.15 1wmp s LYS 539 Cb 0.16 -0.65 0.20 0.00 -1.68 0.00 0.00 37.83 35.86 1wmp s LYS 539 CO 0.74 0.16 1.55 -0.44 -0.76 0.00 0.00 175.35 176.60 1wmp h ASP 540 N 5.30 0.51 -3.51 2.83 5.19 -1.73 -3.39 116.42 121.62 1wmp h ASP 540 Ca -0.34 -0.26 -0.22 0.00 -0.62 0.00 0.00 57.03 55.59 1wmp h ASP 540 Cb 1.19 -0.14 -0.30 0.00 0.18 0.00 0.00 39.33 40.25 1wmp h ASP 540 CO 0.46 0.93 -0.57 -0.22 -3.12 0.00 0.00 179.24 176.72 1wmp s LEU 541 N -8.29 0.85 0.05 1.55 0.20 -0.68 -0.19 118.68 112.17 1wmp s LEU 541 Ca -0.06 0.33 0.07 0.00 0.69 0.00 0.00 54.13 55.16 1wmp s LEU 541 Cb 0.12 0.45 -0.03 0.00 -0.43 0.00 0.00 46.19 46.30 1wmp s LEU 541 CO 0.82 -0.13 -0.19 0.26 -0.29 0.00 0.00 176.35 176.82 1wmp s TRP 542 N 0.91 1.69 -0.10 5.38 0.52 -0.04 0.10 118.94 127.41 1wmp s TRP 542 Ca -0.07 -0.38 0.00 0.00 0.02 0.00 0.00 56.10 55.68 1wmp s TRP 542 Cb -0.09 -0.99 0.02 0.00 -1.15 0.00 0.00 33.47 31.26 1wmp s TRP 542 CO -0.05 0.10 -0.08 0.08 0.02 0.00 0.00 176.95 177.02 1wmp s VAL 543 N -0.87 0.99 0.22 4.03 1.01 -0.58 -0.29 120.40 124.91 1wmp s VAL 543 Ca 0.06 -0.30 0.09 0.00 0.00 0.00 0.00 61.98 61.83 1wmp s VAL 543 Cb -0.09 -0.99 -0.05 0.00 0.00 0.00 0.00 36.38 35.25 1wmp s VAL 543 CO 0.02 0.35 -0.16 0.42 0.00 0.00 0.00 175.10 175.73 1wmp s THR 544 N 1.43 1.93 0.15 3.92 -4.23 -0.19 -4.66 115.64 113.98 1wmp s THR 544 Ca -0.01 -2.22 -0.30 0.00 -1.18 0.00 0.00 61.69 57.98 1wmp s THR 544 Cb -0.13 -2.08 -0.07 0.00 1.34 0.00 0.00 72.50 71.56 1wmp s THR 544 CO -0.05 -0.51 1.08 -0.60 -0.54 0.00 0.00 174.62 174.00 1wmp s ARG 545 N -3.49 4.60 0.36 3.99 6.06 -1.26 -0.50 118.95 128.70 1wmp s ARG 545 Ca 0.23 1.66 -0.28 0.00 -2.50 0.00 0.00 55.73 54.84 1wmp s ARG 545 Cb -0.02 -3.31 -0.11 0.00 0.06 0.00 0.00 34.95 31.56 1wmp s ARG 545 CO 0.09 0.07 1.50 0.98 -2.50 0.00 0.00 175.30 175.43 1wmp n TYR 546 N 2.65 2.92 -3.72 5.12 4.19 0.11 -4.81 117.16 123.62 1wmp n TYR 546 Ca 0.03 0.42 -0.12 0.00 3.31 0.00 0.00 57.90 61.54 1wmp n TYR 546 Cb 0.47 -2.54 -0.11 0.00 0.49 0.00 0.00 39.34 37.65 1wmp n TYR 546 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1wmp s ALA 547 N -0.90 -0.93 0.45 2.98 0.00 -1.26 -5.01 121.76 117.08 1wmp s ALA 547 Ca 0.55 1.27 0.16 0.00 0.00 0.00 0.00 51.96 53.94 1wmp s ALA 547 Cb -0.49 -0.76 1.08 0.00 0.00 0.00 0.00 23.12 22.95 1wmp s ALA 547 CO 0.61 -0.22 1.98 -0.44 0.00 0.00 0.00 175.76 177.68 1wmp h ASP 548 N 6.51 0.32 -0.06 0.00 5.19 -2.02 -2.45 116.42 123.90 1wmp h ASP 548 Ca -0.33 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.09 1wmp h ASP 548 Cb 1.18 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 40.63 1wmp h ASP 548 CO 0.30 0.19 0.00 -0.90 -3.12 0.00 0.00 179.24 175.70 1wmp n ASP 549 N -4.46 2.30 -4.36 6.45 5.75 -1.26 -4.62 116.55 116.35 1wmp n ASP 549 Ca 0.10 -1.77 -0.45 0.00 -0.01 0.00 0.00 54.79 52.67 1wmp n ASP 549 Cb 0.42 -0.03 -0.00 0.00 -1.03 0.00 0.00 41.12 40.48 1wmp n ASP 549 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1wmp s GLU 550 N -1.94 4.15 -0.19 0.11 2.02 -0.92 -4.80 118.70 117.12 1wmp s GLU 550 Ca 0.33 -3.06 -0.08 0.00 0.02 0.00 0.00 54.97 52.18 1wmp s GLU 550 Cb 0.20 -4.64 -0.21 0.00 0.10 0.00 0.00 34.13 29.58 1wmp s GLU 550 CO 0.31 -1.34 0.09 0.54 0.02 0.00 0.00 175.26 174.89 1wmp n ARG 551 N 3.31 0.68 -4.70 1.61 1.74 -1.26 -4.80 116.66 113.23 1wmp n ARG 551 Ca 0.26 0.29 -0.28 0.00 -0.77 0.00 0.00 57.85 57.34 1wmp n ARG 551 Cb 0.40 -1.64 -0.14 0.00 -1.02 0.00 0.00 32.46 30.06 1wmp n ARG 551 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1wmp s TYR 552 N -2.51 2.16 -0.89 -1.55 2.02 -1.26 -4.90 117.35 110.41 1wmp s TYR 552 Ca -0.29 -0.40 0.10 0.00 -0.37 0.00 0.00 57.07 56.11 1wmp s TYR 552 Cb 0.08 -1.26 0.45 0.00 -0.40 0.00 0.00 41.96 40.83 1wmp s TYR 552 CO 0.66 0.16 1.32 -0.35 -1.57 0.00 0.00 175.55 175.77 1wmp n PRO 553 N 1.58 0.03 -0.02 -1.71 -0.04 -1.26 -1.80 135.00 131.78 1wmp n PRO 553 Ca -0.17 0.39 0.02 0.00 -0.04 0.00 0.00 63.50 63.70 1wmp n PRO 553 Cb 0.53 -1.57 0.03 0.00 -0.04 0.00 0.00 33.50 32.45 1wmp n PRO 553 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1wmp n THR 554 N -1.62 0.49 0.00 0.52 -2.24 -1.26 -1.71 114.28 108.45 1wmp n THR 554 Ca 0.02 -0.74 0.00 0.00 -2.27 0.00 0.00 64.05 61.05 1wmp n THR 554 Cb 0.10 0.79 0.00 0.00 -2.10 0.00 0.00 70.33 69.12 1wmp n THR 554 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wmp n GLY 555 N -0.01 -0.23 0.11 3.38 0.00 -0.74 -4.28 105.19 103.41 1wmp n GLY 555 Ca 0.03 -1.83 -0.08 0.00 0.00 0.00 0.00 46.02 44.13 1wmp n GLY 555 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1wmp h ASP 556 N 0.00 0.18 -3.05 1.61 3.32 -1.92 -3.40 116.42 113.16 1wmp h ASP 556 Ca 0.00 -0.16 -0.62 0.00 0.02 0.00 0.00 57.03 56.28 1wmp h ASP 556 Cb 0.00 -0.06 -0.42 0.00 0.22 0.00 0.00 39.33 39.08 1wmp h ASP 556 CO 0.00 1.00 -0.58 0.49 -1.72 0.00 0.00 179.24 178.44 1wmp n PHE 557 N -3.58 3.21 -0.08 4.55 3.72 -1.26 -4.94 117.46 119.08 1wmp n PHE 557 Ca -0.03 -4.30 -0.11 0.00 -0.05 0.00 0.00 57.45 52.96 1wmp n PHE 557 Cb 0.85 -0.61 -0.04 0.00 -0.94 0.00 0.00 39.48 38.73 1wmp n PHE 557 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 1wmp h VAL 558 N 4.35 1.24 -1.35 -4.37 2.07 -1.77 -3.39 116.25 113.03 1wmp h VAL 558 Ca 0.15 -0.81 -0.79 0.00 0.82 0.00 0.00 66.70 66.08 1wmp h VAL 558 Cb 0.75 1.30 0.02 0.00 -1.52 0.00 0.00 31.29 31.84 1wmp h VAL 558 CO 0.72 0.25 0.77 -3.20 0.02 0.00 0.00 177.57 176.13 1wmp n ASN 559 N -4.68 1.85 -1.87 0.57 2.85 -1.25 -1.65 115.26 111.07 1wmp n ASN 559 Ca -0.03 1.12 -0.14 0.00 -0.11 0.00 0.00 54.58 55.41 1wmp n ASN 559 Cb 0.21 -1.05 -0.04 0.00 1.24 0.00 0.00 39.78 40.15 1wmp n ASN 559 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1wmp n GLN 560 N 4.61 -1.67 -3.01 1.20 6.02 -1.26 -0.99 117.38 122.27 1wmp n GLN 560 Ca 0.27 0.78 -0.39 0.00 -0.01 0.00 0.00 57.00 57.65 1wmp n GLN 560 Cb 0.07 -5.20 -0.06 0.00 1.02 0.00 0.00 30.24 26.06 1wmp n GLN 560 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1wmp s HIS 561 N -2.44 3.89 0.47 1.08 2.46 -0.66 -4.72 115.29 115.36 1wmp s HIS 561 Ca 0.00 1.59 0.23 0.00 0.47 0.00 0.00 55.06 57.35 1wmp s HIS 561 Cb 0.00 -2.74 1.25 0.00 -0.13 0.00 0.00 32.58 30.96 1wmp s HIS 561 CO 0.00 0.51 1.88 0.66 -2.47 0.00 0.00 174.74 175.32 1wmp h SER 562 N 4.42 0.23 -5.00 9.88 4.64 -1.91 -3.46 113.55 122.35 1wmp h SER 562 Ca -0.47 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1wmp h SER 562 Cb 1.21 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1wmp h SER 562 CO 0.66 0.09 0.00 0.61 -0.87 0.00 0.00 176.83 177.32 1wmp n GLY 563 N -1.59 2.65 2.17 -0.77 0.00 -1.26 -4.64 105.19 101.74 1wmp n GLY 563 Ca 0.18 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 44.08 1wmp n GLY 563 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wmp n GLY 564 N -0.97 2.99 3.67 -0.02 0.00 -1.00 -4.93 105.19 104.92 1wmp n GLY 564 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1wmp n GLY 564 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wmp s ALA 565 N -1.98 1.18 0.00 4.61 0.00 -1.26 -3.29 121.76 121.02 1wmp s ALA 565 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 51.96 52.04 1wmp s ALA 565 Cb 0.00 -3.26 0.00 0.00 0.00 0.00 0.00 23.12 19.86 1wmp s ALA 565 CO 0.00 -2.69 0.00 0.41 0.00 0.00 0.00 175.76 173.48 1wmp n GLY 566 N -0.48 0.15 0.34 0.00 0.00 -1.26 -4.39 105.19 99.55 1wmp n GLY 566 Ca 0.07 -1.19 0.04 0.00 0.00 0.00 0.00 46.02 44.94 1wmp n GLY 566 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1wmp h LEU 567 N 0.00 -0.92 -1.00 0.99 3.38 -1.54 0.97 115.31 117.19 1wmp h LEU 567 Ca 0.00 0.28 0.11 0.00 0.09 0.00 0.00 57.88 58.36 1wmp h LEU 567 Cb 0.00 0.59 -0.08 0.00 0.09 0.00 0.00 40.66 41.26 1wmp h LEU 567 CO 0.00 -0.31 0.63 -0.65 0.09 0.00 0.00 178.44 178.21 1wmp h PRO 568 N -0.00 0.99 -0.22 1.13 0.11 -1.77 0.19 132.00 132.43 1wmp h PRO 568 Ca 0.44 -0.06 -0.19 0.00 0.11 0.00 0.00 66.00 66.30 1wmp h PRO 568 Cb 0.67 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 31.56 1wmp h PRO 568 CO -0.96 0.66 -0.60 0.77 -0.21 0.00 0.00 178.00 177.65 1wmp h SER 569 N 1.02 0.91 0.03 -2.05 0.02 -0.85 -2.40 113.55 110.22 1wmp h SER 569 Ca 0.49 -0.58 -0.00 0.00 -0.84 0.00 0.00 61.79 60.86 1wmp h SER 569 Cb 0.44 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.71 1wmp h SER 569 CO -0.25 1.32 -0.01 1.88 -1.14 0.00 0.00 176.83 178.63 1wmp h TYR 570 N 0.54 -0.03 -0.61 3.45 0.05 -0.49 -2.77 116.97 117.11 1wmp h TYR 570 Ca -0.01 -0.00 0.10 0.00 0.05 0.00 0.00 58.73 58.86 1wmp h TYR 570 Cb 1.22 0.01 -0.04 0.00 1.01 0.00 0.00 36.73 38.93 1wmp h TYR 570 CO 0.08 0.15 0.41 0.82 -1.05 0.00 0.00 178.16 178.57 1wmp h ILE 571 N -0.21 0.90 -0.07 -2.88 1.08 -0.70 -1.53 117.51 114.10 1wmp h ILE 571 Ca -0.00 -0.15 0.02 0.00 -0.39 0.00 0.00 64.86 64.34 1wmp h ILE 571 Cb 0.19 0.43 -0.00 0.00 -3.07 0.00 0.00 36.82 34.38 1wmp h ILE 571 CO 0.01 0.08 0.11 0.00 -0.69 0.00 0.00 178.15 177.66 1wmp h ALA 572 N 1.69 1.49 0.00 1.87 0.00 -1.12 0.82 119.26 124.01 1wmp h ALA 572 Ca 0.28 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1wmp h ALA 572 Cb 0.54 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1wmp h ALA 572 CO -0.08 -0.15 0.00 1.96 0.00 0.00 0.00 179.25 180.98 1wmp h GLN 573 N 0.00 0.00 -6.42 0.00 4.20 -1.34 -3.47 115.11 108.08 1wmp h GLN 573 Ca 0.03 0.00 -0.48 0.00 0.06 0.00 0.00 58.65 58.26 1wmp h GLN 573 Cb 0.26 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.00 1wmp h GLN 573 CO -0.00 0.00 -0.88 -3.47 -0.67 0.00 0.00 178.83 173.81 1wmp n ASP 574 N -2.97 -0.50 -4.88 1.46 4.64 0.28 -4.95 116.55 109.62 1wmp n ASP 574 Ca 0.00 -0.97 -0.30 0.00 -1.38 0.00 0.00 54.79 52.14 1wmp n ASP 574 Cb 0.26 -3.24 0.04 0.00 -1.04 0.00 0.00 41.12 37.13 1wmp n ASP 574 CO 0.00 0.00 0.00 -0.13 -0.82 0.00 0.00 177.20 176.25 1wmp s ARG 575 N -6.44 2.97 -0.05 -0.67 0.52 -1.26 -4.56 118.95 109.45 1wmp s ARG 575 Ca 0.01 0.47 -0.30 0.00 -0.52 0.00 0.00 55.73 55.38 1wmp s ARG 575 Cb -0.00 -2.05 -0.03 0.00 0.52 0.00 0.00 34.95 33.39 1wmp s ARG 575 CO 0.87 -0.94 1.19 0.34 0.02 0.00 0.00 175.30 176.78 1wmp s ASP 576 N -4.33 7.07 -0.04 0.23 2.15 -1.26 -1.81 116.67 118.67 1wmp s ASP 576 Ca 0.57 1.80 0.05 0.00 0.43 0.00 0.00 52.55 55.41 1wmp s ASP 576 Cb -0.11 -2.56 0.08 0.00 -0.30 0.00 0.00 42.92 40.04 1wmp s ASP 576 CO 0.52 -0.57 0.99 2.30 -0.17 0.00 0.00 175.17 178.24 1wmp n ILE 577 N 4.59 1.10 -2.97 4.11 -5.35 -0.32 -4.81 119.36 115.71 1wmp n ILE 577 Ca 0.11 -1.21 -0.44 0.00 -0.27 0.00 0.00 62.75 60.93 1wmp n ILE 577 Cb 0.46 0.34 -0.02 0.00 -1.74 0.00 0.00 39.64 38.68 1wmp n ILE 577 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1wmp s ASP 578 N -1.44 6.69 0.00 7.28 -1.08 -1.21 -4.15 116.67 122.77 1wmp s ASP 578 Ca 0.09 -2.22 0.00 0.00 -0.52 0.00 0.00 52.55 49.90 1wmp s ASP 578 Cb 0.08 -2.38 0.00 0.00 -1.46 0.00 0.00 42.92 39.16 1wmp s ASP 578 CO 0.01 -0.97 0.00 0.61 0.52 0.00 0.00 175.17 175.33 1wmp n GLY 579 N 5.17 0.59 3.31 2.66 0.00 0.10 -4.98 105.19 112.04 1wmp n GLY 579 Ca 0.24 -0.39 -0.19 0.00 0.00 0.00 0.00 46.02 45.69 1wmp n GLY 579 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1wmp n GLN 580 N -0.93 0.49 -2.46 1.61 1.13 0.06 -4.57 117.38 112.72 1wmp n GLN 580 Ca 0.00 -3.27 -0.42 0.00 -1.94 0.00 0.00 57.00 51.37 1wmp n GLN 580 Cb 0.40 2.78 -0.02 0.00 0.11 0.00 0.00 30.24 33.51 1wmp n GLN 580 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1wmp s ASP 581 N -3.34 6.36 0.31 1.08 -1.08 -1.10 -1.19 116.67 117.70 1wmp s ASP 581 Ca 0.38 0.47 0.08 0.00 -0.52 0.00 0.00 52.55 52.95 1wmp s ASP 581 Cb 0.01 -2.55 -0.06 0.00 -1.46 0.00 0.00 42.92 38.87 1wmp s ASP 581 CO 0.27 -1.48 -0.07 0.27 0.52 0.00 0.00 175.17 174.68 1wmp s ILE 582 N 5.33 1.86 -0.06 4.11 -4.36 -1.26 -0.71 121.20 126.11 1wmp s ILE 582 Ca 0.53 -2.15 0.02 0.00 -0.26 0.00 0.00 60.65 58.79 1wmp s ILE 582 Cb -0.10 -2.54 0.01 0.00 1.25 0.00 0.00 42.46 41.08 1wmp s ILE 582 CO 0.29 -0.25 -0.10 -0.69 0.24 0.00 0.00 174.94 174.43 1wmp s VAL 583 N -2.86 0.97 -0.17 8.37 1.01 0.35 -2.42 120.40 125.64 1wmp s VAL 583 Ca 0.31 -0.39 -0.07 0.00 0.00 0.00 0.00 61.98 61.83 1wmp s VAL 583 Cb 0.03 -0.90 -0.04 0.00 0.00 0.00 0.00 36.38 35.47 1wmp s VAL 583 CO 0.14 0.32 0.06 -0.69 0.00 0.00 0.00 175.10 174.93 1wmp s VAL 584 N 0.68 4.81 -0.27 2.92 1.01 0.72 -1.03 120.40 129.24 1wmp s VAL 584 Ca -0.13 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 61.82 1wmp s VAL 584 Cb -0.15 -3.15 0.05 0.00 0.00 0.00 0.00 36.38 33.13 1wmp s VAL 584 CO 0.03 0.49 -0.07 0.26 0.00 0.00 0.00 175.10 175.81 1wmp s TRP 585 N 0.14 3.21 -0.21 5.22 0.52 0.60 0.23 118.94 128.65 1wmp s TRP 585 Ca 0.05 -2.00 -0.07 0.00 0.02 0.00 0.00 56.10 54.10 1wmp s TRP 585 Cb -0.12 -2.02 -0.03 0.00 -1.15 0.00 0.00 33.47 30.15 1wmp s TRP 585 CO 0.01 -0.82 0.05 -1.58 0.02 0.00 0.00 176.95 174.62 1wmp s HIS 586 N 1.20 3.13 -0.17 -1.98 2.46 -0.31 -0.86 115.29 118.76 1wmp s HIS 586 Ca -0.05 -0.21 -0.13 0.00 0.47 0.00 0.00 55.06 55.13 1wmp s HIS 586 Cb -0.19 -2.12 -0.05 0.00 -0.13 0.00 0.00 32.58 30.09 1wmp s HIS 586 CO -0.04 -0.11 0.25 0.99 -2.47 0.00 0.00 174.74 173.37 1wmp s THR 587 N 0.90 5.33 -0.12 0.89 2.01 0.73 -0.84 115.64 124.54 1wmp s THR 587 Ca 0.03 0.46 -0.19 0.00 0.31 0.00 0.00 61.69 62.30 1wmp s THR 587 Cb -0.14 -3.59 0.05 0.00 0.01 0.00 0.00 72.50 68.82 1wmp s THR 587 CO 0.02 0.40 0.48 0.72 -0.69 0.00 0.00 174.62 175.55 1wmp s PHE 588 N 0.43 -0.47 0.24 4.92 -0.71 -0.72 -4.65 117.98 117.03 1wmp s PHE 588 Ca 0.14 1.03 -0.21 0.00 -1.04 0.00 0.00 56.93 56.86 1wmp s PHE 588 Cb -0.12 0.20 0.07 0.00 -1.21 0.00 0.00 43.02 41.95 1wmp s PHE 588 CO 0.02 -0.35 0.94 0.20 -1.34 0.00 0.00 175.22 174.70 1wmp s GLY 589 N -0.36 0.14 -0.03 1.99 0.00 -1.26 -0.16 107.32 107.63 1wmp s GLY 589 Ca -0.05 -0.40 0.02 0.00 0.00 0.00 0.00 44.72 44.29 1wmp s GLY 589 CO 0.03 1.21 -0.05 1.08 0.00 0.00 0.00 173.10 175.37 1wmp s LEU 590 N -3.23 3.27 -0.19 0.66 1.43 0.47 -4.65 118.68 116.44 1wmp s LEU 590 Ca 0.18 -0.05 -0.03 0.00 -1.03 0.00 0.00 54.13 53.20 1wmp s LEU 590 Cb -0.03 -1.81 -0.01 0.00 0.03 0.00 0.00 46.19 44.37 1wmp s LEU 590 CO 0.07 0.32 -0.06 -0.89 0.23 0.00 0.00 176.35 176.01 1wmp s THR 591 N -0.94 3.35 -0.12 5.49 2.01 -1.26 -0.70 115.64 123.46 1wmp s THR 591 Ca 0.16 -0.52 0.02 0.00 0.31 0.00 0.00 61.69 61.65 1wmp s THR 591 Cb -0.11 -2.49 -0.01 0.00 0.01 0.00 0.00 72.50 69.91 1wmp s THR 591 CO 0.05 0.46 -0.18 -1.00 -0.69 0.00 0.00 174.62 173.26 1wmp s HIS 592 N 1.06 2.70 -0.68 4.92 3.76 0.53 -5.01 115.29 122.57 1wmp s HIS 592 Ca 0.01 -0.92 0.05 0.00 -0.15 0.00 0.00 55.06 54.05 1wmp s HIS 592 Cb -0.15 -1.80 0.17 0.00 1.11 0.00 0.00 32.58 31.91 1wmp s HIS 592 CO -0.01 -0.37 0.48 -0.06 -0.85 0.00 0.00 174.74 173.94 1wmp s PHE 593 N 0.47 3.40 0.03 1.40 0.08 -1.26 -2.33 117.98 119.76 1wmp s PHE 593 Ca -0.12 -3.27 -0.38 0.00 0.12 0.00 0.00 56.93 53.27 1wmp s PHE 593 Cb -0.17 -2.58 -0.20 0.00 -0.57 0.00 0.00 43.02 39.51 1wmp s PHE 593 CO 0.05 -0.57 0.99 -2.30 -0.10 0.00 0.00 175.22 173.30 1wmp n PRO 594 N 2.03 0.00 -3.27 0.24 -0.02 -1.26 -4.98 135.00 127.74 1wmp n PRO 594 Ca 0.20 0.00 -0.18 0.00 -2.02 0.00 0.00 63.50 61.50 1wmp n PRO 594 Cb 0.36 -1.43 -0.00 0.00 -0.02 0.00 0.00 33.50 32.40 1wmp n PRO 594 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1wmp s ARG 595 N -0.14 2.81 0.43 -0.52 0.52 -1.26 -4.75 118.95 116.04 1wmp s ARG 595 Ca 0.87 -1.27 0.13 0.00 -0.52 0.00 0.00 55.73 54.95 1wmp s ARG 595 Cb -1.22 -2.67 0.93 0.00 0.52 0.00 0.00 34.95 32.51 1wmp s ARG 595 CO 0.57 -0.17 1.96 0.28 0.02 0.00 0.00 175.30 177.96 1wmp h VAL 596 N 0.81 1.15 0.00 3.52 2.07 -1.87 -1.04 116.25 120.90 1wmp h VAL 596 Ca -0.42 -0.70 0.00 0.00 0.82 0.00 0.00 66.70 66.40 1wmp h VAL 596 Cb 1.27 1.33 0.00 0.00 -1.52 0.00 0.00 31.29 32.37 1wmp h VAL 596 CO 0.50 0.21 0.00 -0.62 0.02 0.00 0.00 177.57 177.67 1wmp n GLU 597 N -4.30 0.13 0.00 1.57 4.71 -1.26 -1.58 120.64 119.91 1wmp n GLU 597 Ca -0.02 0.49 0.14 0.00 -0.01 0.00 0.00 57.16 57.75 1wmp n GLU 597 Cb 0.26 -1.82 0.48 0.00 -1.01 0.00 0.00 31.44 29.35 1wmp n GLU 597 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1wmp n ASP 598 N -2.08 1.08 -4.51 1.62 8.00 -0.39 -4.60 116.55 115.67 1wmp n ASP 598 Ca 0.01 -1.06 -0.32 0.00 0.71 0.00 0.00 54.79 54.13 1wmp n ASP 598 Cb 0.13 0.05 -0.12 0.00 -0.02 0.00 0.00 41.12 41.16 1wmp n ASP 598 CO 0.00 0.00 0.00 0.86 -0.39 0.00 0.00 177.20 177.67 1wmp s TRP 599 N -2.30 2.72 -0.92 1.24 -0.11 -0.62 -2.07 118.94 116.88 1wmp s TRP 599 Ca 0.31 -0.15 0.27 0.00 1.22 0.00 0.00 56.10 57.75 1wmp s TRP 599 Cb 0.20 -1.57 1.07 0.00 -1.50 0.00 0.00 33.47 31.67 1wmp s TRP 599 CO 0.44 0.27 1.84 -0.35 -4.62 0.00 0.00 176.95 174.54 1wmp n PRO 600 N 1.82 0.07 -3.78 5.86 -0.04 -1.26 -4.95 135.00 132.72 1wmp n PRO 600 Ca -0.16 0.09 -0.13 0.00 -0.04 0.00 0.00 63.50 63.26 1wmp n PRO 600 Cb 0.52 -1.59 -0.13 0.00 -0.04 0.00 0.00 33.50 32.26 1wmp n PRO 600 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1wmp s ILE 601 N -3.04 -0.03 0.15 0.52 2.07 -1.21 -4.74 121.20 114.92 1wmp s ILE 601 Ca 0.12 0.10 -0.15 0.00 -1.41 0.00 0.00 60.65 59.30 1wmp s ILE 601 Cb 0.16 -0.25 -0.07 0.00 0.13 0.00 0.00 42.46 42.44 1wmp s ILE 601 CO 0.52 0.04 0.57 0.00 -1.91 0.00 0.00 174.94 174.16 1wmp s MET 602 N 0.69 4.03 0.62 3.50 0.23 -0.32 -4.73 119.30 123.32 1wmp s MET 602 Ca -0.05 0.56 -0.16 0.00 -1.03 0.00 0.00 55.69 55.00 1wmp s MET 602 Cb -0.07 -2.95 -0.02 0.00 -1.53 0.00 0.00 34.83 30.26 1wmp s MET 602 CO -0.03 0.48 1.11 -2.14 -2.03 0.00 0.00 175.02 172.41 1wmp s PRO 603 N -1.89 3.01 0.28 3.16 0.02 -1.26 -3.98 135.00 134.34 1wmp s PRO 603 Ca 0.38 1.45 -0.30 0.00 0.02 0.00 0.00 61.00 62.54 1wmp s PRO 603 Cb -0.16 -1.97 -0.12 0.00 0.02 0.00 0.00 34.50 32.27 1wmp s PRO 603 CO 0.19 -1.09 1.56 0.28 -0.33 0.00 0.00 177.00 177.61 1wmp n VAL 604 N -2.03 0.99 -4.79 3.83 0.31 -1.26 -4.74 118.33 110.64 1wmp n VAL 604 Ca 0.11 -0.25 -0.31 0.00 -0.01 0.00 0.00 64.34 63.88 1wmp n VAL 604 Cb 0.52 -1.87 -0.13 0.00 -0.91 0.00 0.00 33.84 31.45 1wmp n VAL 604 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1wmp s ASP 605 N 0.47 3.63 0.16 4.52 2.15 -0.24 -4.93 116.67 122.43 1wmp s ASP 605 Ca 0.65 -0.44 0.07 0.00 0.43 0.00 0.00 52.55 53.26 1wmp s ASP 605 Cb -0.53 -0.55 -0.04 0.00 -0.30 0.00 0.00 42.92 41.51 1wmp s ASP 605 CO 0.48 0.27 -0.15 0.42 -0.17 0.00 0.00 175.17 176.02 1wmp s THR 606 N -0.85 1.59 -0.04 1.71 -4.23 -1.26 -0.74 115.64 111.82 1wmp s THR 606 Ca 0.13 -1.92 -0.28 0.00 -1.18 0.00 0.00 61.69 58.44 1wmp s THR 606 Cb -0.10 -1.78 0.06 0.00 1.34 0.00 0.00 72.50 72.02 1wmp s THR 606 CO 0.04 -0.43 0.62 0.54 -0.54 0.00 0.00 174.62 174.84 1wmp s VAL 607 N -2.35 0.01 0.00 2.29 0.11 -1.06 -5.00 120.40 114.40 1wmp s VAL 607 Ca 0.15 -0.08 0.00 0.00 -2.93 0.00 0.00 61.98 59.12 1wmp s VAL 607 Cb -0.04 -0.93 0.00 0.00 -1.53 0.00 0.00 36.38 33.88 1wmp s VAL 607 CO 0.05 -0.04 0.00 0.61 -3.33 0.00 0.00 175.10 172.39 1wmp n GLY 608 N 0.96 1.54 3.66 6.54 0.00 -1.26 -0.60 105.19 116.03 1wmp n GLY 608 Ca -0.19 -0.20 -0.01 0.00 0.00 0.00 0.00 46.02 45.61 1wmp n GLY 608 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1wmp s PHE 609 N -0.49 -0.10 0.09 1.61 -0.12 -0.98 -4.09 117.98 113.91 1wmp s PHE 609 Ca 0.00 -0.07 -0.14 0.00 -0.05 0.00 0.00 56.93 56.66 1wmp s PHE 609 Cb 0.00 0.58 0.02 0.00 -0.63 0.00 0.00 43.02 42.99 1wmp s PHE 609 CO 0.00 -0.48 0.33 -1.59 -0.05 0.00 0.00 175.22 173.43 1wmp s LYS 610 N -2.77 0.95 -0.10 1.99 -2.85 -1.01 -1.44 119.74 114.52 1wmp s LYS 610 Ca 0.13 -0.69 0.02 0.00 -1.00 0.00 0.00 55.97 54.43 1wmp s LYS 610 Cb 0.02 0.41 0.01 0.00 -2.06 0.00 0.00 37.83 36.21 1wmp s LYS 610 CO -0.02 -0.34 -0.14 -0.51 0.10 0.00 0.00 175.35 174.44 1wmp s LEU 611 N -2.58 1.68 0.03 2.77 1.02 0.11 -0.28 118.68 121.44 1wmp s LEU 611 Ca 0.01 -0.39 0.05 0.00 0.02 0.00 0.00 54.13 53.82 1wmp s LEU 611 Cb 0.02 -1.02 -0.03 0.00 0.02 0.00 0.00 46.19 45.17 1wmp s LEU 611 CO -0.09 0.02 -0.12 -0.13 0.02 0.00 0.00 176.35 176.05 1wmp s ARG 612 N 0.93 2.30 0.43 1.70 0.52 -0.19 -1.00 118.95 123.64 1wmp s ARG 612 Ca -0.08 -0.86 -0.26 0.00 -0.52 0.00 0.00 55.73 54.01 1wmp s ARG 612 Cb -0.15 -2.34 -0.09 0.00 0.52 0.00 0.00 34.95 32.89 1wmp s ARG 612 CO -0.00 0.57 1.42 -0.35 0.02 0.00 0.00 175.30 176.95 1wmp n PRO 613 N 1.49 2.28 -3.58 3.54 -0.04 -1.26 0.06 135.00 137.49 1wmp n PRO 613 Ca -0.16 0.81 -0.28 0.00 -0.04 0.00 0.00 63.50 63.83 1wmp n PRO 613 Cb 0.52 -2.60 -0.11 0.00 -0.04 0.00 0.00 33.50 31.27 1wmp n PRO 613 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1wmp s GLU 614 N -2.34 1.24 -0.63 0.54 2.56 0.15 -4.71 118.70 115.51 1wmp s GLU 614 Ca 0.60 -2.19 0.00 0.00 0.00 0.00 0.00 54.97 53.38 1wmp s GLU 614 Cb -0.47 -2.00 0.00 0.00 2.00 0.00 0.00 34.13 33.66 1wmp s GLU 614 CO 0.59 -1.28 0.00 0.41 -0.56 0.00 0.00 175.26 174.41 1wmp n GLY 615 N 3.05 0.70 0.17 -1.50 0.00 -1.26 -2.55 105.19 103.80 1wmp n GLY 615 Ca 0.20 -0.74 -0.19 0.00 0.00 0.00 0.00 46.02 45.29 1wmp n GLY 615 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1wmp h PHE 616 N 0.00 0.83 -1.44 1.61 3.57 -1.86 -3.36 116.94 116.28 1wmp h PHE 616 Ca -0.13 -0.44 -0.45 0.00 3.53 0.00 0.00 57.97 60.48 1wmp h PHE 616 Cb 0.56 -0.10 0.03 0.00 2.79 0.00 0.00 35.95 39.23 1wmp h PHE 616 CO 0.17 1.27 -0.14 -0.06 -2.23 0.00 0.00 178.31 177.32 1wmp s PHE 617 N -3.30 2.24 -1.40 0.41 0.40 -1.26 -4.85 117.98 110.21 1wmp s PHE 617 Ca -0.12 -0.44 0.25 0.00 -0.60 0.00 0.00 56.93 56.02 1wmp s PHE 617 Cb 0.05 -2.43 0.47 0.00 0.51 0.00 0.00 43.02 41.62 1wmp s PHE 617 CO 0.87 -0.85 1.38 -0.25 0.70 0.00 0.00 175.22 177.08 1wmp n ASP 618 N -2.14 0.92 -3.89 1.36 8.00 -1.26 -4.86 116.55 114.68 1wmp n ASP 618 Ca 0.11 -0.72 0.04 0.00 0.71 0.00 0.00 54.79 54.94 1wmp n ASP 618 Cb 0.60 0.31 0.01 0.00 -0.02 0.00 0.00 41.12 42.02 1wmp n ASP 618 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1wmp s ARG 619 N -2.75 0.06 0.19 -1.24 1.70 -1.26 -4.94 118.95 110.70 1wmp s ARG 619 Ca 0.17 -0.04 -0.33 0.00 -0.47 0.00 0.00 55.73 55.06 1wmp s ARG 619 Cb 0.18 0.02 -0.15 0.00 -0.57 0.00 0.00 34.95 34.43 1wmp s ARG 619 CO 0.64 -0.03 1.32 0.45 -1.08 0.00 0.00 175.30 176.60 1wmp n SER 620 N -0.87 2.09 -0.89 -2.89 2.88 -1.26 -4.86 113.62 107.82 1wmp n SER 620 Ca 0.02 1.13 0.08 0.00 -1.33 0.00 0.00 58.87 58.77 1wmp n SER 620 Cb 0.60 -1.31 0.21 0.00 -0.75 0.00 0.00 64.21 62.96 1wmp n SER 620 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1wmp n PRO 621 N 2.12 2.12 -0.44 -1.46 -0.04 -1.26 -4.08 135.00 131.96 1wmp n PRO 621 Ca 0.14 -1.74 0.06 0.00 -0.04 0.00 0.00 63.50 61.93 1wmp n PRO 621 Cb 0.27 -1.38 0.19 0.00 -0.04 0.00 0.00 33.50 32.54 1wmp n PRO 621 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1wmp n VAL 622 N 0.91 2.16 0.30 0.52 0.24 -1.26 -4.59 118.33 116.61 1wmp n VAL 622 Ca 0.16 -2.74 0.14 0.00 -2.04 0.00 0.00 64.34 59.86 1wmp n VAL 622 Cb 0.41 -0.25 0.43 0.00 -1.47 0.00 0.00 33.84 32.95 1wmp n VAL 622 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1wmp h LEU 623 N 0.72 0.00 -1.34 1.34 3.38 -1.98 -3.00 115.31 114.43 1wmp h LEU 623 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1wmp h LEU 623 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1wmp h LEU 623 CO 0.07 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 177.70 1wmp n ASP 624 N -2.92 1.98 -4.71 -0.43 5.75 -1.26 -4.88 116.55 110.07 1wmp n ASP 624 Ca 0.03 -1.87 -0.42 0.00 -0.01 0.00 0.00 54.79 52.52 1wmp n ASP 624 Cb 0.40 -0.19 -0.03 0.00 -1.03 0.00 0.00 41.12 40.27 1wmp n ASP 624 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1wmp s VAL 625 N -1.62 4.46 0.79 2.12 1.01 -1.14 -5.03 120.40 120.99 1wmp s VAL 625 Ca 0.30 1.76 -0.11 0.00 0.00 0.00 0.00 61.98 63.93 1wmp s VAL 625 Cb 0.16 -4.13 0.06 0.00 0.00 0.00 0.00 36.38 32.47 1wmp s VAL 625 CO 0.23 0.13 1.09 -2.16 0.00 0.00 0.00 175.10 174.38 1wmp s PRO 626 N 1.07 2.15 0.03 2.72 0.04 -1.26 -5.01 135.00 134.74 1wmp s PRO 626 Ca 0.55 0.80 -0.06 0.00 0.04 0.00 0.00 61.00 62.34 1wmp s PRO 626 Cb -0.25 -1.91 -0.29 0.00 0.04 0.00 0.00 34.50 32.08 1wmp s PRO 626 CO 0.28 -1.62 0.97 0.00 0.04 0.00 0.00 177.00 176.67 1wmp h ALA 627 N -1.09 0.14 0.00 8.56 0.00 -1.96 -3.45 119.26 121.46 1wmp h ALA 627 Ca -0.46 -1.00 0.00 0.00 0.00 0.00 0.00 54.91 53.45 1wmp h ALA 627 Cb 1.25 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.22 1wmp h ALA 627 CO 0.57 1.01 0.00 0.09 0.00 0.00 0.00 179.25 180.92