#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3lrs s LEU 4 N 0.00 4.07 -0.41 0.00 1.43 -1.06 -4.87 118.68 117.85 3lrs s LEU 4 Ca 0.00 2.15 -0.18 0.00 -1.03 0.00 0.00 54.13 55.07 3lrs s LEU 4 Cb 0.00 -4.23 0.02 0.00 0.03 0.00 0.00 46.19 42.01 3lrs s LEU 4 CO 0.00 -0.69 0.47 -0.89 0.23 0.00 0.00 176.35 175.48 3lrs s THR 5 N -1.63 5.04 0.10 5.49 2.01 -0.06 -2.04 115.64 124.56 3lrs s THR 5 Ca 0.61 -0.15 0.08 0.00 0.31 0.00 0.00 61.69 62.54 3lrs s THR 5 Cb -0.25 -4.04 -0.04 0.00 0.01 0.00 0.00 72.50 68.19 3lrs s THR 5 CO 0.30 -0.39 -0.15 -1.10 -0.69 0.00 0.00 174.62 172.59 3lrs s GLN 6 N 2.27 1.95 0.27 4.92 -0.21 -1.26 -1.23 119.66 126.37 3lrs s GLN 6 Ca 0.15 -1.09 -0.31 0.00 0.02 0.00 0.00 55.36 54.13 3lrs s GLN 6 Cb -0.16 -2.20 -0.11 0.00 1.00 0.00 0.00 33.01 31.53 3lrs s GLN 6 CO 0.14 0.50 1.63 -1.25 -2.12 0.00 0.00 175.29 174.19 3lrs s PRO 7 N -2.08 4.13 0.35 2.91 0.04 -1.26 -4.78 135.00 134.31 3lrs s PRO 7 Ca 0.19 2.58 0.07 0.00 0.04 0.00 0.00 61.00 63.88 3lrs s PRO 7 Cb -0.11 -3.04 0.77 0.00 0.04 0.00 0.00 34.50 32.16 3lrs s PRO 7 CO 0.11 -0.66 1.91 0.00 0.04 0.00 0.00 177.00 178.40 3lrs h ALA 8 N 5.45 1.76 -2.64 8.56 0.00 -1.97 -3.39 119.26 127.03 3lrs h ALA 8 Ca -0.46 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.32 3lrs h ALA 8 Cb 1.21 -0.17 -0.21 0.00 0.00 0.00 0.00 17.79 18.63 3lrs h ALA 8 CO 0.84 0.06 -0.34 -1.54 0.00 0.00 0.00 179.25 178.28 3lrs s SER 9 N -5.98 -0.16 0.02 0.00 1.04 -1.26 -1.40 113.70 105.96 3lrs s SER 9 Ca -0.10 0.09 0.01 0.00 0.48 0.00 0.00 55.95 56.44 3lrs s SER 9 Cb 0.21 0.33 -0.02 0.00 0.10 0.00 0.00 66.02 66.64 3lrs s SER 9 CO 0.78 -0.38 -0.06 0.68 0.98 0.00 0.00 173.24 175.24 3lrs s VAL 10 N -1.13 0.38 -0.01 5.02 -7.23 -0.69 -4.90 120.40 111.83 3lrs s VAL 10 Ca -0.12 -0.71 0.04 0.00 -1.81 0.00 0.00 61.98 59.38 3lrs s VAL 10 Cb -0.05 -0.42 -0.01 0.00 0.56 0.00 0.00 36.38 36.45 3lrs s VAL 10 CO 0.03 -0.23 -0.13 -0.44 -0.31 0.00 0.00 175.10 174.03 3lrs s SER 11 N -1.01 1.50 0.03 4.85 0.01 -1.26 -1.93 113.70 115.88 3lrs s SER 11 Ca -0.07 -0.23 -0.07 0.00 1.31 0.00 0.00 55.95 56.89 3lrs s SER 11 Cb -0.07 -0.17 -0.00 0.00 0.21 0.00 0.00 66.02 65.99 3lrs s SER 11 CO -0.00 0.16 0.14 -0.83 0.41 0.00 0.00 173.24 173.12 3lrs s GLY 12 N -0.29 0.08 0.68 3.44 0.00 -0.89 -4.98 107.32 105.37 3lrs s GLY 12 Ca 0.05 -0.32 -0.11 0.00 0.00 0.00 0.00 44.72 44.34 3lrs s GLY 12 CO -0.00 -0.47 1.06 -0.56 0.00 0.00 0.00 173.10 173.13 3lrs s SER 13 N -1.84 5.60 0.41 1.64 0.01 -1.26 -1.63 113.70 116.62 3lrs s SER 13 Ca -0.09 1.43 -0.26 0.00 1.31 0.00 0.00 55.95 58.34 3lrs s SER 13 Cb -0.03 -2.34 -0.10 0.00 0.21 0.00 0.00 66.02 63.75 3lrs s SER 13 CO -0.02 -1.28 1.31 -2.65 0.41 0.00 0.00 173.24 171.01 3lrs n PRO 14 N -3.01 2.06 0.00 12.44 -0.02 -1.26 -2.12 135.00 143.09 3lrs n PRO 14 Ca 0.07 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 3lrs n PRO 14 Cb 0.55 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 3lrs n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3lrs n GLY 15 N 0.75 2.57 3.92 -1.23 0.00 0.11 -4.79 105.19 106.52 3lrs n GLY 15 Ca 0.06 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.80 3lrs n GLY 15 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3lrs s GLN 16 N 0.00 2.00 0.18 1.61 -1.52 -0.90 -3.26 119.66 117.77 3lrs s GLN 16 Ca 0.00 -0.15 0.05 0.00 -1.95 0.00 0.00 55.36 53.31 3lrs s GLN 16 Cb 0.00 -2.07 -0.04 0.00 -0.22 0.00 0.00 33.01 30.68 3lrs s GLN 16 CO 0.00 -1.45 0.17 0.99 -0.25 0.00 0.00 175.29 174.75 3lrs s THR 17 N -3.40 4.59 -0.22 -0.19 2.01 -1.26 -1.50 115.64 115.66 3lrs s THR 17 Ca 0.62 -1.09 -0.16 0.00 0.31 0.00 0.00 61.69 61.37 3lrs s THR 17 Cb -0.10 -3.38 0.06 0.00 0.01 0.00 0.00 72.50 69.10 3lrs s THR 17 CO 0.47 -0.15 0.57 -0.63 -0.69 0.00 0.00 174.62 174.18 3lrs s ILE 18 N -1.82 -0.01 0.01 1.82 1.01 -0.65 -4.97 121.20 116.60 3lrs s ILE 18 Ca 0.32 0.02 0.04 0.00 0.00 0.00 0.00 60.65 61.03 3lrs s ILE 18 Cb -0.10 -0.82 -0.01 0.00 0.01 0.00 0.00 42.46 41.54 3lrs s ILE 18 CO 0.24 0.01 -0.12 -0.89 0.00 0.00 0.00 174.94 174.19 3lrs s THR 19 N 0.97 0.93 -0.14 2.92 2.01 -1.26 0.03 115.64 121.10 3lrs s THR 19 Ca -0.05 -0.65 0.00 0.00 0.31 0.00 0.00 61.69 61.30 3lrs s THR 19 Cb -0.05 -0.80 0.02 0.00 0.01 0.00 0.00 72.50 71.68 3lrs s THR 19 CO -0.09 0.15 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.24 3lrs s ILE 20 N -0.48 1.41 0.56 1.82 1.01 -0.12 -4.96 121.20 120.44 3lrs s ILE 20 Ca 0.03 -0.53 -0.05 0.00 0.00 0.00 0.00 60.65 60.09 3lrs s ILE 20 Cb -0.06 -1.35 -0.00 0.00 0.01 0.00 0.00 42.46 41.07 3lrs s ILE 20 CO 0.00 0.43 0.86 -0.94 0.00 0.00 0.00 174.94 175.29 3lrs s SER 21 N 1.53 5.73 -0.41 3.58 1.04 -1.26 -1.40 113.70 122.52 3lrs s SER 21 Ca 0.05 0.72 0.06 0.00 0.48 0.00 0.00 55.95 57.26 3lrs s SER 21 Cb -0.13 -1.79 0.17 0.00 0.10 0.00 0.00 66.02 64.38 3lrs s SER 21 CO -0.10 -0.95 0.55 0.00 0.98 0.00 0.00 173.24 173.73 3lrs s ASN 23 N 1.60 6.18 0.00 0.00 3.84 -0.37 -1.37 114.94 124.83 3lrs s ASN 23 Ca 0.18 -1.04 0.00 0.00 0.21 0.00 0.00 52.86 52.21 3lrs s ASN 23 Cb -0.07 -2.22 0.00 0.00 -0.55 0.00 0.00 41.25 38.41 3lrs s ASN 23 CO -0.06 -0.70 0.00 0.61 -2.79 0.00 0.00 177.10 174.17 3lrs n GLY 24 N 5.17 3.83 3.13 1.21 0.00 -0.35 -0.88 105.19 117.31 3lrs n GLY 24 Ca -0.09 -1.78 -0.22 0.00 0.00 0.00 0.00 46.02 43.92 3lrs n GLY 24 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3lrs n THR 25 N 0.00 0.00 0.88 2.61 -2.24 -1.26 -4.76 114.28 109.51 3lrs n THR 25 Ca 0.00 -2.27 0.11 0.00 -2.27 0.00 0.00 64.05 59.62 3lrs n THR 25 Cb 0.00 0.92 0.51 0.00 -2.10 0.00 0.00 70.33 69.65 3lrs n THR 25 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3lrs n SER 26 N -1.62 0.00 -0.12 3.42 3.41 -1.26 -1.74 113.62 115.71 3lrs n SER 26 Ca -0.01 0.26 0.13 0.00 -0.26 0.00 0.00 58.87 58.99 3lrs n SER 26 Cb 0.58 -0.41 0.41 0.00 -0.26 0.00 0.00 64.21 64.53 3lrs n SER 26 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3lrs n SER 27 N -1.41 0.66 0.00 4.04 7.64 -1.26 -3.32 113.62 119.98 3lrs n SER 27 Ca 0.08 -0.51 0.00 0.00 1.01 0.00 0.00 58.87 59.44 3lrs n SER 27 Cb 0.22 0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.50 3lrs n SER 27 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 3lrs n ASP 27 N -1.05 0.00 -0.28 6.43 5.68 -0.71 -0.79 116.55 125.83 3lrs n ASP 27 Ca 0.10 0.00 0.02 0.00 -0.50 0.00 0.00 54.79 54.42 3lrs n ASP 27 Cb 0.33 0.00 0.16 0.00 -1.14 0.00 0.00 41.12 40.47 3lrs n ASP 27 CO 0.00 0.00 0.00 0.58 -1.33 0.00 0.00 177.20 176.45 3lrs h VAL 27 N 0.00 0.88 -0.14 2.12 2.07 -1.72 0.88 116.25 120.33 3lrs h VAL 27 Ca 0.00 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.27 3lrs h VAL 27 Cb 0.00 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 29.87 3lrs h VAL 27 CO 0.00 0.13 0.00 0.61 0.02 0.00 0.00 177.57 178.33 3lrs n GLY 27 N -1.31 -0.24 0.00 2.17 0.00 -0.74 -3.82 105.19 101.25 3lrs n GLY 27 Ca 0.13 -0.21 0.01 0.00 0.00 0.00 0.00 46.02 45.95 3lrs n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3lrs n GLY 28 N 0.83 0.76 3.35 -0.02 0.00 0.28 -4.78 105.19 105.61 3lrs n GLY 28 Ca 0.09 -0.06 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 3lrs n GLY 28 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3lrs s PHE 29 N -1.24 0.21 -0.81 1.61 0.08 -1.04 -4.97 117.98 111.83 3lrs s PHE 29 Ca 0.01 -0.57 -0.01 0.00 0.12 0.00 0.00 56.93 56.48 3lrs s PHE 29 Cb 0.02 0.05 0.36 0.00 -0.57 0.00 0.00 43.02 42.88 3lrs s PHE 29 CO 0.09 -0.72 1.85 -0.25 -0.10 0.00 0.00 175.22 176.08 3lrs n ASP 30 N -0.21 7.05 -3.13 1.36 8.00 -1.26 -4.72 116.55 123.64 3lrs n ASP 30 Ca -0.10 -3.80 -0.21 0.00 0.71 0.00 0.00 54.79 51.39 3lrs n ASP 30 Cb 0.63 -0.99 -0.04 0.00 -0.02 0.00 0.00 41.12 40.71 3lrs n ASP 30 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3lrs n SER 31 N -0.46 1.84 -4.69 -2.24 3.41 -1.26 -4.17 113.62 106.05 3lrs n SER 31 Ca 0.50 -3.19 -0.36 0.00 -0.26 0.00 0.00 58.87 55.57 3lrs n SER 31 Cb 0.30 -0.61 -0.09 0.00 -0.26 0.00 0.00 64.21 63.55 3lrs n SER 31 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3lrs s VAL 32 N -2.92 5.38 0.23 -3.33 1.01 -1.26 -3.19 120.40 116.32 3lrs s VAL 32 Ca 0.42 0.19 0.10 0.00 0.00 0.00 0.00 61.98 62.70 3lrs s VAL 32 Cb 0.32 -3.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 3lrs s VAL 32 CO -0.10 0.39 -0.14 -0.94 0.00 0.00 0.00 175.10 174.31 3lrs s SER 33 N 0.74 3.95 0.10 3.32 1.04 -0.19 -0.34 113.70 122.31 3lrs s SER 33 Ca 0.08 -0.78 0.08 0.00 0.48 0.00 0.00 55.95 55.81 3lrs s SER 33 Cb -0.12 -0.53 -0.03 0.00 0.10 0.00 0.00 66.02 65.43 3lrs s SER 33 CO 0.02 0.07 -0.21 0.26 0.98 0.00 0.00 173.24 174.35 3lrs s TRP 34 N -2.06 1.80 -0.01 5.02 0.52 0.45 -0.87 118.94 123.78 3lrs s TRP 34 Ca 0.27 -0.41 0.02 0.00 0.02 0.00 0.00 56.10 56.00 3lrs s TRP 34 Cb -0.07 -0.99 -0.00 0.00 -1.15 0.00 0.00 33.47 31.25 3lrs s TRP 34 CO 0.15 0.20 -0.07 0.71 0.02 0.00 0.00 176.95 177.96 3lrs s TYR 35 N -1.14 0.67 -0.09 -1.98 1.51 0.22 -0.78 117.35 115.76 3lrs s TYR 35 Ca 0.07 -0.13 -0.01 0.00 -1.01 0.00 0.00 57.07 55.99 3lrs s TYR 35 Cb -0.10 -0.44 -0.03 0.00 -0.11 0.00 0.00 41.96 41.28 3lrs s TYR 35 CO 0.04 -0.02 -0.04 -1.14 -1.11 0.00 0.00 175.55 173.28 3lrs s GLN 36 N -0.12 3.01 -0.23 -0.62 0.74 -0.23 -1.76 119.66 120.45 3lrs s GLN 36 Ca 0.02 -0.50 -0.02 0.00 0.05 0.00 0.00 55.36 54.91 3lrs s GLN 36 Cb -0.03 -2.72 0.07 0.00 1.10 0.00 0.00 33.01 31.42 3lrs s GLN 36 CO -0.00 0.59 0.04 -1.14 -0.55 0.00 0.00 175.29 174.23 3lrs s GLN 37 N -0.60 0.79 0.38 1.67 0.74 0.11 -0.28 119.66 122.47 3lrs s GLN 37 Ca 0.09 -0.65 -0.14 0.00 0.05 0.00 0.00 55.36 54.71 3lrs s GLN 37 Cb -0.12 -2.13 -0.08 0.00 1.10 0.00 0.00 33.01 31.78 3lrs s GLN 37 CO 0.02 -0.72 0.79 -1.12 -0.55 0.00 0.00 175.29 173.71 3lrs s SER 38 N 1.75 6.69 -0.01 6.67 0.01 -1.26 -1.40 113.70 126.15 3lrs s SER 38 Ca 0.01 1.29 -0.35 0.00 1.31 0.00 0.00 55.95 58.21 3lrs s SER 38 Cb -0.17 -2.38 -0.13 0.00 0.21 0.00 0.00 66.02 63.54 3lrs s SER 38 CO -0.12 -0.32 1.72 -2.65 0.41 0.00 0.00 173.24 172.27 3lrs n PRO 39 N -0.82 1.98 0.00 12.44 -0.02 -1.26 -1.27 135.00 146.05 3lrs n PRO 39 Ca 0.04 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 3lrs n PRO 39 Cb 0.54 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 3lrs n PRO 39 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3lrs n GLY 40 N 3.88 2.28 3.81 -1.23 0.00 -1.26 -5.01 105.19 107.66 3lrs n GLY 40 Ca 0.21 -0.46 -0.30 0.00 0.00 0.00 0.00 46.02 45.47 3lrs n GLY 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3lrs s LYS 41 N 0.00 0.12 0.34 1.61 1.02 -0.39 -5.08 119.74 117.35 3lrs s LYS 41 Ca 0.00 -0.21 0.04 0.00 0.02 0.00 0.00 55.97 55.82 3lrs s LYS 41 Cb 0.00 -1.77 -0.01 0.00 -0.52 0.00 0.00 37.83 35.53 3lrs s LYS 41 CO 0.00 -2.79 0.49 0.00 -0.92 0.00 0.00 175.35 172.13 3lrs s ALA 42 N -3.53 4.03 0.61 5.17 0.00 -1.26 -4.61 121.76 122.17 3lrs s ALA 42 Ca 0.72 -1.29 -0.20 0.00 0.00 0.00 0.00 51.96 51.19 3lrs s ALA 42 Cb -0.07 -1.81 -0.03 0.00 0.00 0.00 0.00 23.12 21.21 3lrs s ALA 42 CO 0.54 -0.04 1.33 -2.14 0.00 0.00 0.00 175.76 175.45 3lrs s PRO 43 N -4.22 2.79 -0.08 0.00 0.02 -1.26 -4.59 135.00 127.66 3lrs s PRO 43 Ca 0.43 2.16 0.00 0.00 0.02 0.00 0.00 61.00 63.61 3lrs s PRO 43 Cb -0.09 -2.02 0.02 0.00 0.02 0.00 0.00 34.50 32.43 3lrs s PRO 43 CO 0.32 -1.44 -0.06 0.21 -0.33 0.00 0.00 177.00 175.70 3lrs s LYS 44 N -3.18 1.16 0.33 5.54 2.20 0.61 -4.94 119.74 121.46 3lrs s LYS 44 Ca 0.78 -0.16 -0.29 0.00 -0.36 0.00 0.00 55.97 55.94 3lrs s LYS 44 Cb -0.39 -1.21 -0.11 0.00 -1.51 0.00 0.00 37.83 34.61 3lrs s LYS 44 CO 0.44 -0.17 1.56 0.08 -0.36 0.00 0.00 175.35 176.90 3lrs s VAL 45 N 1.36 2.04 -0.05 4.02 1.01 -1.26 -1.06 120.40 126.46 3lrs s VAL 45 Ca -0.03 0.03 0.03 0.00 0.00 0.00 0.00 61.98 62.01 3lrs s VAL 45 Cb -0.14 -3.02 -0.05 0.00 0.00 0.00 0.00 36.38 33.17 3lrs s VAL 45 CO -0.03 0.01 -0.00 0.23 0.00 0.00 0.00 175.10 175.30 3lrs n MET 46 N 1.52 2.45 -3.76 2.72 0.00 0.04 -4.87 117.12 115.22 3lrs n MET 46 Ca 0.05 0.01 -0.13 0.00 0.00 0.00 0.00 57.70 57.63 3lrs n MET 46 Cb 0.38 -1.12 -0.10 0.00 0.00 0.00 0.00 33.22 32.38 3lrs n MET 46 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 175.97 176.05 3lrs s VAL 47 N -2.11 0.02 0.15 2.03 1.01 -1.17 -4.36 120.40 115.97 3lrs s VAL 47 Ca -0.04 -0.17 -0.02 0.00 0.00 0.00 0.00 61.98 61.76 3lrs s VAL 47 Cb 0.02 -0.51 -0.04 0.00 0.00 0.00 0.00 36.38 35.85 3lrs s VAL 47 CO 0.17 -0.09 0.10 0.72 0.00 0.00 0.00 175.10 176.00 3lrs s PHE 48 N -0.34 0.88 -1.62 5.22 -0.12 -0.02 -0.41 117.98 121.57 3lrs s PHE 48 Ca -0.05 -1.22 -0.12 0.00 -0.05 0.00 0.00 56.93 55.50 3lrs s PHE 48 Cb -0.03 -0.45 0.10 0.00 -0.63 0.00 0.00 43.02 42.01 3lrs s PHE 48 CO 0.02 -0.57 0.58 -0.25 -0.05 0.00 0.00 175.22 174.95 3lrs n ASP 49 N -0.14 -1.84 0.00 1.98 8.00 -1.06 -1.55 116.55 121.94 3lrs n ASP 49 Ca -0.04 -1.06 0.00 0.00 0.71 0.00 0.00 54.79 54.40 3lrs n ASP 49 Cb 0.64 -2.61 0.00 0.00 -0.02 0.00 0.00 41.12 39.13 3lrs n ASP 49 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 3lrs n VAL 50 N -4.39 0.00 -0.38 2.53 0.31 0.54 -4.18 118.33 112.76 3lrs n VAL 50 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.25 3lrs n VAL 50 Cb 0.57 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.50 3lrs n VAL 50 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 3lrs n SER 51 N 3.65 1.19 -4.78 4.52 3.41 -1.16 -4.01 113.62 116.44 3lrs n SER 51 Ca 0.00 -1.57 -0.36 0.00 -0.26 0.00 0.00 58.87 56.68 3lrs n SER 51 Cb 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 63.87 3lrs n SER 51 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3lrs s HIS 52 N -0.57 3.41 -0.14 7.33 4.02 -0.60 -4.51 115.29 124.23 3lrs s HIS 52 Ca 0.00 0.35 -0.09 0.00 1.02 0.00 0.00 55.06 56.34 3lrs s HIS 52 Cb 0.00 -1.93 -0.05 0.00 -1.02 0.00 0.00 32.58 29.58 3lrs s HIS 52 CO 0.00 0.54 0.17 1.03 1.02 0.00 0.00 174.74 177.50 3lrs s ARG 53 N -0.67 3.82 0.81 1.40 0.52 -1.26 -0.84 118.95 122.73 3lrs s ARG 53 Ca 0.12 -0.09 -0.13 0.00 -0.52 0.00 0.00 55.73 55.11 3lrs s ARG 53 Cb -0.12 -3.30 0.09 0.00 0.52 0.00 0.00 34.95 32.14 3lrs s ARG 53 CO 0.02 0.55 1.20 -2.14 0.02 0.00 0.00 175.30 174.96 3lrs s PRO 54 N -0.40 1.59 0.12 3.54 0.02 -1.26 -4.93 135.00 133.68 3lrs s PRO 54 Ca 0.13 1.74 -0.34 0.00 0.02 0.00 0.00 61.00 62.56 3lrs s PRO 54 Cb -0.12 -1.77 -0.13 0.00 0.02 0.00 0.00 34.50 32.49 3lrs s PRO 54 CO 0.03 -2.24 1.66 0.45 -0.33 0.00 0.00 177.00 176.56 3lrs n SER 55 N -3.37 3.28 0.00 2.53 2.88 -1.26 -2.63 113.62 115.05 3lrs n SER 55 Ca 0.13 1.05 0.00 0.00 -1.33 0.00 0.00 58.87 58.73 3lrs n SER 55 Cb 0.51 -1.43 0.00 0.00 -0.75 0.00 0.00 64.21 62.53 3lrs n SER 55 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3lrs n GLY 56 N 3.68 3.22 3.72 0.46 0.00 -1.26 -5.06 105.19 109.96 3lrs n GLY 56 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 3lrs n GLY 56 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3lrs s ILE 57 N -2.82 4.67 0.79 -0.61 1.09 -1.08 -5.02 121.20 118.22 3lrs s ILE 57 Ca 0.00 2.04 -0.15 0.00 -1.10 0.00 0.00 60.65 61.44 3lrs s ILE 57 Cb 0.00 -4.31 -0.01 0.00 -1.06 0.00 0.00 42.46 37.08 3lrs s ILE 57 CO 0.00 0.26 0.59 -0.24 -0.10 0.00 0.00 174.94 175.44 3lrs n SER 58 N 3.24 -1.11 -0.02 3.58 2.88 -1.26 -4.89 113.62 116.04 3lrs n SER 58 Ca 0.03 0.53 0.15 0.00 -1.33 0.00 0.00 58.87 58.26 3lrs n SER 58 Cb 0.50 -1.25 0.77 0.00 -0.75 0.00 0.00 64.21 63.47 3lrs n SER 58 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 3lrs n ASN 59 N -0.89 0.09 0.27 -3.46 3.02 -1.26 -3.25 115.26 109.78 3lrs n ASN 59 Ca 0.10 -0.39 0.18 0.00 -0.03 0.00 0.00 54.58 54.44 3lrs n ASN 59 Cb 0.51 -0.19 0.77 0.00 -0.61 0.00 0.00 39.78 40.25 3lrs n ASN 59 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 3lrs h ARG 60 N 0.12 0.00 -5.14 3.52 3.08 -1.90 -3.42 114.38 110.64 3lrs h ARG 60 Ca 0.00 0.00 -0.62 0.00 0.07 0.00 0.00 59.98 59.43 3lrs h ARG 60 Cb 0.25 0.00 -0.14 0.00 0.08 0.00 0.00 29.97 30.15 3lrs h ARG 60 CO 0.00 0.00 -0.36 -0.06 -1.07 0.00 0.00 179.97 178.48 3lrs s PHE 61 N -3.72 3.29 0.02 3.04 0.40 -1.20 -1.53 117.98 118.29 3lrs s PHE 61 Ca 0.00 0.34 0.01 0.00 -0.60 0.00 0.00 56.93 56.68 3lrs s PHE 61 Cb 0.10 -2.43 -0.02 0.00 0.51 0.00 0.00 43.02 41.17 3lrs s PHE 61 CO 0.49 -0.08 -0.04 -1.54 0.70 0.00 0.00 175.22 174.75 3lrs s SER 62 N 1.37 0.38 0.11 1.36 1.04 -0.55 -4.93 113.70 112.48 3lrs s SER 62 Ca 0.12 -0.46 0.09 0.00 0.48 0.00 0.00 55.95 56.18 3lrs s SER 62 Cb -0.15 0.07 -0.04 0.00 0.10 0.00 0.00 66.02 66.00 3lrs s SER 62 CO 0.08 -0.24 -0.18 -0.83 0.98 0.00 0.00 173.24 173.05 3lrs s GLY 63 N -1.33 1.68 0.30 7.32 0.00 -1.26 -0.39 107.32 113.65 3lrs s GLY 63 Ca -0.13 -1.34 0.02 0.00 0.00 0.00 0.00 44.72 43.28 3lrs s GLY 63 CO -0.01 -1.31 0.30 -1.35 0.00 0.00 0.00 173.10 170.73 3lrs s SER 64 N -2.08 1.08 -0.01 1.64 1.04 -0.56 -4.34 113.70 110.48 3lrs s SER 64 Ca 0.18 -1.58 -0.13 0.00 0.48 0.00 0.00 55.95 54.90 3lrs s SER 64 Cb -0.11 0.54 0.02 0.00 0.10 0.00 0.00 66.02 66.58 3lrs s SER 64 CO 0.10 -1.07 0.27 -0.75 0.98 0.00 0.00 173.24 172.77 3lrs s LYS 65 N -3.54 0.64 -0.26 4.02 2.20 -1.26 -1.44 119.74 120.10 3lrs s LYS 65 Ca 0.37 -0.26 -0.02 0.00 -0.36 0.00 0.00 55.97 55.71 3lrs s LYS 65 Cb 0.03 0.28 0.14 0.00 -1.51 0.00 0.00 37.83 36.77 3lrs s LYS 65 CO 0.22 -0.17 0.41 0.45 -0.36 0.00 0.00 175.35 175.89 3lrs s SER 66 N -1.39 0.07 1.85 1.43 0.15 -0.60 -4.99 113.70 110.22 3lrs s SER 66 Ca -0.13 0.21 0.00 0.00 0.70 0.00 0.00 55.95 56.73 3lrs s SER 66 Cb -0.05 1.24 0.00 0.00 -1.71 0.00 0.00 66.02 65.49 3lrs s SER 66 CO 0.03 -0.30 0.00 0.61 1.20 0.00 0.00 173.24 174.78 3lrs n GLY 67 N 5.37 1.61 0.70 9.45 0.00 -1.26 -2.10 105.19 118.96 3lrs n GLY 67 Ca -0.03 0.29 0.07 0.00 0.00 0.00 0.00 46.02 46.35 3lrs n GLY 67 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3lrs n ASN 68 N 11.45 2.80 -4.05 1.61 3.02 -1.26 -3.87 115.26 124.95 3lrs n ASN 68 Ca 0.00 -1.85 -0.28 0.00 -0.03 0.00 0.00 54.58 52.42 3lrs n ASN 68 Cb 0.00 -0.19 -0.17 0.00 -0.61 0.00 0.00 39.78 38.82 3lrs n ASN 68 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3lrs s THR 69 N -1.05 1.47 0.35 3.41 -4.23 -0.89 -1.21 115.64 113.49 3lrs s THR 69 Ca 0.24 -0.63 -0.04 0.00 -1.18 0.00 0.00 61.69 60.08 3lrs s THR 69 Cb 0.14 -1.34 -0.05 0.00 1.34 0.00 0.00 72.50 72.59 3lrs s THR 69 CO 0.19 0.43 0.62 0.00 -0.54 0.00 0.00 174.62 175.32 3lrs s ALA 70 N 0.96 3.56 0.01 3.99 0.00 -0.47 -1.55 121.76 128.26 3lrs s ALA 70 Ca -0.07 -0.59 0.01 0.00 0.00 0.00 0.00 51.96 51.31 3lrs s ALA 70 Cb -0.15 -2.36 -0.01 0.00 0.00 0.00 0.00 23.12 20.60 3lrs s ALA 70 CO -0.01 0.04 -0.03 -1.12 0.00 0.00 0.00 175.76 174.63 3lrs s SER 71 N -3.54 0.36 -0.17 0.00 0.01 -0.52 -0.58 113.70 109.25 3lrs s SER 71 Ca 0.45 -0.27 -0.00 0.00 1.31 0.00 0.00 55.95 57.43 3lrs s SER 71 Cb -0.10 0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.15 3lrs s SER 71 CO 0.34 -0.11 -0.14 -0.22 0.41 0.00 0.00 173.24 173.52 3lrs s LEU 72 N -0.74 2.49 -0.17 2.44 2.96 -0.49 -1.50 118.68 123.67 3lrs s LEU 72 Ca -0.06 -0.49 -0.04 0.00 -0.22 0.00 0.00 54.13 53.31 3lrs s LEU 72 Cb -0.05 -1.58 -0.03 0.00 0.50 0.00 0.00 46.19 45.03 3lrs s LEU 72 CO -0.00 0.05 -0.02 -0.89 -1.32 0.00 0.00 176.35 174.17 3lrs s THR 73 N 1.03 4.00 -0.29 3.68 2.01 0.48 -0.94 115.64 125.61 3lrs s THR 73 Ca -0.01 -0.31 0.00 0.00 0.31 0.00 0.00 61.69 61.68 3lrs s THR 73 Cb -0.15 -2.77 0.06 0.00 0.01 0.00 0.00 72.50 69.65 3lrs s THR 73 CO -0.03 0.47 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.70 3lrs s ILE 74 N 0.53 2.68 0.18 1.82 1.01 0.11 -1.48 121.20 126.05 3lrs s ILE 74 Ca -0.02 -1.50 0.03 0.00 0.00 0.00 0.00 60.65 59.16 3lrs s ILE 74 Cb -0.14 -2.56 -0.03 0.00 0.01 0.00 0.00 42.46 39.73 3lrs s ILE 74 CO 0.02 -0.09 0.32 -0.94 0.00 0.00 0.00 174.94 174.25 3lrs s SER 75 N 1.20 6.34 -1.16 3.58 1.04 -0.58 -1.63 113.70 122.48 3lrs s SER 75 Ca -0.06 0.17 -0.10 0.00 0.48 0.00 0.00 55.95 56.44 3lrs s SER 75 Cb -0.20 -1.91 -0.02 0.00 0.10 0.00 0.00 66.02 63.99 3lrs s SER 75 CO -0.03 0.00 0.81 0.61 0.98 0.00 0.00 173.24 175.62 3lrs n GLY 76 N -0.82 -0.82 3.63 7.32 0.00 -1.07 -4.78 105.19 108.66 3lrs n GLY 76 Ca -0.07 0.39 -0.54 0.00 0.00 0.00 0.00 46.02 45.79 3lrs n GLY 76 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3lrs n LEU 77 N -3.91 1.86 -4.73 0.99 4.77 -0.56 -4.39 117.00 111.02 3lrs n LEU 77 Ca -0.15 1.11 -0.24 0.00 -0.03 0.00 0.00 56.01 56.69 3lrs n LEU 77 Cb 0.63 -1.17 -0.06 0.00 -2.33 0.00 0.00 43.42 40.49 3lrs n LEU 77 CO 0.65 -0.86 -0.26 -1.00 -1.33 0.00 0.00 177.39 174.59 3lrs s HIS 78 N 1.52 2.93 0.32 -1.77 3.76 -1.26 0.09 115.29 120.89 3lrs s HIS 78 Ca 0.89 -0.14 0.02 0.00 -0.15 0.00 0.00 55.06 55.69 3lrs s HIS 78 Cb -1.00 -1.35 0.60 0.00 1.11 0.00 0.00 32.58 31.94 3lrs s HIS 78 CO 0.54 0.55 1.93 0.82 -0.85 0.00 0.00 174.74 177.73 3lrs h ILE 79 N 1.88 1.06 0.00 0.60 1.08 -1.95 -1.30 117.51 118.89 3lrs h ILE 79 Ca -0.47 -0.32 0.00 0.00 -0.39 0.00 0.00 64.86 63.68 3lrs h ILE 79 Cb 1.23 0.04 0.00 0.00 -3.07 0.00 0.00 36.82 35.02 3lrs h ILE 79 CO 0.60 0.17 0.00 -1.84 -0.69 0.00 0.00 178.15 176.39 3lrs n GLU 80 N -4.48 0.23 0.22 2.37 0.00 -1.26 -1.54 120.64 116.19 3lrs n GLU 80 Ca 0.12 0.13 0.12 0.00 0.00 0.00 0.00 57.16 57.53 3lrs n GLU 80 Cb 0.19 -1.50 0.29 0.00 0.00 0.00 0.00 31.44 30.42 3lrs n GLU 80 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 3lrs h ASP 81 N 0.00 0.00 -3.13 -1.84 3.32 -1.64 -3.46 116.42 109.67 3lrs h ASP 81 Ca 0.00 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.47 3lrs h ASP 81 Cb 0.11 0.00 0.14 0.00 0.22 0.00 0.00 39.33 39.80 3lrs h ASP 81 CO 0.00 0.10 0.08 -0.62 -1.72 0.00 0.00 179.24 177.07 3lrs n GLU 82 N -3.15 1.14 -1.02 3.56 1.02 -0.59 -4.88 120.64 116.73 3lrs n GLU 82 Ca 0.03 0.42 0.00 0.00 -0.02 0.00 0.00 57.16 57.58 3lrs n GLU 82 Cb 0.50 -2.01 0.00 0.00 -0.02 0.00 0.00 31.44 29.91 3lrs n GLU 82 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3lrs n GLY 83 N 1.29 0.30 3.74 0.62 0.00 -1.07 -4.75 105.19 105.32 3lrs n GLY 83 Ca 0.11 -1.75 -0.35 0.00 0.00 0.00 0.00 46.02 44.02 3lrs n GLY 83 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3lrs s ASP 84 N -3.01 6.27 -0.10 1.61 1.01 -0.49 -1.15 116.67 120.81 3lrs s ASP 84 Ca 0.00 0.30 -0.02 0.00 0.71 0.00 0.00 52.55 53.54 3lrs s ASP 84 Cb 0.00 -2.11 -0.03 0.00 1.01 0.00 0.00 42.92 41.79 3lrs s ASP 84 CO 0.00 0.17 -0.00 -0.31 0.21 0.00 0.00 175.17 175.24 3lrs s TYR 85 N 0.33 3.14 -0.05 4.23 1.51 -0.08 -0.71 117.35 125.72 3lrs s TYR 85 Ca 0.10 0.12 0.03 0.00 -1.01 0.00 0.00 57.07 56.31 3lrs s TYR 85 Cb -0.11 -1.82 0.01 0.00 -0.11 0.00 0.00 41.96 39.92 3lrs s TYR 85 CO -0.00 0.38 -0.14 -0.06 -1.11 0.00 0.00 175.55 174.62 3lrs s PHE 86 N -0.65 1.52 0.76 2.71 0.08 -0.72 -1.03 117.98 120.65 3lrs s PHE 86 Ca 0.10 -0.50 -0.05 0.00 0.12 0.00 0.00 56.93 56.60 3lrs s PHE 86 Cb -0.12 -1.07 0.12 0.00 -0.57 0.00 0.00 43.02 41.38 3lrs s PHE 86 CO 0.02 -0.22 1.06 0.00 -0.10 0.00 0.00 175.22 175.98 3lrs s SER 88 N -4.70 -0.40 0.04 0.00 0.15 -0.05 -2.44 113.70 106.30 3lrs s SER 88 Ca 0.66 0.50 -0.00 0.00 0.70 0.00 0.00 55.95 57.81 3lrs s SER 88 Cb -0.07 0.42 -0.03 0.00 -1.71 0.00 0.00 66.02 64.63 3lrs s SER 88 CO 0.46 -0.32 -0.04 -0.55 1.20 0.00 0.00 173.24 173.99 3lrs s SER 89 N -0.87 0.50 0.65 5.45 0.15 -0.24 -1.03 113.70 118.32 3lrs s SER 89 Ca -0.01 -0.77 -0.17 0.00 0.70 0.00 0.00 55.95 55.70 3lrs s SER 89 Cb -0.01 0.14 -0.01 0.00 -1.71 0.00 0.00 66.02 64.43 3lrs s SER 89 CO 0.01 -0.43 1.17 -0.22 1.20 0.00 0.00 173.24 174.96 3lrs s LEU 90 N -2.26 3.49 0.29 3.45 2.96 -1.19 -1.35 118.68 124.07 3lrs s LEU 90 Ca -0.03 2.24 0.06 0.00 -0.22 0.00 0.00 54.13 56.18 3lrs s LEU 90 Cb -0.01 -4.58 -0.06 0.00 0.50 0.00 0.00 46.19 42.04 3lrs s LEU 90 CO -0.05 -1.76 -0.03 0.42 -1.32 0.00 0.00 176.35 173.61 3lrs s THR 91 N -1.94 1.53 -1.44 3.68 -4.23 -0.70 -4.45 115.64 108.08 3lrs s THR 91 Ca 0.73 -2.09 0.03 0.00 -1.18 0.00 0.00 61.69 59.18 3lrs s THR 91 Cb -0.26 -2.54 0.13 0.00 1.34 0.00 0.00 72.50 71.16 3lrs s THR 91 CO 0.38 -0.23 0.91 -0.90 -0.54 0.00 0.00 174.62 174.24 3lrs n ASP 92 N -0.61 1.25 -0.70 3.99 3.85 0.03 -0.41 116.55 123.94 3lrs n ASP 92 Ca -0.05 -2.08 0.06 0.00 -0.71 0.00 0.00 54.79 52.02 3lrs n ASP 92 Cb 0.64 -0.31 0.18 0.00 -1.35 0.00 0.00 41.12 40.28 3lrs n ASP 92 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 3lrs n ARG 93 N -0.01 2.90 -3.12 0.11 1.74 -1.26 -4.97 116.66 112.04 3lrs n ARG 93 Ca 0.05 -2.25 -0.22 0.00 -0.77 0.00 0.00 57.85 54.66 3lrs n ARG 93 Cb 0.26 -1.42 0.04 0.00 -1.02 0.00 0.00 32.46 30.33 3lrs n ARG 93 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 3lrs n SER 94 N 0.24 -6.01 -3.92 0.55 7.64 0.45 -5.01 113.62 107.56 3lrs n SER 94 Ca 0.14 -0.33 -0.18 0.00 1.01 0.00 0.00 58.87 59.51 3lrs n SER 94 Cb 0.55 -4.78 -0.00 0.00 -1.01 0.00 0.00 64.21 58.96 3lrs n SER 94 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 3lrs n HIS 95 N -4.57 -0.70 -4.38 1.43 -0.00 -1.24 -4.91 115.22 100.84 3lrs n HIS 95 Ca -0.08 -1.60 -0.28 0.00 -0.00 0.00 0.00 57.72 55.77 3lrs n HIS 95 Cb 0.60 -0.30 -0.13 0.00 -0.00 0.00 0.00 29.99 30.17 3lrs n HIS 95 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 3lrs s ARG 95 N -3.50 1.34 -0.01 -0.41 1.81 -1.26 -1.72 118.95 115.19 3lrs s ARG 95 Ca 0.19 -1.29 0.02 0.00 -1.72 0.00 0.00 55.73 52.92 3lrs s ARG 95 Cb -0.02 -1.77 -0.00 0.00 -0.45 0.00 0.00 34.95 32.72 3lrs s ARG 95 CO 0.12 0.42 -0.05 -1.50 -0.68 0.00 0.00 175.30 173.61 3lrs s ILE 96 N -1.08 0.41 0.08 1.52 1.10 -0.46 -4.95 121.20 117.83 3lrs s ILE 96 Ca 0.12 -0.21 0.04 0.00 -0.51 0.00 0.00 60.65 60.09 3lrs s ILE 96 Cb -0.10 -0.36 -0.04 0.00 0.15 0.00 0.00 42.46 42.11 3lrs s ILE 96 CO 0.05 0.13 0.03 -0.36 -2.11 0.00 0.00 174.94 172.68 3lrs s PHE 97 N -0.02 3.08 0.74 3.50 0.08 -1.26 -1.07 117.98 123.02 3lrs s PHE 97 Ca 0.01 0.02 -0.11 0.00 0.12 0.00 0.00 56.93 56.96 3lrs s PHE 97 Cb -0.03 -1.58 0.03 0.00 -0.57 0.00 0.00 43.02 40.87 3lrs s PHE 97 CO -0.00 0.50 1.09 0.20 -0.10 0.00 0.00 175.22 176.90 3lrs s GLY 98 N -2.32 1.63 0.29 4.36 0.00 -1.02 -2.57 107.32 107.70 3lrs s GLY 98 Ca 0.27 -0.23 0.24 0.00 0.00 0.00 0.00 44.72 45.00 3lrs s GLY 98 CO 0.20 0.15 1.72 -1.33 0.00 0.00 0.00 173.10 173.84 3lrs h GLY 99 N -0.81 0.00 0.00 0.20 0.00 -1.74 -3.44 103.07 97.27 3lrs h GLY 99 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 3lrs h GLY 99 CO 0.61 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.76 3lrs n GLY 100 N -0.26 0.84 2.83 4.60 0.00 -1.26 -5.03 105.19 106.91 3lrs n GLY 100 Ca 0.01 -1.71 -0.22 0.00 0.00 0.00 0.00 46.02 44.10 3lrs n GLY 100 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3lrs s THR 101 N -2.84 0.50 -0.38 2.61 2.01 -0.19 -4.47 115.64 112.88 3lrs s THR 101 Ca 0.00 -0.02 -0.27 0.00 0.31 0.00 0.00 61.69 61.72 3lrs s THR 101 Cb 0.00 -0.58 0.02 0.00 0.01 0.00 0.00 72.50 71.94 3lrs s THR 101 CO 0.00 0.25 0.97 -0.75 -0.69 0.00 0.00 174.62 174.41 3lrs s LYS 102 N 1.49 3.85 -0.17 4.92 2.20 -0.49 -0.90 119.74 130.64 3lrs s LYS 102 Ca -0.02 0.64 -0.18 0.00 -0.36 0.00 0.00 55.97 56.04 3lrs s LYS 102 Cb -0.13 -3.81 -0.04 0.00 -1.51 0.00 0.00 37.83 32.34 3lrs s LYS 102 CO -0.03 -1.00 0.50 0.08 -0.36 0.00 0.00 175.35 174.54 3lrs s VAL 103 N 3.62 5.14 -0.01 4.02 1.01 -0.30 -1.71 120.40 132.18 3lrs s VAL 103 Ca 0.40 0.95 0.03 0.00 0.00 0.00 0.00 61.98 63.36 3lrs s VAL 103 Cb -0.11 -3.83 -0.03 0.00 0.00 0.00 0.00 36.38 32.40 3lrs s VAL 103 CO 0.20 0.24 -0.07 -0.89 0.00 0.00 0.00 175.10 174.58 3lrs s THR 104 N 1.23 3.63 -0.60 3.92 2.01 -0.82 -2.58 115.64 122.43 3lrs s THR 104 Ca 0.25 -0.73 -0.09 0.00 0.31 0.00 0.00 61.69 61.43 3lrs s THR 104 Cb -0.15 -2.56 0.15 0.00 0.01 0.00 0.00 72.50 69.95 3lrs s THR 104 CO 0.10 0.43 0.48 -0.69 -0.69 0.00 0.00 174.62 174.24 3lrs s VAL 105 N -0.96 4.45 0.13 3.82 1.01 -1.26 -2.09 120.40 125.50 3lrs s VAL 105 Ca 0.16 -2.24 -0.35 0.00 0.00 0.00 0.00 61.98 59.55 3lrs s VAL 105 Cb -0.11 -3.87 -0.15 0.00 0.00 0.00 0.00 36.38 32.25 3lrs s VAL 105 CO 0.06 -0.87 1.39 0.18 0.00 0.00 0.00 175.10 175.87 3lrs n LEU 106 N 4.33 2.18 0.00 3.92 4.77 -0.65 -4.88 117.00 126.68 3lrs n LEU 106 Ca 0.01 1.11 0.00 0.00 -0.03 0.00 0.00 56.01 57.10 3lrs n LEU 106 Cb 0.41 -1.28 0.00 0.00 -2.33 0.00 0.00 43.42 40.22 3lrs n LEU 106 CO 0.39 -0.81 0.03 0.61 -1.33 0.00 0.00 177.39 176.28 3lrs n GLY 107 N 2.69 0.67 3.19 -0.72 0.00 -1.26 -4.46 105.19 105.30 3lrs n GLY 107 Ca 0.17 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.10 3lrs n GLY 107 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3lrs s GLN 108 N -0.36 0.93 0.45 1.61 -2.07 -1.26 -5.15 119.66 113.81 3lrs s GLN 108 Ca 0.00 -1.30 -0.23 0.00 -1.82 0.00 0.00 55.36 52.01 3lrs s GLN 108 Cb 0.00 0.28 -0.11 0.00 -1.09 0.00 0.00 33.01 32.10 3lrs s GLN 108 CO 0.00 -0.28 0.81 -2.30 -1.32 0.00 0.00 175.29 172.20 3lrs n PRO 109 N -0.09 0.97 -1.74 9.60 -0.02 -1.26 -4.93 135.00 137.53 3lrs n PRO 109 Ca -0.08 0.35 -0.42 0.00 -2.02 0.00 0.00 63.50 61.34 3lrs n PRO 109 Cb 0.63 -1.84 -0.01 0.00 -0.02 0.00 0.00 33.50 32.26 3lrs n PRO 109 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 3lrs n LYS 110 N 0.17 2.50 -3.70 -0.52 4.81 -1.26 -4.81 118.16 115.34 3lrs n LYS 110 Ca 0.11 0.88 -0.19 0.00 -0.87 0.00 0.00 58.31 58.24 3lrs n LYS 110 Cb 0.40 -2.57 -0.17 0.00 0.02 0.00 0.00 35.03 32.71 3lrs n LYS 110 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3lrs s ALA 111 N -0.85 0.20 0.47 3.14 0.00 -0.64 -4.95 121.76 119.14 3lrs s ALA 111 Ca 0.57 0.21 -0.18 0.00 0.00 0.00 0.00 51.96 52.55 3lrs s ALA 111 Cb -0.51 -0.52 -0.09 0.00 0.00 0.00 0.00 23.12 21.99 3lrs s ALA 111 CO 0.60 -0.38 0.97 0.00 0.00 0.00 0.00 175.76 176.94 3lrs s ALA 112 N 1.86 3.06 0.38 0.00 0.00 -1.26 -0.74 121.76 125.05 3lrs s ALA 112 Ca 0.01 0.27 -0.27 0.00 0.00 0.00 0.00 51.96 51.98 3lrs s ALA 112 Cb -0.12 -3.13 -0.11 0.00 0.00 0.00 0.00 23.12 19.76 3lrs s ALA 112 CO -0.03 -0.06 1.25 -2.30 0.00 0.00 0.00 175.76 174.62 3lrs n PRO 113 N -1.15 1.96 -3.72 0.00 -0.02 -1.26 -4.31 135.00 126.50 3lrs n PRO 113 Ca 0.07 0.69 -0.38 0.00 -2.02 0.00 0.00 63.50 61.86 3lrs n PRO 113 Cb 0.54 -2.31 -0.12 0.00 -0.02 0.00 0.00 33.50 31.59 3lrs n PRO 113 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3lrs s SER 114 N -0.44 5.27 -0.07 2.55 0.15 -0.50 -4.93 113.70 115.73 3lrs s SER 114 Ca 0.58 -0.63 0.04 0.00 0.70 0.00 0.00 55.95 56.64 3lrs s SER 114 Cb -0.55 -1.92 -0.02 0.00 -1.71 0.00 0.00 66.02 61.82 3lrs s SER 114 CO 0.60 -0.19 -0.18 0.54 1.20 0.00 0.00 173.24 175.22 3lrs s VAL 115 N 1.54 2.73 -0.06 4.45 0.11 -1.26 -2.35 120.40 125.56 3lrs s VAL 115 Ca 0.03 -0.83 0.02 0.00 -2.93 0.00 0.00 61.98 58.27 3lrs s VAL 115 Cb -0.17 -2.06 0.02 0.00 -1.53 0.00 0.00 36.38 32.63 3lrs s VAL 115 CO 0.04 0.57 -0.10 -0.89 -3.33 0.00 0.00 175.10 171.39 3lrs s THR 116 N -0.36 0.95 -0.14 5.04 2.01 -0.67 -4.92 115.64 117.55 3lrs s THR 116 Ca 0.03 -0.36 0.02 0.00 0.31 0.00 0.00 61.69 61.69 3lrs s THR 116 Cb -0.12 -0.90 0.00 0.00 0.01 0.00 0.00 72.50 71.49 3lrs s THR 116 CO 0.02 0.32 -0.20 -0.22 -0.69 0.00 0.00 174.62 173.85 3lrs s LEU 117 N 0.82 2.25 -0.04 4.42 2.96 -1.26 -0.98 118.68 126.84 3lrs s LEU 117 Ca -0.12 -0.54 -0.01 0.00 -0.22 0.00 0.00 54.13 53.23 3lrs s LEU 117 Cb -0.15 -1.48 -0.04 0.00 0.50 0.00 0.00 46.19 45.02 3lrs s LEU 117 CO 0.02 0.10 0.06 -0.36 -1.32 0.00 0.00 176.35 174.85 3lrs s PHE 118 N 0.70 3.27 0.89 5.38 0.08 -0.09 -4.89 117.98 123.32 3lrs s PHE 118 Ca -0.09 0.23 -0.13 0.00 0.12 0.00 0.00 56.93 57.06 3lrs s PHE 118 Cb -0.16 -1.77 0.15 0.00 -0.57 0.00 0.00 43.02 40.68 3lrs s PHE 118 CO 0.01 0.54 1.24 -2.14 -0.10 0.00 0.00 175.22 174.78 3lrs s PRO 119 N -1.43 1.15 0.29 0.24 0.02 -1.26 -2.20 135.00 131.82 3lrs s PRO 119 Ca 0.19 -0.32 -0.30 0.00 0.02 0.00 0.00 61.00 60.59 3lrs s PRO 119 Cb -0.12 -1.93 -0.11 0.00 0.02 0.00 0.00 34.50 32.36 3lrs s PRO 119 CO 0.10 -2.06 1.62 -2.14 -0.33 0.00 0.00 177.00 174.18 3lrs s PRO 120 N -5.71 4.11 0.74 5.54 0.02 -1.25 -4.77 135.00 133.68 3lrs s PRO 120 Ca 0.69 2.60 -0.15 0.00 0.02 0.00 0.00 61.00 64.16 3lrs s PRO 120 Cb -0.06 -3.02 0.01 0.00 0.02 0.00 0.00 34.50 31.45 3lrs s PRO 120 CO 0.51 -0.66 0.94 -1.13 -0.33 0.00 0.00 177.00 176.33 3lrs n SER 121 N 2.28 0.33 -0.08 2.53 3.41 -1.26 -4.85 113.62 115.98 3lrs n SER 121 Ca 0.09 0.64 0.16 0.00 -0.26 0.00 0.00 58.87 59.50 3lrs n SER 121 Cb 0.37 -1.40 0.58 0.00 -0.26 0.00 0.00 64.21 63.50 3lrs n SER 121 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3lrs h SER 122 N -0.40 0.23 0.93 4.04 0.02 -2.00 -2.89 113.55 113.49 3lrs h SER 122 Ca -0.47 0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 60.39 3lrs h SER 122 Cb 1.33 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.81 3lrs h SER 122 CO 0.46 0.13 -1.13 -0.33 -1.14 0.00 0.00 176.83 174.81 3lrs h GLU 123 N 0.25 0.00 -0.08 3.45 5.08 -1.98 -2.50 114.58 118.80 3lrs h GLU 123 Ca 0.30 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.59 3lrs h GLU 123 Cb 0.83 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.08 3lrs h GLU 123 CO -0.06 0.22 -0.21 1.49 -1.00 0.00 0.00 179.01 179.44 3lrs h GLU 124 N 0.00 0.29 -0.88 2.33 4.81 -1.79 -1.91 114.58 117.42 3lrs h GLU 124 Ca -0.09 -0.20 0.06 0.00 -0.13 0.00 0.00 59.36 59.00 3lrs h GLU 124 Cb 1.37 0.03 -0.06 0.00 0.63 0.00 0.00 28.75 30.72 3lrs h GLU 124 CO 0.03 0.81 0.58 -0.07 -0.73 0.00 0.00 179.01 179.63 3lrs h LEU 125 N -0.19 0.89 -1.45 1.64 3.38 -1.38 0.33 115.31 118.53 3lrs h LEU 125 Ca -0.00 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.98 3lrs h LEU 125 Cb 0.82 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 3lrs h LEU 125 CO 0.05 0.57 0.38 1.56 0.09 0.00 0.00 178.44 181.09 3lrs h GLN 126 N 1.01 0.73 -0.70 1.13 4.20 -1.38 -0.99 115.11 119.11 3lrs h GLN 126 Ca 0.38 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 59.04 3lrs h GLN 126 Cb 0.18 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 27.80 3lrs h GLN 126 CO -0.14 0.48 0.00 0.00 -0.67 0.00 0.00 178.83 178.50 3lrs n ALA 127 N -2.45 2.86 -2.22 3.87 0.00 0.11 -4.89 120.51 117.78 3lrs n ALA 127 Ca 0.06 -0.64 -0.15 0.00 0.00 0.00 0.00 53.44 52.71 3lrs n ALA 127 Cb 0.07 -1.03 -0.01 0.00 0.00 0.00 0.00 19.45 18.48 3lrs n ALA 127 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3lrs n ASN 128 N 0.25 -4.60 -4.09 0.00 2.85 -0.38 -5.00 115.26 104.30 3lrs n ASN 128 Ca 0.10 0.02 -0.07 0.00 -0.11 0.00 0.00 54.58 54.51 3lrs n ASN 128 Cb 0.50 -3.71 -0.10 0.00 1.24 0.00 0.00 39.78 37.71 3lrs n ASN 128 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 3lrs s LYS 129 N -4.65 0.60 -0.02 1.20 1.02 -0.76 -4.58 119.74 112.57 3lrs s LYS 129 Ca 0.00 -1.20 0.01 0.00 0.02 0.00 0.00 55.97 54.80 3lrs s LYS 129 Cb 0.00 0.21 0.01 0.00 -0.52 0.00 0.00 37.83 37.53 3lrs s LYS 129 CO 0.00 -0.11 -0.02 0.00 -0.92 0.00 0.00 175.35 174.30 3lrs s ALA 130 N -3.86 0.33 -0.05 5.17 0.00 -0.77 -2.34 121.76 120.24 3lrs s ALA 130 Ca 0.06 -0.01 -0.02 0.00 0.00 0.00 0.00 51.96 52.00 3lrs s ALA 130 Cb 0.08 -0.20 0.03 0.00 0.00 0.00 0.00 23.12 23.03 3lrs s ALA 130 CO -0.10 0.01 0.05 0.99 0.00 0.00 0.00 175.76 176.71 3lrs s THR 131 N 0.44 -0.01 -0.00 0.00 2.01 -1.26 -0.62 115.64 116.19 3lrs s THR 131 Ca -0.04 0.37 -0.23 0.00 0.31 0.00 0.00 61.69 62.09 3lrs s THR 131 Cb -0.07 -0.23 -0.05 0.00 0.01 0.00 0.00 72.50 72.16 3lrs s THR 131 CO -0.01 0.20 0.68 -0.76 -0.69 0.00 0.00 174.62 174.03 3lrs s LEU 132 N 2.12 4.40 -0.28 4.42 1.43 -0.04 -3.75 118.68 126.99 3lrs s LEU 132 Ca 0.05 1.26 -0.01 0.00 -1.03 0.00 0.00 54.13 54.40 3lrs s LEU 132 Cb -0.12 -3.06 0.04 0.00 0.03 0.00 0.00 46.19 43.08 3lrs s LEU 132 CO -0.03 0.02 -0.03 -0.69 0.23 0.00 0.00 176.35 175.85 3lrs s VAL 133 N 0.08 2.90 -0.28 -1.59 1.01 -0.93 -1.67 120.40 119.92 3lrs s VAL 133 Ca 0.35 -1.27 -0.04 0.00 0.00 0.00 0.00 61.98 61.02 3lrs s VAL 133 Cb -0.19 -2.60 0.02 0.00 0.00 0.00 0.00 36.38 33.61 3lrs s VAL 133 CO 0.19 0.00 0.01 0.00 0.00 0.00 0.00 175.10 175.31 3lrs s LEU 135 N 1.40 2.68 -0.07 0.00 1.43 -0.16 -0.47 118.68 123.49 3lrs s LEU 135 Ca 0.01 -0.33 0.02 0.00 -1.03 0.00 0.00 54.13 52.79 3lrs s LEU 135 Cb -0.17 -1.60 0.02 0.00 0.03 0.00 0.00 46.19 44.47 3lrs s LEU 135 CO -0.01 0.18 -0.10 -0.63 0.23 0.00 0.00 176.35 176.02 3lrs s ILE 136 N 0.27 1.00 0.22 -0.59 1.01 0.12 -1.67 121.20 121.55 3lrs s ILE 136 Ca -0.10 -0.37 -0.10 0.00 0.00 0.00 0.00 60.65 60.08 3lrs s ILE 136 Cb -0.16 -0.95 -0.01 0.00 0.01 0.00 0.00 42.46 41.35 3lrs s ILE 136 CO 0.06 0.33 0.37 -0.94 0.00 0.00 0.00 174.94 174.76 3lrs s SER 137 N 0.91 -0.02 -1.34 3.58 1.04 -0.99 -0.43 113.70 116.44 3lrs s SER 137 Ca -0.10 -1.00 -0.03 0.00 0.48 0.00 0.00 55.95 55.30 3lrs s SER 137 Cb -0.15 0.51 0.02 0.00 0.10 0.00 0.00 66.02 66.50 3lrs s SER 137 CO 0.01 -1.02 0.22 0.47 0.98 0.00 0.00 173.24 173.90 3lrs n ASP 138 N -0.32 -4.70 -4.85 7.02 8.00 -0.76 -1.41 116.55 119.52 3lrs n ASP 138 Ca -0.02 -0.06 -0.22 0.00 0.71 0.00 0.00 54.79 55.20 3lrs n ASP 138 Cb 0.63 -3.91 -0.04 0.00 -0.02 0.00 0.00 41.12 37.79 3lrs n ASP 138 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 3lrs s PHE 139 N -2.87 3.09 -0.28 1.24 -0.12 -1.15 -4.37 117.98 113.51 3lrs s PHE 139 Ca 0.14 -0.16 -0.18 0.00 -0.05 0.00 0.00 56.93 56.69 3lrs s PHE 139 Cb -0.07 -1.54 0.11 0.00 -0.63 0.00 0.00 43.02 40.89 3lrs s PHE 139 CO 0.18 0.41 0.86 -0.47 -0.05 0.00 0.00 175.22 176.14 3lrs s TYR 140 N -2.17 -0.76 0.81 3.49 6.14 0.08 -0.75 117.35 124.20 3lrs s TYR 140 Ca 0.35 1.58 -0.12 0.00 0.64 0.00 0.00 57.07 59.52 3lrs s TYR 140 Cb -0.07 0.44 0.09 0.00 0.42 0.00 0.00 41.96 42.84 3lrs s TYR 140 CO 0.26 -0.37 1.17 -1.25 0.64 0.00 0.00 175.55 175.99 3lrs s PRO 141 N 1.19 1.67 -0.91 4.97 0.04 -1.26 -1.62 135.00 139.08 3lrs s PRO 141 Ca -0.07 1.60 -0.06 0.00 0.04 0.00 0.00 61.00 62.51 3lrs s PRO 141 Cb -0.04 -1.80 -0.09 0.00 0.04 0.00 0.00 34.50 32.61 3lrs s PRO 141 CO -0.14 -2.16 2.42 0.41 0.04 0.00 0.00 177.00 177.58 3lrs n GLY 142 N 0.12 3.25 2.80 0.56 0.00 -1.26 -4.77 105.19 105.89 3lrs n GLY 142 Ca 0.12 -1.00 -0.18 0.00 0.00 0.00 0.00 46.02 44.96 3lrs n GLY 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3lrs s ALA 143 N 2.77 0.35 0.16 4.61 0.00 -1.26 -4.76 121.76 123.63 3lrs s ALA 143 Ca 0.48 0.13 -0.02 0.00 0.00 0.00 0.00 51.96 52.56 3lrs s ALA 143 Cb 0.14 -0.39 -0.04 0.00 0.00 0.00 0.00 23.12 22.83 3lrs s ALA 143 CO -0.03 -0.15 0.12 0.14 0.00 0.00 0.00 175.76 175.83 3lrs s VAL 144 N 1.22 0.06 -0.08 0.00 -7.23 -1.26 -4.56 120.40 108.55 3lrs s VAL 144 Ca -0.07 -1.89 0.02 0.00 -1.81 0.00 0.00 61.98 58.23 3lrs s VAL 144 Cb -0.13 -2.21 0.01 0.00 0.56 0.00 0.00 36.38 34.61 3lrs s VAL 144 CO -0.02 -0.25 -0.13 -0.89 -0.31 0.00 0.00 175.10 173.50 3lrs s THR 145 N -4.08 1.24 -0.13 5.32 2.01 -0.57 -5.00 115.64 114.43 3lrs s THR 145 Ca 0.29 -0.51 -0.02 0.00 0.31 0.00 0.00 61.69 61.76 3lrs s THR 145 Cb 0.07 -1.15 -0.02 0.00 0.01 0.00 0.00 72.50 71.41 3lrs s THR 145 CO 0.06 0.39 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.61 3lrs s VAL 146 N 0.88 3.52 -0.06 3.82 1.01 -1.26 -0.80 120.40 127.51 3lrs s VAL 146 Ca -0.10 -0.50 0.02 0.00 0.00 0.00 0.00 61.98 61.41 3lrs s VAL 146 Cb -0.15 -2.51 0.01 0.00 0.00 0.00 0.00 36.38 33.73 3lrs s VAL 146 CO 0.01 0.52 -0.12 0.00 0.00 0.00 0.00 175.10 175.50 3lrs s ALA 147 N 0.21 1.26 -0.06 5.51 0.00 0.66 -4.98 121.76 124.37 3lrs s ALA 147 Ca -0.05 -0.43 -0.00 0.00 0.00 0.00 0.00 51.96 51.48 3lrs s ALA 147 Cb -0.14 -0.55 -0.03 0.00 0.00 0.00 0.00 23.12 22.39 3lrs s ALA 147 CO 0.04 0.13 -0.02 -1.58 0.00 0.00 0.00 175.76 174.33 3lrs s TRP 148 N 0.60 3.07 -0.03 0.00 0.52 -1.26 -0.70 118.94 121.14 3lrs s TRP 148 Ca -0.13 0.12 0.02 0.00 0.02 0.00 0.00 56.10 56.12 3lrs s TRP 148 Cb -0.15 -1.74 0.01 0.00 -1.15 0.00 0.00 33.47 30.44 3lrs s TRP 148 CO 0.04 0.43 -0.07 0.15 0.02 0.00 0.00 176.95 177.51 3lrs s LYS 149 N -0.99 0.88 -0.35 4.98 1.02 -0.62 -0.75 119.74 123.91 3lrs s LYS 149 Ca 0.14 -0.23 -0.15 0.00 0.02 0.00 0.00 55.97 55.76 3lrs s LYS 149 Cb -0.11 -0.83 -0.01 0.00 -0.52 0.00 0.00 37.83 36.36 3lrs s LYS 149 CO 0.03 0.05 0.34 0.00 -0.92 0.00 0.00 175.35 174.85 3lrs s ALA 150 N 0.41 3.49 0.00 5.17 0.00 -0.12 -0.95 121.76 129.76 3lrs s ALA 150 Ca -0.06 -1.31 0.00 0.00 0.00 0.00 0.00 51.96 50.59 3lrs s ALA 150 Cb -0.10 -2.82 0.00 0.00 0.00 0.00 0.00 23.12 20.20 3lrs s ALA 150 CO 0.00 -1.12 0.00 -0.25 0.00 0.00 0.00 175.76 174.39 3lrs n ASP 151 N 5.33 0.00 -0.00 0.00 8.00 0.17 -0.68 116.55 129.37 3lrs n ASP 151 Ca -0.10 0.00 0.01 0.00 0.71 0.00 0.00 54.79 55.42 3lrs n ASP 151 Cb 0.49 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.57 3lrs n ASP 151 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3lrs n SER 152 N 8.18 0.95 -4.68 -2.24 7.64 -1.26 -4.70 113.62 117.51 3lrs n SER 152 Ca 0.00 -0.46 -0.41 0.00 1.01 0.00 0.00 58.87 59.01 3lrs n SER 152 Cb 0.00 1.03 -0.04 0.00 -1.01 0.00 0.00 64.21 64.18 3lrs n SER 152 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 3lrs s SER 153 N -1.49 6.93 0.30 6.43 0.01 0.14 -4.98 113.70 121.04 3lrs s SER 153 Ca 0.01 1.14 -0.28 0.00 1.31 0.00 0.00 55.95 58.13 3lrs s SER 153 Cb 0.02 -2.44 -0.14 0.00 0.21 0.00 0.00 66.02 63.68 3lrs s SER 153 CO 0.12 -0.33 1.10 -2.65 0.41 0.00 0.00 173.24 171.90 3lrs n PRO 154 N 4.93 1.57 -3.74 12.44 -0.02 -1.26 -0.94 135.00 147.97 3lrs n PRO 154 Ca 0.03 0.55 -0.30 0.00 -2.02 0.00 0.00 63.50 61.76 3lrs n PRO 154 Cb 0.49 -1.99 -0.15 0.00 -0.02 0.00 0.00 33.50 31.83 3lrs n PRO 154 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3lrs s VAL 155 N -0.99 0.90 -0.45 -1.45 1.01 0.07 -4.79 120.40 114.70 3lrs s VAL 155 Ca 0.59 -1.39 0.22 0.00 0.00 0.00 0.00 61.98 61.40 3lrs s VAL 155 Cb -0.67 -1.67 -0.16 0.00 0.00 0.00 0.00 36.38 33.88 3lrs s VAL 155 CO 0.60 -0.66 0.89 0.29 0.00 0.00 0.00 175.10 176.22 3lrs n LYS 156 N 4.84 0.40 -2.82 2.72 5.02 -1.26 -4.38 118.16 122.68 3lrs n LYS 156 Ca -0.02 -0.03 -0.41 0.00 -2.02 0.00 0.00 58.31 55.83 3lrs n LYS 156 Cb 0.42 -1.60 -0.04 0.00 -0.02 0.00 0.00 35.03 33.79 3lrs n LYS 156 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3lrs s ALA 157 N -3.28 3.26 0.00 7.82 0.00 -1.26 -4.00 121.76 124.29 3lrs s ALA 157 Ca 0.01 0.44 0.00 0.00 0.00 0.00 0.00 51.96 52.41 3lrs s ALA 157 Cb 0.14 -3.20 0.00 0.00 0.00 0.00 0.00 23.12 20.06 3lrs s ALA 157 CO 0.83 -0.08 0.00 0.41 0.00 0.00 0.00 175.76 176.92 3lrs n GLY 158 N 2.59 0.59 3.70 0.00 0.00 -1.26 -4.80 105.19 106.00 3lrs n GLY 158 Ca 0.02 -0.69 -0.37 0.00 0.00 0.00 0.00 46.02 44.98 3lrs n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3lrs s VAL 159 N -2.00 5.30 -0.09 1.61 1.01 -1.26 -2.03 120.40 122.95 3lrs s VAL 159 Ca 0.00 0.47 0.03 0.00 0.00 0.00 0.00 61.98 62.48 3lrs s VAL 159 Cb 0.00 -3.61 0.01 0.00 0.00 0.00 0.00 36.38 32.78 3lrs s VAL 159 CO 0.00 0.35 -0.18 -1.61 0.00 0.00 0.00 175.10 173.66 3lrs s GLU 160 N 0.79 2.42 -0.03 2.72 0.41 -0.59 -4.98 118.70 119.43 3lrs s GLU 160 Ca 0.14 -0.66 0.02 0.00 -0.41 0.00 0.00 54.97 54.07 3lrs s GLU 160 Cb -0.13 -1.90 0.01 0.00 -1.78 0.00 0.00 34.13 30.32 3lrs s GLU 160 CO 0.04 0.09 -0.08 0.99 -0.49 0.00 0.00 175.26 175.80 3lrs s THR 161 N 0.56 0.75 0.41 3.63 2.01 -1.26 -0.10 115.64 121.62 3lrs s THR 161 Ca -0.15 -0.33 -0.06 0.00 0.31 0.00 0.00 61.69 61.46 3lrs s THR 161 Cb -0.17 -0.68 -0.05 0.00 0.01 0.00 0.00 72.50 71.62 3lrs s THR 161 CO 0.05 0.24 0.71 0.42 -0.69 0.00 0.00 174.62 175.35 3lrs s THR 162 N 0.29 4.92 0.33 -0.82 -4.23 -0.51 -5.01 115.64 110.61 3lrs s THR 162 Ca -0.05 0.20 -0.27 0.00 -1.18 0.00 0.00 61.69 60.40 3lrs s THR 162 Cb -0.09 -3.80 -0.09 0.00 1.34 0.00 0.00 72.50 69.85 3lrs s THR 162 CO 0.01 -0.62 1.02 -0.89 -0.54 0.00 0.00 174.62 173.59 3lrs s THR 163 N -2.46 3.84 0.26 3.99 2.01 -1.26 -4.46 115.64 117.56 3lrs s THR 163 Ca 0.47 1.61 -0.30 0.00 0.31 0.00 0.00 61.69 63.77 3lrs s THR 163 Cb -0.10 -3.93 -0.11 0.00 0.01 0.00 0.00 72.50 68.37 3lrs s THR 163 CO 0.37 0.20 1.52 -2.84 -0.69 0.00 0.00 174.62 173.19 3lrs s PRO 164 N -1.93 4.19 0.16 4.92 0.02 -1.26 -4.75 135.00 136.35 3lrs s PRO 164 Ca 0.50 2.44 0.05 0.00 0.02 0.00 0.00 61.00 64.01 3lrs s PRO 164 Cb -0.24 -3.07 -0.05 0.00 0.02 0.00 0.00 34.50 31.16 3lrs s PRO 164 CO 0.30 -0.54 -0.10 -1.54 -0.33 0.00 0.00 177.00 174.80 3lrs s SER 165 N 0.48 1.86 0.15 2.53 1.04 -0.70 -4.89 113.70 114.16 3lrs s SER 165 Ca 0.62 -1.03 -0.30 0.00 0.48 0.00 0.00 55.95 55.72 3lrs s SER 165 Cb -0.45 -0.02 -0.07 0.00 0.10 0.00 0.00 66.02 65.58 3lrs s SER 165 CO 0.45 -0.34 1.08 -0.54 0.98 0.00 0.00 173.24 174.87 3lrs s LYS 166 N -3.75 4.60 0.64 4.02 -0.14 -1.26 -1.12 119.74 122.73 3lrs s LYS 166 Ca 0.18 1.66 -0.02 0.00 -1.36 0.00 0.00 55.97 56.44 3lrs s LYS 166 Cb 0.03 -3.31 0.07 0.00 -1.68 0.00 0.00 37.83 32.93 3lrs s LYS 166 CO 0.02 0.07 0.91 -0.65 -0.76 0.00 0.00 175.35 174.93 3lrs s GLN 167 N -0.11 2.19 0.28 1.68 -0.21 0.88 -4.93 119.66 119.44 3lrs s GLN 167 Ca 0.50 -0.71 0.02 0.00 0.02 0.00 0.00 55.36 55.19 3lrs s GLN 167 Cb -0.28 -2.35 0.60 0.00 1.00 0.00 0.00 33.01 31.98 3lrs s GLN 167 CO 0.33 -1.08 1.79 0.77 -2.12 0.00 0.00 175.29 174.98 3lrs h SER 168 N -0.30 0.71 -0.13 5.90 0.02 -1.97 -1.75 113.55 116.03 3lrs h SER 168 Ca -0.41 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.62 3lrs h SER 168 Cb 1.29 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.79 3lrs h SER 168 CO 0.51 0.31 0.00 -0.46 -1.14 0.00 0.00 176.83 176.05 3lrs n ASN 169 N -4.77 1.32 -0.64 3.07 0.23 -1.26 -4.85 115.26 108.35 3lrs n ASN 169 Ca 0.19 -2.09 -0.08 0.00 -0.53 0.00 0.00 54.58 52.08 3lrs n ASN 169 Cb 0.45 -0.30 -0.04 0.00 -2.08 0.00 0.00 39.78 37.82 3lrs n ASN 169 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 3lrs n ASN 170 N 0.02 -4.81 -4.91 0.53 3.02 -0.66 -5.00 115.26 103.45 3lrs n ASN 170 Ca 0.05 0.21 -0.22 0.00 -0.03 0.00 0.00 54.58 54.58 3lrs n ASN 170 Cb 0.27 -3.04 0.04 0.00 -0.61 0.00 0.00 39.78 36.43 3lrs n ASN 170 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3lrs n LYS 171 N -1.69 0.63 -4.22 3.52 5.02 -1.26 -4.86 118.16 115.30 3lrs n LYS 171 Ca -0.08 -3.28 -0.23 0.00 -2.02 0.00 0.00 58.31 52.69 3lrs n LYS 171 Cb 0.41 0.03 -0.07 0.00 -0.02 0.00 0.00 35.03 35.38 3lrs n LYS 171 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3lrs s TYR 172 N -2.68 2.70 -0.01 2.13 1.51 0.07 -0.08 117.35 121.00 3lrs s TYR 172 Ca 0.48 -0.30 0.00 0.00 -1.01 0.00 0.00 57.07 56.24 3lrs s TYR 172 Cb -0.04 -1.41 0.01 0.00 -0.11 0.00 0.00 41.96 40.42 3lrs s TYR 172 CO 0.30 0.49 0.01 0.00 -1.11 0.00 0.00 175.55 175.25 3lrs s ALA 173 N -2.38 0.04 0.23 3.71 0.00 -0.28 -1.84 121.76 121.25 3lrs s ALA 173 Ca 0.34 0.09 0.01 0.00 0.00 0.00 0.00 51.96 52.40 3lrs s ALA 173 Cb -0.04 -0.08 -0.04 0.00 0.00 0.00 0.00 23.12 22.95 3lrs s ALA 173 CO 0.21 -0.03 0.14 0.00 0.00 0.00 0.00 175.76 176.07 3lrs s ALA 174 N 0.35 1.43 0.10 0.00 0.00 0.43 -1.73 121.76 122.34 3lrs s ALA 174 Ca -0.03 -1.77 -0.06 0.00 0.00 0.00 0.00 51.96 50.10 3lrs s ALA 174 Cb -0.04 1.29 -0.02 0.00 0.00 0.00 0.00 23.12 24.35 3lrs s ALA 174 CO -0.01 -0.56 0.14 -1.54 0.00 0.00 0.00 175.76 173.79 3lrs s SER 175 N -3.23 0.22 -0.11 0.00 1.04 -1.26 -0.70 113.70 109.65 3lrs s SER 175 Ca 0.39 -0.86 -0.18 0.00 0.48 0.00 0.00 55.95 55.78 3lrs s SER 175 Cb 0.07 0.32 0.04 0.00 0.10 0.00 0.00 66.02 66.55 3lrs s SER 175 CO 0.14 -0.73 0.45 -0.55 0.98 0.00 0.00 173.24 173.53 3lrs s SER 176 N -2.92 -0.42 -0.05 7.02 0.15 0.38 -1.42 113.70 116.42 3lrs s SER 176 Ca 0.11 0.67 0.02 0.00 0.70 0.00 0.00 55.95 57.45 3lrs s SER 176 Cb 0.06 0.72 0.01 0.00 -1.71 0.00 0.00 66.02 65.10 3lrs s SER 176 CO -0.07 -0.30 -0.10 -0.31 1.20 0.00 0.00 173.24 173.66 3lrs s TYR 177 N -0.38 1.21 -0.24 3.44 2.02 0.85 -0.64 117.35 123.62 3lrs s TYR 177 Ca -0.05 -0.40 -0.04 0.00 -0.37 0.00 0.00 57.07 56.21 3lrs s TYR 177 Cb -0.03 -0.91 0.00 0.00 -0.40 0.00 0.00 41.96 40.62 3lrs s TYR 177 CO 0.03 -0.22 -0.03 -1.17 -1.57 0.00 0.00 175.55 172.59 3lrs s LEU 178 N 0.60 3.10 -0.24 -1.29 2.96 -0.67 -1.54 118.68 121.60 3lrs s LEU 178 Ca -0.11 -0.55 -0.19 0.00 -0.22 0.00 0.00 54.13 53.06 3lrs s LEU 178 Cb -0.14 -1.74 -0.03 0.00 0.50 0.00 0.00 46.19 44.78 3lrs s LEU 178 CO 0.02 -0.07 0.54 -0.44 -1.32 0.00 0.00 176.35 175.08 3lrs s SER 179 N 1.45 6.50 0.29 3.68 0.01 -0.86 -0.86 113.70 123.90 3lrs s SER 179 Ca 0.04 0.60 0.11 0.00 1.31 0.00 0.00 55.95 58.01 3lrs s SER 179 Cb -0.15 -2.30 -0.05 0.00 0.21 0.00 0.00 66.02 63.73 3lrs s SER 179 CO -0.03 -0.28 -0.10 -0.76 0.41 0.00 0.00 173.24 172.48 3lrs s LEU 180 N 2.20 2.83 0.25 2.44 1.43 0.20 -4.78 118.68 123.25 3lrs s LEU 180 Ca 0.23 -0.94 -0.13 0.00 -1.03 0.00 0.00 54.13 52.27 3lrs s LEU 180 Cb -0.16 -1.30 -0.08 0.00 0.03 0.00 0.00 46.19 44.69 3lrs s LEU 180 CO 0.09 -0.04 0.62 0.42 0.23 0.00 0.00 176.35 177.66 3lrs s THR 181 N -2.47 4.82 0.49 5.49 -4.23 -1.26 -1.86 115.64 116.62 3lrs s THR 181 Ca 0.31 0.72 0.32 0.00 -1.18 0.00 0.00 61.69 61.86 3lrs s THR 181 Cb -0.04 -3.65 0.51 0.00 1.34 0.00 0.00 72.50 70.67 3lrs s THR 181 CO 0.17 -0.04 1.76 -0.65 -0.54 0.00 0.00 174.62 175.32 3lrs h PRO 182 N 2.65 0.12 -0.22 3.99 0.11 -1.84 -1.85 132.00 134.96 3lrs h PRO 182 Ca -0.47 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 65.49 3lrs h PRO 182 Cb 1.18 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3lrs h PRO 182 CO 0.67 0.08 -0.40 0.93 -0.21 0.00 0.00 178.00 179.07 3lrs h GLU 183 N 0.12 0.67 -0.46 1.05 3.07 -1.97 -1.67 114.58 115.39 3lrs h GLU 183 Ca 0.63 -0.42 -0.06 0.00 -0.50 0.00 0.00 59.36 59.01 3lrs h GLU 183 Cb 2.18 0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 30.12 3lrs h GLU 183 CO -0.14 1.04 0.04 1.96 -1.40 0.00 0.00 179.01 180.51 3lrs h GLN 184 N 0.37 0.73 -0.26 2.33 4.20 -1.75 -1.98 115.11 118.75 3lrs h GLN 184 Ca 0.01 -0.17 -0.10 0.00 0.06 0.00 0.00 58.65 58.46 3lrs h GLN 184 Cb 1.00 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.68 3lrs h GLN 184 CO 0.09 0.72 -0.21 2.35 -0.67 0.00 0.00 178.83 181.11 3lrs h TRP 185 N 0.69 0.71 0.00 2.96 -0.00 -1.10 -3.13 115.95 116.09 3lrs h TRP 185 Ca 0.14 -0.20 -0.15 0.00 -0.00 0.00 0.00 58.89 58.68 3lrs h TRP 185 Cb 0.37 -0.15 -0.02 0.00 -0.00 0.00 0.00 29.16 29.36 3lrs h TRP 185 CO 0.02 0.90 -0.71 0.87 -0.00 0.00 0.00 178.44 179.51 3lrs h LYS 186 N 0.32 0.00 -0.00 2.65 1.57 -1.29 -3.31 116.57 116.52 3lrs h LYS 186 Ca 0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 3lrs h LYS 186 Cb 0.76 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.07 3lrs h LYS 186 CO 0.05 0.71 -0.12 -1.13 -0.57 0.00 0.00 179.45 178.40 3lrs n SER 187 N -3.59 0.21 -4.87 0.86 3.41 -0.75 -4.81 113.62 104.08 3lrs n SER 187 Ca -0.00 -0.01 -0.21 0.00 -0.26 0.00 0.00 58.87 58.38 3lrs n SER 187 Cb 0.72 -0.22 -0.03 0.00 -0.26 0.00 0.00 64.21 64.42 3lrs n SER 187 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3lrs s HIS 188 N -2.80 3.09 -0.05 7.33 3.76 -1.20 -5.05 115.29 120.37 3lrs s HIS 188 Ca 0.20 -0.18 -0.26 0.00 -0.15 0.00 0.00 55.06 54.67 3lrs s HIS 188 Cb 0.19 -1.63 -0.21 0.00 1.11 0.00 0.00 32.58 32.04 3lrs s HIS 188 CO 0.54 0.33 1.11 -0.22 -0.85 0.00 0.00 174.74 175.65 3lrs h LYS 189 N 1.29 -0.03 -2.79 1.40 3.64 -1.89 -3.43 116.57 114.75 3lrs h LYS 189 Ca -0.47 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 58.95 3lrs h LYS 189 Cb 1.24 0.01 -0.11 0.00 -0.41 0.00 0.00 32.23 32.96 3lrs h LYS 189 CO 0.59 0.55 0.30 -1.54 -2.27 0.00 0.00 179.45 177.07 3lrs s SER 190 N -5.76 -0.44 0.07 4.20 1.04 -1.26 -4.16 113.70 107.39 3lrs s SER 190 Ca -0.16 -0.13 0.08 0.00 0.48 0.00 0.00 55.95 56.22 3lrs s SER 190 Cb 0.01 0.57 -0.03 0.00 0.10 0.00 0.00 66.02 66.66 3lrs s SER 190 CO 0.65 -0.95 -0.22 -0.31 0.98 0.00 0.00 173.24 173.38 3lrs s TYR 191 N -3.61 1.92 -0.07 5.02 1.51 -0.13 0.45 117.35 122.45 3lrs s TYR 191 Ca 0.04 -0.39 0.02 0.00 -1.01 0.00 0.00 57.07 55.74 3lrs s TYR 191 Cb -0.02 -1.11 0.01 0.00 -0.11 0.00 0.00 41.96 40.73 3lrs s TYR 191 CO -0.08 0.15 -0.13 -1.12 -1.11 0.00 0.00 175.55 173.27 3lrs s SER 192 N -1.46 1.86 -0.18 2.29 0.01 -0.13 -0.78 113.70 115.32 3lrs s SER 192 Ca 0.08 -0.31 -0.18 0.00 1.31 0.00 0.00 55.95 56.85 3lrs s SER 192 Cb -0.09 -0.86 -0.04 0.00 0.21 0.00 0.00 66.02 65.24 3lrs s SER 192 CO 0.03 0.03 0.49 0.00 0.41 0.00 0.00 173.24 174.21 3lrs s GLN 194 N 1.32 2.71 -0.35 0.00 -0.21 0.12 -1.92 119.66 121.32 3lrs s GLN 194 Ca 0.24 -0.94 -0.04 0.00 0.02 0.00 0.00 55.36 54.64 3lrs s GLN 194 Cb -0.15 -2.61 0.06 0.00 1.00 0.00 0.00 33.01 31.31 3lrs s GLN 194 CO 0.10 -0.31 0.10 0.08 -2.12 0.00 0.00 175.29 173.13 3lrs s VAL 195 N 1.26 3.42 -0.05 1.09 1.01 0.07 -0.24 120.40 126.96 3lrs s VAL 195 Ca 0.01 -1.44 -0.16 0.00 0.00 0.00 0.00 61.98 60.39 3lrs s VAL 195 Cb -0.15 -3.05 -0.05 0.00 0.00 0.00 0.00 36.38 33.13 3lrs s VAL 195 CO -0.11 -0.29 0.42 -0.89 0.00 0.00 0.00 175.10 174.24 3lrs s THR 196 N 1.29 5.10 -0.19 3.92 2.01 0.02 -1.22 115.64 126.58 3lrs s THR 196 Ca -0.01 0.86 -0.06 0.00 0.31 0.00 0.00 61.69 62.80 3lrs s THR 196 Cb -0.21 -3.74 0.09 0.00 0.01 0.00 0.00 72.50 68.65 3lrs s THR 196 CO -0.00 0.48 0.36 -2.28 -0.69 0.00 0.00 174.62 172.49 3lrs s HIS 197 N -0.35 -0.68 -1.48 4.92 5.04 -0.04 -1.51 115.29 121.19 3lrs s HIS 197 Ca 0.24 1.22 -0.05 0.00 -1.54 0.00 0.00 55.06 54.93 3lrs s HIS 197 Cb -0.16 0.14 0.04 0.00 0.04 0.00 0.00 32.58 32.65 3lrs s HIS 197 CO 0.11 -0.49 0.54 0.39 -2.34 0.00 0.00 174.74 172.96 3lrs n GLU 198 N 5.37 -3.46 0.00 2.88 -0.58 -1.26 -1.85 120.64 121.74 3lrs n GLU 198 Ca -0.07 0.41 0.00 0.00 -0.42 0.00 0.00 57.16 57.09 3lrs n GLU 198 Cb 0.50 -4.73 0.00 0.00 -0.57 0.00 0.00 31.44 26.63 3lrs n GLU 198 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3lrs n GLY 199 N -1.83 3.17 3.66 0.62 0.00 -1.26 -5.02 105.19 104.53 3lrs n GLY 199 Ca -0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.47 3lrs n GLY 199 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3lrs s SER 200 N -0.89 5.38 -0.17 1.61 0.01 -0.77 -5.11 113.70 113.75 3lrs s SER 200 Ca 0.00 0.12 -0.07 0.00 1.31 0.00 0.00 55.95 57.31 3lrs s SER 200 Cb 0.00 -1.71 -0.04 0.00 0.21 0.00 0.00 66.02 64.48 3lrs s SER 200 CO 0.00 0.29 0.06 -0.89 0.41 0.00 0.00 173.24 173.11 3lrs s THR 201 N -0.37 4.75 -0.09 1.44 2.01 -1.26 -0.86 115.64 121.25 3lrs s THR 201 Ca 0.08 -0.05 -0.00 0.00 0.31 0.00 0.00 61.69 62.02 3lrs s THR 201 Cb -0.12 -3.13 -0.03 0.00 0.01 0.00 0.00 72.50 69.23 3lrs s THR 201 CO 0.02 0.47 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.68 3lrs s VAL 202 N 0.27 3.83 -0.01 3.82 1.01 -0.36 -4.96 120.40 124.00 3lrs s VAL 202 Ca 0.03 -0.42 0.02 0.00 0.00 0.00 0.00 61.98 61.62 3lrs s VAL 202 Cb -0.12 -2.59 -0.01 0.00 0.00 0.00 0.00 36.38 33.66 3lrs s VAL 202 CO 0.00 0.58 -0.08 -0.70 0.00 0.00 0.00 175.10 174.90 3lrs s GLU 203 N -0.60 0.66 0.10 2.72 2.12 -1.26 -0.75 118.70 121.69 3lrs s GLU 203 Ca 0.09 -0.29 0.06 0.00 0.36 0.00 0.00 54.97 55.20 3lrs s GLU 203 Cb -0.12 -0.64 -0.03 0.00 0.26 0.00 0.00 34.13 33.60 3lrs s GLU 203 CO 0.02 0.17 -0.16 0.15 -0.54 0.00 0.00 175.26 174.90 3lrs s LYS 204 N -0.19 1.00 -0.00 4.30 -0.14 -0.81 -5.01 119.74 118.89 3lrs s LYS 204 Ca 0.03 -1.13 0.01 0.00 -1.36 0.00 0.00 55.97 53.52 3lrs s LYS 204 Cb -0.03 -1.04 -0.00 0.00 -1.68 0.00 0.00 37.83 35.08 3lrs s LYS 204 CO -0.00 0.22 -0.03 0.99 -0.76 0.00 0.00 175.35 175.77 3lrs s THR 205 N -1.58 0.26 0.22 2.17 2.01 -1.26 -0.83 115.64 116.63 3lrs s THR 205 Ca 0.05 -0.13 0.11 0.00 0.31 0.00 0.00 61.69 62.03 3lrs s THR 205 Cb -0.08 -0.23 -0.05 0.00 0.01 0.00 0.00 72.50 72.15 3lrs s THR 205 CO 0.03 0.08 -0.20 0.68 -0.69 0.00 0.00 174.62 174.52 3lrs s VAL 206 N -0.00 2.21 0.02 3.82 -7.23 0.04 -4.96 120.40 114.30 3lrs s VAL 206 Ca 0.00 -2.19 0.02 0.00 -1.81 0.00 0.00 61.98 58.01 3lrs s VAL 206 Cb -0.02 -2.13 -0.02 0.00 0.56 0.00 0.00 36.38 34.77 3lrs s VAL 206 CO -0.00 -0.34 -0.07 0.00 -0.31 0.00 0.00 175.10 174.38 3lrs s ALA 207 N -2.27 0.58 0.12 1.32 0.00 -1.26 -0.95 121.76 119.29 3lrs s ALA 207 Ca 0.24 -0.55 -0.27 0.00 0.00 0.00 0.00 51.96 51.37 3lrs s ALA 207 Cb -0.05 -0.04 -0.08 0.00 0.00 0.00 0.00 23.12 22.94 3lrs s ALA 207 CO 0.11 0.06 1.46 -1.35 0.00 0.00 0.00 175.76 176.04 3lrs h PRO 208 N 5.17 -0.23 0.00 0.00 0.11 -1.82 -3.51 132.00 131.71 3lrs h PRO 208 Ca -0.33 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.80 3lrs h PRO 208 Cb 1.20 0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3lrs h PRO 208 CO 0.45 -0.16 0.00 0.25 -0.21 0.00 0.00 178.00 178.33