#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dbm s VAL 2 N 0.00 3.67 -0.23 2.53 1.01 -1.26 -5.00 120.40 121.12 1dbm s VAL 2 Ca 0.00 1.23 0.02 0.00 0.00 0.00 0.00 61.98 63.23 1dbm s VAL 2 Cb 0.00 -3.61 0.05 0.00 0.00 0.00 0.00 36.38 32.81 1dbm s VAL 2 CO 0.00 -0.04 -0.14 -0.69 0.00 0.00 0.00 175.10 174.23 1dbm s VAL 3 N -1.71 2.12 -0.24 2.92 1.01 -1.26 -4.81 120.40 118.43 1dbm s VAL 3 Ca 0.60 -1.39 -0.08 0.00 0.00 0.00 0.00 61.98 61.11 1dbm s VAL 3 Cb -0.22 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.00 1dbm s VAL 3 CO 0.27 0.17 0.10 -0.04 0.00 0.00 0.00 175.10 175.60 1dbm s MET 4 N 1.17 3.84 0.04 2.72 -1.94 -1.26 -1.17 119.30 122.71 1dbm s MET 4 Ca -0.04 -0.39 0.07 0.00 -1.71 0.00 0.00 55.69 53.62 1dbm s MET 4 Cb -0.18 -3.38 -0.03 0.00 2.01 0.00 0.00 34.83 33.25 1dbm s MET 4 CO -0.08 -0.03 -0.17 0.95 -0.01 0.00 0.00 175.02 175.68 1dbm s THR 5 N 1.24 2.84 0.16 2.05 -4.23 -0.78 -4.25 115.64 112.66 1dbm s THR 5 Ca 0.05 -1.15 0.09 0.00 -1.18 0.00 0.00 61.69 59.51 1dbm s THR 5 Cb -0.14 -2.20 -0.04 0.00 1.34 0.00 0.00 72.50 71.46 1dbm s THR 5 CO 0.04 0.35 -0.14 -1.10 -0.54 0.00 0.00 174.62 173.23 1dbm s GLN 6 N -1.42 1.91 -0.16 3.99 1.11 -1.26 -1.52 119.66 122.31 1dbm s GLN 6 Ca 0.15 -1.25 -0.20 0.00 0.01 0.00 0.00 55.36 54.07 1dbm s GLN 6 Cb -0.11 -2.12 0.05 0.00 -1.01 0.00 0.00 33.01 29.83 1dbm s GLN 6 CO 0.05 0.45 0.53 0.42 0.01 0.00 0.00 175.29 176.76 1dbm s ILE 7 N -1.49 0.01 1.01 1.08 -1.09 -1.22 -4.75 121.20 114.75 1dbm s ILE 7 Ca 0.22 -0.05 -0.13 0.00 -2.23 0.00 0.00 60.65 58.46 1dbm s ILE 7 Cb -0.09 -0.77 0.19 0.00 -1.58 0.00 0.00 42.46 40.21 1dbm s ILE 7 CO 0.13 -0.03 1.10 -2.84 -1.23 0.00 0.00 174.94 172.07 1dbm s PRO 8 N -0.09 0.35 -0.02 2.79 0.02 -1.26 -3.51 135.00 133.27 1dbm s PRO 8 Ca -0.03 0.40 -0.22 0.00 0.02 0.00 0.00 61.00 61.17 1dbm s PRO 8 Cb -0.03 -1.74 -0.23 0.00 0.02 0.00 0.00 34.50 32.52 1dbm s PRO 8 CO 0.02 -2.76 1.07 1.25 -0.33 0.00 0.00 177.00 176.26 1dbm h LEU 9 N -1.91 0.37 -9.07 -5.54 7.12 -1.85 -3.41 115.31 101.02 1dbm h LEU 9 Ca -0.54 -0.76 -0.57 0.00 0.13 0.00 0.00 57.88 56.15 1dbm h LEU 9 Cb 1.33 -0.11 -0.15 0.00 -0.53 0.00 0.00 40.66 41.20 1dbm h LEU 9 CO 0.57 1.08 -0.77 -0.44 -0.13 0.00 0.00 178.44 178.75 1dbm s SER 10 N -6.51 3.23 -0.18 1.25 0.01 -1.26 -0.60 113.70 109.64 1dbm s SER 10 Ca -0.15 -0.98 -0.02 0.00 1.31 0.00 0.00 55.95 56.11 1dbm s SER 10 Cb 0.02 -0.24 0.05 0.00 0.21 0.00 0.00 66.02 66.07 1dbm s SER 10 CO 0.78 -0.00 0.01 -0.22 0.41 0.00 0.00 173.24 174.22 1dbm s LEU 11 N -3.25 1.34 0.12 2.44 0.20 -0.31 -4.88 118.68 114.34 1dbm s LEU 11 Ca 0.25 -0.78 -0.32 0.00 0.69 0.00 0.00 54.13 53.98 1dbm s LEU 11 Cb -0.05 -0.69 -0.11 0.00 -0.43 0.00 0.00 46.19 44.92 1dbm s LEU 11 CO 0.11 -0.27 1.83 -2.65 -0.29 0.00 0.00 176.35 175.08 1dbm n PRO 12 N 4.99 2.73 -4.05 0.98 -0.02 -1.26 -0.91 135.00 137.46 1dbm n PRO 12 Ca -0.09 0.99 -0.14 0.00 -2.02 0.00 0.00 63.50 62.24 1dbm n PRO 12 Cb 0.47 -2.88 -0.13 0.00 -0.02 0.00 0.00 33.50 30.94 1dbm n PRO 12 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1dbm s VAL 13 N 2.67 0.30 -0.10 -1.45 1.01 0.02 -4.84 120.40 118.02 1dbm s VAL 13 Ca 0.82 -0.41 -0.16 0.00 0.00 0.00 0.00 61.98 62.23 1dbm s VAL 13 Cb -0.50 -0.31 -0.05 0.00 0.00 0.00 0.00 36.38 35.52 1dbm s VAL 13 CO 0.38 -0.08 0.40 0.20 0.00 0.00 0.00 175.10 176.00 1dbm s ASN 14 N -0.53 6.65 0.02 3.32 0.01 -1.26 -2.26 114.94 120.89 1dbm s ASN 14 Ca -0.03 0.77 -0.36 0.00 -0.71 0.00 0.00 52.86 52.53 1dbm s ASN 14 Cb -0.04 -2.24 -0.15 0.00 0.41 0.00 0.00 41.25 39.23 1dbm s ASN 14 CO -0.00 0.12 1.55 0.18 -1.51 0.00 0.00 177.10 177.44 1dbm n LEU 15 N 3.10 2.43 0.00 0.60 4.77 -1.26 -1.04 117.00 125.60 1dbm n LEU 15 Ca -0.11 1.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.96 1dbm n LEU 15 Cb 0.52 -1.27 0.00 0.00 -2.33 0.00 0.00 43.42 40.33 1dbm n LEU 15 CO 0.40 -0.59 0.00 0.61 -1.33 0.00 0.00 177.39 176.48 1dbm n GLY 16 N 3.31 2.06 3.75 -0.72 0.00 0.10 -4.91 105.19 108.79 1dbm n GLY 16 Ca 0.20 -0.62 -0.29 0.00 0.00 0.00 0.00 46.02 45.31 1dbm n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1dbm s ASP 17 N -0.31 3.62 0.70 1.61 1.01 -0.21 -4.02 116.67 119.07 1dbm s ASP 17 Ca 0.00 1.29 -0.11 0.00 0.71 0.00 0.00 52.55 54.44 1dbm s ASP 17 Cb 0.00 -1.96 0.01 0.00 1.01 0.00 0.00 42.92 41.98 1dbm s ASP 17 CO 0.00 -2.52 1.08 -1.10 0.21 0.00 0.00 175.17 172.84 1dbm s GLN 18 N -5.07 2.88 0.05 8.23 1.11 -1.08 -0.12 119.66 125.66 1dbm s GLN 18 Ca 0.63 0.43 -0.12 0.00 0.01 0.00 0.00 55.36 56.32 1dbm s GLN 18 Cb -0.16 -2.04 0.01 0.00 -1.01 0.00 0.00 33.01 29.81 1dbm s GLN 18 CO 0.56 -1.00 0.25 0.00 0.01 0.00 0.00 175.29 175.11 1dbm s ALA 19 N -3.33 -0.52 -0.04 6.09 0.00 -0.26 -4.88 121.76 118.82 1dbm s ALA 19 Ca 0.58 -0.16 -0.02 0.00 0.00 0.00 0.00 51.96 52.36 1dbm s ALA 19 Cb -0.11 0.32 0.03 0.00 0.00 0.00 0.00 23.12 23.36 1dbm s ALA 19 CO 0.51 -0.40 0.05 -1.12 0.00 0.00 0.00 175.76 174.80 1dbm s SER 20 N -2.14 1.04 0.46 0.00 0.01 -1.26 -0.54 113.70 111.27 1dbm s SER 20 Ca -0.04 0.05 0.01 0.00 1.31 0.00 0.00 55.95 57.28 1dbm s SER 20 Cb -0.01 -0.17 0.00 0.00 0.21 0.00 0.00 66.02 66.06 1dbm s SER 20 CO -0.04 -0.22 0.67 -0.63 0.41 0.00 0.00 173.24 173.43 1dbm s ILE 21 N 1.98 3.81 -0.17 1.44 1.09 -0.68 -4.89 121.20 123.78 1dbm s ILE 21 Ca 0.03 -0.55 -0.04 0.00 -1.10 0.00 0.00 60.65 58.99 1dbm s ILE 21 Cb -0.12 -3.40 0.08 0.00 -1.06 0.00 0.00 42.46 37.95 1dbm s ILE 21 CO -0.03 -0.28 0.18 -0.44 -0.10 0.00 0.00 174.94 174.27 1dbm s SER 22 N -4.24 1.39 0.77 3.58 0.01 -1.23 -3.00 113.70 110.97 1dbm s SER 22 Ca 0.49 -0.14 -0.04 0.00 1.31 0.00 0.00 55.95 57.57 1dbm s SER 22 Cb -0.10 0.24 0.14 0.00 0.21 0.00 0.00 66.02 66.51 1dbm s SER 22 CO 0.38 -0.31 0.88 0.00 0.41 0.00 0.00 173.24 174.60 1dbm s ARG 24 N -4.80 0.66 0.02 0.00 3.52 -0.58 -3.51 118.95 114.27 1dbm s ARG 24 Ca 0.55 0.57 0.04 0.00 -0.13 0.00 0.00 55.73 56.77 1dbm s ARG 24 Cb -0.03 0.32 -0.03 0.00 -1.56 0.00 0.00 34.95 33.65 1dbm s ARG 24 CO 0.37 -0.12 -0.08 -1.54 -0.81 0.00 0.00 175.30 173.12 1dbm s SER 25 N -0.13 4.52 -0.01 -2.12 1.04 -0.34 -1.87 113.70 114.79 1dbm s SER 25 Ca 0.00 -0.21 0.05 0.00 0.48 0.00 0.00 55.95 56.28 1dbm s SER 25 Cb -0.04 -1.00 0.18 0.00 0.10 0.00 0.00 66.02 65.26 1dbm s SER 25 CO -0.01 0.26 1.07 -1.54 0.98 0.00 0.00 173.24 174.00 1dbm n SER 26 N 1.41 1.30 -3.65 7.02 3.41 -0.31 -4.81 113.62 117.99 1dbm n SER 26 Ca -0.15 -2.05 -0.09 0.00 -0.26 0.00 0.00 58.87 56.32 1dbm n SER 26 Cb 0.52 -0.22 -0.02 0.00 -0.26 0.00 0.00 64.21 64.23 1dbm n SER 26 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1dbm s GLN 27 N -1.68 1.48 0.29 4.33 -1.52 -1.26 -4.85 119.66 116.45 1dbm s GLN 27 Ca 0.13 -0.71 -0.04 0.00 -1.95 0.00 0.00 55.36 52.79 1dbm s GLN 27 Cb 0.08 0.57 -0.05 0.00 -0.22 0.00 0.00 33.01 33.39 1dbm s GLN 27 CO 0.08 -0.67 0.54 0.45 -0.25 0.00 0.00 175.29 175.44 1dbm s SER 27 N -2.83 6.41 0.00 5.90 0.15 -1.26 -4.79 113.70 117.29 1dbm s SER 27 Ca 0.07 0.65 0.16 0.00 0.70 0.00 0.00 55.95 57.52 1dbm s SER 27 Cb -0.03 -2.11 0.41 0.00 -1.71 0.00 0.00 66.02 62.57 1dbm s SER 27 CO -0.03 -0.20 1.33 0.18 1.20 0.00 0.00 173.24 175.73 1dbm n LEU 27 N -1.03 3.23 -4.70 3.45 4.32 -1.14 -4.87 117.00 116.27 1dbm n LEU 27 Ca -0.02 -1.86 -0.40 0.00 -0.02 0.00 0.00 56.01 53.71 1dbm n LEU 27 Cb 0.54 -0.29 -0.05 0.00 -1.62 0.00 0.00 43.42 42.00 1dbm n LEU 27 CO 0.48 0.78 0.44 -0.63 -1.22 0.00 0.00 177.39 177.24 1dbm s ILE 27 N -1.05 5.01 0.08 -0.08 1.01 -1.26 -2.71 121.20 122.19 1dbm s ILE 27 Ca 0.32 1.43 -0.04 0.00 0.00 0.00 0.00 60.65 62.36 1dbm s ILE 27 Cb 0.17 -4.04 -0.05 0.00 0.01 0.00 0.00 42.46 38.55 1dbm s ILE 27 CO 0.23 0.18 0.30 -2.28 0.00 0.00 0.00 174.94 173.37 1dbm s HIS 27 N 1.29 3.52 0.26 3.97 5.65 0.23 -4.96 115.29 125.25 1dbm s HIS 27 Ca 0.36 0.49 -0.07 0.00 0.25 0.00 0.00 55.06 56.09 1dbm s HIS 27 Cb -0.17 -1.94 0.45 0.00 -1.18 0.00 0.00 32.58 29.73 1dbm s HIS 27 CO 0.15 0.53 1.47 0.43 -0.65 0.00 0.00 174.74 176.67 1dbm n SER 27 N 0.49 -0.33 0.00 9.88 7.64 -1.26 0.66 113.62 130.70 1dbm n SER 27 Ca -0.06 1.62 0.00 0.00 1.01 0.00 0.00 58.87 61.44 1dbm n SER 27 Cb 0.52 -0.49 0.03 0.00 -1.01 0.00 0.00 64.21 63.25 1dbm n SER 27 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1dbm n ASN 28 N -5.53 0.00 0.00 6.43 6.94 -1.26 -4.72 115.26 117.12 1dbm n ASN 28 Ca 0.15 -0.03 0.00 0.00 -0.02 0.00 0.00 54.58 54.68 1dbm n ASN 28 Cb 0.48 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.90 1dbm n ASN 28 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1dbm n GLY 29 N -0.92 3.42 3.86 4.83 0.00 0.21 -5.06 105.19 111.52 1dbm n GLY 29 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1dbm n GLY 29 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1dbm s ASN 30 N -0.68 6.56 -0.21 1.61 0.01 -1.24 -4.55 114.94 116.44 1dbm s ASN 30 Ca 0.00 1.37 -0.04 0.00 -0.71 0.00 0.00 52.86 53.49 1dbm s ASN 30 Cb 0.00 -2.43 -0.01 0.00 0.41 0.00 0.00 41.25 39.22 1dbm s ASN 30 CO 0.00 -0.52 -0.04 -0.89 -1.51 0.00 0.00 177.10 174.13 1dbm s THR 31 N -2.55 3.43 -1.03 1.60 2.01 -1.25 0.75 115.64 118.60 1dbm s THR 31 Ca 0.55 -0.48 -0.03 0.00 0.31 0.00 0.00 61.69 62.05 1dbm s THR 31 Cb -0.10 -2.55 0.31 0.00 0.01 0.00 0.00 72.50 70.17 1dbm s THR 31 CO 0.33 0.43 1.49 -1.22 -0.69 0.00 0.00 174.62 174.95 1dbm n TYR 32 N 4.62 2.45 -3.58 4.92 4.01 -1.10 -4.11 117.16 124.37 1dbm n TYR 32 Ca -0.18 -2.70 -0.38 0.00 -0.16 0.00 0.00 57.90 54.48 1dbm n TYR 32 Cb 0.51 -1.18 -0.10 0.00 -0.31 0.00 0.00 39.34 38.26 1dbm n TYR 32 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1dbm s LEU 33 N -3.07 4.06 0.19 7.72 1.98 -1.26 0.15 118.68 128.45 1dbm s LEU 33 Ca 0.33 0.10 0.11 0.00 -2.89 0.00 0.00 54.13 51.79 1dbm s LEU 33 Cb 0.09 -2.17 -0.04 0.00 0.66 0.00 0.00 46.19 44.72 1dbm s LEU 33 CO 0.05 -0.03 -0.23 -1.00 -1.89 0.00 0.00 176.35 173.25 1dbm s HIS 34 N 1.51 2.32 -0.07 5.38 3.76 0.21 -1.95 115.29 126.46 1dbm s HIS 34 Ca 0.09 -0.35 0.02 0.00 -0.15 0.00 0.00 55.06 54.67 1dbm s HIS 34 Cb -0.15 -1.15 0.01 0.00 1.11 0.00 0.00 32.58 32.40 1dbm s HIS 34 CO 0.08 0.49 -0.12 -0.46 -0.85 0.00 0.00 174.74 173.89 1dbm s TRP 35 N -1.65 1.45 0.14 1.40 -0.11 -0.46 0.87 118.94 120.59 1dbm s TRP 35 Ca 0.21 -0.55 0.10 0.00 1.22 0.00 0.00 56.10 57.07 1dbm s TRP 35 Cb -0.08 -1.08 -0.04 0.00 -1.50 0.00 0.00 33.47 30.77 1dbm s TRP 35 CO 0.10 -0.29 -0.19 0.71 -4.62 0.00 0.00 176.95 172.65 1dbm s TYR 36 N 0.75 2.48 -0.18 5.86 2.02 0.73 -1.55 117.35 127.46 1dbm s TYR 36 Ca -0.13 -0.29 0.01 0.00 -0.37 0.00 0.00 57.07 56.29 1dbm s TYR 36 Cb -0.16 -1.29 0.03 0.00 -0.40 0.00 0.00 41.96 40.14 1dbm s TYR 36 CO 0.03 0.41 -0.16 -1.17 -1.57 0.00 0.00 175.55 173.09 1dbm s LEU 37 N -2.31 2.11 -0.85 -1.29 2.96 -0.76 -1.36 118.68 117.19 1dbm s LEU 37 Ca 0.19 -0.69 -0.04 0.00 -0.22 0.00 0.00 54.13 53.37 1dbm s LEU 37 Cb -0.10 -1.35 0.21 0.00 0.50 0.00 0.00 46.19 45.45 1dbm s LEU 37 CO 0.10 -0.05 0.74 -1.58 -1.32 0.00 0.00 176.35 174.23 1dbm s GLN 38 N 1.36 3.25 0.59 1.98 0.74 -0.58 -1.12 119.66 125.87 1dbm s GLN 38 Ca 0.03 -3.01 -0.20 0.00 0.05 0.00 0.00 55.36 52.23 1dbm s GLN 38 Cb -0.14 -4.02 -0.03 0.00 1.10 0.00 0.00 33.01 29.92 1dbm s GLN 38 CO -0.11 -1.24 1.33 1.63 -0.55 0.00 0.00 175.29 176.35 1dbm n LYS 39 N 2.82 1.44 -1.56 1.67 5.02 -1.26 -2.86 118.16 123.43 1dbm n LYS 39 Ca 0.18 0.54 -0.37 0.00 -2.02 0.00 0.00 58.31 56.64 1dbm n LYS 39 Cb 0.38 -2.56 0.07 0.00 -0.02 0.00 0.00 35.03 32.91 1dbm n LYS 39 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1dbm n PRO 40 N -1.40 0.82 -3.80 1.97 -0.04 -1.26 -3.48 135.00 127.81 1dbm n PRO 40 Ca 0.13 0.33 -0.23 0.00 -0.04 0.00 0.00 63.50 63.69 1dbm n PRO 40 Cb 0.46 -2.33 0.01 0.00 -0.04 0.00 0.00 33.50 31.61 1dbm n PRO 40 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1dbm n GLY 41 N 1.07 -0.27 0.49 0.55 0.00 -1.26 -4.94 105.19 100.83 1dbm n GLY 41 Ca 0.14 0.13 -0.03 0.00 0.00 0.00 0.00 46.02 46.27 1dbm n GLY 41 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1dbm n GLN 42 N -4.33 0.08 -5.19 1.61 -0.06 -1.23 -5.16 117.38 103.11 1dbm n GLN 42 Ca -0.29 -0.46 -0.31 0.00 -2.00 0.00 0.00 57.00 53.94 1dbm n GLN 42 Cb 0.68 0.41 -0.15 0.00 -4.06 0.00 0.00 30.24 27.11 1dbm n GLN 42 CO 0.00 0.00 0.00 -1.54 -0.20 0.00 0.00 177.06 175.32 1dbm s SER 43 N -1.34 3.18 0.71 1.69 1.04 -1.26 -4.99 113.70 112.73 1dbm s SER 43 Ca 0.05 -0.46 -0.16 0.00 0.48 0.00 0.00 55.95 55.86 1dbm s SER 43 Cb 0.00 -0.39 0.03 0.00 0.10 0.00 0.00 66.02 65.76 1dbm s SER 43 CO 0.04 0.31 1.24 -2.84 0.98 0.00 0.00 173.24 172.97 1dbm s PRO 44 N -0.74 2.20 -0.13 4.02 0.02 -1.26 -4.86 135.00 134.25 1dbm s PRO 44 Ca 0.11 1.88 0.01 0.00 0.02 0.00 0.00 61.00 63.02 1dbm s PRO 44 Cb -0.10 -1.83 -0.00 0.00 0.02 0.00 0.00 34.50 32.59 1dbm s PRO 44 CO -0.00 -1.81 -0.18 0.15 -0.33 0.00 0.00 177.00 174.82 1dbm s LYS 45 N -3.74 3.19 0.30 5.54 1.02 -0.28 -4.92 119.74 120.85 1dbm s LYS 45 Ca 0.77 -0.78 -0.30 0.00 0.02 0.00 0.00 55.97 55.69 1dbm s LYS 45 Cb -0.32 -2.51 -0.11 0.00 -0.52 0.00 0.00 37.83 34.36 1dbm s LYS 45 CO 0.44 0.11 1.53 -1.17 -0.92 0.00 0.00 175.35 175.34 1dbm s LEU 46 N 0.56 4.35 -0.06 3.17 0.20 -1.26 -1.82 118.68 123.82 1dbm s LEU 46 Ca -0.11 2.91 -0.06 0.00 0.69 0.00 0.00 54.13 57.56 1dbm s LEU 46 Cb -0.16 -3.64 -0.04 0.00 -0.43 0.00 0.00 46.19 41.92 1dbm s LEU 46 CO 0.04 -0.85 -0.14 0.18 -0.29 0.00 0.00 176.35 175.29 1dbm n LEU 47 N 1.81 1.05 -4.00 -0.68 4.77 -0.60 -4.81 117.00 114.54 1dbm n LEU 47 Ca 0.06 0.17 -0.16 0.00 -0.03 0.00 0.00 56.01 56.04 1dbm n LEU 47 Cb 0.38 -0.39 -0.14 0.00 -2.33 0.00 0.00 43.42 40.94 1dbm n LEU 47 CO 0.63 -0.12 -0.41 -0.32 -1.33 0.00 0.00 177.39 175.83 1dbm s MET 48 N -2.26 0.54 -0.01 3.23 1.75 -1.13 -0.13 119.30 121.29 1dbm s MET 48 Ca -0.13 -0.33 0.01 0.00 -1.25 0.00 0.00 55.69 53.99 1dbm s MET 48 Cb 0.04 -0.49 0.00 0.00 2.84 0.00 0.00 34.83 37.22 1dbm s MET 48 CO 0.18 0.13 -0.04 1.52 -0.65 0.00 0.00 175.02 176.16 1dbm s TYR 49 N -0.37 0.37 -1.06 4.11 1.13 0.11 -1.35 117.35 120.29 1dbm s TYR 49 Ca 0.01 -0.07 -0.05 0.00 -1.41 0.00 0.00 57.07 55.55 1dbm s TYR 49 Cb -0.04 -0.27 -0.06 0.00 -1.10 0.00 0.00 41.96 40.50 1dbm s TYR 49 CO -0.00 -0.03 0.93 1.63 -2.51 0.00 0.00 175.55 175.57 1dbm n LYS 50 N 3.15 -2.83 0.00 -3.49 4.76 -0.99 -1.14 118.16 117.62 1dbm n LYS 50 Ca -0.15 0.86 0.00 0.00 -2.87 0.00 0.00 58.31 56.16 1dbm n LYS 50 Cb 0.57 -5.82 0.00 0.00 -1.84 0.00 0.00 35.03 27.94 1dbm n LYS 50 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1dbm n VAL 51 N -3.34 0.00 -0.09 -0.18 0.31 -0.82 -3.61 118.33 110.60 1dbm n VAL 51 Ca -0.10 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.23 1dbm n VAL 51 Cb 0.63 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.56 1dbm n VAL 51 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1dbm n SER 52 N 0.00 1.71 -4.60 4.52 7.64 -1.25 -4.13 113.62 117.51 1dbm n SER 52 Ca 0.00 -1.80 -0.37 0.00 1.01 0.00 0.00 58.87 57.71 1dbm n SER 52 Cb 0.00 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.09 1dbm n SER 52 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1dbm s ASN 53 N -0.80 5.93 0.32 6.43 0.01 -0.29 -4.54 114.94 121.99 1dbm s ASN 53 Ca 0.00 0.02 -0.28 0.00 -0.71 0.00 0.00 52.86 51.89 1dbm s ASN 53 Cb 0.00 -2.08 -0.09 0.00 0.41 0.00 0.00 41.25 39.48 1dbm s ASN 53 CO 0.00 0.01 1.10 -0.13 -1.51 0.00 0.00 177.10 176.57 1dbm s ARG 54 N 1.38 4.48 0.96 -0.60 0.52 -1.26 0.09 118.95 124.53 1dbm s ARG 54 Ca 0.07 1.75 -0.16 0.00 -0.52 0.00 0.00 55.73 56.87 1dbm s ARG 54 Cb -0.15 -3.00 0.20 0.00 0.52 0.00 0.00 34.95 32.52 1dbm s ARG 54 CO 0.07 0.08 1.30 0.12 0.02 0.00 0.00 175.30 176.89 1dbm s PHE 55 N -1.29 1.64 0.18 -0.53 5.36 0.82 -4.88 117.98 119.27 1dbm s PHE 55 Ca 0.48 0.36 -0.30 0.00 -0.96 0.00 0.00 56.93 56.51 1dbm s PHE 55 Cb -0.30 -4.04 -0.08 0.00 -0.34 0.00 0.00 43.02 38.26 1dbm s PHE 55 CO 0.38 -2.66 1.27 0.71 -1.46 0.00 0.00 175.22 173.46 1dbm s TYR 56 N -3.82 3.32 0.00 10.12 1.51 -1.26 -2.82 117.35 124.40 1dbm s TYR 56 Ca 0.73 1.27 0.00 0.00 -1.01 0.00 0.00 57.07 58.06 1dbm s TYR 56 Cb -0.05 -3.54 0.00 0.00 -0.11 0.00 0.00 41.96 38.26 1dbm s TYR 56 CO 0.53 -1.66 0.00 0.41 -1.11 0.00 0.00 175.55 173.72 1dbm n GLY 57 N 2.44 2.59 3.69 0.71 0.00 -1.26 -4.97 105.19 108.38 1dbm n GLY 57 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 1dbm n GLY 57 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1dbm n VAL 58 N -0.27 0.43 -1.71 1.61 3.14 -1.13 -4.77 118.33 115.64 1dbm n VAL 58 Ca 0.00 -0.08 -0.38 0.00 -2.96 0.00 0.00 64.34 60.93 1dbm n VAL 58 Cb 0.00 -2.16 0.06 0.00 -1.06 0.00 0.00 33.84 30.68 1dbm n VAL 58 CO 0.00 0.00 0.00 -2.65 -6.46 0.00 0.00 176.83 167.72 1dbm n PRO 59 N 5.95 1.21 0.02 1.45 -0.02 -1.26 -4.79 135.00 137.56 1dbm n PRO 59 Ca 0.18 0.47 0.22 0.00 -2.02 0.00 0.00 63.50 62.35 1dbm n PRO 59 Cb 0.38 -2.46 0.62 0.00 -0.02 0.00 0.00 33.50 32.02 1dbm n PRO 59 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1dbm h ASP 60 N 0.75 0.00 0.00 2.55 1.82 -2.00 -3.08 116.42 116.45 1dbm h ASP 60 Ca -0.50 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.14 1dbm h ASP 60 Cb 1.34 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.35 1dbm h ASP 60 CO 0.54 0.00 0.00 -2.11 -1.61 0.00 0.00 179.24 176.06 1dbm n ARG 61 N -3.43 0.99 -4.46 0.28 1.85 -1.26 -4.85 116.66 105.78 1dbm n ARG 61 Ca 0.12 0.00 -0.25 0.00 -1.00 0.00 0.00 57.85 56.72 1dbm n ARG 61 Cb 0.92 -1.40 -0.10 0.00 -1.05 0.00 0.00 32.46 30.84 1dbm n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1dbm s PHE 62 N -0.80 2.43 -0.28 2.89 0.40 -1.17 0.44 117.98 121.89 1dbm s PHE 62 Ca 0.00 -0.42 -0.21 0.00 -0.60 0.00 0.00 56.93 55.71 1dbm s PHE 62 Cb 0.00 -1.28 0.08 0.00 0.51 0.00 0.00 43.02 42.33 1dbm s PHE 62 CO 0.00 0.60 0.75 -1.12 0.70 0.00 0.00 175.22 176.15 1dbm s SER 63 N -3.61 -0.80 0.39 1.36 0.01 -0.85 -4.93 113.70 105.28 1dbm s SER 63 Ca 0.32 1.40 0.07 0.00 1.31 0.00 0.00 55.95 59.06 1dbm s SER 63 Cb -0.01 1.38 0.00 0.00 0.21 0.00 0.00 66.02 67.60 1dbm s SER 63 CO 0.17 -0.23 0.54 -0.83 0.41 0.00 0.00 173.24 173.30 1dbm s GLY 64 N 0.94 1.83 -0.04 3.44 0.00 -1.26 -0.72 107.32 111.51 1dbm s GLY 64 Ca -0.04 -1.60 -0.30 0.00 0.00 0.00 0.00 44.72 42.78 1dbm s GLY 64 CO -0.09 -1.45 0.97 -0.56 0.00 0.00 0.00 173.10 171.97 1dbm s SER 65 N -4.29 -0.30 0.00 1.64 0.01 -0.80 -4.83 113.70 105.12 1dbm s SER 65 Ca 0.52 -0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.76 1dbm s SER 65 Cb -0.10 0.33 0.00 0.00 0.21 0.00 0.00 66.02 66.47 1dbm s SER 65 CO 0.32 -0.54 0.00 0.61 0.41 0.00 0.00 173.24 174.04 1dbm n GLY 66 N -0.22 2.24 3.44 3.44 0.00 -1.26 -1.98 105.19 110.86 1dbm n GLY 66 Ca -0.07 -2.14 -0.12 0.00 0.00 0.00 0.00 46.02 43.70 1dbm n GLY 66 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1dbm s SER 67 N 0.00 -0.53 0.15 1.61 0.15 -0.90 -4.94 113.70 109.24 1dbm s SER 67 Ca 0.00 0.03 0.00 0.00 0.70 0.00 0.00 55.95 56.68 1dbm s SER 67 Cb 0.00 0.55 0.00 0.00 -1.71 0.00 0.00 66.02 64.86 1dbm s SER 67 CO 0.00 -0.88 0.00 0.61 1.20 0.00 0.00 173.24 174.17 1dbm n GLY 68 N -0.29 1.84 0.00 9.45 0.00 -1.26 -2.36 105.19 112.57 1dbm n GLY 68 Ca -0.15 0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1dbm n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1dbm n THR 69 N 0.00 0.31 -4.09 2.61 -2.24 -1.26 -2.87 114.28 106.74 1dbm n THR 69 Ca 0.00 -0.55 -0.32 0.00 -2.27 0.00 0.00 64.05 60.90 1dbm n THR 69 Cb 0.00 0.97 -0.16 0.00 -2.10 0.00 0.00 70.33 69.04 1dbm n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1dbm s ASP 70 N -0.31 3.39 0.03 3.42 1.11 -1.00 -1.20 116.67 122.12 1dbm s ASP 70 Ca 0.00 -0.81 0.02 0.00 0.18 0.00 0.00 52.55 51.94 1dbm s ASP 70 Cb 0.00 -1.44 -0.02 0.00 1.07 0.00 0.00 42.92 42.53 1dbm s ASP 70 CO 0.00 -0.06 -0.08 -0.36 1.18 0.00 0.00 175.17 175.85 1dbm s PHE 71 N 1.28 0.69 0.03 4.23 0.40 -1.23 -2.12 117.98 121.26 1dbm s PHE 71 Ca 0.01 -0.38 0.02 0.00 -0.60 0.00 0.00 56.93 55.98 1dbm s PHE 71 Cb -0.15 -0.42 -0.02 0.00 0.51 0.00 0.00 43.02 42.95 1dbm s PHE 71 CO -0.11 -0.05 -0.06 0.95 0.70 0.00 0.00 175.22 176.65 1dbm s THR 72 N -1.00 0.45 -0.14 0.64 -4.23 -0.84 -1.29 115.64 109.23 1dbm s THR 72 Ca -0.06 -0.82 -0.04 0.00 -1.18 0.00 0.00 61.69 59.59 1dbm s THR 72 Cb -0.08 -0.49 -0.03 0.00 1.34 0.00 0.00 72.50 73.24 1dbm s THR 72 CO 0.00 -0.26 -0.00 -0.22 -0.54 0.00 0.00 174.62 173.60 1dbm s LEU 73 N -1.17 3.49 -0.19 4.79 0.20 -1.16 -1.91 118.68 122.73 1dbm s LEU 73 Ca -0.07 0.02 -0.03 0.00 0.69 0.00 0.00 54.13 54.73 1dbm s LEU 73 Cb -0.08 -1.83 -0.01 0.00 -0.43 0.00 0.00 46.19 43.84 1dbm s LEU 73 CO 0.00 0.25 -0.07 -0.54 -0.29 0.00 0.00 176.35 175.70 1dbm s LYS 74 N -0.10 3.42 0.19 1.98 3.01 0.10 -1.69 119.74 126.65 1dbm s LYS 74 Ca 0.04 -0.62 -0.08 0.00 -1.01 0.00 0.00 55.97 54.29 1dbm s LYS 74 Cb -0.13 -2.89 -0.07 0.00 -1.01 0.00 0.00 37.83 33.74 1dbm s LYS 74 CO 0.02 -0.02 0.49 0.42 0.51 0.00 0.00 175.35 176.77 1dbm s ILE 75 N 1.00 5.01 -0.22 2.17 1.09 0.30 -2.00 121.20 128.55 1dbm s ILE 75 Ca -0.00 0.35 -0.16 0.00 -1.10 0.00 0.00 60.65 59.73 1dbm s ILE 75 Cb -0.15 -3.62 -0.12 0.00 -1.06 0.00 0.00 42.46 37.51 1dbm s ILE 75 CO -0.00 -0.01 -0.14 -1.54 -0.10 0.00 0.00 174.94 173.15 1dbm n SER 76 N 0.02 1.90 -3.70 3.58 3.41 0.17 -1.10 113.62 117.89 1dbm n SER 76 Ca -0.01 0.41 -0.30 0.00 -0.26 0.00 0.00 58.87 58.71 1dbm n SER 76 Cb 0.52 -0.86 -0.15 0.00 -0.26 0.00 0.00 64.21 63.46 1dbm n SER 76 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1dbm s ARG 77 N -2.48 0.65 0.19 4.33 1.70 -1.24 -2.64 118.95 119.46 1dbm s ARG 77 Ca -0.30 -1.03 -0.32 0.00 -0.47 0.00 0.00 55.73 53.61 1dbm s ARG 77 Cb 0.08 -1.87 -0.12 0.00 -0.57 0.00 0.00 34.95 32.48 1dbm s ARG 77 CO 0.47 -1.00 1.75 0.08 -1.08 0.00 0.00 175.30 175.52 1dbm s VAL 78 N 1.63 2.13 0.61 4.99 1.01 0.83 -4.67 120.40 126.93 1dbm s VAL 78 Ca 0.10 0.02 0.06 0.00 0.00 0.00 0.00 61.98 62.17 1dbm s VAL 78 Cb -0.17 -3.01 0.10 0.00 0.00 0.00 0.00 36.38 33.29 1dbm s VAL 78 CO -0.26 0.00 0.85 -0.70 0.00 0.00 0.00 175.10 174.99 1dbm s GLU 79 N 1.51 2.13 0.10 2.72 2.56 -1.26 -0.72 118.70 125.73 1dbm s GLU 79 Ca 0.76 -1.47 0.26 0.00 0.00 0.00 0.00 54.97 54.52 1dbm s GLU 79 Cb -0.49 -2.56 0.72 0.00 2.00 0.00 0.00 34.13 33.81 1dbm s GLU 79 CO 0.33 -1.02 1.62 0.00 -0.56 0.00 0.00 175.26 175.62 1dbm n ALA 80 N -2.41 2.69 1.21 6.30 0.00 -1.26 -3.74 120.51 123.29 1dbm n ALA 80 Ca 0.15 -0.16 0.13 0.00 0.00 0.00 0.00 53.44 53.56 1dbm n ALA 80 Cb 0.61 -1.33 0.33 0.00 0.00 0.00 0.00 19.45 19.07 1dbm n ALA 80 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1dbm n GLU 81 N -1.92 0.83 0.00 0.00 0.28 -1.26 -3.62 120.64 114.95 1dbm n GLU 81 Ca 0.05 -0.51 0.14 0.00 -0.16 0.00 0.00 57.16 56.67 1dbm n GLU 81 Cb 0.40 -1.49 0.53 0.00 1.43 0.00 0.00 31.44 32.30 1dbm n GLU 81 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1dbm n ASP 82 N -0.64 0.48 -4.66 -1.84 8.00 -1.25 -4.88 116.55 111.77 1dbm n ASP 82 Ca 0.11 -0.42 -0.42 0.00 0.71 0.00 0.00 54.79 54.77 1dbm n ASP 82 Cb 0.36 -0.05 -0.03 0.00 -0.02 0.00 0.00 41.12 41.38 1dbm n ASP 82 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1dbm s LEU 83 N -2.63 4.25 0.00 0.64 2.01 -1.24 -4.89 118.68 116.82 1dbm s LEU 83 Ca 0.23 2.10 0.00 0.00 0.01 0.00 0.00 54.13 56.48 1dbm s LEU 83 Cb 0.19 -3.53 0.00 0.00 0.01 0.00 0.00 46.19 42.86 1dbm s LEU 83 CO 0.52 -0.96 0.00 0.61 1.01 0.00 0.00 176.35 177.53 1dbm n GLY 84 N 4.16 0.44 3.74 -3.19 0.00 -1.26 -4.65 105.19 104.43 1dbm n GLY 84 Ca 0.17 -0.80 -0.38 0.00 0.00 0.00 0.00 46.02 45.01 1dbm n GLY 84 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dbm s ILE 85 N -2.03 5.06 -0.15 -0.61 -1.09 -1.14 -0.86 121.20 120.39 1dbm s ILE 85 Ca 0.00 1.11 -0.08 0.00 -2.23 0.00 0.00 60.65 59.45 1dbm s ILE 85 Cb 0.00 -3.88 -0.04 0.00 -1.58 0.00 0.00 42.46 36.96 1dbm s ILE 85 CO 0.00 0.37 0.12 -0.31 -1.23 0.00 0.00 174.94 173.89 1dbm s TYR 86 N 0.22 3.48 0.06 3.97 1.51 -0.17 -1.53 117.35 124.89 1dbm s TYR 86 Ca 0.29 0.41 0.09 0.00 -1.01 0.00 0.00 57.07 56.85 1dbm s TYR 86 Cb -0.17 -2.02 -0.03 0.00 -0.11 0.00 0.00 41.96 39.63 1dbm s TYR 86 CO 0.14 0.52 -0.26 -0.06 -1.11 0.00 0.00 175.55 174.78 1dbm s PHE 87 N -0.41 2.25 0.15 2.71 0.08 -0.46 -1.81 117.98 120.49 1dbm s PHE 87 Ca 0.11 -0.40 0.06 0.00 0.12 0.00 0.00 56.93 56.82 1dbm s PHE 87 Cb -0.12 -1.33 -0.04 0.00 -0.57 0.00 0.00 43.02 40.97 1dbm s PHE 87 CO 0.01 0.15 0.02 0.00 -0.10 0.00 0.00 175.22 175.31 1dbm s SER 89 N -2.78 0.14 -0.08 0.00 0.01 0.25 -1.32 113.70 109.92 1dbm s SER 89 Ca 0.27 -0.30 -0.11 0.00 1.31 0.00 0.00 55.95 57.13 1dbm s SER 89 Cb -0.10 0.08 -0.05 0.00 0.21 0.00 0.00 66.02 66.16 1dbm s SER 89 CO 0.19 -0.20 0.27 0.00 0.41 0.00 0.00 173.24 173.92 1dbm s GLN 90 N -0.93 3.77 -0.43 12.44 1.03 -0.91 -0.61 119.66 134.02 1dbm s GLN 90 Ca -0.10 0.12 0.09 0.00 0.04 0.00 0.00 55.36 55.51 1dbm s GLN 90 Cb -0.06 -3.24 0.41 0.00 0.03 0.00 0.00 33.01 30.15 1dbm s GLN 90 CO -0.01 0.65 1.01 0.45 -2.54 0.00 0.00 175.29 174.86 1dbm n SER 91 N 2.19 3.53 0.00 12.60 2.88 0.12 -2.52 113.62 132.42 1dbm n SER 91 Ca -0.16 -3.40 0.00 0.00 -1.33 0.00 0.00 58.87 53.98 1dbm n SER 91 Cb 0.53 -0.51 0.00 0.00 -0.75 0.00 0.00 64.21 63.49 1dbm n SER 91 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1dbm n SER 92 N -0.27 4.91 -4.27 -3.46 7.64 -1.26 -4.52 113.62 112.39 1dbm n SER 92 Ca 0.29 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.86 1dbm n SER 92 Cb 0.66 0.60 -0.16 0.00 -1.01 0.00 0.00 64.21 64.30 1dbm n SER 92 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1dbm s HIS 93 N -1.98 2.39 0.24 1.43 3.76 -1.26 -4.97 115.29 114.90 1dbm s HIS 93 Ca 0.00 -0.68 -0.30 0.00 -0.15 0.00 0.00 55.06 53.93 1dbm s HIS 93 Cb 0.00 -1.57 -0.09 0.00 1.11 0.00 0.00 32.58 32.04 1dbm s HIS 93 CO 0.00 -0.20 1.08 0.08 -0.85 0.00 0.00 174.74 174.85 1dbm s VAL 94 N -0.21 3.68 0.38 -0.90 1.01 -1.26 -3.19 120.40 119.91 1dbm s VAL 94 Ca -0.02 1.61 -0.23 0.00 0.00 0.00 0.00 61.98 63.34 1dbm s VAL 94 Cb -0.13 -4.03 -0.10 0.00 0.00 0.00 0.00 36.38 32.12 1dbm s VAL 94 CO 0.03 0.35 0.95 -2.84 0.00 0.00 0.00 175.10 173.59 1dbm s PRO 95 N -1.08 4.39 0.35 2.72 0.02 -1.26 -4.96 135.00 135.18 1dbm s PRO 95 Ca 0.45 1.22 -0.28 0.00 0.02 0.00 0.00 61.00 62.42 1dbm s PRO 95 Cb -0.30 -2.47 -0.12 0.00 0.02 0.00 0.00 34.50 31.62 1dbm s PRO 95 CO 0.38 0.11 1.32 -2.30 -0.33 0.00 0.00 177.00 176.18 1dbm n PRO 96 N -0.08 2.21 -4.44 5.54 -0.02 -1.19 -4.73 135.00 132.28 1dbm n PRO 96 Ca 0.05 0.78 -0.21 0.00 -2.02 0.00 0.00 63.50 62.09 1dbm n PRO 96 Cb 0.52 -2.38 -0.11 0.00 -0.02 0.00 0.00 33.50 31.51 1dbm n PRO 96 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1dbm s THR 97 N -1.08 1.16 0.10 3.45 -4.23 -1.05 -4.96 115.64 109.03 1dbm s THR 97 Ca 0.55 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 59.15 1dbm s THR 97 Cb -0.56 -2.79 -0.04 0.00 1.34 0.00 0.00 72.50 70.46 1dbm s THR 97 CO 0.62 0.00 -0.23 -0.36 -0.54 0.00 0.00 174.62 174.11 1dbm s PHE 98 N -3.32 2.01 0.79 3.99 0.08 -1.26 -2.14 117.98 118.13 1dbm s PHE 98 Ca 0.37 -0.40 -0.10 0.00 0.12 0.00 0.00 56.93 56.91 1dbm s PHE 98 Cb 0.09 -1.11 0.08 0.00 -0.57 0.00 0.00 43.02 41.51 1dbm s PHE 98 CO 0.15 0.24 1.14 0.20 -0.10 0.00 0.00 175.22 176.85 1dbm s GLY 99 N -1.86 1.64 0.19 4.36 0.00 -0.43 -4.55 107.32 106.67 1dbm s GLY 99 Ca 0.10 -0.80 -0.01 0.00 0.00 0.00 0.00 44.72 44.01 1dbm s GLY 99 CO 0.05 -0.31 1.48 -1.33 0.00 0.00 0.00 173.10 172.99 1dbm h GLY 100 N -0.95 0.47 0.00 0.20 0.00 -1.90 -3.45 103.07 97.44 1dbm h GLY 100 Ca -0.45 -0.61 0.00 0.00 0.00 0.00 0.00 47.33 46.27 1dbm h GLY 100 CO 0.62 0.54 0.00 0.61 0.00 0.00 0.00 176.54 178.31 1dbm n GLY 101 N 0.40 2.90 2.76 4.60 0.00 -1.26 -5.01 105.19 109.58 1dbm n GLY 101 Ca -0.04 -2.00 -0.19 0.00 0.00 0.00 0.00 46.02 43.79 1dbm n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1dbm s THR 102 N -2.78 -0.25 0.09 2.61 2.01 -0.75 -4.71 115.64 111.86 1dbm s THR 102 Ca 0.00 0.11 -0.27 0.00 0.31 0.00 0.00 61.69 61.83 1dbm s THR 102 Cb 0.00 -0.47 -0.06 0.00 0.01 0.00 0.00 72.50 71.98 1dbm s THR 102 CO 0.00 -0.05 0.85 -0.75 -0.69 0.00 0.00 174.62 173.99 1dbm s LYS 103 N 2.27 4.60 0.04 4.92 2.20 0.23 -1.00 119.74 132.99 1dbm s LYS 103 Ca 0.04 1.25 -0.18 0.00 -0.36 0.00 0.00 55.97 56.72 1dbm s LYS 103 Cb -0.14 -3.36 -0.06 0.00 -1.51 0.00 0.00 37.83 32.76 1dbm s LYS 103 CO -0.08 0.28 0.52 -1.17 -0.36 0.00 0.00 175.35 174.54 1dbm s LEU 104 N -0.14 4.50 0.05 5.43 2.96 -0.04 -1.16 118.68 130.28 1dbm s LEU 104 Ca 0.42 1.16 -0.11 0.00 -0.22 0.00 0.00 54.13 55.38 1dbm s LEU 104 Cb -0.22 -2.81 0.01 0.00 0.50 0.00 0.00 46.19 43.67 1dbm s LEU 104 CO 0.26 0.27 0.23 -1.83 -1.32 0.00 0.00 176.35 173.96 1dbm s GLU 105 N -0.97 0.76 0.32 1.98 -1.05 -0.09 -4.25 118.70 115.39 1dbm s GLU 105 Ca 0.28 -0.63 -0.15 0.00 -0.15 0.00 0.00 54.97 54.32 1dbm s GLU 105 Cb -0.18 0.32 -0.09 0.00 -0.44 0.00 0.00 34.13 33.73 1dbm s GLU 105 CO 0.17 -0.23 0.73 0.42 0.95 0.00 0.00 175.26 177.30 1dbm s ILE 106 N -2.74 4.69 0.06 1.83 1.01 -1.26 -0.80 121.20 123.99 1dbm s ILE 106 Ca -0.04 0.93 0.08 0.00 0.00 0.00 0.00 60.65 61.62 1dbm s ILE 106 Cb -0.00 -3.61 -0.03 0.00 0.01 0.00 0.00 42.46 38.82 1dbm s ILE 106 CO -0.05 -0.17 -0.19 -1.59 0.00 0.00 0.00 174.94 172.94 1dbm s LYS 107 N -2.95 1.97 0.33 2.79 -2.85 -0.96 -4.64 119.74 113.42 1dbm s LYS 107 Ca 0.54 -1.04 -0.08 0.00 -1.00 0.00 0.00 55.97 54.38 1dbm s LYS 107 Cb -0.10 -2.14 0.01 0.00 -2.06 0.00 0.00 37.83 33.54 1dbm s LYS 107 CO 0.18 0.52 0.55 -0.98 0.10 0.00 0.00 175.35 175.72 1dbm s ARG 108 N -1.57 1.91 0.45 1.78 1.04 -1.26 -4.78 118.95 116.53 1dbm s ARG 108 Ca 0.15 -1.56 -0.23 0.00 -1.04 0.00 0.00 55.73 53.04 1dbm s ARG 108 Cb -0.10 0.49 -0.09 0.00 -2.04 0.00 0.00 34.95 33.21 1dbm s ARG 108 CO 0.06 -0.82 1.07 0.00 -0.04 0.00 0.00 175.30 175.57 1dbm n ALA 109 N -0.52 0.48 -1.77 7.88 0.00 -1.26 -4.92 120.51 120.41 1dbm n ALA 109 Ca -0.02 0.20 -0.40 0.00 0.00 0.00 0.00 53.44 53.21 1dbm n ALA 109 Cb 0.61 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.93 1dbm n ALA 109 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1dbm s ASP 110 N -0.78 6.21 0.10 0.00 1.01 -1.26 -4.83 116.67 117.12 1dbm s ASP 110 Ca 0.65 2.94 0.06 0.00 0.71 0.00 0.00 52.55 56.91 1dbm s ASP 110 Cb -0.52 -2.66 -0.03 0.00 1.01 0.00 0.00 42.92 40.72 1dbm s ASP 110 CO 0.55 -0.95 -0.16 0.00 0.21 0.00 0.00 175.17 174.82 1dbm s ALA 111 N -1.16 1.47 0.11 5.23 0.00 -0.71 -4.92 121.76 121.78 1dbm s ALA 111 Ca 0.56 -1.19 0.04 0.00 0.00 0.00 0.00 51.96 51.37 1dbm s ALA 111 Cb -0.44 -0.13 -0.04 0.00 0.00 0.00 0.00 23.12 22.51 1dbm s ALA 111 CO 0.59 0.19 0.06 0.00 0.00 0.00 0.00 175.76 176.59 1dbm s ALA 112 N -1.61 3.46 -0.06 0.00 0.00 -1.26 -2.39 121.76 119.89 1dbm s ALA 112 Ca 0.05 -1.11 -0.30 0.00 0.00 0.00 0.00 51.96 50.60 1dbm s ALA 112 Cb -0.08 -1.31 -0.03 0.00 0.00 0.00 0.00 23.12 21.70 1dbm s ALA 112 CO 0.03 0.66 1.23 -1.25 0.00 0.00 0.00 175.76 176.43 1dbm s PRO 113 N -2.56 4.33 -0.78 0.00 0.04 -1.26 -4.35 135.00 130.42 1dbm s PRO 113 Ca 0.28 1.70 -0.25 0.00 0.04 0.00 0.00 61.00 62.78 1dbm s PRO 113 Cb -0.11 -3.59 0.05 0.00 0.04 0.00 0.00 34.50 30.89 1dbm s PRO 113 CO 0.21 -0.50 1.23 0.95 0.04 0.00 0.00 177.00 178.93 1dbm s THR 114 N 2.41 3.95 0.00 1.26 -4.23 0.49 -4.73 115.64 114.80 1dbm s THR 114 Ca 0.57 -0.08 -0.17 0.00 -1.18 0.00 0.00 61.69 60.82 1dbm s THR 114 Cb -0.25 -4.88 -0.06 0.00 1.34 0.00 0.00 72.50 68.65 1dbm s THR 114 CO 0.21 -1.76 0.49 0.54 -0.54 0.00 0.00 174.62 173.56 1dbm s VAL 115 N 5.06 4.96 0.03 2.29 0.11 -1.26 -2.68 120.40 128.90 1dbm s VAL 115 Ca 0.34 1.02 0.04 0.00 -2.93 0.00 0.00 61.98 60.44 1dbm s VAL 115 Cb -0.08 -3.81 -0.02 0.00 -1.53 0.00 0.00 36.38 30.94 1dbm s VAL 115 CO 0.08 0.51 -0.12 -0.44 -3.33 0.00 0.00 175.10 171.80 1dbm s SER 116 N -0.69 1.39 0.14 3.54 0.01 -0.19 -4.93 113.70 112.97 1dbm s SER 116 Ca 0.26 -0.39 0.09 0.00 1.31 0.00 0.00 55.95 57.22 1dbm s SER 116 Cb -0.17 -0.09 -0.04 0.00 0.21 0.00 0.00 66.02 65.93 1dbm s SER 116 CO 0.15 0.02 -0.17 -0.51 0.41 0.00 0.00 173.24 173.14 1dbm s ILE 117 N -0.75 2.89 -0.03 1.44 2.07 -1.26 -0.59 121.20 124.97 1dbm s ILE 117 Ca 0.00 -1.57 0.01 0.00 -1.41 0.00 0.00 60.65 57.69 1dbm s ILE 117 Cb -0.07 -2.35 0.01 0.00 0.13 0.00 0.00 42.46 40.18 1dbm s ILE 117 CO 0.01 0.04 -0.05 -0.36 -1.91 0.00 0.00 174.94 172.67 1dbm s PHE 118 N -1.30 0.65 0.63 3.50 0.40 0.12 -4.95 117.98 117.03 1dbm s PHE 118 Ca 0.20 -0.15 -0.07 0.00 -0.60 0.00 0.00 56.93 56.30 1dbm s PHE 118 Cb -0.10 -0.53 0.01 0.00 0.51 0.00 0.00 43.02 42.91 1dbm s PHE 118 CO 0.11 -0.11 0.96 -2.14 0.70 0.00 0.00 175.22 174.74 1dbm s PRO 119 N 0.51 2.84 0.01 0.24 0.02 -1.26 -2.17 135.00 135.19 1dbm s PRO 119 Ca -0.06 0.09 -0.34 0.00 0.02 0.00 0.00 61.00 60.71 1dbm s PRO 119 Cb -0.10 -2.20 -0.12 0.00 0.02 0.00 0.00 34.50 32.10 1dbm s PRO 119 CO -0.00 -0.83 1.77 -2.30 -0.33 0.00 0.00 177.00 175.31 1dbm n PRO 120 N -2.72 2.22 -1.54 5.54 -0.02 -1.25 -4.89 135.00 132.34 1dbm n PRO 120 Ca 0.05 0.81 -0.41 0.00 -2.02 0.00 0.00 63.50 61.93 1dbm n PRO 120 Cb 0.58 -2.63 0.01 0.00 -0.02 0.00 0.00 33.50 31.44 1dbm n PRO 120 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1dbm n SER 121 N 5.48 0.22 0.02 2.55 2.88 -1.26 -4.92 113.62 118.58 1dbm n SER 121 Ca 0.20 0.95 -0.02 0.00 -1.33 0.00 0.00 58.87 58.67 1dbm n SER 121 Cb 0.30 -1.25 0.24 0.00 -0.75 0.00 0.00 64.21 62.75 1dbm n SER 121 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1dbm h SER 122 N 1.09 0.46 0.45 -3.46 0.02 -1.99 -3.00 113.55 107.12 1dbm h SER 122 Ca -0.43 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.39 1dbm h SER 122 Cb 1.37 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.78 1dbm h SER 122 CO 0.54 0.66 0.00 -1.84 -1.14 0.00 0.00 176.83 175.05 1dbm n GLU 123 N -4.17 0.02 -0.03 3.45 0.00 -1.26 -2.20 120.64 116.44 1dbm n GLU 123 Ca 0.00 0.30 -0.22 0.00 0.00 0.00 0.00 57.16 57.24 1dbm n GLU 123 Cb 0.36 -1.54 -0.13 0.00 0.00 0.00 0.00 31.44 30.13 1dbm n GLU 123 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.13 178.07 1dbm n GLN 124 N -1.57 0.71 -0.29 3.44 7.27 -1.14 -4.00 117.38 121.79 1dbm n GLN 124 Ca 0.03 0.33 -0.01 0.00 0.07 0.00 0.00 57.00 57.42 1dbm n GLN 124 Cb 0.15 -1.70 0.11 0.00 2.41 0.00 0.00 30.24 31.21 1dbm n GLN 124 CO 0.00 0.00 0.00 -0.07 0.07 0.00 0.00 177.06 177.06 1dbm h LEU 125 N -0.21 0.81 -1.06 1.69 3.38 -1.35 -1.30 115.31 117.26 1dbm h LEU 125 Ca -0.42 0.00 0.21 0.00 0.09 0.00 0.00 57.88 57.76 1dbm h LEU 125 Cb 1.85 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 42.40 1dbm h LEU 125 CO -0.00 0.54 1.03 0.74 0.09 0.00 0.00 178.44 180.84 1dbm h THR 126 N 0.95 0.05 0.00 0.22 2.02 -1.60 0.24 112.91 114.79 1dbm h THR 126 Ca 0.33 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.51 1dbm h THR 126 Cb 0.07 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 66.61 1dbm h THR 126 CO -0.13 0.00 -0.23 -1.54 0.37 0.00 0.00 175.52 173.99 1dbm n SER 127 N -3.17 0.63 0.00 4.18 3.41 -0.56 -5.04 113.62 113.06 1dbm n SER 127 Ca 0.16 -0.49 0.00 0.00 -0.26 0.00 0.00 58.87 58.28 1dbm n SER 127 Cb 1.26 1.01 0.00 0.00 -0.26 0.00 0.00 64.21 66.22 1dbm n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1dbm n GLY 128 N 1.21 1.19 2.60 5.00 0.00 0.83 -5.06 105.19 110.96 1dbm n GLY 128 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 1dbm n GLY 128 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dbm n GLY 129 N 0.00 3.22 3.21 -0.02 0.00 -1.04 -0.88 105.19 109.69 1dbm n GLY 129 Ca 0.00 -1.92 0.04 0.00 0.00 0.00 0.00 46.02 44.14 1dbm n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dbm s ALA 130 N -3.02 -2.72 -0.20 4.61 0.00 -0.67 -3.10 121.76 116.67 1dbm s ALA 130 Ca 0.27 1.76 -0.05 0.00 0.00 0.00 0.00 51.96 53.94 1dbm s ALA 130 Cb 0.01 -2.25 -0.03 0.00 0.00 0.00 0.00 23.12 20.86 1dbm s ALA 130 CO 0.19 -1.31 0.01 -1.12 0.00 0.00 0.00 175.76 173.53 1dbm s SER 131 N 2.85 4.91 0.22 0.00 0.01 -1.26 -0.90 113.70 119.53 1dbm s SER 131 Ca 0.08 -0.17 -0.09 0.00 1.31 0.00 0.00 55.95 57.08 1dbm s SER 131 Cb -0.12 -1.84 -0.07 0.00 0.21 0.00 0.00 66.02 64.20 1dbm s SER 131 CO -0.17 0.08 0.54 -0.69 0.41 0.00 0.00 173.24 173.40 1dbm s VAL 132 N 0.93 4.95 -0.03 3.43 1.01 0.17 -3.87 120.40 126.99 1dbm s VAL 132 Ca 0.01 0.43 -0.00 0.00 0.00 0.00 0.00 61.98 62.42 1dbm s VAL 132 Cb -0.14 -3.62 0.03 0.00 0.00 0.00 0.00 36.38 32.65 1dbm s VAL 132 CO 0.02 -0.07 0.03 -0.69 0.00 0.00 0.00 175.10 174.39 1dbm s VAL 133 N -1.81 -0.02 -0.03 2.92 1.01 -0.92 -1.66 120.40 119.88 1dbm s VAL 133 Ca 0.47 0.24 0.07 0.00 0.00 0.00 0.00 61.98 62.75 1dbm s VAL 133 Cb -0.11 -0.14 -0.02 0.00 0.00 0.00 0.00 36.38 36.11 1dbm s VAL 133 CO 0.22 0.12 -0.23 0.00 0.00 0.00 0.00 175.10 175.21 1dbm s PHE 135 N -0.55 2.56 -0.34 0.00 0.08 0.24 -2.14 117.98 117.83 1dbm s PHE 135 Ca 0.08 -0.90 -0.04 0.00 0.12 0.00 0.00 56.93 56.18 1dbm s PHE 135 Cb -0.11 -1.69 0.05 0.00 -0.57 0.00 0.00 43.02 40.70 1dbm s PHE 135 CO 0.00 -0.33 0.08 -0.51 -0.10 0.00 0.00 175.22 174.36 1dbm s LEU 136 N 0.19 4.31 0.15 -0.37 1.02 0.26 -1.02 118.68 123.21 1dbm s LEU 136 Ca -0.14 -1.30 0.09 0.00 0.02 0.00 0.00 54.13 52.81 1dbm s LEU 136 Cb -0.17 -1.81 -0.04 0.00 0.02 0.00 0.00 46.19 44.19 1dbm s LEU 136 CO 0.07 -0.34 -0.21 0.20 0.02 0.00 0.00 176.35 176.10 1dbm s ASN 137 N 1.43 2.84 -1.34 2.29 0.02 -1.09 -0.15 114.94 118.94 1dbm s ASN 137 Ca -0.02 -0.81 -0.06 0.00 -1.02 0.00 0.00 52.86 50.95 1dbm s ASN 137 Cb -0.20 -0.18 -0.00 0.00 0.02 0.00 0.00 41.25 40.89 1dbm s ASN 137 CO 0.01 0.04 0.52 0.59 0.02 0.00 0.00 177.10 178.27 1dbm n ASN 138 N 0.54 -1.58 -4.53 -1.22 4.13 -1.04 -0.38 115.26 111.19 1dbm n ASN 138 Ca -0.15 -1.02 -0.28 0.00 1.68 0.00 0.00 54.58 54.82 1dbm n ASN 138 Cb 0.56 -3.10 -0.10 0.00 -1.54 0.00 0.00 39.78 35.59 1dbm n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1dbm s PHE 139 N -3.83 2.57 -0.02 3.10 -0.71 -1.10 -4.52 117.98 113.46 1dbm s PHE 139 Ca 0.13 -0.25 -0.02 0.00 -1.04 0.00 0.00 56.93 55.75 1dbm s PHE 139 Cb -0.05 -1.29 0.01 0.00 -1.21 0.00 0.00 43.02 40.48 1dbm s PHE 139 CO 0.88 0.47 0.06 -0.47 -1.34 0.00 0.00 175.22 174.82 1dbm s TYR 140 N -1.51 -0.06 0.32 3.49 5.04 -1.00 -0.82 117.35 122.79 1dbm s TYR 140 Ca 0.22 0.17 0.03 0.00 -2.44 0.00 0.00 57.07 55.05 1dbm s TYR 140 Cb -0.09 0.00 -0.02 0.00 0.35 0.00 0.00 41.96 42.20 1dbm s TYR 140 CO 0.13 -0.04 0.48 -1.25 -1.34 0.00 0.00 175.55 173.53 1dbm s PRO 141 N 0.13 3.34 0.01 4.97 0.05 -1.26 -1.74 135.00 140.50 1dbm s PRO 141 Ca -0.01 -0.65 0.00 0.00 0.05 0.00 0.00 61.00 60.39 1dbm s PRO 141 Cb -0.02 -2.77 0.00 0.00 0.05 0.00 0.00 34.50 31.77 1dbm s PRO 141 CO -0.00 0.18 0.50 0.36 0.05 0.00 0.00 177.00 178.09 1dbm n LYS 142 N -1.65 0.00 -3.84 4.56 2.85 -1.26 -4.53 118.16 114.29 1dbm n LYS 142 Ca -0.05 0.02 -0.37 0.00 -1.05 0.00 0.00 58.31 56.87 1dbm n LYS 142 Cb 0.57 -1.97 -0.06 0.00 -0.65 0.00 0.00 35.03 32.92 1dbm n LYS 142 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1dbm s ASP 143 N -1.98 6.36 -0.22 -5.58 1.11 -1.26 -5.04 116.67 110.06 1dbm s ASP 143 Ca 0.00 0.43 -0.24 0.00 0.18 0.00 0.00 52.55 52.92 1dbm s ASP 143 Cb 0.00 -2.08 0.06 0.00 1.07 0.00 0.00 42.92 41.97 1dbm s ASP 143 CO 0.00 0.35 0.65 -0.51 1.18 0.00 0.00 175.17 176.85 1dbm s ILE 144 N -0.71 0.00 -0.12 0.77 2.07 -1.26 -4.74 121.20 117.22 1dbm s ILE 144 Ca 0.14 -0.01 0.01 0.00 -1.41 0.00 0.00 60.65 59.38 1dbm s ILE 144 Cb -0.12 -0.92 -0.01 0.00 0.13 0.00 0.00 42.46 41.54 1dbm s ILE 144 CO 0.03 -0.01 -0.17 0.21 -1.91 0.00 0.00 174.94 173.10 1dbm s ASN 145 N 0.14 3.71 -0.31 4.50 2.47 -1.09 -4.99 114.94 119.37 1dbm s ASN 145 Ca -0.01 -0.40 -0.01 0.00 0.42 0.00 0.00 52.86 52.86 1dbm s ASN 145 Cb -0.04 -1.51 0.06 0.00 -1.45 0.00 0.00 41.25 38.31 1dbm s ASN 145 CO 0.02 0.17 0.01 0.68 -3.72 0.00 0.00 177.10 174.26 1dbm s VAL 146 N 0.31 2.91 0.30 -5.21 -7.23 -1.26 -1.11 120.40 109.11 1dbm s VAL 146 Ca -0.13 -1.53 -0.20 0.00 -1.81 0.00 0.00 61.98 58.31 1dbm s VAL 146 Cb -0.16 -2.74 -0.09 0.00 0.56 0.00 0.00 36.38 33.95 1dbm s VAL 146 CO 0.07 -0.19 0.81 -0.75 -0.31 0.00 0.00 175.10 174.72 1dbm s LYS 147 N 1.21 4.25 -0.54 4.82 2.47 0.29 -4.87 119.74 127.37 1dbm s LYS 147 Ca -0.03 0.95 0.04 0.00 -1.56 0.00 0.00 55.97 55.36 1dbm s LYS 147 Cb -0.20 -2.64 0.13 0.00 -1.46 0.00 0.00 37.83 33.66 1dbm s LYS 147 CO -0.02 0.24 0.29 -1.58 0.16 0.00 0.00 175.35 174.44 1dbm s TRP 148 N -1.76 3.22 -0.41 4.03 0.52 -1.26 -0.09 118.94 123.19 1dbm s TRP 148 Ca 0.50 -3.17 -0.29 0.00 0.02 0.00 0.00 56.10 53.16 1dbm s TRP 148 Cb -0.14 -2.83 0.02 0.00 -1.15 0.00 0.00 33.47 29.37 1dbm s TRP 148 CO 0.19 -0.73 1.26 0.21 0.02 0.00 0.00 176.95 177.90 1dbm s LYS 149 N -0.39 3.74 -0.02 4.98 2.20 0.28 -0.61 119.74 129.92 1dbm s LYS 149 Ca 0.18 0.86 0.13 0.00 -0.36 0.00 0.00 55.97 56.78 1dbm s LYS 149 Cb -0.24 -3.93 0.39 0.00 -1.51 0.00 0.00 37.83 32.54 1dbm s LYS 149 CO -0.02 -1.36 1.32 1.51 -0.36 0.00 0.00 175.35 176.45 1dbm n ILE 150 N 6.73 1.16 -1.99 5.43 3.06 0.32 0.35 119.36 134.41 1dbm n ILE 150 Ca 0.14 -1.09 -0.00 0.00 -2.50 0.00 0.00 62.75 59.30 1dbm n ILE 150 Cb 0.48 0.41 0.00 0.00 0.54 0.00 0.00 39.64 41.08 1dbm n ILE 150 CO 0.00 0.00 0.00 -0.67 -2.50 0.00 0.00 176.55 173.38 1dbm n ASP 151 N 0.60 -0.03 0.00 9.51 2.03 -1.24 -4.74 116.55 122.68 1dbm n ASP 151 Ca 0.15 -0.52 0.00 0.00 0.52 0.00 0.00 54.79 54.94 1dbm n ASP 151 Cb 0.52 0.01 0.00 0.00 -0.72 0.00 0.00 41.12 40.93 1dbm n ASP 151 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1dbm n GLY 152 N -0.02 2.05 0.00 0.27 0.00 -1.26 -4.98 105.19 101.25 1dbm n GLY 152 Ca -0.01 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.72 1dbm n GLY 152 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1dbm n SER 153 N 3.37 -1.07 -4.30 1.61 7.64 -1.26 -4.97 113.62 114.64 1dbm n SER 153 Ca 0.00 -0.46 -0.31 0.00 1.01 0.00 0.00 58.87 59.11 1dbm n SER 153 Cb 0.00 0.00 -0.16 0.00 -1.01 0.00 0.00 64.21 63.04 1dbm n SER 153 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1dbm s GLU 154 N -2.97 2.15 0.03 1.43 2.12 -1.26 -0.53 118.70 119.68 1dbm s GLU 154 Ca 0.00 -0.93 0.04 0.00 0.36 0.00 0.00 54.97 54.45 1dbm s GLU 154 Cb 0.00 -2.05 -0.03 0.00 0.26 0.00 0.00 34.13 32.31 1dbm s GLU 154 CO 0.00 0.54 -0.08 0.50 -0.54 0.00 0.00 175.26 175.68 1dbm s ARG 155 N -0.56 2.42 -0.20 4.30 3.52 0.22 -4.77 118.95 123.88 1dbm s ARG 155 Ca 0.09 -0.81 -0.16 0.00 -0.13 0.00 0.00 55.73 54.71 1dbm s ARG 155 Cb -0.10 -2.43 -0.08 0.00 -1.56 0.00 0.00 34.95 30.78 1dbm s ARG 155 CO -0.01 0.58 -0.31 0.00 -0.81 0.00 0.00 175.30 174.75 1dbm n GLN 156 N 1.37 0.54 -3.79 5.12 -0.00 -1.26 -4.44 117.38 114.92 1dbm n GLN 156 Ca -0.15 0.28 -0.31 0.00 -0.00 0.00 0.00 57.00 56.81 1dbm n GLN 156 Cb 0.52 -1.49 -0.04 0.00 -0.00 0.00 0.00 30.24 29.23 1dbm n GLN 156 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.06 178.27 1dbm s ASN 157 N -6.37 6.43 0.00 2.61 2.47 -1.26 -3.99 114.94 114.83 1dbm s ASN 157 Ca -0.30 0.44 0.00 0.00 0.42 0.00 0.00 52.86 53.42 1dbm s ASN 157 Cb 0.07 -2.03 0.00 0.00 -1.45 0.00 0.00 41.25 37.84 1dbm s ASN 157 CO 0.43 0.12 0.00 0.61 -3.72 0.00 0.00 177.10 174.54 1dbm n GLY 158 N 0.24 1.87 3.78 1.21 0.00 -1.26 -4.51 105.19 106.51 1dbm n GLY 158 Ca -0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.63 1dbm n GLY 158 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dbm s VAL 159 N -2.33 3.30 -0.02 1.61 0.11 -1.25 -1.27 120.40 120.55 1dbm s VAL 159 Ca 0.00 0.80 -0.01 0.00 -2.93 0.00 0.00 61.98 59.84 1dbm s VAL 159 Cb 0.00 -3.31 0.01 0.00 -1.53 0.00 0.00 36.38 31.54 1dbm s VAL 159 CO 0.00 -0.19 0.04 -0.76 -3.33 0.00 0.00 175.10 170.86 1dbm s LEU 160 N -3.81 1.70 0.38 2.54 1.43 -0.84 -4.91 118.68 115.17 1dbm s LEU 160 Ca 0.71 0.07 0.08 0.00 -1.03 0.00 0.00 54.13 53.96 1dbm s LEU 160 Cb -0.22 0.09 -0.05 0.00 0.03 0.00 0.00 46.19 46.04 1dbm s LEU 160 CO 0.26 -0.04 0.13 0.20 0.23 0.00 0.00 176.35 177.14 1dbm s ASN 161 N 0.24 4.43 -0.28 2.29 -0.87 -1.26 -2.37 114.94 117.11 1dbm s ASN 161 Ca -0.02 -0.98 -0.19 0.00 -1.57 0.00 0.00 52.86 50.10 1dbm s ASN 161 Cb -0.03 -0.56 0.08 0.00 -0.02 0.00 0.00 41.25 40.73 1dbm s ASN 161 CO -0.01 -0.40 0.71 -0.55 -2.57 0.00 0.00 177.10 174.28 1dbm s SER 162 N -3.84 -0.87 0.30 -1.22 0.15 -1.20 -4.98 113.70 102.05 1dbm s SER 162 Ca 0.39 1.47 0.09 0.00 0.70 0.00 0.00 55.95 58.60 1dbm s SER 162 Cb 0.01 1.41 -0.04 0.00 -1.71 0.00 0.00 66.02 65.69 1dbm s SER 162 CO 0.22 -0.24 0.07 0.26 1.20 0.00 0.00 173.24 174.75 1dbm s TRP 163 N 1.20 2.72 0.42 3.44 0.51 -1.26 -2.18 118.94 123.79 1dbm s TRP 163 Ca -0.06 -0.29 0.04 0.00 -2.12 0.00 0.00 56.10 53.67 1dbm s TRP 163 Cb -0.05 -1.40 0.00 0.00 -0.81 0.00 0.00 33.47 31.21 1dbm s TRP 163 CO -0.13 0.49 0.60 0.95 -0.51 0.00 0.00 176.95 178.36 1dbm s THR 164 N -2.36 3.58 0.39 2.01 -4.23 -0.15 -4.97 115.64 109.90 1dbm s THR 164 Ca 0.34 -0.80 -0.06 0.00 -1.18 0.00 0.00 61.69 60.00 1dbm s THR 164 Cb -0.05 -3.27 0.09 0.00 1.34 0.00 0.00 72.50 70.61 1dbm s THR 164 CO 0.21 -0.14 0.53 -0.67 -0.54 0.00 0.00 174.62 174.00 1dbm n ASP 165 N -1.94 0.14 -4.62 3.99 -0.08 -1.26 -4.45 116.55 108.34 1dbm n ASP 165 Ca 0.03 -1.25 -0.43 0.00 -1.51 0.00 0.00 54.79 51.63 1dbm n ASP 165 Cb 0.58 -0.39 -0.03 0.00 2.34 0.00 0.00 41.12 43.62 1dbm n ASP 165 CO 0.00 0.00 0.00 -1.58 0.12 0.00 0.00 177.20 175.74 1dbm s GLN 166 N -4.07 3.43 -0.10 -0.67 0.74 -1.26 -4.71 119.66 113.01 1dbm s GLN 166 Ca 0.31 2.06 -0.29 0.00 0.05 0.00 0.00 55.36 57.49 1dbm s GLN 166 Cb -0.01 -4.28 -0.07 0.00 1.10 0.00 0.00 33.01 29.75 1dbm s GLN 166 CO 0.21 -1.76 2.08 0.34 -0.55 0.00 0.00 175.29 175.61 1dbm s ASP 167 N 6.88 5.95 0.37 6.67 -1.08 -0.15 -4.88 116.67 130.43 1dbm s ASP 167 Ca 0.93 2.23 0.06 0.00 -0.52 0.00 0.00 52.55 55.26 1dbm s ASP 167 Cb -0.33 -2.52 0.72 0.00 -1.46 0.00 0.00 42.92 39.32 1dbm s ASP 167 CO 0.36 -1.52 1.93 0.77 0.52 0.00 0.00 175.17 177.23 1dbm h SER 168 N 12.82 0.42 -0.27 -0.34 4.64 -1.88 0.40 113.55 129.34 1dbm h SER 168 Ca -0.45 -0.06 -0.15 0.00 -0.47 0.00 0.00 61.79 60.67 1dbm h SER 168 Cb 1.23 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1dbm h SER 168 CO 0.95 0.46 -0.40 0.50 -0.87 0.00 0.00 176.83 177.47 1dbm h LYS 169 N 0.44 0.75 0.00 4.77 3.64 -1.98 -3.36 116.57 120.83 1dbm h LYS 169 Ca 0.10 -0.45 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 1dbm h LYS 169 Cb 0.24 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 1dbm h LYS 169 CO 0.00 1.07 0.00 -0.40 -2.27 0.00 0.00 179.45 177.86 1dbm n ASP 170 N -4.17 1.37 -2.06 4.20 5.75 -1.11 -4.99 116.55 115.54 1dbm n ASP 170 Ca -0.04 -1.53 -0.15 0.00 -0.01 0.00 0.00 54.79 53.05 1dbm n ASP 170 Cb 0.54 0.00 0.02 0.00 -1.03 0.00 0.00 41.12 40.65 1dbm n ASP 170 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1dbm n SER 171 N -0.27 -4.67 -3.76 -1.12 7.64 0.14 -5.00 113.62 106.57 1dbm n SER 171 Ca 0.00 -0.16 -0.15 0.00 1.01 0.00 0.00 58.87 59.56 1dbm n SER 171 Cb 0.20 -3.60 0.01 0.00 -1.01 0.00 0.00 64.21 59.81 1dbm n SER 171 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1dbm n THR 172 N -4.11 0.00 -4.65 0.44 -1.04 -1.15 -4.79 114.28 98.98 1dbm n THR 172 Ca -0.10 -1.32 -0.29 0.00 -2.04 0.00 0.00 64.05 60.29 1dbm n THR 172 Cb 0.59 -0.29 -0.09 0.00 -1.82 0.00 0.00 70.33 68.73 1dbm n THR 172 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1dbm s TYR 173 N -1.61 1.96 -0.08 -1.42 2.02 -0.00 -0.97 117.35 117.24 1dbm s TYR 173 Ca 0.22 -0.99 -0.26 0.00 -0.37 0.00 0.00 57.07 55.67 1dbm s TYR 173 Cb -0.02 -1.50 0.06 0.00 -0.40 0.00 0.00 41.96 40.10 1dbm s TYR 173 CO 0.14 0.11 0.59 -1.12 -1.57 0.00 0.00 175.55 173.70 1dbm s SER 174 N -3.75 -0.56 0.03 2.29 0.01 -1.26 -2.49 113.70 107.97 1dbm s SER 174 Ca 0.18 0.70 0.03 0.00 1.31 0.00 0.00 55.95 58.16 1dbm s SER 174 Cb 0.04 0.65 -0.02 0.00 0.21 0.00 0.00 66.02 66.90 1dbm s SER 174 CO 0.09 -0.49 -0.09 -0.32 0.41 0.00 0.00 173.24 172.84 1dbm s MET 175 N -0.90 0.61 -0.09 12.44 1.75 0.78 -0.97 119.30 132.92 1dbm s MET 175 Ca -0.09 -0.63 -0.02 0.00 -1.25 0.00 0.00 55.69 53.69 1dbm s MET 175 Cb -0.02 -0.49 0.03 0.00 2.84 0.00 0.00 34.83 37.19 1dbm s MET 175 CO 0.07 0.11 0.02 -1.54 -0.65 0.00 0.00 175.02 173.03 1dbm s SER 176 N -1.15 1.70 -0.05 1.11 1.04 -0.92 -0.58 113.70 114.85 1dbm s SER 176 Ca -0.04 -0.17 0.01 0.00 0.48 0.00 0.00 55.95 56.23 1dbm s SER 176 Cb -0.08 -0.39 -0.03 0.00 0.10 0.00 0.00 66.02 65.62 1dbm s SER 176 CO 0.01 -0.23 -0.06 -0.94 0.98 0.00 0.00 173.24 172.99 1dbm s SER 177 N 2.01 4.67 -0.26 7.02 1.04 -0.91 -3.20 113.70 124.06 1dbm s SER 177 Ca 0.04 -0.04 0.01 0.00 0.48 0.00 0.00 55.95 56.44 1dbm s SER 177 Cb -0.13 -1.16 0.07 0.00 0.10 0.00 0.00 66.02 64.90 1dbm s SER 177 CO -0.05 0.34 -0.02 -0.89 0.98 0.00 0.00 173.24 173.60 1dbm s THR 178 N -0.86 1.59 0.18 2.02 2.01 -1.00 -1.58 115.64 118.01 1dbm s THR 178 Ca 0.14 -1.42 -0.29 0.00 0.31 0.00 0.00 61.69 60.43 1dbm s THR 178 Cb -0.11 -1.93 -0.08 0.00 0.01 0.00 0.00 72.50 70.39 1dbm s THR 178 CO 0.03 -0.24 0.90 -0.22 -0.69 0.00 0.00 174.62 174.40 1dbm s LEU 179 N 1.33 4.59 -0.06 4.42 2.96 -0.67 -1.98 118.68 129.27 1dbm s LEU 179 Ca -0.02 1.81 -0.00 0.00 -0.22 0.00 0.00 54.13 55.70 1dbm s LEU 179 Cb -0.19 -3.51 0.02 0.00 0.50 0.00 0.00 46.19 43.02 1dbm s LEU 179 CO -0.09 0.10 -0.03 -0.89 -1.32 0.00 0.00 176.35 174.13 1dbm s THR 180 N -0.80 0.49 0.26 3.68 2.01 -0.40 -0.66 115.64 120.22 1dbm s THR 180 Ca 0.41 -0.02 0.11 0.00 0.31 0.00 0.00 61.69 62.49 1dbm s THR 180 Cb -0.24 -0.57 -0.05 0.00 0.01 0.00 0.00 72.50 71.65 1dbm s THR 180 CO 0.30 0.25 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.53 1dbm s LEU 181 N 1.41 2.58 0.42 4.42 1.02 -0.08 -4.63 118.68 123.83 1dbm s LEU 181 Ca -0.03 -1.04 -0.23 0.00 0.02 0.00 0.00 54.13 52.85 1dbm s LEU 181 Cb -0.13 -0.98 -0.09 0.00 0.02 0.00 0.00 46.19 45.01 1dbm s LEU 181 CO -0.03 -0.03 1.08 -0.89 0.02 0.00 0.00 176.35 176.50 1dbm s THR 182 N -2.64 3.58 0.20 5.49 2.01 -1.26 -1.67 115.64 121.35 1dbm s THR 182 Ca 0.28 1.18 -0.23 0.00 0.31 0.00 0.00 61.69 63.23 1dbm s THR 182 Cb -0.04 -3.59 0.11 0.00 0.01 0.00 0.00 72.50 69.00 1dbm s THR 182 CO 0.13 -0.03 1.55 0.50 -0.69 0.00 0.00 174.62 176.08 1dbm h LYS 183 N 2.27 -0.03 0.09 4.92 3.11 -1.18 0.47 116.57 126.23 1dbm h LYS 183 Ca -0.49 0.00 0.01 0.00 -2.81 0.00 0.00 60.65 57.37 1dbm h LYS 183 Cb 1.22 0.01 -0.04 0.00 -1.00 0.00 0.00 32.23 32.42 1dbm h LYS 183 CO 0.61 -0.02 -0.45 0.22 -2.81 0.00 0.00 179.45 177.01 1dbm h ASP 184 N -0.03 -1.35 -0.10 4.20 3.58 -1.92 -0.47 116.42 120.33 1dbm h ASP 184 Ca 0.26 0.14 0.03 0.00 0.42 0.00 0.00 57.03 57.89 1dbm h ASP 184 Cb 0.53 0.50 -0.00 0.00 1.72 0.00 0.00 39.33 42.08 1dbm h ASP 184 CO -0.93 -0.47 0.29 -0.08 -2.88 0.00 0.00 179.24 175.17 1dbm h GLU 185 N -0.63 0.00 0.12 0.28 4.57 -1.40 0.25 114.58 117.77 1dbm h GLU 185 Ca -0.00 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 1dbm h GLU 185 Cb 0.64 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.23 1dbm h GLU 185 CO -0.25 0.00 -0.06 -0.92 -1.18 0.00 0.00 179.01 176.60 1dbm h TYR 186 N 0.00 -0.15 0.00 0.92 3.20 0.14 -3.36 116.97 117.72 1dbm h TYR 186 Ca 0.05 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.92 1dbm h TYR 186 Cb 0.62 0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.94 1dbm h TYR 186 CO 0.00 0.13 0.00 -0.85 -1.64 0.00 0.00 178.16 175.80 1dbm n GLU 187 N -4.86 0.27 -1.80 1.82 0.28 -0.01 -2.70 120.64 113.64 1dbm n GLU 187 Ca -0.05 0.10 -0.35 0.00 -0.16 0.00 0.00 57.16 56.71 1dbm n GLU 187 Cb 0.17 -1.50 -0.01 0.00 1.43 0.00 0.00 31.44 31.54 1dbm n GLU 187 CO 0.00 0.00 0.00 2.89 -0.16 0.00 0.00 177.13 179.86 1dbm n ARG 188 N -1.16 2.96 -3.50 3.44 1.85 -0.70 -4.99 116.66 114.56 1dbm n ARG 188 Ca 0.07 -3.11 -0.13 0.00 -1.00 0.00 0.00 57.85 53.68 1dbm n ARG 188 Cb 0.07 -2.26 -0.04 0.00 -1.05 0.00 0.00 32.46 29.19 1dbm n ARG 188 CO 0.00 0.00 0.00 -1.01 -0.01 0.00 0.00 177.63 176.61 1dbm s HIS 189 N -2.88 -0.51 0.00 2.89 3.76 -1.10 -5.06 115.29 112.39 1dbm s HIS 189 Ca 0.54 0.63 0.00 0.00 -0.15 0.00 0.00 55.06 56.08 1dbm s HIS 189 Cb 0.38 0.49 0.00 0.00 1.11 0.00 0.00 32.58 34.55 1dbm s HIS 189 CO -0.29 -0.62 0.00 -1.71 -0.85 0.00 0.00 174.74 171.27 1dbm n ASN 190 N 0.27 0.00 -4.67 1.40 5.15 -1.26 -4.74 115.26 111.40 1dbm n ASN 190 Ca -0.15 0.06 -0.23 0.00 -0.60 0.00 0.00 54.58 53.67 1dbm n ASN 190 Cb 0.60 -0.32 -0.07 0.00 -0.53 0.00 0.00 39.78 39.47 1dbm n ASN 190 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 1dbm s SER 191 N -2.80 4.69 -0.03 1.20 1.04 -1.26 -2.35 113.70 114.19 1dbm s SER 191 Ca 0.00 -0.59 0.01 0.00 0.48 0.00 0.00 55.95 55.85 1dbm s SER 191 Cb 0.00 -0.92 0.02 0.00 0.10 0.00 0.00 66.02 65.21 1dbm s SER 191 CO 0.00 -0.01 -0.04 -0.31 0.98 0.00 0.00 173.24 173.86 1dbm s TYR 192 N -2.30 0.55 -0.04 5.02 1.51 -0.63 -3.73 117.35 117.74 1dbm s TYR 192 Ca 0.32 -0.12 -0.01 0.00 -1.01 0.00 0.00 57.07 56.25 1dbm s TYR 192 Cb -0.07 -0.49 0.03 0.00 -0.11 0.00 0.00 41.96 41.33 1dbm s TYR 192 CO 0.21 -0.12 0.07 -0.08 -1.11 0.00 0.00 175.55 174.52 1dbm s THR 193 N 0.62 -0.07 0.05 -0.71 -1.32 0.15 -2.57 115.64 111.79 1dbm s THR 193 Ca -0.07 0.24 -0.26 0.00 -1.21 0.00 0.00 61.69 60.39 1dbm s THR 193 Cb -0.11 -0.14 -0.05 0.00 -1.51 0.00 0.00 72.50 70.69 1dbm s THR 193 CO -0.00 0.10 0.81 0.00 -2.21 0.00 0.00 174.62 173.32 1dbm s GLU 195 N 0.03 0.63 -0.25 0.00 2.12 0.87 -1.61 118.70 120.49 1dbm s GLU 195 Ca 0.41 0.06 -0.05 0.00 0.36 0.00 0.00 54.97 55.75 1dbm s GLU 195 Cb -0.21 -0.91 -0.00 0.00 0.26 0.00 0.00 34.13 33.27 1dbm s GLU 195 CO 0.24 -0.25 -0.00 0.00 -0.54 0.00 0.00 175.26 174.71 1dbm s ALA 196 N 1.69 2.89 -0.25 6.30 0.00 -0.40 0.11 121.76 132.10 1dbm s ALA 196 Ca 0.01 -1.28 -0.07 0.00 0.00 0.00 0.00 51.96 50.61 1dbm s ALA 196 Cb -0.13 -1.85 -0.03 0.00 0.00 0.00 0.00 23.12 21.11 1dbm s ALA 196 CO -0.04 -0.63 0.06 0.99 0.00 0.00 0.00 175.76 176.14 1dbm s THR 197 N 1.47 4.23 -0.28 0.00 2.01 -0.27 -1.83 115.64 120.98 1dbm s THR 197 Ca 0.04 -0.20 -0.22 0.00 0.31 0.00 0.00 61.69 61.62 1dbm s THR 197 Cb -0.15 -2.97 0.10 0.00 0.01 0.00 0.00 72.50 69.49 1dbm s THR 197 CO -0.01 0.35 0.88 -2.28 -0.69 0.00 0.00 174.62 172.86 1dbm s HIS 198 N 1.60 -0.68 0.00 4.92 5.04 -1.26 -2.68 115.29 122.24 1dbm s HIS 198 Ca 0.06 1.54 -0.00 0.00 -1.54 0.00 0.00 55.06 55.12 1dbm s HIS 198 Cb -0.15 0.38 0.00 0.00 0.04 0.00 0.00 32.58 32.85 1dbm s HIS 198 CO 0.03 -0.33 0.00 1.63 -2.34 0.00 0.00 174.74 173.73 1dbm n LYS 199 N 2.92 -0.00 0.00 2.88 5.02 -1.26 -0.64 118.16 127.08 1dbm n LYS 199 Ca -0.15 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.14 1dbm n LYS 199 Cb 0.56 -0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.57 1dbm n LYS 199 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1dbm n THR 200 N -4.00 1.19 -4.81 -0.18 -2.24 -1.26 -4.55 114.28 98.42 1dbm n THR 200 Ca 0.00 0.32 -0.33 0.00 -2.27 0.00 0.00 64.05 61.78 1dbm n THR 200 Cb 0.00 -1.32 -0.15 0.00 -2.10 0.00 0.00 70.33 66.75 1dbm n THR 200 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1dbm s SER 201 N -2.56 3.71 0.09 3.42 0.01 0.19 -4.97 113.70 113.58 1dbm s SER 201 Ca 0.00 -0.42 -0.31 0.00 1.31 0.00 0.00 55.95 56.53 1dbm s SER 201 Cb 0.00 -1.55 -0.14 0.00 0.21 0.00 0.00 66.02 64.53 1dbm s SER 201 CO 0.00 0.14 1.62 0.71 0.41 0.00 0.00 173.24 176.12 1dbm h THR 202 N 5.55 0.31 -3.65 1.44 1.35 -1.89 -3.44 112.91 112.58 1dbm h THR 202 Ca -0.26 0.00 -0.41 0.00 -0.55 0.00 0.00 66.41 65.19 1dbm h THR 202 Cb 1.21 0.31 -0.19 0.00 -1.73 0.00 0.00 68.15 67.76 1dbm h THR 202 CO 0.54 0.00 -0.76 -0.94 -0.25 0.00 0.00 175.52 174.11 1dbm s SER 203 N -4.57 1.92 0.35 5.36 1.04 -1.26 -5.08 113.70 111.46 1dbm s SER 203 Ca -0.17 -0.78 -0.25 0.00 0.48 0.00 0.00 55.95 55.23 1dbm s SER 203 Cb 0.05 -0.06 -0.14 0.00 0.10 0.00 0.00 66.02 65.97 1dbm s SER 203 CO 0.63 -0.14 0.64 -2.65 0.98 0.00 0.00 173.24 172.70 1dbm n PRO 204 N 0.64 0.64 -3.49 4.02 -0.02 -1.26 -4.93 135.00 130.60 1dbm n PRO 204 Ca -0.16 0.23 -0.42 0.00 -2.02 0.00 0.00 63.50 61.13 1dbm n PRO 204 Cb 0.57 -1.48 -0.07 0.00 -0.02 0.00 0.00 33.50 32.49 1dbm n PRO 204 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 1dbm s ILE 205 N -1.29 4.47 0.05 4.25 2.07 -0.76 -4.96 121.20 125.03 1dbm s ILE 205 Ca 0.62 -1.77 0.07 0.00 -1.41 0.00 0.00 60.65 58.16 1dbm s ILE 205 Cb -0.69 -3.92 -0.03 0.00 0.13 0.00 0.00 42.46 37.95 1dbm s ILE 205 CO 0.58 -0.81 -0.16 0.54 -1.91 0.00 0.00 174.94 173.19 1dbm s VAL 206 N 1.35 2.96 0.04 4.00 0.11 -1.26 -1.28 120.40 126.32 1dbm s VAL 206 Ca 0.06 -1.16 0.03 0.00 -2.93 0.00 0.00 61.98 57.98 1dbm s VAL 206 Cb -0.26 -2.27 -0.02 0.00 -1.53 0.00 0.00 36.38 32.29 1dbm s VAL 206 CO -0.00 0.31 -0.10 -0.54 -3.33 0.00 0.00 175.10 171.44 1dbm s LYS 207 N -1.55 0.62 0.12 1.54 -0.14 -0.63 -5.01 119.74 114.69 1dbm s LYS 207 Ca 0.16 -0.76 -0.13 0.00 -1.36 0.00 0.00 55.97 53.88 1dbm s LYS 207 Cb -0.11 -0.49 0.02 0.00 -1.68 0.00 0.00 37.83 35.58 1dbm s LYS 207 CO 0.07 0.10 0.32 -1.12 -0.76 0.00 0.00 175.35 173.96 1dbm s SER 208 N -1.46 -0.09 0.26 2.83 0.01 -1.26 -2.27 113.70 111.72 1dbm s SER 208 Ca -0.06 -0.49 0.01 0.00 1.31 0.00 0.00 55.95 56.72 1dbm s SER 208 Cb -0.09 0.43 -0.05 0.00 0.21 0.00 0.00 66.02 66.52 1dbm s SER 208 CO 0.01 -0.82 0.11 0.72 0.41 0.00 0.00 173.24 173.66 1dbm s PHE 209 N -3.84 1.51 0.00 2.43 -0.12 -1.06 -5.01 117.98 111.89 1dbm s PHE 209 Ca 0.05 -1.23 0.00 0.00 -0.05 0.00 0.00 56.93 55.70 1dbm s PHE 209 Cb 0.03 -0.86 0.00 0.00 -0.63 0.00 0.00 43.02 41.56 1dbm s PHE 209 CO -0.10 -0.39 0.00 0.27 -0.05 0.00 0.00 175.22 174.95 1dbm n ASN 210 N -0.52 0.00 -0.10 1.98 6.94 -1.26 -1.60 115.26 120.70 1dbm n ASN 210 Ca 0.00 -0.15 0.01 0.00 -0.02 0.00 0.00 54.58 54.43 1dbm n ASN 210 Cb 0.66 0.00 0.01 0.00 -2.36 0.00 0.00 39.78 38.09 1dbm n ASN 210 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77