#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xyp s ILE 3 N 0.00 1.19 0.64 12.58 -4.36 -0.81 -4.99 121.20 125.45 1xyp s ILE 3 Ca 0.00 -2.06 -0.07 0.00 -0.26 0.00 0.00 60.65 58.26 1xyp s ILE 3 Cb 0.00 -2.24 0.03 0.00 1.25 0.00 0.00 42.46 41.50 1xyp s ILE 3 CO 0.00 -0.43 0.95 -1.10 0.24 0.00 0.00 174.94 174.61 1xyp s GLN 4 N -3.81 2.68 0.30 0.37 -0.21 -1.26 -4.57 119.66 113.16 1xyp s GLN 4 Ca 0.26 -0.05 -0.27 0.00 0.02 0.00 0.00 55.36 55.31 1xyp s GLN 4 Cb 0.04 -2.22 -0.14 0.00 1.00 0.00 0.00 33.01 31.70 1xyp s GLN 4 CO 0.07 -0.90 0.96 -2.30 -2.12 0.00 0.00 175.29 171.00 1xyp n PRO 5 N -2.73 1.23 -3.66 2.91 -0.02 -1.26 -4.93 135.00 126.55 1xyp n PRO 5 Ca 0.06 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 1xyp n PRO 5 Cb 0.58 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 32.27 1xyp n PRO 5 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xyp n GLY 6 N 1.29 -2.08 3.24 -1.23 0.00 -0.19 -5.00 105.19 101.22 1xyp n GLY 6 Ca 0.10 -1.19 -0.13 0.00 0.00 0.00 0.00 46.02 44.80 1xyp n GLY 6 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1xyp s THR 7 N -2.24 0.66 -3.94 2.61 -4.23 -1.26 -1.14 115.64 106.10 1xyp s THR 7 Ca 0.00 -1.98 0.00 0.00 -1.18 0.00 0.00 61.69 58.53 1xyp s THR 7 Cb 0.00 -2.10 0.00 0.00 1.34 0.00 0.00 72.50 71.74 1xyp s THR 7 CO 0.00 -0.49 0.00 0.61 -0.54 0.00 0.00 174.62 174.20 1xyp n GLY 8 N -0.23 -0.77 3.25 3.99 0.00 -1.01 -5.00 105.19 105.43 1xyp n GLY 8 Ca -0.07 -1.05 -0.30 0.00 0.00 0.00 0.00 46.02 44.60 1xyp n GLY 8 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xyp s TYR 9 N -3.00 2.29 -0.09 1.61 2.02 -1.26 -0.96 117.35 117.96 1xyp s TYR 9 Ca 0.00 -0.64 -0.03 0.00 -0.37 0.00 0.00 57.07 56.04 1xyp s TYR 9 Cb 0.00 -1.50 0.04 0.00 -0.40 0.00 0.00 41.96 40.10 1xyp s TYR 9 CO 0.00 -0.18 0.05 1.21 -1.57 0.00 0.00 175.55 175.06 1xyp s ASN 10 N -0.20 1.69 -1.40 2.29 3.84 0.16 -4.88 114.94 116.43 1xyp s ASN 10 Ca -0.01 -0.20 -0.04 0.00 0.21 0.00 0.00 52.86 52.81 1xyp s ASN 10 Cb -0.13 -0.29 0.02 0.00 -0.55 0.00 0.00 41.25 40.31 1xyp s ASN 10 CO 0.03 -0.26 0.33 0.59 -2.79 0.00 0.00 177.10 175.00 1xyp n ASN 11 N 5.23 -4.94 0.00 -4.21 3.02 -1.26 -1.85 115.26 111.26 1xyp n ASN 11 Ca -0.06 -0.15 0.00 0.00 -0.03 0.00 0.00 54.58 54.34 1xyp n ASN 11 Cb 0.49 -4.07 0.00 0.00 -0.61 0.00 0.00 39.78 35.59 1xyp n ASN 11 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xyp n GLY 12 N -1.18 0.79 3.29 7.41 0.00 -1.26 -4.47 105.19 109.77 1xyp n GLY 12 Ca -0.12 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.64 1xyp n GLY 12 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xyp s TYR 13 N -2.13 1.91 0.44 1.61 1.51 -0.77 -5.04 117.35 114.88 1xyp s TYR 13 Ca 0.00 -0.39 -0.23 0.00 -1.01 0.00 0.00 57.07 55.44 1xyp s TYR 13 Cb 0.00 -1.10 -0.08 0.00 -0.11 0.00 0.00 41.96 40.67 1xyp s TYR 13 CO 0.00 0.16 1.09 0.12 -1.11 0.00 0.00 175.55 175.81 1xyp s PHE 14 N -0.95 3.07 0.05 2.71 5.36 -0.51 0.37 117.98 128.07 1xyp s PHE 14 Ca 0.08 1.59 0.00 0.00 -0.96 0.00 0.00 56.93 57.64 1xyp s PHE 14 Cb -0.09 -3.22 -0.03 0.00 -0.34 0.00 0.00 43.02 39.34 1xyp s PHE 14 CO 0.03 -1.01 -0.04 1.52 -1.46 0.00 0.00 175.22 174.26 1xyp s TYR 15 N -1.66 0.51 -0.13 10.12 -0.85 -0.13 -0.39 117.35 124.82 1xyp s TYR 15 Ca 0.62 -0.80 -0.06 0.00 -0.52 0.00 0.00 57.07 56.31 1xyp s TYR 15 Cb -0.24 -0.35 0.06 0.00 0.38 0.00 0.00 41.96 41.81 1xyp s TYR 15 CO 0.29 -0.25 0.29 0.45 -1.52 0.00 0.00 175.55 174.81 1xyp s SER 16 N -2.29 -0.12 -0.08 -0.18 0.15 -0.66 -2.39 113.70 108.12 1xyp s SER 16 Ca -0.02 0.64 0.00 0.00 0.70 0.00 0.00 55.95 57.27 1xyp s SER 16 Cb -0.01 0.62 0.02 0.00 -1.71 0.00 0.00 66.02 64.95 1xyp s SER 16 CO -0.05 -0.20 -0.07 -0.47 1.20 0.00 0.00 173.24 173.66 1xyp s TYR 17 N 1.72 1.17 0.02 3.44 5.04 -0.29 -1.86 117.35 126.59 1xyp s TYR 17 Ca -0.06 -0.47 0.01 0.00 -2.44 0.00 0.00 57.07 54.11 1xyp s TYR 17 Cb -0.11 -0.99 -0.01 0.00 0.35 0.00 0.00 41.96 41.20 1xyp s TYR 17 CO -0.10 -0.35 -0.05 -0.46 -1.34 0.00 0.00 175.55 173.26 1xyp s TRP 18 N 1.31 0.39 0.11 4.97 -0.00 0.07 -1.02 118.94 124.77 1xyp s TRP 18 Ca -0.04 -0.29 -0.07 0.00 -0.00 0.00 0.00 56.10 55.71 1xyp s TRP 18 Cb -0.14 -0.25 -0.01 0.00 -0.00 0.00 0.00 33.47 33.07 1xyp s TRP 18 CO -0.03 -0.07 0.17 0.54 -0.00 0.00 0.00 176.95 177.56 1xyp s ASN 19 N -0.81 0.17 0.00 5.86 2.20 -1.26 -1.04 114.94 120.06 1xyp s ASN 19 Ca -0.06 -0.82 0.11 0.00 -0.94 0.00 0.00 52.86 51.15 1xyp s ASN 19 Cb -0.06 0.34 0.48 0.00 -2.00 0.00 0.00 41.25 40.01 1xyp s ASN 19 CO -0.00 -0.75 1.34 -0.90 -2.94 0.00 0.00 177.10 173.84 1xyp n ASP 20 N -0.08 0.79 0.00 3.54 5.75 -0.40 -4.89 116.55 121.26 1xyp n ASP 20 Ca -0.12 -1.81 0.00 0.00 -0.01 0.00 0.00 54.79 52.85 1xyp n ASP 20 Cb 0.62 -0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.63 1xyp n ASP 20 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1xyp n GLY 21 N 0.83 1.79 0.36 6.12 0.00 -1.26 -4.95 105.19 108.08 1xyp n GLY 21 Ca 0.09 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.17 1xyp n GLY 21 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1xyp h HIS 22 N 0.00 1.14 0.00 1.61 6.17 -1.91 -3.49 115.15 118.67 1xyp h HIS 22 Ca 0.00 0.03 0.00 0.00 0.71 0.00 0.00 60.37 61.11 1xyp h HIS 22 Cb 0.00 -0.36 0.00 0.00 2.52 0.00 0.00 27.41 29.57 1xyp h HIS 22 CO 0.00 0.49 0.00 0.41 0.71 0.00 0.00 177.93 179.54 1xyp n GLY 23 N -1.35 2.22 0.16 5.26 0.00 -1.26 -4.86 105.19 105.36 1xyp n GLY 23 Ca 0.18 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 44.30 1xyp n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xyp n GLY 24 N 1.98 0.96 3.07 -0.02 0.00 -1.26 -3.75 105.19 106.16 1xyp n GLY 24 Ca 0.00 -0.02 -0.23 0.00 0.00 0.00 0.00 46.02 45.77 1xyp n GLY 24 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xyp s VAL 25 N -2.00 1.07 -0.15 1.61 1.01 -1.26 -0.37 120.40 120.32 1xyp s VAL 25 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 61.98 61.45 1xyp s VAL 25 Cb 0.00 -0.93 0.02 0.00 0.00 0.00 0.00 36.38 35.47 1xyp s VAL 25 CO 0.00 0.32 -0.13 -0.89 0.00 0.00 0.00 175.10 174.39 1xyp s THR 26 N 0.06 1.54 -0.14 3.92 2.01 0.54 -5.01 115.64 118.56 1xyp s THR 26 Ca -0.02 -0.63 -0.00 0.00 0.31 0.00 0.00 61.69 61.35 1xyp s THR 26 Cb -0.09 -1.46 -0.01 0.00 0.01 0.00 0.00 72.50 70.95 1xyp s THR 26 CO 0.01 0.43 -0.13 -0.47 -0.69 0.00 0.00 174.62 173.77 1xyp s TYR 27 N 1.50 2.81 -0.07 4.92 6.14 -1.26 -1.12 117.35 130.26 1xyp s TYR 27 Ca 0.05 -0.73 0.01 0.00 0.64 0.00 0.00 57.07 57.04 1xyp s TYR 27 Cb -0.13 -1.86 0.02 0.00 0.42 0.00 0.00 41.96 40.41 1xyp s TYR 27 CO -0.10 -0.27 -0.09 0.99 0.64 0.00 0.00 175.55 176.72 1xyp s THR 28 N 0.47 0.91 -0.09 4.34 2.01 -0.11 -1.92 115.64 121.25 1xyp s THR 28 Ca -0.10 -0.31 -0.27 0.00 0.31 0.00 0.00 61.69 61.32 1xyp s THR 28 Cb -0.16 -0.88 -0.02 0.00 0.01 0.00 0.00 72.50 71.45 1xyp s THR 28 CO 0.05 0.32 0.87 0.20 -0.69 0.00 0.00 174.62 175.36 1xyp s ASN 29 N 1.00 7.13 0.09 3.53 0.01 -1.26 -1.05 114.94 124.38 1xyp s ASN 29 Ca -0.09 1.37 0.01 0.00 -0.71 0.00 0.00 52.86 53.44 1xyp s ASN 29 Cb -0.15 -2.49 0.01 0.00 0.41 0.00 0.00 41.25 39.03 1xyp s ASN 29 CO -0.00 -0.30 0.07 0.61 -1.51 0.00 0.00 177.10 175.97 1xyp n GLY 30 N 3.15 2.91 3.76 0.66 0.00 0.30 -4.75 105.19 111.22 1xyp n GLY 30 Ca 0.04 -2.19 -0.39 0.00 0.00 0.00 0.00 46.02 43.49 1xyp n GLY 30 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1xyp s PRO 31 N -2.38 3.45 5.88 1.61 0.04 -1.26 -4.31 135.00 138.02 1xyp s PRO 31 Ca 0.06 2.28 0.00 0.00 0.04 0.00 0.00 61.00 63.37 1xyp s PRO 31 Cb -0.00 -2.46 0.00 0.00 0.04 0.00 0.00 34.50 32.08 1xyp s PRO 31 CO 0.04 -0.96 0.00 0.41 0.04 0.00 0.00 177.00 176.53 1xyp n GLY 32 N 0.65 3.23 1.67 0.56 0.00 -1.26 -1.35 105.19 108.68 1xyp n GLY 32 Ca 0.08 -0.13 -0.07 0.00 0.00 0.00 0.00 46.02 45.90 1xyp n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xyp n GLY 33 N 0.00 3.18 3.85 -0.02 0.00 -1.25 -4.67 105.19 106.27 1xyp n GLY 33 Ca 0.00 -0.69 -0.35 0.00 0.00 0.00 0.00 46.02 44.98 1xyp n GLY 33 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1xyp s GLN 34 N -2.22 3.90 0.02 1.61 0.74 -0.46 -1.27 119.66 121.98 1xyp s GLN 34 Ca 0.38 0.38 -0.06 0.00 0.05 0.00 0.00 55.36 56.11 1xyp s GLN 34 Cb 0.31 -2.99 -0.00 0.00 1.10 0.00 0.00 33.01 31.42 1xyp s GLN 34 CO 0.09 0.53 0.11 -0.59 -0.55 0.00 0.00 175.29 174.89 1xyp s PHE 35 N -1.39 0.12 -0.00 1.67 -0.71 -0.34 -0.54 117.98 116.78 1xyp s PHE 35 Ca 0.34 -0.31 0.03 0.00 -1.04 0.00 0.00 56.93 55.96 1xyp s PHE 35 Cb -0.15 -0.09 -0.01 0.00 -1.21 0.00 0.00 43.02 41.56 1xyp s PHE 35 CO 0.18 -0.32 -0.11 -1.12 -1.34 0.00 0.00 175.22 172.52 1xyp s SER 36 N -1.71 1.26 -0.03 1.98 0.01 -0.22 -1.30 113.70 113.68 1xyp s SER 36 Ca -0.11 -0.23 0.01 0.00 1.31 0.00 0.00 55.95 56.93 1xyp s SER 36 Cb -0.05 -0.13 0.02 0.00 0.21 0.00 0.00 66.02 66.07 1xyp s SER 36 CO -0.01 0.11 -0.03 -0.69 0.41 0.00 0.00 173.24 173.03 1xyp s VAL 37 N -0.34 0.39 -0.07 3.43 1.01 -0.33 -0.93 120.40 123.55 1xyp s VAL 37 Ca 0.03 -0.05 0.02 0.00 0.00 0.00 0.00 61.98 61.98 1xyp s VAL 37 Cb -0.05 -0.43 0.02 0.00 0.00 0.00 0.00 36.38 35.92 1xyp s VAL 37 CO -0.00 0.18 -0.11 0.21 0.00 0.00 0.00 175.10 175.38 1xyp s ASN 38 N 0.86 1.72 0.06 3.32 2.47 -0.28 -1.02 114.94 122.06 1xyp s ASN 38 Ca -0.10 -0.28 0.01 0.00 0.42 0.00 0.00 52.86 52.91 1xyp s ASN 38 Cb -0.13 -0.78 -0.03 0.00 -1.45 0.00 0.00 41.25 38.85 1xyp s ASN 38 CO -0.00 0.00 -0.05 -1.66 -3.72 0.00 0.00 177.10 171.66 1xyp s TRP 39 N 0.82 0.62 -0.25 0.43 -2.14 -0.38 -0.34 118.94 117.72 1xyp s TRP 39 Ca -0.12 -0.76 -0.04 0.00 2.66 0.00 0.00 56.10 57.85 1xyp s TRP 39 Cb -0.15 -0.39 0.13 0.00 -3.10 0.00 0.00 33.47 29.96 1xyp s TRP 39 CO 0.02 -0.19 0.45 0.45 -2.66 0.00 0.00 176.95 175.01 1xyp s SER 40 N -2.29 -0.27 -1.30 -2.66 0.15 0.51 -1.06 113.70 106.78 1xyp s SER 40 Ca -0.01 0.62 -0.02 0.00 0.70 0.00 0.00 55.95 57.24 1xyp s SER 40 Cb -0.01 1.44 -0.00 0.00 -1.71 0.00 0.00 66.02 65.74 1xyp s SER 40 CO -0.04 -0.27 0.68 0.59 1.20 0.00 0.00 173.24 175.40 1xyp n ASN 41 N 5.39 -1.54 -3.30 5.45 3.02 -0.70 -4.54 115.26 119.03 1xyp n ASN 41 Ca -0.05 -0.86 -0.20 0.00 -0.03 0.00 0.00 54.58 53.44 1xyp n ASN 41 Cb 0.50 -3.92 0.15 0.00 -0.61 0.00 0.00 39.78 35.90 1xyp n ASN 41 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1xyp n SER 42 N -3.03 -0.17 0.00 6.41 3.41 -0.59 -4.70 113.62 114.96 1xyp n SER 42 Ca -0.28 -1.28 0.00 0.00 -0.26 0.00 0.00 58.87 57.05 1xyp n SER 42 Cb 0.67 -0.70 0.00 0.00 -0.26 0.00 0.00 64.21 63.92 1xyp n SER 42 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xyp n GLY 43 N -1.22 2.48 3.68 5.00 0.00 -1.25 -3.78 105.19 110.11 1xyp n GLY 43 Ca 0.11 -1.25 -0.35 0.00 0.00 0.00 0.00 46.02 44.54 1xyp n GLY 43 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1xyp s ASN 44 N -0.34 5.91 0.09 1.61 3.04 -1.26 -1.27 114.94 122.73 1xyp s ASN 44 Ca 0.00 0.15 -0.10 0.00 0.04 0.00 0.00 52.86 52.95 1xyp s ASN 44 Cb 0.00 -2.03 0.00 0.00 -1.54 0.00 0.00 41.25 37.69 1xyp s ASN 44 CO 0.00 0.17 0.23 0.72 -3.04 0.00 0.00 177.10 175.18 1xyp s PHE 45 N 0.40 0.08 -0.09 0.43 -0.71 -0.85 -1.27 117.98 115.98 1xyp s PHE 45 Ca 0.06 -0.47 -0.04 0.00 -1.04 0.00 0.00 56.93 55.44 1xyp s PHE 45 Cb -0.12 -0.00 0.04 0.00 -1.21 0.00 0.00 43.02 41.73 1xyp s PHE 45 CO -0.01 -0.56 0.20 0.08 -1.34 0.00 0.00 175.22 173.59 1xyp s VAL 46 N -3.71 -0.05 -0.14 -2.49 1.01 -0.21 -1.50 120.40 113.32 1xyp s VAL 46 Ca 0.04 0.17 -0.16 0.00 0.00 0.00 0.00 61.98 62.03 1xyp s VAL 46 Cb 0.04 -0.31 0.04 0.00 0.00 0.00 0.00 36.38 36.15 1xyp s VAL 46 CO -0.10 0.07 0.43 -0.83 0.00 0.00 0.00 175.10 174.66 1xyp s GLY 47 N 1.23 -0.31 0.00 4.51 0.00 -0.71 -0.76 107.32 111.28 1xyp s GLY 47 Ca -0.09 1.11 0.00 0.00 0.00 0.00 0.00 44.72 45.74 1xyp s GLY 47 CO -0.07 0.93 0.00 0.61 0.00 0.00 0.00 173.10 174.56 1xyp n GLY 48 N 2.57 -0.89 3.33 0.20 0.00 -0.78 -0.96 105.19 108.65 1xyp n GLY 48 Ca -0.15 -1.02 -0.22 0.00 0.00 0.00 0.00 46.02 44.63 1xyp n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xyp s LYS 49 N -2.00 1.25 0.00 1.61 1.02 -1.12 -1.66 119.74 118.84 1xyp s LYS 49 Ca 0.00 -1.36 0.00 0.00 0.02 0.00 0.00 55.97 54.63 1xyp s LYS 49 Cb 0.00 -1.36 0.00 0.00 -0.52 0.00 0.00 37.83 35.95 1xyp s LYS 49 CO 0.00 0.28 0.00 0.41 -0.92 0.00 0.00 175.35 175.12 1xyp n GLY 50 N 0.46 -0.31 3.08 -3.33 0.00 0.48 -1.10 105.19 104.46 1xyp n GLY 50 Ca -0.14 0.41 -0.11 0.00 0.00 0.00 0.00 46.02 46.17 1xyp n GLY 50 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1xyp s TRP 51 N 0.00 0.64 -0.26 1.61 0.51 0.05 -1.42 118.94 120.07 1xyp s TRP 51 Ca 0.00 -0.69 -0.01 0.00 -2.12 0.00 0.00 56.10 53.28 1xyp s TRP 51 Cb 0.00 -0.39 0.13 0.00 -0.81 0.00 0.00 33.47 32.40 1xyp s TRP 51 CO 0.00 -0.16 0.32 -1.14 -0.51 0.00 0.00 176.95 175.46 1xyp s GLN 52 N -2.44 0.31 0.63 4.98 2.00 -1.26 -1.13 119.66 122.76 1xyp s GLN 52 Ca -0.03 0.15 -0.08 0.00 -2.00 0.00 0.00 55.36 53.40 1xyp s GLN 52 Cb -0.04 -0.68 0.01 0.00 0.80 0.00 0.00 33.01 33.11 1xyp s GLN 52 CO -0.02 -0.85 0.97 -1.25 -0.50 0.00 0.00 175.29 173.64 1xyp s PRO 53 N 2.43 2.86 0.38 1.67 0.04 -1.26 -5.03 135.00 136.10 1xyp s PRO 53 Ca 0.10 0.13 -0.01 0.00 0.04 0.00 0.00 61.00 61.26 1xyp s PRO 53 Cb -0.14 -2.19 0.08 0.00 0.04 0.00 0.00 34.50 32.29 1xyp s PRO 53 CO -0.24 -0.83 0.52 0.41 0.04 0.00 0.00 177.00 176.90 1xyp n GLY 54 N -2.74 0.51 3.27 0.56 0.00 0.01 -4.89 105.19 101.92 1xyp n GLY 54 Ca 0.05 -1.96 -0.15 0.00 0.00 0.00 0.00 46.02 43.96 1xyp n GLY 54 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1xyp s THR 55 N -1.55 0.53 -1.83 2.61 -4.23 -1.26 -4.77 115.64 105.14 1xyp s THR 55 Ca 0.34 -1.99 0.28 0.00 -1.18 0.00 0.00 61.69 59.14 1xyp s THR 55 Cb -0.02 -2.42 0.45 0.00 1.34 0.00 0.00 72.50 71.86 1xyp s THR 55 CO 0.23 -0.19 1.79 0.29 -0.54 0.00 0.00 174.62 176.20 1xyp n LYS 56 N -0.35 0.90 -0.89 3.99 5.02 -1.26 -4.00 118.16 121.56 1xyp n LYS 56 Ca -0.02 -0.40 0.04 0.00 -2.02 0.00 0.00 58.31 55.91 1xyp n LYS 56 Cb 0.65 -1.49 0.06 0.00 -0.02 0.00 0.00 35.03 34.23 1xyp n LYS 56 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1xyp n ASN 57 N -0.70 1.02 -4.76 4.39 6.94 -1.26 -3.58 115.26 117.31 1xyp n ASN 57 Ca 0.15 -2.48 -0.40 0.00 -0.02 0.00 0.00 54.58 51.83 1xyp n ASN 57 Cb 0.30 -0.33 -0.04 0.00 -2.36 0.00 0.00 39.78 37.34 1xyp n ASN 57 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 1xyp s LYS 58 N -0.94 4.62 -0.31 -3.83 2.20 -1.26 -4.75 119.74 115.48 1xyp s LYS 58 Ca 0.25 1.81 -0.09 0.00 -0.36 0.00 0.00 55.97 57.58 1xyp s LYS 58 Cb 0.27 -3.16 0.00 0.00 -1.51 0.00 0.00 37.83 33.42 1xyp s LYS 58 CO -0.08 0.19 0.13 0.08 -0.36 0.00 0.00 175.35 175.31 1xyp s VAL 59 N -1.18 4.38 -0.18 4.02 1.01 -1.26 -2.15 120.40 125.05 1xyp s VAL 59 Ca 0.45 -0.54 -0.07 0.00 0.00 0.00 0.00 61.98 61.82 1xyp s VAL 59 Cb -0.32 -3.26 -0.04 0.00 0.00 0.00 0.00 36.38 32.77 1xyp s VAL 59 CO 0.41 0.05 0.06 -0.63 0.00 0.00 0.00 175.10 174.99 1xyp s ILE 60 N 1.57 4.74 -0.02 2.22 1.01 0.43 -4.92 121.20 126.22 1xyp s ILE 60 Ca 0.04 -0.05 0.00 0.00 0.00 0.00 0.00 60.65 60.64 1xyp s ILE 60 Cb -0.17 -3.13 -0.04 0.00 0.01 0.00 0.00 42.46 39.14 1xyp s ILE 60 CO 0.05 0.47 0.02 0.20 0.00 0.00 0.00 174.94 175.68 1xyp s ASN 61 N 0.30 5.28 -0.07 3.58 0.01 -0.31 -0.01 114.94 123.72 1xyp s ASN 61 Ca 0.03 0.07 -0.13 0.00 -0.71 0.00 0.00 52.86 52.11 1xyp s ASN 61 Cb -0.12 -1.44 0.03 0.00 0.41 0.00 0.00 41.25 40.12 1xyp s ASN 61 CO 0.00 0.30 0.33 0.72 -1.51 0.00 0.00 177.10 176.94 1xyp s PHE 62 N -1.06 -0.28 0.10 2.20 -0.71 -0.44 -1.70 117.98 116.09 1xyp s PHE 62 Ca 0.19 0.60 -0.16 0.00 -1.04 0.00 0.00 56.93 56.52 1xyp s PHE 62 Cb -0.12 0.11 0.03 0.00 -1.21 0.00 0.00 43.02 41.84 1xyp s PHE 62 CO 0.09 -0.28 0.39 -1.54 -1.34 0.00 0.00 175.22 172.53 1xyp s SER 63 N -0.55 -0.22 0.00 1.98 1.04 -0.60 -0.93 113.70 114.42 1xyp s SER 63 Ca -0.07 -0.27 0.00 0.00 0.48 0.00 0.00 55.95 56.09 1xyp s SER 63 Cb -0.04 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.53 1xyp s SER 63 CO 0.02 -0.80 0.00 0.61 0.98 0.00 0.00 173.24 174.05 1xyp n GLY 64 N -0.04 0.52 3.51 7.32 0.00 -1.24 -0.26 105.19 114.99 1xyp n GLY 64 Ca -0.17 -1.71 -0.34 0.00 0.00 0.00 0.00 46.02 43.81 1xyp n GLY 64 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xyp s SER 65 N -4.00 4.63 -0.22 1.61 1.04 -0.15 -4.74 113.70 111.88 1xyp s SER 65 Ca 0.00 -0.12 -0.01 0.00 0.48 0.00 0.00 55.95 56.30 1xyp s SER 65 Cb 0.00 -1.53 0.07 0.00 0.10 0.00 0.00 66.02 64.65 1xyp s SER 65 CO 0.00 0.24 0.02 -0.47 0.98 0.00 0.00 173.24 174.01 1xyp s TYR 66 N -0.08 1.54 -0.62 5.02 5.04 -1.26 -0.60 117.35 126.38 1xyp s TYR 66 Ca 0.01 -1.26 0.05 0.00 -2.44 0.00 0.00 57.07 53.43 1xyp s TYR 66 Cb -0.13 -1.29 0.17 0.00 0.35 0.00 0.00 41.96 41.06 1xyp s TYR 66 CO 0.03 -0.70 0.46 0.09 -1.34 0.00 0.00 175.55 174.09 1xyp n ASN 67 N 4.91 2.05 -4.77 4.32 4.13 0.56 -5.02 115.26 121.44 1xyp n ASN 67 Ca -0.09 -2.98 -0.38 0.00 1.68 0.00 0.00 54.58 52.81 1xyp n ASN 67 Cb 0.45 -0.70 -0.05 0.00 -1.54 0.00 0.00 39.78 37.94 1xyp n ASN 67 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1xyp s PRO 68 N -1.08 4.54 -0.67 3.52 0.04 -1.26 -1.71 135.00 138.38 1xyp s PRO 68 Ca 0.28 1.49 0.06 0.00 0.04 0.00 0.00 61.00 62.86 1xyp s PRO 68 Cb -0.01 -2.89 0.21 0.00 0.04 0.00 0.00 34.50 31.85 1xyp s PRO 68 CO -0.17 0.21 0.64 -1.71 0.04 0.00 0.00 177.00 176.00 1xyp n ASN 69 N 0.68 3.42 0.00 6.66 5.15 0.76 -4.94 115.26 126.98 1xyp n ASN 69 Ca 0.01 -3.34 0.00 0.00 -0.60 0.00 0.00 54.58 50.66 1xyp n ASN 69 Cb 0.48 -0.71 0.00 0.00 -0.53 0.00 0.00 39.78 39.02 1xyp n ASN 69 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1xyp n GLY 70 N 1.34 0.30 3.62 8.20 0.00 -1.26 -2.58 105.19 114.81 1xyp n GLY 70 Ca 0.25 -2.07 -0.43 0.00 0.00 0.00 0.00 46.02 43.77 1xyp n GLY 70 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1xyp s ASN 71 N -4.00 6.31 -0.01 1.61 3.04 -1.26 -2.27 114.94 118.36 1xyp s ASN 71 Ca 0.00 1.37 -0.28 0.00 0.04 0.00 0.00 52.86 53.99 1xyp s ASN 71 Cb 0.00 -2.53 0.10 0.00 -1.54 0.00 0.00 41.25 37.27 1xyp s ASN 71 CO 0.00 -1.35 0.82 -0.55 -3.04 0.00 0.00 177.10 172.97 1xyp s SER 72 N 4.37 -0.45 0.06 -4.21 0.15 -1.26 -1.51 113.70 110.84 1xyp s SER 72 Ca 0.69 0.19 0.03 0.00 0.70 0.00 0.00 55.95 57.56 1xyp s SER 72 Cb -0.21 0.44 -0.03 0.00 -1.71 0.00 0.00 66.02 64.50 1xyp s SER 72 CO 0.30 -0.64 -0.09 -0.31 1.20 0.00 0.00 173.24 173.70 1xyp s TYR 73 N -2.57 0.83 -0.20 3.44 2.02 -0.29 -0.55 117.35 120.03 1xyp s TYR 73 Ca 0.00 -0.59 0.01 0.00 -0.37 0.00 0.00 57.07 56.12 1xyp s TYR 73 Cb -0.01 -0.48 0.04 0.00 -0.40 0.00 0.00 41.96 41.11 1xyp s TYR 73 CO -0.05 -0.07 -0.11 -1.17 -1.57 0.00 0.00 175.55 172.58 1xyp s LEU 74 N -1.99 2.33 0.21 -1.29 2.96 0.01 -1.26 118.68 119.65 1xyp s LEU 74 Ca -0.03 -0.90 -0.09 0.00 -0.22 0.00 0.00 54.13 52.89 1xyp s LEU 74 Cb -0.06 -1.27 -0.01 0.00 0.50 0.00 0.00 46.19 45.35 1xyp s LEU 74 CO -0.00 -0.14 0.34 -0.44 -1.32 0.00 0.00 176.35 174.79 1xyp s SER 75 N 1.37 -0.00 -0.20 3.68 0.01 -0.45 -0.89 113.70 117.22 1xyp s SER 75 Ca -0.01 -0.99 -0.18 0.00 1.31 0.00 0.00 55.95 56.08 1xyp s SER 75 Cb -0.16 0.49 -0.03 0.00 0.21 0.00 0.00 66.02 66.53 1xyp s SER 75 CO -0.08 -1.00 0.48 -0.69 0.41 0.00 0.00 173.24 172.36 1xyp s VAL 76 N -4.03 5.14 0.01 3.43 1.01 -0.13 0.03 120.40 125.86 1xyp s VAL 76 Ca 0.24 0.87 0.03 0.00 0.00 0.00 0.00 61.98 63.12 1xyp s VAL 76 Cb 0.02 -3.80 -0.01 0.00 0.00 0.00 0.00 36.38 32.59 1xyp s VAL 76 CO 0.06 0.21 -0.09 -0.47 0.00 0.00 0.00 175.10 174.81 1xyp s TYR 77 N 1.49 0.81 0.03 5.22 5.04 0.12 -0.42 117.35 129.64 1xyp s TYR 77 Ca 0.23 -0.22 -0.10 0.00 -2.44 0.00 0.00 57.07 54.54 1xyp s TYR 77 Cb -0.15 -0.51 0.03 0.00 0.35 0.00 0.00 41.96 41.68 1xyp s TYR 77 CO 0.09 -0.01 0.45 0.41 -1.34 0.00 0.00 175.55 175.15 1xyp n GLY 78 N 2.55 0.75 3.14 8.97 0.00 -0.95 -1.09 105.19 118.56 1xyp n GLY 78 Ca -0.15 -0.96 -0.10 0.00 0.00 0.00 0.00 46.02 44.81 1xyp n GLY 78 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1xyp s TRP 79 N -3.58 0.78 0.09 1.61 0.52 -1.11 -1.00 118.94 116.26 1xyp s TRP 79 Ca 0.10 -0.90 0.04 0.00 0.02 0.00 0.00 56.10 55.36 1xyp s TRP 79 Cb -0.01 -0.47 -0.03 0.00 -1.15 0.00 0.00 33.47 31.81 1xyp s TRP 79 CO 0.01 -0.19 -0.11 0.45 0.02 0.00 0.00 176.95 177.13 1xyp s SER 80 N -2.85 1.48 0.09 2.95 0.15 -0.04 -1.19 113.70 114.29 1xyp s SER 80 Ca 0.08 -0.76 0.09 0.00 0.70 0.00 0.00 55.95 56.06 1xyp s SER 80 Cb 0.04 -0.01 -0.03 0.00 -1.71 0.00 0.00 66.02 64.31 1xyp s SER 80 CO -0.05 -0.22 -0.23 -0.13 1.20 0.00 0.00 173.24 173.80 1xyp s ARG 81 N -2.51 1.37 -0.84 5.44 0.52 0.11 -1.64 118.95 121.39 1xyp s ARG 81 Ca 0.03 -1.16 -0.03 0.00 -0.52 0.00 0.00 55.73 54.05 1xyp s ARG 81 Cb -0.05 -1.65 -0.00 0.00 0.52 0.00 0.00 34.95 33.77 1xyp s ARG 81 CO 0.01 0.40 0.66 0.09 0.02 0.00 0.00 175.30 176.48 1xyp n ASN 82 N 1.32 -5.94 -4.83 0.23 3.02 -1.26 -0.56 115.26 107.23 1xyp n ASN 82 Ca -0.18 -0.67 -0.32 0.00 -0.03 0.00 0.00 54.58 53.38 1xyp n ASN 82 Cb 0.53 -3.18 -0.02 0.00 -0.61 0.00 0.00 39.78 36.50 1xyp n ASN 82 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1xyp s PRO 83 N -4.45 3.78 -0.34 3.52 0.04 -1.26 -3.83 135.00 132.47 1xyp s PRO 83 Ca 0.07 1.00 -0.29 0.00 0.04 0.00 0.00 61.00 61.82 1xyp s PRO 83 Cb -0.03 -2.11 0.01 0.00 0.04 0.00 0.00 34.50 32.42 1xyp s PRO 83 CO 0.84 -0.42 1.17 -1.17 0.04 0.00 0.00 177.00 177.46 1xyp s LEU 84 N -4.24 3.87 -0.00 -3.56 2.96 -1.26 -4.53 118.68 111.91 1xyp s LEU 84 Ca 0.60 1.02 0.00 0.00 -0.22 0.00 0.00 54.13 55.53 1xyp s LEU 84 Cb -0.11 -3.54 -0.00 0.00 0.50 0.00 0.00 46.19 43.03 1xyp s LEU 84 CO 0.34 -1.01 -0.02 -0.63 -1.32 0.00 0.00 176.35 173.71 1xyp s ILE 85 N 4.04 0.13 -0.18 6.68 -1.09 -0.65 -3.94 121.20 126.18 1xyp s ILE 85 Ca 0.50 -0.08 -0.03 0.00 -2.23 0.00 0.00 60.65 58.80 1xyp s ILE 85 Cb -0.13 -0.12 -0.02 0.00 -1.58 0.00 0.00 42.46 40.61 1xyp s ILE 85 CO 0.21 0.03 -0.04 -0.70 -1.23 0.00 0.00 174.94 173.20 1xyp s GLU 86 N -0.06 3.52 0.16 2.79 2.12 -1.04 -0.86 118.70 125.34 1xyp s GLU 86 Ca 0.00 -0.58 0.07 0.00 0.36 0.00 0.00 54.97 54.82 1xyp s GLU 86 Cb -0.01 -2.94 -0.04 0.00 0.26 0.00 0.00 34.13 31.40 1xyp s GLU 86 CO -0.00 0.04 -0.14 1.52 -0.54 0.00 0.00 175.26 176.14 1xyp s TYR 87 N 0.88 1.54 -0.02 5.30 -0.85 -0.17 -1.37 117.35 122.66 1xyp s TYR 87 Ca -0.01 -0.58 0.01 0.00 -0.52 0.00 0.00 57.07 55.96 1xyp s TYR 87 Cb -0.15 -0.76 0.02 0.00 0.38 0.00 0.00 41.96 41.45 1xyp s TYR 87 CO 0.01 0.23 -0.01 0.71 -1.52 0.00 0.00 175.55 174.98 1xyp s TYR 88 N -2.60 0.27 -0.47 -3.49 1.51 -0.21 -2.24 117.35 110.13 1xyp s TYR 88 Ca 0.16 -0.01 0.04 0.00 -1.01 0.00 0.00 57.07 56.24 1xyp s TYR 88 Cb -0.02 -0.31 0.12 0.00 -0.11 0.00 0.00 41.96 41.64 1xyp s TYR 88 CO 0.04 -0.08 0.21 0.42 -1.11 0.00 0.00 175.55 175.03 1xyp s ILE 89 N 0.64 2.40 -0.30 2.71 1.01 0.43 -0.94 121.20 127.16 1xyp s ILE 89 Ca -0.06 -3.04 -0.29 0.00 0.00 0.00 0.00 60.65 57.26 1xyp s ILE 89 Cb -0.09 -2.69 0.01 0.00 0.01 0.00 0.00 42.46 39.70 1xyp s ILE 89 CO -0.01 -0.76 1.11 -0.69 0.00 0.00 0.00 174.94 174.59 1xyp s VAL 90 N 0.03 4.47 -0.11 2.92 1.01 0.45 -0.96 120.40 128.20 1xyp s VAL 90 Ca 0.16 1.70 0.17 0.00 0.00 0.00 0.00 61.98 64.00 1xyp s VAL 90 Cb -0.24 -4.35 -0.18 0.00 0.00 0.00 0.00 36.38 31.61 1xyp s VAL 90 CO -0.02 -0.43 0.68 -0.62 0.00 0.00 0.00 175.10 174.71 1xyp n GLU 91 N 6.86 0.63 -3.51 2.72 -0.58 -0.07 -1.17 120.64 125.53 1xyp n GLU 91 Ca 0.12 0.18 -0.14 0.00 -0.42 0.00 0.00 57.16 56.91 1xyp n GLU 91 Cb 0.47 -1.75 -0.04 0.00 -0.57 0.00 0.00 31.44 29.54 1xyp n GLU 91 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 1xyp s ASN 92 N -5.71 -0.53 0.17 1.62 3.04 -1.05 -2.11 114.94 110.38 1xyp s ASN 92 Ca -0.04 0.38 -0.15 0.00 0.04 0.00 0.00 52.86 53.09 1xyp s ASN 92 Cb 0.09 0.48 0.02 0.00 -1.54 0.00 0.00 41.25 40.29 1xyp s ASN 92 CO 0.82 -0.63 0.43 0.72 -3.04 0.00 0.00 177.10 175.40 1xyp s PHE 93 N -2.04 -0.01 0.00 0.43 -0.12 -1.26 -0.81 117.98 114.17 1xyp s PHE 93 Ca -0.04 -0.34 0.00 0.00 -0.05 0.00 0.00 56.93 56.51 1xyp s PHE 93 Cb -0.00 0.25 0.00 0.00 -0.63 0.00 0.00 43.02 42.63 1xyp s PHE 93 CO 0.00 -0.81 0.00 0.41 -0.05 0.00 0.00 175.22 174.77 1xyp n GLY 94 N -0.28 1.27 0.01 1.99 0.00 0.29 -4.91 105.19 103.57 1xyp n GLY 94 Ca -0.11 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.03 1xyp n GLY 94 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xyp n THR 95 N 0.00 0.07 -4.59 2.61 -2.24 -0.96 -4.85 114.28 104.31 1xyp n THR 95 Ca 0.00 -0.06 -0.28 0.00 -2.27 0.00 0.00 64.05 61.44 1xyp n THR 95 Cb 0.00 0.13 -0.17 0.00 -2.10 0.00 0.00 70.33 68.19 1xyp n THR 95 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1xyp s TYR 96 N -3.04 1.93 -0.27 4.78 5.04 -1.26 -4.97 117.35 119.56 1xyp s TYR 96 Ca 0.10 -0.85 -0.29 0.00 -2.44 0.00 0.00 57.07 53.59 1xyp s TYR 96 Cb 0.17 -1.38 0.01 0.00 0.35 0.00 0.00 41.96 41.11 1xyp s TYR 96 CO 0.69 -0.42 1.13 1.21 -1.34 0.00 0.00 175.55 176.83 1xyp s ASN 97 N 0.83 6.93 0.64 4.32 3.84 -1.26 -4.82 114.94 125.41 1xyp s ASN 97 Ca -0.10 1.25 0.39 0.00 0.21 0.00 0.00 52.86 54.61 1xyp s ASN 97 Cb -0.16 -2.54 2.19 0.00 -0.55 0.00 0.00 41.25 40.19 1xyp s ASN 97 CO 0.01 -0.85 2.31 1.55 -2.79 0.00 0.00 177.10 177.33 1xyp h PRO 98 N 8.16 0.00 -0.01 0.43 0.13 -1.98 -2.26 132.00 136.47 1xyp h PRO 98 Ca -0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.91 1xyp h PRO 98 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1xyp h PRO 98 CO 1.01 0.00 -0.02 -1.13 -0.23 0.00 0.00 178.00 177.63 1xyp n SER 99 N -3.33 0.64 -4.68 1.44 3.41 -1.26 -4.87 113.62 104.97 1xyp n SER 99 Ca -0.03 -1.10 -0.47 0.00 -0.26 0.00 0.00 58.87 57.00 1xyp n SER 99 Cb 0.10 -0.01 -0.05 0.00 -0.26 0.00 0.00 64.21 63.99 1xyp n SER 99 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1xyp n THR 100 N -0.56 0.43 -0.01 6.66 -1.04 -0.85 -0.68 114.28 118.23 1xyp n THR 100 Ca 0.20 -0.08 0.00 0.00 -2.04 0.00 0.00 64.05 62.14 1xyp n THR 100 Cb 0.23 -1.80 0.00 0.00 -1.82 0.00 0.00 70.33 66.95 1xyp n THR 100 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1xyp n GLY 101 N 4.14 1.17 3.92 3.41 0.00 -1.26 -5.05 105.19 111.52 1xyp n GLY 101 Ca 0.21 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.97 1xyp n GLY 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xyp s ALA 102 N -2.41 3.39 -0.25 4.61 0.00 0.14 -5.04 121.76 122.21 1xyp s ALA 102 Ca 0.00 -0.69 -0.16 0.00 0.00 0.00 0.00 51.96 51.11 1xyp s ALA 102 Cb 0.00 -2.53 -0.03 0.00 0.00 0.00 0.00 23.12 20.55 1xyp s ALA 102 CO 0.00 -0.61 0.44 0.99 0.00 0.00 0.00 175.76 176.59 1xyp s THR 103 N -2.86 5.13 -0.14 0.00 2.01 -0.91 -4.89 115.64 113.99 1xyp s THR 103 Ca 0.51 0.75 -0.29 0.00 0.31 0.00 0.00 61.69 62.96 1xyp s THR 103 Cb -0.10 -3.77 -0.02 0.00 0.01 0.00 0.00 72.50 68.62 1xyp s THR 103 CO 0.44 0.15 1.34 -0.75 -0.69 0.00 0.00 174.62 175.11 1xyp s LYS 104 N 2.00 4.23 -0.14 4.92 2.20 -1.26 -1.86 119.74 129.82 1xyp s LYS 104 Ca 0.19 1.77 -0.03 0.00 -0.36 0.00 0.00 55.97 57.54 1xyp s LYS 104 Cb -0.15 -3.79 -0.24 0.00 -1.51 0.00 0.00 37.83 32.13 1xyp s LYS 104 CO 0.09 -0.72 0.29 1.28 -0.36 0.00 0.00 175.35 175.93 1xyp n LEU 105 N 6.62 2.45 0.00 5.43 4.32 0.99 -4.97 117.00 131.85 1xyp n LEU 105 Ca 0.14 0.17 0.00 0.00 -0.02 0.00 0.00 56.01 56.30 1xyp n LEU 105 Cb 0.44 -0.91 0.00 0.00 -1.62 0.00 0.00 43.42 41.33 1xyp n LEU 105 CO 0.57 0.81 0.00 0.61 -1.22 0.00 0.00 177.39 178.16 1xyp n GLY 106 N 1.99 -0.65 3.07 -0.72 0.00 -1.20 -5.01 105.19 102.66 1xyp n GLY 106 Ca -0.33 -0.51 -0.08 0.00 0.00 0.00 0.00 46.02 45.10 1xyp n GLY 106 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xyp s GLU 107 N -0.29 0.54 -0.14 1.61 2.02 -1.26 -0.62 118.70 120.56 1xyp s GLU 107 Ca 0.00 -1.06 -0.13 0.00 0.02 0.00 0.00 54.97 53.80 1xyp s GLU 107 Cb 0.00 0.19 0.04 0.00 0.10 0.00 0.00 34.13 34.45 1xyp s GLU 107 CO 0.00 -0.10 0.37 0.54 0.02 0.00 0.00 175.26 176.09 1xyp s VAL 108 N -3.31 0.00 -0.21 2.63 0.11 -0.27 -4.95 120.40 114.40 1xyp s VAL 108 Ca 0.01 -0.01 -0.10 0.00 -2.93 0.00 0.00 61.98 58.96 1xyp s VAL 108 Cb 0.03 -0.52 -0.05 0.00 -1.53 0.00 0.00 36.38 34.32 1xyp s VAL 108 CO -0.08 -0.00 0.14 -0.89 -3.33 0.00 0.00 175.10 170.94 1xyp s THR 109 N 0.17 5.37 -0.25 5.04 2.01 -1.26 0.54 115.64 127.26 1xyp s THR 109 Ca -0.00 0.18 -0.19 0.00 0.31 0.00 0.00 61.69 61.99 1xyp s THR 109 Cb -0.03 -3.47 0.07 0.00 0.01 0.00 0.00 72.50 69.09 1xyp s THR 109 CO 0.01 0.41 0.64 -0.55 -0.69 0.00 0.00 174.62 174.44 1xyp s SER 110 N 0.57 -0.76 -1.40 3.53 0.15 -0.19 -4.98 113.70 110.63 1xyp s SER 110 Ca 0.08 1.34 -0.02 0.00 0.70 0.00 0.00 55.95 58.06 1xyp s SER 110 Cb -0.12 1.30 0.01 0.00 -1.71 0.00 0.00 66.02 65.50 1xyp s SER 110 CO 0.00 -0.23 0.55 0.47 1.20 0.00 0.00 173.24 175.23 1xyp n ASP 111 N 3.43 -0.92 0.00 5.45 8.00 -1.26 -2.56 116.55 128.68 1xyp n ASP 111 Ca -0.17 -0.94 0.00 0.00 0.71 0.00 0.00 54.79 54.39 1xyp n ASP 111 Cb 0.57 -3.39 0.00 0.00 -0.02 0.00 0.00 41.12 38.28 1xyp n ASP 111 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xyp n GLY 112 N -1.82 0.56 3.43 0.44 0.00 -1.26 -4.96 105.19 101.58 1xyp n GLY 112 Ca -0.27 -0.13 -0.15 0.00 0.00 0.00 0.00 46.02 45.47 1xyp n GLY 112 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1xyp s SER 113 N -2.12 -0.52 0.24 1.61 0.15 -1.06 -4.99 113.70 107.02 1xyp s SER 113 Ca 0.00 0.32 -0.20 0.00 0.70 0.00 0.00 55.95 56.77 1xyp s SER 113 Cb 0.00 0.52 -0.09 0.00 -1.71 0.00 0.00 66.02 64.74 1xyp s SER 113 CO 0.00 -0.71 0.75 -0.69 1.20 0.00 0.00 173.24 173.79 1xyp s VAL 114 N -2.21 4.53 -0.04 4.45 1.01 -1.26 -1.03 120.40 125.85 1xyp s VAL 114 Ca -0.06 1.33 0.06 0.00 0.00 0.00 0.00 61.98 63.30 1xyp s VAL 114 Cb -0.01 -3.86 -0.01 0.00 0.00 0.00 0.00 36.38 32.51 1xyp s VAL 114 CO 0.00 0.17 -0.22 -0.31 0.00 0.00 0.00 175.10 174.74 1xyp s TYR 115 N -1.57 2.13 -0.07 5.22 1.51 0.19 -2.05 117.35 122.71 1xyp s TYR 115 Ca 0.45 -0.57 -0.16 0.00 -1.01 0.00 0.00 57.07 55.78 1xyp s TYR 115 Cb -0.16 -1.40 -0.05 0.00 -0.11 0.00 0.00 41.96 40.24 1xyp s TYR 115 CO 0.21 -0.16 0.41 -0.51 -1.11 0.00 0.00 175.55 174.40 1xyp s ASP 116 N -0.20 6.71 -0.15 2.29 1.01 -0.60 -1.11 116.67 124.61 1xyp s ASP 116 Ca -0.01 0.84 -0.07 0.00 0.71 0.00 0.00 52.55 54.03 1xyp s ASP 116 Cb -0.12 -2.25 -0.04 0.00 1.01 0.00 0.00 42.92 41.52 1xyp s ASP 116 CO 0.02 0.17 0.08 -0.63 0.21 0.00 0.00 175.17 175.03 1xyp s ILE 117 N -0.23 5.01 0.22 0.77 1.01 0.21 -0.76 121.20 127.42 1xyp s ILE 117 Ca 0.23 0.03 0.00 0.00 0.00 0.00 0.00 60.65 60.92 1xyp s ILE 117 Cb -0.16 -3.22 -0.04 0.00 0.01 0.00 0.00 42.46 39.05 1xyp s ILE 117 CO 0.11 0.52 0.10 -0.31 0.00 0.00 0.00 174.94 175.36 1xyp s TYR 118 N -0.18 1.29 -0.06 3.97 1.51 -0.32 -0.00 117.35 123.56 1xyp s TYR 118 Ca 0.08 -1.26 -0.15 0.00 -1.01 0.00 0.00 57.07 54.74 1xyp s TYR 118 Cb -0.12 -0.70 0.03 0.00 -0.11 0.00 0.00 41.96 41.06 1xyp s TYR 118 CO 0.01 -0.47 0.35 0.50 -1.11 0.00 0.00 175.55 174.83 1xyp s ARG 119 N -4.08 0.61 0.00 -0.62 3.52 -0.78 -1.36 118.95 116.25 1xyp s ARG 119 Ca 0.36 0.07 -0.14 0.00 -0.13 0.00 0.00 55.73 55.89 1xyp s ARG 119 Cb 0.07 0.28 0.02 0.00 -1.56 0.00 0.00 34.95 33.76 1xyp s ARG 119 CO 0.11 -0.15 0.30 -0.08 -0.81 0.00 0.00 175.30 174.67 1xyp s THR 120 N -0.81 0.07 -0.14 4.11 -1.32 -0.75 -2.14 115.64 114.66 1xyp s THR 120 Ca -0.09 -0.55 -0.06 0.00 -1.21 0.00 0.00 61.69 59.78 1xyp s THR 120 Cb -0.04 -0.70 -0.04 0.00 -1.51 0.00 0.00 72.50 70.21 1xyp s THR 120 CO 0.03 -0.30 0.08 -1.58 -2.21 0.00 0.00 174.62 170.64 1xyp s GLN 121 N -1.68 3.54 -0.26 7.08 0.74 -1.26 -0.17 119.66 127.65 1xyp s GLN 121 Ca -0.11 -0.27 -0.05 0.00 0.05 0.00 0.00 55.36 54.97 1xyp s GLN 121 Cb -0.04 -3.11 -0.00 0.00 1.10 0.00 0.00 33.01 30.96 1xyp s GLN 121 CO 0.02 0.57 0.03 1.03 -0.55 0.00 0.00 175.29 176.39 1xyp s ARG 122 N -0.47 3.26 -0.22 1.67 1.81 0.58 -4.97 118.95 120.61 1xyp s ARG 122 Ca 0.10 -0.72 -0.10 0.00 -1.72 0.00 0.00 55.73 53.30 1xyp s ARG 122 Cb -0.12 -3.21 -0.05 0.00 -0.45 0.00 0.00 34.95 31.12 1xyp s ARG 122 CO 0.02 -0.31 0.13 0.08 -0.68 0.00 0.00 175.30 174.53 1xyp s VAL 123 N 1.50 5.18 -1.31 3.52 1.01 -1.26 -1.32 120.40 127.71 1xyp s VAL 123 Ca 0.04 0.11 -0.09 0.00 0.00 0.00 0.00 61.98 62.05 1xyp s VAL 123 Cb -0.16 -3.39 0.00 0.00 0.00 0.00 0.00 36.38 32.83 1xyp s VAL 123 CO 0.00 0.38 0.54 0.59 0.00 0.00 0.00 175.10 176.62 1xyp n ASN 124 N 4.06 -2.05 -4.67 3.32 3.02 -0.85 -4.95 115.26 113.13 1xyp n ASN 124 Ca -0.16 -1.03 -0.23 0.00 -0.03 0.00 0.00 54.58 53.13 1xyp n ASN 124 Cb 0.52 -3.04 -0.07 0.00 -0.61 0.00 0.00 39.78 36.58 1xyp n ASN 124 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1xyp s GLN 125 N -6.45 2.32 0.45 3.52 -1.52 -0.04 -4.74 119.66 113.20 1xyp s GLN 125 Ca 0.18 -1.46 -0.24 0.00 -1.95 0.00 0.00 55.36 51.88 1xyp s GLN 125 Cb -0.07 -2.16 -0.08 0.00 -0.22 0.00 0.00 33.01 30.48 1xyp s GLN 125 CO 0.89 0.28 1.28 -2.14 -0.25 0.00 0.00 175.29 175.35 1xyp s PRO 126 N -3.73 3.75 0.34 2.91 0.02 -1.26 -1.08 135.00 135.95 1xyp s PRO 126 Ca 0.33 2.08 -0.09 0.00 0.02 0.00 0.00 61.00 63.34 1xyp s PRO 126 Cb -0.05 -2.57 0.02 0.00 0.02 0.00 0.00 34.50 31.92 1xyp s PRO 126 CO 0.21 -0.65 0.59 -1.54 -0.33 0.00 0.00 177.00 175.28 1xyp s SER 127 N -0.93 0.44 0.29 2.53 1.04 -0.84 -4.87 113.70 111.35 1xyp s SER 127 Ca 0.61 -1.27 0.22 0.00 0.48 0.00 0.00 55.95 56.00 1xyp s SER 127 Cb -0.36 0.72 1.07 0.00 0.10 0.00 0.00 66.02 67.55 1xyp s SER 127 CO 0.45 -1.41 1.68 2.30 0.98 0.00 0.00 173.24 177.23 1xyp n ILE 128 N -0.53 0.95 0.08 -1.02 -5.35 -1.26 -1.75 119.36 110.49 1xyp n ILE 128 Ca -0.03 0.49 0.03 0.00 -0.27 0.00 0.00 62.75 62.97 1xyp n ILE 128 Cb 0.61 -1.46 0.05 0.00 -1.74 0.00 0.00 39.64 37.11 1xyp n ILE 128 CO 0.00 0.00 0.00 2.30 -1.76 0.00 0.00 176.55 177.09 1xyp n ILE 129 N -2.24 0.50 0.00 7.28 -5.35 -1.26 -5.11 119.36 113.17 1xyp n ILE 129 Ca 0.00 -0.75 0.00 0.00 -0.27 0.00 0.00 62.75 61.73 1xyp n ILE 129 Cb 0.13 0.81 0.00 0.00 -1.74 0.00 0.00 39.64 38.84 1xyp n ILE 129 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1xyp n GLY 130 N 0.20 -0.45 3.66 3.28 0.00 -0.72 -4.96 105.19 106.21 1xyp n GLY 130 Ca 0.05 -2.20 -0.42 0.00 0.00 0.00 0.00 46.02 43.44 1xyp n GLY 130 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xyp s THR 131 N 0.00 3.30 0.31 2.61 2.01 -1.26 -1.99 115.64 120.62 1xyp s THR 131 Ca 0.00 0.42 -0.14 0.00 0.31 0.00 0.00 61.69 62.28 1xyp s THR 131 Cb 0.00 -3.27 0.02 0.00 0.01 0.00 0.00 72.50 69.26 1xyp s THR 131 CO 0.00 -0.03 0.64 0.00 -0.69 0.00 0.00 174.62 174.53 1xyp s ALA 132 N 4.00 -0.51 -0.15 7.40 0.00 -0.24 -4.89 121.76 127.37 1xyp s ALA 132 Ca 0.79 -0.78 0.01 0.00 0.00 0.00 0.00 51.96 51.98 1xyp s ALA 132 Cb -0.38 0.91 0.00 0.00 0.00 0.00 0.00 23.12 23.65 1xyp s ALA 132 CO 0.34 -0.94 -0.17 0.99 0.00 0.00 0.00 175.76 175.98 1xyp s THR 133 N -3.35 2.50 0.23 0.00 2.01 -1.26 -0.86 115.64 114.91 1xyp s THR 133 Ca 0.18 -0.83 -0.16 0.00 0.31 0.00 0.00 61.69 61.19 1xyp s THR 133 Cb -0.03 -2.04 0.01 0.00 0.01 0.00 0.00 72.50 70.45 1xyp s THR 133 CO 0.11 0.53 0.54 0.72 -0.69 0.00 0.00 174.62 175.82 1xyp s PHE 134 N 0.77 0.06 0.28 4.92 -0.71 -0.44 -4.98 117.98 117.89 1xyp s PHE 134 Ca -0.07 -0.43 -0.04 0.00 -1.04 0.00 0.00 56.93 55.35 1xyp s PHE 134 Cb -0.16 0.36 -0.05 0.00 -1.21 0.00 0.00 43.02 41.97 1xyp s PHE 134 CO 0.00 -1.00 0.53 0.71 -1.34 0.00 0.00 175.22 174.12 1xyp s TYR 135 N -3.94 3.48 -0.17 3.49 2.02 -1.25 -0.31 117.35 120.67 1xyp s TYR 135 Ca 0.15 0.58 0.01 0.00 -0.37 0.00 0.00 57.07 57.44 1xyp s TYR 135 Cb -0.02 -2.06 0.02 0.00 -0.40 0.00 0.00 41.96 39.51 1xyp s TYR 135 CO 0.03 0.20 -0.19 -1.14 -1.57 0.00 0.00 175.55 172.88 1xyp s GLN 136 N -3.56 2.87 -0.09 -0.62 0.74 0.76 -2.48 119.66 117.28 1xyp s GLN 136 Ca 0.43 -0.79 -0.05 0.00 0.05 0.00 0.00 55.36 55.01 1xyp s GLN 136 Cb -0.11 -2.47 -0.04 0.00 1.10 0.00 0.00 33.01 31.50 1xyp s GLN 136 CO 0.30 -0.18 0.10 0.71 -0.55 0.00 0.00 175.29 175.67 1xyp s TYR 137 N 1.24 3.45 -0.03 1.67 1.51 -0.47 -1.81 117.35 122.91 1xyp s TYR 137 Ca 0.03 0.40 0.02 0.00 -1.01 0.00 0.00 57.07 56.51 1xyp s TYR 137 Cb -0.13 -1.87 0.01 0.00 -0.11 0.00 0.00 41.96 39.85 1xyp s TYR 137 CO -0.11 0.64 -0.09 -1.58 -1.11 0.00 0.00 175.55 173.31 1xyp s TRP 138 N -1.03 0.97 -0.21 2.71 0.52 -0.46 -1.04 118.94 120.40 1xyp s TRP 138 Ca 0.16 -0.26 0.01 0.00 0.02 0.00 0.00 56.10 56.04 1xyp s TRP 138 Cb -0.12 -0.71 0.04 0.00 -1.15 0.00 0.00 33.47 31.53 1xyp s TRP 138 CO 0.06 -0.13 -0.13 -1.12 0.02 0.00 0.00 176.95 175.65 1xyp s SER 139 N 0.34 3.58 -0.25 2.95 0.01 -0.12 -1.18 113.70 119.03 1xyp s SER 139 Ca -0.06 -0.95 -0.04 0.00 1.31 0.00 0.00 55.95 56.21 1xyp s SER 139 Cb -0.10 -1.37 0.01 0.00 0.21 0.00 0.00 66.02 64.76 1xyp s SER 139 CO 0.01 -0.12 -0.00 -0.69 0.41 0.00 0.00 173.24 172.85 1xyp s VAL 140 N 1.30 3.47 0.20 3.43 1.01 0.06 -0.41 120.40 129.45 1xyp s VAL 140 Ca -0.01 -0.70 -0.31 0.00 0.00 0.00 0.00 61.98 60.96 1xyp s VAL 140 Cb -0.16 -2.71 -0.09 0.00 0.00 0.00 0.00 36.38 33.42 1xyp s VAL 140 CO -0.09 0.24 1.44 -0.60 0.00 0.00 0.00 175.10 176.09 1xyp s ARG 141 N 1.45 4.28 0.08 2.72 3.52 -0.31 -1.56 118.95 129.13 1xyp s ARG 141 Ca 0.03 2.24 -0.14 0.00 -0.13 0.00 0.00 55.73 57.73 1xyp s ARG 141 Cb -0.16 -3.16 -0.21 0.00 -1.56 0.00 0.00 34.95 29.86 1xyp s ARG 141 CO -0.01 -0.44 1.21 0.00 -0.81 0.00 0.00 175.30 175.25 1xyp h ARG 142 N 5.84 0.71 -4.09 5.12 3.08 -1.75 -3.41 114.38 119.87 1xyp h ARG 142 Ca -0.44 -0.70 -0.76 0.00 0.07 0.00 0.00 59.98 58.14 1xyp h ARG 142 Cb 1.21 0.19 -0.24 0.00 0.08 0.00 0.00 29.97 31.21 1xyp h ARG 142 CO 0.83 1.29 -0.18 -0.80 -1.07 0.00 0.00 179.97 180.04 1xyp s ASN 143 N -7.19 6.24 0.44 7.04 0.01 -1.26 -5.06 114.94 115.16 1xyp s ASN 143 Ca -0.10 -1.85 -0.26 0.00 -0.71 0.00 0.00 52.86 49.94 1xyp s ASN 143 Cb 0.07 -2.21 -0.08 0.00 0.41 0.00 0.00 41.25 39.43 1xyp s ASN 143 CO 0.91 -0.85 1.43 -1.00 -1.51 0.00 0.00 177.10 176.08 1xyp s HIS 144 N 1.52 2.48 0.13 2.20 3.76 -1.26 -4.99 115.29 119.13 1xyp s HIS 144 Ca 0.05 1.26 -0.17 0.00 -0.15 0.00 0.00 55.06 56.04 1xyp s HIS 144 Cb -0.28 -3.92 0.04 0.00 1.11 0.00 0.00 32.58 29.53 1xyp s HIS 144 CO 0.02 -2.92 0.44 -0.98 -0.85 0.00 0.00 174.74 170.45 1xyp s ARG 145 N -2.41 1.10 0.00 1.40 1.70 -0.89 -5.02 118.95 114.82 1xyp s ARG 145 Ca 0.60 -0.65 0.06 0.00 -0.47 0.00 0.00 55.73 55.27 1xyp s ARG 145 Cb -0.44 0.49 0.04 0.00 -0.57 0.00 0.00 34.95 34.48 1xyp s ARG 145 CO 0.57 -0.44 0.68 0.43 -1.08 0.00 0.00 175.30 175.45 1xyp n SER 146 N -0.23 1.46 -3.74 -2.89 7.64 -1.26 -4.22 113.62 110.38 1xyp n SER 146 Ca -0.16 -1.23 -0.13 0.00 1.01 0.00 0.00 58.87 58.35 1xyp n SER 146 Cb 0.64 0.04 -0.09 0.00 -1.01 0.00 0.00 64.21 63.78 1xyp n SER 146 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1xyp s SER 147 N -0.55 -0.30 0.00 6.43 1.04 -1.26 -3.70 113.70 115.36 1xyp s SER 147 Ca 0.07 0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.89 1xyp s SER 147 Cb 0.05 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.68 1xyp s SER 147 CO 0.08 -0.33 0.00 0.61 0.98 0.00 0.00 173.24 174.58 1xyp n GLY 148 N 1.90 -0.58 3.07 7.32 0.00 -0.11 -4.99 105.19 111.80 1xyp n GLY 148 Ca -0.18 -1.24 -0.24 0.00 0.00 0.00 0.00 46.02 44.36 1xyp n GLY 148 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1xyp s SER 149 N -4.00 1.74 -0.23 1.61 0.15 -1.26 -1.33 113.70 110.39 1xyp s SER 149 Ca 0.00 -0.28 -0.02 0.00 0.70 0.00 0.00 55.95 56.35 1xyp s SER 149 Cb 0.00 -0.51 0.01 0.00 -1.71 0.00 0.00 66.02 63.81 1xyp s SER 149 CO 0.00 0.10 -0.07 -0.69 1.20 0.00 0.00 173.24 173.78 1xyp s VAL 150 N 0.17 2.98 -0.83 4.45 1.01 0.99 -4.80 120.40 124.37 1xyp s VAL 150 Ca -0.05 -0.77 -0.19 0.00 0.00 0.00 0.00 61.98 60.97 1xyp s VAL 150 Cb -0.11 -2.41 0.13 0.00 0.00 0.00 0.00 36.38 33.99 1xyp s VAL 150 CO 0.02 0.35 1.00 0.21 0.00 0.00 0.00 175.10 176.68 1xyp s ASN 151 N 1.39 6.52 0.55 3.32 3.84 -1.26 -0.43 114.94 128.87 1xyp s ASN 151 Ca 0.03 -1.89 0.26 0.00 0.21 0.00 0.00 52.86 51.48 1xyp s ASN 151 Cb -0.15 -2.37 1.45 0.00 -0.55 0.00 0.00 41.25 39.64 1xyp s ASN 151 CO -0.05 -1.07 2.01 0.71 -2.79 0.00 0.00 177.10 175.91 1xyp h THR 152 N 5.74 0.64 -0.96 -5.21 1.35 -1.76 -2.08 112.91 110.63 1xyp h THR 152 Ca 0.02 0.00 0.03 0.00 -0.55 0.00 0.00 66.41 65.92 1xyp h THR 152 Cb 1.04 0.75 -0.05 0.00 -1.73 0.00 0.00 68.15 68.15 1xyp h THR 152 CO 1.07 0.00 0.63 0.00 -0.25 0.00 0.00 175.52 176.97 1xyp h ALA 153 N 1.71 1.37 -0.73 6.62 0.00 -1.76 -0.89 119.26 125.57 1xyp h ALA 153 Ca 0.21 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1xyp h ALA 153 Cb 0.91 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 1xyp h ALA 153 CO -0.00 0.55 0.47 -0.91 0.00 0.00 0.00 179.25 179.36 1xyp h ASN 154 N 1.23 0.85 0.04 0.00 2.35 -1.71 0.65 115.58 118.98 1xyp h ASN 154 Ca 0.38 -0.03 -0.20 0.00 -0.55 0.00 0.00 56.30 55.89 1xyp h ASN 154 Cb -0.02 -0.21 0.02 0.00 0.05 0.00 0.00 38.32 38.15 1xyp h ASN 154 CO -0.11 0.63 -0.81 0.45 -1.65 0.00 0.00 177.43 175.94 1xyp h HIS 155 N 1.00 0.75 -0.49 1.19 3.86 -1.49 -1.99 115.15 117.97 1xyp h HIS 155 Ca 0.27 -0.43 -0.08 0.00 -1.16 0.00 0.00 60.37 58.96 1xyp h HIS 155 Cb -0.09 -0.08 -0.02 0.00 1.06 0.00 0.00 27.41 28.28 1xyp h HIS 155 CO 0.00 1.27 -0.03 0.74 0.86 0.00 0.00 177.93 180.77 1xyp h PHE 156 N 0.02 0.91 -0.48 2.45 0.04 -0.95 0.13 116.94 119.06 1xyp h PHE 156 Ca -0.11 -0.15 -0.11 0.00 2.80 0.00 0.00 57.97 60.40 1xyp h PHE 156 Cb 1.52 -0.24 -0.01 0.00 2.20 0.00 0.00 35.95 39.42 1xyp h PHE 156 CO 0.14 0.85 -0.13 -0.91 -0.60 0.00 0.00 178.31 177.66 1xyp h ASN 157 N 0.78 0.95 -0.56 2.17 -0.26 -0.92 -0.45 115.58 117.29 1xyp h ASN 157 Ca 0.14 -0.37 -0.06 0.00 -0.56 0.00 0.00 56.30 55.45 1xyp h ASN 157 Cb 0.52 -0.26 -0.02 0.00 -1.06 0.00 0.00 38.32 37.49 1xyp h ASN 157 CO 0.03 1.10 0.12 0.00 -1.06 0.00 0.00 177.43 177.62 1xyp h ALA 158 N 0.88 0.74 -0.28 -0.83 0.00 -1.06 -1.78 119.26 116.93 1xyp h ALA 158 Ca 0.12 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 1xyp h ALA 158 Cb 0.69 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1xyp h ALA 158 CO 0.05 0.47 -0.12 -1.49 0.00 0.00 0.00 179.25 178.16 1xyp h TRP 159 N 0.81 0.50 -0.51 0.00 6.55 -0.75 -2.66 115.95 119.90 1xyp h TRP 159 Ca 0.17 -0.07 -0.10 0.00 0.95 0.00 0.00 58.89 59.84 1xyp h TRP 159 Cb 0.38 -0.14 -0.02 0.00 -0.86 0.00 0.00 29.16 28.52 1xyp h TRP 159 CO 0.03 0.58 -0.07 0.00 -1.05 0.00 0.00 178.44 177.93 1xyp h ALA 160 N 1.44 0.90 0.00 1.49 0.00 -0.62 0.14 119.26 122.61 1xyp h ALA 160 Ca 0.08 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 1xyp h ALA 160 Cb 0.48 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 1xyp h ALA 160 CO 0.03 0.64 -0.07 1.96 0.00 0.00 0.00 179.25 181.80 1xyp h GLN 161 N 0.84 0.00 -0.60 0.00 4.20 -1.00 -1.19 115.11 117.36 1xyp h GLN 161 Ca 0.14 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.85 1xyp h GLN 161 Cb 0.59 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.37 1xyp h GLN 161 CO 0.04 0.07 0.00 1.04 -0.67 0.00 0.00 178.83 179.31 1xyp n GLN 162 N -3.32 2.66 0.00 1.46 1.13 -0.79 -4.93 117.38 113.59 1xyp n GLN 162 Ca -0.01 -2.16 0.00 0.00 -1.94 0.00 0.00 57.00 52.89 1xyp n GLN 162 Cb 0.26 -1.57 0.00 0.00 0.11 0.00 0.00 30.24 29.04 1xyp n GLN 162 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1xyp n GLY 163 N 1.26 2.04 3.76 1.08 0.00 -0.45 -5.06 105.19 107.82 1xyp n GLY 163 Ca 0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 1xyp n GLY 163 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1xyp s LEU 164 N 0.00 4.54 -0.41 0.99 2.96 -0.03 -4.94 118.68 121.78 1xyp s LEU 164 Ca 0.00 2.05 0.03 0.00 -0.22 0.00 0.00 54.13 55.99 1xyp s LEU 164 Cb 0.00 -3.71 0.16 0.00 0.50 0.00 0.00 46.19 43.14 1xyp s LEU 164 CO 0.00 -0.02 0.30 0.42 -1.32 0.00 0.00 176.35 175.73 1xyp s THR 165 N -1.26 0.55 0.58 3.68 -4.23 -1.26 -3.26 115.64 110.44 1xyp s THR 165 Ca 0.45 -2.43 -0.19 0.00 -1.18 0.00 0.00 61.69 58.34 1xyp s THR 165 Cb -0.27 -1.40 -0.06 0.00 1.34 0.00 0.00 72.50 72.11 1xyp s THR 165 CO 0.34 -1.10 0.82 0.18 -0.54 0.00 0.00 174.62 174.31 1xyp n LEU 166 N 3.26 2.66 0.00 4.79 4.77 -1.26 -4.32 117.00 126.90 1xyp n LEU 166 Ca 0.21 0.79 0.00 0.00 -0.03 0.00 0.00 56.01 56.98 1xyp n LEU 166 Cb 0.42 -1.31 0.00 0.00 -2.33 0.00 0.00 43.42 40.20 1xyp n LEU 166 CO 0.13 -2.24 0.00 0.61 -1.33 0.00 0.00 177.39 174.56 1xyp n GLY 167 N 1.45 0.71 3.66 -0.72 0.00 -1.25 -4.84 105.19 104.20 1xyp n GLY 167 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 1xyp n GLY 167 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xyp s THR 168 N 1.01 5.20 -0.02 2.61 2.01 0.27 -4.89 115.64 121.84 1xyp s THR 168 Ca 0.00 0.66 -0.30 0.00 0.31 0.00 0.00 61.69 62.36 1xyp s THR 168 Cb 0.00 -3.71 -0.03 0.00 0.01 0.00 0.00 72.50 68.77 1xyp s THR 168 CO 0.00 0.24 0.99 -0.04 -0.69 0.00 0.00 174.62 175.12 1xyp s MET 169 N 1.40 4.53 0.00 4.92 1.00 -1.26 0.06 119.30 129.95 1xyp s MET 169 Ca 0.18 1.43 0.00 0.00 0.00 0.00 0.00 55.69 57.29 1xyp s MET 169 Cb -0.15 -3.47 0.00 0.00 0.00 0.00 0.00 34.83 31.21 1xyp s MET 169 CO 0.08 -0.10 0.00 -3.47 0.00 0.00 0.00 175.02 171.53 1xyp n ASP 170 N 4.08 0.00 -4.76 3.03 2.03 -0.34 -4.33 116.55 116.27 1xyp n ASP 170 Ca 0.07 0.00 -0.32 0.00 0.52 0.00 0.00 54.79 55.06 1xyp n ASP 170 Cb 0.51 0.00 0.08 0.00 -0.72 0.00 0.00 41.12 40.98 1xyp n ASP 170 CO 0.00 0.00 0.00 -0.72 -1.92 0.00 0.00 177.20 174.56 1xyp s TYR 171 N 4.44 2.51 -0.21 -0.67 -0.85 -1.26 -0.81 117.35 120.50 1xyp s TYR 171 Ca 0.00 1.57 -0.04 0.00 -0.52 0.00 0.00 57.07 58.08 1xyp s TYR 171 Cb 0.00 -3.14 0.11 0.00 0.38 0.00 0.00 41.96 39.31 1xyp s TYR 171 CO 0.00 -1.86 0.28 -1.14 -1.52 0.00 0.00 175.55 171.31 1xyp s GLN 172 N -4.51 0.24 0.22 -3.49 0.74 -0.28 -2.77 119.66 109.82 1xyp s GLN 172 Ca 0.64 0.34 0.02 0.00 0.05 0.00 0.00 55.36 56.42 1xyp s GLN 172 Cb -0.19 -0.91 -0.05 0.00 1.10 0.00 0.00 33.01 32.95 1xyp s GLN 172 CO 0.50 -0.63 0.03 0.96 -0.55 0.00 0.00 175.29 175.59 1xyp s ILE 173 N 2.40 0.79 -0.28 -2.34 -4.36 -0.25 -0.77 121.20 116.39 1xyp s ILE 173 Ca 0.09 -2.01 -0.11 0.00 -0.26 0.00 0.00 60.65 58.36 1xyp s ILE 173 Cb -0.15 -2.38 -0.05 0.00 1.25 0.00 0.00 42.46 41.13 1xyp s ILE 173 CO -0.13 -0.27 0.20 -0.69 0.24 0.00 0.00 174.94 174.29 1xyp s VAL 174 N -3.58 5.30 0.10 8.37 1.01 -0.26 -0.70 120.40 130.64 1xyp s VAL 174 Ca 0.30 0.17 0.09 0.00 0.00 0.00 0.00 61.98 62.54 1xyp s VAL 174 Cb 0.07 -3.55 -0.03 0.00 0.00 0.00 0.00 36.38 32.86 1xyp s VAL 174 CO 0.09 0.23 -0.22 0.00 0.00 0.00 0.00 175.10 175.20 1xyp s ALA 175 N 1.77 1.90 -0.20 5.51 0.00 0.10 -2.80 121.76 128.05 1xyp s ALA 175 Ca 0.07 -1.26 -0.05 0.00 0.00 0.00 0.00 51.96 50.73 1xyp s ALA 175 Cb -0.16 -0.28 -0.02 0.00 0.00 0.00 0.00 23.12 22.65 1xyp s ALA 175 CO 0.11 0.40 -0.01 0.08 0.00 0.00 0.00 175.76 176.33 1xyp s VAL 176 N -1.09 3.83 -0.02 0.00 1.01 -0.13 -1.35 120.40 122.65 1xyp s VAL 176 Ca 0.08 -0.36 0.07 0.00 0.00 0.00 0.00 61.98 61.77 1xyp s VAL 176 Cb -0.10 -2.72 -0.02 0.00 0.00 0.00 0.00 36.38 33.53 1xyp s VAL 176 CO 0.04 0.44 -0.22 -0.70 0.00 0.00 0.00 175.10 174.66 1xyp s GLU 177 N 0.98 2.19 0.07 2.72 2.12 -0.39 -1.75 118.70 124.65 1xyp s GLU 177 Ca 0.01 -0.88 0.07 0.00 0.36 0.00 0.00 54.97 54.53 1xyp s GLU 177 Cb -0.14 -2.14 -0.03 0.00 0.26 0.00 0.00 34.13 32.08 1xyp s GLU 177 CO 0.01 0.57 -0.19 0.20 -0.54 0.00 0.00 175.26 175.32 1xyp s GLY 178 N -0.76 1.08 -0.34 -1.50 0.00 -0.56 -1.13 107.32 104.11 1xyp s GLY 178 Ca 0.11 -1.08 -0.01 0.00 0.00 0.00 0.00 44.72 43.74 1xyp s GLY 178 CO 0.00 -1.05 0.16 -0.47 0.00 0.00 0.00 173.10 171.74 1xyp s TYR 179 N -0.98 1.07 -1.19 1.90 5.04 -0.57 -2.01 117.35 120.61 1xyp s TYR 179 Ca 0.05 -1.57 -0.23 0.00 -2.44 0.00 0.00 57.07 52.88 1xyp s TYR 179 Cb -0.09 -1.28 0.01 0.00 0.35 0.00 0.00 41.96 40.95 1xyp s TYR 179 CO 0.03 -0.83 0.72 1.19 -1.34 0.00 0.00 175.55 175.31 1xyp n PHE 180 N 4.51 -1.73 -2.70 4.97 3.01 -0.39 -4.47 117.46 120.66 1xyp n PHE 180 Ca 0.03 0.37 0.00 0.00 1.01 0.00 0.00 57.45 58.85 1xyp n PHE 180 Cb 0.39 -3.27 0.00 0.00 -0.01 0.00 0.00 39.48 36.59 1xyp n PHE 180 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1xyp n SER 181 N -2.55 0.00 -4.19 4.37 3.41 -1.26 -4.79 113.62 108.60 1xyp n SER 181 Ca -0.12 -0.04 -0.12 0.00 -0.26 0.00 0.00 58.87 58.34 1xyp n SER 181 Cb 0.59 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.44 1xyp n SER 181 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1xyp s SER 182 N 1.25 0.29 0.00 4.04 0.01 -1.07 -1.55 113.70 116.68 1xyp s SER 182 Ca 0.00 -1.32 0.00 0.00 1.31 0.00 0.00 55.95 55.94 1xyp s SER 182 Cb 0.00 0.33 0.00 0.00 0.21 0.00 0.00 66.02 66.56 1xyp s SER 182 CO 0.00 -0.79 0.00 0.61 0.41 0.00 0.00 173.24 173.47 1xyp n GLY 183 N -0.22 -1.62 3.17 3.44 0.00 -0.22 -0.17 105.19 109.56 1xyp n GLY 183 Ca -0.01 -1.47 -0.11 0.00 0.00 0.00 0.00 46.02 44.43 1xyp n GLY 183 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xyp s SER 184 N -1.09 -0.02 -0.17 1.61 1.04 -0.69 -1.24 113.70 113.13 1xyp s SER 184 Ca 0.00 -0.20 -0.23 0.00 0.48 0.00 0.00 55.95 56.00 1xyp s SER 184 Cb 0.00 0.26 0.06 0.00 0.10 0.00 0.00 66.02 66.44 1xyp s SER 184 CO 0.00 -0.46 0.60 0.00 0.98 0.00 0.00 173.24 174.36 1xyp s ALA 185 N -1.84 -1.51 -0.22 5.32 0.00 -0.19 -0.32 121.76 123.00 1xyp s ALA 185 Ca -0.11 1.51 -0.04 0.00 0.00 0.00 0.00 51.96 53.32 1xyp s ALA 185 Cb -0.04 -0.67 0.08 0.00 0.00 0.00 0.00 23.12 22.49 1xyp s ALA 185 CO 0.00 -0.31 0.14 0.45 0.00 0.00 0.00 175.76 176.04 1xyp s SER 186 N -0.19 2.52 -0.01 0.00 0.15 0.23 -1.19 113.70 115.21 1xyp s SER 186 Ca -0.04 -0.77 0.07 0.00 0.70 0.00 0.00 55.95 55.91 1xyp s SER 186 Cb -0.03 -0.13 -0.02 0.00 -1.71 0.00 0.00 66.02 64.13 1xyp s SER 186 CO 0.03 -0.38 -0.24 -0.63 1.20 0.00 0.00 173.24 173.23 1xyp s ILE 187 N 2.17 1.89 -0.16 6.45 -1.09 -0.42 -0.97 121.20 129.07 1xyp s ILE 187 Ca 0.05 -1.04 0.02 0.00 -2.23 0.00 0.00 60.65 57.45 1xyp s ILE 187 Cb -0.16 -1.57 0.01 0.00 -1.58 0.00 0.00 42.46 39.17 1xyp s ILE 187 CO -0.20 0.51 -0.21 -0.89 -1.23 0.00 0.00 174.94 172.92 1xyp s THR 188 N -0.58 2.08 -0.00 2.92 2.01 0.64 -1.20 115.64 121.50 1xyp s THR 188 Ca 0.09 -0.96 -0.02 0.00 0.31 0.00 0.00 61.69 61.12 1xyp s THR 188 Cb -0.09 -1.85 -0.04 0.00 0.01 0.00 0.00 72.50 70.53 1xyp s THR 188 CO -0.01 0.54 0.14 -0.69 -0.69 0.00 0.00 174.62 173.92 1xyp s VAL 189 N 1.01 5.15 0.00 3.82 1.01 -0.40 -1.56 120.40 129.43 1xyp s VAL 189 Ca -0.02 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 61.68 1xyp s VAL 189 Cb -0.14 -3.39 0.00 0.00 0.00 0.00 0.00 36.38 32.84 1xyp s VAL 189 CO -0.06 0.32 0.00 -1.54 0.00 0.00 0.00 175.10 173.81