#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uwe s ASP 1 N 0.00 6.21 -0.72 1.96 -1.08 -1.26 -5.04 116.67 116.74 1uwe s ASP 1 Ca 0.00 0.31 -0.27 0.00 -0.52 0.00 0.00 52.55 52.07 1uwe s ASP 1 Cb 0.00 -2.06 0.01 0.00 -1.46 0.00 0.00 42.92 39.41 1uwe s ASP 1 CO 0.00 0.27 1.50 0.20 0.52 0.00 0.00 175.17 177.66 1uwe s ASN 2 N -0.18 5.86 -0.15 -0.34 0.01 -1.26 -4.93 114.94 113.94 1uwe s ASN 2 Ca 0.10 -0.25 -0.20 0.00 -0.71 0.00 0.00 52.86 51.80 1uwe s ASN 2 Cb -0.11 -2.55 -0.03 0.00 0.41 0.00 0.00 41.25 38.96 1uwe s ASN 2 CO 0.00 -2.03 0.60 -0.69 -1.51 0.00 0.00 177.10 173.47 1uwe s VAL 3 N 6.92 5.07 -0.31 1.60 1.01 -1.26 -4.75 120.40 128.68 1uwe s VAL 3 Ca 0.47 1.16 -0.10 0.00 0.00 0.00 0.00 61.98 63.51 1uwe s VAL 3 Cb -0.09 -3.92 -0.01 0.00 0.00 0.00 0.00 36.38 32.36 1uwe s VAL 3 CO 0.15 0.20 0.16 -0.04 0.00 0.00 0.00 175.10 175.56 1uwe s MET 4 N 1.36 3.33 -0.40 2.72 -1.94 -1.26 -1.91 119.30 121.19 1uwe s MET 4 Ca 0.29 -0.73 -0.15 0.00 -1.71 0.00 0.00 55.69 53.40 1uwe s MET 4 Cb -0.16 -3.57 0.01 0.00 2.01 0.00 0.00 34.83 33.12 1uwe s MET 4 CO 0.12 -0.42 0.29 0.99 -0.01 0.00 0.00 175.02 175.99 1uwe s THR 5 N 1.61 5.26 0.14 2.05 2.01 -0.43 -4.01 115.64 122.28 1uwe s THR 5 Ca 0.05 -0.58 -0.05 0.00 0.31 0.00 0.00 61.69 61.42 1uwe s THR 5 Cb -0.17 -3.89 -0.06 0.00 0.01 0.00 0.00 72.50 68.39 1uwe s THR 5 CO 0.06 -0.26 0.38 -1.58 -0.69 0.00 0.00 174.62 172.53 1uwe s GLN 6 N 1.69 3.63 -0.13 4.92 0.74 -1.26 -1.72 119.66 127.53 1uwe s GLN 6 Ca 0.05 -0.07 -0.17 0.00 0.05 0.00 0.00 55.36 55.23 1uwe s GLN 6 Cb -0.19 -2.86 0.04 0.00 1.10 0.00 0.00 33.01 31.11 1uwe s GLN 6 CO 0.10 0.47 0.44 -1.12 -0.55 0.00 0.00 175.29 174.64 1uwe s SER 7 N -2.38 -0.43 0.87 6.67 0.01 -0.57 -4.64 113.70 113.23 1uwe s SER 7 Ca 0.40 0.72 -0.08 0.00 1.31 0.00 0.00 55.95 58.30 1uwe s SER 7 Cb -0.12 0.76 0.19 0.00 0.21 0.00 0.00 66.02 67.05 1uwe s SER 7 CO 0.24 -0.26 1.18 -0.81 0.41 0.00 0.00 173.24 174.00 1uwe n PRO 8 N 2.31 -0.71 -0.09 12.44 -0.04 -1.26 -0.96 135.00 146.70 1uwe n PRO 8 Ca -0.16 -2.44 -0.12 0.00 -0.04 0.00 0.00 63.50 60.74 1uwe n PRO 8 Cb 0.57 -1.02 -0.04 0.00 -0.04 0.00 0.00 33.50 32.96 1uwe n PRO 8 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1uwe h SER 9 N -1.17 0.53 -3.95 3.54 0.87 -1.82 -3.41 113.55 108.14 1uwe h SER 9 Ca -0.39 -0.39 -0.56 0.00 -1.23 0.00 0.00 61.79 59.23 1uwe h SER 9 Cb 1.22 -0.15 -0.31 0.00 -0.44 0.00 0.00 62.40 62.73 1uwe h SER 9 CO 0.34 0.80 -0.84 -0.36 -0.53 0.00 0.00 176.83 176.24 1uwe s PHE 10 N -4.69 1.67 -0.03 2.24 0.08 -1.26 -0.66 117.98 115.33 1uwe s PHE 10 Ca -0.13 -0.46 0.01 0.00 0.12 0.00 0.00 56.93 56.47 1uwe s PHE 10 Cb 0.08 -1.12 0.02 0.00 -0.57 0.00 0.00 43.02 41.43 1uwe s PHE 10 CO 0.77 -0.15 -0.01 1.41 -0.10 0.00 0.00 175.22 177.15 1uwe s MET 11 N -0.01 0.42 -0.11 0.44 -2.45 0.09 -4.92 119.30 112.75 1uwe s MET 11 Ca -0.02 0.03 0.03 0.00 -1.25 0.00 0.00 55.69 54.47 1uwe s MET 11 Cb -0.11 -0.55 0.01 0.00 1.25 0.00 0.00 34.83 35.43 1uwe s MET 11 CO 0.02 -0.11 -0.20 -1.54 1.05 0.00 0.00 175.02 174.24 1uwe s SER 12 N 0.95 2.79 0.19 1.11 1.04 -1.26 0.14 113.70 118.66 1uwe s SER 12 Ca -0.10 -0.51 -0.00 0.00 0.48 0.00 0.00 55.95 55.81 1uwe s SER 12 Cb -0.14 -1.28 -0.04 0.00 0.10 0.00 0.00 66.02 64.66 1uwe s SER 12 CO -0.01 0.08 0.10 0.28 0.98 0.00 0.00 173.24 174.67 1uwe s THR 13 N 0.71 0.19 0.11 2.02 -1.32 0.27 -4.90 115.64 112.71 1uwe s THR 13 Ca -0.11 -1.98 0.03 0.00 -1.21 0.00 0.00 61.69 58.42 1uwe s THR 13 Cb -0.16 -2.40 -0.04 0.00 -1.51 0.00 0.00 72.50 68.39 1uwe s THR 13 CO 0.02 -0.14 0.15 -0.44 -2.21 0.00 0.00 174.62 172.00 1uwe s SER 14 N -3.17 5.81 -0.08 8.08 0.01 -1.26 -0.11 113.70 122.99 1uwe s SER 14 Ca 0.34 0.04 -0.37 0.00 1.31 0.00 0.00 55.95 57.28 1uwe s SER 14 Cb 0.07 -1.63 -0.14 0.00 0.21 0.00 0.00 66.02 64.53 1uwe s SER 14 CO 0.09 0.13 1.68 0.52 0.41 0.00 0.00 173.24 176.08 1uwe n VAL 15 N 0.08 0.29 0.00 3.43 0.31 -1.26 -1.50 118.33 119.67 1uwe n VAL 15 Ca -0.08 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.20 1uwe n VAL 15 Cb 0.53 -1.40 0.00 0.00 -0.91 0.00 0.00 33.84 32.06 1uwe n VAL 15 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1uwe n GLY 16 N 3.82 1.60 3.94 2.92 0.00 0.79 -4.94 105.19 113.32 1uwe n GLY 16 Ca 0.22 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.99 1uwe n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1uwe s ASP 17 N -1.72 4.86 -0.12 1.61 1.01 -0.56 -4.06 116.67 117.70 1uwe s ASP 17 Ca 0.00 0.34 -0.05 0.00 0.71 0.00 0.00 52.55 53.55 1uwe s ASP 17 Cb 0.00 -1.02 -0.04 0.00 1.01 0.00 0.00 42.92 42.87 1uwe s ASP 17 CO 0.00 -1.54 0.08 -0.60 0.21 0.00 0.00 175.17 173.33 1uwe s ARG 18 N -5.16 3.37 0.02 8.23 3.52 -1.26 -1.22 118.95 126.46 1uwe s ARG 18 Ca 0.60 -0.25 0.02 0.00 -0.13 0.00 0.00 55.73 55.97 1uwe s ARG 18 Cb -0.10 -3.07 -0.01 0.00 -1.56 0.00 0.00 34.95 30.21 1uwe s ARG 18 CO 0.44 0.68 -0.07 0.54 -0.81 0.00 0.00 175.30 176.07 1uwe s VAL 19 N -0.77 0.52 -0.10 7.11 0.11 -0.35 -4.98 120.40 121.93 1uwe s VAL 19 Ca 0.13 -0.64 0.04 0.00 -2.93 0.00 0.00 61.98 58.57 1uwe s VAL 19 Cb -0.12 -0.51 0.00 0.00 -1.53 0.00 0.00 36.38 34.23 1uwe s VAL 19 CO 0.03 -0.10 -0.24 -0.44 -3.33 0.00 0.00 175.10 171.02 1uwe s SER 20 N -0.82 3.09 -0.19 3.54 0.01 -1.26 -1.17 113.70 116.91 1uwe s SER 20 Ca -0.03 -0.57 -0.05 0.00 1.31 0.00 0.00 55.95 56.61 1uwe s SER 20 Cb -0.06 -1.41 -0.03 0.00 0.21 0.00 0.00 66.02 64.73 1uwe s SER 20 CO 0.00 0.15 -0.00 -0.69 0.41 0.00 0.00 173.24 173.11 1uwe s VAL 21 N 0.40 4.03 0.14 3.43 1.01 -0.11 -4.78 120.40 124.51 1uwe s VAL 21 Ca -0.18 -0.29 0.02 0.00 0.00 0.00 0.00 61.98 61.53 1uwe s VAL 21 Cb -0.18 -2.81 -0.04 0.00 0.00 0.00 0.00 36.38 33.36 1uwe s VAL 21 CO 0.08 0.44 0.28 -0.89 0.00 0.00 0.00 175.10 175.01 1uwe s THR 22 N 0.80 5.33 -0.17 3.92 2.01 -0.13 -0.46 115.64 126.93 1uwe s THR 22 Ca 0.00 -0.58 -0.07 0.00 0.31 0.00 0.00 61.69 61.35 1uwe s THR 22 Cb -0.14 -3.72 0.08 0.00 0.01 0.00 0.00 72.50 68.73 1uwe s THR 22 CO 0.02 -0.05 0.37 0.00 -0.69 0.00 0.00 174.62 174.27 1uwe s ALA 24 N 2.26 2.60 0.29 0.00 0.00 -0.70 -0.12 121.76 126.09 1uwe s ALA 24 Ca -0.03 -1.12 -0.19 0.00 0.00 0.00 0.00 51.96 50.63 1uwe s ALA 24 Cb -0.11 -1.40 -0.09 0.00 0.00 0.00 0.00 23.12 21.52 1uwe s ALA 24 CO -0.12 -0.23 0.78 0.00 0.00 0.00 0.00 175.76 176.19 1uwe s ALA 25 N 1.14 3.32 -0.79 0.00 0.00 0.03 -1.31 121.76 124.14 1uwe s ALA 25 Ca 0.01 0.18 0.27 0.00 0.00 0.00 0.00 51.96 52.41 1uwe s ALA 25 Cb -0.14 -2.87 0.84 0.00 0.00 0.00 0.00 23.12 20.95 1uwe s ALA 25 CO -0.04 0.29 1.75 -1.13 0.00 0.00 0.00 175.76 176.63 1uwe n SER 26 N 0.15 0.62 -3.84 0.00 3.41 -0.80 -4.77 113.62 108.37 1uwe n SER 26 Ca 0.01 0.48 -0.13 0.00 -0.26 0.00 0.00 58.87 58.98 1uwe n SER 26 Cb 0.52 -0.59 -0.15 0.00 -0.26 0.00 0.00 64.21 63.73 1uwe n SER 26 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1uwe s GLN 27 N -3.08 -0.01 0.11 4.33 -0.21 -1.26 -4.99 119.66 114.54 1uwe s GLN 27 Ca 0.11 0.06 -0.32 0.00 0.02 0.00 0.00 55.36 55.23 1uwe s GLN 27 Cb 0.14 -0.07 -0.17 0.00 1.00 0.00 0.00 33.01 33.91 1uwe s GLN 27 CO 0.60 -0.05 0.72 -1.71 -2.12 0.00 0.00 175.29 172.73 1uwe n ASN 28 N 3.39 -0.69 0.00 5.90 2.85 -1.26 -4.77 115.26 120.67 1uwe n ASN 28 Ca -0.16 1.09 0.00 0.00 -0.11 0.00 0.00 54.58 55.40 1uwe n ASN 28 Cb 0.57 -0.90 0.00 0.00 1.24 0.00 0.00 39.78 40.70 1uwe n ASN 28 CO 0.00 0.00 0.00 0.55 -2.11 0.00 0.00 177.26 175.70 1uwe n VAL 29 N 0.61 0.16 -0.34 3.44 3.14 0.12 -4.98 118.33 120.47 1uwe n VAL 29 Ca 0.18 -0.27 0.00 0.00 -2.96 0.00 0.00 64.34 61.29 1uwe n VAL 29 Cb 0.17 1.29 0.00 0.00 -1.06 0.00 0.00 33.84 34.24 1uwe n VAL 29 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1uwe n GLY 30 N -0.08 1.68 0.17 7.55 0.00 -1.25 -2.98 105.19 110.28 1uwe n GLY 30 Ca 0.00 -0.47 0.02 0.00 0.00 0.00 0.00 46.02 45.57 1uwe n GLY 30 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1uwe n THR 31 N 0.00 0.69 -1.20 2.61 -2.24 -1.26 -0.57 114.28 112.31 1uwe n THR 31 Ca 0.00 -0.84 -0.35 0.00 -2.27 0.00 0.00 64.05 60.58 1uwe n THR 31 Cb 0.00 0.68 -0.03 0.00 -2.10 0.00 0.00 70.33 68.88 1uwe n THR 31 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1uwe n ASN 32 N -0.08 7.65 -4.26 3.42 3.02 -1.16 -2.24 115.26 121.62 1uwe n ASN 32 Ca 0.03 -2.53 -0.25 0.00 -0.03 0.00 0.00 54.58 51.80 1uwe n ASN 32 Cb 0.23 -1.46 -0.14 0.00 -0.61 0.00 0.00 39.78 37.81 1uwe n ASN 32 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1uwe s VAL 33 N 2.52 1.69 0.15 2.41 1.01 -1.26 -1.35 120.40 125.57 1uwe s VAL 33 Ca 0.62 -1.26 0.05 0.00 0.00 0.00 0.00 61.98 61.40 1uwe s VAL 33 Cb 0.16 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 35.02 1uwe s VAL 33 CO -0.05 0.17 -0.11 0.00 0.00 0.00 0.00 175.10 175.10 1uwe s ALA 34 N -0.85 1.55 -0.02 5.51 0.00 0.10 -0.39 121.76 127.66 1uwe s ALA 34 Ca 0.07 -1.49 0.06 0.00 0.00 0.00 0.00 51.96 50.60 1uwe s ALA 34 Cb -0.09 0.01 -0.02 0.00 0.00 0.00 0.00 23.12 23.03 1uwe s ALA 34 CO 0.02 -0.05 -0.21 -1.58 0.00 0.00 0.00 175.76 173.95 1uwe s TRP 35 N -3.12 1.87 0.18 0.00 0.52 -0.62 -0.29 118.94 117.48 1uwe s TRP 35 Ca 0.17 -0.36 0.10 0.00 0.02 0.00 0.00 56.10 56.03 1uwe s TRP 35 Cb 0.01 -1.21 -0.04 0.00 -1.15 0.00 0.00 33.47 31.08 1uwe s TRP 35 CO 0.02 -0.04 -0.21 0.71 0.02 0.00 0.00 176.95 177.45 1uwe s TYR 36 N -0.48 2.06 -0.09 -1.98 2.02 0.64 -0.71 117.35 118.81 1uwe s TYR 36 Ca 0.08 -0.41 0.01 0.00 -0.37 0.00 0.00 57.07 56.38 1uwe s TYR 36 Cb -0.08 -1.03 0.02 0.00 -0.40 0.00 0.00 41.96 40.47 1uwe s TYR 36 CO -0.01 0.41 -0.10 -1.14 -1.57 0.00 0.00 175.55 173.14 1uwe s GLN 37 N -2.68 1.65 -0.30 -0.62 0.74 -0.20 -1.47 119.66 116.79 1uwe s GLN 37 Ca 0.18 -0.35 0.01 0.00 0.05 0.00 0.00 55.36 55.25 1uwe s GLN 37 Cb -0.07 -1.53 0.07 0.00 1.10 0.00 0.00 33.01 32.58 1uwe s GLN 37 CO 0.08 -0.12 -0.02 -1.14 -0.55 0.00 0.00 175.29 173.54 1uwe s GLN 38 N 1.18 2.14 0.48 1.67 0.74 0.86 -0.24 119.66 126.50 1uwe s GLN 38 Ca -0.05 -1.46 -0.14 0.00 0.05 0.00 0.00 55.36 53.76 1uwe s GLN 38 Cb -0.14 -3.09 -0.07 0.00 1.10 0.00 0.00 33.01 30.81 1uwe s GLN 38 CO -0.03 -0.69 0.91 0.15 -0.55 0.00 0.00 175.29 175.09 1uwe s LYS 39 N 1.11 3.87 0.04 1.67 1.02 -1.26 -1.23 119.74 124.96 1uwe s LYS 39 Ca -0.03 0.77 -0.36 0.00 0.02 0.00 0.00 55.97 56.37 1uwe s LYS 39 Cb -0.20 -2.22 -0.15 0.00 -0.52 0.00 0.00 37.83 34.74 1uwe s LYS 39 CO -0.04 -0.21 1.50 -2.30 -0.92 0.00 0.00 175.35 173.38 1uwe n PRO 40 N -1.56 1.50 -0.43 -1.68 -0.02 -1.26 -1.33 135.00 130.23 1uwe n PRO 40 Ca 0.05 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1uwe n PRO 40 Cb 0.54 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 1uwe n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1uwe n GLY 41 N 3.13 1.94 3.62 -1.23 0.00 -1.26 -5.02 105.19 106.37 1uwe n GLY 41 Ca 0.19 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.98 1uwe n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1uwe s GLN 42 N -0.07 2.12 0.65 1.61 -0.21 -0.44 -5.13 119.66 118.20 1uwe s GLN 42 Ca 0.00 -1.60 -0.16 0.00 0.02 0.00 0.00 55.36 53.63 1uwe s GLN 42 Cb 0.00 -2.02 -0.00 0.00 1.00 0.00 0.00 33.01 31.99 1uwe s GLN 42 CO 0.00 0.27 1.13 -2.14 -2.12 0.00 0.00 175.29 172.43 1uwe s PRO 43 N -3.67 2.78 0.48 2.91 0.02 -1.26 -4.57 135.00 131.69 1uwe s PRO 43 Ca 0.33 1.49 -0.24 0.00 0.02 0.00 0.00 61.00 62.60 1uwe s PRO 43 Cb -0.04 -1.94 -0.07 0.00 0.02 0.00 0.00 34.50 32.47 1uwe s PRO 43 CO 0.19 -1.28 1.40 -2.14 -0.33 0.00 0.00 177.00 174.84 1uwe s PRO 44 N -3.92 3.51 -0.09 5.54 0.02 -1.26 -4.59 135.00 134.21 1uwe s PRO 44 Ca 0.69 2.34 0.03 0.00 0.02 0.00 0.00 61.00 64.08 1uwe s PRO 44 Cb -0.23 -2.52 -0.01 0.00 0.02 0.00 0.00 34.50 31.76 1uwe s PRO 44 CO 0.40 -0.93 -0.19 0.21 -0.33 0.00 0.00 177.00 176.16 1uwe s LYS 45 N -2.60 2.92 -0.01 5.54 2.20 0.67 -4.92 119.74 123.54 1uwe s LYS 45 Ca 0.64 -0.79 -0.30 0.00 -0.36 0.00 0.00 55.97 55.16 1uwe s LYS 45 Cb -0.42 -2.38 -0.05 0.00 -1.51 0.00 0.00 37.83 33.47 1uwe s LYS 45 CO 0.53 0.32 1.32 0.00 -0.36 0.00 0.00 175.35 177.16 1uwe s ALA 46 N 0.02 3.54 -0.26 3.13 0.00 -1.26 -1.03 121.76 125.90 1uwe s ALA 46 Ca -0.07 0.80 -0.15 0.00 0.00 0.00 0.00 51.96 52.54 1uwe s ALA 46 Cb -0.15 -3.56 -0.11 0.00 0.00 0.00 0.00 23.12 19.31 1uwe s ALA 46 CO 0.05 -0.83 -0.35 1.28 0.00 0.00 0.00 175.76 175.91 1uwe n LEU 47 N 5.20 1.95 -4.02 0.00 4.77 0.11 -4.76 117.00 120.25 1uwe n LEU 47 Ca 0.12 0.34 -0.15 0.00 -0.03 0.00 0.00 56.01 56.29 1uwe n LEU 47 Cb 0.45 -0.80 -0.13 0.00 -2.33 0.00 0.00 43.42 40.60 1uwe n LEU 47 CO 0.57 0.39 -0.41 -0.63 -1.33 0.00 0.00 177.39 175.99 1uwe s ILE 48 N -2.60 0.52 0.25 -0.08 1.01 -1.16 -1.93 121.20 117.22 1uwe s ILE 48 Ca -0.37 -0.70 0.03 0.00 0.00 0.00 0.00 60.65 59.61 1uwe s ILE 48 Cb 0.13 -0.52 -0.05 0.00 0.01 0.00 0.00 42.46 42.02 1uwe s ILE 48 CO 0.48 -0.14 0.04 -0.72 0.00 0.00 0.00 174.94 174.59 1uwe s TYR 49 N -0.80 1.61 -1.65 3.97 -0.85 0.01 -1.58 117.35 118.05 1uwe s TYR 49 Ca -0.04 -1.00 -0.16 0.00 -0.52 0.00 0.00 57.07 55.35 1uwe s TYR 49 Cb -0.06 -0.96 0.13 0.00 0.38 0.00 0.00 41.96 41.44 1uwe s TYR 49 CO 0.00 -0.12 0.76 0.45 -1.52 0.00 0.00 175.55 175.12 1uwe n SER 50 N -0.47 -3.08 0.00 -0.18 2.88 -0.94 -1.48 113.62 110.35 1uwe n SER 50 Ca -0.03 -0.99 0.00 0.00 -1.33 0.00 0.00 58.87 56.52 1uwe n SER 50 Cb 0.65 -2.92 0.00 0.00 -0.75 0.00 0.00 64.21 61.19 1uwe n SER 50 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1uwe n THR 51 N -4.43 0.00 -0.84 2.46 -1.04 0.48 -4.20 114.28 106.71 1uwe n THR 51 Ca 0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 1uwe n THR 51 Cb 0.52 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.03 1uwe n THR 51 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1uwe n SER 52 N 2.98 0.19 -4.83 8.00 3.41 -1.12 -3.55 113.62 118.70 1uwe n SER 52 Ca 0.00 -1.03 -0.37 0.00 -0.26 0.00 0.00 58.87 57.20 1uwe n SER 52 Cb 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 1uwe n SER 52 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1uwe s TYR 53 N -0.03 3.72 -0.11 7.33 2.02 -0.55 -4.58 117.35 125.14 1uwe s TYR 53 Ca 0.00 1.10 -0.04 0.00 -0.37 0.00 0.00 57.07 57.76 1uwe s TYR 53 Cb 0.00 -2.38 -0.04 0.00 -0.40 0.00 0.00 41.96 39.15 1uwe s TYR 53 CO 0.00 0.56 0.04 1.03 -1.57 0.00 0.00 175.55 175.61 1uwe s ARG 54 N -1.37 3.30 0.74 -0.62 0.52 -1.26 -0.81 118.95 119.45 1uwe s ARG 54 Ca 0.30 -0.35 -0.13 0.00 -0.52 0.00 0.00 55.73 55.03 1uwe s ARG 54 Cb -0.17 -2.95 0.04 0.00 0.52 0.00 0.00 34.95 32.39 1uwe s ARG 54 CO 0.17 0.61 1.12 0.71 0.02 0.00 0.00 175.30 177.93 1uwe s TYR 55 N -0.60 2.42 0.54 -0.53 2.02 -0.81 -4.95 117.35 115.44 1uwe s TYR 55 Ca 0.10 1.59 -0.22 0.00 -0.37 0.00 0.00 57.07 58.17 1uwe s TYR 55 Cb -0.12 -3.18 -0.05 0.00 -0.40 0.00 0.00 41.96 38.21 1uwe s TYR 55 CO 0.02 -1.97 1.37 -1.13 -1.57 0.00 0.00 175.55 172.27 1uwe n SER 56 N -3.11 2.77 -0.24 2.29 3.41 -1.26 -2.09 113.62 115.40 1uwe n SER 56 Ca 0.10 0.99 -0.03 0.00 -0.26 0.00 0.00 58.87 59.68 1uwe n SER 56 Cb 0.52 -1.58 -0.01 0.00 -0.26 0.00 0.00 64.21 62.88 1uwe n SER 56 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1uwe n GLY 57 N 0.73 0.62 3.49 5.00 0.00 -1.26 -5.02 105.19 108.75 1uwe n GLY 57 Ca 0.10 -0.50 -0.36 0.00 0.00 0.00 0.00 46.02 45.25 1uwe n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uwe s VAL 58 N -2.02 4.39 0.47 1.61 1.01 -0.89 -5.08 120.40 119.90 1uwe s VAL 58 Ca 0.00 -0.15 -0.24 0.00 0.00 0.00 0.00 61.98 61.59 1uwe s VAL 58 Cb 0.00 -3.03 -0.08 0.00 0.00 0.00 0.00 36.38 33.27 1uwe s VAL 58 CO 0.00 0.37 1.37 -2.65 0.00 0.00 0.00 175.10 174.18 1uwe n PRO 59 N 4.58 2.00 0.00 2.72 -0.02 -1.26 -4.87 135.00 138.15 1uwe n PRO 59 Ca -0.16 0.72 0.03 0.00 -2.02 0.00 0.00 63.50 62.07 1uwe n PRO 59 Cb 0.52 -2.55 0.20 0.00 -0.02 0.00 0.00 33.50 31.64 1uwe n PRO 59 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1uwe n ASP 60 N -0.32 0.00 0.00 2.55 5.68 -1.26 -2.29 116.55 120.91 1uwe n ASP 60 Ca 0.07 -1.61 0.14 0.00 -0.50 0.00 0.00 54.79 52.89 1uwe n ASP 60 Cb 0.42 0.00 0.74 0.00 -1.14 0.00 0.00 41.12 41.14 1uwe n ASP 60 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 1uwe n ARG 61 N -0.61 0.49 -3.66 0.11 1.85 -1.26 -4.61 116.66 108.97 1uwe n ARG 61 Ca 0.05 0.02 -0.38 0.00 -1.00 0.00 0.00 57.85 56.54 1uwe n ARG 61 Cb 0.02 -1.50 -0.12 0.00 -1.05 0.00 0.00 32.46 29.82 1uwe n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1uwe s PHE 62 N -2.47 3.16 0.04 2.89 0.08 -0.97 -0.48 117.98 120.23 1uwe s PHE 62 Ca 0.30 -0.36 0.04 0.00 0.12 0.00 0.00 56.93 57.02 1uwe s PHE 62 Cb 0.19 -2.34 -0.02 0.00 -0.57 0.00 0.00 43.02 40.28 1uwe s PHE 62 CO 0.42 -0.36 -0.11 0.95 -0.10 0.00 0.00 175.22 176.02 1uwe s THR 63 N 1.65 0.82 0.10 0.64 -4.23 -0.63 -4.98 115.64 109.02 1uwe s THR 63 Ca 0.06 -0.97 0.09 0.00 -1.18 0.00 0.00 61.69 59.69 1uwe s THR 63 Cb -0.16 -0.79 -0.04 0.00 1.34 0.00 0.00 72.50 72.85 1uwe s THR 63 CO 0.07 -0.14 -0.19 -0.83 -0.54 0.00 0.00 174.62 172.98 1uwe s GLY 64 N -1.24 1.64 0.30 3.99 0.00 -1.26 -0.74 107.32 110.01 1uwe s GLY 64 Ca -0.03 -1.32 -0.04 0.00 0.00 0.00 0.00 44.72 43.33 1uwe s GLY 64 CO 0.01 -1.27 0.43 -1.35 0.00 0.00 0.00 173.10 170.91 1uwe s SER 65 N -1.91 0.61 0.00 1.64 1.04 -0.68 -4.23 113.70 110.16 1uwe s SER 65 Ca 0.16 -1.35 0.00 0.00 0.48 0.00 0.00 55.95 55.24 1uwe s SER 65 Cb -0.10 0.61 0.00 0.00 0.10 0.00 0.00 66.02 66.62 1uwe s SER 65 CO 0.08 -1.20 0.00 0.61 0.98 0.00 0.00 173.24 173.71 1uwe n GLY 66 N -0.49 0.65 3.65 7.32 0.00 -1.26 -1.88 105.19 113.17 1uwe n GLY 66 Ca 0.01 -2.31 -0.03 0.00 0.00 0.00 0.00 46.02 43.69 1uwe n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uwe s SER 67 N -1.45 -0.20 0.00 1.61 1.04 -0.91 -4.98 113.70 108.81 1uwe s SER 67 Ca 0.00 0.35 0.00 0.00 0.48 0.00 0.00 55.95 56.78 1uwe s SER 67 Cb 0.00 0.65 0.00 0.00 0.10 0.00 0.00 66.02 66.77 1uwe s SER 67 CO 0.00 -0.06 0.00 0.61 0.98 0.00 0.00 173.24 174.77 1uwe n GLY 68 N 2.41 2.22 0.00 7.32 0.00 0.27 -3.35 105.19 114.06 1uwe n GLY 68 Ca -0.14 0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1uwe n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1uwe n THR 69 N 0.00 0.00 -4.00 2.61 -2.24 -1.26 0.10 114.28 109.49 1uwe n THR 69 Ca 0.00 -0.16 -0.35 0.00 -2.27 0.00 0.00 64.05 61.28 1uwe n THR 69 Cb 0.00 0.64 -0.14 0.00 -2.10 0.00 0.00 70.33 68.73 1uwe n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1uwe s ASP 70 N -1.17 4.24 0.08 3.42 1.01 -1.21 -0.79 116.67 122.25 1uwe s ASP 70 Ca 0.00 -0.39 0.06 0.00 0.71 0.00 0.00 52.55 52.93 1uwe s ASP 70 Cb 0.00 -1.72 -0.03 0.00 1.01 0.00 0.00 42.92 42.18 1uwe s ASP 70 CO 0.00 0.00 -0.15 -0.36 0.21 0.00 0.00 175.17 174.87 1uwe s PHE 71 N 1.35 1.35 -0.03 4.23 0.08 0.83 -2.14 117.98 123.66 1uwe s PHE 71 Ca 0.04 -0.47 -0.04 0.00 0.12 0.00 0.00 56.93 56.59 1uwe s PHE 71 Cb -0.14 -0.75 0.01 0.00 -0.57 0.00 0.00 43.02 41.57 1uwe s PHE 71 CO -0.03 0.10 0.09 0.99 -0.10 0.00 0.00 175.22 176.27 1uwe s THR 72 N -1.39 0.01 -0.22 0.64 2.01 -0.79 -0.51 115.64 115.40 1uwe s THR 72 Ca 0.01 -0.11 -0.00 0.00 0.31 0.00 0.00 61.69 61.90 1uwe s THR 72 Cb -0.09 -0.17 0.02 0.00 0.01 0.00 0.00 72.50 72.27 1uwe s THR 72 CO 0.03 -0.06 -0.12 -0.22 -0.69 0.00 0.00 174.62 173.56 1uwe s LEU 73 N -0.15 2.76 -0.11 4.42 2.96 0.39 -1.69 118.68 127.26 1uwe s LEU 73 Ca -0.02 -0.80 -0.09 0.00 -0.22 0.00 0.00 54.13 53.00 1uwe s LEU 73 Cb -0.02 -1.58 -0.04 0.00 0.50 0.00 0.00 46.19 45.05 1uwe s LEU 73 CO 0.00 -0.07 0.19 -0.89 -1.32 0.00 0.00 176.35 174.26 1uwe s THR 74 N 1.30 5.41 -0.20 3.68 2.01 0.08 -0.93 115.64 126.99 1uwe s THR 74 Ca 0.02 0.33 0.01 0.00 0.31 0.00 0.00 61.69 62.36 1uwe s THR 74 Cb -0.15 -3.47 0.03 0.00 0.01 0.00 0.00 72.50 68.92 1uwe s THR 74 CO -0.08 0.59 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.64 1uwe s ILE 75 N -0.84 2.01 0.18 1.82 1.01 -0.32 -1.60 121.20 123.46 1uwe s ILE 75 Ca 0.16 -1.09 -0.00 0.00 0.00 0.00 0.00 60.65 59.72 1uwe s ILE 75 Cb -0.13 -1.92 -0.04 0.00 0.01 0.00 0.00 42.46 40.39 1uwe s ILE 75 CO 0.05 0.36 0.36 -0.44 0.00 0.00 0.00 174.94 175.27 1uwe s SER 76 N 1.27 6.38 -1.46 3.58 0.01 0.37 -1.21 113.70 122.64 1uwe s SER 76 Ca 0.01 0.37 -0.03 0.00 1.31 0.00 0.00 55.95 57.61 1uwe s SER 76 Cb -0.15 -2.00 0.03 0.00 0.21 0.00 0.00 66.02 64.11 1uwe s SER 76 CO -0.10 -0.00 0.49 -3.20 0.41 0.00 0.00 173.24 170.83 1uwe n ASN 77 N -0.51 -0.89 -4.54 2.44 4.05 -1.04 -4.75 115.26 110.02 1uwe n ASN 77 Ca -0.05 -1.00 -0.58 0.00 0.45 0.00 0.00 54.58 53.40 1uwe n ASN 77 Cb 0.53 -3.02 -0.08 0.00 1.23 0.00 0.00 39.78 38.45 1uwe n ASN 77 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 177.26 174.73 1uwe n VAL 78 N -4.41 0.01 -4.22 3.44 0.31 -0.35 -4.48 118.33 108.62 1uwe n VAL 78 Ca -0.24 -0.00 -0.23 0.00 -0.01 0.00 0.00 64.34 63.86 1uwe n VAL 78 Cb 0.65 -0.22 -0.06 0.00 -0.91 0.00 0.00 33.84 33.30 1uwe n VAL 78 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 1uwe s ASN 79 N 0.38 4.93 0.43 4.52 0.01 -1.26 -0.15 114.94 123.80 1uwe s ASN 79 Ca 0.91 -0.47 0.12 0.00 -0.71 0.00 0.00 52.86 52.70 1uwe s ASN 79 Cb -1.22 -1.07 0.95 0.00 0.41 0.00 0.00 41.25 40.32 1uwe s ASN 79 CO 0.57 -0.00 2.00 0.77 -1.51 0.00 0.00 177.10 178.93 1uwe h SER 80 N 1.83 0.15 0.18 -1.22 4.64 -1.92 -0.34 113.55 116.88 1uwe h SER 80 Ca -0.46 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1uwe h SER 80 Cb 1.24 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1uwe h SER 80 CO 0.60 0.24 0.00 -0.62 -0.87 0.00 0.00 176.83 176.19 1uwe n GLU 81 N -4.37 0.05 0.00 4.77 -0.58 -1.15 -2.42 120.64 116.94 1uwe n GLU 81 Ca -0.01 0.30 0.14 0.00 -0.42 0.00 0.00 57.16 57.17 1uwe n GLU 81 Cb 0.20 -1.50 0.59 0.00 -0.57 0.00 0.00 31.44 30.16 1uwe n GLU 81 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1uwe n ASP 82 N -1.39 0.60 -4.68 1.62 8.00 -0.14 -4.84 116.55 115.73 1uwe n ASP 82 Ca 0.02 -0.72 -0.42 0.00 0.71 0.00 0.00 54.79 54.39 1uwe n ASP 82 Cb 0.07 -0.04 -0.03 0.00 -0.02 0.00 0.00 41.12 41.10 1uwe n ASP 82 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1uwe s LEU 83 N -2.41 4.38 0.00 0.64 2.96 -1.02 -4.87 118.68 118.37 1uwe s LEU 83 Ca 0.30 2.58 0.00 0.00 -0.22 0.00 0.00 54.13 56.79 1uwe s LEU 83 Cb 0.20 -3.56 0.00 0.00 0.50 0.00 0.00 46.19 43.33 1uwe s LEU 83 CO 0.46 -0.95 0.00 0.00 -1.32 0.00 0.00 176.35 174.54 1uwe n ALA 84 N 5.98 0.00 -2.73 5.97 0.00 -1.23 -4.68 120.51 123.82 1uwe n ALA 84 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.26 1uwe n ALA 84 Cb 0.40 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.77 1uwe n ALA 84 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1uwe s GLU 85 N -2.00 4.19 -0.11 0.00 2.56 -0.36 -1.13 118.70 121.84 1uwe s GLU 85 Ca 0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 54.97 54.79 1uwe s GLU 85 Cb 0.00 -3.42 -0.03 0.00 2.00 0.00 0.00 34.13 32.69 1uwe s GLU 85 CO 0.00 0.30 -0.06 0.71 -0.56 0.00 0.00 175.26 175.64 1uwe s TYR 86 N 0.36 2.96 -0.06 5.30 2.02 0.13 -0.10 117.35 127.96 1uwe s TYR 86 Ca 0.10 -0.21 0.04 0.00 -0.37 0.00 0.00 57.07 56.63 1uwe s TYR 86 Cb -0.11 -1.83 -0.00 0.00 -0.40 0.00 0.00 41.96 39.61 1uwe s TYR 86 CO -0.01 0.10 -0.20 -0.06 -1.57 0.00 0.00 175.55 173.82 1uwe s PHE 87 N -0.16 1.99 0.39 2.71 0.08 -0.54 -0.06 117.98 122.39 1uwe s PHE 87 Ca 0.02 -0.64 -0.04 0.00 0.12 0.00 0.00 56.93 56.39 1uwe s PHE 87 Cb -0.13 -1.34 -0.04 0.00 -0.57 0.00 0.00 43.02 40.94 1uwe s PHE 87 CO 0.03 -0.23 0.65 0.00 -0.10 0.00 0.00 175.22 175.57 1uwe s GLN 89 N -4.28 0.42 -0.06 0.00 0.74 0.60 -0.58 119.66 116.50 1uwe s GLN 89 Ca 0.44 0.15 0.03 0.00 0.05 0.00 0.00 55.36 56.03 1uwe s GLN 89 Cb -0.10 0.19 -0.02 0.00 1.10 0.00 0.00 33.01 34.18 1uwe s GLN 89 CO 0.38 -0.08 -0.15 -1.14 -0.55 0.00 0.00 175.29 173.75 1uwe s GLN 90 N -0.40 2.66 -0.02 1.67 -0.44 -0.59 0.02 119.66 122.57 1uwe s GLN 90 Ca -0.05 -0.71 0.16 0.00 -2.50 0.00 0.00 55.36 52.26 1uwe s GLN 90 Cb -0.03 -2.41 0.28 0.00 -1.64 0.00 0.00 33.01 29.21 1uwe s GLN 90 CO 0.01 0.53 1.12 2.48 0.50 0.00 0.00 175.29 179.93 1uwe n TYR 91 N 2.58 0.00 0.30 1.67 4.11 -0.46 -2.59 117.16 122.77 1uwe n TYR 91 Ca -0.17 -0.44 -0.12 0.00 -0.00 0.00 0.00 57.90 57.17 1uwe n TYR 91 Cb 0.52 -0.13 -0.06 0.00 -0.00 0.00 0.00 39.34 39.68 1uwe n TYR 91 CO 0.00 0.00 0.00 -0.97 -0.00 0.00 0.00 176.86 175.89 1uwe h ASN 92 N 0.63 -0.67 -3.81 9.48 -1.24 -1.83 -3.45 115.58 114.69 1uwe h ASN 92 Ca -0.13 0.02 -0.68 0.00 0.71 0.00 0.00 56.30 56.23 1uwe h ASN 92 Cb 1.62 0.17 -0.20 0.00 0.73 0.00 0.00 38.32 40.65 1uwe h ASN 92 CO 0.05 -0.31 -0.81 -0.63 -1.29 0.00 0.00 177.43 174.45 1uwe s ILE 93 N -4.18 2.78 0.33 2.57 -1.09 -1.26 -5.12 121.20 115.22 1uwe s ILE 93 Ca -0.12 -1.45 -0.19 0.00 -2.23 0.00 0.00 60.65 56.67 1uwe s ILE 93 Cb 0.01 -2.24 -0.09 0.00 -1.58 0.00 0.00 42.46 38.55 1uwe s ILE 93 CO 0.35 0.16 0.82 -0.31 -1.23 0.00 0.00 174.94 174.72 1uwe s TYR 94 N -1.08 3.45 0.50 3.97 2.02 -1.26 -4.06 117.35 120.90 1uwe s TYR 94 Ca 0.17 1.43 -0.17 0.00 -0.37 0.00 0.00 57.07 58.12 1uwe s TYR 94 Cb -0.10 -2.68 -0.08 0.00 -0.40 0.00 0.00 41.96 38.69 1uwe s TYR 94 CO 0.09 0.11 0.99 -1.25 -1.57 0.00 0.00 175.55 173.91 1uwe s PRO 95 N -2.71 3.94 0.36 -1.71 0.04 -1.26 -5.01 135.00 128.65 1uwe s PRO 95 Ca 0.53 1.03 -0.28 0.00 0.04 0.00 0.00 61.00 62.32 1uwe s PRO 95 Cb -0.12 -2.13 -0.11 0.00 0.04 0.00 0.00 34.50 32.18 1uwe s PRO 95 CO 0.18 -0.28 1.47 0.08 0.04 0.00 0.00 177.00 178.49 1uwe s VAL 96 N -2.50 2.17 0.04 -0.36 1.01 -1.26 -4.87 120.40 114.64 1uwe s VAL 96 Ca 0.60 0.17 0.04 0.00 0.00 0.00 0.00 61.98 62.79 1uwe s VAL 96 Cb -0.11 -3.11 -0.02 0.00 0.00 0.00 0.00 36.38 33.14 1uwe s VAL 96 CO 0.28 0.04 -0.12 0.42 0.00 0.00 0.00 175.10 175.72 1uwe s THR 97 N -0.98 0.91 0.12 3.92 -4.23 -1.07 -5.01 115.64 109.30 1uwe s THR 97 Ca 0.53 -1.00 0.07 0.00 -1.18 0.00 0.00 61.69 60.11 1uwe s THR 97 Cb -0.45 -0.86 -0.04 0.00 1.34 0.00 0.00 72.50 72.48 1uwe s THR 97 CO 0.60 -0.12 -0.05 -0.36 -0.54 0.00 0.00 174.62 174.14 1uwe s PHE 98 N -0.99 2.82 0.82 3.99 0.08 -1.26 -1.54 117.98 121.90 1uwe s PHE 98 Ca -0.02 -0.12 -0.12 0.00 0.12 0.00 0.00 56.93 56.79 1uwe s PHE 98 Cb -0.08 -1.44 0.08 0.00 -0.57 0.00 0.00 43.02 41.01 1uwe s PHE 98 CO 0.01 0.47 1.11 0.20 -0.10 0.00 0.00 175.22 176.90 1uwe s GLY 99 N -2.43 1.61 0.43 4.36 0.00 0.26 -4.57 107.32 106.97 1uwe s GLY 99 Ca 0.24 -0.29 0.30 0.00 0.00 0.00 0.00 44.72 44.97 1uwe s GLY 99 CO 0.16 0.17 1.90 -1.33 0.00 0.00 0.00 173.10 173.99 1uwe h GLY 100 N -1.16 0.00 0.00 0.20 0.00 -1.89 -3.43 103.07 96.79 1uwe h GLY 100 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 1uwe h GLY 100 CO 0.60 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.75 1uwe n GLY 101 N -0.48 2.49 2.95 4.60 0.00 -1.26 -5.06 105.19 108.43 1uwe n GLY 101 Ca -0.00 -1.82 -0.21 0.00 0.00 0.00 0.00 46.02 43.99 1uwe n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1uwe s THR 102 N -2.41 0.74 -0.31 2.61 2.01 0.91 -4.57 115.64 114.62 1uwe s THR 102 Ca 0.00 -0.26 -0.14 0.00 0.31 0.00 0.00 61.69 61.60 1uwe s THR 102 Cb 0.00 -0.71 -0.02 0.00 0.01 0.00 0.00 72.50 71.77 1uwe s THR 102 CO 0.00 0.26 0.34 -0.75 -0.69 0.00 0.00 174.62 173.78 1uwe s LYS 103 N 0.72 3.75 -0.24 4.92 2.20 0.17 0.21 119.74 131.48 1uwe s LYS 103 Ca -0.11 -0.27 -0.17 0.00 -0.36 0.00 0.00 55.97 55.05 1uwe s LYS 103 Cb -0.14 -3.74 -0.03 0.00 -1.51 0.00 0.00 37.83 32.41 1uwe s LYS 103 CO 0.01 -0.40 0.49 -1.17 -0.36 0.00 0.00 175.35 173.92 1uwe s LEU 104 N 1.99 4.08 -0.05 5.43 2.96 -0.28 -0.73 118.68 132.08 1uwe s LEU 104 Ca 0.12 0.53 0.04 0.00 -0.22 0.00 0.00 54.13 54.60 1uwe s LEU 104 Cb -0.16 -2.63 -0.03 0.00 0.50 0.00 0.00 46.19 43.87 1uwe s LEU 104 CO 0.11 -0.23 -0.15 -1.61 -1.32 0.00 0.00 176.35 173.16 1uwe s GLU 105 N 2.02 2.49 -0.23 1.98 2.02 0.12 -3.47 118.70 123.63 1uwe s GLU 105 Ca 0.21 -0.70 -0.13 0.00 0.02 0.00 0.00 54.97 54.37 1uwe s GLU 105 Cb -0.15 -2.37 -0.04 0.00 0.10 0.00 0.00 34.13 31.66 1uwe s GLU 105 CO 0.09 0.62 0.28 0.42 0.02 0.00 0.00 175.26 176.69 1uwe s ILE 106 N -0.73 5.28 0.04 -1.63 -1.09 -1.26 -0.57 121.20 121.24 1uwe s ILE 106 Ca 0.11 0.42 -0.25 0.00 -2.23 0.00 0.00 60.65 58.71 1uwe s ILE 106 Cb -0.11 -3.61 -0.05 0.00 -1.58 0.00 0.00 42.46 37.11 1uwe s ILE 106 CO 0.00 0.29 0.76 -0.54 -1.23 0.00 0.00 174.94 174.22 1uwe s LYS 107 N 1.28 4.49 0.33 2.79 1.02 0.85 -4.91 119.74 125.59 1uwe s LYS 107 Ca 0.13 1.05 0.04 0.00 0.02 0.00 0.00 55.97 57.21 1uwe s LYS 107 Cb -0.14 -3.37 -0.02 0.00 -0.52 0.00 0.00 37.83 33.78 1uwe s LYS 107 CO 0.07 0.28 0.33 -0.98 -0.92 0.00 0.00 175.35 174.13 1uwe s ARG 108 N -0.03 1.79 0.54 1.68 1.70 -1.26 -4.32 118.95 119.05 1uwe s ARG 108 Ca 0.38 -1.94 -0.19 0.00 -0.47 0.00 0.00 55.73 53.51 1uwe s ARG 108 Cb -0.20 0.36 -0.06 0.00 -0.57 0.00 0.00 34.95 34.47 1uwe s ARG 108 CO 0.23 -0.69 1.09 0.95 -1.08 0.00 0.00 175.30 175.80 1uwe s THR 109 N -3.34 3.43 0.31 4.99 -4.23 -1.26 -4.96 115.64 110.57 1uwe s THR 109 Ca 0.38 0.85 -0.26 0.00 -1.18 0.00 0.00 61.69 61.48 1uwe s THR 109 Cb 0.02 -3.33 -0.15 0.00 1.34 0.00 0.00 72.50 70.38 1uwe s THR 109 CO 0.25 -0.23 0.66 1.33 -0.54 0.00 0.00 174.62 176.09 1uwe n VAL 110 N -1.34 1.85 -3.72 2.29 0.24 -1.26 -4.73 118.33 111.65 1uwe n VAL 110 Ca 0.11 -0.50 -0.15 0.00 -2.04 0.00 0.00 64.34 61.76 1uwe n VAL 110 Cb 0.52 -0.48 -0.15 0.00 -1.47 0.00 0.00 33.84 32.25 1uwe n VAL 110 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1uwe s ALA 111 N -1.20 -0.20 0.33 2.33 0.00 0.39 -4.88 121.76 118.53 1uwe s ALA 111 Ca 0.62 0.61 -0.27 0.00 0.00 0.00 0.00 51.96 52.92 1uwe s ALA 111 Cb -0.74 -0.55 -0.09 0.00 0.00 0.00 0.00 23.12 21.74 1uwe s ALA 111 CO 0.58 -0.27 1.02 0.00 0.00 0.00 0.00 175.76 177.08 1uwe s ALA 112 N 1.50 3.23 0.48 0.00 0.00 -1.26 -1.10 121.76 124.62 1uwe s ALA 112 Ca -0.05 0.68 -0.21 0.00 0.00 0.00 0.00 51.96 52.38 1uwe s ALA 112 Cb -0.12 -3.25 -0.07 0.00 0.00 0.00 0.00 23.12 19.68 1uwe s ALA 112 CO -0.06 -0.03 1.10 -1.25 0.00 0.00 0.00 175.76 175.53 1uwe s PRO 113 N -1.96 3.70 -0.10 0.00 0.04 -1.26 -4.57 135.00 130.84 1uwe s PRO 113 Ca 0.50 1.57 -0.18 0.00 0.04 0.00 0.00 61.00 62.94 1uwe s PRO 113 Cb -0.24 -2.21 -0.04 0.00 0.04 0.00 0.00 34.50 32.05 1uwe s PRO 113 CO 0.30 -0.56 0.47 -1.12 0.04 0.00 0.00 177.00 176.13 1uwe s SER 114 N -1.69 6.70 -0.16 6.66 0.01 -0.65 -4.83 113.70 119.74 1uwe s SER 114 Ca 0.67 0.84 -0.04 0.00 1.31 0.00 0.00 55.95 58.72 1uwe s SER 114 Cb -0.23 -2.28 -0.03 0.00 0.21 0.00 0.00 66.02 63.69 1uwe s SER 114 CO 0.27 0.05 -0.02 -0.69 0.41 0.00 0.00 173.24 173.26 1uwe s VAL 115 N 0.37 4.08 0.06 3.43 1.01 -1.26 -0.22 120.40 127.87 1uwe s VAL 115 Ca 0.25 -0.29 0.04 0.00 0.00 0.00 0.00 61.98 61.98 1uwe s VAL 115 Cb -0.15 -2.80 -0.03 0.00 0.00 0.00 0.00 36.38 33.40 1uwe s VAL 115 CO 0.11 0.49 -0.12 -0.36 0.00 0.00 0.00 175.10 175.22 1uwe s PHE 116 N 0.34 1.03 -0.01 5.22 0.08 -0.08 -4.98 117.98 119.57 1uwe s PHE 116 Ca -0.03 -0.47 0.04 0.00 0.12 0.00 0.00 56.93 56.60 1uwe s PHE 116 Cb -0.14 -0.59 -0.01 0.00 -0.57 0.00 0.00 43.02 41.71 1uwe s PHE 116 CO 0.02 0.01 -0.14 -1.50 -0.10 0.00 0.00 175.22 173.51 1uwe s ILE 117 N -1.28 1.10 -0.13 0.64 2.07 -1.26 0.11 121.20 122.45 1uwe s ILE 117 Ca -0.04 -0.62 0.00 0.00 -1.41 0.00 0.00 60.65 58.58 1uwe s ILE 117 Cb -0.10 -0.92 0.02 0.00 0.13 0.00 0.00 42.46 41.59 1uwe s ILE 117 CO 0.02 0.30 -0.13 -0.36 -1.91 0.00 0.00 174.94 172.86 1uwe s PHE 118 N -0.36 1.93 0.84 3.50 0.40 0.09 -5.01 117.98 119.38 1uwe s PHE 118 Ca 0.05 -1.02 -0.11 0.00 -0.60 0.00 0.00 56.93 55.25 1uwe s PHE 118 Cb -0.06 -1.46 0.10 0.00 0.51 0.00 0.00 43.02 42.11 1uwe s PHE 118 CO -0.00 -0.59 1.10 -2.14 0.70 0.00 0.00 175.22 174.29 1uwe s PRO 119 N 1.44 1.71 0.19 0.24 0.02 -1.26 -2.04 135.00 135.29 1uwe s PRO 119 Ca 0.02 1.13 -0.32 0.00 0.02 0.00 0.00 61.00 61.86 1uwe s PRO 119 Cb -0.13 -1.84 -0.11 0.00 0.02 0.00 0.00 34.50 32.44 1uwe s PRO 119 CO -0.08 -2.02 1.62 -1.25 -0.33 0.00 0.00 177.00 174.94 1uwe s PRO 120 N -4.86 4.18 0.81 5.54 0.04 -1.20 -4.84 135.00 134.66 1uwe s PRO 120 Ca 0.63 2.46 -0.13 0.00 0.04 0.00 0.00 61.00 64.00 1uwe s PRO 120 Cb -0.18 -3.11 0.08 0.00 0.04 0.00 0.00 34.50 31.32 1uwe s PRO 120 CO 0.57 -0.65 1.19 -1.54 0.04 0.00 0.00 177.00 176.60 1uwe s SER 121 N 1.08 3.66 0.35 6.66 1.04 -1.26 -4.88 113.70 120.35 1uwe s SER 121 Ca 0.71 2.31 0.09 0.00 0.48 0.00 0.00 55.95 59.53 1uwe s SER 121 Cb -0.46 -2.58 0.64 0.00 0.10 0.00 0.00 66.02 63.72 1uwe s SER 121 CO 0.33 -2.62 1.81 0.00 0.98 0.00 0.00 173.24 173.75 1uwe h ALA 122 N -0.94 1.33 -0.25 5.32 0.00 -2.00 -2.78 119.26 119.94 1uwe h ALA 122 Ca -0.46 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.07 1uwe h ALA 122 Cb 1.29 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1uwe h ALA 122 CO 0.46 0.47 -0.14 0.93 0.00 0.00 0.00 179.25 180.97 1uwe h GLU 123 N 0.18 0.43 -0.19 0.00 5.08 -2.00 -2.42 114.58 115.66 1uwe h GLU 123 Ca 0.03 -0.12 -0.19 0.00 -1.00 0.00 0.00 59.36 58.07 1uwe h GLU 123 Cb 0.60 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.81 1uwe h GLU 123 CO 0.04 0.57 -0.63 0.37 -1.00 0.00 0.00 179.01 178.37 1uwe h GLN 124 N 0.40 0.77 -0.59 2.33 4.15 -1.83 -3.20 115.11 117.14 1uwe h GLN 124 Ca 0.07 -0.57 0.04 0.00 0.77 0.00 0.00 58.65 58.97 1uwe h GLN 124 Cb 0.49 0.10 -0.03 0.00 0.21 0.00 0.00 27.48 28.25 1uwe h GLN 124 CO 0.03 1.19 0.39 -0.07 -1.93 0.00 0.00 178.83 178.44 1uwe h LEU 125 N 0.50 0.56 -0.29 -2.39 3.38 -1.20 0.20 115.31 116.06 1uwe h LEU 125 Ca -0.02 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1uwe h LEU 125 Cb 1.25 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1uwe h LEU 125 CO 0.13 0.38 0.00 0.00 0.09 0.00 0.00 178.44 179.04 1uwe n ALA 126 N -2.47 1.78 0.62 1.53 0.00 -0.95 -2.41 120.51 118.61 1uwe n ALA 126 Ca 0.08 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.64 1uwe n ALA 126 Cb 0.18 -1.34 0.18 0.00 0.00 0.00 0.00 19.45 18.47 1uwe n ALA 126 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1uwe n SER 127 N -1.88 0.67 0.00 0.00 3.41 0.69 -4.97 113.62 111.55 1uwe n SER 127 Ca 0.03 0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.74 1uwe n SER 127 Cb 0.23 0.16 0.00 0.00 -0.26 0.00 0.00 64.21 64.34 1uwe n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1uwe n GLY 128 N 1.35 1.71 3.53 5.00 0.00 -1.01 -5.09 105.19 110.68 1uwe n GLY 128 Ca 0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 1uwe n GLY 128 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1uwe s THR 129 N -2.21 2.15 -0.07 2.61 -4.23 -1.24 -1.40 115.64 111.25 1uwe s THR 129 Ca 0.00 -2.20 -0.03 0.00 -1.18 0.00 0.00 61.69 58.29 1uwe s THR 129 Cb 0.00 -2.61 0.04 0.00 1.34 0.00 0.00 72.50 71.27 1uwe s THR 129 CO 0.00 -0.22 0.14 0.00 -0.54 0.00 0.00 174.62 174.00 1uwe s ALA 130 N -2.67 -0.15 -0.21 3.99 0.00 -0.52 -3.56 121.76 118.64 1uwe s ALA 130 Ca 0.32 0.56 -0.02 0.00 0.00 0.00 0.00 51.96 52.82 1uwe s ALA 130 Cb 0.03 -0.64 0.01 0.00 0.00 0.00 0.00 23.12 22.51 1uwe s ALA 130 CO 0.16 -0.39 -0.11 -1.12 0.00 0.00 0.00 175.76 174.31 1uwe s SER 131 N 1.81 3.83 -0.22 0.00 0.01 -1.26 -1.49 113.70 116.38 1uwe s SER 131 Ca -0.02 -0.53 -0.12 0.00 1.31 0.00 0.00 55.95 56.60 1uwe s SER 131 Cb -0.12 -1.63 -0.05 0.00 0.21 0.00 0.00 66.02 64.43 1uwe s SER 131 CO -0.05 -0.02 0.21 -0.69 0.41 0.00 0.00 173.24 173.09 1uwe s VAL 132 N 1.39 5.34 -0.10 3.43 1.01 0.46 -3.26 120.40 128.67 1uwe s VAL 132 Ca 0.05 0.31 0.01 0.00 0.00 0.00 0.00 61.98 62.35 1uwe s VAL 132 Cb -0.14 -3.55 -0.02 0.00 0.00 0.00 0.00 36.38 32.68 1uwe s VAL 132 CO -0.07 0.35 -0.13 -0.69 0.00 0.00 0.00 175.10 174.55 1uwe s VAL 133 N 0.91 3.06 -0.14 2.92 1.01 -0.87 -0.04 120.40 127.26 1uwe s VAL 133 Ca 0.10 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 61.40 1uwe s VAL 133 Cb -0.13 -2.25 -0.01 0.00 0.00 0.00 0.00 36.38 33.98 1uwe s VAL 133 CO 0.04 0.55 -0.14 0.00 0.00 0.00 0.00 175.10 175.55 1uwe s LEU 135 N 0.55 2.46 -0.30 0.00 2.96 0.12 0.34 118.68 124.81 1uwe s LEU 135 Ca -0.09 -0.51 -0.09 0.00 -0.22 0.00 0.00 54.13 53.22 1uwe s LEU 135 Cb -0.16 -1.58 -0.01 0.00 0.50 0.00 0.00 46.19 44.94 1uwe s LEU 135 CO 0.04 0.03 0.14 -0.76 -1.32 0.00 0.00 176.35 174.47 1uwe s LEU 136 N 1.17 4.03 -0.11 -0.68 1.02 0.15 -0.91 118.68 123.34 1uwe s LEU 136 Ca 0.01 -0.51 -0.01 0.00 0.02 0.00 0.00 54.13 53.65 1uwe s LEU 136 Cb -0.14 -1.99 -0.02 0.00 0.02 0.00 0.00 46.19 44.06 1uwe s LEU 136 CO -0.06 -0.18 -0.09 0.21 0.02 0.00 0.00 176.35 176.26 1uwe s ASN 137 N 1.60 4.42 -1.12 2.29 3.04 0.69 -0.06 114.94 125.81 1uwe s ASN 137 Ca 0.05 -0.17 -0.15 0.00 0.04 0.00 0.00 52.86 52.63 1uwe s ASN 137 Cb -0.17 -1.45 -0.03 0.00 -1.54 0.00 0.00 41.25 38.06 1uwe s ASN 137 CO 0.06 0.24 0.83 0.59 -3.04 0.00 0.00 177.10 175.78 1uwe n ASN 138 N 3.02 -5.44 -4.61 -4.21 3.02 -0.53 -1.64 115.26 104.87 1uwe n ASN 138 Ca -0.18 -0.91 -0.25 0.00 -0.03 0.00 0.00 54.58 53.21 1uwe n ASN 138 Cb 0.53 -4.01 -0.09 0.00 -0.61 0.00 0.00 39.78 35.59 1uwe n ASN 138 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 1uwe s PHE 139 N -3.46 2.51 -0.20 3.10 -0.71 -0.18 -4.60 117.98 114.44 1uwe s PHE 139 Ca 0.44 -0.50 -0.18 0.00 -1.04 0.00 0.00 56.93 55.64 1uwe s PHE 139 Cb -0.12 -1.54 0.05 0.00 -1.21 0.00 0.00 43.02 40.20 1uwe s PHE 139 CO 0.82 0.48 0.54 -0.47 -1.34 0.00 0.00 175.22 175.25 1uwe s TYR 140 N -2.58 -0.61 0.00 3.49 6.14 -0.26 -0.30 117.35 123.24 1uwe s TYR 140 Ca 0.35 1.47 0.00 0.00 0.64 0.00 0.00 57.07 59.53 1uwe s TYR 140 Cb 0.02 0.22 0.00 0.00 0.42 0.00 0.00 41.96 42.62 1uwe s TYR 140 CO 0.19 -0.30 0.00 -0.35 0.64 0.00 0.00 175.55 175.73 1uwe n PRO 141 N 2.89 -0.04 0.03 4.97 -0.04 -1.26 -0.46 135.00 141.08 1uwe n PRO 141 Ca -0.14 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.23 1uwe n PRO 141 Cb 0.56 0.00 0.06 0.00 -0.04 0.00 0.00 33.50 34.08 1uwe n PRO 141 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 1uwe h ARG 142 N 0.00 0.46 -6.73 0.54 2.43 -1.99 -3.45 114.38 105.65 1uwe h ARG 142 Ca 0.00 -0.32 -0.53 0.00 -0.81 0.00 0.00 59.98 58.33 1uwe h ARG 142 Cb 0.00 0.05 0.06 0.00 -0.42 0.00 0.00 29.97 29.65 1uwe h ARG 142 CO 0.00 0.93 0.80 -1.21 -1.51 0.00 0.00 179.97 178.97 1uwe s GLU 143 N -3.87 4.24 -0.28 0.20 8.01 -1.26 -5.00 118.70 120.74 1uwe s GLU 143 Ca -0.06 2.35 -0.17 0.00 0.01 0.00 0.00 54.97 57.09 1uwe s GLU 143 Cb 0.11 -3.11 0.11 0.00 -4.31 0.00 0.00 34.13 26.93 1uwe s GLU 143 CO 0.83 -0.48 0.82 0.00 0.01 0.00 0.00 175.26 176.45 1uwe s ALA 144 N 0.20 -2.04 -0.15 5.21 0.00 -1.26 -4.67 121.76 119.04 1uwe s ALA 144 Ca 0.62 2.29 -0.15 0.00 0.00 0.00 0.00 51.96 54.72 1uwe s ALA 144 Cb -0.43 -1.53 -0.04 0.00 0.00 0.00 0.00 23.12 21.12 1uwe s ALA 144 CO 0.42 -0.36 0.34 0.00 0.00 0.00 0.00 175.76 176.16 1uwe s ALA 145 N 1.39 3.56 -0.20 0.00 0.00 -0.29 -4.95 121.76 121.28 1uwe s ALA 145 Ca -0.08 -0.39 0.01 0.00 0.00 0.00 0.00 51.96 51.49 1uwe s ALA 145 Cb -0.04 -2.47 0.04 0.00 0.00 0.00 0.00 23.12 20.65 1uwe s ALA 145 CO -0.16 0.05 -0.12 0.08 0.00 0.00 0.00 175.76 175.61 1uwe s VAL 146 N 0.55 1.72 -0.05 0.00 1.01 -1.26 0.07 120.40 122.45 1uwe s VAL 146 Ca 0.19 -1.00 0.05 0.00 0.00 0.00 0.00 61.98 61.22 1uwe s VAL 146 Cb -0.14 -1.75 -0.02 0.00 0.00 0.00 0.00 36.38 34.48 1uwe s VAL 146 CO 0.06 0.23 -0.21 -1.10 0.00 0.00 0.00 175.10 174.08 1uwe s GLN 147 N 1.37 2.47 -0.13 2.72 -0.21 0.85 -4.95 119.66 121.78 1uwe s GLN 147 Ca -0.00 -0.83 -0.07 0.00 0.02 0.00 0.00 55.36 54.47 1uwe s GLN 147 Cb -0.16 -2.23 -0.04 0.00 1.00 0.00 0.00 33.01 31.58 1uwe s GLN 147 CO -0.09 0.49 0.13 -1.58 -2.12 0.00 0.00 175.29 172.13 1uwe s TRP 148 N -0.42 3.54 -0.05 0.91 0.52 -1.26 0.54 118.94 122.72 1uwe s TRP 148 Ca 0.04 0.47 0.03 0.00 0.02 0.00 0.00 56.10 56.66 1uwe s TRP 148 Cb -0.12 -1.98 0.01 0.00 -1.15 0.00 0.00 33.47 30.23 1uwe s TRP 148 CO 0.01 0.63 -0.12 0.15 0.02 0.00 0.00 176.95 177.65 1uwe s LYS 149 N -0.74 1.43 -0.25 4.98 1.02 0.58 -0.18 119.74 126.58 1uwe s LYS 149 Ca 0.13 -0.41 0.02 0.00 0.02 0.00 0.00 55.97 55.73 1uwe s LYS 149 Cb -0.12 -1.25 0.05 0.00 -0.52 0.00 0.00 37.83 35.99 1uwe s LYS 149 CO 0.03 0.11 -0.11 0.08 -0.92 0.00 0.00 175.35 174.53 1uwe s VAL 150 N 0.36 2.29 -1.36 3.17 1.01 0.32 -0.45 120.40 125.74 1uwe s VAL 150 Ca -0.08 -1.42 -0.08 0.00 0.00 0.00 0.00 61.98 60.40 1uwe s VAL 150 Cb -0.12 -2.26 0.02 0.00 0.00 0.00 0.00 36.38 34.02 1uwe s VAL 150 CO 0.02 0.10 1.13 0.47 0.00 0.00 0.00 175.10 176.82 1uwe n ASP 151 N 4.51 -5.62 0.00 3.32 8.00 0.12 -1.09 116.55 125.79 1uwe n ASP 151 Ca -0.16 -0.58 0.00 0.00 0.71 0.00 0.00 54.79 54.76 1uwe n ASP 151 Cb 0.44 -4.89 0.00 0.00 -0.02 0.00 0.00 41.12 36.66 1uwe n ASP 151 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1uwe n ASN 152 N -3.01 -0.30 -4.62 -2.24 5.15 -1.26 -4.97 115.26 104.01 1uwe n ASN 152 Ca -0.03 0.00 -0.41 0.00 -0.60 0.00 0.00 54.58 53.54 1uwe n ASN 152 Cb 0.57 -1.60 -0.05 0.00 -0.53 0.00 0.00 39.78 38.17 1uwe n ASN 152 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1uwe s ALA 153 N -2.10 3.56 0.00 5.20 0.00 -0.25 -5.01 121.76 123.16 1uwe s ALA 153 Ca 0.00 -0.44 -0.30 0.00 0.00 0.00 0.00 51.96 51.22 1uwe s ALA 153 Cb 0.00 -3.21 -0.08 0.00 0.00 0.00 0.00 23.12 19.83 1uwe s ALA 153 CO 0.00 -1.08 1.85 -1.17 0.00 0.00 0.00 175.76 175.36 1uwe s LEU 154 N 2.80 4.38 0.59 0.00 2.96 -1.26 -0.52 118.68 127.63 1uwe s LEU 154 Ca 0.30 2.50 -0.10 0.00 -0.22 0.00 0.00 54.13 56.61 1uwe s LEU 154 Cb -0.15 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 42.97 1uwe s LEU 154 CO 0.11 -1.02 0.98 -1.10 -1.32 0.00 0.00 176.35 174.00 1uwe s GLN 155 N 4.33 3.59 -0.23 1.98 -1.52 0.74 -4.94 119.66 123.60 1uwe s GLN 155 Ca 0.83 0.63 -0.26 0.00 -1.95 0.00 0.00 55.36 54.61 1uwe s GLN 155 Cb -0.39 -2.14 0.08 0.00 -0.22 0.00 0.00 33.01 30.34 1uwe s GLN 155 CO 0.37 -0.49 0.80 -1.54 -0.25 0.00 0.00 175.29 174.17 1uwe s SER 156 N -4.16 -0.65 -0.48 5.90 1.04 -1.26 -4.70 113.70 109.38 1uwe s SER 156 Ca 0.53 1.15 0.00 0.00 0.48 0.00 0.00 55.95 58.11 1uwe s SER 156 Cb -0.11 1.13 0.00 0.00 0.10 0.00 0.00 66.02 67.14 1uwe s SER 156 CO 0.52 -0.29 0.00 0.61 0.98 0.00 0.00 173.24 175.06 1uwe n GLY 157 N 2.19 0.61 0.24 7.32 0.00 -1.26 -4.84 105.19 109.45 1uwe n GLY 157 Ca -0.14 -0.15 0.06 0.00 0.00 0.00 0.00 46.02 45.78 1uwe n GLY 157 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1uwe n ASN 158 N -0.43 1.37 -4.06 1.61 0.23 -1.26 -5.06 115.26 107.66 1uwe n ASN 158 Ca -0.05 -2.60 -0.08 0.00 -0.53 0.00 0.00 54.58 51.32 1uwe n ASN 158 Cb 0.35 -0.32 -0.10 0.00 -2.08 0.00 0.00 39.78 37.62 1uwe n ASN 158 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 1uwe s SER 159 N -2.05 0.50 0.03 0.53 1.04 -1.26 -1.50 113.70 111.00 1uwe s SER 159 Ca 0.18 -0.82 -0.05 0.00 0.48 0.00 0.00 55.95 55.74 1uwe s SER 159 Cb 0.16 0.15 -0.01 0.00 0.10 0.00 0.00 66.02 66.41 1uwe s SER 159 CO 0.02 -0.47 0.07 0.00 0.98 0.00 0.00 173.24 173.84 1uwe s GLN 160 N -3.02 0.54 0.14 4.02 -2.07 -0.85 -4.96 119.66 113.46 1uwe s GLN 160 Ca -0.01 -0.73 0.10 0.00 -1.82 0.00 0.00 55.36 52.90 1uwe s GLN 160 Cb 0.01 0.21 -0.04 0.00 -1.09 0.00 0.00 33.01 32.10 1uwe s GLN 160 CO -0.06 -0.13 -0.20 -1.21 -1.32 0.00 0.00 175.29 172.38 1uwe s GLU 161 N -2.42 1.70 -0.03 9.60 2.02 -1.26 -1.40 118.70 126.91 1uwe s GLU 161 Ca -0.07 -1.28 0.02 0.00 0.02 0.00 0.00 54.97 53.66 1uwe s GLU 161 Cb -0.02 -2.03 0.01 0.00 0.10 0.00 0.00 34.13 32.18 1uwe s GLU 161 CO -0.04 0.45 -0.08 0.45 0.02 0.00 0.00 175.26 176.07 1uwe s SER 162 N -2.31 1.17 0.04 -0.19 0.15 -0.68 -5.00 113.70 106.88 1uwe s SER 162 Ca 0.19 -0.18 0.08 0.00 0.70 0.00 0.00 55.95 56.74 1uwe s SER 162 Cb -0.10 -0.39 -0.03 0.00 -1.71 0.00 0.00 66.02 63.80 1uwe s SER 162 CO 0.10 0.04 -0.22 -0.69 1.20 0.00 0.00 173.24 173.66 1uwe s VAL 163 N 0.37 2.44 0.68 4.45 1.01 -1.26 -1.95 120.40 126.15 1uwe s VAL 163 Ca -0.06 -1.26 -0.11 0.00 0.00 0.00 0.00 61.98 60.55 1uwe s VAL 163 Cb -0.10 -1.98 -0.00 0.00 0.00 0.00 0.00 36.38 34.30 1uwe s VAL 163 CO 0.01 0.38 1.05 -0.89 0.00 0.00 0.00 175.10 175.65 1uwe s THR 164 N -0.84 4.17 0.61 3.92 2.01 -0.46 -5.01 115.64 120.04 1uwe s THR 164 Ca 0.13 0.71 -0.09 0.00 0.31 0.00 0.00 61.69 62.74 1uwe s THR 164 Cb -0.10 -3.50 -0.02 0.00 0.01 0.00 0.00 72.50 68.89 1uwe s THR 164 CO 0.03 -0.92 0.98 -1.61 -0.69 0.00 0.00 174.62 172.41 1uwe s GLU 165 N -5.08 3.26 0.26 4.92 2.02 -1.26 -4.68 118.70 118.13 1uwe s GLU 165 Ca 0.57 0.43 -0.31 0.00 0.02 0.00 0.00 54.97 55.69 1uwe s GLU 165 Cb -0.13 -2.15 -0.13 0.00 0.10 0.00 0.00 34.13 31.81 1uwe s GLU 165 CO 0.55 -0.66 1.34 1.04 0.02 0.00 0.00 175.26 177.55 1uwe n GLN 166 N -2.70 1.93 -1.98 1.61 6.02 -1.26 -4.80 117.38 116.19 1uwe n GLN 166 Ca 0.05 0.69 -0.41 0.00 -0.01 0.00 0.00 57.00 57.31 1uwe n GLN 166 Cb 0.56 -2.30 -0.02 0.00 1.02 0.00 0.00 30.24 29.50 1uwe n GLN 166 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1uwe s ASP 167 N 0.10 6.61 0.35 1.08 2.15 -0.14 -4.90 116.67 121.91 1uwe s ASP 167 Ca 0.66 2.77 0.13 0.00 0.43 0.00 0.00 52.55 56.53 1uwe s ASP 167 Cb -0.65 -2.64 0.66 0.00 -0.30 0.00 0.00 42.92 39.99 1uwe s ASP 167 CO 0.53 -0.70 1.78 0.28 -0.17 0.00 0.00 175.17 176.89 1uwe h SER 168 N 4.16 0.00 0.08 -0.34 0.02 -1.90 -1.17 113.55 114.40 1uwe h SER 168 Ca -0.48 0.00 -0.33 0.00 -0.84 0.00 0.00 61.79 60.14 1uwe h SER 168 Cb 1.22 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.74 1uwe h SER 168 CO 0.72 0.42 -1.81 0.00 -1.14 0.00 0.00 176.83 175.01 1uwe n ALA 169 N -2.44 0.88 -0.07 3.77 0.00 -1.26 -2.95 120.51 118.44 1uwe n ALA 169 Ca -0.02 -0.59 0.00 0.00 0.00 0.00 0.00 53.44 52.83 1uwe n ALA 169 Cb 0.45 -0.60 0.00 0.00 0.00 0.00 0.00 19.45 19.30 1uwe n ALA 169 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1uwe n ASP 170 N -3.79 0.93 -0.02 0.00 5.68 -1.25 -4.92 116.55 113.18 1uwe n ASP 170 Ca -0.33 -1.00 -0.00 0.00 -0.50 0.00 0.00 54.79 52.96 1uwe n ASP 170 Cb 0.93 0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 40.91 1uwe n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1uwe n SER 171 N -0.00 -4.63 -4.91 -1.12 7.64 -0.44 -4.95 113.62 105.20 1uwe n SER 171 Ca 0.00 0.01 -0.28 0.00 1.01 0.00 0.00 58.87 59.61 1uwe n SER 171 Cb 0.02 -2.15 0.08 0.00 -1.01 0.00 0.00 64.21 61.15 1uwe n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1uwe s THR 172 N -1.47 2.31 0.32 0.44 -4.23 -1.26 -4.51 115.64 107.23 1uwe s THR 172 Ca 0.00 -0.04 0.09 0.00 -1.18 0.00 0.00 61.69 60.56 1uwe s THR 172 Cb 0.00 -3.07 -0.05 0.00 1.34 0.00 0.00 72.50 70.73 1uwe s THR 172 CO 0.00 -0.08 0.06 -0.31 -0.54 0.00 0.00 174.62 173.75 1uwe s TYR 173 N -3.42 2.65 0.05 3.99 2.02 0.60 -0.97 117.35 122.26 1uwe s TYR 173 Ca 0.61 -0.35 0.03 0.00 -0.37 0.00 0.00 57.07 56.98 1uwe s TYR 173 Cb -0.11 -1.46 -0.03 0.00 -0.40 0.00 0.00 41.96 39.96 1uwe s TYR 173 CO 0.48 0.46 -0.09 -1.12 -1.57 0.00 0.00 175.55 173.71 1uwe s SER 174 N -3.75 0.98 -0.02 2.29 0.01 -1.26 -1.01 113.70 110.94 1uwe s SER 174 Ca 0.35 -0.58 -0.01 0.00 1.31 0.00 0.00 55.95 57.01 1uwe s SER 174 Cb -0.03 0.03 0.01 0.00 0.21 0.00 0.00 66.02 66.24 1uwe s SER 174 CO 0.21 -0.20 0.04 -0.22 0.41 0.00 0.00 173.24 173.48 1uwe s LEU 175 N -1.68 1.75 -0.06 2.44 0.20 0.92 -1.36 118.68 120.89 1uwe s LEU 175 Ca -0.08 0.09 0.04 0.00 0.69 0.00 0.00 54.13 54.87 1uwe s LEU 175 Cb -0.09 0.13 -0.02 0.00 -0.43 0.00 0.00 46.19 45.78 1uwe s LEU 175 CO 0.00 -0.03 -0.18 -0.94 -0.29 0.00 0.00 176.35 174.91 1uwe s SER 176 N 0.14 3.66 -0.14 3.68 1.04 -0.82 0.30 113.70 121.56 1uwe s SER 176 Ca -0.01 -0.33 0.01 0.00 0.48 0.00 0.00 55.95 56.09 1uwe s SER 176 Cb -0.02 -0.93 -0.01 0.00 0.10 0.00 0.00 66.02 65.17 1uwe s SER 176 CO -0.00 0.28 -0.16 -0.55 0.98 0.00 0.00 173.24 173.79 1uwe s SER 177 N -0.37 3.68 -0.19 7.02 0.15 0.15 -1.69 113.70 122.45 1uwe s SER 177 Ca 0.03 -0.44 0.01 0.00 0.70 0.00 0.00 55.95 56.26 1uwe s SER 177 Cb -0.12 -1.55 0.03 0.00 -1.71 0.00 0.00 66.02 62.66 1uwe s SER 177 CO 0.02 0.13 -0.19 -0.89 1.20 0.00 0.00 173.24 173.51 1uwe s THR 178 N 0.58 2.06 -0.21 6.45 2.01 -0.50 0.70 115.64 126.74 1uwe s THR 178 Ca -0.10 -1.03 -0.13 0.00 0.31 0.00 0.00 61.69 60.75 1uwe s THR 178 Cb -0.16 -1.91 -0.05 0.00 0.01 0.00 0.00 72.50 70.40 1uwe s THR 178 CO 0.03 0.46 0.25 -0.22 -0.69 0.00 0.00 174.62 174.45 1uwe s LEU 179 N 1.27 4.16 -0.18 4.42 2.96 0.94 -2.00 118.68 130.25 1uwe s LEU 179 Ca 0.03 0.32 -0.00 0.00 -0.22 0.00 0.00 54.13 54.26 1uwe s LEU 179 Cb -0.14 -2.27 0.01 0.00 0.50 0.00 0.00 46.19 44.28 1uwe s LEU 179 CO -0.12 0.05 -0.15 -0.89 -1.32 0.00 0.00 176.35 173.92 1uwe s THR 180 N 0.92 2.52 0.27 3.68 2.01 -0.57 -0.41 115.64 124.06 1uwe s THR 180 Ca 0.13 -0.79 0.07 0.00 0.31 0.00 0.00 61.69 61.40 1uwe s THR 180 Cb -0.13 -2.08 -0.06 0.00 0.01 0.00 0.00 72.50 70.24 1uwe s THR 180 CO 0.04 0.51 -0.07 -0.76 -0.69 0.00 0.00 174.62 173.65 1uwe s LEU 181 N 1.19 2.48 0.41 4.42 1.43 -0.55 -4.90 118.68 123.15 1uwe s LEU 181 Ca 0.02 -1.17 -0.22 0.00 -1.03 0.00 0.00 54.13 51.73 1uwe s LEU 181 Cb -0.14 -0.63 -0.10 0.00 0.03 0.00 0.00 46.19 45.35 1uwe s LEU 181 CO -0.07 -0.33 0.96 -0.94 0.23 0.00 0.00 176.35 176.21 1uwe s SER 182 N -3.42 6.99 0.41 2.29 1.04 -1.26 -1.43 113.70 118.32 1uwe s SER 182 Ca 0.28 1.76 0.22 0.00 0.48 0.00 0.00 55.95 58.69 1uwe s SER 182 Cb 0.03 -2.55 1.20 0.00 0.10 0.00 0.00 66.02 64.80 1uwe s SER 182 CO 0.11 -0.32 1.74 0.50 0.98 0.00 0.00 173.24 176.25 1uwe h LYS 183 N 2.21 0.29 -0.20 4.02 3.11 -1.49 -0.01 116.57 124.50 1uwe h LYS 183 Ca -0.48 -0.02 -0.04 0.00 -2.81 0.00 0.00 60.65 57.30 1uwe h LYS 183 Cb 1.19 -0.07 -0.01 0.00 -1.00 0.00 0.00 32.23 32.34 1uwe h LYS 183 CO 0.62 0.19 -0.03 0.00 -2.81 0.00 0.00 179.45 177.43 1uwe h ALA 184 N 1.61 0.28 -0.45 5.00 0.00 -1.92 -1.39 119.26 122.39 1uwe h ALA 184 Ca 0.64 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 55.22 1uwe h ALA 184 Cb 1.78 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.48 1uwe h ALA 184 CO -0.31 0.03 -0.12 -0.44 0.00 0.00 0.00 179.25 178.41 1uwe h ASP 185 N 0.12 0.82 -0.19 0.00 3.32 -1.44 -2.08 116.42 116.97 1uwe h ASP 185 Ca 0.05 -0.25 -0.00 0.00 0.02 0.00 0.00 57.03 56.85 1uwe h ASP 185 Cb 0.45 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 1uwe h ASP 185 CO 0.02 0.95 0.10 0.22 -1.72 0.00 0.00 179.24 178.81 1uwe h TYR 186 N 0.74 0.26 0.00 4.55 3.20 -1.12 -2.83 116.97 121.78 1uwe h TYR 186 Ca 0.12 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.96 1uwe h TYR 186 Cb 0.62 -0.08 -0.00 0.00 1.54 0.00 0.00 36.73 38.80 1uwe h TYR 186 CO 0.03 0.25 -0.14 0.93 -1.64 0.00 0.00 178.16 177.60 1uwe h GLU 187 N 0.19 0.00 0.00 1.82 4.39 -1.05 -2.50 114.58 117.43 1uwe h GLU 187 Ca 0.06 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.76 1uwe h GLU 187 Cb 0.08 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1uwe h GLU 187 CO -0.01 0.14 0.00 0.00 -1.16 0.00 0.00 179.01 177.98 1uwe h ALA 188 N 1.86 1.00 -1.68 3.43 0.00 -1.12 -3.45 119.26 119.30 1uwe h ALA 188 Ca -0.00 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 54.30 1uwe h ALA 188 Cb 0.44 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 18.11 1uwe h ALA 188 CO 0.02 0.00 -0.58 -1.01 0.00 0.00 0.00 179.25 177.68 1uwe s HIS 189 N -3.24 2.54 0.00 0.00 3.76 -0.94 -5.08 115.29 112.33 1uwe s HIS 189 Ca 0.07 -0.62 0.00 0.00 -0.15 0.00 0.00 55.06 54.36 1uwe s HIS 189 Cb 0.10 -1.78 0.00 0.00 1.11 0.00 0.00 32.58 32.01 1uwe s HIS 189 CO 0.52 0.39 0.00 0.00 -0.85 0.00 0.00 174.74 174.80 1uwe n ALA 190 N -1.03 2.53 -2.47 -1.40 0.00 -1.26 -4.79 120.51 112.08 1uwe n ALA 190 Ca -0.04 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.97 1uwe n ALA 190 Cb 0.66 0.40 -0.09 0.00 0.00 0.00 0.00 19.45 20.42 1uwe n ALA 190 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1uwe s VAL 191 N -1.91 5.17 -0.20 0.00 1.01 -1.26 -1.36 120.40 121.84 1uwe s VAL 191 Ca 0.00 -0.49 -0.05 0.00 0.00 0.00 0.00 61.98 61.44 1uwe s VAL 191 Cb 0.00 -3.99 -0.02 0.00 0.00 0.00 0.00 36.38 32.37 1uwe s VAL 191 CO 0.00 -0.37 0.00 -0.31 0.00 0.00 0.00 175.10 174.43 1uwe s TYR 192 N 1.92 3.04 -0.02 5.22 1.51 -0.84 0.13 117.35 128.30 1uwe s TYR 192 Ca 0.09 -0.49 0.03 0.00 -1.01 0.00 0.00 57.07 55.69 1uwe s TYR 192 Cb -0.18 -2.09 -0.00 0.00 -0.11 0.00 0.00 41.96 39.58 1uwe s TYR 192 CO 0.12 -0.27 -0.10 0.00 -1.11 0.00 0.00 175.55 174.19 1uwe s ALA 193 N 1.07 0.93 -0.23 3.71 0.00 0.41 -2.01 121.76 125.64 1uwe s ALA 193 Ca 0.02 -0.40 0.01 0.00 0.00 0.00 0.00 51.96 51.59 1uwe s ALA 193 Cb -0.14 -0.31 0.04 0.00 0.00 0.00 0.00 23.12 22.70 1uwe s ALA 193 CO 0.02 0.17 -0.14 0.00 0.00 0.00 0.00 175.76 175.81 1uwe s GLU 195 N 1.22 3.81 -0.09 0.00 2.12 0.19 -1.53 118.70 124.42 1uwe s GLU 195 Ca -0.02 -0.41 0.03 0.00 0.36 0.00 0.00 54.97 54.93 1uwe s GLU 195 Cb -0.17 -3.28 -0.02 0.00 0.26 0.00 0.00 34.13 30.93 1uwe s GLU 195 CO -0.08 0.03 -0.17 0.54 -0.54 0.00 0.00 175.26 175.03 1uwe s VAL 196 N 1.04 2.75 -0.18 3.70 0.11 -0.02 -0.11 120.40 127.70 1uwe s VAL 196 Ca 0.04 -0.80 -0.04 0.00 -2.93 0.00 0.00 61.98 58.25 1uwe s VAL 196 Cb -0.14 -2.09 -0.02 0.00 -1.53 0.00 0.00 36.38 32.59 1uwe s VAL 196 CO 0.03 0.56 -0.03 -0.89 -3.33 0.00 0.00 175.10 171.44 1uwe s THR 197 N -0.08 3.77 -0.00 5.04 2.01 0.11 -1.93 115.64 124.56 1uwe s THR 197 Ca -0.04 -0.39 -0.11 0.00 0.31 0.00 0.00 61.69 61.47 1uwe s THR 197 Cb -0.14 -2.68 0.01 0.00 0.01 0.00 0.00 72.50 69.70 1uwe s THR 197 CO 0.04 0.46 0.22 -2.28 -0.69 0.00 0.00 174.62 172.36 1uwe s HIS 198 N 0.81 -0.06 0.38 4.92 2.46 -1.26 -1.13 115.29 121.41 1uwe s HIS 198 Ca -0.01 0.05 0.31 0.00 0.47 0.00 0.00 55.06 55.88 1uwe s HIS 198 Cb -0.14 0.02 1.56 0.00 -0.13 0.00 0.00 32.58 33.89 1uwe s HIS 198 CO 0.02 -0.34 2.09 0.37 -2.47 0.00 0.00 174.74 174.41 1uwe h GLN 199 N 4.06 0.00 0.00 2.88 5.75 -1.92 -1.08 115.11 124.81 1uwe h GLN 199 Ca -0.30 0.00 -0.08 0.00 -0.15 0.00 0.00 58.65 58.12 1uwe h GLN 199 Cb 1.19 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.72 1uwe h GLN 199 CO 0.40 0.08 -0.36 0.78 -2.65 0.00 0.00 178.83 177.08 1uwe h GLY 200 N 1.00 0.00 -5.14 2.39 0.00 -1.84 -3.43 103.07 96.05 1uwe h GLY 200 Ca -0.00 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.75 1uwe h GLY 200 CO 0.01 0.00 -0.07 1.08 0.00 0.00 0.00 176.54 177.56 1uwe s LEU 201 N -7.13 4.37 0.00 3.11 1.43 -0.41 -4.67 118.68 115.38 1uwe s LEU 201 Ca -0.00 1.02 0.29 0.00 -1.03 0.00 0.00 54.13 54.41 1uwe s LEU 201 Cb 0.11 -2.81 1.30 0.00 0.03 0.00 0.00 46.19 44.82 1uwe s LEU 201 CO 0.68 0.08 1.93 -0.24 0.23 0.00 0.00 176.35 179.04 1uwe n SER 202 N 3.02 0.10 -3.62 2.29 2.88 -1.26 -4.73 113.62 112.29 1uwe n SER 202 Ca -0.07 0.03 -0.14 0.00 -1.33 0.00 0.00 58.87 57.36 1uwe n SER 202 Cb 0.51 -0.30 -0.07 0.00 -0.75 0.00 0.00 64.21 63.61 1uwe n SER 202 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1uwe s SER 203 N -2.75 -0.73 0.49 -3.46 1.04 -1.26 -5.15 113.70 101.87 1uwe s SER 203 Ca 0.22 1.36 -0.20 0.00 0.48 0.00 0.00 55.95 57.80 1uwe s SER 203 Cb 0.20 1.36 -0.11 0.00 0.10 0.00 0.00 66.02 67.57 1uwe s SER 203 CO 0.51 -0.28 0.56 -2.65 0.98 0.00 0.00 173.24 172.36 1uwe n PRO 204 N 2.52 0.60 -4.50 4.02 -0.02 -1.26 -4.94 135.00 131.43 1uwe n PRO 204 Ca -0.14 0.23 -0.33 0.00 -2.02 0.00 0.00 63.50 61.23 1uwe n PRO 204 Cb 0.55 -1.63 -0.16 0.00 -0.02 0.00 0.00 33.50 32.24 1uwe n PRO 204 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1uwe s VAL 205 N -1.58 2.22 -0.08 -1.45 1.01 -0.81 -4.97 120.40 114.74 1uwe s VAL 205 Ca 0.65 -0.91 -0.02 0.00 0.00 0.00 0.00 61.98 61.70 1uwe s VAL 205 Cb -0.53 -1.91 -0.03 0.00 0.00 0.00 0.00 36.38 33.91 1uwe s VAL 205 CO 0.57 0.54 0.01 -0.89 0.00 0.00 0.00 175.10 175.32 1uwe s THR 206 N 0.94 4.38 -0.15 3.92 2.01 -1.26 -0.84 115.64 124.65 1uwe s THR 206 Ca -0.04 -0.24 0.01 0.00 0.31 0.00 0.00 61.69 61.73 1uwe s THR 206 Cb -0.15 -2.85 0.02 0.00 0.01 0.00 0.00 72.50 69.53 1uwe s THR 206 CO -0.04 0.59 -0.16 -0.54 -0.69 0.00 0.00 174.62 173.78 1uwe s LYS 207 N -0.93 2.47 0.29 4.92 -0.14 -0.58 -4.98 119.74 120.78 1uwe s LYS 207 Ca 0.14 -0.63 0.03 0.00 -1.36 0.00 0.00 55.97 54.14 1uwe s LYS 207 Cb -0.11 -2.18 -0.04 0.00 -1.68 0.00 0.00 37.83 33.81 1uwe s LYS 207 CO 0.03 -0.18 0.15 -1.54 -0.76 0.00 0.00 175.35 173.05 1uwe s SER 208 N 1.31 1.40 0.18 2.83 1.04 -1.26 -0.86 113.70 118.34 1uwe s SER 208 Ca 0.02 -1.53 -0.22 0.00 0.48 0.00 0.00 55.95 54.70 1uwe s SER 208 Cb -0.13 0.37 0.06 0.00 0.10 0.00 0.00 66.02 66.41 1uwe s SER 208 CO -0.09 -0.87 0.61 0.72 0.98 0.00 0.00 173.24 174.59 1uwe s PHE 209 N -3.66 -0.43 -0.07 5.02 -0.12 -0.85 -5.01 117.98 112.86 1uwe s PHE 209 Ca 0.36 0.16 -0.00 0.00 -0.05 0.00 0.00 56.93 57.40 1uwe s PHE 209 Cb 0.05 0.57 -0.03 0.00 -0.63 0.00 0.00 43.02 42.98 1uwe s PHE 209 CO 0.17 -0.92 -0.04 -0.80 -0.05 0.00 0.00 175.22 173.58 1uwe s ASN 210 N -2.79 4.89 -0.80 1.98 0.01 -1.26 -1.99 114.94 114.97 1uwe s ASN 210 Ca 0.04 0.04 -0.24 0.00 -0.71 0.00 0.00 52.86 51.99 1uwe s ASN 210 Cb -0.02 -1.29 -0.18 0.00 0.41 0.00 0.00 41.25 40.17 1uwe s ASN 210 CO -0.08 0.36 2.43 0.54 -1.51 0.00 0.00 177.10 178.84 1uwe n ARG 211 N 2.15 0.45 -0.24 -0.60 1.74 -0.47 -5.03 116.66 114.65 1uwe n ARG 211 Ca -0.18 -0.22 0.00 0.00 -0.77 0.00 0.00 57.85 56.68 1uwe n ARG 211 Cb 0.53 -2.53 0.00 0.00 -1.02 0.00 0.00 32.46 29.45 1uwe n ARG 211 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52