#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dwe s ALA 2 N 0.00 0.90 -0.36 0.00 0.00 -1.26 -1.79 121.76 119.25 3dwe s ALA 2 Ca 0.00 -0.21 -0.06 0.00 0.00 0.00 0.00 51.96 51.69 3dwe s ALA 2 Cb 0.00 -0.56 0.06 0.00 0.00 0.00 0.00 23.12 22.61 3dwe s ALA 2 CO 0.00 -0.10 0.14 -1.14 0.00 0.00 0.00 175.76 174.66 3dwe s GLN 3 N 1.11 2.52 0.59 0.00 0.74 0.38 -4.97 119.66 120.03 3dwe s GLN 3 Ca -0.08 -1.33 -0.15 0.00 0.05 0.00 0.00 55.36 53.86 3dwe s GLN 3 Cb -0.14 -3.52 -0.04 0.00 1.10 0.00 0.00 33.01 30.41 3dwe s GLN 3 CO -0.01 -0.77 1.03 0.95 -0.55 0.00 0.00 175.29 175.94 3dwe s THR 4 N 1.36 4.13 -1.56 -0.34 -4.23 -1.26 -1.38 115.64 112.37 3dwe s THR 4 Ca 0.00 0.93 -0.12 0.00 -1.18 0.00 0.00 61.69 61.32 3dwe s THR 4 Cb -0.21 -3.52 0.09 0.00 1.34 0.00 0.00 72.50 70.20 3dwe s THR 4 CO 0.01 -0.67 0.79 0.59 -0.54 0.00 0.00 174.62 174.80 3dwe n ASN 5 N -2.13 -3.15 -4.82 3.99 3.02 -0.90 -4.94 115.26 106.33 3dwe n ASN 5 Ca 0.08 -0.91 -0.32 0.00 -0.03 0.00 0.00 54.58 53.40 3dwe n ASN 5 Cb 0.53 -3.33 0.03 0.00 -0.61 0.00 0.00 39.78 36.40 3dwe n ASN 5 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3dwe s ALA 6 N -3.44 2.74 0.48 5.41 0.00 0.17 -5.00 121.76 122.12 3dwe s ALA 6 Ca 0.52 0.19 -0.22 0.00 0.00 0.00 0.00 51.96 52.44 3dwe s ALA 6 Cb -0.27 -3.19 -0.09 0.00 0.00 0.00 0.00 23.12 19.57 3dwe s ALA 6 CO 0.88 -1.00 1.02 -2.30 0.00 0.00 0.00 175.76 174.35 3dwe n PRO 7 N -2.65 1.28 -0.15 0.00 -0.02 -1.26 -4.76 135.00 127.43 3dwe n PRO 7 Ca 0.08 0.47 0.13 0.00 -2.02 0.00 0.00 63.50 62.15 3dwe n PRO 7 Cb 0.53 -2.12 0.47 0.00 -0.02 0.00 0.00 33.50 32.36 3dwe n PRO 7 CO 0.00 0.00 0.00 0.11 1.98 0.00 0.00 175.50 177.59 3dwe h TRP 8 N 1.26 0.54 -0.54 6.00 5.08 -1.90 -1.81 115.95 124.59 3dwe h TRP 8 Ca -0.46 0.01 -0.09 0.00 1.08 0.00 0.00 58.89 59.43 3dwe h TRP 8 Cb 1.34 -0.17 -0.02 0.00 -3.00 0.00 0.00 29.16 27.31 3dwe h TRP 8 CO 0.42 0.23 -0.04 0.78 -1.28 0.00 0.00 178.44 178.55 3dwe h GLY 9 N 0.49 1.02 0.84 11.11 0.00 -1.92 0.14 103.07 114.75 3dwe h GLY 9 Ca 0.34 -0.75 -0.02 0.00 0.00 0.00 0.00 47.33 46.90 3dwe h GLY 9 CO -0.11 0.69 0.03 1.41 0.00 0.00 0.00 176.54 178.56 3dwe h LEU 10 N 0.86 0.30 -1.16 3.11 3.38 -1.69 -1.84 115.31 118.28 3dwe h LEU 10 Ca 0.15 -0.25 0.05 0.00 0.09 0.00 0.00 57.88 57.92 3dwe h LEU 10 Cb 0.56 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.18 3dwe h LEU 10 CO 0.03 0.48 0.58 0.00 0.09 0.00 0.00 178.44 179.62 3dwe h ALA 11 N 0.83 1.50 -0.63 1.53 0.00 -1.19 -2.61 119.26 118.69 3dwe h ALA 11 Ca 0.06 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 3dwe h ALA 11 Cb 0.30 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3dwe h ALA 11 CO 0.00 0.39 0.13 -0.09 0.00 0.00 0.00 179.25 179.68 3dwe h ARG 12 N 1.05 1.02 0.00 0.00 9.65 -0.40 -2.84 114.38 122.86 3dwe h ARG 12 Ca 0.37 -0.26 0.00 0.00 -1.10 0.00 0.00 59.98 59.00 3dwe h ARG 12 Cb 0.14 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 28.59 3dwe h ARG 12 CO -0.13 0.94 0.00 0.82 2.80 0.00 0.00 179.97 184.40 3dwe h ILE 13 N 0.94 0.00 -0.26 1.20 2.04 -0.95 -2.32 117.51 118.17 3dwe h ILE 13 Ca 0.19 -0.30 -0.03 0.00 1.00 0.00 0.00 64.86 65.73 3dwe h ILE 13 Cb 0.39 1.15 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 3dwe h ILE 13 CO 0.01 0.00 -0.00 -1.54 0.00 0.00 0.00 178.15 176.61 3dwe n SER 14 N -2.71 3.58 -4.16 1.72 3.41 -1.08 -0.14 113.62 114.23 3dwe n SER 14 Ca 0.00 -3.13 -0.22 0.00 -0.26 0.00 0.00 58.87 55.26 3dwe n SER 14 Cb 0.22 -0.55 -0.14 0.00 -0.26 0.00 0.00 64.21 63.48 3dwe n SER 14 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3dwe s SER 15 N -2.09 1.86 0.00 4.04 0.15 -0.87 -4.77 113.70 112.03 3dwe s SER 15 Ca 0.42 -0.44 0.30 0.00 0.70 0.00 0.00 55.95 56.93 3dwe s SER 15 Cb 0.35 -0.14 1.50 0.00 -1.71 0.00 0.00 66.02 66.01 3dwe s SER 15 CO 0.07 0.09 2.03 0.35 1.20 0.00 0.00 173.24 176.98 3dwe n THR 16 N 2.03 0.00 -3.94 6.45 -2.24 -1.26 -4.87 114.28 110.45 3dwe n THR 16 Ca -0.17 -0.02 -0.10 0.00 -2.27 0.00 0.00 64.05 61.49 3dwe n THR 16 Cb 0.54 -0.38 -0.11 0.00 -2.10 0.00 0.00 70.33 68.28 3dwe n THR 16 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3dwe s SER 17 N -2.46 0.16 0.90 3.42 1.04 -1.26 -5.12 113.70 110.38 3dwe s SER 17 Ca 0.32 -0.38 -0.12 0.00 0.48 0.00 0.00 55.95 56.25 3dwe s SER 17 Cb 0.20 0.14 0.13 0.00 0.10 0.00 0.00 66.02 66.59 3dwe s SER 17 CO 0.45 -0.31 1.10 -2.16 0.98 0.00 0.00 173.24 173.30 3dwe s PRO 18 N -1.38 1.21 0.00 4.02 0.04 -1.26 -4.46 135.00 133.17 3dwe s PRO 18 Ca -0.15 0.56 0.00 0.00 0.04 0.00 0.00 61.00 61.45 3dwe s PRO 18 Cb -0.09 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.63 3dwe s PRO 18 CO -0.00 -2.21 0.00 0.41 0.04 0.00 0.00 177.00 175.24 3dwe n GLY 19 N -1.63 0.67 3.66 0.56 0.00 -1.26 -5.07 105.19 102.12 3dwe n GLY 19 Ca 0.06 -0.53 -0.26 0.00 0.00 0.00 0.00 46.02 45.29 3dwe n GLY 19 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dwe s THR 20 N -2.00 2.20 0.00 2.61 -4.23 -1.26 -5.07 115.64 107.88 3dwe s THR 20 Ca 0.00 -1.89 0.00 0.00 -1.18 0.00 0.00 61.69 58.62 3dwe s THR 20 Cb 0.00 -2.96 0.00 0.00 1.34 0.00 0.00 72.50 70.88 3dwe s THR 20 CO 0.00 -0.03 0.59 -1.54 -0.54 0.00 0.00 174.62 173.10 3dwe n SER 21 N -1.06 0.55 -4.41 3.99 3.41 -1.26 -4.72 113.62 110.11 3dwe n SER 21 Ca -0.03 -1.26 -0.33 0.00 -0.26 0.00 0.00 58.87 56.99 3dwe n SER 21 Cb 0.65 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.47 3dwe n SER 21 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3dwe s THR 22 N -0.26 3.27 -0.22 6.66 2.01 -1.26 -0.66 115.64 125.18 3dwe s THR 22 Ca 0.00 -0.59 -0.16 0.00 0.31 0.00 0.00 61.69 61.26 3dwe s THR 22 Cb 0.00 -2.39 -0.04 0.00 0.01 0.00 0.00 72.50 70.09 3dwe s THR 22 CO 0.00 0.52 0.40 -0.47 -0.69 0.00 0.00 174.62 174.39 3dwe s TYR 23 N 0.27 3.34 -0.13 4.92 5.04 -0.48 -4.50 117.35 125.81 3dwe s TYR 23 Ca -0.08 0.58 -0.02 0.00 -2.44 0.00 0.00 57.07 55.11 3dwe s TYR 23 Cb -0.15 -2.55 -0.03 0.00 0.35 0.00 0.00 41.96 39.58 3dwe s TYR 23 CO 0.05 -0.08 -0.06 0.71 -1.34 0.00 0.00 175.55 174.82 3dwe s TYR 24 N 1.56 2.96 0.00 4.97 1.51 -1.26 -0.47 117.35 126.63 3dwe s TYR 24 Ca 0.18 -0.31 -0.26 0.00 -1.01 0.00 0.00 57.07 55.67 3dwe s TYR 24 Cb -0.15 -1.89 0.06 0.00 -0.11 0.00 0.00 41.96 39.87 3dwe s TYR 24 CO 0.08 -0.00 0.59 1.52 -1.11 0.00 0.00 175.55 176.63 3dwe s TYR 25 N 0.14 -0.53 0.25 2.71 1.13 -0.74 -4.74 117.35 115.57 3dwe s TYR 25 Ca -0.03 0.77 -0.30 0.00 -1.41 0.00 0.00 57.07 56.10 3dwe s TYR 25 Cb -0.14 0.37 -0.10 0.00 -1.10 0.00 0.00 41.96 40.99 3dwe s TYR 25 CO 0.03 -0.62 1.45 0.34 -2.51 0.00 0.00 175.55 174.24 3dwe s ASP 26 N -1.59 6.63 0.62 -0.18 2.15 -1.26 -0.62 116.67 122.41 3dwe s ASP 26 Ca -0.08 2.68 0.31 0.00 0.43 0.00 0.00 52.55 55.89 3dwe s ASP 26 Cb -0.01 -2.62 1.70 0.00 -0.30 0.00 0.00 42.92 41.69 3dwe s ASP 26 CO 0.04 -0.72 2.05 -0.33 -0.17 0.00 0.00 175.17 176.03 3dwe h GLU 27 N 5.09 0.00 -0.76 4.34 4.39 -2.01 -1.64 114.58 123.99 3dwe h GLU 27 Ca -0.46 0.00 0.09 0.00 0.34 0.00 0.00 59.36 59.33 3dwe h GLU 27 Cb 1.22 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.82 3dwe h GLU 27 CO 0.78 0.00 0.50 0.66 -1.16 0.00 0.00 179.01 179.79 3dwe h SER 28 N 0.00 0.64 -4.89 1.42 4.64 -1.99 -3.46 113.55 109.91 3dwe h SER 28 Ca 0.08 0.01 -0.39 0.00 -0.47 0.00 0.00 61.79 61.03 3dwe h SER 28 Cb 0.61 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 3dwe h SER 28 CO -0.00 0.39 -0.57 0.00 -0.87 0.00 0.00 176.83 175.77 3dwe n ALA 29 N -2.45 -1.01 -1.01 5.18 0.00 -0.62 -0.91 120.51 119.69 3dwe n ALA 29 Ca 0.12 0.19 -0.00 0.00 0.00 0.00 0.00 53.44 53.75 3dwe n ALA 29 Cb 0.31 -3.28 -0.00 0.00 0.00 0.00 0.00 19.45 16.48 3dwe n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dwe n GLY 30 N -1.33 0.45 3.73 0.00 0.00 -1.26 -0.18 105.19 106.59 3dwe n GLY 30 Ca -0.07 -0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 3dwe n GLY 30 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3dwe n GLN 31 N -2.43 2.55 -0.32 1.61 7.27 -0.09 -1.83 117.38 124.14 3dwe n GLN 31 Ca -0.00 0.91 0.00 0.00 0.07 0.00 0.00 57.00 57.97 3dwe n GLN 31 Cb 0.08 -2.66 0.00 0.00 2.41 0.00 0.00 30.24 30.07 3dwe n GLN 31 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3dwe n GLY 32 N 2.05 1.26 4.01 1.69 0.00 -1.26 -4.81 105.19 108.12 3dwe n GLY 32 Ca 0.09 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.93 3dwe n GLY 32 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dwe s SER 33 N -3.09 5.71 0.01 1.61 1.04 -0.76 -0.86 113.70 117.36 3dwe s SER 33 Ca 0.00 -0.37 0.01 0.00 0.48 0.00 0.00 55.95 56.08 3dwe s SER 33 Cb 0.00 -0.77 -0.01 0.00 0.10 0.00 0.00 66.02 65.34 3dwe s SER 33 CO 0.00 -0.71 -0.05 0.00 0.98 0.00 0.00 173.24 173.46 3dwe s VAL 35 N -0.45 1.18 -0.03 0.00 1.01 0.15 -0.95 120.40 121.30 3dwe s VAL 35 Ca -0.02 -0.42 -0.22 0.00 0.00 0.00 0.00 61.98 61.31 3dwe s VAL 35 Cb -0.04 -1.13 -0.05 0.00 0.00 0.00 0.00 36.38 35.16 3dwe s VAL 35 CO -0.00 0.38 0.66 -0.31 0.00 0.00 0.00 175.10 175.84 3dwe s TYR 36 N 1.31 3.63 -0.34 5.22 1.51 0.35 -1.21 117.35 127.83 3dwe s TYR 36 Ca -0.02 1.25 -0.05 0.00 -1.01 0.00 0.00 57.07 57.25 3dwe s TYR 36 Cb -0.14 -2.73 0.05 0.00 -0.11 0.00 0.00 41.96 39.03 3dwe s TYR 36 CO -0.04 0.21 0.08 0.08 -1.11 0.00 0.00 175.55 174.77 3dwe s VAL 37 N 0.33 3.50 -0.47 0.71 1.01 0.10 -0.30 120.40 125.27 3dwe s VAL 37 Ca 0.35 -1.30 -0.15 0.00 0.00 0.00 0.00 61.98 60.87 3dwe s VAL 37 Cb -0.18 -3.03 0.08 0.00 0.00 0.00 0.00 36.38 33.25 3dwe s VAL 37 CO 0.18 -0.21 0.40 -0.63 0.00 0.00 0.00 175.10 174.84 3dwe s ILE 38 N 1.33 5.21 0.00 2.22 1.01 -0.80 -1.67 121.20 128.50 3dwe s ILE 38 Ca -0.02 -1.10 0.00 0.00 0.00 0.00 0.00 60.65 59.53 3dwe s ILE 38 Cb -0.20 -4.12 0.00 0.00 0.01 0.00 0.00 42.46 38.15 3dwe s ILE 38 CO 0.01 -0.59 0.00 -0.67 0.00 0.00 0.00 174.94 173.69 3dwe n ASP 39 N 5.20 0.79 -0.23 3.58 -0.08 -0.39 -4.22 116.55 121.20 3dwe n ASP 39 Ca -0.12 0.00 0.09 0.00 -1.51 0.00 0.00 54.79 53.25 3dwe n ASP 39 Cb 0.43 0.00 0.45 0.00 2.34 0.00 0.00 41.12 44.34 3dwe n ASP 39 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 3dwe n THR 40 N 0.00 0.09 0.00 5.18 -2.24 -1.26 -1.44 114.28 114.61 3dwe n THR 40 Ca 0.00 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 3dwe n THR 40 Cb 0.00 -0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.22 3dwe n THR 40 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dwe n GLY 41 N 0.91 -1.30 2.77 3.38 0.00 -1.26 -4.02 105.19 105.68 3dwe n GLY 41 Ca 0.14 -2.22 -0.15 0.00 0.00 0.00 0.00 46.02 43.79 3dwe n GLY 41 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dwe s ILE 42 N -0.70 -0.06 -1.02 -0.61 1.01 -1.26 -2.82 121.20 115.75 3dwe s ILE 42 Ca 0.00 0.21 -0.23 0.00 0.00 0.00 0.00 60.65 60.63 3dwe s ILE 42 Cb 0.00 -0.08 0.01 0.00 0.01 0.00 0.00 42.46 42.41 3dwe s ILE 42 CO 0.00 0.09 1.65 -0.70 0.00 0.00 0.00 174.94 175.98 3dwe s GLU 43 N 1.04 3.25 0.53 2.79 2.12 -1.26 -4.61 118.70 122.56 3dwe s GLU 43 Ca -0.09 -0.94 0.25 0.00 0.36 0.00 0.00 54.97 54.55 3dwe s GLU 43 Cb -0.13 -5.28 1.45 0.00 0.26 0.00 0.00 34.13 30.44 3dwe s GLU 43 CO -0.03 -2.66 2.11 0.00 -0.54 0.00 0.00 175.26 174.13 3dwe h ALA 44 N 10.06 1.45 0.00 6.30 0.00 -1.96 -1.92 119.26 133.19 3dwe h ALA 44 Ca 0.19 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3dwe h ALA 44 Cb 0.99 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.77 3dwe h ALA 44 CO 1.35 0.12 0.00 -1.13 0.00 0.00 0.00 179.25 179.60 3dwe n SER 45 N -3.86 0.00 -4.69 0.00 3.41 -1.26 -4.63 113.62 102.60 3dwe n SER 45 Ca -0.02 0.36 -0.43 0.00 -0.26 0.00 0.00 58.87 58.51 3dwe n SER 45 Cb 0.19 -0.44 -0.03 0.00 -0.26 0.00 0.00 64.21 63.67 3dwe n SER 45 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 3dwe n HIS 46 N -1.44 2.58 -0.22 7.33 -0.00 -0.72 -4.84 115.22 117.91 3dwe n HIS 46 Ca 0.06 -0.09 0.29 0.00 0.46 0.00 0.00 57.72 58.44 3dwe n HIS 46 Cb 0.22 -2.71 0.71 0.00 -0.12 0.00 0.00 29.99 28.08 3dwe n HIS 46 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 3dwe h PRO 47 N 8.28 0.04 0.00 1.57 0.11 -1.91 -0.55 132.00 139.55 3dwe h PRO 47 Ca -0.46 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 3dwe h PRO 47 Cb 1.23 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 3dwe h PRO 47 CO 0.94 0.03 -0.00 0.93 -0.21 0.00 0.00 178.00 179.69 3dwe h GLU 48 N 0.05 0.00 0.00 1.05 4.39 -1.95 -2.31 114.58 115.81 3dwe h GLU 48 Ca 0.46 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.16 3dwe h GLU 48 Cb 1.77 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.42 3dwe h GLU 48 CO -0.03 0.00 -0.80 1.19 -1.16 0.00 0.00 179.01 178.22 3dwe n PHE 49 N -3.17 0.48 -2.52 4.33 3.72 -0.21 -1.20 117.46 118.88 3dwe n PHE 49 Ca -0.02 0.14 -0.18 0.00 -0.05 0.00 0.00 57.45 57.33 3dwe n PHE 49 Cb 0.11 -0.60 -0.00 0.00 -0.94 0.00 0.00 39.48 38.05 3dwe n PHE 49 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3dwe n GLU 50 N -2.09 -2.27 -0.96 -1.08 1.02 -0.87 -0.71 120.64 113.67 3dwe n GLU 50 Ca 0.03 0.84 0.00 0.00 -0.02 0.00 0.00 57.16 58.00 3dwe n GLU 50 Cb 0.45 -5.50 0.00 0.00 -0.02 0.00 0.00 31.44 26.36 3dwe n GLU 50 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dwe n GLY 51 N -1.00 0.92 0.24 0.62 0.00 -1.26 -4.89 105.19 99.81 3dwe n GLY 51 Ca -0.19 0.00 0.14 0.00 0.00 0.00 0.00 46.02 45.97 3dwe n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dwe n ARG 52 N -2.13 0.95 -4.19 1.61 1.74 0.11 -4.86 116.66 109.89 3dwe n ARG 52 Ca 0.00 -0.47 -0.31 0.00 -0.77 0.00 0.00 57.85 56.29 3dwe n ARG 52 Cb 0.00 -1.49 -0.08 0.00 -1.02 0.00 0.00 32.46 29.87 3dwe n ARG 52 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3dwe s ALA 53 N -2.38 3.30 -0.08 7.54 0.00 -1.26 -0.64 121.76 128.24 3dwe s ALA 53 Ca 0.29 -1.04 -0.21 0.00 0.00 0.00 0.00 51.96 51.00 3dwe s ALA 53 Cb 0.20 -1.26 0.05 0.00 0.00 0.00 0.00 23.12 22.10 3dwe s ALA 53 CO 0.46 0.68 0.48 -0.65 0.00 0.00 0.00 175.76 176.74 3dwe s GLN 54 N -2.01 0.77 0.08 0.00 -0.21 -0.58 -4.81 119.66 112.89 3dwe s GLN 54 Ca 0.23 0.21 -0.30 0.00 0.02 0.00 0.00 55.36 55.53 3dwe s GLN 54 Cb -0.12 0.36 -0.05 0.00 1.00 0.00 0.00 33.01 34.20 3dwe s GLN 54 CO 0.15 -0.20 0.95 -1.64 -2.12 0.00 0.00 175.29 172.44 3dwe s MET 55 N -0.82 4.65 -0.00 2.91 -1.94 -1.26 -0.57 119.30 122.26 3dwe s MET 55 Ca -0.09 1.42 0.04 0.00 -1.71 0.00 0.00 55.69 55.35 3dwe s MET 55 Cb -0.03 -3.40 -0.05 0.00 2.01 0.00 0.00 34.83 33.36 3dwe s MET 55 CO 0.05 0.14 0.13 1.33 -0.01 0.00 0.00 175.02 176.66 3dwe n VAL 56 N 3.10 0.00 -3.62 -6.03 0.24 -0.22 -4.85 118.33 106.95 3dwe n VAL 56 Ca 0.03 -0.28 -0.13 0.00 -2.04 0.00 0.00 64.34 61.93 3dwe n VAL 56 Cb 0.50 0.75 -0.07 0.00 -1.47 0.00 0.00 33.84 33.55 3dwe n VAL 56 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 3dwe s LYS 57 N -1.73 0.74 0.04 7.34 2.47 -1.13 -5.04 119.74 122.43 3dwe s LYS 57 Ca 0.00 0.79 -0.01 0.00 -1.56 0.00 0.00 55.97 55.19 3dwe s LYS 57 Cb 0.03 0.36 -0.03 0.00 -1.46 0.00 0.00 37.83 36.72 3dwe s LYS 57 CO 0.15 -0.11 -0.03 -0.08 0.16 0.00 0.00 175.35 175.45 3dwe s THR 58 N 0.16 0.18 -0.73 3.43 -1.32 -1.26 -0.76 115.64 115.34 3dwe s THR 58 Ca 0.00 -1.46 0.09 0.00 -1.21 0.00 0.00 61.69 59.10 3dwe s THR 58 Cb -0.04 -1.04 0.25 0.00 -1.51 0.00 0.00 72.50 70.15 3dwe s THR 58 CO -0.01 -0.81 1.20 -1.22 -2.21 0.00 0.00 174.62 171.58 3dwe n TYR 59 N 0.68 0.37 -4.62 9.09 4.01 -1.07 -4.96 117.16 120.66 3dwe n TYR 59 Ca -0.18 -0.50 -0.28 0.00 -0.16 0.00 0.00 57.90 56.78 3dwe n TYR 59 Cb 0.59 -0.03 -0.06 0.00 -0.31 0.00 0.00 39.34 39.52 3dwe n TYR 59 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 3dwe n TYR 60 N 0.29 0.73 0.31 -0.72 4.01 -1.26 -5.03 117.16 115.49 3dwe n TYR 60 Ca 0.09 -2.39 0.19 0.00 -0.16 0.00 0.00 57.90 55.64 3dwe n TYR 60 Cb 0.40 -0.19 0.92 0.00 -0.31 0.00 0.00 39.34 40.15 3dwe n TYR 60 CO 0.00 0.00 0.00 1.88 -0.46 0.00 0.00 176.86 178.28 3dwe h TYR 61 N 1.39 0.00 -4.10 -0.72 -1.99 -2.01 -3.43 116.97 106.12 3dwe h TYR 61 Ca -0.36 0.00 -0.12 0.00 2.00 0.00 0.00 58.73 60.26 3dwe h TYR 61 Cb 1.17 0.00 -0.15 0.00 2.00 0.00 0.00 36.73 39.75 3dwe h TYR 61 CO 0.00 0.00 -0.60 0.45 -0.00 0.00 0.00 178.16 178.01 3dwe s SER 62 N -5.32 0.38 0.00 3.88 0.15 -1.26 -5.02 113.70 106.50 3dwe s SER 62 Ca -0.02 -0.87 0.25 0.00 0.70 0.00 0.00 55.95 56.02 3dwe s SER 62 Cb 0.11 0.23 0.51 0.00 -1.71 0.00 0.00 66.02 65.15 3dwe s SER 62 CO 0.46 -0.61 1.42 -1.54 1.20 0.00 0.00 173.24 174.18 3dwe n SER 63 N 0.20 2.01 -4.76 5.45 3.41 -1.26 -4.79 113.62 113.88 3dwe n SER 63 Ca -0.15 -1.56 -0.41 0.00 -0.26 0.00 0.00 58.87 56.49 3dwe n SER 63 Cb 0.61 0.12 -0.02 0.00 -0.26 0.00 0.00 64.21 64.66 3dwe n SER 63 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dwe s ARG 64 N -2.18 4.28 -0.76 4.33 3.03 -1.26 -4.55 118.95 121.84 3dwe s ARG 64 Ca 0.28 2.30 -0.27 0.00 2.03 0.00 0.00 55.73 60.08 3dwe s ARG 64 Cb 0.20 -3.08 0.03 0.00 -1.03 0.00 0.00 34.95 31.07 3dwe s ARG 64 CO 0.40 -0.34 1.29 0.34 -1.13 0.00 0.00 175.30 175.86 3dwe s ASP 65 N -0.03 6.18 -0.01 -2.89 2.15 -1.26 -4.83 116.67 115.98 3dwe s ASP 65 Ca 0.54 -0.52 0.15 0.00 0.43 0.00 0.00 52.55 53.15 3dwe s ASP 65 Cb -0.42 -2.56 0.44 0.00 -0.30 0.00 0.00 42.92 40.09 3dwe s ASP 65 CO 0.49 -1.82 1.36 0.61 -0.17 0.00 0.00 175.17 175.65 3dwe n GLY 66 N 5.47 1.40 0.63 2.66 0.00 -1.26 -4.43 105.19 109.66 3dwe n GLY 66 Ca 0.05 -0.54 -0.08 0.00 0.00 0.00 0.00 46.02 45.45 3dwe n GLY 66 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3dwe n ASN 67 N 0.90 1.21 0.00 1.61 2.85 -1.26 -4.91 115.26 115.66 3dwe n ASN 67 Ca 0.17 0.19 0.00 0.00 -0.11 0.00 0.00 54.58 54.83 3dwe n ASN 67 Cb 0.45 -0.45 0.00 0.00 1.24 0.00 0.00 39.78 41.03 3dwe n ASN 67 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3dwe n GLY 68 N 2.46 0.84 0.30 8.20 0.00 -1.26 -4.88 105.19 110.86 3dwe n GLY 68 Ca -0.13 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.83 3dwe n GLY 68 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3dwe h HIS 69 N 0.00 1.00 -0.80 1.61 -0.00 -1.94 0.14 115.15 115.15 3dwe h HIS 69 Ca 0.00 -0.02 -0.04 0.00 -0.00 0.00 0.00 60.37 60.30 3dwe h HIS 69 Cb 0.00 -0.32 -0.04 0.00 -0.00 0.00 0.00 27.41 27.06 3dwe h HIS 69 CO 0.00 0.70 0.33 0.78 -0.00 0.00 0.00 177.93 179.74 3dwe h GLY 70 N 1.00 1.28 1.12 5.26 0.00 -1.89 -1.16 103.07 108.67 3dwe h GLY 70 Ca 0.25 -0.69 -0.07 0.00 0.00 0.00 0.00 47.33 46.83 3dwe h GLY 70 CO -0.04 0.65 0.17 -0.84 0.00 0.00 0.00 176.54 176.48 3dwe h THR 71 N 1.17 1.26 0.01 4.70 2.02 -1.22 -0.24 112.91 120.60 3dwe h THR 71 Ca 0.27 -0.95 -0.00 0.00 0.77 0.00 0.00 66.41 66.49 3dwe h THR 71 Cb 0.21 0.55 0.00 0.00 -1.74 0.00 0.00 68.15 67.17 3dwe h THR 71 CO -0.02 0.37 -0.00 -0.74 0.37 0.00 0.00 175.52 175.49 3dwe h HIS 72 N 1.04 -0.01 -0.40 3.16 6.17 -0.59 -0.86 115.15 123.66 3dwe h HIS 72 Ca 0.22 -0.00 0.03 0.00 0.71 0.00 0.00 60.37 61.32 3dwe h HIS 72 Cb 0.36 0.00 -0.03 0.00 2.52 0.00 0.00 27.41 30.26 3dwe h HIS 72 CO 0.03 0.18 0.21 0.00 0.71 0.00 0.00 177.93 179.06 3dwe h ALA 74 N 1.20 1.51 -0.70 0.00 0.00 -0.95 -1.70 119.26 118.63 3dwe h ALA 74 Ca 0.17 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 3dwe h ALA 74 Cb 0.05 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 3dwe h ALA 74 CO -0.10 0.40 0.29 0.78 0.00 0.00 0.00 179.25 180.62 3dwe h GLY 75 N 1.01 1.10 1.71 0.00 0.00 -0.41 -0.92 103.07 105.55 3dwe h GLY 75 Ca 0.33 -0.57 -0.14 0.00 0.00 0.00 0.00 47.33 46.96 3dwe h GLY 75 CO -0.10 0.54 -0.53 -0.84 0.00 0.00 0.00 176.54 175.61 3dwe h THR 76 N 1.00 1.35 0.12 4.70 2.02 -0.63 -1.06 112.91 120.42 3dwe h THR 76 Ca 0.24 -1.80 -0.01 0.00 0.77 0.00 0.00 66.41 65.61 3dwe h THR 76 Cb 0.18 1.85 0.00 0.00 -1.74 0.00 0.00 68.15 68.44 3dwe h THR 76 CO -0.02 0.54 -0.06 0.58 0.37 0.00 0.00 175.52 176.93 3dwe h VAL 77 N 0.24 0.99 0.00 3.16 2.07 -0.91 -0.95 116.25 120.85 3dwe h VAL 77 Ca 0.01 -0.48 0.00 0.00 0.82 0.00 0.00 66.70 67.05 3dwe h VAL 77 Cb 1.01 1.29 0.00 0.00 -1.52 0.00 0.00 31.29 32.07 3dwe h VAL 77 CO 0.09 0.11 -0.04 0.61 0.02 0.00 0.00 177.57 178.36 3dwe n GLY 78 N -0.55 -0.94 3.77 2.17 0.00 -0.39 -0.77 105.19 108.47 3dwe n GLY 78 Ca -0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 3dwe n GLY 78 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dwe s SER 79 N -0.08 4.86 0.20 1.61 1.04 -0.44 -4.54 113.70 116.35 3dwe s SER 79 Ca 0.00 1.97 -0.11 0.00 0.48 0.00 0.00 55.95 58.28 3dwe s SER 79 Cb 0.00 -2.54 0.14 0.00 0.10 0.00 0.00 66.02 63.71 3dwe s SER 79 CO 0.00 -1.79 1.86 -0.09 0.98 0.00 0.00 173.24 174.19 3dwe h ARG 80 N -0.34 0.85 0.08 4.02 2.43 -1.44 -1.06 114.38 118.93 3dwe h ARG 80 Ca -0.46 -0.05 -0.37 0.00 -0.81 0.00 0.00 59.98 58.29 3dwe h ARG 80 Cb 1.24 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 30.57 3dwe h ARG 80 CO 0.53 0.56 -2.12 2.41 -1.51 0.00 0.00 179.97 179.84 3dwe n THR 81 N -4.65 1.69 0.81 0.20 -1.04 -1.26 -4.55 114.28 105.48 3dwe n THR 81 Ca 0.06 -0.60 0.10 0.00 -2.04 0.00 0.00 64.05 61.57 3dwe n THR 81 Cb 0.04 -1.66 0.10 0.00 -1.82 0.00 0.00 70.33 66.99 3dwe n THR 81 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 3dwe n TYR 82 N -3.47 0.05 -3.96 -1.42 4.01 -1.24 -4.73 117.16 106.39 3dwe n TYR 82 Ca -0.36 -0.03 -0.29 0.00 -0.16 0.00 0.00 57.90 57.06 3dwe n TYR 82 Cb 1.01 -0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 40.00 3dwe n TYR 82 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 3dwe s GLY 83 N -1.70 2.00 -0.01 2.72 0.00 -0.40 -4.12 107.32 105.80 3dwe s GLY 83 Ca 0.25 -0.94 -0.22 0.00 0.00 0.00 0.00 44.72 43.81 3dwe s GLY 83 CO 0.26 -0.93 1.16 -2.08 0.00 0.00 0.00 173.10 171.51 3dwe h VAL 84 N 2.02 1.45 -3.48 1.40 2.07 -0.82 -3.41 116.25 115.48 3dwe h VAL 84 Ca -0.46 -1.70 -0.69 0.00 0.82 0.00 0.00 66.70 64.67 3dwe h VAL 84 Cb 1.17 2.40 -0.36 0.00 -1.52 0.00 0.00 31.29 32.98 3dwe h VAL 84 CO 0.72 0.48 -0.36 0.00 0.02 0.00 0.00 177.57 178.42 3dwe s ALA 85 N -3.61 3.67 -1.56 1.67 0.00 0.05 -4.93 121.76 117.05 3dwe s ALA 85 Ca -0.15 -3.40 0.25 0.00 0.00 0.00 0.00 51.96 48.67 3dwe s ALA 85 Cb 0.03 -2.62 1.32 0.00 0.00 0.00 0.00 23.12 21.86 3dwe s ALA 85 CO 0.75 -2.11 1.85 1.63 0.00 0.00 0.00 175.76 177.88 3dwe n LYS 86 N 3.17 0.46 0.00 0.00 5.02 -1.02 -2.48 118.16 123.31 3dwe n LYS 86 Ca 0.10 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.43 3dwe n LYS 86 Cb 0.37 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.88 3dwe n LYS 86 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3dwe n LYS 87 N -1.22 2.32 -1.30 1.97 4.01 0.75 -4.70 118.16 119.99 3dwe n LYS 87 Ca 0.14 -1.28 -0.31 0.00 -0.51 0.00 0.00 58.31 56.34 3dwe n LYS 87 Cb 0.17 -0.91 0.09 0.00 -0.51 0.00 0.00 35.03 33.87 3dwe n LYS 87 CO 0.00 0.00 0.00 -0.08 -1.11 0.00 0.00 177.40 176.21 3dwe s THR 88 N -0.79 3.36 -0.09 -0.18 -1.32 -1.04 -3.94 115.64 111.65 3dwe s THR 88 Ca 0.00 0.44 -0.16 0.00 -1.21 0.00 0.00 61.69 60.76 3dwe s THR 88 Cb 0.00 -2.96 -0.05 0.00 -1.51 0.00 0.00 72.50 67.98 3dwe s THR 88 CO 0.00 -0.58 0.40 -1.10 -2.21 0.00 0.00 174.62 171.14 3dwe s GLN 89 N -4.93 4.15 -0.15 7.08 -1.52 -1.00 -4.88 119.66 118.42 3dwe s GLN 89 Ca 0.61 0.34 -0.02 0.00 -1.95 0.00 0.00 55.36 54.34 3dwe s GLN 89 Cb -0.17 -3.35 -0.02 0.00 -0.22 0.00 0.00 33.01 29.25 3dwe s GLN 89 CO 0.56 0.38 -0.07 -0.51 -0.25 0.00 0.00 175.29 175.39 3dwe s LEU 90 N -0.05 3.05 -0.17 2.90 1.43 0.18 -0.67 118.68 125.35 3dwe s LEU 90 Ca 0.23 -0.20 0.01 0.00 -1.03 0.00 0.00 54.13 53.14 3dwe s LEU 90 Cb -0.15 -1.72 0.02 0.00 0.03 0.00 0.00 46.19 44.37 3dwe s LEU 90 CO 0.10 0.17 -0.20 -0.36 0.23 0.00 0.00 176.35 176.29 3dwe s PHE 91 N 0.35 2.70 -0.10 0.29 0.08 -0.35 -1.52 117.98 119.43 3dwe s PHE 91 Ca -0.07 -1.54 -0.17 0.00 0.12 0.00 0.00 56.93 55.28 3dwe s PHE 91 Cb -0.15 -1.86 -0.05 0.00 -0.57 0.00 0.00 43.02 40.39 3dwe s PHE 91 CO 0.04 -0.75 0.43 0.20 -0.10 0.00 0.00 175.22 175.04 3dwe s GLY 92 N 1.18 2.38 -0.24 4.36 0.00 0.26 -0.73 107.32 114.54 3dwe s GLY 92 Ca 0.02 -0.24 0.01 0.00 0.00 0.00 0.00 44.72 44.51 3dwe s GLY 92 CO -0.10 0.56 -0.05 0.14 0.00 0.00 0.00 173.10 173.64 3dwe s VAL 93 N 0.17 1.63 -0.91 1.40 1.01 -0.67 -1.06 120.40 121.97 3dwe s VAL 93 Ca 0.24 -1.32 -0.20 0.00 0.00 0.00 0.00 61.98 60.70 3dwe s VAL 93 Cb -0.15 -1.89 0.11 0.00 0.00 0.00 0.00 36.38 34.45 3dwe s VAL 93 CO 0.10 -0.12 1.15 -0.75 0.00 0.00 0.00 175.10 175.48 3dwe s LYS 94 N 1.34 3.53 0.02 2.72 2.20 0.06 -1.26 119.74 128.35 3dwe s LYS 94 Ca -0.05 -1.55 0.22 0.00 -0.36 0.00 0.00 55.97 54.23 3dwe s LYS 94 Cb -0.19 -4.89 -0.01 0.00 -1.51 0.00 0.00 37.83 31.23 3dwe s LYS 94 CO -0.06 -1.84 1.00 1.33 -0.36 0.00 0.00 175.35 175.41 3dwe n VAL 95 N 5.75 0.06 -4.55 4.02 0.24 -0.52 -2.61 118.33 120.71 3dwe n VAL 95 Ca 0.22 -0.13 -0.34 0.00 -2.04 0.00 0.00 64.34 62.04 3dwe n VAL 95 Cb 0.49 0.50 -0.11 0.00 -1.47 0.00 0.00 33.84 33.25 3dwe n VAL 95 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 3dwe s LEU 96 N -3.47 3.26 0.00 1.34 1.43 -0.66 -4.51 118.68 116.07 3dwe s LEU 96 Ca 0.06 -0.00 -0.15 0.00 -1.03 0.00 0.00 54.13 53.00 3dwe s LEU 96 Cb 0.15 -1.73 0.22 0.00 0.03 0.00 0.00 46.19 44.87 3dwe s LEU 96 CO 0.82 0.34 0.95 -0.90 0.23 0.00 0.00 176.35 177.79 3dwe n ASP 97 N 2.37 -1.06 0.00 2.29 5.68 0.96 -4.34 116.55 122.46 3dwe n ASP 97 Ca -0.18 -1.18 0.10 0.00 -0.50 0.00 0.00 54.79 53.03 3dwe n ASP 97 Cb 0.53 -0.80 0.48 0.00 -1.14 0.00 0.00 41.12 40.19 3dwe n ASP 97 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 3dwe n ASP 98 N -4.15 0.00 -0.48 -1.12 8.00 -1.26 -0.82 116.55 116.72 3dwe n ASP 98 Ca 0.13 0.15 0.13 0.00 0.71 0.00 0.00 54.79 55.91 3dwe n ASP 98 Cb 0.46 -0.35 0.40 0.00 -0.02 0.00 0.00 41.12 41.61 3dwe n ASP 98 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3dwe n ASN 99 N -1.35 1.59 0.00 -2.24 5.03 -1.26 -4.22 115.26 112.81 3dwe n ASN 99 Ca 0.08 -1.40 0.00 0.00 0.87 0.00 0.00 54.58 54.13 3dwe n ASN 99 Cb 0.18 0.07 0.00 0.00 -1.02 0.00 0.00 39.78 39.01 3dwe n ASN 99 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3dwe n GLY 100 N 1.26 0.52 3.72 7.41 0.00 0.00 -5.05 105.19 113.05 3dwe n GLY 100 Ca 0.16 -0.51 -0.28 0.00 0.00 0.00 0.00 46.02 45.39 3dwe n GLY 100 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3dwe s SER 101 N -2.46 5.16 -0.27 1.61 0.01 -1.26 -4.80 113.70 111.69 3dwe s SER 101 Ca 0.00 -0.21 -0.22 0.00 1.31 0.00 0.00 55.95 56.82 3dwe s SER 101 Cb 0.00 -1.25 0.08 0.00 0.21 0.00 0.00 66.02 65.06 3dwe s SER 101 CO 0.00 0.11 0.74 -0.83 0.41 0.00 0.00 173.24 173.68 3dwe s GLY 102 N -2.77 -0.52 0.37 3.44 0.00 -1.26 -0.03 107.32 106.55 3dwe s GLY 102 Ca 0.28 2.23 -0.27 0.00 0.00 0.00 0.00 44.72 46.96 3dwe s GLY 102 CO 0.20 1.97 1.25 1.20 0.00 0.00 0.00 173.10 177.72 3dwe s GLN 103 N 0.75 4.16 0.38 2.90 1.11 -1.26 -4.88 119.66 122.81 3dwe s GLN 103 Ca -0.03 2.05 0.10 0.00 0.01 0.00 0.00 55.36 57.49 3dwe s GLN 103 Cb -0.05 -2.86 0.86 0.00 -1.01 0.00 0.00 33.01 29.96 3dwe s GLN 103 CO -0.06 -0.29 1.91 1.88 0.01 0.00 0.00 175.29 178.73 3dwe h TYR 104 N 2.96 0.71 -0.66 0.91 0.05 -1.99 -0.97 116.97 117.99 3dwe h TYR 104 Ca -0.49 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.29 3dwe h TYR 104 Cb 1.23 -0.23 -0.03 0.00 1.01 0.00 0.00 36.73 38.72 3dwe h TYR 104 CO 0.55 0.29 0.32 1.03 -1.05 0.00 0.00 178.16 179.30 3dwe h SER 105 N 0.63 0.83 -0.26 3.88 0.87 -1.99 0.54 113.55 118.05 3dwe h SER 105 Ca 0.39 -0.08 -0.15 0.00 -1.23 0.00 0.00 61.79 60.72 3dwe h SER 105 Cb 0.64 -0.21 -0.00 0.00 -0.44 0.00 0.00 62.40 62.39 3dwe h SER 105 CO -0.16 0.71 -0.44 0.74 -0.53 0.00 0.00 176.83 177.15 3dwe h THR 106 N 0.92 1.30 -0.61 2.23 2.02 -1.58 -1.75 112.91 115.44 3dwe h THR 106 Ca 0.23 -1.64 0.00 0.00 0.77 0.00 0.00 66.41 65.78 3dwe h THR 106 Cb 0.09 1.71 -0.03 0.00 -1.74 0.00 0.00 68.15 68.18 3dwe h THR 106 CO -0.03 0.52 0.40 0.40 0.37 0.00 0.00 175.52 177.18 3dwe h ILE 107 N 0.48 1.16 -0.37 3.11 2.04 -0.99 -0.66 117.51 122.29 3dwe h ILE 107 Ca 0.02 -0.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.56 3dwe h ILE 107 Cb 1.04 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.37 3dwe h ILE 107 CO 0.10 0.16 0.20 0.40 0.00 0.00 0.00 178.15 179.00 3dwe h ILE 108 N 0.83 1.15 -0.93 -0.67 2.04 -0.88 -1.82 117.51 117.22 3dwe h ILE 108 Ca 0.22 -0.40 0.08 0.00 1.00 0.00 0.00 64.86 65.76 3dwe h ILE 108 Cb -0.08 0.74 -0.07 0.00 -0.74 0.00 0.00 36.82 36.67 3dwe h ILE 108 CO -0.05 0.15 0.58 0.00 0.00 0.00 0.00 178.15 178.84 3dwe h ALA 109 N 1.06 1.31 -0.78 1.87 0.00 -0.99 -1.56 119.26 120.17 3dwe h ALA 109 Ca 0.13 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 3dwe h ALA 109 Cb 0.07 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 3dwe h ALA 109 CO -0.02 0.31 0.31 0.78 0.00 0.00 0.00 179.25 180.63 3dwe h GLY 110 N 1.03 1.25 0.82 0.00 0.00 -0.64 0.52 103.07 106.06 3dwe h GLY 110 Ca 0.42 -0.68 -0.02 0.00 0.00 0.00 0.00 47.33 47.04 3dwe h GLY 110 CO -0.20 0.64 0.02 -0.33 0.00 0.00 0.00 176.54 176.68 3dwe h MET 111 N 1.14 0.30 -0.28 4.80 2.07 -0.73 -1.83 114.93 120.40 3dwe h MET 111 Ca 0.26 -0.09 -0.03 0.00 -2.07 0.00 0.00 59.70 57.77 3dwe h MET 111 Cb 0.22 -0.03 -0.02 0.00 -1.87 0.00 0.00 31.60 29.90 3dwe h MET 111 CO -0.02 0.49 0.03 -0.44 1.07 0.00 0.00 176.91 178.04 3dwe h ASP 112 N 0.08 0.37 -0.17 1.22 3.32 -1.14 -2.16 116.42 117.94 3dwe h ASP 112 Ca 0.05 -0.05 0.01 0.00 0.02 0.00 0.00 57.03 57.06 3dwe h ASP 112 Cb 0.34 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 3dwe h ASP 112 CO 0.01 0.41 0.08 0.15 -1.72 0.00 0.00 179.24 178.16 3dwe h PHE 113 N 0.40 0.14 -0.92 4.55 3.04 -0.63 -2.68 116.94 120.84 3dwe h PHE 113 Ca 0.09 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 62.04 3dwe h PHE 113 Cb 0.21 -0.04 -0.04 0.00 2.56 0.00 0.00 35.95 38.64 3dwe h PHE 113 CO 0.01 0.08 0.53 0.28 -2.02 0.00 0.00 178.31 177.18 3dwe h VAL 114 N 0.17 1.26 -0.61 1.41 2.07 -0.79 0.45 116.25 120.21 3dwe h VAL 114 Ca 0.07 -0.61 0.02 0.00 0.82 0.00 0.00 66.70 67.00 3dwe h VAL 114 Cb 0.02 -0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 29.75 3dwe h VAL 114 CO -0.05 0.28 0.41 0.00 0.02 0.00 0.00 177.57 178.23 3dwe h ALA 115 N 1.30 1.64 0.11 1.67 0.00 -1.15 -2.20 119.26 120.63 3dwe h ALA 115 Ca 0.33 -0.03 -0.22 0.00 0.00 0.00 0.00 54.91 54.98 3dwe h ALA 115 Cb -0.01 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 17.57 3dwe h ALA 115 CO -0.06 0.31 -1.07 1.03 0.00 0.00 0.00 179.25 179.46 3dwe h SER 116 N 0.76 0.37 -0.06 0.00 0.87 -1.09 -3.39 113.55 111.01 3dwe h SER 116 Ca 0.24 -0.88 0.02 0.00 -1.23 0.00 0.00 61.79 59.93 3dwe h SER 116 Cb 0.02 -0.12 -0.00 0.00 -0.44 0.00 0.00 62.40 61.86 3dwe h SER 116 CO -0.06 1.48 0.04 -0.78 -0.53 0.00 0.00 176.83 176.99 3dwe h ASP 117 N -0.41 0.00 0.03 6.23 3.58 0.24 -1.12 116.42 124.97 3dwe h ASP 117 Ca -0.22 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.23 3dwe h ASP 117 Cb 1.64 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.69 3dwe h ASP 117 CO 0.08 0.00 -0.01 0.07 -2.88 0.00 0.00 179.24 176.50 3dwe h LYS 118 N 0.00 0.00 0.00 0.28 2.10 -1.60 0.20 116.57 117.56 3dwe h LYS 118 Ca 0.03 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.68 3dwe h LYS 118 Cb 0.12 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.45 3dwe h LYS 118 CO -0.00 0.01 0.00 0.09 -2.00 0.00 0.00 179.45 177.55 3dwe n ASN 119 N -3.66 0.00 -0.97 7.07 5.03 -0.42 -2.17 115.26 120.14 3dwe n ASN 119 Ca -0.03 0.30 0.09 0.00 0.87 0.00 0.00 54.58 55.81 3dwe n ASN 119 Cb 0.09 -0.41 0.22 0.00 -1.02 0.00 0.00 39.78 38.65 3dwe n ASN 119 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 3dwe n ASN 120 N -1.41 3.33 -4.37 6.41 3.02 0.71 -5.00 115.26 117.95 3dwe n ASN 120 Ca 0.07 -1.96 -0.20 0.00 -0.03 0.00 0.00 54.58 52.45 3dwe n ASN 120 Cb 0.20 -0.31 -0.10 0.00 -0.61 0.00 0.00 39.78 38.95 3dwe n ASN 120 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3dwe s ARG 121 N -1.07 1.38 -0.45 3.52 1.81 -0.92 -5.11 118.95 118.12 3dwe s ARG 121 Ca 0.35 -1.58 -0.13 0.00 -1.72 0.00 0.00 55.73 52.64 3dwe s ARG 121 Cb 0.19 -1.30 0.07 0.00 -0.45 0.00 0.00 34.95 33.45 3dwe s ARG 121 CO 0.25 0.24 0.34 1.21 -0.68 0.00 0.00 175.30 176.65 3dwe s ASN 122 N -3.19 5.97 -0.38 0.23 2.47 -1.26 -4.94 114.94 113.84 3dwe s ASN 122 Ca 0.22 -1.33 0.11 0.00 0.42 0.00 0.00 52.86 52.29 3dwe s ASN 122 Cb -0.03 -2.11 0.33 0.00 -1.45 0.00 0.00 41.25 37.99 3dwe s ASN 122 CO 0.08 -0.58 0.69 0.00 -3.72 0.00 0.00 177.10 173.57 3dwe h PRO 124 N 3.22 0.00 0.00 0.00 0.13 -1.78 -1.38 132.00 132.19 3dwe h PRO 124 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 3dwe h PRO 124 Cb 0.95 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.08 3dwe h PRO 124 CO 0.48 0.00 -0.65 1.63 -0.23 0.00 0.00 178.00 179.23 3dwe n LYS 125 N -3.89 0.21 0.00 0.86 4.76 -0.04 -5.02 118.16 115.04 3dwe n LYS 125 Ca -0.02 0.05 0.00 0.00 -2.87 0.00 0.00 58.31 55.47 3dwe n LYS 125 Cb 0.12 -1.62 0.00 0.00 -1.84 0.00 0.00 35.03 31.69 3dwe n LYS 125 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3dwe n GLY 126 N 1.39 3.15 3.13 0.72 0.00 -0.52 -4.38 105.19 108.68 3dwe n GLY 126 Ca 0.04 -1.85 -0.26 0.00 0.00 0.00 0.00 46.02 43.95 3dwe n GLY 126 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dwe s VAL 127 N -2.07 1.38 0.09 1.61 1.01 -1.26 -1.67 120.40 119.49 3dwe s VAL 127 Ca 0.00 -0.69 0.07 0.00 0.00 0.00 0.00 61.98 61.36 3dwe s VAL 127 Cb 0.00 -1.18 -0.03 0.00 0.00 0.00 0.00 36.38 35.17 3dwe s VAL 127 CO 0.00 0.40 -0.18 -0.69 0.00 0.00 0.00 175.10 174.63 3dwe s VAL 128 N 0.02 1.47 -0.04 2.92 1.01 -0.13 -1.25 120.40 124.40 3dwe s VAL 128 Ca -0.03 -1.49 0.03 0.00 0.00 0.00 0.00 61.98 60.50 3dwe s VAL 128 Cb -0.11 -1.39 0.00 0.00 0.00 0.00 0.00 36.38 34.89 3dwe s VAL 128 CO 0.02 -0.16 -0.13 0.00 0.00 0.00 0.00 175.10 174.83 3dwe s ALA 129 N -1.32 1.23 -0.23 5.51 0.00 0.45 -0.49 121.76 126.91 3dwe s ALA 129 Ca 0.04 -0.49 -0.04 0.00 0.00 0.00 0.00 51.96 51.47 3dwe s ALA 129 Cb -0.09 -0.46 -0.01 0.00 0.00 0.00 0.00 23.12 22.55 3dwe s ALA 129 CO 0.04 0.18 -0.03 0.45 0.00 0.00 0.00 175.76 176.40 3dwe s SER 130 N 0.29 4.42 -0.58 0.00 0.15 0.60 -1.10 113.70 117.47 3dwe s SER 130 Ca -0.07 -0.38 0.02 0.00 0.70 0.00 0.00 55.95 56.22 3dwe s SER 130 Cb -0.12 -1.76 0.15 0.00 -1.71 0.00 0.00 66.02 62.57 3dwe s SER 130 CO 0.02 -0.03 0.35 -0.76 1.20 0.00 0.00 173.24 174.02 3dwe s LEU 131 N 1.49 4.64 -1.26 3.45 1.43 -0.01 -1.90 118.68 126.52 3dwe s LEU 131 Ca 0.06 -3.10 -0.08 0.00 -1.03 0.00 0.00 54.13 49.98 3dwe s LEU 131 Cb -0.14 -1.70 0.18 0.00 0.03 0.00 0.00 46.19 44.55 3dwe s LEU 131 CO -0.02 -0.24 1.96 -1.20 0.23 0.00 0.00 176.35 177.07 3dwe n SER 132 N 3.03 6.03 -3.47 2.29 7.64 -1.26 -1.76 113.62 126.11 3dwe n SER 132 Ca 0.08 -3.17 -0.08 0.00 1.01 0.00 0.00 58.87 56.71 3dwe n SER 132 Cb 0.34 -1.42 -0.00 0.00 -1.01 0.00 0.00 64.21 62.12 3dwe n SER 132 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 3dwe s LEU 133 N -1.06 -0.11 0.00 -3.43 0.05 -1.26 -4.87 118.68 108.00 3dwe s LEU 133 Ca 0.42 -0.85 0.00 0.00 0.05 0.00 0.00 54.13 53.75 3dwe s LEU 133 Cb 0.12 2.73 0.00 0.00 -2.05 0.00 0.00 46.19 46.98 3dwe s LEU 133 CO -0.01 -1.48 0.00 0.61 -0.55 0.00 0.00 176.35 174.92 3dwe n GLY 134 N -0.49 1.99 0.00 -3.48 0.00 -1.26 -4.46 105.19 97.49 3dwe n GLY 134 Ca -0.06 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.89 3dwe n GLY 134 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dwe n GLY 135 N -0.93 3.43 3.67 -0.02 0.00 -0.46 -4.99 105.19 105.90 3dwe n GLY 135 Ca 0.00 -0.80 -0.30 0.00 0.00 0.00 0.00 46.02 44.92 3dwe n GLY 135 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dwe s GLY 136 N 0.00 1.64 0.16 -0.02 0.00 -1.26 -0.93 107.32 106.91 3dwe s GLY 136 Ca 0.00 0.22 -0.34 0.00 0.00 0.00 0.00 44.72 44.60 3dwe s GLY 136 CO 0.00 0.70 1.45 2.98 0.00 0.00 0.00 173.10 178.23 3dwe n TYR 137 N -4.12 1.98 -3.63 1.90 9.36 -0.64 -3.65 117.16 118.37 3dwe n TYR 137 Ca 0.08 0.43 -0.14 0.00 3.32 0.00 0.00 57.90 61.59 3dwe n TYR 137 Cb 0.53 -2.45 -0.13 0.00 -0.63 0.00 0.00 39.34 36.66 3dwe n TYR 137 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 3dwe s SER 138 N 0.61 0.51 0.40 2.98 0.15 -1.26 -4.92 113.70 112.17 3dwe s SER 138 Ca 0.78 0.45 0.08 0.00 0.70 0.00 0.00 55.95 57.96 3dwe s SER 138 Cb -0.76 0.64 0.84 0.00 -1.71 0.00 0.00 66.02 65.04 3dwe s SER 138 CO 0.44 -0.25 2.02 0.77 1.20 0.00 0.00 173.24 177.41 3dwe h SER 139 N 8.29 0.42 -0.43 5.45 4.64 -1.99 -1.64 113.55 128.29 3dwe h SER 139 Ca -0.15 -0.03 -0.12 0.00 -0.47 0.00 0.00 61.79 61.02 3dwe h SER 139 Cb 1.12 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 63.09 3dwe h SER 139 CO 0.16 0.36 -0.22 0.28 -0.87 0.00 0.00 176.83 176.54 3dwe h SER 140 N 0.47 0.94 -0.33 4.97 0.02 -1.98 0.23 113.55 117.86 3dwe h SER 140 Ca 0.12 -0.41 -0.04 0.00 -0.84 0.00 0.00 61.79 60.62 3dwe h SER 140 Cb 0.05 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.32 3dwe h SER 140 CO -0.02 1.14 0.05 0.58 -1.14 0.00 0.00 176.83 177.44 3dwe h VAL 141 N 0.74 1.24 -0.67 2.27 2.07 -1.87 -1.65 116.25 118.37 3dwe h VAL 141 Ca 0.09 -0.84 0.01 0.00 0.82 0.00 0.00 66.70 66.79 3dwe h VAL 141 Cb 0.79 1.14 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 3dwe h VAL 141 CO 0.07 0.28 0.44 0.78 0.02 0.00 0.00 177.57 179.15 3dwe h ASN 142 N 0.39 0.77 -0.60 0.57 4.21 -1.23 -2.07 115.58 117.61 3dwe h ASN 142 Ca 0.10 -0.02 -0.04 0.00 1.21 0.00 0.00 56.30 57.55 3dwe h ASN 142 Cb 0.36 -0.19 -0.03 0.00 -1.12 0.00 0.00 38.32 37.34 3dwe h ASN 142 CO 0.01 0.56 0.23 -1.28 -1.29 0.00 0.00 177.43 175.65 3dwe h SER 143 N 0.90 0.86 -0.45 5.81 0.87 -0.81 0.23 113.55 120.96 3dwe h SER 143 Ca 0.24 -0.13 -0.03 0.00 -1.23 0.00 0.00 61.79 60.65 3dwe h SER 143 Cb -0.10 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 61.61 3dwe h SER 143 CO -0.05 0.79 0.17 0.00 -0.53 0.00 0.00 176.83 177.21 3dwe h ALA 144 N 1.34 0.59 -0.81 6.23 0.00 -0.98 -0.10 119.26 125.52 3dwe h ALA 144 Ca 0.21 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 3dwe h ALA 144 Cb 0.21 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 3dwe h ALA 144 CO -0.02 0.20 0.40 0.00 0.00 0.00 0.00 179.25 179.83 3dwe h ALA 145 N 1.02 1.05 -0.77 0.00 0.00 -0.94 -1.43 119.26 118.19 3dwe h ALA 145 Ca 0.15 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 3dwe h ALA 145 Cb 0.20 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 3dwe h ALA 145 CO -0.01 0.61 0.36 0.00 0.00 0.00 0.00 179.25 180.21 3dwe h ALA 146 N 1.21 1.00 -0.49 0.00 0.00 -0.67 -1.63 119.26 118.68 3dwe h ALA 146 Ca 0.28 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 3dwe h ALA 146 Cb 0.11 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3dwe h ALA 146 CO -0.04 0.58 0.18 0.00 0.00 0.00 0.00 179.25 179.98 3dwe h ARG 147 N 1.10 0.75 -0.31 0.00 3.08 -0.65 0.45 114.38 118.79 3dwe h ARG 147 Ca 0.26 -0.14 0.01 0.00 0.07 0.00 0.00 59.98 60.18 3dwe h ARG 147 Cb 0.14 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 3dwe h ARG 147 CO -0.03 0.68 0.18 1.25 -1.07 0.00 0.00 179.97 180.97 3dwe h LEU 148 N 0.66 0.29 -0.10 3.04 5.85 -1.00 -0.28 115.31 123.77 3dwe h LEU 148 Ca 0.16 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3dwe h LEU 148 Cb 0.22 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 3dwe h LEU 148 CO -0.01 0.21 0.05 -0.61 -0.34 0.00 0.00 178.44 177.74 3dwe h GLN 149 N 0.37 0.11 -0.43 1.25 5.75 -1.14 -2.66 115.11 118.35 3dwe h GLN 149 Ca 0.12 -0.01 0.07 0.00 -0.15 0.00 0.00 58.65 58.68 3dwe h GLN 149 Cb 0.00 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.50 3dwe h GLN 149 CO -0.06 0.07 0.29 0.66 -2.65 0.00 0.00 178.83 177.15 3dwe h SER 150 N 0.12 0.27 0.55 -0.69 4.64 -0.40 -1.57 113.55 116.45 3dwe h SER 150 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 3dwe h SER 150 Cb -0.00 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 3dwe h SER 150 CO -0.02 0.17 0.00 -1.54 -0.87 0.00 0.00 176.83 174.57 3dwe n SER 151 N -4.47 0.00 0.00 4.97 3.41 -0.16 -4.82 113.62 112.55 3dwe n SER 151 Ca 0.06 0.47 0.00 0.00 -0.26 0.00 0.00 58.87 59.14 3dwe n SER 151 Cb 0.28 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.75 3dwe n SER 151 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dwe n GLY 152 N 0.19 1.93 3.24 5.00 0.00 -0.60 -5.10 105.19 109.84 3dwe n GLY 152 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 3dwe n GLY 152 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dwe s VAL 153 N -2.00 2.09 -0.42 1.61 1.01 -1.19 -4.53 120.40 116.96 3dwe s VAL 153 Ca 0.00 -1.02 -0.29 0.00 0.00 0.00 0.00 61.98 60.67 3dwe s VAL 153 Cb 0.00 -1.78 0.01 0.00 0.00 0.00 0.00 36.38 34.60 3dwe s VAL 153 CO 0.00 0.56 1.46 -0.32 0.00 0.00 0.00 175.10 176.80 3dwe s MET 154 N 0.20 3.50 -0.29 2.72 1.75 -0.38 -4.06 119.30 122.75 3dwe s MET 154 Ca -0.14 0.93 -0.12 0.00 -1.25 0.00 0.00 55.69 55.10 3dwe s MET 154 Cb -0.17 -4.06 -0.04 0.00 2.84 0.00 0.00 34.83 33.40 3dwe s MET 154 CO 0.07 -1.65 0.23 0.08 -0.65 0.00 0.00 175.02 173.10 3dwe s VAL 155 N 5.70 5.28 -0.15 10.11 1.01 -1.26 -0.41 120.40 140.68 3dwe s VAL 155 Ca 0.62 0.18 -0.02 0.00 0.00 0.00 0.00 61.98 62.76 3dwe s VAL 155 Cb -0.14 -3.59 -0.02 0.00 0.00 0.00 0.00 36.38 32.63 3dwe s VAL 155 CO 0.32 0.19 -0.08 0.00 0.00 0.00 0.00 175.10 175.54 3dwe s ALA 156 N 1.81 2.82 0.06 5.51 0.00 -0.26 -0.81 121.76 130.90 3dwe s ALA 156 Ca 0.08 -0.88 0.05 0.00 0.00 0.00 0.00 51.96 51.21 3dwe s ALA 156 Cb -0.16 -1.43 -0.03 0.00 0.00 0.00 0.00 23.12 21.50 3dwe s ALA 156 CO 0.11 0.16 -0.15 0.14 0.00 0.00 0.00 175.76 176.02 3dwe s VAL 157 N 0.47 1.19 0.29 0.00 -7.23 0.11 -0.83 120.40 114.40 3dwe s VAL 157 Ca -0.06 -1.18 -0.29 0.00 -1.81 0.00 0.00 61.98 58.64 3dwe s VAL 157 Cb -0.15 -1.10 -0.10 0.00 0.56 0.00 0.00 36.38 35.59 3dwe s VAL 157 CO 0.04 -0.08 1.27 0.00 -0.31 0.00 0.00 175.10 176.01 3dwe s ALA 158 N -1.04 3.49 0.31 1.32 0.00 -0.72 -0.74 121.76 124.37 3dwe s ALA 158 Ca 0.01 1.16 0.12 0.00 0.00 0.00 0.00 51.96 53.25 3dwe s ALA 158 Cb -0.09 -3.45 0.56 0.00 0.00 0.00 0.00 23.12 20.14 3dwe s ALA 158 CO 0.02 -0.52 1.73 0.00 0.00 0.00 0.00 175.76 176.98 3dwe h ALA 159 N 3.95 1.17 0.00 0.00 0.00 -1.33 -3.39 119.26 119.66 3dwe h ALA 159 Ca -0.47 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.00 3dwe h ALA 159 Cb 1.22 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3dwe h ALA 159 CO 0.69 0.60 0.00 0.41 0.00 0.00 0.00 179.25 180.95 3dwe n GLY 160 N -0.10 2.82 2.05 0.00 0.00 -1.26 -4.72 105.19 103.98 3dwe n GLY 160 Ca -0.01 -1.92 -0.26 0.00 0.00 0.00 0.00 46.02 43.83 3dwe n GLY 160 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3dwe n ASN 161 N 0.00 5.66 -0.87 1.61 3.02 -1.26 -1.12 115.26 122.30 3dwe n ASN 161 Ca 0.00 -3.77 0.10 0.00 -0.03 0.00 0.00 54.58 50.88 3dwe n ASN 161 Cb 0.00 -0.60 0.12 0.00 -0.61 0.00 0.00 39.78 38.69 3dwe n ASN 161 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3dwe n ASN 162 N -0.83 2.88 -4.04 6.41 3.02 -0.99 -4.78 115.26 116.93 3dwe n ASN 162 Ca 0.50 -1.87 -0.28 0.00 -0.03 0.00 0.00 54.58 52.90 3dwe n ASN 162 Cb 0.87 -0.09 -0.03 0.00 -0.61 0.00 0.00 39.78 39.93 3dwe n ASN 162 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3dwe n ASN 163 N 1.17 -0.93 -3.87 6.41 4.05 -0.19 -4.94 115.26 116.96 3dwe n ASN 163 Ca 0.14 -1.02 -0.13 0.00 0.45 0.00 0.00 54.58 54.01 3dwe n ASN 163 Cb 0.51 -2.89 -0.08 0.00 1.23 0.00 0.00 39.78 38.56 3dwe n ASN 163 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3dwe s ALA 164 N -3.84 0.89 -0.05 5.20 0.00 -1.26 -4.93 121.76 117.76 3dwe s ALA 164 Ca 0.17 -1.54 -0.30 0.00 0.00 0.00 0.00 51.96 50.30 3dwe s ALA 164 Cb -0.09 1.29 -0.05 0.00 0.00 0.00 0.00 23.12 24.27 3dwe s ALA 164 CO 0.90 -0.69 1.44 0.34 0.00 0.00 0.00 175.76 177.75 3dwe s ASP 165 N -3.17 6.82 0.00 0.00 -1.08 -1.26 -1.45 116.67 116.53 3dwe s ASP 165 Ca 0.34 2.06 0.13 0.00 -0.52 0.00 0.00 52.55 54.56 3dwe s ASP 165 Cb 0.03 -2.55 0.66 0.00 -1.46 0.00 0.00 42.92 39.61 3dwe s ASP 165 CO 0.15 -0.79 1.32 0.00 0.52 0.00 0.00 175.17 176.37 3dwe n ALA 166 N 6.14 1.77 0.29 3.66 0.00 0.38 -3.09 120.51 129.66 3dwe n ALA 166 Ca 0.14 -0.06 0.18 0.00 0.00 0.00 0.00 53.44 53.71 3dwe n ALA 166 Cb 0.44 -1.21 0.98 0.00 0.00 0.00 0.00 19.45 19.66 3dwe n ALA 166 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 3dwe h ARG 167 N 0.00 0.00 -0.63 0.00 0.11 -1.90 -2.14 114.38 109.82 3dwe h ARG 167 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3dwe h ARG 167 Cb 0.11 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.19 3dwe h ARG 167 CO 0.00 0.00 0.00 0.09 0.10 0.00 0.00 179.97 180.16 3dwe n ASN 168 N -3.46 3.90 -4.17 0.08 5.03 -1.18 -4.80 115.26 110.67 3dwe n ASN 168 Ca -0.02 -2.33 -0.15 0.00 0.87 0.00 0.00 54.58 52.95 3dwe n ASN 168 Cb 0.19 -0.51 -0.11 0.00 -1.02 0.00 0.00 39.78 38.33 3dwe n ASN 168 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 3dwe s TYR 169 N -1.73 1.08 0.02 3.10 2.02 -0.80 -1.62 117.35 119.40 3dwe s TYR 169 Ca 0.42 -0.58 0.03 0.00 -0.37 0.00 0.00 57.07 56.57 3dwe s TYR 169 Cb 0.26 -0.60 -0.01 0.00 -0.40 0.00 0.00 41.96 41.21 3dwe s TYR 169 CO 0.21 0.02 -0.10 -1.12 -1.57 0.00 0.00 175.55 172.99 3dwe s SER 170 N -2.15 1.12 0.00 2.29 0.01 -0.10 -1.06 113.70 113.80 3dwe s SER 170 Ca 0.02 -0.31 0.05 0.00 1.31 0.00 0.00 55.95 57.02 3dwe s SER 170 Cb -0.06 -0.08 0.29 0.00 0.21 0.00 0.00 66.02 66.39 3dwe s SER 170 CO 0.01 0.02 1.12 -0.81 0.41 0.00 0.00 173.24 173.99 3dwe n PRO 171 N 2.34 0.92 -0.33 12.44 -0.04 -1.26 -1.35 135.00 147.71 3dwe n PRO 171 Ca -0.16 0.00 0.17 0.00 -0.04 0.00 0.00 63.50 63.46 3dwe n PRO 171 Cb 0.56 -1.08 0.40 0.00 -0.04 0.00 0.00 33.50 33.33 3dwe n PRO 171 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3dwe h ALA 172 N 3.02 1.88 -0.00 0.55 0.00 -1.75 -1.60 119.26 121.35 3dwe h ALA 172 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3dwe h ALA 172 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3dwe h ALA 172 CO 0.00 -0.27 -0.03 -1.13 0.00 0.00 0.00 179.25 177.82 3dwe n SER 173 N -4.73 0.30 -4.66 0.00 3.41 -0.22 -4.79 113.62 102.94 3dwe n SER 173 Ca 0.24 -0.76 -0.43 0.00 -0.26 0.00 0.00 58.87 57.66 3dwe n SER 173 Cb 0.69 -0.08 -0.02 0.00 -0.26 0.00 0.00 64.21 64.53 3dwe n SER 173 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 3dwe s GLU 174 N -2.25 4.15 0.44 4.33 2.56 -0.60 -4.91 118.70 122.42 3dwe s GLU 174 Ca 0.38 1.90 0.13 0.00 0.00 0.00 0.00 54.97 57.37 3dwe s GLU 174 Cb 0.21 -3.90 0.98 0.00 2.00 0.00 0.00 34.13 33.42 3dwe s GLU 174 CO 0.41 -0.85 2.01 -1.35 -0.56 0.00 0.00 175.26 174.92 3dwe h PRO 175 N 9.14 0.12 -0.00 4.30 0.11 -1.90 -3.19 132.00 140.58 3dwe h PRO 175 Ca -0.33 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.76 3dwe h PRO 175 Cb 1.14 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3dwe h PRO 175 CO 0.97 0.22 -0.18 -1.13 -0.21 0.00 0.00 178.00 177.67 3dwe n SER 176 N -4.37 0.34 -4.91 -2.05 3.41 -1.26 -4.83 113.62 99.96 3dwe n SER 176 Ca -0.02 -0.17 -0.20 0.00 -0.26 0.00 0.00 58.87 58.22 3dwe n SER 176 Cb 0.20 -0.12 -0.02 0.00 -0.26 0.00 0.00 64.21 64.02 3dwe n SER 176 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 3dwe s VAL 177 N -2.77 2.92 -0.46 -3.33 -7.23 -1.21 -4.96 120.40 103.36 3dwe s VAL 177 Ca 0.20 -1.25 -0.19 0.00 -1.81 0.00 0.00 61.98 58.92 3dwe s VAL 177 Cb 0.19 -3.04 0.04 0.00 0.56 0.00 0.00 36.38 34.13 3dwe s VAL 177 CO 0.55 -0.03 0.58 0.00 -0.31 0.00 0.00 175.10 175.89 3dwe s THR 179 N 2.55 5.19 -0.22 0.00 2.01 -1.26 -0.71 115.64 123.20 3dwe s THR 179 Ca 0.17 0.72 -0.03 0.00 0.31 0.00 0.00 61.69 62.86 3dwe s THR 179 Cb -0.17 -3.74 0.00 0.00 0.01 0.00 0.00 72.50 68.61 3dwe s THR 179 CO 0.14 0.23 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.55 3dwe s VAL 180 N 1.42 3.06 0.65 3.82 1.01 0.08 -1.09 120.40 129.34 3dwe s VAL 180 Ca 0.19 -0.70 -0.03 0.00 0.00 0.00 0.00 61.98 61.45 3dwe s VAL 180 Cb -0.15 -2.42 0.06 0.00 0.00 0.00 0.00 36.38 33.87 3dwe s VAL 180 CO 0.08 0.38 0.92 -0.83 0.00 0.00 0.00 175.10 175.65 3dwe s GLY 181 N 1.41 1.76 -0.00 4.51 0.00 -0.07 -0.96 107.32 113.97 3dwe s GLY 181 Ca 0.04 -1.21 0.05 0.00 0.00 0.00 0.00 44.72 43.61 3dwe s GLY 181 CO -0.05 -0.83 -0.16 0.00 0.00 0.00 0.00 173.10 172.07 3dwe s ALA 182 N -3.04 2.65 0.31 3.20 0.00 -1.26 -1.08 121.76 122.54 3dwe s ALA 182 Ca 0.60 -1.08 0.08 0.00 0.00 0.00 0.00 51.96 51.56 3dwe s ALA 182 Cb -0.10 -0.87 -0.06 0.00 0.00 0.00 0.00 23.12 22.10 3dwe s ALA 182 CO 0.42 0.57 -0.08 -1.54 0.00 0.00 0.00 175.76 175.13 3dwe s SER 183 N -1.12 3.20 0.51 0.00 1.04 -0.26 -0.73 113.70 116.34 3dwe s SER 183 Ca 0.13 -1.19 0.07 0.00 0.48 0.00 0.00 55.95 55.45 3dwe s SER 183 Cb -0.11 -0.25 0.03 0.00 0.10 0.00 0.00 66.02 65.79 3dwe s SER 183 CO 0.03 -0.27 0.44 1.51 0.98 0.00 0.00 173.24 175.94 3dwe s ASP 184 N -3.51 4.79 0.05 7.02 1.47 0.08 -0.71 116.67 125.85 3dwe s ASP 184 Ca 0.31 -1.06 0.14 0.00 1.18 0.00 0.00 52.55 53.12 3dwe s ASP 184 Cb 0.03 0.12 0.59 0.00 -0.34 0.00 0.00 42.92 43.32 3dwe s ASP 184 CO 0.14 -1.01 1.44 -1.14 0.68 0.00 0.00 175.17 175.28 3dwe n ARG 185 N -1.76 0.03 -0.59 2.11 0.63 -1.26 -0.96 116.66 114.86 3dwe n ARG 185 Ca 0.02 0.32 0.08 0.00 -0.92 0.00 0.00 57.85 57.36 3dwe n ARG 185 Cb 0.63 -1.57 0.32 0.00 0.45 0.00 0.00 32.46 32.29 3dwe n ARG 185 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 3dwe n TYR 186 N -1.63 1.36 -2.38 -0.14 4.01 -1.26 -4.40 117.16 112.73 3dwe n TYR 186 Ca 0.03 -0.72 -0.19 0.00 -0.16 0.00 0.00 57.90 56.86 3dwe n TYR 186 Cb 0.15 -0.32 -0.01 0.00 -0.31 0.00 0.00 39.34 38.85 3dwe n TYR 186 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3dwe n ASP 187 N 0.37 -5.45 -4.87 7.72 8.00 -0.14 -4.89 116.55 117.30 3dwe n ASP 187 Ca 0.23 -0.03 -0.35 0.00 0.71 0.00 0.00 54.79 55.36 3dwe n ASP 187 Cb 0.93 -4.49 -0.05 0.00 -0.02 0.00 0.00 41.12 37.48 3dwe n ASP 187 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3dwe s ARG 188 N -4.96 3.75 0.18 -1.24 0.52 -1.26 -0.48 118.95 115.46 3dwe s ARG 188 Ca 0.01 0.16 -0.33 0.00 -0.52 0.00 0.00 55.73 55.05 3dwe s ARG 188 Cb -0.00 -3.03 -0.14 0.00 0.52 0.00 0.00 34.95 32.30 3dwe s ARG 188 CO 0.01 0.58 1.51 -2.13 0.02 0.00 0.00 175.30 175.29 3dwe n ARG 189 N 1.01 2.07 -1.75 3.54 0.63 -0.40 -0.74 116.66 121.01 3dwe n ARG 189 Ca -0.09 0.74 -0.41 0.00 -0.92 0.00 0.00 57.85 57.17 3dwe n ARG 189 Cb 0.52 -2.47 0.00 0.00 0.45 0.00 0.00 32.46 30.97 3dwe n ARG 189 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 3dwe n SER 190 N 2.95 3.36 0.27 6.15 7.64 0.09 -4.75 113.62 129.34 3dwe n SER 190 Ca 0.15 1.19 0.12 0.00 1.01 0.00 0.00 58.87 61.34 3dwe n SER 190 Cb 0.29 -1.58 0.78 0.00 -1.01 0.00 0.00 64.21 62.69 3dwe n SER 190 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 3dwe h SER 191 N 2.63 0.00 0.31 6.43 4.64 -1.90 -0.75 113.55 124.91 3dwe h SER 191 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 3dwe h SER 191 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 3dwe h SER 191 CO 0.63 0.05 -0.55 2.22 -0.87 0.00 0.00 176.83 178.31 3dwe n PHE 192 N -3.95 0.00 -2.14 4.77 1.16 -1.26 -4.65 117.46 111.39 3dwe n PHE 192 Ca -0.03 0.00 -0.42 0.00 -1.87 0.00 0.00 57.45 55.14 3dwe n PHE 192 Cb 0.14 -0.15 -0.03 0.00 -1.61 0.00 0.00 39.48 37.83 3dwe n PHE 192 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 3dwe s SER 193 N -2.86 6.80 1.05 5.98 0.15 -0.29 -1.02 113.70 123.50 3dwe s SER 193 Ca 0.14 2.40 -0.12 0.00 0.70 0.00 0.00 55.95 59.07 3dwe s SER 193 Cb 0.18 -2.59 0.22 0.00 -1.71 0.00 0.00 66.02 62.11 3dwe s SER 193 CO 0.69 -0.65 1.07 0.20 1.20 0.00 0.00 173.24 175.74 3dwe s ASN 194 N 0.91 2.03 0.00 5.45 0.02 -0.28 -4.08 114.94 118.99 3dwe s ASN 194 Ca 0.63 1.57 0.00 0.00 -1.02 0.00 0.00 52.86 54.05 3dwe s ASN 194 Cb -0.38 -2.25 0.00 0.00 0.02 0.00 0.00 41.25 38.64 3dwe s ASN 194 CO 0.33 -3.56 0.00 0.00 0.02 0.00 0.00 177.10 173.89 3dwe n TYR 195 N -4.49 -0.44 0.00 2.20 4.11 -0.53 -4.75 117.16 113.26 3dwe n TYR 195 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.96 3dwe n TYR 195 Cb 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.89 3dwe n TYR 195 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 3dwe n GLY 196 N 0.00 1.85 0.30 -7.48 0.00 -1.26 -0.47 105.19 98.12 3dwe n GLY 196 Ca 0.00 -2.18 0.12 0.00 0.00 0.00 0.00 46.02 43.96 3dwe n GLY 196 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3dwe h SER 197 N 0.00 0.00 1.08 1.61 4.64 -1.97 -2.42 113.55 116.50 3dwe h SER 197 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3dwe h SER 197 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3dwe h SER 197 CO 0.00 0.00 0.00 0.55 -0.87 0.00 0.00 176.83 176.51 3dwe n VAL 198 N -4.40 0.69 -2.17 0.95 3.14 -1.26 -4.78 118.33 110.51 3dwe n VAL 198 Ca 0.00 -0.02 -0.40 0.00 -2.96 0.00 0.00 64.34 60.96 3dwe n VAL 198 Cb 0.23 -0.87 -0.02 0.00 -1.06 0.00 0.00 33.84 32.12 3dwe n VAL 198 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 3dwe s LEU 199 N -4.42 4.38 -0.08 6.55 1.02 -0.91 -4.53 118.68 120.69 3dwe s LEU 199 Ca 0.08 2.59 0.12 0.00 0.02 0.00 0.00 54.13 56.94 3dwe s LEU 199 Cb 0.11 -3.74 -0.17 0.00 0.02 0.00 0.00 46.19 42.41 3dwe s LEU 199 CO 0.49 -0.56 0.14 0.47 0.02 0.00 0.00 176.35 176.91 3dwe n ASP 200 N 0.64 2.04 -3.53 2.29 8.00 -0.25 -4.64 116.55 121.09 3dwe n ASP 200 Ca 0.01 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.41 3dwe n ASP 200 Cb 0.43 1.12 -0.03 0.00 -0.02 0.00 0.00 41.12 42.61 3dwe n ASP 200 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3dwe s ILE 201 N -2.54 0.00 0.09 0.53 1.10 -1.12 -4.78 121.20 114.48 3dwe s ILE 201 Ca -0.05 0.00 0.07 0.00 -0.51 0.00 0.00 60.65 60.15 3dwe s ILE 201 Cb 0.05 -1.00 -0.04 0.00 0.15 0.00 0.00 42.46 41.63 3dwe s ILE 201 CO 0.51 0.00 -0.11 -0.36 -2.11 0.00 0.00 174.94 172.87 3dwe s PHE 202 N -2.21 2.73 0.14 3.50 0.40 -0.14 -0.89 117.98 121.51 3dwe s PHE 202 Ca 0.01 -0.16 -0.01 0.00 -0.60 0.00 0.00 56.93 56.18 3dwe s PHE 202 Cb -0.01 -1.45 -0.04 0.00 0.51 0.00 0.00 43.02 42.03 3dwe s PHE 202 CO -0.04 0.41 0.05 0.20 0.70 0.00 0.00 175.22 176.54 3dwe s GLY 203 N -2.06 1.07 0.05 4.36 0.00 -0.24 -1.09 107.32 109.41 3dwe s GLY 203 Ca 0.20 -1.51 -0.34 0.00 0.00 0.00 0.00 44.72 43.07 3dwe s GLY 203 CO 0.12 -1.40 1.73 -1.05 0.00 0.00 0.00 173.10 172.51 3dwe n PRO 204 N -0.13 2.23 0.00 2.90 -0.02 -1.26 -1.11 135.00 137.61 3dwe n PRO 204 Ca -0.05 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 3dwe n PRO 204 Cb 0.64 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.49 3dwe n PRO 204 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dwe n GLY 205 N 3.91 0.90 3.57 -1.23 0.00 0.11 -2.82 105.19 109.63 3dwe n GLY 205 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 3dwe n GLY 205 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dwe s THR 206 N -0.18 4.64 -0.98 2.61 2.01 -1.01 -0.35 115.64 122.38 3dwe s THR 206 Ca 0.00 -0.08 -0.05 0.00 0.31 0.00 0.00 61.69 61.87 3dwe s THR 206 Cb 0.00 -3.12 -0.06 0.00 0.01 0.00 0.00 72.50 69.33 3dwe s THR 206 CO 0.00 0.41 0.86 -1.20 -0.69 0.00 0.00 174.62 174.00 3dwe n SER 207 N 4.08 -6.65 -4.46 3.53 7.64 -1.23 -4.66 113.62 111.88 3dwe n SER 207 Ca -0.16 -0.61 -0.40 0.00 1.01 0.00 0.00 58.87 58.71 3dwe n SER 207 Cb 0.52 -5.08 -0.11 0.00 -1.01 0.00 0.00 64.21 58.53 3dwe n SER 207 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3dwe s ILE 208 N -3.33 4.85 0.01 0.44 -1.09 -0.29 -4.87 121.20 116.92 3dwe s ILE 208 Ca 0.39 -0.45 -0.30 0.00 -2.23 0.00 0.00 60.65 58.06 3dwe s ILE 208 Cb -0.05 -3.54 -0.03 0.00 -1.58 0.00 0.00 42.46 37.26 3dwe s ILE 208 CO 0.72 -0.04 1.01 -0.22 -1.23 0.00 0.00 174.94 175.18 3dwe s LEU 209 N 1.64 4.37 0.00 2.97 2.96 -1.26 -2.17 118.68 127.19 3dwe s LEU 209 Ca 0.05 1.71 -0.08 0.00 -0.22 0.00 0.00 54.13 55.59 3dwe s LEU 209 Cb -0.18 -3.57 0.03 0.00 0.50 0.00 0.00 46.19 42.97 3dwe s LEU 209 CO 0.08 -0.29 0.47 -0.24 -1.32 0.00 0.00 176.35 175.05 3dwe n SER 210 N 3.90 -1.35 -4.74 3.68 2.88 -0.50 -4.88 113.62 112.61 3dwe n SER 210 Ca 0.06 -2.01 -0.34 0.00 -1.33 0.00 0.00 58.87 55.25 3dwe n SER 210 Cb 0.50 2.27 0.07 0.00 -0.75 0.00 0.00 64.21 66.31 3dwe n SER 210 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 3dwe s THR 211 N -2.47 2.60 0.16 2.46 -4.23 -1.26 -1.19 115.64 111.70 3dwe s THR 211 Ca 0.11 0.30 -0.02 0.00 -1.18 0.00 0.00 61.69 60.90 3dwe s THR 211 Cb -0.03 -2.89 -0.04 0.00 1.34 0.00 0.00 72.50 70.88 3dwe s THR 211 CO 0.08 -0.15 0.12 0.86 -0.54 0.00 0.00 174.62 174.99 3dwe s TRP 212 N -2.00 0.90 0.85 3.99 -0.11 -0.02 -2.92 118.94 119.63 3dwe s TRP 212 Ca 0.73 -1.22 -0.11 0.00 1.22 0.00 0.00 56.10 56.72 3dwe s TRP 212 Cb -0.27 -0.44 0.10 0.00 -1.50 0.00 0.00 33.47 31.36 3dwe s TRP 212 CO 0.42 -0.60 1.10 0.96 -4.62 0.00 0.00 176.95 174.21 3dwe s ILE 213 N -4.08 2.88 -0.90 5.86 -4.36 -1.26 -2.23 121.20 117.10 3dwe s ILE 213 Ca 0.29 0.28 0.00 0.00 -0.26 0.00 0.00 60.65 60.96 3dwe s ILE 213 Cb 0.07 -2.68 0.00 0.00 1.25 0.00 0.00 42.46 41.09 3dwe s ILE 213 CO 0.05 -0.37 0.00 0.61 0.24 0.00 0.00 174.94 175.47 3dwe n GLY 214 N -0.89 0.59 2.31 6.27 0.00 -1.26 -3.43 105.19 108.77 3dwe n GLY 214 Ca 0.09 -0.56 -0.15 0.00 0.00 0.00 0.00 46.02 45.40 3dwe n GLY 214 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dwe n GLY 215 N -1.46 -0.25 0.39 -0.02 0.00 -1.22 -4.99 105.19 97.63 3dwe n GLY 215 Ca -0.10 -0.24 -0.03 0.00 0.00 0.00 0.00 46.02 45.65 3dwe n GLY 215 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3dwe n SER 216 N -0.92 1.29 -4.08 1.61 3.41 -0.95 -4.96 113.62 109.02 3dwe n SER 216 Ca -0.18 -1.20 -0.08 0.00 -0.26 0.00 0.00 58.87 57.15 3dwe n SER 216 Cb 0.63 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.49 3dwe n SER 216 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3dwe s THR 217 N -0.38 0.17 -0.25 6.66 -4.23 -1.26 -0.84 115.64 115.50 3dwe s THR 217 Ca 0.03 -1.76 -0.26 0.00 -1.18 0.00 0.00 61.69 58.53 3dwe s THR 217 Cb -0.00 -1.68 0.08 0.00 1.34 0.00 0.00 72.50 72.24 3dwe s THR 217 CO 0.02 -0.76 0.79 -0.60 -0.54 0.00 0.00 174.62 173.53 3dwe s ARG 218 N -3.96 0.78 -0.22 3.99 6.06 -0.33 -4.80 118.95 120.47 3dwe s ARG 218 Ca 0.13 0.84 -0.08 0.00 -2.50 0.00 0.00 55.73 54.11 3dwe s ARG 218 Cb 0.07 0.38 -0.04 0.00 0.06 0.00 0.00 34.95 35.42 3dwe s ARG 218 CO -0.06 -0.11 0.08 0.45 -2.50 0.00 0.00 175.30 173.17 3dwe s SER 219 N 0.19 5.54 0.23 -2.12 0.15 -1.26 -1.40 113.70 115.03 3dwe s SER 219 Ca -0.00 -0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.63 3dwe s SER 219 Cb -0.05 -1.98 -0.04 0.00 -1.71 0.00 0.00 66.02 62.25 3dwe s SER 219 CO 0.00 0.08 0.13 0.27 1.20 0.00 0.00 173.24 174.92 3dwe s ILE 220 N 0.97 0.18 0.06 6.45 -4.36 -0.92 -4.84 121.20 118.74 3dwe s ILE 220 Ca 0.05 -2.00 0.06 0.00 -0.26 0.00 0.00 60.65 58.50 3dwe s ILE 220 Cb -0.14 -2.54 -0.03 0.00 1.25 0.00 0.00 42.46 41.01 3dwe s ILE 220 CO 0.03 0.00 -0.18 -0.44 0.24 0.00 0.00 174.94 174.59 3dwe s SER 221 N -3.23 2.12 0.00 4.36 0.01 -1.26 -1.14 113.70 114.55 3dwe s SER 221 Ca 0.38 -0.57 0.00 0.00 1.31 0.00 0.00 55.95 57.08 3dwe s SER 221 Cb 0.07 -0.13 0.00 0.00 0.21 0.00 0.00 66.02 66.17 3dwe s SER 221 CO 0.14 0.05 0.00 0.61 0.41 0.00 0.00 173.24 174.45 3dwe n GLY 222 N 1.54 2.72 0.30 3.44 0.00 0.53 -4.88 105.19 108.84 3dwe n GLY 222 Ca -0.19 -0.95 0.20 0.00 0.00 0.00 0.00 46.02 45.08 3dwe n GLY 222 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3dwe h THR 223 N 0.98 0.00 -0.00 2.61 1.35 -1.85 -0.92 112.91 115.07 3dwe h THR 223 Ca 0.00 -0.19 0.00 0.00 -0.55 0.00 0.00 66.41 65.67 3dwe h THR 223 Cb 0.00 1.16 -0.00 0.00 -1.73 0.00 0.00 68.15 67.57 3dwe h THR 223 CO 0.00 0.00 0.00 0.28 -0.25 0.00 0.00 175.52 175.55 3dwe h SER 224 N 0.00 0.00 0.49 5.36 0.02 -1.90 -1.77 113.55 115.75 3dwe h SER 224 Ca 0.00 0.00 -0.29 0.00 -0.84 0.00 0.00 61.79 60.66 3dwe h SER 224 Cb 0.20 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.69 3dwe h SER 224 CO 0.00 0.00 -1.71 0.23 -1.14 0.00 0.00 176.83 174.21 3dwe n MET 225 N -4.12 0.63 -0.08 3.45 2.81 -0.36 -4.14 117.12 115.32 3dwe n MET 225 Ca -0.03 0.30 -0.15 0.00 -1.81 0.00 0.00 57.70 56.02 3dwe n MET 225 Cb 0.09 -1.80 -0.05 0.00 -0.71 0.00 0.00 33.22 30.76 3dwe n MET 225 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3dwe h ALA 226 N 0.97 0.43 -0.18 3.04 0.00 -1.33 -3.32 119.26 118.88 3dwe h ALA 226 Ca -0.29 -0.49 0.05 0.00 0.00 0.00 0.00 54.91 54.18 3dwe h ALA 226 Cb 2.01 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 19.67 3dwe h ALA 226 CO 0.08 0.60 -0.18 1.15 0.00 0.00 0.00 179.25 180.90 3dwe h THR 227 N 0.57 0.52 0.00 0.00 2.02 -1.48 -1.79 112.91 112.75 3dwe h THR 227 Ca 0.02 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.18 3dwe h THR 227 Cb 1.10 0.52 -0.00 0.00 -1.74 0.00 0.00 68.15 68.02 3dwe h THR 227 CO 0.11 0.00 -0.07 1.55 0.37 0.00 0.00 175.52 177.48 3dwe h PRO 228 N -0.21 0.00 -0.50 6.66 0.13 -1.72 -0.28 132.00 136.09 3dwe h PRO 228 Ca 0.11 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.22 3dwe h PRO 228 Cb 0.38 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.49 3dwe h PRO 228 CO -0.30 0.07 0.20 0.45 -0.23 0.00 0.00 178.00 178.19 3dwe h HIS 229 N 0.00 0.75 -0.34 1.56 3.86 -1.43 -0.11 115.15 119.44 3dwe h HIS 229 Ca -0.00 -0.05 -0.15 0.00 -1.16 0.00 0.00 60.37 59.00 3dwe h HIS 229 Cb 0.30 -0.23 -0.00 0.00 1.06 0.00 0.00 27.41 28.54 3dwe h HIS 229 CO 0.00 0.62 -0.39 0.28 0.86 0.00 0.00 177.93 179.30 3dwe h VAL 230 N 0.66 1.28 -0.27 2.45 2.07 -1.05 -0.53 116.25 120.86 3dwe h VAL 230 Ca 0.17 -1.56 -0.00 0.00 0.82 0.00 0.00 66.70 66.12 3dwe h VAL 230 Cb 0.19 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 3dwe h VAL 230 CO -0.01 0.52 0.16 0.00 0.02 0.00 0.00 177.57 178.25 3dwe h ALA 231 N 0.74 0.34 -0.85 1.67 0.00 -1.03 -0.13 119.26 120.00 3dwe h ALA 231 Ca 0.05 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3dwe h ALA 231 Cb 0.98 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.62 3dwe h ALA 231 CO 0.09 -0.15 0.41 0.78 0.00 0.00 0.00 179.25 180.38 3dwe h GLY 232 N 0.33 1.31 0.99 0.00 0.00 -0.98 -1.81 103.07 102.91 3dwe h GLY 232 Ca 0.10 -0.65 -0.00 0.00 0.00 0.00 0.00 47.33 46.78 3dwe h GLY 232 CO -0.02 0.62 0.27 -2.00 0.00 0.00 0.00 176.54 175.41 3dwe h LEU 233 N 1.21 0.52 -0.40 3.11 5.85 -0.72 -0.75 115.31 124.14 3dwe h LEU 233 Ca 0.29 -0.05 0.04 0.00 0.84 0.00 0.00 57.88 59.00 3dwe h LEU 233 Cb 0.11 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 40.97 3dwe h LEU 233 CO -0.04 0.41 0.18 0.00 -0.34 0.00 0.00 178.44 178.65 3dwe h ALA 234 N 1.13 0.48 -0.41 1.25 0.00 -0.72 0.43 119.26 121.42 3dwe h ALA 234 Ca 0.16 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3dwe h ALA 234 Cb -0.01 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3dwe h ALA 234 CO -0.03 -0.20 0.27 0.00 0.00 0.00 0.00 179.25 179.29 3dwe h ALA 235 N 1.23 0.52 -0.46 0.00 0.00 -1.01 0.42 119.26 119.95 3dwe h ALA 235 Ca 0.17 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.10 3dwe h ALA 235 Cb 0.11 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 3dwe h ALA 235 CO -0.14 -0.02 0.20 -0.92 0.00 0.00 0.00 179.25 178.36 3dwe h TYR 236 N 0.55 0.35 -0.13 0.00 3.20 -0.76 -1.12 116.97 119.07 3dwe h TYR 236 Ca 0.15 0.02 -0.13 0.00 3.14 0.00 0.00 58.73 61.91 3dwe h TYR 236 Cb -0.06 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.11 3dwe h TYR 236 CO -0.05 0.16 -0.47 -0.07 -1.64 0.00 0.00 178.16 176.09 3dwe h LEU 237 N 0.39 0.36 -0.46 2.82 3.38 -0.54 -2.33 115.31 118.94 3dwe h LEU 237 Ca 0.21 -0.17 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 3dwe h LEU 237 Cb 0.16 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 3dwe h LEU 237 CO -0.18 0.78 -0.06 0.24 0.09 0.00 0.00 178.44 179.31 3dwe h MET 238 N 0.27 0.85 -0.82 1.13 2.86 -0.62 -1.39 114.93 117.21 3dwe h MET 238 Ca 0.02 -0.30 0.03 0.00 -2.06 0.00 0.00 59.70 57.38 3dwe h MET 238 Cb 0.93 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 32.49 3dwe h MET 238 CO 0.08 0.93 0.54 1.79 1.06 0.00 0.00 176.91 181.31 3dwe h THR 239 N 0.70 1.16 0.00 2.22 1.35 -1.05 -0.37 112.91 116.91 3dwe h THR 239 Ca 0.12 -0.36 0.00 0.00 -0.55 0.00 0.00 66.41 65.62 3dwe h THR 239 Cb 0.59 0.02 0.00 0.00 -1.73 0.00 0.00 68.15 67.03 3dwe h THR 239 CO 0.04 0.19 0.00 0.18 -0.25 0.00 0.00 175.52 175.68 3dwe n LEU 240 N -4.44 0.09 -0.15 3.87 4.77 -0.89 -4.88 117.00 115.37 3dwe n LEU 240 Ca 0.10 0.52 -0.02 0.00 -0.03 0.00 0.00 56.01 56.58 3dwe n LEU 240 Cb 0.08 -0.51 -0.01 0.00 -2.33 0.00 0.00 43.42 40.66 3dwe n LEU 240 CO 0.35 -0.26 -0.02 0.61 -1.33 0.00 0.00 177.39 176.75 3dwe n GLY 241 N 0.20 0.54 0.17 -0.72 0.00 -0.15 -4.92 105.19 100.31 3dwe n GLY 241 Ca 0.04 -0.60 0.07 0.00 0.00 0.00 0.00 46.02 45.52 3dwe n GLY 241 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dwe h LYS 242 N 0.31 0.00 0.00 1.61 1.79 -1.49 -3.48 116.57 115.31 3dwe h LYS 242 Ca -0.04 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.36 3dwe h LYS 242 Cb 0.17 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.82 3dwe h LYS 242 CO 0.06 0.26 0.20 -2.37 -1.08 0.00 0.00 179.45 176.51 3dwe n THR 243 N -3.13 0.00 -4.34 -0.16 5.66 -1.24 -5.03 114.28 106.04 3dwe n THR 243 Ca 0.02 -1.13 -0.18 0.00 -3.05 0.00 0.00 64.05 59.71 3dwe n THR 243 Cb 0.65 1.01 -0.10 0.00 -1.55 0.00 0.00 70.33 70.33 3dwe n THR 243 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3dwe s THR 244 N -2.24 0.51 0.27 1.09 -4.23 -1.26 -4.45 115.64 105.33 3dwe s THR 244 Ca 0.18 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 58.68 3dwe s THR 244 Cb -0.04 -2.59 0.27 0.00 1.34 0.00 0.00 72.50 71.48 3dwe s THR 244 CO 0.13 0.00 1.87 0.00 -0.54 0.00 0.00 174.62 176.09 3dwe h ALA 245 N 2.30 1.42 0.00 3.99 0.00 -1.88 0.79 119.26 125.88 3dwe h ALA 245 Ca -0.37 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.50 3dwe h ALA 245 Cb 1.25 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 3dwe h ALA 245 CO 0.58 0.41 -0.15 0.00 0.00 0.00 0.00 179.25 180.09 3dwe h ALA 246 N 1.47 0.99 0.00 0.00 0.00 -1.90 -3.31 119.26 116.51 3dwe h ALA 246 Ca 0.45 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.22 3dwe h ALA 246 Cb 0.23 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3dwe h ALA 246 CO -0.19 0.19 0.00 -1.13 0.00 0.00 0.00 179.25 178.12 3dwe n SER 247 N -3.26 1.28 -0.24 0.00 3.41 -0.85 -4.79 113.62 109.18 3dwe n SER 247 Ca 0.01 -1.40 -0.05 0.00 -0.26 0.00 0.00 58.87 57.16 3dwe n SER 247 Cb 0.42 0.00 0.10 0.00 -0.26 0.00 0.00 64.21 64.47 3dwe n SER 247 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dwe h ALA 248 N 0.00 1.07 -0.35 7.33 0.00 -0.95 0.31 119.26 126.67 3dwe h ALA 248 Ca 0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 3dwe h ALA 248 Cb 0.29 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3dwe h ALA 248 CO 0.00 0.64 0.16 0.00 0.00 0.00 0.00 179.25 180.05 3dwe h ARG 250 N 0.43 0.64 -0.44 0.00 2.43 -1.82 -0.81 114.38 114.81 3dwe h ARG 250 Ca 0.12 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 3dwe h ARG 250 Cb 0.13 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 3dwe h ARG 250 CO -0.01 0.42 0.17 -0.92 -1.51 0.00 0.00 179.97 178.12 3dwe h TYR 251 N 0.66 0.67 -0.59 2.20 3.20 -0.65 0.21 116.97 122.67 3dwe h TYR 251 Ca 0.18 -0.05 -0.00 0.00 3.14 0.00 0.00 58.73 62.00 3dwe h TYR 251 Cb -0.06 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 37.98 3dwe h TYR 251 CO -0.04 0.59 0.36 0.82 -1.64 0.00 0.00 178.16 178.24 3dwe h ILE 252 N 0.57 1.17 -0.51 1.81 2.04 -0.65 -1.10 117.51 120.84 3dwe h ILE 252 Ca 0.15 -0.38 -0.02 0.00 1.00 0.00 0.00 64.86 65.60 3dwe h ILE 252 Cb 0.20 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.63 3dwe h ILE 252 CO -0.01 0.18 0.24 0.00 0.00 0.00 0.00 178.15 178.55 3dwe h ALA 253 N 1.18 0.66 -0.97 1.87 0.00 -0.85 -1.22 119.26 119.93 3dwe h ALA 253 Ca 0.21 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 55.09 3dwe h ALA 253 Cb -0.02 -0.20 -0.07 0.00 0.00 0.00 0.00 17.79 17.49 3dwe h ALA 253 CO -0.04 0.23 0.62 -0.44 0.00 0.00 0.00 179.25 179.62 3dwe h ASP 254 N 0.68 0.93 -0.29 0.00 3.32 -0.17 -2.97 116.42 117.93 3dwe h ASP 254 Ca 0.17 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.25 3dwe h ASP 254 Cb 0.13 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.52 3dwe h ASP 254 CO -0.02 0.55 0.00 0.35 -1.72 0.00 0.00 179.24 178.40 3dwe n THR 255 N -4.55 0.42 -1.27 0.35 -2.24 -0.45 -5.00 114.28 101.54 3dwe n THR 255 Ca 0.17 -0.71 -0.32 0.00 -2.27 0.00 0.00 64.05 60.92 3dwe n THR 255 Cb 0.28 1.03 0.10 0.00 -2.10 0.00 0.00 70.33 69.64 3dwe n THR 255 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dwe s ALA 256 N -1.41 2.16 0.08 6.98 0.00 -0.48 -4.64 121.76 124.45 3dwe s ALA 256 Ca 0.32 0.41 -0.31 0.00 0.00 0.00 0.00 51.96 52.38 3dwe s ALA 256 Cb 0.19 -3.32 -0.08 0.00 0.00 0.00 0.00 23.12 19.91 3dwe s ALA 256 CO 0.27 -1.85 1.45 -0.80 0.00 0.00 0.00 175.76 174.84 3dwe s ASN 257 N -3.04 6.77 -0.13 0.00 0.02 -0.27 -4.83 114.94 113.47 3dwe s ASN 257 Ca 0.64 2.33 -0.01 0.00 -1.02 0.00 0.00 52.86 54.80 3dwe s ASN 257 Cb -0.19 -2.58 -0.02 0.00 0.02 0.00 0.00 41.25 38.48 3dwe s ASN 257 CO 0.53 -0.73 -0.10 -0.54 0.02 0.00 0.00 177.10 176.29 3dwe s LYS 258 N 1.70 3.35 -0.47 -0.60 1.02 -1.26 -0.95 119.74 122.53 3dwe s LYS 258 Ca 0.66 -0.62 0.00 0.00 0.02 0.00 0.00 55.97 56.03 3dwe s LYS 258 Cb -0.37 -2.70 0.00 0.00 -0.52 0.00 0.00 37.83 34.25 3dwe s LYS 258 CO 0.30 0.30 0.00 0.41 -0.92 0.00 0.00 175.35 175.43 3dwe n GLY 259 N 3.31 0.72 0.00 -3.33 0.00 -0.10 -4.91 105.19 100.88 3dwe n GLY 259 Ca -0.18 -0.60 0.10 0.00 0.00 0.00 0.00 46.02 45.34 3dwe n GLY 259 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3dwe n ASP 260 N 0.74 0.89 -4.85 1.61 8.00 -1.26 -4.95 116.55 116.72 3dwe n ASP 260 Ca -0.04 -0.87 -0.34 0.00 0.71 0.00 0.00 54.79 54.24 3dwe n ASP 260 Cb 0.18 1.07 -0.06 0.00 -0.02 0.00 0.00 41.12 42.29 3dwe n ASP 260 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3dwe s LEU 261 N -3.15 4.30 0.24 0.64 1.43 -1.26 -4.89 118.68 115.98 3dwe s LEU 261 Ca 0.07 1.03 0.06 0.00 -1.03 0.00 0.00 54.13 54.25 3dwe s LEU 261 Cb 0.16 -3.35 -0.03 0.00 0.03 0.00 0.00 46.19 43.00 3dwe s LEU 261 CO 0.87 0.07 0.32 -0.94 0.23 0.00 0.00 176.35 176.89 3dwe s SER 262 N -1.87 6.10 -1.44 2.29 1.04 0.36 -4.53 113.70 115.66 3dwe s SER 262 Ca 0.40 -0.02 -0.08 0.00 0.48 0.00 0.00 55.95 56.73 3dwe s SER 262 Cb -0.14 -1.74 0.04 0.00 0.10 0.00 0.00 66.02 64.29 3dwe s SER 262 CO 0.19 -0.06 0.69 -3.20 0.98 0.00 0.00 173.24 171.84 3dwe n ASN 263 N -1.34 -5.10 -4.60 7.02 5.15 -1.26 -1.27 115.26 113.86 3dwe n ASN 263 Ca -0.09 -0.43 -0.42 0.00 -0.60 0.00 0.00 54.58 53.04 3dwe n ASN 263 Cb 0.57 -4.12 -0.06 0.00 -0.53 0.00 0.00 39.78 35.64 3dwe n ASN 263 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3dwe s ILE 264 N -3.13 4.83 0.54 -1.44 -1.09 -1.26 -4.67 121.20 114.98 3dwe s ILE 264 Ca 0.43 0.99 -0.22 0.00 -2.23 0.00 0.00 60.65 59.62 3dwe s ILE 264 Cb -0.21 -4.11 -0.05 0.00 -1.58 0.00 0.00 42.46 36.51 3dwe s ILE 264 CO 0.53 -0.25 1.37 -2.84 -1.23 0.00 0.00 174.94 172.52 3dwe s PRO 265 N 2.86 3.18 -0.03 2.79 0.02 -1.26 -4.88 135.00 137.67 3dwe s PRO 265 Ca 0.30 2.27 -0.37 0.00 0.02 0.00 0.00 61.00 63.21 3dwe s PRO 265 Cb -0.14 -2.29 -0.16 0.00 0.02 0.00 0.00 34.50 31.93 3dwe s PRO 265 CO 0.13 -1.17 1.53 0.34 -0.33 0.00 0.00 177.00 177.50 3dwe n PHE 266 N -0.96 1.81 -0.01 6.54 7.35 -1.26 -1.68 117.46 129.25 3dwe n PHE 266 Ca 0.10 0.53 0.00 0.00 -0.76 0.00 0.00 57.45 57.32 3dwe n PHE 266 Cb 0.45 -2.42 0.00 0.00 0.35 0.00 0.00 39.48 37.86 3dwe n PHE 266 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3dwe n GLY 267 N 3.26 0.25 3.77 7.13 0.00 -1.26 -5.02 105.19 113.33 3dwe n GLY 267 Ca 0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.88 3dwe n GLY 267 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dwe s THR 268 N -2.02 4.82 0.39 2.61 2.01 -0.68 -3.99 115.64 118.78 3dwe s THR 268 Ca 0.00 -0.09 -0.27 0.00 0.31 0.00 0.00 61.69 61.64 3dwe s THR 268 Cb 0.00 -3.07 -0.10 0.00 0.01 0.00 0.00 72.50 69.33 3dwe s THR 268 CO 0.00 0.59 1.47 1.33 -0.69 0.00 0.00 174.62 177.31 3dwe n VAL 269 N 1.99 2.19 -3.45 3.82 0.24 -1.26 -4.84 118.33 117.01 3dwe n VAL 269 Ca -0.19 -0.50 -0.37 0.00 -2.04 0.00 0.00 64.34 61.24 3dwe n VAL 269 Cb 0.54 -1.93 -0.04 0.00 -1.47 0.00 0.00 33.84 30.94 3dwe n VAL 269 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 3dwe n ASN 270 N 0.31 4.75 -3.81 -1.34 4.05 -1.26 -4.92 115.26 113.04 3dwe n ASN 270 Ca 0.02 -3.21 -0.18 0.00 0.45 0.00 0.00 54.58 51.66 3dwe n ASN 270 Cb 0.39 -1.09 -0.16 0.00 1.23 0.00 0.00 39.78 40.15 3dwe n ASN 270 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 3dwe s LEU 271 N -1.78 1.03 -0.15 1.20 1.43 -1.26 -0.92 118.68 118.23 3dwe s LEU 271 Ca 0.30 -0.04 0.02 0.00 -1.03 0.00 0.00 54.13 53.39 3dwe s LEU 271 Cb -0.02 -0.27 0.01 0.00 0.03 0.00 0.00 46.19 45.94 3dwe s LEU 271 CO -0.06 -0.12 -0.21 -0.22 0.23 0.00 0.00 176.35 175.97 3dwe s LEU 272 N 1.22 2.14 0.21 1.79 2.96 -0.13 -0.97 118.68 125.90 3dwe s LEU 272 Ca -0.07 -0.61 -0.32 0.00 -0.22 0.00 0.00 54.13 52.92 3dwe s LEU 272 Cb -0.13 -1.46 -0.15 0.00 0.50 0.00 0.00 46.19 44.95 3dwe s LEU 272 CO -0.02 0.06 1.25 0.00 -1.32 0.00 0.00 176.35 176.32 3dwe n ALA 273 N 4.20 0.01 -3.67 5.97 0.00 -0.25 -1.11 120.51 125.66 3dwe n ALA 273 Ca -0.20 0.44 -0.11 0.00 0.00 0.00 0.00 53.44 53.57 3dwe n ALA 273 Cb 0.51 -2.12 -0.11 0.00 0.00 0.00 0.00 19.45 17.73 3dwe n ALA 273 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3dwe s TYR 274 N -0.22 -0.54 -1.13 0.00 5.04 -1.26 -4.49 117.35 114.75 3dwe s TYR 274 Ca 0.70 1.18 0.29 0.00 -2.44 0.00 0.00 57.07 56.80 3dwe s TYR 274 Cb -0.76 0.22 1.22 0.00 0.35 0.00 0.00 41.96 42.99 3dwe s TYR 274 CO 0.52 -0.31 1.90 0.27 -1.34 0.00 0.00 175.55 176.58 3dwe n ASN 275 N 4.16 0.09 -3.20 4.32 2.04 0.80 -4.68 115.26 118.79 3dwe n ASN 275 Ca -0.23 0.21 -0.21 0.00 -0.44 0.00 0.00 54.58 53.91 3dwe n ASN 275 Cb 0.55 -0.35 -0.01 0.00 -2.53 0.00 0.00 39.78 37.45 3dwe n ASN 275 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 3dwe n ASN 276 N -1.42 -3.60 -4.69 0.53 3.02 -1.26 -4.91 115.26 102.93 3dwe n ASN 276 Ca 0.09 -0.27 -0.41 0.00 -0.03 0.00 0.00 54.58 53.95 3dwe n ASN 276 Cb 0.31 -3.00 -0.04 0.00 -0.61 0.00 0.00 39.78 36.45 3dwe n ASN 276 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3dwe s TYR 277 N -2.85 3.52 -0.36 3.10 5.04 -1.26 -5.02 117.35 119.53 3dwe s TYR 277 Ca 0.33 1.44 -0.08 0.00 -2.44 0.00 0.00 57.07 56.32 3dwe s TYR 277 Cb -0.17 -3.04 0.04 0.00 0.35 0.00 0.00 41.96 39.14 3dwe s TYR 277 CO 0.40 -0.13 0.14 -0.65 -1.34 0.00 0.00 175.55 173.98 3dwe s GLN 278 N 1.62 2.64 0.00 4.97 1.11 -1.26 -4.99 119.66 123.75 3dwe s GLN 278 Ca 0.44 -1.21 0.00 0.00 0.01 0.00 0.00 55.36 54.60 3dwe s GLN 278 Cb -0.18 -3.55 0.00 0.00 -1.01 0.00 0.00 33.01 28.27 3dwe s GLN 278 CO 0.18 -0.72 0.41 0.00 0.01 0.00 0.00 175.29 175.17