#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lo3 s VAL 2 N 0.00 4.38 -0.21 2.53 1.01 -1.26 -4.94 120.40 121.92 1lo3 s VAL 2 Ca 0.00 -0.15 -0.10 0.00 0.00 0.00 0.00 61.98 61.73 1lo3 s VAL 2 Cb 0.00 -3.04 -0.05 0.00 0.00 0.00 0.00 36.38 33.29 1lo3 s VAL 2 CO 0.00 0.36 0.13 -0.76 0.00 0.00 0.00 175.10 174.83 1lo3 s LEU 3 N 1.41 4.17 -0.21 3.92 1.43 -1.26 -4.63 118.68 123.51 1lo3 s LEU 3 Ca 0.05 0.20 -0.14 0.00 -1.03 0.00 0.00 54.13 53.21 1lo3 s LEU 3 Cb -0.15 -2.08 -0.04 0.00 0.03 0.00 0.00 46.19 43.94 1lo3 s LEU 3 CO 0.04 0.16 0.32 -0.04 0.23 0.00 0.00 176.35 177.06 1lo3 s MET 4 N 0.48 4.16 -0.18 1.70 -1.94 -1.26 -1.51 119.30 120.75 1lo3 s MET 4 Ca 0.08 0.07 -0.03 0.00 -1.71 0.00 0.00 55.69 54.09 1lo3 s MET 4 Cb -0.12 -3.53 -0.02 0.00 2.01 0.00 0.00 34.83 33.18 1lo3 s MET 4 CO -0.01 0.02 -0.05 0.99 -0.01 0.00 0.00 175.02 175.96 1lo3 s THR 5 N 1.16 3.56 -0.08 2.05 2.01 0.15 -4.17 115.64 120.33 1lo3 s THR 5 Ca 0.16 -0.45 0.02 0.00 0.31 0.00 0.00 61.69 61.72 1lo3 s THR 5 Cb -0.14 -2.58 -0.02 0.00 0.01 0.00 0.00 72.50 69.76 1lo3 s THR 5 CO 0.07 0.46 -0.12 -1.10 -0.69 0.00 0.00 174.62 173.24 1lo3 s GLN 6 N 0.90 2.82 -0.13 4.92 -0.21 -1.26 -0.59 119.66 126.10 1lo3 s GLN 6 Ca -0.01 -0.65 -0.12 0.00 0.02 0.00 0.00 55.36 54.61 1lo3 s GLN 6 Cb -0.15 -2.51 0.03 0.00 1.00 0.00 0.00 33.01 31.38 1lo3 s GLN 6 CO 0.01 0.53 0.35 0.95 -2.12 0.00 0.00 175.29 175.01 1lo3 s THR 7 N -0.46 -0.00 0.79 -0.19 -4.23 -1.17 -4.45 115.64 105.93 1lo3 s THR 7 Ca 0.06 0.00 -0.10 0.00 -1.18 0.00 0.00 61.69 60.47 1lo3 s THR 7 Cb -0.12 -0.49 0.09 0.00 1.34 0.00 0.00 72.50 73.32 1lo3 s THR 7 CO 0.02 0.00 1.13 -2.16 -0.54 0.00 0.00 174.62 173.07 1lo3 s PRO 8 N 0.20 1.82 0.08 3.99 0.04 -1.26 -3.51 135.00 136.37 1lo3 s PRO 8 Ca -0.00 -0.19 0.23 0.00 0.04 0.00 0.00 61.00 61.07 1lo3 s PRO 8 Cb -0.03 -2.04 0.91 0.00 0.04 0.00 0.00 34.50 33.38 1lo3 s PRO 8 CO 0.00 -1.58 1.70 1.28 0.04 0.00 0.00 177.00 178.45 1lo3 n LEU 9 N -3.21 0.26 -3.66 -3.56 4.77 -1.26 -4.48 117.00 105.86 1lo3 n LEU 9 Ca 0.10 0.54 -0.09 0.00 -0.03 0.00 0.00 56.01 56.52 1lo3 n LEU 9 Cb 0.60 -0.48 -0.10 0.00 -2.33 0.00 0.00 43.42 41.11 1lo3 n LEU 9 CO 0.52 -0.22 -0.01 -0.55 -1.33 0.00 0.00 177.39 175.81 1lo3 s SER 10 N -3.48 -0.13 -0.31 -1.43 0.15 -1.26 -1.91 113.70 105.33 1lo3 s SER 10 Ca 0.09 0.91 0.00 0.00 0.70 0.00 0.00 55.95 57.65 1lo3 s SER 10 Cb 0.13 1.22 0.07 0.00 -1.71 0.00 0.00 66.02 65.73 1lo3 s SER 10 CO 0.42 -0.23 0.01 -0.22 1.20 0.00 0.00 173.24 174.42 1lo3 s LEU 11 N 2.58 4.12 -0.07 3.45 2.96 -0.12 -4.93 118.68 126.66 1lo3 s LEU 11 Ca -0.01 -1.56 -0.30 0.00 -0.22 0.00 0.00 54.13 52.04 1lo3 s LEU 11 Cb -0.12 -1.67 -0.02 0.00 0.50 0.00 0.00 46.19 44.88 1lo3 s LEU 11 CO -0.12 -0.30 1.03 -2.16 -1.32 0.00 0.00 176.35 173.47 1lo3 s PRO 12 N 1.14 4.45 0.14 0.98 0.04 -1.26 -1.44 135.00 139.05 1lo3 s PRO 12 Ca -0.02 1.44 0.01 0.00 0.04 0.00 0.00 61.00 62.48 1lo3 s PRO 12 Cb -0.20 -3.52 -0.04 0.00 0.04 0.00 0.00 34.50 30.78 1lo3 s PRO 12 CO -0.04 -0.26 -0.01 0.14 0.04 0.00 0.00 177.00 176.87 1lo3 s VAL 13 N 1.74 0.59 0.04 -0.36 -7.23 0.98 -4.76 120.40 111.40 1lo3 s VAL 13 Ca 0.50 -1.95 0.03 0.00 -1.81 0.00 0.00 61.98 58.76 1lo3 s VAL 13 Cb -0.20 -1.95 -0.04 0.00 0.56 0.00 0.00 36.38 34.75 1lo3 s VAL 13 CO 0.21 -0.62 -0.02 -0.44 -0.31 0.00 0.00 175.10 173.92 1lo3 s SER 14 N -3.11 4.94 0.42 4.85 0.01 -1.26 -0.35 113.70 119.20 1lo3 s SER 14 Ca 0.19 -0.12 -0.26 0.00 1.31 0.00 0.00 55.95 57.08 1lo3 s SER 14 Cb 0.06 -1.21 -0.09 0.00 0.21 0.00 0.00 66.02 64.99 1lo3 s SER 14 CO 0.00 0.24 1.40 -0.76 0.41 0.00 0.00 173.24 174.53 1lo3 s LEU 15 N -1.82 4.20 0.00 2.44 1.43 -1.26 -2.26 118.68 121.41 1lo3 s LEU 15 Ca 0.21 2.87 0.00 0.00 -1.03 0.00 0.00 54.13 56.18 1lo3 s LEU 15 Cb -0.11 -3.85 0.00 0.00 0.03 0.00 0.00 46.19 42.25 1lo3 s LEU 15 CO 0.13 -0.99 0.00 0.61 0.23 0.00 0.00 176.35 176.33 1lo3 n GLY 16 N 0.59 0.73 3.78 -3.19 0.00 0.12 -4.91 105.19 102.31 1lo3 n GLY 16 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 1lo3 n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1lo3 s ASP 17 N -2.87 7.38 -0.29 1.61 1.11 -0.96 -4.46 116.67 118.20 1lo3 s ASP 17 Ca 0.00 1.74 -0.20 0.00 0.18 0.00 0.00 52.55 54.27 1lo3 s ASP 17 Cb 0.00 -2.54 -0.01 0.00 1.07 0.00 0.00 42.92 41.44 1lo3 s ASP 17 CO 0.00 0.08 0.63 -1.58 1.18 0.00 0.00 175.17 175.48 1lo3 s GLN 18 N -1.57 3.96 0.15 8.23 0.74 -1.24 -1.69 119.66 128.24 1lo3 s GLN 18 Ca 0.43 0.37 0.11 0.00 0.05 0.00 0.00 55.36 56.32 1lo3 s GLN 18 Cb -0.21 -3.71 -0.04 0.00 1.10 0.00 0.00 33.01 30.15 1lo3 s GLN 18 CO 0.26 -0.53 -0.26 0.14 -0.55 0.00 0.00 175.29 174.36 1lo3 s VAL 19 N 2.59 2.32 -0.10 1.34 -7.23 -0.69 -4.99 120.40 113.64 1lo3 s VAL 19 Ca 0.26 -1.86 -0.00 0.00 -1.81 0.00 0.00 61.98 58.57 1lo3 s VAL 19 Cb -0.15 -2.06 0.02 0.00 0.56 0.00 0.00 36.38 34.75 1lo3 s VAL 19 CO 0.11 0.01 -0.07 -0.44 -0.31 0.00 0.00 175.10 174.40 1lo3 s SER 20 N -2.30 2.01 -0.19 4.85 0.01 -1.26 -1.74 113.70 115.08 1lo3 s SER 20 Ca 0.17 -0.26 -0.06 0.00 1.31 0.00 0.00 55.95 57.10 1lo3 s SER 20 Cb -0.09 -0.77 -0.03 0.00 0.21 0.00 0.00 66.02 65.34 1lo3 s SER 20 CO 0.08 -0.11 0.03 -0.63 0.41 0.00 0.00 173.24 173.02 1lo3 s ILE 21 N 1.61 4.38 0.09 1.44 1.01 0.72 -4.94 121.20 125.51 1lo3 s ILE 21 Ca 0.02 -0.17 0.03 0.00 0.00 0.00 0.00 60.65 60.53 1lo3 s ILE 21 Cb -0.13 -2.98 -0.04 0.00 0.01 0.00 0.00 42.46 39.32 1lo3 s ILE 21 CO -0.06 0.44 0.13 -0.36 0.00 0.00 0.00 174.94 175.08 1lo3 s PHE 22 N 0.69 3.28 -0.07 3.97 0.40 -1.23 -1.07 117.98 123.95 1lo3 s PHE 22 Ca 0.02 0.11 -0.03 0.00 -0.60 0.00 0.00 56.93 56.42 1lo3 s PHE 22 Cb -0.14 -1.64 0.04 0.00 0.51 0.00 0.00 43.02 41.79 1lo3 s PHE 22 CO 0.02 0.54 0.17 0.00 0.70 0.00 0.00 175.22 176.64 1lo3 s THR 24 N 1.32 1.86 0.03 0.00 -4.23 0.24 -0.94 115.64 113.92 1lo3 s THR 24 Ca -0.08 -1.19 -0.04 0.00 -1.18 0.00 0.00 61.69 59.20 1lo3 s THR 24 Cb -0.11 -1.59 -0.04 0.00 1.34 0.00 0.00 72.50 72.09 1lo3 s THR 24 CO -0.06 0.35 0.25 -0.94 -0.54 0.00 0.00 174.62 173.68 1lo3 s SER 25 N -1.00 6.43 0.15 3.99 1.04 -0.37 0.34 113.70 124.29 1lo3 s SER 25 Ca 0.09 0.44 0.17 0.00 0.48 0.00 0.00 55.95 57.14 1lo3 s SER 25 Cb -0.09 -2.04 0.76 0.00 0.10 0.00 0.00 66.02 64.76 1lo3 s SER 25 CO 0.01 0.21 1.53 -1.54 0.98 0.00 0.00 173.24 174.43 1lo3 n SER 26 N 0.75 0.35 -3.60 7.02 3.41 -0.57 -4.80 113.62 116.18 1lo3 n SER 26 Ca -0.09 0.61 -0.03 0.00 -0.26 0.00 0.00 58.87 59.10 1lo3 n SER 26 Cb 0.52 -0.67 -0.00 0.00 -0.26 0.00 0.00 64.21 63.80 1lo3 n SER 26 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1lo3 s GLN 27 N -3.21 1.22 0.49 4.33 -2.07 -1.26 -4.97 119.66 114.19 1lo3 s GLN 27 Ca 0.03 -0.72 -0.24 0.00 -1.82 0.00 0.00 55.36 52.62 1lo3 s GLN 27 Cb 0.08 0.39 -0.07 0.00 -1.09 0.00 0.00 33.01 32.32 1lo3 s GLN 27 CO 0.27 -0.56 1.39 0.95 -1.32 0.00 0.00 175.29 176.01 1lo3 s THR 28 N -2.87 2.11 -0.58 3.63 -4.23 -1.26 -4.84 115.64 107.61 1lo3 s THR 28 Ca 0.15 0.09 0.05 0.00 -1.18 0.00 0.00 61.69 60.81 1lo3 s THR 28 Cb -0.02 -3.05 0.33 0.00 1.34 0.00 0.00 72.50 71.11 1lo3 s THR 28 CO 0.03 0.01 0.92 2.30 -0.54 0.00 0.00 174.62 177.33 1lo3 n ILE 29 N -0.57 2.84 -4.08 2.99 -5.35 -1.26 -5.02 119.36 108.91 1lo3 n ILE 29 Ca 0.07 -5.49 -0.35 0.00 -0.27 0.00 0.00 62.75 56.71 1lo3 n ILE 29 Cb 0.43 -1.43 -0.12 0.00 -1.74 0.00 0.00 39.64 36.79 1lo3 n ILE 29 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1lo3 s VAL 30 N -4.15 4.01 0.84 7.28 1.01 -1.26 -4.25 120.40 123.88 1lo3 s VAL 30 Ca 0.48 -0.29 -0.11 0.00 0.00 0.00 0.00 61.98 62.05 1lo3 s VAL 30 Cb 0.27 -2.81 0.10 0.00 0.00 0.00 0.00 36.38 33.93 1lo3 s VAL 30 CO -0.12 0.43 1.09 -2.28 0.00 0.00 0.00 175.10 174.22 1lo3 s HIS 31 N 0.94 2.40 -1.05 5.22 2.46 0.16 -4.88 115.29 120.55 1lo3 s HIS 31 Ca 0.01 1.43 0.12 0.00 0.47 0.00 0.00 55.06 57.09 1lo3 s HIS 31 Cb -0.14 -3.11 0.52 0.00 -0.13 0.00 0.00 32.58 29.72 1lo3 s HIS 31 CO 0.02 -2.13 1.37 0.25 -2.47 0.00 0.00 174.74 171.78 1lo3 n THR 32 N -3.73 1.13 -0.89 0.89 -2.24 -1.26 -1.76 114.28 106.41 1lo3 n THR 32 Ca 0.08 0.28 0.07 0.00 -2.27 0.00 0.00 64.05 62.22 1lo3 n THR 32 Cb 0.54 -1.08 0.39 0.00 -2.10 0.00 0.00 70.33 68.08 1lo3 n THR 32 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1lo3 n ASN 33 N -1.48 5.54 0.00 3.42 2.04 -1.26 -4.94 115.26 118.58 1lo3 n ASN 33 Ca 0.03 -2.90 0.00 0.00 -0.44 0.00 0.00 54.58 51.27 1lo3 n ASN 33 Cb 0.13 -0.67 0.00 0.00 -2.53 0.00 0.00 39.78 36.72 1lo3 n ASN 33 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1lo3 n GLY 34 N 0.58 3.05 3.84 4.83 0.00 -0.72 -5.02 105.19 111.75 1lo3 n GLY 34 Ca 0.27 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.96 1lo3 n GLY 34 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1lo3 s ASN 35 N -0.86 6.83 -0.37 1.61 0.01 -1.26 -4.71 114.94 116.19 1lo3 s ASN 35 Ca 0.00 1.34 -0.07 0.00 -0.71 0.00 0.00 52.86 53.42 1lo3 s ASN 35 Cb 0.00 -2.40 0.06 0.00 0.41 0.00 0.00 41.25 39.32 1lo3 s ASN 35 CO 0.00 -0.19 0.16 -0.89 -1.51 0.00 0.00 177.10 174.67 1lo3 s THR 36 N -1.95 3.90 -1.37 1.60 2.01 -1.26 0.40 115.64 118.97 1lo3 s THR 36 Ca 0.54 -1.28 -0.08 0.00 0.31 0.00 0.00 61.69 61.17 1lo3 s THR 36 Cb -0.11 -3.30 0.09 0.00 0.01 0.00 0.00 72.50 69.20 1lo3 s THR 36 CO 0.17 -0.32 2.29 -1.22 -0.69 0.00 0.00 174.62 174.86 1lo3 n TYR 37 N 4.83 2.77 -3.65 4.92 4.01 -1.26 -3.84 117.16 124.93 1lo3 n TYR 37 Ca -0.11 -2.87 -0.37 0.00 -0.16 0.00 0.00 57.90 54.39 1lo3 n TYR 37 Cb 0.44 -2.05 -0.11 0.00 -0.31 0.00 0.00 39.34 37.31 1lo3 n TYR 37 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1lo3 s LEU 38 N -0.67 3.94 0.17 7.72 2.96 -1.26 -1.24 118.68 130.30 1lo3 s LEU 38 Ca 0.51 -0.01 0.10 0.00 -0.22 0.00 0.00 54.13 54.51 1lo3 s LEU 38 Cb 0.15 -2.08 -0.04 0.00 0.50 0.00 0.00 46.19 44.72 1lo3 s LEU 38 CO -0.06 -0.01 -0.18 -1.61 -1.32 0.00 0.00 176.35 173.17 1lo3 s GLU 39 N 1.52 1.76 -0.06 1.98 2.02 0.15 -0.74 118.70 125.32 1lo3 s GLU 39 Ca 0.07 -1.36 0.05 0.00 0.02 0.00 0.00 54.97 53.75 1lo3 s GLU 39 Cb -0.15 -2.01 -0.01 0.00 0.10 0.00 0.00 34.13 32.06 1lo3 s GLU 39 CO 0.08 0.43 -0.21 -1.58 0.02 0.00 0.00 175.26 173.99 1lo3 s TRP 40 N -1.55 2.13 0.05 1.61 0.52 -0.09 -1.17 118.94 120.44 1lo3 s TRP 40 Ca 0.21 -0.66 0.07 0.00 0.02 0.00 0.00 56.10 55.74 1lo3 s TRP 40 Cb -0.09 -1.42 -0.03 0.00 -1.15 0.00 0.00 33.47 30.79 1lo3 s TRP 40 CO 0.12 -0.22 -0.19 0.71 0.02 0.00 0.00 176.95 177.38 1lo3 s TYR 41 N 0.00 1.70 -0.23 -1.98 2.02 0.79 -0.86 117.35 118.78 1lo3 s TYR 41 Ca -0.06 -0.38 -0.00 0.00 -0.37 0.00 0.00 57.07 56.26 1lo3 s TYR 41 Cb -0.13 -0.99 0.03 0.00 -0.40 0.00 0.00 41.96 40.46 1lo3 s TYR 41 CO 0.04 0.10 -0.11 -1.17 -1.57 0.00 0.00 175.55 172.84 1lo3 s LEU 42 N -1.31 2.93 -0.40 -1.29 2.96 -0.58 -0.62 118.68 120.37 1lo3 s LEU 42 Ca 0.06 -0.88 -0.13 0.00 -0.22 0.00 0.00 54.13 52.96 1lo3 s LEU 42 Cb -0.09 -1.60 0.03 0.00 0.50 0.00 0.00 46.19 45.03 1lo3 s LEU 42 CO 0.02 -0.10 0.27 -1.58 -1.32 0.00 0.00 176.35 173.64 1lo3 s GLN 43 N 1.28 2.90 0.02 1.98 0.74 -0.04 -2.10 119.66 124.44 1lo3 s GLN 43 Ca 0.00 -1.07 -0.27 0.00 0.05 0.00 0.00 55.36 54.06 1lo3 s GLN 43 Cb -0.16 -3.89 -0.04 0.00 1.10 0.00 0.00 33.01 30.02 1lo3 s GLN 43 CO -0.07 -0.75 0.86 0.21 -0.55 0.00 0.00 175.29 174.99 1lo3 s LYS 44 N 1.62 4.54 -0.05 1.67 2.47 -1.26 -2.47 119.74 126.27 1lo3 s LYS 44 Ca 0.04 1.22 -0.41 0.00 -1.56 0.00 0.00 55.97 55.26 1lo3 s LYS 44 Cb -0.19 -3.42 -0.20 0.00 -1.46 0.00 0.00 37.83 32.56 1lo3 s LYS 44 CO 0.08 0.11 1.13 -0.35 0.16 0.00 0.00 175.35 176.48 1lo3 n PRO 45 N 3.37 0.02 0.00 4.03 -0.04 -1.26 -0.10 135.00 141.02 1lo3 n PRO 45 Ca 0.02 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 1lo3 n PRO 45 Cb 0.50 -1.51 0.00 0.00 -0.04 0.00 0.00 33.50 32.45 1lo3 n PRO 45 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1lo3 n GLY 46 N 1.76 2.87 3.65 0.55 0.00 -1.26 -5.00 105.19 107.76 1lo3 n GLY 46 Ca 0.21 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.02 1lo3 n GLY 46 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1lo3 n GLN 47 N -0.72 0.66 -3.19 1.61 6.02 0.86 -5.13 117.38 117.49 1lo3 n GLN 47 Ca 0.00 -3.06 -0.22 0.00 -0.01 0.00 0.00 57.00 53.71 1lo3 n GLN 47 Cb 0.00 -0.01 0.00 0.00 1.02 0.00 0.00 30.24 31.26 1lo3 n GLN 47 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1lo3 s SER 48 N -4.26 5.95 0.52 1.08 1.04 -1.26 -4.54 113.70 112.22 1lo3 s SER 48 Ca 0.47 0.19 -0.23 0.00 0.48 0.00 0.00 55.95 56.86 1lo3 s SER 48 Cb -0.04 -1.55 -0.06 0.00 0.10 0.00 0.00 66.02 64.48 1lo3 s SER 48 CO 0.30 -0.56 1.38 -2.84 0.98 0.00 0.00 173.24 172.50 1lo3 s PRO 49 N -4.41 3.30 -0.01 4.02 0.02 -1.26 -4.43 135.00 132.22 1lo3 s PRO 49 Ca 0.46 2.29 0.03 0.00 0.02 0.00 0.00 61.00 63.80 1lo3 s PRO 49 Cb -0.10 -2.38 -0.01 0.00 0.02 0.00 0.00 34.50 32.04 1lo3 s PRO 49 CO 0.36 -1.08 -0.11 0.15 -0.33 0.00 0.00 177.00 175.99 1lo3 s LYS 50 N -2.77 0.92 0.24 5.54 1.02 -0.89 -4.93 119.74 118.87 1lo3 s LYS 50 Ca 0.68 -0.37 -0.31 0.00 0.02 0.00 0.00 55.97 55.99 1lo3 s LYS 50 Cb -0.41 -0.88 -0.11 0.00 -0.52 0.00 0.00 37.83 35.91 1lo3 s LYS 50 CO 0.50 0.20 1.57 -1.17 -0.92 0.00 0.00 175.35 175.53 1lo3 s LEU 51 N -0.14 4.37 0.05 3.17 2.96 -1.26 -1.53 118.68 126.30 1lo3 s LEU 51 Ca 0.02 2.78 -0.03 0.00 -0.22 0.00 0.00 54.13 56.68 1lo3 s LEU 51 Cb -0.05 -3.62 -0.01 0.00 0.50 0.00 0.00 46.19 43.01 1lo3 s LEU 51 CO -0.00 -0.84 -0.06 0.18 -1.32 0.00 0.00 176.35 174.31 1lo3 n LEU 52 N 2.94 1.20 -4.19 -0.68 4.77 -0.04 -4.85 117.00 116.15 1lo3 n LEU 52 Ca 0.10 0.16 -0.27 0.00 -0.03 0.00 0.00 56.01 55.98 1lo3 n LEU 52 Cb 0.38 -0.39 -0.16 0.00 -2.33 0.00 0.00 43.42 40.92 1lo3 n LEU 52 CO 0.62 -0.67 -0.52 -0.63 -1.33 0.00 0.00 177.39 174.87 1lo3 s ILE 53 N -2.10 1.58 0.11 -0.08 -1.09 -1.16 -1.03 121.20 117.44 1lo3 s ILE 53 Ca -0.05 -0.83 0.08 0.00 -2.23 0.00 0.00 60.65 57.63 1lo3 s ILE 53 Cb 0.01 -1.34 -0.04 0.00 -1.58 0.00 0.00 42.46 39.51 1lo3 s ILE 53 CO 0.07 0.45 -0.21 -0.72 -1.23 0.00 0.00 174.94 173.30 1lo3 s TYR 54 N -0.22 1.83 -1.25 3.97 1.13 -0.20 -0.91 117.35 121.71 1lo3 s TYR 54 Ca 0.01 -0.42 -0.08 0.00 -1.41 0.00 0.00 57.07 55.18 1lo3 s TYR 54 Cb -0.10 -0.99 -0.01 0.00 -1.10 0.00 0.00 41.96 39.76 1lo3 s TYR 54 CO 0.01 0.23 0.69 1.63 -2.51 0.00 0.00 175.55 175.60 1lo3 n LYS 55 N 0.98 -3.09 0.00 -3.49 5.02 -0.97 -1.51 118.16 115.10 1lo3 n LYS 55 Ca -0.19 0.54 0.00 0.00 -2.02 0.00 0.00 58.31 56.64 1lo3 n LYS 55 Cb 0.54 -4.73 0.00 0.00 -0.02 0.00 0.00 35.03 30.82 1lo3 n LYS 55 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1lo3 n VAL 56 N -4.19 0.00 -0.03 -0.18 0.31 0.08 -3.98 118.33 110.34 1lo3 n VAL 56 Ca -0.21 0.00 0.01 0.00 -0.01 0.00 0.00 64.34 64.13 1lo3 n VAL 56 Cb 0.65 0.00 0.03 0.00 -0.91 0.00 0.00 33.84 33.61 1lo3 n VAL 56 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1lo3 n SER 57 N 1.59 2.11 -4.57 4.52 3.41 -1.25 -3.26 113.62 116.17 1lo3 n SER 57 Ca 0.00 -1.92 -0.42 0.00 -0.26 0.00 0.00 58.87 56.28 1lo3 n SER 57 Cb 0.00 -0.05 -0.07 0.00 -0.26 0.00 0.00 64.21 63.84 1lo3 n SER 57 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1lo3 s ASN 58 N -0.93 6.42 0.03 4.04 0.01 -0.57 -4.51 114.94 119.43 1lo3 s ASN 58 Ca 0.05 0.12 -0.30 0.00 -0.71 0.00 0.00 52.86 52.02 1lo3 s ASN 58 Cb 0.03 -2.32 -0.05 0.00 0.41 0.00 0.00 41.25 39.31 1lo3 s ASN 58 CO 0.03 -0.59 1.26 -0.60 -1.51 0.00 0.00 177.10 175.69 1lo3 s ARG 59 N 2.69 4.37 0.53 -0.60 3.52 -1.26 -1.03 118.95 127.17 1lo3 s ARG 59 Ca 0.24 1.82 -0.19 0.00 -0.13 0.00 0.00 55.73 57.47 1lo3 s ARG 59 Cb -0.14 -3.44 -0.07 0.00 -1.56 0.00 0.00 34.95 29.74 1lo3 s ARG 59 CO 0.15 -0.39 1.08 0.12 -0.81 0.00 0.00 175.30 175.45 1lo3 s PHE 60 N 1.63 2.83 0.31 5.12 5.36 -0.19 -4.94 117.98 128.09 1lo3 s PHE 60 Ca 0.60 1.56 -0.30 0.00 -0.96 0.00 0.00 56.93 57.83 1lo3 s PHE 60 Cb -0.29 -3.17 -0.12 0.00 -0.34 0.00 0.00 43.02 39.10 1lo3 s PHE 60 CO 0.27 -1.22 1.53 -1.13 -1.46 0.00 0.00 175.22 173.20 1lo3 n SER 61 N -1.27 3.63 0.00 6.13 3.41 -1.26 -2.03 113.62 122.22 1lo3 n SER 61 Ca 0.10 1.17 0.00 0.00 -0.26 0.00 0.00 58.87 59.88 1lo3 n SER 61 Cb 0.52 -1.57 0.00 0.00 -0.26 0.00 0.00 64.21 62.90 1lo3 n SER 61 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1lo3 n GLY 62 N 1.66 1.30 3.71 5.00 0.00 -1.26 -5.03 105.19 110.57 1lo3 n GLY 62 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 1lo3 n GLY 62 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lo3 s VAL 63 N -2.50 5.11 0.52 1.61 1.01 -0.86 -5.03 120.40 120.25 1lo3 s VAL 63 Ca 0.00 1.21 -0.18 0.00 0.00 0.00 0.00 61.98 63.00 1lo3 s VAL 63 Cb 0.00 -3.93 -0.12 0.00 0.00 0.00 0.00 36.38 32.33 1lo3 s VAL 63 CO 0.00 0.27 0.21 -2.65 0.00 0.00 0.00 175.10 172.94 1lo3 n PRO 64 N 3.85 0.26 0.00 2.72 -0.02 -1.26 -4.87 135.00 135.68 1lo3 n PRO 64 Ca -0.04 0.10 0.09 0.00 -2.02 0.00 0.00 63.50 61.64 1lo3 n PRO 64 Cb 0.51 -1.34 0.47 0.00 -0.02 0.00 0.00 33.50 33.13 1lo3 n PRO 64 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1lo3 n ASP 65 N 1.54 0.00 -0.00 2.55 9.92 -1.26 -2.88 116.55 126.42 1lo3 n ASP 65 Ca 0.10 0.08 0.13 0.00 -0.53 0.00 0.00 54.79 54.57 1lo3 n ASP 65 Cb 0.46 -0.31 0.48 0.00 -0.64 0.00 0.00 41.12 41.11 1lo3 n ASP 65 CO 0.00 0.00 0.00 -2.11 0.13 0.00 0.00 177.20 175.22 1lo3 n ARG 66 N -1.31 0.02 -3.67 -1.24 1.85 -1.26 -4.79 116.66 106.26 1lo3 n ARG 66 Ca 0.08 -0.01 -0.36 0.00 -1.00 0.00 0.00 57.85 56.57 1lo3 n ARG 66 Cb 0.16 -1.50 -0.07 0.00 -1.05 0.00 0.00 32.46 30.00 1lo3 n ARG 66 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1lo3 s PHE 67 N -2.99 3.52 0.18 2.89 0.40 -1.14 -0.74 117.98 120.10 1lo3 s PHE 67 Ca 0.13 0.57 -0.07 0.00 -0.60 0.00 0.00 56.93 56.95 1lo3 s PHE 67 Cb 0.18 -2.19 -0.02 0.00 0.51 0.00 0.00 43.02 41.51 1lo3 s PHE 67 CO 0.59 0.43 0.26 -1.54 0.70 0.00 0.00 175.22 175.67 1lo3 s SER 68 N -0.15 0.07 0.02 1.36 1.04 -0.55 -4.91 113.70 110.58 1lo3 s SER 68 Ca 0.15 -0.98 -0.01 0.00 0.48 0.00 0.00 55.95 55.59 1lo3 s SER 68 Cb -0.13 0.43 -0.02 0.00 0.10 0.00 0.00 66.02 66.41 1lo3 s SER 68 CO 0.04 -0.90 -0.01 -0.83 0.98 0.00 0.00 173.24 172.52 1lo3 s GLY 69 N -3.01 0.21 0.34 7.32 0.00 -1.26 -1.69 107.32 109.23 1lo3 s GLY 69 Ca 0.21 -0.52 -0.17 0.00 0.00 0.00 0.00 44.72 44.24 1lo3 s GLY 69 CO 0.03 -0.59 0.74 -1.35 0.00 0.00 0.00 173.10 171.93 1lo3 s SER 70 N -1.39 -0.07 0.00 1.64 1.04 -0.56 -4.06 113.70 110.30 1lo3 s SER 70 Ca -0.15 -0.94 0.00 0.00 0.48 0.00 0.00 55.95 55.34 1lo3 s SER 70 Cb -0.09 0.79 0.00 0.00 0.10 0.00 0.00 66.02 66.81 1lo3 s SER 70 CO -0.01 -1.52 0.00 0.61 0.98 0.00 0.00 173.24 173.30 1lo3 n GLY 71 N -0.50 3.15 3.52 7.32 0.00 -1.26 0.65 105.19 118.07 1lo3 n GLY 71 Ca -0.06 -1.61 -0.11 0.00 0.00 0.00 0.00 46.02 44.25 1lo3 n GLY 71 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1lo3 s SER 72 N 0.00 -0.42 0.00 1.61 1.04 0.31 -4.95 113.70 111.29 1lo3 s SER 72 Ca 0.00 0.21 0.00 0.00 0.48 0.00 0.00 55.95 56.64 1lo3 s SER 72 Cb 0.00 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.52 1lo3 s SER 72 CO 0.00 -0.56 0.00 0.61 0.98 0.00 0.00 173.24 174.27 1lo3 n GLY 73 N 0.19 0.50 0.00 7.32 0.00 -1.26 -1.63 105.19 110.31 1lo3 n GLY 73 Ca -0.11 0.67 0.00 0.00 0.00 0.00 0.00 46.02 46.58 1lo3 n GLY 73 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1lo3 n THR 74 N 0.00 0.00 -4.09 2.61 -2.24 -1.26 -4.02 114.28 105.28 1lo3 n THR 74 Ca 0.00 -0.03 -0.35 0.00 -2.27 0.00 0.00 64.05 61.41 1lo3 n THR 74 Cb 0.00 1.47 -0.13 0.00 -2.10 0.00 0.00 70.33 69.57 1lo3 n THR 74 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1lo3 s ASP 75 N -0.03 4.49 0.09 3.42 -0.00 -0.64 -1.24 116.67 122.76 1lo3 s ASP 75 Ca 0.00 -0.30 0.07 0.00 -0.00 0.00 0.00 52.55 52.32 1lo3 s ASP 75 Cb 0.00 -1.76 -0.03 0.00 -0.00 0.00 0.00 42.92 41.13 1lo3 s ASP 75 CO 0.00 0.04 -0.18 -0.36 -0.00 0.00 0.00 175.17 174.67 1lo3 s PHE 76 N 1.12 1.59 -0.01 4.23 0.40 -0.12 -0.53 117.98 124.67 1lo3 s PHE 76 Ca 0.02 -0.44 0.00 0.00 -0.60 0.00 0.00 56.93 55.92 1lo3 s PHE 76 Cb -0.15 -0.88 0.01 0.00 0.51 0.00 0.00 43.02 42.52 1lo3 s PHE 76 CO 0.00 0.16 -0.00 0.99 0.70 0.00 0.00 175.22 177.06 1lo3 s THR 77 N -1.24 0.10 -0.16 0.64 2.01 0.21 -1.82 115.64 115.38 1lo3 s THR 77 Ca 0.04 0.02 -0.05 0.00 0.31 0.00 0.00 61.69 62.01 1lo3 s THR 77 Cb -0.10 -0.14 -0.03 0.00 0.01 0.00 0.00 72.50 72.24 1lo3 s THR 77 CO 0.04 0.07 0.01 -0.22 -0.69 0.00 0.00 174.62 173.82 1lo3 s LEU 78 N 0.39 3.51 0.02 4.42 2.96 -0.23 -1.50 118.68 128.25 1lo3 s LEU 78 Ca -0.03 -0.02 0.09 0.00 -0.22 0.00 0.00 54.13 53.94 1lo3 s LEU 78 Cb -0.06 -1.86 -0.03 0.00 0.50 0.00 0.00 46.19 44.75 1lo3 s LEU 78 CO -0.01 0.18 -0.26 -0.75 -1.32 0.00 0.00 176.35 174.20 1lo3 s LYS 79 N 0.28 1.90 -0.33 1.98 2.47 -0.68 -0.20 119.74 125.16 1lo3 s LYS 79 Ca -0.00 -1.04 -0.01 0.00 -1.56 0.00 0.00 55.97 53.36 1lo3 s LYS 79 Cb -0.13 -1.98 0.11 0.00 -1.46 0.00 0.00 37.83 34.36 1lo3 s LYS 79 CO 0.02 0.52 0.13 0.42 0.16 0.00 0.00 175.35 176.60 1lo3 s ILE 80 N -0.73 0.74 0.51 5.43 1.01 -0.71 -1.48 121.20 125.97 1lo3 s ILE 80 Ca 0.11 -1.48 0.26 0.00 0.00 0.00 0.00 60.65 59.54 1lo3 s ILE 80 Cb -0.10 -1.56 0.43 0.00 0.01 0.00 0.00 42.46 41.24 1lo3 s ILE 80 CO 0.01 -0.74 1.92 0.77 0.00 0.00 0.00 174.94 176.90 1lo3 h SER 81 N 7.87 0.10 -1.67 3.58 4.64 -1.21 -1.84 113.55 125.01 1lo3 h SER 81 Ca -0.11 0.01 -0.07 0.00 -0.47 0.00 0.00 61.79 61.15 1lo3 h SER 81 Cb 1.00 -0.01 -0.27 0.00 -0.31 0.00 0.00 62.40 62.81 1lo3 h SER 81 CO 0.45 0.04 -0.40 -0.60 -0.87 0.00 0.00 176.83 175.46 1lo3 s ARG 82 N -5.09 0.42 0.29 4.77 3.52 -1.25 -3.72 118.95 117.89 1lo3 s ARG 82 Ca -0.06 0.74 -0.28 0.00 -0.13 0.00 0.00 55.73 56.00 1lo3 s ARG 82 Cb 0.21 -0.06 -0.09 0.00 -1.56 0.00 0.00 34.95 33.44 1lo3 s ARG 82 CO 0.76 -0.59 1.04 0.08 -0.81 0.00 0.00 175.30 175.78 1lo3 s VAL 83 N 2.66 3.71 0.53 7.11 1.01 -0.68 -4.80 120.40 129.95 1lo3 s VAL 83 Ca 0.14 1.64 0.03 0.00 0.00 0.00 0.00 61.98 63.79 1lo3 s VAL 83 Cb -0.15 -4.01 0.02 0.00 0.00 0.00 0.00 36.38 32.24 1lo3 s VAL 83 CO -0.17 0.32 0.23 -1.61 0.00 0.00 0.00 175.10 173.87 1lo3 s GLU 84 N -1.59 2.23 0.37 2.72 0.41 -1.26 -0.70 118.70 120.88 1lo3 s GLU 84 Ca 0.46 -2.21 0.25 0.00 -0.41 0.00 0.00 54.97 53.06 1lo3 s GLU 84 Cb -0.28 -1.84 0.64 0.00 -1.78 0.00 0.00 34.13 30.87 1lo3 s GLU 84 CO 0.36 -0.52 1.71 0.00 -0.49 0.00 0.00 175.26 176.31 1lo3 h THR 85 N 1.00 0.00 0.00 3.63 1.03 -2.00 -3.12 112.91 113.45 1lo3 h THR 85 Ca -0.40 -0.74 0.00 0.00 -0.01 0.00 0.00 66.41 65.26 1lo3 h THR 85 Cb 1.31 1.72 0.00 0.00 -1.07 0.00 0.00 68.15 70.11 1lo3 h THR 85 CO 0.65 0.00 -0.12 -0.33 -0.01 0.00 0.00 175.52 175.71 1lo3 h GLU 86 N 0.00 0.00 -0.00 0.00 4.39 -2.02 -3.26 114.58 113.69 1lo3 h GLU 86 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1lo3 h GLU 86 Cb 0.83 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.48 1lo3 h GLU 86 CO 0.00 0.00 -0.05 -0.25 -1.16 0.00 0.00 179.01 177.55 1lo3 n ASP 87 N -2.58 0.26 -4.70 1.42 8.00 -1.18 -4.83 116.55 112.94 1lo3 n ASP 87 Ca 0.04 -0.50 -0.42 0.00 0.71 0.00 0.00 54.79 54.62 1lo3 n ASP 87 Cb 0.47 -0.14 -0.03 0.00 -0.02 0.00 0.00 41.12 41.41 1lo3 n ASP 87 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1lo3 s LEU 88 N -2.43 4.32 0.00 0.64 1.43 -1.23 -4.87 118.68 116.54 1lo3 s LEU 88 Ca 0.32 1.79 0.00 0.00 -1.03 0.00 0.00 54.13 55.20 1lo3 s LEU 88 Cb 0.20 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.86 1lo3 s LEU 88 CO 0.45 -0.45 0.00 0.61 0.23 0.00 0.00 176.35 177.19 1lo3 n GLY 89 N 3.17 -1.14 3.78 -3.19 0.00 -1.16 -4.65 105.19 101.99 1lo3 n GLY 89 Ca 0.09 -1.19 -0.36 0.00 0.00 0.00 0.00 46.02 44.56 1lo3 n GLY 89 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1lo3 s ILE 90 N -3.00 5.41 -0.18 -0.61 2.07 -1.03 0.24 121.20 124.10 1lo3 s ILE 90 Ca 0.00 0.18 -0.06 0.00 -1.41 0.00 0.00 60.65 59.36 1lo3 s ILE 90 Cb 0.00 -3.43 -0.04 0.00 0.13 0.00 0.00 42.46 39.13 1lo3 s ILE 90 CO 0.00 0.50 0.03 -0.31 -1.91 0.00 0.00 174.94 173.26 1lo3 s TYR 91 N -0.13 3.16 -0.03 3.50 1.51 0.11 -0.86 117.35 124.61 1lo3 s TYR 91 Ca 0.10 -0.10 0.06 0.00 -1.01 0.00 0.00 57.07 56.11 1lo3 s TYR 91 Cb -0.11 -2.06 -0.02 0.00 -0.11 0.00 0.00 41.96 39.65 1lo3 s TYR 91 CO 0.00 0.03 -0.19 0.71 -1.11 0.00 0.00 175.55 174.99 1lo3 s TYR 92 N 0.53 2.54 0.33 2.71 2.02 0.21 -0.61 117.35 125.09 1lo3 s TYR 92 Ca 0.01 -0.28 0.08 0.00 -0.37 0.00 0.00 57.07 56.51 1lo3 s TYR 92 Cb -0.13 -1.57 -0.04 0.00 -0.40 0.00 0.00 41.96 39.82 1lo3 s TYR 92 CO 0.02 0.09 0.20 0.00 -1.57 0.00 0.00 175.55 174.29 1lo3 s PHE 94 N -2.36 -0.71 -0.11 0.00 5.36 -0.32 -0.84 117.98 119.00 1lo3 s PHE 94 Ca 0.38 1.71 0.02 0.00 -0.96 0.00 0.00 56.93 58.08 1lo3 s PHE 94 Cb -0.04 0.30 -0.01 0.00 -0.34 0.00 0.00 43.02 42.92 1lo3 s PHE 94 CO 0.24 -0.35 -0.16 1.14 -1.46 0.00 0.00 175.22 174.63 1lo3 s GLN 95 N 0.29 3.14 -0.13 10.12 1.03 -0.10 -0.68 119.66 133.34 1lo3 s GLN 95 Ca 0.00 -0.74 0.15 0.00 0.04 0.00 0.00 55.36 54.81 1lo3 s GLN 95 Cb -0.05 -2.50 0.30 0.00 0.03 0.00 0.00 33.01 30.80 1lo3 s GLN 95 CO -0.00 0.27 1.15 0.41 -2.54 0.00 0.00 175.29 174.58 1lo3 n GLY 96 N 3.33 4.27 0.08 2.60 0.00 -0.37 -1.73 105.19 113.37 1lo3 n GLY 96 Ca -0.18 -1.05 -0.10 0.00 0.00 0.00 0.00 46.02 44.69 1lo3 n GLY 96 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1lo3 h SER 97 N 0.33 0.15 -4.33 1.61 0.02 -1.85 -3.46 113.55 106.02 1lo3 h SER 97 Ca -0.01 -0.16 -0.39 0.00 -0.84 0.00 0.00 61.79 60.39 1lo3 h SER 97 Cb 1.09 -0.05 -0.20 0.00 0.14 0.00 0.00 62.40 63.39 1lo3 h SER 97 CO 0.01 1.12 -0.76 -1.00 -1.14 0.00 0.00 176.83 175.05 1lo3 s HIS 98 N -2.71 1.22 -0.07 3.45 3.76 -1.26 -4.47 115.29 115.20 1lo3 s HIS 98 Ca -0.01 -0.54 -0.09 0.00 -0.15 0.00 0.00 55.06 54.27 1lo3 s HIS 98 Cb 0.09 -0.66 -0.05 0.00 1.11 0.00 0.00 32.58 33.07 1lo3 s HIS 98 CO 0.84 0.07 0.24 -0.06 -0.85 0.00 0.00 174.74 174.98 1lo3 s PHE 99 N -1.83 3.64 0.40 1.40 0.40 -1.26 -3.21 117.98 117.52 1lo3 s PHE 99 Ca 0.03 0.68 -0.24 0.00 -0.60 0.00 0.00 56.93 56.80 1lo3 s PHE 99 Cb -0.07 -2.06 -0.09 0.00 0.51 0.00 0.00 43.02 41.32 1lo3 s PHE 99 CO 0.02 0.70 1.03 -1.25 0.70 0.00 0.00 175.22 176.41 1lo3 s PRO 100 N -1.12 4.20 0.30 0.24 0.04 -1.26 -4.72 135.00 132.67 1lo3 s PRO 100 Ca 0.19 1.44 -0.30 0.00 0.04 0.00 0.00 61.00 62.38 1lo3 s PRO 100 Cb -0.14 -2.51 -0.11 0.00 0.04 0.00 0.00 34.50 31.78 1lo3 s PRO 100 CO 0.08 -0.10 1.57 -0.51 0.04 0.00 0.00 177.00 178.08 1lo3 s LEU 101 N -2.68 4.35 -0.04 -3.56 1.43 -1.20 -4.59 118.68 112.39 1lo3 s LEU 101 Ca 0.58 2.93 0.06 0.00 -1.03 0.00 0.00 54.13 56.67 1lo3 s LEU 101 Cb -0.20 -3.64 -0.01 0.00 0.03 0.00 0.00 46.19 42.37 1lo3 s LEU 101 CO 0.25 -0.89 -0.23 0.00 0.23 0.00 0.00 176.35 175.72 1lo3 s ALA 102 N -0.11 1.95 0.07 4.21 0.00 -0.70 -4.99 121.76 122.18 1lo3 s ALA 102 Ca 0.62 -0.96 0.01 0.00 0.00 0.00 0.00 51.96 51.63 1lo3 s ALA 102 Cb -0.47 -0.57 -0.04 0.00 0.00 0.00 0.00 23.12 22.04 1lo3 s ALA 102 CO 0.49 0.41 0.18 -0.06 0.00 0.00 0.00 175.76 176.77 1lo3 s PHE 103 N -0.26 3.42 0.49 0.00 0.08 -1.26 -0.92 117.98 119.53 1lo3 s PHE 103 Ca 0.01 0.19 -0.03 0.00 0.12 0.00 0.00 56.93 57.23 1lo3 s PHE 103 Cb -0.12 -1.71 -0.01 0.00 -0.57 0.00 0.00 43.02 40.61 1lo3 s PHE 103 CO 0.02 0.57 0.75 0.20 -0.10 0.00 0.00 175.22 176.65 1lo3 s GLY 104 N -2.51 1.55 0.53 4.36 0.00 -0.02 -4.41 107.32 106.81 1lo3 s GLY 104 Ca 0.33 -0.84 0.23 0.00 0.00 0.00 0.00 44.72 44.45 1lo3 s GLY 104 CO 0.26 -0.64 2.13 0.00 0.00 0.00 0.00 173.10 174.85 1lo3 h ALA 105 N 0.23 1.60 0.00 3.20 0.00 -1.90 -3.42 119.26 118.96 1lo3 h ALA 105 Ca -0.46 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1lo3 h ALA 105 Cb 1.24 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1lo3 h ALA 105 CO 0.59 0.09 0.00 0.41 0.00 0.00 0.00 179.25 180.35 1lo3 n GLY 106 N -1.13 2.36 2.97 0.00 0.00 -1.26 -5.01 105.19 103.11 1lo3 n GLY 106 Ca -0.03 -1.80 -0.26 0.00 0.00 0.00 0.00 46.02 43.93 1lo3 n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1lo3 s THR 107 N -2.35 1.11 -0.24 2.61 2.01 0.22 -4.60 115.64 114.40 1lo3 s THR 107 Ca 0.00 -0.40 -0.17 0.00 0.31 0.00 0.00 61.69 61.42 1lo3 s THR 107 Cb 0.00 -1.07 -0.03 0.00 0.01 0.00 0.00 72.50 71.41 1lo3 s THR 107 CO 0.00 0.37 0.48 -0.75 -0.69 0.00 0.00 174.62 174.03 1lo3 s LYS 108 N 1.18 4.10 -0.24 4.92 2.20 -0.80 0.07 119.74 131.17 1lo3 s LYS 108 Ca -0.05 0.29 -0.24 0.00 -0.36 0.00 0.00 55.97 55.61 1lo3 s LYS 108 Cb -0.14 -3.62 -0.01 0.00 -1.51 0.00 0.00 37.83 32.55 1lo3 s LYS 108 CO -0.03 -0.27 0.81 -1.17 -0.36 0.00 0.00 175.35 174.34 1lo3 s LEU 109 N 2.03 4.08 0.31 5.43 2.96 0.14 -0.94 118.68 132.69 1lo3 s LEU 109 Ca 0.21 1.01 0.03 0.00 -0.22 0.00 0.00 54.13 55.16 1lo3 s LEU 109 Cb -0.15 -3.16 -0.05 0.00 0.50 0.00 0.00 46.19 43.32 1lo3 s LEU 109 CO 0.09 -0.49 0.09 -1.61 -1.32 0.00 0.00 176.35 173.10 1lo3 s GLU 110 N 2.77 1.60 -0.03 1.98 2.02 -0.52 -2.98 118.70 123.54 1lo3 s GLU 110 Ca 0.34 -1.89 -0.14 0.00 0.02 0.00 0.00 54.97 53.29 1lo3 s GLU 110 Cb -0.15 -0.59 -0.05 0.00 0.10 0.00 0.00 34.13 33.43 1lo3 s GLU 110 CO 0.08 -0.27 0.38 -0.51 0.02 0.00 0.00 175.26 174.96 1lo3 s LEU 111 N -3.44 4.43 0.22 1.80 1.43 -1.26 -0.01 118.68 121.86 1lo3 s LEU 111 Ca 0.35 0.88 -0.17 0.00 -1.03 0.00 0.00 54.13 54.16 1lo3 s LEU 111 Cb 0.08 -2.54 -0.08 0.00 0.03 0.00 0.00 46.19 43.68 1lo3 s LEU 111 CO 0.15 0.29 0.68 -0.75 0.23 0.00 0.00 176.35 176.95 1lo3 s LYS 112 N -0.81 4.12 0.35 1.70 2.20 0.53 -4.68 119.74 123.15 1lo3 s LYS 112 Ca 0.23 0.72 -0.09 0.00 -0.36 0.00 0.00 55.97 56.47 1lo3 s LYS 112 Cb -0.16 -2.80 0.04 0.00 -1.51 0.00 0.00 37.83 33.40 1lo3 s LYS 112 CO 0.12 0.37 0.62 2.89 -0.36 0.00 0.00 175.35 178.98 1lo3 n ARG 113 N 0.50 0.88 -2.62 4.03 1.85 -1.26 -4.86 116.66 115.18 1lo3 n ARG 113 Ca -0.02 -2.26 -0.40 0.00 -1.00 0.00 0.00 57.85 54.16 1lo3 n ARG 113 Cb 0.52 2.53 -0.05 0.00 -1.05 0.00 0.00 32.46 34.41 1lo3 n ARG 113 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1lo3 s ALA 114 N -2.27 3.35 0.40 2.89 0.00 -1.26 -4.97 121.76 119.90 1lo3 s ALA 114 Ca 0.20 0.73 -0.22 0.00 0.00 0.00 0.00 51.96 52.66 1lo3 s ALA 114 Cb -0.03 -3.28 -0.14 0.00 0.00 0.00 0.00 23.12 19.67 1lo3 s ALA 114 CO 0.14 -0.01 0.41 -0.25 0.00 0.00 0.00 175.76 176.05 1lo3 n ASP 115 N 1.78 -1.47 -3.59 0.00 10.43 -1.26 -4.81 116.55 117.62 1lo3 n ASP 115 Ca -0.00 0.90 -0.18 0.00 2.57 0.00 0.00 54.79 58.08 1lo3 n ASP 115 Cb 0.47 -1.04 -0.14 0.00 1.84 0.00 0.00 41.12 42.25 1lo3 n ASP 115 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1lo3 s ALA 116 N -1.50 -0.20 0.39 2.24 0.00 0.28 -4.86 121.76 118.12 1lo3 s ALA 116 Ca 0.62 0.42 -0.27 0.00 0.00 0.00 0.00 51.96 52.73 1lo3 s ALA 116 Cb -0.64 -1.06 -0.10 0.00 0.00 0.00 0.00 23.12 21.33 1lo3 s ALA 116 CO 0.59 -0.88 1.38 0.00 0.00 0.00 0.00 175.76 176.86 1lo3 s ALA 117 N 2.31 3.40 0.49 0.00 0.00 -1.26 -0.28 121.76 126.43 1lo3 s ALA 117 Ca 0.04 1.39 -0.19 0.00 0.00 0.00 0.00 51.96 53.21 1lo3 s ALA 117 Cb -0.14 -3.54 -0.08 0.00 0.00 0.00 0.00 23.12 19.36 1lo3 s ALA 117 CO -0.09 -0.93 1.00 -1.25 0.00 0.00 0.00 175.76 174.49 1lo3 s PRO 118 N -2.14 3.90 -0.35 0.00 0.04 -1.26 -4.46 135.00 130.72 1lo3 s PRO 118 Ca 0.55 1.14 -0.14 0.00 0.04 0.00 0.00 61.00 62.59 1lo3 s PRO 118 Cb -0.42 -2.12 -0.01 0.00 0.04 0.00 0.00 34.50 31.99 1lo3 s PRO 118 CO 0.56 -0.32 0.27 0.99 0.04 0.00 0.00 177.00 178.54 1lo3 s THR 119 N -2.31 5.26 -0.21 1.26 2.01 -0.35 -4.85 115.64 116.45 1lo3 s THR 119 Ca 0.63 -0.25 -0.16 0.00 0.31 0.00 0.00 61.69 62.21 1lo3 s THR 119 Cb -0.12 -3.78 -0.04 0.00 0.01 0.00 0.00 72.50 68.58 1lo3 s THR 119 CO 0.24 -0.08 0.41 -0.69 -0.69 0.00 0.00 174.62 173.80 1lo3 s VAL 120 N 1.77 5.18 -0.10 3.82 1.01 -1.25 -1.53 120.40 129.31 1lo3 s VAL 120 Ca 0.07 0.71 0.02 0.00 0.00 0.00 0.00 61.98 62.79 1lo3 s VAL 120 Cb -0.18 -3.74 0.01 0.00 0.00 0.00 0.00 36.38 32.48 1lo3 s VAL 120 CO 0.11 0.23 -0.16 -0.44 0.00 0.00 0.00 175.10 174.83 1lo3 s SER 121 N 1.14 2.41 -0.07 3.32 0.01 -0.08 -4.91 113.70 115.51 1lo3 s SER 121 Ca 0.19 -0.42 0.02 0.00 1.31 0.00 0.00 55.95 57.05 1lo3 s SER 121 Cb -0.15 -1.09 -0.02 0.00 0.21 0.00 0.00 66.02 64.96 1lo3 s SER 121 CO 0.08 0.05 -0.12 -0.51 0.41 0.00 0.00 173.24 173.15 1lo3 s ILE 122 N 0.76 3.23 -0.15 1.44 2.07 -1.26 -0.59 121.20 126.69 1lo3 s ILE 122 Ca -0.11 -0.65 -0.01 0.00 -1.41 0.00 0.00 60.65 58.47 1lo3 s ILE 122 Cb -0.16 -2.30 0.04 0.00 0.13 0.00 0.00 42.46 40.17 1lo3 s ILE 122 CO 0.02 0.58 -0.02 -0.36 -1.91 0.00 0.00 174.94 173.25 1lo3 s PHE 123 N -0.50 1.26 1.08 3.50 0.40 0.08 -5.01 117.98 118.79 1lo3 s PHE 123 Ca 0.07 -0.78 -0.13 0.00 -0.60 0.00 0.00 56.93 55.49 1lo3 s PHE 123 Cb -0.12 -1.11 0.24 0.00 0.51 0.00 0.00 43.02 42.54 1lo3 s PHE 123 CO 0.02 -0.54 1.06 -1.25 0.70 0.00 0.00 175.22 175.21 1lo3 s PRO 124 N 1.78 -0.24 0.43 0.24 0.04 -1.26 -2.14 135.00 133.85 1lo3 s PRO 124 Ca 0.02 0.66 -0.26 0.00 0.04 0.00 0.00 61.00 61.46 1lo3 s PRO 124 Cb -0.15 -1.65 -0.09 0.00 0.04 0.00 0.00 34.50 32.65 1lo3 s PRO 124 CO -0.07 -3.22 1.44 -2.30 0.04 0.00 0.00 177.00 172.89 1lo3 n PRO 125 N -4.54 2.35 -2.27 0.56 -0.02 -1.24 -4.80 135.00 125.03 1lo3 n PRO 125 Ca 0.04 0.83 -0.35 0.00 -2.02 0.00 0.00 63.50 62.00 1lo3 n PRO 125 Cb 0.56 -2.63 -0.00 0.00 -0.02 0.00 0.00 33.50 31.40 1lo3 n PRO 125 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1lo3 s SER 126 N -0.39 5.78 0.57 2.55 1.04 -1.26 -4.89 113.70 117.10 1lo3 s SER 126 Ca 0.59 2.18 0.27 0.00 0.48 0.00 0.00 55.95 59.48 1lo3 s SER 126 Cb -0.46 -2.58 1.68 0.00 0.10 0.00 0.00 66.02 64.76 1lo3 s SER 126 CO 0.59 -1.18 2.21 0.28 0.98 0.00 0.00 173.24 176.12 1lo3 h SER 127 N 1.29 0.00 0.07 7.02 0.02 -1.99 -2.26 113.55 117.70 1lo3 h SER 127 Ca -0.50 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.45 1lo3 h SER 127 Cb 1.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.80 1lo3 h SER 127 CO 0.57 0.02 -0.03 -0.33 -1.14 0.00 0.00 176.83 175.92 1lo3 h GLU 128 N 0.00 -0.09 -0.90 3.45 5.08 -1.98 -3.11 114.58 117.03 1lo3 h GLU 128 Ca -0.00 0.01 0.10 0.00 -1.00 0.00 0.00 59.36 58.46 1lo3 h GLU 128 Cb 0.05 0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.25 1lo3 h GLU 128 CO 0.00 0.45 0.54 0.37 -1.00 0.00 0.00 179.01 179.38 1lo3 h GLN 129 N -0.72 0.88 -0.91 2.33 4.15 -1.74 -1.49 115.11 117.60 1lo3 h GLN 129 Ca -0.01 -0.05 0.13 0.00 0.77 0.00 0.00 58.65 59.49 1lo3 h GLN 129 Cb 0.58 -0.20 -0.07 0.00 0.21 0.00 0.00 27.48 28.00 1lo3 h GLN 129 CO 0.02 0.58 0.59 -0.07 -1.93 0.00 0.00 178.83 178.02 1lo3 h LEU 130 N 0.91 0.73 -0.61 -2.39 3.38 -1.33 -0.82 115.31 115.19 1lo3 h LEU 130 Ca 0.43 0.04 -0.13 0.00 0.09 0.00 0.00 57.88 58.31 1lo3 h LEU 130 Cb 0.36 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1lo3 h LEU 130 CO -0.24 0.38 -0.32 0.74 0.09 0.00 0.00 178.44 179.10 1lo3 h THR 131 N 0.78 1.28 0.00 0.22 2.02 -1.20 -1.48 112.91 114.52 1lo3 h THR 131 Ca 0.46 -1.46 0.00 0.00 0.77 0.00 0.00 66.41 66.17 1lo3 h THR 131 Cb 0.64 1.35 0.00 0.00 -1.74 0.00 0.00 68.15 68.40 1lo3 h THR 131 CO -0.22 0.48 0.00 0.77 0.37 0.00 0.00 175.52 176.92 1lo3 h SER 132 N 0.64 0.00 0.00 4.18 4.64 -0.98 -3.46 113.55 118.58 1lo3 h SER 132 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1lo3 h SER 132 Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 1lo3 h SER 132 CO 0.07 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.64 1lo3 n GLY 133 N -0.29 1.39 3.36 -0.77 0.00 -0.56 -5.09 105.19 103.23 1lo3 n GLY 133 Ca 0.01 -0.11 -0.18 0.00 0.00 0.00 0.00 46.02 45.74 1lo3 n GLY 133 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1lo3 s GLY 134 N -2.11 1.70 -0.22 -0.02 0.00 -0.77 -2.98 107.32 102.93 1lo3 s GLY 134 Ca 0.00 -1.85 -0.03 0.00 0.00 0.00 0.00 44.72 42.84 1lo3 s GLY 134 CO 0.00 -1.70 0.28 0.00 0.00 0.00 0.00 173.10 171.69 1lo3 s ALA 135 N -3.41 -0.60 -0.22 3.20 0.00 -1.21 -3.00 121.76 116.52 1lo3 s ALA 135 Ca 0.31 0.52 -0.01 0.00 0.00 0.00 0.00 51.96 52.79 1lo3 s ALA 135 Cb 0.06 -1.46 0.02 0.00 0.00 0.00 0.00 23.12 21.74 1lo3 s ALA 135 CO 0.11 -1.23 -0.12 -1.12 0.00 0.00 0.00 175.76 173.40 1lo3 s SER 136 N 2.41 3.84 -0.34 0.00 0.01 -1.26 0.11 113.70 118.48 1lo3 s SER 136 Ca 0.09 -0.74 -0.12 0.00 1.31 0.00 0.00 55.95 56.49 1lo3 s SER 136 Cb -0.16 -1.59 -0.01 0.00 0.21 0.00 0.00 66.02 64.47 1lo3 s SER 136 CO -0.14 -0.06 0.23 -0.69 0.41 0.00 0.00 173.24 172.99 1lo3 s VAL 137 N 1.32 5.16 0.16 3.43 1.01 0.13 -3.70 120.40 127.91 1lo3 s VAL 137 Ca 0.02 -0.26 0.03 0.00 0.00 0.00 0.00 61.98 61.77 1lo3 s VAL 137 Cb -0.15 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.54 1lo3 s VAL 137 CO -0.08 -0.00 0.26 -0.69 0.00 0.00 0.00 175.10 174.59 1lo3 s VAL 138 N 1.70 5.15 -0.16 2.92 1.01 -0.91 -0.24 120.40 129.87 1lo3 s VAL 138 Ca 0.06 -0.79 -0.07 0.00 0.00 0.00 0.00 61.98 61.18 1lo3 s VAL 138 Cb -0.17 -3.66 0.07 0.00 0.00 0.00 0.00 36.38 32.62 1lo3 s VAL 138 CO 0.10 -0.12 0.35 0.00 0.00 0.00 0.00 175.10 175.44 1lo3 s PHE 140 N 2.12 3.20 -0.61 0.00 0.08 0.24 -1.00 117.98 122.00 1lo3 s PHE 140 Ca -0.04 -0.06 -0.06 0.00 0.12 0.00 0.00 56.93 56.90 1lo3 s PHE 140 Cb -0.11 -2.22 0.16 0.00 -0.57 0.00 0.00 43.02 40.28 1lo3 s PHE 140 CO -0.11 -0.09 0.45 -0.51 -0.10 0.00 0.00 175.22 174.86 1lo3 s LEU 141 N 1.17 5.55 0.29 -0.37 1.02 0.06 -0.91 118.68 125.50 1lo3 s LEU 141 Ca 0.06 -2.61 0.06 0.00 0.02 0.00 0.00 54.13 51.66 1lo3 s LEU 141 Cb -0.14 -1.93 -0.02 0.00 0.02 0.00 0.00 46.19 44.12 1lo3 s LEU 141 CO 0.04 -0.47 0.39 0.20 0.02 0.00 0.00 176.35 176.54 1lo3 s ASN 142 N 1.32 6.00 -0.72 2.29 0.02 -0.58 -0.65 114.94 122.62 1lo3 s ASN 142 Ca 0.15 -0.12 -0.19 0.00 -1.02 0.00 0.00 52.86 51.67 1lo3 s ASN 142 Cb -0.20 -1.46 0.03 0.00 0.02 0.00 0.00 41.25 39.64 1lo3 s ASN 142 CO -0.04 -0.25 0.42 0.59 0.02 0.00 0.00 177.10 177.83 1lo3 n ASN 143 N -1.49 -2.59 -4.50 -1.22 4.13 -0.81 -1.22 115.26 107.55 1lo3 n ASN 143 Ca -0.04 -0.79 -0.25 0.00 1.68 0.00 0.00 54.58 55.17 1lo3 n ASN 143 Cb 0.58 -0.98 -0.10 0.00 -1.54 0.00 0.00 39.78 37.74 1lo3 n ASN 143 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1lo3 s PHE 144 N -3.89 2.43 -0.14 3.10 -0.12 0.38 -4.48 117.98 115.26 1lo3 s PHE 144 Ca 0.27 -0.30 -0.14 0.00 -0.05 0.00 0.00 56.93 56.71 1lo3 s PHE 144 Cb -0.15 -1.14 0.04 0.00 -0.63 0.00 0.00 43.02 41.14 1lo3 s PHE 144 CO 0.60 0.59 0.39 -0.47 -0.05 0.00 0.00 175.22 176.28 1lo3 s TYR 145 N -2.03 -0.42 0.48 3.49 6.14 0.62 -0.85 117.35 124.78 1lo3 s TYR 145 Ca 0.26 1.02 -0.08 0.00 0.64 0.00 0.00 57.07 58.91 1lo3 s TYR 145 Cb -0.07 0.15 0.12 0.00 0.42 0.00 0.00 41.96 42.58 1lo3 s TYR 145 CO 0.14 -0.22 0.38 -0.35 0.64 0.00 0.00 175.55 176.14 1lo3 n PRO 146 N 2.77 -2.18 0.00 4.97 -0.04 -1.26 -0.55 135.00 138.72 1lo3 n PRO 146 Ca -0.14 -0.62 0.13 0.00 -0.04 0.00 0.00 63.50 62.84 1lo3 n PRO 146 Cb 0.57 -0.64 0.59 0.00 -0.04 0.00 0.00 33.50 33.99 1lo3 n PRO 146 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 1lo3 n LYS 147 N -2.94 0.00 -2.55 0.54 2.85 -1.26 -4.81 118.16 109.99 1lo3 n LYS 147 Ca 0.05 0.02 -0.43 0.00 -1.05 0.00 0.00 58.31 56.91 1lo3 n LYS 147 Cb 0.22 -1.51 -0.02 0.00 -0.65 0.00 0.00 35.03 33.07 1lo3 n LYS 147 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1lo3 s ASP 148 N -3.03 6.94 -0.02 -5.58 1.11 -1.26 -5.02 116.67 109.82 1lo3 s ASP 148 Ca 0.13 1.35 -0.17 0.00 0.18 0.00 0.00 52.55 54.04 1lo3 s ASP 148 Cb 0.18 -2.54 0.03 0.00 1.07 0.00 0.00 42.92 41.66 1lo3 s ASP 148 CO 0.51 -0.82 0.36 -0.51 1.18 0.00 0.00 175.17 175.89 1lo3 s ILE 149 N 3.60 0.05 -0.16 0.77 2.07 -1.26 -4.47 121.20 121.80 1lo3 s ILE 149 Ca 0.49 -0.41 0.01 0.00 -1.41 0.00 0.00 60.65 59.34 1lo3 s ILE 149 Cb -0.16 -0.67 0.01 0.00 0.13 0.00 0.00 42.46 41.77 1lo3 s ILE 149 CO 0.14 -0.22 -0.18 0.20 -1.91 0.00 0.00 174.94 172.96 1lo3 s ASN 150 N -1.29 3.40 -0.22 4.50 0.01 -0.73 -4.97 114.94 115.64 1lo3 s ASN 150 Ca -0.13 -0.54 -0.04 0.00 -0.71 0.00 0.00 52.86 51.44 1lo3 s ASN 150 Cb -0.04 -1.51 -0.01 0.00 0.41 0.00 0.00 41.25 40.09 1lo3 s ASN 150 CO 0.05 0.07 -0.05 0.54 -1.51 0.00 0.00 177.10 176.20 1lo3 s VAL 151 N 0.91 3.36 -0.06 1.60 0.11 -1.26 0.34 120.40 125.40 1lo3 s VAL 151 Ca -0.04 -0.50 0.05 0.00 -2.93 0.00 0.00 61.98 58.56 1lo3 s VAL 151 Cb -0.15 -2.52 -0.02 0.00 -1.53 0.00 0.00 36.38 32.16 1lo3 s VAL 151 CO -0.03 0.43 -0.20 -0.75 -3.33 0.00 0.00 175.10 171.22 1lo3 s LYS 152 N 1.46 2.54 0.05 1.54 2.20 0.80 -4.97 119.74 123.34 1lo3 s LYS 152 Ca 0.06 -0.81 0.04 0.00 -0.36 0.00 0.00 55.97 54.90 1lo3 s LYS 152 Cb -0.14 -2.27 -0.04 0.00 -1.51 0.00 0.00 37.83 33.87 1lo3 s LYS 152 CO -0.03 0.49 -0.02 -1.58 -0.36 0.00 0.00 175.35 173.85 1lo3 s TRP 153 N -0.41 2.97 -0.19 4.03 0.52 -1.26 0.09 118.94 124.69 1lo3 s TRP 153 Ca 0.04 -0.01 -0.05 0.00 0.02 0.00 0.00 56.10 56.11 1lo3 s TRP 153 Cb -0.12 -1.58 0.07 0.00 -1.15 0.00 0.00 33.47 30.69 1lo3 s TRP 153 CO 0.02 0.45 0.14 0.15 0.02 0.00 0.00 176.95 177.73 1lo3 s LYS 154 N -1.90 0.12 -0.59 4.98 1.02 -0.80 -1.32 119.74 121.24 1lo3 s LYS 154 Ca 0.22 0.01 -0.17 0.00 0.02 0.00 0.00 55.97 56.05 1lo3 s LYS 154 Cb -0.11 -1.56 0.13 0.00 -0.52 0.00 0.00 37.83 35.76 1lo3 s LYS 154 CO 0.13 -0.68 0.61 0.42 -0.92 0.00 0.00 175.35 174.92 1lo3 s ILE 155 N 2.21 5.08 -0.15 2.17 1.01 0.28 -2.11 121.20 129.69 1lo3 s ILE 155 Ca 0.04 -1.39 -0.01 0.00 0.00 0.00 0.00 60.65 59.29 1lo3 s ILE 155 Cb -0.16 -4.42 0.00 0.00 0.01 0.00 0.00 42.46 37.89 1lo3 s ILE 155 CO -0.11 -1.00 0.13 0.47 0.00 0.00 0.00 174.94 174.43 1lo3 n ASP 156 N 5.58 -2.43 0.00 3.58 8.00 0.96 -3.62 116.55 128.62 1lo3 n ASP 156 Ca -0.09 -0.06 0.00 0.00 0.71 0.00 0.00 54.79 55.35 1lo3 n ASP 156 Cb 0.42 -1.02 0.00 0.00 -0.02 0.00 0.00 41.12 40.50 1lo3 n ASP 156 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1lo3 n GLY 157 N -0.72 2.99 3.63 0.44 0.00 -1.26 -4.98 105.19 105.29 1lo3 n GLY 157 Ca -0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1lo3 n GLY 157 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1lo3 s SER 158 N -1.52 6.31 0.20 1.61 0.01 -1.24 -4.97 113.70 114.09 1lo3 s SER 158 Ca 0.00 0.36 -0.32 0.00 1.31 0.00 0.00 55.95 57.30 1lo3 s SER 158 Cb 0.00 -2.21 -0.12 0.00 0.21 0.00 0.00 66.02 63.90 1lo3 s SER 158 CO 0.00 -0.14 1.74 -0.70 0.41 0.00 0.00 173.24 174.55 1lo3 s GLU 159 N 1.78 4.12 -0.80 12.44 2.12 -1.26 -0.56 118.70 136.55 1lo3 s GLU 159 Ca 0.16 2.61 0.00 0.00 0.36 0.00 0.00 54.97 58.10 1lo3 s GLU 159 Cb -0.15 -3.15 0.20 0.00 0.26 0.00 0.00 34.13 31.28 1lo3 s GLU 159 CO 0.09 -0.77 0.65 0.50 -0.54 0.00 0.00 175.26 175.19 1lo3 s ARG 160 N 1.43 2.95 -0.44 4.30 6.06 -0.44 -4.87 118.95 127.94 1lo3 s ARG 160 Ca 0.76 -3.19 -0.04 0.00 -2.50 0.00 0.00 55.73 50.76 1lo3 s ARG 160 Cb -0.49 -3.78 0.06 0.00 0.06 0.00 0.00 34.95 30.80 1lo3 s ARG 160 CO 0.33 -1.25 2.76 0.00 -2.50 0.00 0.00 175.30 174.63 1lo3 n GLN 161 N 2.40 2.37 -3.76 5.12 -0.00 -1.26 -4.62 117.38 117.63 1lo3 n GLN 161 Ca 0.19 -2.29 -0.13 0.00 -0.00 0.00 0.00 57.00 54.76 1lo3 n GLN 161 Cb 0.36 -2.12 -0.11 0.00 -0.00 0.00 0.00 30.24 28.38 1lo3 n GLN 161 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.06 178.27 1lo3 s ASN 162 N 0.37 -0.35 -0.73 2.61 3.84 -1.26 -4.93 114.94 114.49 1lo3 s ASN 162 Ca 0.58 0.65 -0.02 0.00 0.21 0.00 0.00 52.86 54.29 1lo3 s ASN 162 Cb 0.38 0.68 0.00 0.00 -0.55 0.00 0.00 41.25 41.76 1lo3 s ASN 162 CO -0.21 -0.14 0.26 0.61 -2.79 0.00 0.00 177.10 174.83 1lo3 n GLY 163 N 2.80 0.11 3.36 1.21 0.00 -1.26 -4.91 105.19 106.51 1lo3 n GLY 163 Ca -0.13 -0.37 -0.34 0.00 0.00 0.00 0.00 46.02 45.17 1lo3 n GLY 163 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lo3 s VAL 164 N -2.79 3.23 -0.28 1.61 1.01 -1.26 -2.85 120.40 119.07 1lo3 s VAL 164 Ca 0.13 -0.57 -0.09 0.00 0.00 0.00 0.00 61.98 61.44 1lo3 s VAL 164 Cb -0.06 -2.41 -0.03 0.00 0.00 0.00 0.00 36.38 33.89 1lo3 s VAL 164 CO 0.16 0.49 0.14 -0.76 0.00 0.00 0.00 175.10 175.12 1lo3 s LEU 165 N 0.76 3.83 0.00 3.92 1.43 -0.55 -4.94 118.68 123.13 1lo3 s LEU 165 Ca -0.04 -0.20 0.04 0.00 -1.03 0.00 0.00 54.13 52.90 1lo3 s LEU 165 Cb -0.15 -2.02 -0.03 0.00 0.03 0.00 0.00 46.19 44.02 1lo3 s LEU 165 CO 0.02 -0.08 -0.12 0.20 0.23 0.00 0.00 176.35 176.60 1lo3 s ASN 166 N 1.67 4.25 0.02 2.29 0.02 -1.26 -0.31 114.94 121.63 1lo3 s ASN 166 Ca 0.06 -0.24 0.02 0.00 -1.02 0.00 0.00 52.86 51.68 1lo3 s ASN 166 Cb -0.16 -0.89 -0.02 0.00 0.02 0.00 0.00 41.25 40.20 1lo3 s ASN 166 CO 0.07 0.29 -0.06 -0.55 0.02 0.00 0.00 177.10 176.87 1lo3 s SER 167 N -1.27 0.64 0.12 -1.22 0.15 -0.39 -5.01 113.70 106.73 1lo3 s SER 167 Ca 0.15 -0.36 0.09 0.00 0.70 0.00 0.00 55.95 56.53 1lo3 s SER 167 Cb -0.11 0.01 -0.04 0.00 -1.71 0.00 0.00 66.02 64.17 1lo3 s SER 167 CO 0.05 -0.11 -0.22 0.26 1.20 0.00 0.00 173.24 174.42 1lo3 s TRP 168 N -0.88 1.90 0.25 3.44 0.51 -1.26 -1.41 118.94 121.48 1lo3 s TRP 168 Ca -0.06 -0.42 0.01 0.00 -2.12 0.00 0.00 56.10 53.51 1lo3 s TRP 168 Cb -0.07 -1.02 -0.04 0.00 -0.81 0.00 0.00 33.47 31.54 1lo3 s TRP 168 CO 0.00 0.26 0.43 0.95 -0.51 0.00 0.00 176.95 178.08 1lo3 s THR 169 N -1.32 5.19 0.55 2.01 -4.23 -0.65 -5.01 115.64 112.19 1lo3 s THR 169 Ca 0.10 -0.56 -0.16 0.00 -1.18 0.00 0.00 61.69 59.89 1lo3 s THR 169 Cb -0.09 -3.80 -0.06 0.00 1.34 0.00 0.00 72.50 69.88 1lo3 s THR 169 CO 0.05 -0.32 1.01 -1.81 -0.54 0.00 0.00 174.62 173.00 1lo3 s ASP 170 N -3.63 6.38 0.21 3.99 1.01 -1.26 -4.56 116.67 118.80 1lo3 s ASP 170 Ca 0.38 1.61 -0.31 0.00 0.71 0.00 0.00 52.55 54.94 1lo3 s ASP 170 Cb -0.10 -2.51 -0.16 0.00 1.01 0.00 0.00 42.92 41.16 1lo3 s ASP 170 CO 0.31 -0.76 0.98 1.67 0.21 0.00 0.00 175.17 177.58 1lo3 n GLN 171 N -1.82 0.92 -2.09 8.23 7.27 -1.26 -4.83 117.38 123.80 1lo3 n GLN 171 Ca 0.07 0.32 -0.42 0.00 0.07 0.00 0.00 57.00 57.04 1lo3 n GLN 171 Cb 0.54 -1.68 -0.03 0.00 2.41 0.00 0.00 30.24 31.48 1lo3 n GLN 171 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1lo3 s ASP 172 N -0.39 6.73 0.34 1.69 2.15 -0.10 -4.88 116.67 122.21 1lo3 s ASP 172 Ca 0.68 2.19 0.25 0.00 0.43 0.00 0.00 52.55 56.10 1lo3 s ASP 172 Cb -0.84 -2.54 1.24 0.00 -0.30 0.00 0.00 42.92 40.47 1lo3 s ASP 172 CO 0.56 -0.85 1.75 0.77 -0.17 0.00 0.00 175.17 177.22 1lo3 h SER 173 N 8.81 0.00 0.00 -0.34 4.64 -1.91 0.74 113.55 125.49 1lo3 h SER 173 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1lo3 h SER 173 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1lo3 h SER 173 CO 0.94 0.00 0.00 1.17 -0.87 0.00 0.00 176.83 178.07 1lo3 n LYS 174 N -2.35 0.00 0.00 4.77 4.81 -1.26 -4.73 118.16 119.39 1lo3 n LYS 174 Ca -0.01 0.13 0.12 0.00 -0.87 0.00 0.00 58.31 57.68 1lo3 n LYS 174 Cb 0.10 -0.57 0.25 0.00 0.02 0.00 0.00 35.03 34.83 1lo3 n LYS 174 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1lo3 n ASP 175 N -2.16 0.53 -1.03 3.14 5.68 -1.25 -4.98 116.55 116.48 1lo3 n ASP 175 Ca 0.00 -0.29 -0.10 0.00 -0.50 0.00 0.00 54.79 53.90 1lo3 n ASP 175 Cb 0.00 0.26 -0.02 0.00 -1.14 0.00 0.00 41.12 40.22 1lo3 n ASP 175 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1lo3 n SER 176 N -1.47 -3.69 -4.21 -1.12 7.64 0.25 -4.99 113.62 106.04 1lo3 n SER 176 Ca 0.06 0.08 -0.16 0.00 1.01 0.00 0.00 58.87 59.85 1lo3 n SER 176 Cb 0.34 -2.65 0.03 0.00 -1.01 0.00 0.00 64.21 60.92 1lo3 n SER 176 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1lo3 n THR 177 N -3.56 0.00 -4.33 0.44 -2.24 -1.26 -4.67 114.28 98.66 1lo3 n THR 177 Ca -0.11 -1.54 -0.21 0.00 -2.27 0.00 0.00 64.05 59.92 1lo3 n THR 177 Cb 0.50 -0.46 -0.11 0.00 -2.10 0.00 0.00 70.33 68.16 1lo3 n THR 177 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1lo3 s TYR 178 N -1.85 1.77 0.05 4.78 1.51 -0.03 -0.93 117.35 122.65 1lo3 s TYR 178 Ca 0.39 -0.50 -0.00 0.00 -1.01 0.00 0.00 57.07 55.95 1lo3 s TYR 178 Cb -0.03 -0.87 -0.04 0.00 -0.11 0.00 0.00 41.96 40.92 1lo3 s TYR 178 CO 0.25 0.33 -0.04 -1.12 -1.11 0.00 0.00 175.55 173.86 1lo3 s SER 179 N -2.82 0.53 -0.13 2.29 0.01 -1.26 -0.47 113.70 111.85 1lo3 s SER 179 Ca 0.17 -0.91 -0.17 0.00 1.31 0.00 0.00 55.95 56.35 1lo3 s SER 179 Cb -0.04 0.17 0.04 0.00 0.21 0.00 0.00 66.02 66.40 1lo3 s SER 179 CO 0.07 -0.53 0.44 0.00 0.41 0.00 0.00 173.24 173.63 1lo3 s MET 180 N -3.46 0.60 -0.10 12.44 0.23 0.18 -1.63 119.30 127.56 1lo3 s MET 180 Ca 0.03 0.44 0.00 0.00 -1.03 0.00 0.00 55.69 55.14 1lo3 s MET 180 Cb 0.04 0.28 -0.03 0.00 -1.53 0.00 0.00 34.83 33.60 1lo3 s MET 180 CO -0.08 -0.11 -0.09 -1.54 -2.03 0.00 0.00 175.02 171.18 1lo3 s SER 181 N -0.17 4.43 -0.24 -1.18 1.04 -0.50 -0.76 113.70 116.31 1lo3 s SER 181 Ca -0.03 -0.14 0.00 0.00 0.48 0.00 0.00 55.95 56.26 1lo3 s SER 181 Cb -0.03 -1.33 0.07 0.00 0.10 0.00 0.00 66.02 64.82 1lo3 s SER 181 CO 0.02 0.28 -0.01 -0.55 0.98 0.00 0.00 173.24 173.96 1lo3 s SER 182 N -0.31 3.75 -0.38 7.02 0.15 -0.17 -1.26 113.70 122.49 1lo3 s SER 182 Ca 0.04 -1.23 -0.12 0.00 0.70 0.00 0.00 55.95 55.34 1lo3 s SER 182 Cb -0.13 -1.06 0.03 0.00 -1.71 0.00 0.00 66.02 63.15 1lo3 s SER 182 CO 0.02 -0.28 0.22 -0.89 1.20 0.00 0.00 173.24 173.52 1lo3 s THR 183 N 1.48 4.68 -0.01 6.45 2.01 0.58 -1.77 115.64 129.06 1lo3 s THR 183 Ca -0.02 -0.85 -0.26 0.00 0.31 0.00 0.00 61.69 60.87 1lo3 s THR 183 Cb -0.18 -3.63 -0.04 0.00 0.01 0.00 0.00 72.50 68.66 1lo3 s THR 183 CO -0.09 -0.26 0.80 -0.22 -0.69 0.00 0.00 174.62 174.16 1lo3 s LEU 184 N 1.57 4.38 -0.16 4.42 0.20 0.66 -1.49 118.68 128.26 1lo3 s LEU 184 Ca 0.02 1.41 0.01 0.00 0.69 0.00 0.00 54.13 56.27 1lo3 s LEU 184 Cb -0.19 -3.27 0.02 0.00 -0.43 0.00 0.00 46.19 42.31 1lo3 s LEU 184 CO 0.07 -0.11 -0.20 0.28 -0.29 0.00 0.00 176.35 176.10 1lo3 s THR 185 N 0.55 2.01 0.00 3.68 -1.32 -1.13 0.21 115.64 119.63 1lo3 s THR 185 Ca 0.42 -0.92 0.00 0.00 -1.21 0.00 0.00 61.69 59.98 1lo3 s THR 185 Cb -0.20 -1.80 0.00 0.00 -1.51 0.00 0.00 72.50 68.99 1lo3 s THR 185 CO 0.23 0.53 0.00 0.18 -2.21 0.00 0.00 174.62 173.35 1lo3 n LEU 186 N 4.46 0.00 -4.20 9.08 4.32 0.31 -4.94 117.00 126.02 1lo3 n LEU 186 Ca -0.20 0.00 -0.16 0.00 -0.02 0.00 0.00 56.01 55.62 1lo3 n LEU 186 Cb 0.50 0.00 -0.11 0.00 -1.62 0.00 0.00 43.42 42.19 1lo3 n LEU 186 CO 0.26 0.00 -0.43 0.42 -1.22 0.00 0.00 177.39 176.42 1lo3 s THR 187 N 1.64 1.12 0.25 -5.08 -4.23 -1.26 -3.30 115.64 104.78 1lo3 s THR 187 Ca 0.00 -1.65 -0.05 0.00 -1.18 0.00 0.00 61.69 58.81 1lo3 s THR 187 Cb 0.00 -1.41 0.24 0.00 1.34 0.00 0.00 72.50 72.67 1lo3 s THR 187 CO 0.00 -0.47 1.68 0.50 -0.54 0.00 0.00 174.62 175.79 1lo3 h LYS 188 N 3.60 0.23 -0.24 3.99 3.64 -1.73 0.72 116.57 126.78 1lo3 h LYS 188 Ca -0.39 -0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 58.87 1lo3 h LYS 188 Cb 1.19 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.96 1lo3 h LYS 188 CO 0.51 0.15 -0.28 -0.44 -2.27 0.00 0.00 179.45 177.13 1lo3 h ASP 189 N 0.24 0.66 -0.28 4.20 5.19 -1.96 -0.96 116.42 123.51 1lo3 h ASP 189 Ca 0.42 -0.49 -0.15 0.00 -0.62 0.00 0.00 57.03 56.19 1lo3 h ASP 189 Cb 0.74 -0.19 -0.01 0.00 0.18 0.00 0.00 39.33 40.05 1lo3 h ASP 189 CO -0.54 1.02 -0.39 -0.08 -3.12 0.00 0.00 179.24 176.13 1lo3 h GLU 190 N 0.32 0.83 -0.69 3.56 4.81 -1.77 -2.83 114.58 118.81 1lo3 h GLU 190 Ca 0.03 -0.43 -0.03 0.00 -0.13 0.00 0.00 59.36 58.80 1lo3 h GLU 190 Cb 0.85 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.21 1lo3 h GLU 190 CO 0.07 1.07 0.30 -0.92 -0.73 0.00 0.00 179.01 178.79 1lo3 h TYR 191 N 0.68 1.03 0.00 0.92 3.20 0.42 -1.86 116.97 121.35 1lo3 h TYR 191 Ca 0.06 -0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.86 1lo3 h TYR 191 Cb 0.96 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.91 1lo3 h TYR 191 CO 0.05 0.78 0.00 0.39 -1.64 0.00 0.00 178.16 177.75 1lo3 n GLU 192 N -4.41 0.57 0.03 1.82 4.71 -0.37 -2.40 120.64 120.60 1lo3 n GLU 192 Ca 0.05 0.02 0.12 0.00 -0.01 0.00 0.00 57.16 57.34 1lo3 n GLU 192 Cb 0.16 -1.50 0.12 0.00 -1.01 0.00 0.00 31.44 29.21 1lo3 n GLU 192 CO 0.00 0.00 0.00 -2.13 0.09 0.00 0.00 177.13 175.09 1lo3 n ARG 193 N -1.05 0.23 -4.58 3.49 0.63 -0.70 -4.94 116.66 109.75 1lo3 n ARG 193 Ca 0.14 0.03 -0.26 0.00 -0.92 0.00 0.00 57.85 56.84 1lo3 n ARG 193 Cb 0.08 -1.61 -0.10 0.00 0.45 0.00 0.00 32.46 31.28 1lo3 n ARG 193 CO 0.00 0.00 0.00 -1.01 -2.51 0.00 0.00 177.63 174.11 1lo3 s HIS 194 N -3.14 2.23 0.01 -0.14 3.76 -1.01 -5.08 115.29 111.92 1lo3 s HIS 194 Ca 0.06 -0.83 0.00 0.00 -0.15 0.00 0.00 55.06 54.15 1lo3 s HIS 194 Cb 0.15 -1.57 0.00 0.00 1.11 0.00 0.00 32.58 32.27 1lo3 s HIS 194 CO 0.75 0.25 0.00 -1.71 -0.85 0.00 0.00 174.74 173.18 1lo3 n ASN 195 N -0.93 0.03 -4.59 1.40 2.85 -1.26 -4.68 115.26 108.09 1lo3 n ASN 195 Ca -0.06 0.01 -0.41 0.00 -0.11 0.00 0.00 54.58 54.01 1lo3 n ASN 195 Cb 0.67 -0.01 -0.07 0.00 1.24 0.00 0.00 39.78 41.61 1lo3 n ASN 195 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 1lo3 s SER 196 N -5.03 6.41 -0.16 1.20 0.01 -1.26 0.58 113.70 115.45 1lo3 s SER 196 Ca 0.00 0.27 -0.01 0.00 1.31 0.00 0.00 55.95 57.52 1lo3 s SER 196 Cb 0.00 -2.30 -0.01 0.00 0.21 0.00 0.00 66.02 63.93 1lo3 s SER 196 CO 0.00 -0.44 -0.13 -0.31 0.41 0.00 0.00 173.24 172.77 1lo3 s TYR 197 N 2.47 2.83 0.01 2.43 2.02 -0.71 -0.03 117.35 126.36 1lo3 s TYR 197 Ca 0.22 -0.92 0.03 0.00 -0.37 0.00 0.00 57.07 56.03 1lo3 s TYR 197 Cb -0.15 -1.92 -0.01 0.00 -0.40 0.00 0.00 41.96 39.48 1lo3 s TYR 197 CO 0.12 -0.42 -0.10 0.99 -1.57 0.00 0.00 175.55 174.57 1lo3 s THR 198 N 0.81 0.80 -0.26 -0.71 2.01 -0.90 -1.84 115.64 115.55 1lo3 s THR 198 Ca -0.04 -0.60 0.02 0.00 0.31 0.00 0.00 61.69 61.37 1lo3 s THR 198 Cb -0.15 -0.70 0.07 0.00 0.01 0.00 0.00 72.50 71.73 1lo3 s THR 198 CO 0.00 0.10 -0.04 0.00 -0.69 0.00 0.00 174.62 174.00 1lo3 s GLU 200 N 1.27 3.84 -0.19 0.00 2.02 0.11 -1.96 118.70 123.80 1lo3 s GLU 200 Ca -0.03 -0.33 -0.02 0.00 0.02 0.00 0.00 54.97 54.61 1lo3 s GLU 200 Cb -0.19 -3.17 -0.00 0.00 0.10 0.00 0.00 34.13 30.86 1lo3 s GLU 200 CO -0.07 0.36 -0.10 0.00 0.02 0.00 0.00 175.26 175.46 1lo3 s ALA 201 N 0.13 2.66 -0.57 5.21 0.00 0.27 -0.14 121.76 129.31 1lo3 s ALA 201 Ca 0.05 -1.11 -0.11 0.00 0.00 0.00 0.00 51.96 50.78 1lo3 s ALA 201 Cb -0.12 -1.47 0.15 0.00 0.00 0.00 0.00 23.12 21.68 1lo3 s ALA 201 CO 0.01 -0.25 0.48 0.99 0.00 0.00 0.00 175.76 176.98 1lo3 s THR 202 N 1.17 4.71 0.04 0.00 2.01 0.15 -0.75 115.64 122.97 1lo3 s THR 202 Ca 0.02 -1.96 0.05 0.00 0.31 0.00 0.00 61.69 60.11 1lo3 s THR 202 Cb -0.14 -4.03 -0.03 0.00 0.01 0.00 0.00 72.50 68.30 1lo3 s THR 202 CO -0.03 -0.86 -0.10 -2.28 -0.69 0.00 0.00 174.62 170.65 1lo3 s HIS 203 N 1.05 2.77 -1.54 4.92 2.46 -1.26 -1.78 115.29 121.91 1lo3 s HIS 203 Ca 0.08 -0.12 0.00 0.00 0.47 0.00 0.00 55.06 55.49 1lo3 s HIS 203 Cb -0.24 -1.53 0.00 0.00 -0.13 0.00 0.00 32.58 30.68 1lo3 s HIS 203 CO -0.02 0.36 0.00 0.36 -2.47 0.00 0.00 174.74 172.97 1lo3 n LYS 204 N 1.33 0.00 -0.06 2.88 -0.00 -1.26 0.12 118.16 121.17 1lo3 n LYS 204 Ca -0.15 0.00 0.04 0.00 -0.00 0.00 0.00 58.31 58.20 1lo3 n LYS 204 Cb 0.52 -1.00 0.07 0.00 -0.00 0.00 0.00 35.03 34.63 1lo3 n LYS 204 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 1lo3 n THR 205 N -0.36 0.43 0.01 0.58 -2.24 -1.26 -4.84 114.28 106.59 1lo3 n THR 205 Ca 0.00 -0.71 0.00 0.00 -2.27 0.00 0.00 64.05 61.07 1lo3 n THR 205 Cb 0.00 0.89 0.00 0.00 -2.10 0.00 0.00 70.33 69.12 1lo3 n THR 205 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1lo3 n SER 206 N 0.40 -0.01 0.00 3.42 3.41 0.31 -5.00 113.62 116.16 1lo3 n SER 206 Ca 0.07 0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 1lo3 n SER 206 Cb 0.29 0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.25 1lo3 n SER 206 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1lo3 n THR 207 N -2.54 0.00 -3.40 6.66 -1.04 -1.13 -4.52 114.28 108.30 1lo3 n THR 207 Ca 0.00 0.00 -0.41 0.00 -2.04 0.00 0.00 64.05 61.60 1lo3 n THR 207 Cb 0.01 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 68.50 1lo3 n THR 207 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1lo3 n SER 208 N 0.41 5.16 0.00 8.00 2.88 -1.26 -4.99 113.62 123.81 1lo3 n SER 208 Ca 0.00 -3.13 0.00 0.00 -1.33 0.00 0.00 58.87 54.41 1lo3 n SER 208 Cb 0.00 -1.24 0.00 0.00 -0.75 0.00 0.00 64.21 62.22 1lo3 n SER 208 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1lo3 n PRO 209 N 2.33 0.00 -2.82 -1.46 -0.02 -1.26 -4.89 135.00 126.89 1lo3 n PRO 209 Ca 0.24 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.29 1lo3 n PRO 209 Cb 0.38 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 33.82 1lo3 n PRO 209 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1lo3 s ILE 210 N 0.00 4.74 -0.16 4.25 1.01 0.07 -4.77 121.20 126.34 1lo3 s ILE 210 Ca 0.00 1.58 -0.01 0.00 0.00 0.00 0.00 60.65 62.22 1lo3 s ILE 210 Cb 0.00 -4.21 -0.01 0.00 0.01 0.00 0.00 42.46 38.25 1lo3 s ILE 210 CO 0.00 -0.21 -0.11 -0.69 0.00 0.00 0.00 174.94 173.93 1lo3 s VAL 211 N 3.08 3.07 -0.09 2.92 1.01 -1.26 -0.57 120.40 128.57 1lo3 s VAL 211 Ca 0.38 -0.64 0.02 0.00 0.00 0.00 0.00 61.98 61.74 1lo3 s VAL 211 Cb -0.14 -2.32 0.01 0.00 0.00 0.00 0.00 36.38 33.93 1lo3 s VAL 211 CO 0.10 0.50 -0.15 -0.54 0.00 0.00 0.00 175.10 175.01 1lo3 s LYS 212 N 0.68 2.08 0.34 2.72 -0.14 -0.83 -4.99 119.74 119.60 1lo3 s LYS 212 Ca -0.06 -0.53 0.05 0.00 -1.36 0.00 0.00 55.97 54.08 1lo3 s LYS 212 Cb -0.15 -1.72 -0.02 0.00 -1.68 0.00 0.00 37.83 34.26 1lo3 s LYS 212 CO 0.02 0.00 0.33 -1.12 -0.76 0.00 0.00 175.35 173.83 1lo3 s SER 213 N 0.79 1.55 0.08 2.83 0.01 -1.26 -0.84 113.70 116.86 1lo3 s SER 213 Ca -0.11 -1.71 -0.26 0.00 1.31 0.00 0.00 55.95 55.17 1lo3 s SER 213 Cb -0.16 0.59 0.08 0.00 0.21 0.00 0.00 66.02 66.75 1lo3 s SER 213 CO 0.02 -1.14 0.83 0.72 0.41 0.00 0.00 173.24 174.08 1lo3 s PHE 214 N -3.30 -0.34 -0.16 2.43 -0.12 -0.77 -5.02 117.98 110.71 1lo3 s PHE 214 Ca 0.38 0.13 -0.01 0.00 -0.05 0.00 0.00 56.93 57.39 1lo3 s PHE 214 Cb 0.01 0.57 -0.01 0.00 -0.63 0.00 0.00 43.02 42.97 1lo3 s PHE 214 CO 0.27 -0.71 -0.11 -0.80 -0.05 0.00 0.00 175.22 173.81 1lo3 s ASN 215 N -2.66 4.01 0.14 1.98 0.01 0.18 -1.74 114.94 116.86 1lo3 s ASN 215 Ca 0.06 -0.38 -0.32 0.00 -0.71 0.00 0.00 52.86 51.52 1lo3 s ASN 215 Cb -0.01 -1.63 -0.09 0.00 0.41 0.00 0.00 41.25 39.92 1lo3 s ASN 215 CO -0.07 0.10 1.53 -0.09 -1.51 0.00 0.00 177.10 177.06 1lo3 h ARG 216 N 7.22 -0.24 -0.46 -0.60 2.43 -0.13 -2.33 114.38 120.27 1lo3 h ARG 216 Ca -0.32 0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 58.76 1lo3 h ARG 216 Cb 1.19 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.78 1lo3 h ARG 216 CO 0.58 -0.16 -0.13 -2.95 -1.51 0.00 0.00 179.97 175.80 1lo3 h ASN 217 N -0.24 0.91 -3.32 -3.80 -1.07 -1.88 -3.44 115.58 102.74 1lo3 h ASN 217 Ca 0.10 -0.37 -0.48 0.00 0.07 0.00 0.00 56.30 55.63 1lo3 h ASN 217 Cb 0.51 -0.25 -0.36 0.00 -2.07 0.00 0.00 38.32 36.16 1lo3 h ASN 217 CO -0.71 1.07 -0.79 -1.83 0.07 0.00 0.00 177.43 175.24 1lo3 s GLU 218 N -4.77 1.19 0.00 4.14 4.04 -0.88 -5.26 118.70 117.17 1lo3 s GLU 218 Ca -0.12 -0.17 0.00 0.00 0.04 0.00 0.00 54.97 54.72 1lo3 s GLU 218 Cb 0.11 -1.23 0.00 0.00 0.02 0.00 0.00 34.13 33.03 1lo3 s GLU 218 CO 0.84 -0.17 0.00 0.00 -1.84 0.00 0.00 175.26 174.10