#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1weh s LEU 3 N 0.00 2.36 -0.21 0.55 1.43 -1.26 -1.04 118.68 120.50 1weh s LEU 3 Ca 0.00 -0.78 -0.07 0.00 -1.03 0.00 0.00 54.13 52.25 1weh s LEU 3 Cb 0.00 -1.09 -0.03 0.00 0.03 0.00 0.00 46.19 45.10 1weh s LEU 3 CO 0.00 0.11 0.06 -0.22 0.23 0.00 0.00 176.35 176.54 1weh s LEU 4 N -2.25 3.59 -0.16 1.79 2.96 -0.40 -0.59 118.68 123.62 1weh s LEU 4 Ca 0.14 -0.08 -0.18 0.00 -0.22 0.00 0.00 54.13 53.79 1weh s LEU 4 Cb -0.09 -1.93 -0.04 0.00 0.50 0.00 0.00 46.19 44.63 1weh s LEU 4 CO 0.07 0.07 0.50 0.00 -1.32 0.00 0.00 176.35 175.66 1weh s ALA 5 N 1.01 3.51 -0.06 5.97 0.00 -0.76 -1.50 121.76 129.93 1weh s ALA 5 Ca 0.04 -0.30 0.05 0.00 0.00 0.00 0.00 51.96 51.76 1weh s ALA 5 Cb -0.14 -2.73 -0.01 0.00 0.00 0.00 0.00 23.12 20.24 1weh s ALA 5 CO 0.03 -0.22 -0.23 0.08 0.00 0.00 0.00 175.76 175.42 1weh s VAL 6 N 1.13 2.25 -0.15 0.00 1.01 -0.46 -1.25 120.40 122.93 1weh s VAL 6 Ca 0.25 -1.00 -0.03 0.00 0.00 0.00 0.00 61.98 61.20 1weh s VAL 6 Cb -0.15 -1.83 -0.03 0.00 0.00 0.00 0.00 36.38 34.37 1weh s VAL 6 CO 0.10 0.57 -0.05 -0.36 0.00 0.00 0.00 175.10 175.36 1weh s PHE 7 N -0.21 3.00 0.11 5.22 2.99 0.04 -4.54 117.98 124.59 1weh s PHE 7 Ca -0.02 -0.31 -0.25 0.00 0.00 0.00 0.00 56.93 56.35 1weh s PHE 7 Cb -0.13 -1.93 0.08 0.00 0.00 0.00 0.00 43.02 41.03 1weh s PHE 7 CO 0.03 -0.03 0.69 0.54 -0.00 0.00 0.00 175.22 176.45 1weh s VAL 8 N 0.30 0.00 0.12 -0.44 0.11 -1.26 -0.12 120.40 119.10 1weh s VAL 8 Ca -0.04 0.00 -0.34 0.00 -2.93 0.00 0.00 61.98 58.67 1weh s VAL 8 Cb -0.14 -1.00 -0.17 0.00 -1.53 0.00 0.00 36.38 33.53 1weh s VAL 8 CO 0.03 0.00 0.98 -0.24 -3.33 0.00 0.00 175.10 172.55 1weh n SER 9 N -0.31 0.28 0.03 3.54 2.88 -0.47 -4.76 113.62 114.79 1weh n SER 9 Ca -0.15 1.14 0.11 0.00 -1.33 0.00 0.00 58.87 58.65 1weh n SER 9 Cb 0.64 -1.05 0.01 0.00 -0.75 0.00 0.00 64.21 63.06 1weh n SER 9 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1weh n SER 10 N 1.85 0.60 -0.23 -3.46 3.41 -1.26 -0.93 113.62 113.60 1weh n SER 10 Ca 0.18 -0.18 0.10 0.00 -0.26 0.00 0.00 58.87 58.71 1weh n SER 10 Cb 0.19 0.84 -0.06 0.00 -0.26 0.00 0.00 64.21 64.91 1weh n SER 10 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1weh n ARG 11 N -2.01 0.67 -1.65 4.33 1.85 -1.26 -3.09 116.66 115.50 1weh n ARG 11 Ca 0.02 -0.47 -0.58 0.00 -1.00 0.00 0.00 57.85 55.82 1weh n ARG 11 Cb 0.45 -1.47 -0.07 0.00 -1.05 0.00 0.00 32.46 30.31 1weh n ARG 11 CO 0.00 0.00 0.00 -0.11 -0.01 0.00 0.00 177.63 177.51 1weh n LEU 12 N -0.79 1.62 -4.81 2.89 7.94 -1.26 -4.84 117.00 117.75 1weh n LEU 12 Ca 0.06 1.12 -0.37 0.00 -1.11 0.00 0.00 56.01 55.71 1weh n LEU 12 Cb 0.39 -1.08 -0.06 0.00 0.53 0.00 0.00 43.42 43.20 1weh n LEU 12 CO 0.35 -0.91 0.40 -0.55 -1.11 0.00 0.00 177.39 175.57 1weh s SER 13 N 1.96 7.12 0.61 1.96 0.15 -1.26 -4.01 113.70 120.23 1weh s SER 13 Ca 0.94 1.43 0.31 0.00 0.70 0.00 0.00 55.95 59.32 1weh s SER 13 Cb -1.13 -2.42 1.73 0.00 -1.71 0.00 0.00 66.02 62.50 1weh s SER 13 CO 0.61 0.11 2.09 -0.65 1.20 0.00 0.00 173.24 176.60 1weh h PRO 14 N 3.80 0.00 -0.00 5.44 0.11 -1.95 0.89 132.00 140.29 1weh h PRO 14 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1weh h PRO 14 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1weh h PRO 14 CO 0.65 0.00 -0.15 0.39 -0.21 0.00 0.00 178.00 178.68 1weh n GLU 15 N -3.55 0.32 -2.54 1.05 4.71 -1.26 -4.67 120.64 114.71 1weh n GLU 15 Ca 0.01 -0.10 -0.41 0.00 -0.01 0.00 0.00 57.16 56.65 1weh n GLU 15 Cb 0.33 -1.50 -0.04 0.00 -1.01 0.00 0.00 31.44 29.23 1weh n GLU 15 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1weh s ASP 16 N -2.75 7.29 0.50 1.62 -1.08 0.31 -4.92 116.67 117.64 1weh s ASP 16 Ca 0.21 2.05 0.19 0.00 -0.52 0.00 0.00 52.55 54.47 1weh s ASP 16 Cb 0.19 -2.60 1.25 0.00 -1.46 0.00 0.00 42.92 40.30 1weh s ASP 16 CO 0.54 -0.21 2.06 -0.65 0.52 0.00 0.00 175.17 177.42 1weh h PRO 17 N 5.23 0.10 -0.05 4.34 0.11 -1.87 -1.37 132.00 138.50 1weh h PRO 17 Ca -0.44 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.61 1weh h PRO 17 Cb 1.21 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1weh h PRO 17 CO 0.73 0.07 -0.21 -0.07 -0.21 0.00 0.00 178.00 178.30 1weh h LEU 18 N 0.10 0.08 -0.24 2.35 3.38 -1.91 -2.79 115.31 116.28 1weh h LEU 18 Ca 0.15 -0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.14 1weh h LEU 18 Cb 0.47 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.17 1weh h LEU 18 CO -0.02 0.30 0.01 0.22 0.09 0.00 0.00 178.44 179.04 1weh h TYR 19 N 0.08 0.01 -0.31 1.13 3.20 -1.49 0.31 116.97 119.91 1weh h TYR 19 Ca 0.01 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.86 1weh h TYR 19 Cb 0.42 0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.70 1weh h TYR 19 CO 0.00 -0.02 -0.00 0.00 -1.64 0.00 0.00 178.16 176.50 1weh h ALA 20 N 1.20 1.43 -0.36 1.82 0.00 -1.61 -1.46 119.26 120.29 1weh h ALA 20 Ca 0.11 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 1weh h ALA 20 Cb 0.14 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1weh h ALA 20 CO -0.18 0.41 -0.22 0.00 0.00 0.00 0.00 179.25 179.25 1weh h ARG 21 N 0.45 0.70 0.00 0.00 3.08 -1.01 -2.43 114.38 115.17 1weh h ARG 21 Ca 0.10 -0.27 -0.14 0.00 0.07 0.00 0.00 59.98 59.73 1weh h ARG 21 Cb 0.30 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 1weh h ARG 21 CO 0.01 0.86 -0.69 -1.49 -1.07 0.00 0.00 179.97 177.59 1weh h TRP 22 N 0.61 0.00 -0.36 3.04 -0.00 -0.44 -1.28 115.95 117.53 1weh h TRP 22 Ca 0.09 0.00 -0.02 0.00 -0.00 0.00 0.00 58.89 58.96 1weh h TRP 22 Cb 0.70 0.00 -0.02 0.00 -0.00 0.00 0.00 29.16 29.85 1weh h TRP 22 CO 0.03 0.69 0.15 0.28 -0.00 0.00 0.00 178.44 179.59 1weh h VAL 23 N 0.00 1.18 -0.94 1.49 2.07 -1.08 -0.91 116.25 118.06 1weh h VAL 23 Ca -0.01 -0.54 0.00 0.00 0.82 0.00 0.00 66.70 66.98 1weh h VAL 23 Cb 1.28 0.88 -0.05 0.00 -1.52 0.00 0.00 31.29 31.88 1weh h VAL 23 CO 0.09 0.19 0.60 -0.09 0.02 0.00 0.00 177.57 178.39 1weh h ARG 24 N 0.43 1.25 -0.57 1.57 9.65 -1.21 -0.81 114.38 124.68 1weh h ARG 24 Ca 0.12 -0.09 -0.01 0.00 -1.10 0.00 0.00 59.98 58.90 1weh h ARG 24 Cb 0.16 -0.28 -0.03 0.00 -1.39 0.00 0.00 29.97 28.44 1weh h ARG 24 CO -0.01 0.84 0.32 1.88 2.80 0.00 0.00 179.97 185.79 1weh h TYR 25 N 1.28 0.76 -0.44 2.20 -1.99 -0.67 -0.32 116.97 117.79 1weh h TYR 25 Ca 0.34 -0.01 -0.04 0.00 2.00 0.00 0.00 58.73 61.03 1weh h TYR 25 Cb -0.12 -0.25 -0.02 0.00 2.00 0.00 0.00 36.73 38.34 1weh h TYR 25 CO 0.00 0.53 0.13 0.78 -0.00 0.00 0.00 178.16 179.60 1weh h GLY 26 N 0.86 0.75 0.99 3.88 0.00 0.21 -1.09 103.07 108.66 1weh h GLY 26 Ca 0.20 -0.45 -0.00 0.00 0.00 0.00 0.00 47.33 47.08 1weh h GLY 26 CO -0.03 0.42 0.28 0.83 0.00 0.00 0.00 176.54 178.04 1weh h GLU 27 N 0.58 0.66 -0.44 4.80 5.08 -0.74 -2.46 114.58 122.06 1weh h GLU 27 Ca 0.14 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 1weh h GLU 27 Cb 0.28 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 1weh h GLU 27 CO -0.00 0.49 0.22 0.28 -1.00 0.00 0.00 179.01 179.00 1weh h VAL 28 N 0.64 1.18 -0.31 3.13 2.07 -0.89 -0.81 116.25 121.25 1weh h VAL 28 Ca 0.17 -0.50 -0.06 0.00 0.82 0.00 0.00 66.70 67.13 1weh h VAL 28 Cb 0.01 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 1weh h VAL 28 CO -0.03 0.19 -0.08 0.17 0.02 0.00 0.00 177.57 177.85 1weh h LEU 29 N 0.57 0.49 -0.52 2.57 8.10 -1.06 -0.70 115.31 124.76 1weh h LEU 29 Ca 0.15 -0.11 -0.10 0.00 0.11 0.00 0.00 57.88 57.92 1weh h LEU 29 Cb 0.11 -0.13 -0.02 0.00 -0.44 0.00 0.00 40.66 40.18 1weh h LEU 29 CO -0.02 0.62 -0.08 0.00 -4.11 0.00 0.00 178.44 174.84 1weh h ALA 30 N 1.44 0.71 -0.29 0.17 0.00 -1.19 -0.72 119.26 119.39 1weh h ALA 30 Ca 0.10 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 1weh h ALA 30 Cb 0.43 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1weh h ALA 30 CO 0.02 0.60 -0.02 0.93 0.00 0.00 0.00 179.25 180.79 1weh h GLU 31 N 0.85 0.45 0.00 0.00 5.08 -0.56 -1.59 114.58 118.80 1weh h GLU 31 Ca 0.14 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1weh h GLU 31 Cb 0.64 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.82 1weh h GLU 31 CO 0.04 0.49 0.00 0.39 -1.00 0.00 0.00 179.01 178.93 1weh n GLU 32 N -4.30 0.93 -0.47 2.33 -0.58 -0.32 -4.87 120.64 113.37 1weh n GLU 32 Ca 0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 1weh n GLU 32 Cb 0.24 -1.33 0.00 0.00 -0.57 0.00 0.00 31.44 29.78 1weh n GLU 32 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1weh n GLY 33 N 0.72 0.76 3.78 0.62 0.00 -0.60 -4.99 105.19 105.48 1weh n GLY 33 Ca 0.15 -0.06 -0.22 0.00 0.00 0.00 0.00 46.02 45.88 1weh n GLY 33 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1weh s PHE 34 N -2.00 3.01 0.55 1.61 0.40 -0.31 -4.56 117.98 116.69 1weh s PHE 34 Ca 0.00 -0.13 0.07 0.00 -0.60 0.00 0.00 56.93 56.27 1weh s PHE 34 Cb 0.00 -1.36 0.05 0.00 0.51 0.00 0.00 43.02 42.22 1weh s PHE 34 CO 0.00 0.54 0.53 0.20 0.70 0.00 0.00 175.22 177.19 1weh s GLY 35 N -3.74 2.15 -0.04 4.36 0.00 -0.21 -3.70 107.32 106.15 1weh s GLY 35 Ca 0.32 -1.58 0.06 0.00 0.00 0.00 0.00 44.72 43.53 1weh s GLY 35 CO 0.24 -1.84 -0.23 -2.27 0.00 0.00 0.00 173.10 168.99 1weh s LEU 36 N -4.40 2.19 -0.15 0.66 2.96 0.37 -1.27 118.68 119.05 1weh s LEU 36 Ca 0.44 -0.43 0.02 0.00 -0.22 0.00 0.00 54.13 53.94 1weh s LEU 36 Cb -0.03 -1.39 0.01 0.00 0.50 0.00 0.00 46.19 45.27 1weh s LEU 36 CO 0.27 0.30 -0.21 0.00 -1.32 0.00 0.00 176.35 175.39 1weh s ALA 37 N -0.48 2.29 0.30 5.97 0.00 -0.56 0.08 121.76 129.35 1weh s ALA 37 Ca 0.06 -1.10 -0.03 0.00 0.00 0.00 0.00 51.96 50.89 1weh s ALA 37 Cb -0.11 -1.04 0.01 0.00 0.00 0.00 0.00 23.12 21.98 1weh s ALA 37 CO 0.01 -0.06 0.44 0.00 0.00 0.00 0.00 175.76 176.15 1weh n GLY 39 N -0.48 -0.91 2.60 0.00 0.00 -1.26 -0.15 105.19 104.99 1weh n GLY 39 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1weh n GLY 39 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1weh n GLY 40 N 0.02 0.42 0.00 -0.02 0.00 -1.26 -3.73 105.19 100.62 1weh n GLY 40 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1weh n GLY 40 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1weh n TYR 41 N -2.49 0.00 -0.95 1.61 0.53 -1.26 -0.91 117.16 113.69 1weh n TYR 41 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.88 1weh n TYR 41 Cb 0.13 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.44 1weh n TYR 41 CO 0.00 0.00 0.00 1.04 -1.02 0.00 0.00 176.86 176.88 1weh n GLN 42 N 0.00 2.77 0.00 -0.72 3.00 -1.26 -2.79 117.38 118.37 1weh n GLN 42 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1weh n GLN 42 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 1weh n GLN 42 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1weh n GLY 43 N 5.00 3.03 2.02 1.08 0.00 -1.18 -3.35 105.19 111.79 1weh n GLY 43 Ca 0.00 -0.28 -0.00 0.00 0.00 0.00 0.00 46.02 45.73 1weh n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1weh n GLY 44 N 0.00 0.79 0.00 -0.02 0.00 -0.10 -2.10 105.19 103.75 1weh n GLY 44 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1weh n GLY 44 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1weh n GLU 46 N 2.09 0.00 -0.02 1.61 2.13 -1.12 -0.93 120.64 124.39 1weh n GLU 46 Ca 0.01 0.00 -0.10 0.00 0.66 0.00 0.00 57.16 57.72 1weh n GLU 46 Cb 0.06 0.00 -0.04 0.00 0.27 0.00 0.00 31.44 31.73 1weh n GLU 46 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1weh h ALA 47 N 0.00 0.19 -0.40 4.31 0.00 -1.73 0.76 119.26 122.39 1weh h ALA 47 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1weh h ALA 47 Cb 0.00 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1weh h ALA 47 CO 0.00 -0.33 0.19 -0.07 0.00 0.00 0.00 179.25 179.03 1weh h LEU 48 N 0.19 0.52 -0.80 0.00 3.38 -1.18 -2.68 115.31 114.74 1weh h LEU 48 Ca 0.06 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1weh h LEU 48 Cb -0.01 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.56 1weh h LEU 48 CO -0.02 0.51 0.51 0.00 0.09 0.00 0.00 178.44 179.53 1weh h ALA 49 N 1.03 1.02 -0.71 1.53 0.00 -1.73 -1.65 119.26 118.76 1weh h ALA 49 Ca 0.14 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.99 1weh h ALA 49 Cb 0.13 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 1weh h ALA 49 CO -0.02 0.46 0.46 0.00 0.00 0.00 0.00 179.25 180.15 1weh h ARG 50 N 1.09 0.89 -0.29 0.00 3.08 -0.66 -0.66 114.38 117.84 1weh h ARG 50 Ca 0.29 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.26 1weh h ARG 50 Cb -0.09 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 29.75 1weh h ARG 50 CO -0.06 0.59 0.09 0.78 -1.07 0.00 0.00 179.97 180.30 1weh h GLY 51 N 0.92 0.49 1.00 0.04 0.00 -1.13 -1.10 103.07 103.30 1weh h GLY 51 Ca 0.27 -0.30 0.01 0.00 0.00 0.00 0.00 47.33 47.31 1weh h GLY 51 CO -0.08 0.28 0.33 -2.08 0.00 0.00 0.00 176.54 174.98 1weh h VAL 52 N 0.31 1.13 -0.08 4.60 2.07 -1.02 -2.25 116.25 121.00 1weh h VAL 52 Ca 0.09 -0.23 -0.07 0.00 0.82 0.00 0.00 66.70 67.31 1weh h VAL 52 Cb 0.25 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 1weh h VAL 52 CO -0.00 0.12 -0.29 0.11 0.02 0.00 0.00 177.57 177.53 1weh h LYS 53 N 0.67 0.15 0.00 1.57 1.79 -1.03 -0.12 116.57 119.59 1weh h LYS 53 Ca 0.18 -0.05 -0.02 0.00 -2.18 0.00 0.00 60.65 58.58 1weh h LYS 53 Cb -0.08 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 30.56 1weh h LYS 53 CO -0.04 0.44 -0.10 0.00 -1.08 0.00 0.00 179.45 178.67 1weh h ALA 54 N 1.57 1.58 -0.52 3.86 0.00 -0.60 -1.99 119.26 123.15 1weh h ALA 54 Ca 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1weh h ALA 54 Cb 0.59 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1weh h ALA 54 CO 0.04 0.13 0.00 1.63 0.00 0.00 0.00 179.25 181.05 1weh n LYS 55 N -4.05 3.73 -1.04 0.00 4.76 -0.78 -4.96 118.16 115.82 1weh n LYS 55 Ca -0.02 -2.85 -0.01 0.00 -2.87 0.00 0.00 58.31 52.55 1weh n LYS 55 Cb 0.19 -1.90 -0.01 0.00 -1.84 0.00 0.00 35.03 31.48 1weh n LYS 55 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1weh n GLY 56 N 0.62 0.49 3.93 0.72 0.00 -0.75 -4.83 105.19 105.37 1weh n GLY 56 Ca 0.24 -0.23 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 1weh n GLY 56 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1weh s GLY 57 N -2.26 1.74 -0.07 -0.02 0.00 -0.13 -4.99 107.32 101.59 1weh s GLY 57 Ca 0.00 -1.14 -0.03 0.00 0.00 0.00 0.00 44.72 43.55 1weh s GLY 57 CO 0.00 -0.48 0.08 -2.27 0.00 0.00 0.00 173.10 170.43 1weh s LEU 58 N -5.69 3.97 -0.11 0.66 2.96 -1.26 -4.46 118.68 114.76 1weh s LEU 58 Ca 0.70 0.26 0.01 0.00 -0.22 0.00 0.00 54.13 54.88 1weh s LEU 58 Cb -0.06 -2.07 0.02 0.00 0.50 0.00 0.00 46.19 44.57 1weh s LEU 58 CO 0.50 0.35 -0.14 -0.69 -1.32 0.00 0.00 176.35 175.06 1weh s VAL 59 N -1.04 1.40 -0.16 1.68 1.01 -1.26 -0.48 120.40 121.54 1weh s VAL 59 Ca 0.17 -0.57 -0.03 0.00 0.00 0.00 0.00 61.98 61.55 1weh s VAL 59 Cb -0.12 -1.30 -0.03 0.00 0.00 0.00 0.00 36.38 34.94 1weh s VAL 59 CO 0.07 0.42 -0.04 -0.69 0.00 0.00 0.00 175.10 174.86 1weh s VAL 60 N 1.13 3.79 -0.23 2.92 1.01 0.11 -0.17 120.40 128.96 1weh s VAL 60 Ca -0.04 -0.39 -0.01 0.00 0.00 0.00 0.00 61.98 61.54 1weh s VAL 60 Cb -0.14 -2.66 0.02 0.00 0.00 0.00 0.00 36.38 33.60 1weh s VAL 60 CO -0.03 0.49 -0.10 -0.83 0.00 0.00 0.00 175.10 174.63 1weh s GLY 61 N 0.46 1.57 -0.78 4.51 0.00 0.70 -1.32 107.32 112.45 1weh s GLY 61 Ca -0.04 -1.40 -0.17 0.00 0.00 0.00 0.00 44.72 43.11 1weh s GLY 61 CO 0.03 0.46 0.86 0.14 0.00 0.00 0.00 173.10 174.59 1weh s VAL 62 N 1.31 5.09 0.88 1.40 1.01 0.79 -0.67 120.40 130.21 1weh s VAL 62 Ca 0.01 -1.73 -0.12 0.00 0.00 0.00 0.00 61.98 60.14 1weh s VAL 62 Cb -0.16 -4.57 0.16 0.00 0.00 0.00 0.00 36.38 31.81 1weh s VAL 62 CO -0.07 -1.21 1.22 0.42 0.00 0.00 0.00 175.10 175.47 1weh s THR 63 N 1.74 2.05 -0.43 3.92 -4.23 -1.14 -4.41 115.64 113.14 1weh s THR 63 Ca 0.20 -0.15 0.08 0.00 -1.18 0.00 0.00 61.69 60.65 1weh s THR 63 Cb -0.13 -2.90 0.29 0.00 1.34 0.00 0.00 72.50 71.10 1weh s THR 63 CO -0.04 0.00 0.79 0.00 -0.54 0.00 0.00 174.62 174.83 1weh n ALA 64 N -3.47 0.67 -0.31 3.99 0.00 -1.26 -0.43 120.51 119.69 1weh n ALA 64 Ca 0.14 -2.48 0.16 0.00 0.00 0.00 0.00 53.44 51.25 1weh n ALA 64 Cb 0.60 -1.05 0.34 0.00 0.00 0.00 0.00 19.45 19.34 1weh n ALA 64 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1weh h PRO 65 N 3.54 0.36 -0.25 0.00 0.13 -1.89 -0.81 132.00 133.08 1weh h PRO 65 Ca -0.01 -0.02 0.06 0.00 -0.87 0.00 0.00 66.00 65.15 1weh h PRO 65 Cb 0.99 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.02 1weh h PRO 65 CO 0.37 0.24 0.18 0.00 -0.23 0.00 0.00 178.00 178.56 1weh h ALA 66 N 1.75 2.15 0.00 -0.56 0.00 -1.92 -1.39 119.26 119.29 1weh h ALA 66 Ca 0.60 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.50 1weh h ALA 66 Cb 1.20 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1weh h ALA 66 CO -0.56 -0.21 -0.76 0.74 0.00 0.00 0.00 179.25 178.46 1weh h PHE 67 N 0.07 0.00 -2.11 0.00 -1.00 -1.51 -3.40 116.94 109.00 1weh h PHE 67 Ca 0.12 0.00 -0.53 0.00 2.81 0.00 0.00 57.97 60.37 1weh h PHE 67 Cb 0.38 0.00 -0.41 0.00 3.61 0.00 0.00 35.95 39.53 1weh h PHE 67 CO -0.00 0.00 -0.98 1.19 -1.61 0.00 0.00 178.31 176.91 1weh n PHE 68 N -2.75 1.60 -0.02 -0.55 3.01 -0.56 -4.90 117.46 113.29 1weh n PHE 68 Ca 0.01 -3.88 0.22 0.00 1.01 0.00 0.00 57.45 54.81 1weh n PHE 68 Cb 0.54 -0.44 0.70 0.00 -0.01 0.00 0.00 39.48 40.27 1weh n PHE 68 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1weh h PRO 69 N 3.13 0.00 0.00 -1.08 0.11 -1.70 0.43 132.00 132.89 1weh h PRO 69 Ca 0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.22 1weh h PRO 69 Cb 0.79 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.90 1weh h PRO 69 CO 0.62 0.00 0.00 1.05 -0.21 0.00 0.00 178.00 179.46 1weh h GLU 70 N 0.00 0.00 -4.49 1.05 -0.00 -1.90 -3.38 114.58 105.86 1weh h GLU 70 Ca 0.28 0.00 -0.72 0.00 -0.00 0.00 0.00 59.36 58.91 1weh h GLU 70 Cb 1.13 0.00 -0.21 0.00 -0.00 0.00 0.00 28.75 29.67 1weh h GLU 70 CO -0.00 0.00 -0.08 1.03 -0.00 0.00 0.00 179.01 179.96 1weh s ARG 71 N -3.58 3.03 0.55 1.06 0.52 0.15 -4.94 118.95 115.74 1weh s ARG 71 Ca 0.01 -1.36 0.46 0.00 -0.52 0.00 0.00 55.73 54.32 1weh s ARG 71 Cb 0.09 -4.22 1.68 0.00 0.52 0.00 0.00 34.95 33.02 1weh s ARG 71 CO 0.41 -1.33 1.65 0.00 0.02 0.00 0.00 175.30 176.05 1weh h ARG 72 N 8.99 0.00 0.00 3.54 -0.00 -1.81 -3.46 114.38 121.63 1weh h ARG 72 Ca -0.29 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.19 1weh h ARG 72 Cb 1.10 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.07 1weh h ARG 72 CO 1.02 0.00 0.00 0.41 0.00 0.00 0.00 179.97 181.40 1weh n GLY 73 N -1.88 -1.62 3.71 0.04 0.00 -1.26 -5.14 105.19 99.04 1weh n GLY 73 Ca 0.38 -1.17 -0.31 0.00 0.00 0.00 0.00 46.02 44.92 1weh n GLY 73 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1weh s PRO 74 N -1.69 1.51 0.86 1.61 0.04 -1.26 -4.89 135.00 131.17 1weh s PRO 74 Ca 0.00 1.27 -0.11 0.00 0.04 0.00 0.00 61.00 62.20 1weh s PRO 74 Cb 0.00 -1.80 0.11 0.00 0.04 0.00 0.00 34.50 32.85 1weh s PRO 74 CO 0.00 -2.20 1.10 0.54 0.04 0.00 0.00 177.00 176.48 1weh s ASN 75 N -3.07 3.64 0.62 6.66 2.20 -0.09 -4.89 114.94 120.01 1weh s ASN 75 Ca 0.64 1.86 0.36 0.00 -0.94 0.00 0.00 52.86 54.78 1weh s ASN 75 Cb -0.20 -2.46 1.98 0.00 -2.00 0.00 0.00 41.25 38.56 1weh s ASN 75 CO 0.57 -2.59 2.11 -0.65 -2.94 0.00 0.00 177.10 173.60 1weh h PRO 76 N -1.52 0.00 -0.23 3.55 0.11 -1.94 -2.50 132.00 129.48 1weh h PRO 76 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1weh h PRO 76 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1weh h PRO 76 CO 0.49 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 179.47 1weh n PHE 77 N -2.89 0.29 -3.03 0.65 3.01 -1.26 -4.88 117.46 109.35 1weh n PHE 77 Ca -0.02 -0.15 -0.40 0.00 1.01 0.00 0.00 57.45 57.89 1weh n PHE 77 Cb 0.18 0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 39.61 1weh n PHE 77 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1weh s VAL 78 N -1.71 5.01 -0.12 -4.37 1.01 -0.94 -4.61 120.40 114.67 1weh s VAL 78 Ca 0.34 1.44 -0.18 0.00 0.00 0.00 0.00 61.98 63.58 1weh s VAL 78 Cb 0.20 -4.04 -0.26 0.00 0.00 0.00 0.00 36.38 32.27 1weh s VAL 78 CO 0.29 0.19 0.54 0.44 0.00 0.00 0.00 175.10 176.56 1weh h ASP 79 N 6.97 0.29 -3.30 3.32 5.19 -0.90 -3.46 116.42 124.53 1weh h ASP 79 Ca -0.37 -0.82 -0.60 0.00 -0.62 0.00 0.00 57.03 54.61 1weh h ASP 79 Cb 1.18 -0.10 -0.34 0.00 0.18 0.00 0.00 39.33 40.25 1weh h ASP 79 CO 0.77 1.53 -0.85 -0.76 -3.12 0.00 0.00 179.24 176.82 1weh s LEU 80 N -7.67 1.83 -0.15 1.55 1.43 -0.86 -5.04 118.68 109.77 1weh s LEU 80 Ca -0.21 -0.45 -0.07 0.00 -1.03 0.00 0.00 54.13 52.37 1weh s LEU 80 Cb 0.04 -1.15 -0.04 0.00 0.03 0.00 0.00 46.19 45.06 1weh s LEU 80 CO 0.74 0.06 0.10 -0.70 0.23 0.00 0.00 176.35 176.77 1weh s GLU 81 N 0.78 3.66 -0.49 1.70 2.12 -1.26 -0.22 118.70 124.99 1weh s GLU 81 Ca -0.11 -0.24 0.03 0.00 0.36 0.00 0.00 54.97 55.02 1weh s GLU 81 Cb -0.16 -3.19 0.15 0.00 0.26 0.00 0.00 34.13 31.19 1weh s GLU 81 CO 0.01 0.55 0.31 -1.17 -0.54 0.00 0.00 175.26 174.43 1weh s LEU 82 N -0.40 2.89 0.18 2.70 2.96 0.16 -4.95 118.68 122.23 1weh s LEU 82 Ca 0.11 -2.96 -0.30 0.00 -0.22 0.00 0.00 54.13 50.75 1weh s LEU 82 Cb -0.12 -1.05 -0.09 0.00 0.50 0.00 0.00 46.19 45.44 1weh s LEU 82 CO 0.02 -0.21 1.37 -2.16 -1.32 0.00 0.00 176.35 174.05 1weh s PRO 83 N -0.08 4.33 0.04 0.98 0.04 -1.26 -2.90 135.00 136.16 1weh s PRO 83 Ca 0.22 2.13 0.04 0.00 0.04 0.00 0.00 61.00 63.43 1weh s PRO 83 Cb -0.15 -3.19 -0.04 0.00 0.04 0.00 0.00 34.50 31.17 1weh s PRO 83 CO -0.07 -0.36 -0.06 0.00 0.04 0.00 0.00 177.00 176.54 1weh s ALA 84 N 0.43 3.04 -0.31 8.56 0.00 0.42 -4.92 121.76 128.99 1weh s ALA 84 Ca 0.60 -1.09 0.23 0.00 0.00 0.00 0.00 51.96 51.70 1weh s ALA 84 Cb -0.38 -1.09 -0.02 0.00 0.00 0.00 0.00 23.12 21.63 1weh s ALA 84 CO 0.37 0.63 0.96 0.00 0.00 0.00 0.00 175.76 177.72 1weh n ALA 85 N 1.21 2.78 -2.16 0.00 0.00 -1.26 -4.25 120.51 116.83 1weh n ALA 85 Ca -0.14 -0.32 -0.10 0.00 0.00 0.00 0.00 53.44 52.88 1weh n ALA 85 Cb 0.52 -1.02 -0.10 0.00 0.00 0.00 0.00 19.45 18.85 1weh n ALA 85 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1weh s THR 86 N -3.34 0.30 0.09 0.00 -4.23 -1.26 -4.93 115.64 102.27 1weh s THR 86 Ca -0.00 -1.91 -0.17 0.00 -1.18 0.00 0.00 61.69 58.43 1weh s THR 86 Cb 0.12 -1.93 -0.08 0.00 1.34 0.00 0.00 72.50 71.95 1weh s THR 86 CO 0.81 -0.61 1.46 -0.07 -0.54 0.00 0.00 174.62 175.67 1weh h LEU 87 N 2.89 0.57 -1.17 4.79 3.38 -1.99 -1.27 115.31 122.51 1weh h LEU 87 Ca -0.35 -0.40 0.01 0.00 0.09 0.00 0.00 57.88 57.23 1weh h LEU 87 Cb 1.19 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.74 1weh h LEU 87 CO 0.62 0.84 0.56 -0.65 0.09 0.00 0.00 178.44 179.90 1weh h PRO 88 N 0.29 1.10 -0.61 1.13 0.11 -1.99 -0.92 132.00 131.10 1weh h PRO 88 Ca 0.06 -0.07 -0.10 0.00 0.11 0.00 0.00 66.00 66.01 1weh h PRO 88 Cb 0.62 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 31.46 1weh h PRO 88 CO 0.04 0.73 -0.00 0.37 -0.21 0.00 0.00 178.00 178.92 1weh h GLN 89 N 1.13 1.09 -0.14 1.05 4.15 -1.94 0.42 115.11 120.86 1weh h GLN 89 Ca 0.32 -0.35 -0.00 0.00 0.77 0.00 0.00 58.65 59.38 1weh h GLN 89 Cb -0.10 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.48 1weh h GLN 89 CO -0.07 1.06 0.07 -0.09 -1.93 0.00 0.00 178.83 177.87 1weh h ARG 90 N 0.99 0.20 -0.23 1.69 2.43 -0.61 -1.28 114.38 117.57 1weh h ARG 90 Ca 0.17 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.30 1weh h ARG 90 Cb 0.57 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.07 1weh h ARG 90 CO 0.03 0.24 0.08 0.82 -1.51 0.00 0.00 179.97 179.63 1weh h ILE 91 N 0.12 1.19 -0.94 1.20 2.04 -1.04 -2.10 117.51 117.97 1weh h ILE 91 Ca 0.05 -0.58 0.12 0.00 1.00 0.00 0.00 64.86 65.45 1weh h ILE 91 Cb 0.10 1.13 -0.08 0.00 -0.74 0.00 0.00 36.82 37.23 1weh h ILE 91 CO -0.01 0.19 0.60 1.23 0.00 0.00 0.00 178.15 180.16 1weh h GLY 92 N 0.21 1.43 1.03 5.37 0.00 -0.77 -0.46 103.07 109.88 1weh h GLY 92 Ca 0.08 -0.37 -0.13 0.00 0.00 0.00 0.00 47.33 46.90 1weh h GLY 92 CO -0.00 0.15 -0.27 3.21 0.00 0.00 0.00 176.54 179.63 1weh h ARG 93 N 0.88 0.82 -0.71 4.80 3.08 -0.90 -1.48 114.38 120.87 1weh h ARG 93 Ca 0.46 -0.40 -0.02 0.00 0.07 0.00 0.00 59.98 60.10 1weh h ARG 93 Cb 0.53 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.55 1weh h ARG 93 CO -0.23 1.03 0.38 -0.07 -1.07 0.00 0.00 179.97 180.02 1weh h LEU 94 N 0.61 0.89 -0.64 3.04 3.38 -0.64 -1.36 115.31 120.60 1weh h LEU 94 Ca 0.07 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 1weh h LEU 94 Cb 0.84 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.34 1weh h LEU 94 CO 0.07 0.74 0.11 -0.07 0.09 0.00 0.00 178.44 179.38 1weh h LEU 95 N 0.98 1.01 -0.98 1.67 3.38 -1.00 -2.56 115.31 117.81 1weh h LEU 95 Ca 0.25 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1weh h LEU 95 Cb 0.05 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.53 1weh h LEU 95 CO -0.04 1.01 -0.12 0.44 0.09 0.00 0.00 178.44 179.82 1weh h ASP 96 N 0.96 0.00 0.76 -0.43 3.32 -1.01 -3.12 116.42 116.91 1weh h ASP 96 Ca 0.19 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 57.02 1weh h ASP 96 Cb 0.42 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 1weh h ASP 96 CO 0.01 0.12 -1.02 -0.07 -1.72 0.00 0.00 179.24 176.56 1weh h LEU 97 N 0.00 0.19 -9.89 1.55 3.38 -0.93 -3.47 115.31 106.14 1weh h LEU 97 Ca -0.00 -0.19 -0.58 0.00 0.09 0.00 0.00 57.88 57.20 1weh h LEU 97 Cb 0.74 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.39 1weh h LEU 97 CO 0.02 1.09 -0.29 -0.83 0.09 0.00 0.00 178.44 178.52 1weh s GLY 98 N -4.63 2.27 0.14 0.83 0.00 -0.99 -4.31 107.32 100.63 1weh s GLY 98 Ca -0.02 -0.49 0.25 0.00 0.00 0.00 0.00 44.72 44.46 1weh s GLY 98 CO 0.84 -0.36 1.44 0.00 0.00 0.00 0.00 173.10 175.01 1weh n ALA 99 N 0.40 2.77 -3.71 3.20 0.00 0.24 -4.92 120.51 118.48 1weh n ALA 99 Ca -0.05 -0.19 -0.07 0.00 0.00 0.00 0.00 53.44 53.13 1weh n ALA 99 Cb 0.52 -1.25 -0.02 0.00 0.00 0.00 0.00 19.45 18.70 1weh n ALA 99 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1weh s GLY 100 N -3.63 -0.27 0.06 0.00 0.00 -1.25 -4.33 107.32 97.90 1weh s GLY 100 Ca 0.07 0.11 0.04 0.00 0.00 0.00 0.00 44.72 44.94 1weh s GLY 100 CO 0.69 0.03 -0.12 -0.19 0.00 0.00 0.00 173.10 173.50 1weh s TYR 101 N -3.62 1.06 -0.06 1.90 1.51 0.13 -1.82 117.35 116.44 1weh s TYR 101 Ca 0.09 -0.47 -0.00 0.00 -1.01 0.00 0.00 57.07 55.68 1weh s TYR 101 Cb -0.03 -0.60 0.02 0.00 -0.11 0.00 0.00 41.96 41.24 1weh s TYR 101 CO 0.00 0.02 -0.02 -1.17 -1.11 0.00 0.00 175.55 173.26 1weh s LEU 102 N -1.69 0.97 -0.40 -1.29 2.96 -0.38 -0.88 118.68 117.96 1weh s LEU 102 Ca -0.04 -0.12 -0.10 0.00 -0.22 0.00 0.00 54.13 53.65 1weh s LEU 102 Cb -0.10 -0.47 0.06 0.00 0.50 0.00 0.00 46.19 46.18 1weh s LEU 102 CO 0.02 -0.13 0.24 0.00 -1.32 0.00 0.00 176.35 175.16 1weh s ALA 103 N 1.47 3.28 0.68 5.97 0.00 0.23 -0.78 121.76 132.61 1weh s ALA 103 Ca -0.02 -1.99 -0.05 0.00 0.00 0.00 0.00 51.96 49.90 1weh s ALA 103 Cb -0.13 -2.62 0.07 0.00 0.00 0.00 0.00 23.12 20.43 1weh s ALA 103 CO -0.03 -1.55 0.97 -0.51 0.00 0.00 0.00 175.76 174.64 1weh s LEU 104 N 1.47 2.93 0.34 0.00 1.43 0.83 -1.35 118.68 124.33 1weh s LEU 104 Ca 0.02 0.26 -0.28 0.00 -1.03 0.00 0.00 54.13 53.10 1weh s LEU 104 Cb -0.22 -2.90 -0.12 0.00 0.03 0.00 0.00 46.19 42.98 1weh s LEU 104 CO 0.04 -1.57 1.33 -2.65 0.23 0.00 0.00 176.35 173.73 1weh n PRO 105 N -2.82 2.23 -1.51 1.29 -0.02 -1.26 -4.51 135.00 128.39 1weh n PRO 105 Ca 0.09 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.35 1weh n PRO 105 Cb 0.60 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 1weh n PRO 105 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1weh n GLY 106 N 0.78 1.05 0.00 -1.23 0.00 -1.26 -1.37 105.19 103.16 1weh n GLY 106 Ca 0.04 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.19 1weh n GLY 106 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1weh n GLY 107 N 0.00 2.70 0.37 -0.02 0.00 -1.26 -4.84 105.19 102.14 1weh n GLY 107 Ca 0.00 -1.96 0.12 0.00 0.00 0.00 0.00 46.02 44.18 1weh n GLY 107 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1weh h VAL 108 N 0.00 0.79 -0.43 1.61 2.07 -2.03 -0.09 116.25 118.18 1weh h VAL 108 Ca 0.00 -0.26 -0.08 0.00 0.82 0.00 0.00 66.70 67.17 1weh h VAL 108 Cb 0.00 -0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 29.71 1weh h VAL 108 CO 0.00 0.14 -0.07 1.23 0.02 0.00 0.00 177.57 178.89 1weh h GLY 109 N 0.77 0.80 1.45 2.17 0.00 -2.00 -0.50 103.07 105.75 1weh h GLY 109 Ca 0.51 -0.57 -0.18 0.00 0.00 0.00 0.00 47.33 47.10 1weh h GLY 109 CO -0.28 0.52 -0.62 -0.84 0.00 0.00 0.00 176.54 175.32 1weh h THR 110 N 0.68 1.33 -0.75 4.70 2.02 -1.54 -3.04 112.91 116.31 1weh h THR 110 Ca 0.12 -1.90 -0.05 0.00 0.77 0.00 0.00 66.41 65.35 1weh h THR 110 Cb 0.53 1.88 -0.03 0.00 -1.74 0.00 0.00 68.15 68.78 1weh h THR 110 CO 0.03 0.59 0.26 0.25 0.37 0.00 0.00 175.52 177.02 1weh h LEU 111 N 0.41 1.07 -0.87 2.58 5.85 -0.62 -1.59 115.31 122.14 1weh h LEU 111 Ca -0.01 -0.19 0.08 0.00 0.84 0.00 0.00 57.88 58.59 1weh h LEU 111 Cb 1.19 -0.28 -0.07 0.00 0.37 0.00 0.00 40.66 41.87 1weh h LEU 111 CO 0.12 0.97 0.53 0.00 -0.34 0.00 0.00 178.44 179.72 1weh h ALA 112 N 1.13 1.22 -0.18 1.25 0.00 -1.00 0.15 119.26 121.83 1weh h ALA 112 Ca 0.24 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.10 1weh h ALA 112 Cb 0.27 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1weh h ALA 112 CO -0.01 0.22 -0.12 0.93 0.00 0.00 0.00 179.25 180.27 1weh h GLU 113 N 0.92 0.39 0.11 0.00 5.08 -1.38 -2.49 114.58 117.21 1weh h GLU 113 Ca 0.40 -0.18 0.01 0.00 -1.00 0.00 0.00 59.36 58.58 1weh h GLU 113 Cb 0.26 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 1weh h GLU 113 CO -0.21 0.72 -0.18 1.25 -1.00 0.00 0.00 179.01 179.60 1weh h LEU 114 N 0.06 -0.48 -1.21 1.33 6.46 -0.72 -2.21 115.31 118.54 1weh h LEU 114 Ca 0.04 0.06 -0.05 0.00 -0.12 0.00 0.00 57.88 57.81 1weh h LEU 114 Cb 0.62 0.18 -0.02 0.00 -0.73 0.00 0.00 40.66 40.71 1weh h LEU 114 CO 0.03 -0.25 0.06 0.58 -0.62 0.00 0.00 178.44 178.23 1weh h VAL 115 N -0.35 1.20 -0.48 1.05 2.07 -0.76 0.31 116.25 119.28 1weh h VAL 115 Ca 0.02 -0.74 -0.07 0.00 0.82 0.00 0.00 66.70 66.73 1weh h VAL 115 Cb 0.36 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 1weh h VAL 115 CO -0.09 0.26 0.02 -0.07 0.02 0.00 0.00 177.57 177.72 1weh h LEU 116 N 0.58 0.82 -0.59 2.57 3.38 -1.27 0.23 115.31 121.04 1weh h LEU 116 Ca 0.13 -0.30 -0.05 0.00 0.09 0.00 0.00 57.88 57.75 1weh h LEU 116 Cb 0.29 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1weh h LEU 116 CO 0.00 0.92 0.18 0.00 0.09 0.00 0.00 178.44 179.63 1weh h ALA 117 N 0.94 0.78 -0.67 1.53 0.00 -1.00 -2.50 119.26 118.34 1weh h ALA 117 Ca 0.14 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1weh h ALA 117 Cb 0.48 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1weh h ALA 117 CO 0.02 0.45 0.43 2.35 0.00 0.00 0.00 179.25 182.50 1weh h TRP 118 N 0.85 0.85 -0.76 0.00 7.01 -0.65 -2.49 115.95 120.76 1weh h TRP 118 Ca 0.19 0.01 0.11 0.00 2.11 0.00 0.00 58.89 61.31 1weh h TRP 118 Cb 0.30 -0.29 -0.08 0.00 -2.10 0.00 0.00 29.16 26.99 1weh h TRP 118 CO 0.02 0.56 0.38 -0.97 -2.79 0.00 0.00 178.44 175.64 1weh h ASN 119 N 0.90 0.48 -0.64 2.65 -0.73 -0.14 0.69 115.58 118.80 1weh h ASN 119 Ca 0.24 0.07 -0.02 0.00 1.87 0.00 0.00 56.30 58.46 1weh h ASN 119 Cb -0.07 -0.00 -0.03 0.00 0.27 0.00 0.00 38.32 38.48 1weh h ASN 119 CO -0.05 0.25 0.32 -0.07 -0.37 0.00 0.00 177.43 177.50 1weh h LEU 120 N 0.61 0.82 -0.70 0.34 3.38 -1.03 -2.00 115.31 116.73 1weh h LEU 120 Ca 0.39 -0.12 -0.12 0.00 0.09 0.00 0.00 57.88 58.12 1weh h LEU 120 Cb 0.47 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1weh h LEU 120 CO -0.31 0.71 -0.29 -0.07 0.09 0.00 0.00 178.44 178.58 1weh h LEU 121 N 0.87 0.71 -1.56 1.67 3.38 -1.15 -3.01 115.31 116.23 1weh h LEU 121 Ca 0.22 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1weh h LEU 121 Cb 0.10 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1weh h LEU 121 CO -0.03 0.96 0.26 0.22 0.09 0.00 0.00 178.44 179.94 1weh h TYR 122 N 0.59 0.53 0.00 1.13 3.20 -0.46 -0.91 116.97 121.06 1weh h TYR 122 Ca 0.07 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.94 1weh h TYR 122 Cb 0.79 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 38.88 1weh h TYR 122 CO 0.04 0.35 -0.04 -0.07 -1.64 0.00 0.00 178.16 176.80 1weh h LEU 123 N 0.57 0.00 -2.29 2.82 3.38 -1.23 -3.46 115.31 115.09 1weh h LEU 123 Ca 0.15 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 57.68 1weh h LEU 123 Cb -0.04 0.00 0.04 0.00 0.09 0.00 0.00 40.66 40.75 1weh h LEU 123 CO -0.03 0.04 -0.88 0.54 0.09 0.00 0.00 178.44 178.19 1weh n ARG 124 N -3.86 -3.13 -0.98 1.13 1.74 -0.35 -4.90 116.66 106.32 1weh n ARG 124 Ca -0.03 0.51 0.04 0.00 -0.77 0.00 0.00 57.85 57.60 1weh n ARG 124 Cb 0.13 -4.66 0.07 0.00 -1.02 0.00 0.00 32.46 26.97 1weh n ARG 124 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1weh n ARG 125 N -4.24 0.46 -1.50 5.56 1.74 -1.26 -4.98 116.66 112.43 1weh n ARG 125 Ca -0.23 -2.14 -0.10 0.00 -0.77 0.00 0.00 57.85 54.62 1weh n ARG 125 Cb 0.65 -0.58 -0.03 0.00 -1.02 0.00 0.00 32.46 31.48 1weh n ARG 125 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1weh n GLY 126 N -0.12 0.84 3.85 -0.13 0.00 -1.26 -5.03 105.19 103.34 1weh n GLY 126 Ca 0.09 -0.56 -0.21 0.00 0.00 0.00 0.00 46.02 45.33 1weh n GLY 126 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1weh s VAL 127 N -2.39 3.77 0.00 1.61 -7.23 -1.26 -5.01 120.40 109.89 1weh s VAL 127 Ca 0.00 -1.37 0.00 0.00 -1.81 0.00 0.00 61.98 58.80 1weh s VAL 127 Cb 0.00 -3.24 0.00 0.00 0.56 0.00 0.00 36.38 33.70 1weh s VAL 127 CO 0.00 -0.22 0.00 0.61 -0.31 0.00 0.00 175.10 175.18 1weh n GLY 128 N -1.33 -1.90 3.37 2.32 0.00 -1.26 -4.33 105.19 102.06 1weh n GLY 128 Ca -0.03 -1.38 -0.10 0.00 0.00 0.00 0.00 46.02 44.51 1weh n GLY 128 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1weh s ARG 129 N 0.00 1.30 0.35 1.61 1.81 -1.26 -5.03 118.95 117.74 1weh s ARG 129 Ca 0.00 -1.37 -0.28 0.00 -1.72 0.00 0.00 55.73 52.36 1weh s ARG 129 Cb 0.00 0.37 -0.12 0.00 -0.45 0.00 0.00 34.95 34.75 1weh s ARG 129 CO 0.00 -0.49 1.27 -2.30 -0.68 0.00 0.00 175.30 173.10 1weh n PRO 130 N -0.29 2.05 -4.20 3.54 -0.02 -1.26 -4.78 135.00 130.04 1weh n PRO 130 Ca -0.02 0.72 -0.28 0.00 -2.02 0.00 0.00 63.50 61.90 1weh n PRO 130 Cb 0.64 -2.31 -0.17 0.00 -0.02 0.00 0.00 33.50 31.64 1weh n PRO 130 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1weh s LEU 131 N -1.04 1.59 0.07 2.45 2.96 -1.26 -0.69 118.68 122.76 1weh s LEU 131 Ca 0.56 -0.41 0.06 0.00 -0.22 0.00 0.00 54.13 54.12 1weh s LEU 131 Cb -0.57 -1.05 -0.04 0.00 0.50 0.00 0.00 46.19 45.04 1weh s LEU 131 CO 0.61 -0.04 -0.09 0.00 -1.32 0.00 0.00 176.35 175.51 1weh s ALA 132 N 1.29 2.96 0.07 5.97 0.00 -0.06 -1.29 121.76 130.69 1weh s ALA 132 Ca -0.01 -1.17 0.05 0.00 0.00 0.00 0.00 51.96 50.83 1weh s ALA 132 Cb -0.14 -0.96 -0.03 0.00 0.00 0.00 0.00 23.12 22.00 1weh s ALA 132 CO -0.06 0.63 -0.14 0.14 0.00 0.00 0.00 175.76 176.34 1weh s VAL 133 N -1.14 1.07 0.33 0.00 -7.23 0.92 -0.60 120.40 113.75 1weh s VAL 133 Ca 0.20 -1.25 -0.27 0.00 -1.81 0.00 0.00 61.98 58.85 1weh s VAL 133 Cb -0.11 -1.03 -0.09 0.00 0.56 0.00 0.00 36.38 35.71 1weh s VAL 133 CO 0.12 -0.21 1.06 -0.62 -0.31 0.00 0.00 175.10 175.13 1weh s ASP 134 N -1.66 7.09 0.53 4.85 2.15 -0.46 -1.40 116.67 127.78 1weh s ASP 134 Ca -0.02 2.12 0.44 0.00 0.43 0.00 0.00 52.55 55.52 1weh s ASP 134 Cb -0.10 -2.61 1.65 0.00 -0.30 0.00 0.00 42.92 41.56 1weh s ASP 134 CO 0.02 -0.26 1.63 -0.65 -0.17 0.00 0.00 175.17 175.75 1weh h PRO 135 N 3.26 0.02 -0.83 4.34 0.11 -1.92 -0.80 132.00 136.18 1weh h PRO 135 Ca -0.47 -0.00 0.20 0.00 0.11 0.00 0.00 66.00 65.84 1weh h PRO 135 Cb 1.21 -0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.17 1weh h PRO 135 CO 0.65 0.01 0.05 -0.92 -0.21 0.00 0.00 178.00 177.58 1weh h TYR 136 N 0.02 0.02 0.00 0.65 3.20 -1.95 -0.05 116.97 118.86 1weh h TYR 136 Ca 0.84 0.06 -0.03 0.00 3.14 0.00 0.00 58.73 62.74 1weh h TYR 136 Cb 3.24 0.12 -0.00 0.00 1.54 0.00 0.00 36.73 41.63 1weh h TYR 136 CO -0.00 -0.27 -0.15 -1.49 -1.64 0.00 0.00 178.16 174.60 1weh h TRP 137 N 0.11 0.00 0.00 -3.82 4.06 -1.49 -2.26 115.95 112.55 1weh h TRP 137 Ca 0.48 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.43 1weh h TRP 137 Cb 0.90 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.06 1weh h TRP 137 CO -0.41 0.15 0.00 1.28 -3.56 0.00 0.00 178.44 175.90 1weh n LEU 138 N -3.60 0.02 0.02 -4.49 4.77 -0.03 -0.59 117.00 113.09 1weh n LEU 138 Ca -0.01 0.50 0.14 0.00 -0.03 0.00 0.00 56.01 56.61 1weh n LEU 138 Cb 0.29 -0.50 0.57 0.00 -2.33 0.00 0.00 43.42 41.44 1weh n LEU 138 CO 0.31 -0.15 0.94 0.61 -1.33 0.00 0.00 177.39 177.77 1weh n GLY 139 N 0.63 -1.53 0.80 -0.72 0.00 -0.85 -4.20 105.19 99.32 1weh n GLY 139 Ca 0.05 -0.08 -0.05 0.00 0.00 0.00 0.00 46.02 45.93 1weh n GLY 139 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1weh n LEU 140 N -1.66 0.81 -4.63 0.99 7.94 -0.65 -4.98 117.00 114.81 1weh n LEU 140 Ca 0.07 0.12 -0.43 0.00 -1.11 0.00 0.00 56.01 54.66 1weh n LEU 140 Cb 0.35 -0.29 -0.03 0.00 0.53 0.00 0.00 43.42 43.98 1weh n LEU 140 CO 0.27 -0.17 0.87 -0.76 -1.11 0.00 0.00 177.39 176.50 1weh s LEU 141 N -6.70 3.96 0.19 -1.96 1.43 0.24 -4.98 118.68 110.85 1weh s LEU 141 Ca -0.08 0.91 -0.09 0.00 -1.03 0.00 0.00 54.13 53.84 1weh s LEU 141 Cb 0.03 -3.43 -0.01 0.00 0.03 0.00 0.00 46.19 42.81 1weh s LEU 141 CO 0.11 -0.84 0.31 -1.59 0.23 0.00 0.00 176.35 174.57 1weh s LYS 142 N 3.53 1.26 0.38 1.70 -2.85 -1.26 -4.57 119.74 117.93 1weh s LYS 142 Ca 0.42 -1.25 -0.28 0.00 -1.00 0.00 0.00 55.97 53.87 1weh s LYS 142 Cb -0.12 0.39 -0.11 0.00 -2.06 0.00 0.00 37.83 35.92 1weh s LYS 142 CO 0.16 -0.47 1.48 0.00 0.10 0.00 0.00 175.35 176.61 1weh n ALA 143 N -0.26 2.32 -3.32 0.59 0.00 -1.26 -4.97 120.51 113.61 1weh n ALA 143 Ca -0.05 0.33 0.03 0.00 0.00 0.00 0.00 53.44 53.75 1weh n ALA 143 Cb 0.63 -2.41 -0.03 0.00 0.00 0.00 0.00 19.45 17.63 1weh n ALA 143 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1weh s HIS 144 N -1.13 -0.72 0.00 0.00 5.04 0.02 -5.02 115.29 113.48 1weh s HIS 144 Ca 0.54 1.07 0.00 0.00 -1.54 0.00 0.00 55.06 55.13 1weh s HIS 144 Cb -0.47 0.37 0.00 0.00 0.04 0.00 0.00 32.58 32.51 1weh s HIS 144 CO 0.63 -0.37 0.00 0.41 -2.34 0.00 0.00 174.74 173.07 1weh n GLY 145 N 5.13 3.75 0.00 1.59 0.00 -1.26 -1.05 105.19 113.35 1weh n GLY 145 Ca -0.08 0.06 0.08 0.00 0.00 0.00 0.00 46.02 46.08 1weh n GLY 145 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1weh n GLU 146 N 14.00 0.03 -2.92 1.61 1.02 -1.26 -4.43 120.64 128.69 1weh n GLU 146 Ca 0.00 0.22 -0.43 0.00 -0.02 0.00 0.00 57.16 56.93 1weh n GLU 146 Cb 0.00 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 29.87 1weh n GLU 146 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1weh s ILE 147 N -2.94 4.51 0.61 -3.67 1.01 -0.22 -5.02 121.20 115.48 1weh s ILE 147 Ca 0.09 0.06 -0.09 0.00 0.00 0.00 0.00 60.65 60.71 1weh s ILE 147 Cb 0.10 -4.48 -0.01 0.00 0.01 0.00 0.00 42.46 38.08 1weh s ILE 147 CO 0.28 -1.04 0.97 0.00 0.00 0.00 0.00 174.94 175.14 1weh s ALA 148 N 3.61 3.16 0.37 9.38 0.00 -1.26 -0.80 121.76 136.21 1weh s ALA 148 Ca 0.26 -0.39 0.04 0.00 0.00 0.00 0.00 51.96 51.88 1weh s ALA 148 Cb -0.14 -2.85 0.72 0.00 0.00 0.00 0.00 23.12 20.85 1weh s ALA 148 CO 0.17 -0.76 2.01 -1.35 0.00 0.00 0.00 175.76 175.83 1weh h PRO 149 N -0.26 0.73 -0.02 0.00 0.11 -1.95 -0.29 132.00 130.33 1weh h PRO 149 Ca -0.45 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.55 1weh h PRO 149 Cb 1.22 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 1weh h PRO 149 CO 0.62 0.49 -0.29 0.93 -0.21 0.00 0.00 178.00 179.54 1weh h GLU 150 N 0.76 0.03 -0.21 1.05 3.07 -1.97 0.11 114.58 117.42 1weh h GLU 150 Ca 0.23 -0.01 -0.11 0.00 -0.50 0.00 0.00 59.36 58.97 1weh h GLU 150 Cb 0.01 -0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1weh h GLU 150 CO -0.06 0.32 -0.30 -0.44 -1.40 0.00 0.00 179.01 177.14 1weh h ASP 151 N 0.03 0.62 -0.02 1.42 3.32 -1.44 -2.65 116.42 117.70 1weh h ASP 151 Ca 0.00 -0.51 -0.04 0.00 0.02 0.00 0.00 57.03 56.50 1weh h ASP 151 Cb 0.53 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 1weh h ASP 151 CO 0.04 1.01 -0.09 0.58 -1.72 0.00 0.00 179.24 179.06 1weh h VAL 152 N 0.25 1.16 0.00 -1.35 2.07 -0.98 -1.73 116.25 115.67 1weh h VAL 152 Ca 0.02 -0.70 0.00 0.00 0.82 0.00 0.00 66.70 66.84 1weh h VAL 152 Cb 0.87 1.14 0.00 0.00 -1.52 0.00 0.00 31.29 31.78 1weh h VAL 152 CO 0.07 0.22 0.00 0.61 0.02 0.00 0.00 177.57 178.49 1weh n GLY 153 N -0.95 -1.07 0.23 2.17 0.00 0.35 -1.72 105.19 104.19 1weh n GLY 153 Ca -0.00 0.04 0.15 0.00 0.00 0.00 0.00 46.02 46.20 1weh n GLY 153 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1weh h LEU 154 N 0.00 0.00 -9.20 0.99 3.38 -1.10 -3.43 115.31 105.95 1weh h LEU 154 Ca 0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 1weh h LEU 154 Cb 0.26 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.96 1weh h LEU 154 CO 0.00 0.00 0.55 -0.76 0.09 0.00 0.00 178.44 178.32 1weh s LEU 155 N -5.82 4.20 0.33 1.67 1.43 -0.70 -4.73 118.68 115.06 1weh s LEU 155 Ca 0.04 1.39 -0.08 0.00 -1.03 0.00 0.00 54.13 54.45 1weh s LEU 155 Cb 0.08 -3.45 -0.06 0.00 0.03 0.00 0.00 46.19 42.79 1weh s LEU 155 CO 0.57 -0.47 0.65 -0.13 0.23 0.00 0.00 176.35 177.19 1weh s ARG 156 N 2.26 3.73 -0.17 1.70 0.52 -0.41 -4.92 118.95 121.65 1weh s ARG 156 Ca 0.44 0.25 -0.04 0.00 -0.52 0.00 0.00 55.73 55.87 1weh s ARG 156 Cb -0.17 -2.53 -0.02 0.00 0.52 0.00 0.00 34.95 32.74 1weh s ARG 156 CO 0.14 0.12 -0.04 0.08 0.02 0.00 0.00 175.30 175.62 1weh s VAL 157 N -2.17 3.78 -0.26 3.52 1.01 -1.26 -0.05 120.40 124.96 1weh s VAL 157 Ca 0.48 -0.39 0.02 0.00 0.00 0.00 0.00 61.98 62.08 1weh s VAL 157 Cb -0.11 -2.67 0.07 0.00 0.00 0.00 0.00 36.38 33.68 1weh s VAL 157 CO 0.29 0.48 -0.04 -0.69 0.00 0.00 0.00 175.10 175.14 1weh s VAL 158 N 0.60 1.75 -0.17 2.92 1.01 -0.49 -4.88 120.40 121.13 1weh s VAL 158 Ca -0.03 -1.52 0.16 0.00 0.00 0.00 0.00 61.98 60.59 1weh s VAL 158 Cb -0.14 -2.04 -0.23 0.00 0.00 0.00 0.00 36.38 33.97 1weh s VAL 158 CO 0.02 -0.21 0.41 0.00 0.00 0.00 0.00 175.10 175.32 1weh n ALA 159 N 4.56 2.87 -3.27 5.51 0.00 -1.26 -3.97 120.51 124.95 1weh n ALA 159 Ca -0.09 -0.39 -0.11 0.00 0.00 0.00 0.00 53.44 52.85 1weh n ALA 159 Cb 0.43 -0.54 -0.02 0.00 0.00 0.00 0.00 19.45 19.32 1weh n ALA 159 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1weh s ASP 160 N -3.52 0.37 0.54 0.00 3.84 -1.26 -4.99 116.67 111.65 1weh s ASP 160 Ca -0.03 -1.22 0.20 0.00 -0.00 0.00 0.00 52.55 51.50 1weh s ASP 160 Cb 0.10 0.71 1.44 0.00 -1.38 0.00 0.00 42.92 43.79 1weh s ASP 160 CO 0.65 -1.38 2.18 1.05 -0.00 0.00 0.00 175.17 177.67 1weh h GLU 161 N 2.10 0.00 -0.35 2.11 4.11 -1.97 -1.26 114.58 119.33 1weh h GLU 161 Ca -0.28 0.00 -0.12 0.00 0.07 0.00 0.00 59.36 59.02 1weh h GLU 161 Cb 1.25 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.49 1weh h GLU 161 CO 0.38 0.00 -0.27 0.93 0.07 0.00 0.00 179.01 180.12 1weh h GLU 162 N 0.00 0.79 -0.72 1.06 4.39 -1.99 -1.15 114.58 116.96 1weh h GLU 162 Ca -0.00 -0.39 -0.04 0.00 0.34 0.00 0.00 59.36 59.27 1weh h GLU 162 Cb 0.00 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.62 1weh h GLU 162 CO 0.00 1.02 0.30 -0.44 -1.16 0.00 0.00 179.01 178.73 1weh h ASP 163 N 0.58 0.99 -0.46 1.42 3.32 -1.74 -2.05 116.42 118.47 1weh h ASP 163 Ca 0.06 -0.17 0.02 0.00 0.02 0.00 0.00 57.03 56.96 1weh h ASP 163 Cb 0.84 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 40.10 1weh h ASP 163 CO 0.07 0.89 0.28 0.25 -1.72 0.00 0.00 179.24 179.00 1weh h LEU 164 N 1.03 0.45 -0.53 1.55 5.85 -1.02 0.32 115.31 122.96 1weh h LEU 164 Ca 0.24 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.93 1weh h LEU 164 Cb 0.20 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 1weh h LEU 164 CO -0.02 0.32 0.22 0.03 -0.34 0.00 0.00 178.44 178.65 1weh h ARG 165 N 0.56 0.80 -0.70 1.25 3.08 -0.96 -0.63 114.38 117.77 1weh h ARG 165 Ca 0.18 -0.14 -0.05 0.00 0.07 0.00 0.00 59.98 60.04 1weh h ARG 165 Cb 0.00 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 29.89 1weh h ARG 165 CO -0.08 0.70 0.25 0.00 -1.07 0.00 0.00 179.97 179.77 1weh h ARG 166 N 0.72 1.05 0.05 0.04 3.08 -1.00 -0.44 114.38 117.89 1weh h ARG 166 Ca 0.18 -0.20 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 1weh h ARG 166 Cb 0.19 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.08 1weh h ARG 166 CO -0.02 0.87 -0.02 0.35 -1.07 0.00 0.00 179.97 180.09 1weh h PHE 167 N 1.02 -0.06 -0.83 3.04 3.57 -0.54 -2.59 116.94 120.56 1weh h PHE 167 Ca 0.23 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.71 1weh h PHE 167 Cb 0.24 0.02 -0.04 0.00 2.79 0.00 0.00 35.95 38.96 1weh h PHE 167 CO 0.02 0.07 0.43 -0.07 -2.23 0.00 0.00 178.31 176.53 1weh h LEU 168 N -0.17 1.04 -1.11 0.59 3.38 -0.90 -1.80 115.31 116.35 1weh h LEU 168 Ca -0.01 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1weh h LEU 168 Cb 0.15 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.64 1weh h LEU 168 CO 0.01 0.86 0.00 0.03 0.09 0.00 0.00 178.44 179.43 1weh h ARG 169 N 1.16 0.00 -0.01 1.13 3.08 -0.96 -2.24 114.38 116.54 1weh h ARG 169 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.34 1weh h ARG 169 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.11 1weh h ARG 169 CO -0.04 0.00 -0.36 -1.13 -1.07 0.00 0.00 179.97 177.36 1weh n SER 170 N -2.50 1.34 0.00 7.04 3.41 -0.68 -5.09 113.62 117.14 1weh n SER 170 Ca 0.01 -1.08 0.14 0.00 -0.26 0.00 0.00 58.87 57.68 1weh n SER 170 Cb 0.22 0.28 0.83 0.00 -0.26 0.00 0.00 64.21 65.28 1weh n SER 170 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06