#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ull s ASN 15 N 0.00 6.08 -0.48 0.00 -0.87 -1.26 -0.34 114.94 118.07 2ull s ASN 15 Ca 0.00 -0.56 -0.29 0.00 -1.57 0.00 0.00 52.86 50.44 2ull s ASN 15 Cb 0.00 -2.15 0.03 0.00 -0.02 0.00 0.00 41.25 39.11 2ull s ASN 15 CO 0.00 -0.30 1.14 -0.63 -2.57 0.00 0.00 177.10 174.74 2ull s ILE 16 N 1.72 4.19 -0.03 0.60 -1.09 0.15 -4.95 121.20 121.79 2ull s ILE 16 Ca 0.06 1.21 0.04 0.00 -2.23 0.00 0.00 60.65 59.72 2ull s ILE 16 Cb -0.18 -4.61 -0.00 0.00 -1.58 0.00 0.00 42.46 36.09 2ull s ILE 16 CO 0.10 -1.03 -0.13 -0.69 -1.23 0.00 0.00 174.94 171.97 2ull s VAL 17 N 4.49 1.07 0.22 2.92 1.01 -1.26 -2.84 120.40 126.01 2ull s VAL 17 Ca 0.48 -0.54 -0.31 0.00 0.00 0.00 0.00 61.98 61.61 2ull s VAL 17 Cb -0.07 -0.92 -0.11 0.00 0.00 0.00 0.00 36.38 35.27 2ull s VAL 17 CO 0.32 0.32 1.65 -0.83 0.00 0.00 0.00 175.10 176.56 2ull s GLY 18 N -0.01 1.53 0.00 4.51 0.00 0.31 -2.83 107.32 110.84 2ull s GLY 18 Ca -0.01 1.54 0.00 0.00 0.00 0.00 0.00 44.72 46.25 2ull s GLY 18 CO 0.01 2.73 0.00 0.61 0.00 0.00 0.00 173.10 176.45 2ull n GLY 19 N 3.45 2.55 3.82 0.20 0.00 0.76 -0.33 105.19 115.64 2ull n GLY 19 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 2ull n GLY 19 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2ull s ILE 31 N -2.64 3.91 0.28 -0.61 -4.36 -1.13 -2.89 121.20 113.77 2ull s ILE 31 Ca 0.00 0.62 -0.24 0.00 -0.26 0.00 0.00 60.65 60.77 2ull s ILE 31 Cb 0.00 -3.36 -0.09 0.00 1.25 0.00 0.00 42.46 40.25 2ull s ILE 31 CO 0.00 -0.81 0.87 -0.70 0.24 0.00 0.00 174.94 174.54 2ull s GLU 32 N -5.06 4.51 -0.01 0.37 2.12 -1.26 -0.88 118.70 118.49 2ull s GLU 32 Ca 0.58 1.20 -0.11 0.00 0.36 0.00 0.00 54.97 57.01 2ull s GLU 32 Cb -0.14 -2.87 0.01 0.00 0.26 0.00 0.00 34.13 31.39 2ull s GLU 32 CO 0.55 0.34 0.22 1.52 -0.54 0.00 0.00 175.26 177.35 2ull s TYR 33 N -1.54 -0.07 0.20 5.30 1.13 -0.82 -4.77 117.35 116.78 2ull s TYR 33 Ca 0.47 0.08 0.06 0.00 -1.41 0.00 0.00 57.07 56.27 2ull s TYR 33 Cb -0.19 0.02 -0.04 0.00 -1.10 0.00 0.00 41.96 40.66 2ull s TYR 33 CO 0.24 -0.33 0.17 -1.54 -2.51 0.00 0.00 175.55 171.58 2ull s SER 34 N -1.29 5.58 -0.20 -0.18 1.04 -0.16 -1.65 113.70 116.84 2ull s SER 34 Ca -0.14 -0.16 0.01 0.00 0.48 0.00 0.00 55.95 56.14 2ull s SER 34 Cb -0.06 -1.46 0.02 0.00 0.10 0.00 0.00 66.02 64.62 2ull s SER 34 CO 0.03 0.02 -0.16 -0.63 0.98 0.00 0.00 173.24 173.48 2ull s ILE 35 N -1.90 2.29 -1.58 -1.02 1.09 0.14 -1.56 121.20 118.64 2ull s ILE 35 Ca 0.32 -0.99 -0.11 0.00 -1.10 0.00 0.00 60.65 58.76 2ull s ILE 35 Cb -0.09 -2.04 0.09 0.00 -1.06 0.00 0.00 42.46 39.36 2ull s ILE 35 CO 0.24 0.42 0.65 0.59 -0.10 0.00 0.00 174.94 176.75 2ull n ASN 36 N 4.62 -2.27 -2.49 3.58 3.02 -0.36 -1.05 115.26 120.30 2ull n ASN 36 Ca -0.19 -1.00 -0.17 0.00 -0.03 0.00 0.00 54.58 53.19 2ull n ASN 36 Cb 0.49 -2.92 -0.01 0.00 -0.61 0.00 0.00 39.78 36.73 2ull n ASN 36 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2ull n ASN 38 N -2.79 -4.95 0.00 6.41 3.02 -1.26 -4.82 115.26 110.86 2ull n ASN 38 Ca -0.07 0.05 0.00 0.00 -0.03 0.00 0.00 54.58 54.53 2ull n ASN 38 Cb 0.57 -4.14 0.00 0.00 -0.61 0.00 0.00 39.78 35.59 2ull n ASN 38 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ull n ALA 39 N -2.26 1.09 -1.67 5.41 0.00 -0.22 -5.11 120.51 117.76 2ull n ALA 39 Ca -0.19 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 52.90 2ull n ALA 39 Cb 0.64 0.00 0.04 0.00 0.00 0.00 0.00 19.45 20.13 2ull n ALA 39 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2ull s SER 40 N 1.00 5.10 -0.07 0.00 0.01 -1.19 -4.73 113.70 113.83 2ull s SER 40 Ca 0.00 2.32 0.05 0.00 1.31 0.00 0.00 55.95 59.62 2ull s SER 40 Cb 0.00 -2.59 -0.01 0.00 0.21 0.00 0.00 66.02 63.63 2ull s SER 40 CO 0.00 -1.65 -0.22 -0.76 0.41 0.00 0.00 173.24 171.03 2ull s LEU 41 N -4.28 2.27 0.00 2.44 1.43 -1.26 -0.69 118.68 118.60 2ull s LEU 41 Ca 0.75 -0.44 0.04 0.00 -1.03 0.00 0.00 54.13 53.46 2ull s LEU 41 Cb -0.28 -1.44 -0.02 0.00 0.03 0.00 0.00 46.19 44.48 2ull s LEU 41 CO 0.35 0.25 0.15 0.00 0.23 0.00 0.00 176.35 177.33 2ull s SER 43 N -2.60 3.29 0.26 0.00 0.01 0.03 -1.94 113.70 112.75 2ull s SER 43 Ca 0.21 -0.67 -0.29 0.00 1.31 0.00 0.00 55.95 56.51 2ull s SER 43 Cb 0.01 -0.27 -0.09 0.00 0.21 0.00 0.00 66.02 65.88 2ull s SER 43 CO 0.15 0.21 1.20 -0.69 0.41 0.00 0.00 173.24 174.52 2ull s VAL 44 N -0.96 3.28 0.00 3.43 1.01 -0.06 -2.73 120.40 124.39 2ull s VAL 44 Ca 0.13 1.20 0.00 0.00 0.00 0.00 0.00 61.98 63.32 2ull s VAL 44 Cb -0.10 -3.77 0.00 0.00 0.00 0.00 0.00 36.38 32.51 2ull s VAL 44 CO 0.05 0.25 0.00 0.61 0.00 0.00 0.00 175.10 176.01 2ull n GLY 44 N 1.48 1.15 3.17 4.51 0.00 -0.10 -0.17 105.19 115.24 2ull n GLY 44 Ca 0.01 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.91 2ull n GLY 44 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ull s PHE 45 N 0.00 -0.19 0.22 1.61 0.08 -1.15 -4.02 117.98 114.53 2ull s PHE 45 Ca 0.00 0.39 -0.30 0.00 0.12 0.00 0.00 56.93 57.14 2ull s PHE 45 Cb 0.00 0.07 -0.09 0.00 -0.57 0.00 0.00 43.02 42.43 2ull s PHE 45 CO 0.00 -0.25 1.29 -1.12 -0.10 0.00 0.00 175.22 175.04 2ull s SER 46 N -0.65 6.92 0.20 1.36 0.01 -1.26 -1.29 113.70 118.99 2ull s SER 46 Ca -0.07 2.42 -0.04 0.00 1.31 0.00 0.00 55.95 59.57 2ull s SER 46 Cb -0.04 -2.62 -0.03 0.00 0.21 0.00 0.00 66.02 63.54 2ull s SER 46 CO 0.02 -0.49 0.20 0.68 0.41 0.00 0.00 173.24 174.06 2ull s VAL 47 N -0.16 0.01 0.08 3.43 -7.23 0.02 -1.83 120.40 114.71 2ull s VAL 47 Ca 0.54 -1.84 0.06 0.00 -1.81 0.00 0.00 61.98 58.93 2ull s VAL 47 Cb -0.36 -2.36 -0.03 0.00 0.56 0.00 0.00 36.38 34.18 2ull s VAL 47 CO 0.40 -0.06 -0.15 0.42 -0.31 0.00 0.00 175.10 175.40 2ull s THR 48 N -4.11 1.23 -0.38 5.32 -4.23 0.05 -1.63 115.64 111.89 2ull s THR 48 Ca 0.33 -1.36 0.01 0.00 -1.18 0.00 0.00 61.69 59.49 2ull s THR 48 Cb 0.05 -1.17 0.13 0.00 1.34 0.00 0.00 72.50 72.85 2ull s THR 48 CO 0.10 -0.20 0.20 -0.60 -0.54 0.00 0.00 174.62 173.58 2ull s ARG 48 N -1.79 0.87 7.55 3.99 3.52 -0.30 -1.27 118.95 131.53 2ull s ARG 48 Ca -0.00 -1.54 0.00 0.00 -0.13 0.00 0.00 55.73 54.06 2ull s ARG 48 Cb -0.10 -1.84 0.00 0.00 -1.56 0.00 0.00 34.95 31.45 2ull s ARG 48 CO 0.03 -1.15 0.00 0.41 -0.81 0.00 0.00 175.30 173.78 2ull n GLY 48 N 4.01 2.73 0.12 8.12 0.00 -1.26 -2.30 105.19 116.62 2ull n GLY 48 Ca 0.08 -0.26 0.05 0.00 0.00 0.00 0.00 46.02 45.89 2ull n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ull h ALA 48 N -0.52 0.65 -2.67 4.61 0.00 -2.02 -3.47 119.26 115.84 2ull h ALA 48 Ca 0.00 -0.41 -0.51 0.00 0.00 0.00 0.00 54.91 53.99 2ull h ALA 48 Cb 0.00 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 2ull h ALA 48 CO 0.00 0.47 0.44 0.99 0.00 0.00 0.00 179.25 181.15 2ull s THR 49 N -3.10 3.95 0.55 0.00 2.01 -0.97 -5.05 115.64 113.03 2ull s THR 49 Ca 0.00 1.73 -0.09 0.00 0.31 0.00 0.00 61.69 63.63 2ull s THR 49 Cb 0.08 -4.10 -0.04 0.00 0.01 0.00 0.00 72.50 68.45 2ull s THR 49 CO 0.78 0.32 0.93 -0.54 -0.69 0.00 0.00 174.62 175.41 2ull s LYS 50 N -0.50 3.62 0.02 4.92 1.02 -1.26 -1.15 119.74 126.42 2ull s LYS 50 Ca 0.48 0.56 -0.28 0.00 0.02 0.00 0.00 55.97 56.74 2ull s LYS 50 Cb -0.28 -2.21 0.10 0.00 -0.52 0.00 0.00 37.83 34.92 2ull s LYS 50 CO 0.34 -0.39 1.23 0.20 -0.92 0.00 0.00 175.35 175.82 2ull s GLY 51 N -4.00 -0.22 -0.04 -3.33 0.00 -0.65 -1.16 107.32 97.93 2ull s GLY 51 Ca 0.52 0.27 -0.03 0.00 0.00 0.00 0.00 44.72 45.48 2ull s GLY 51 CO 0.48 2.54 0.10 -0.11 0.00 0.00 0.00 173.10 176.10 2ull s PHE 52 N -2.28 -0.10 0.37 1.90 -0.12 -0.77 -0.80 117.98 116.17 2ull s PHE 52 Ca 0.21 0.27 -0.14 0.00 -0.05 0.00 0.00 56.93 57.22 2ull s PHE 52 Cb 0.01 0.02 -0.08 0.00 -0.63 0.00 0.00 43.02 42.34 2ull s PHE 52 CO -0.01 -0.06 0.79 0.14 -0.05 0.00 0.00 175.22 176.03 2ull s VAL 53 N 0.19 4.67 0.01 -2.49 -7.23 -0.41 -0.74 120.40 114.40 2ull s VAL 53 Ca -0.01 0.92 -0.01 0.00 -1.81 0.00 0.00 61.98 61.07 2ull s VAL 53 Cb -0.02 -3.66 0.00 0.00 0.56 0.00 0.00 36.38 33.27 2ull s VAL 53 CO -0.01 -0.34 0.03 1.07 -0.31 0.00 0.00 175.10 175.54 2ull n THR 54 N -0.78 0.00 -2.91 5.32 5.66 -0.20 -0.93 114.28 120.44 2ull n THR 54 Ca 0.04 -0.04 -0.37 0.00 -3.05 0.00 0.00 64.05 60.63 2ull n THR 54 Cb 0.54 0.04 -0.06 0.00 -1.55 0.00 0.00 70.33 69.29 2ull n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2ull s ALA 55 N -1.04 3.31 0.35 1.79 0.00 -1.26 -1.66 121.76 123.25 2ull s ALA 55 Ca 0.01 0.39 0.14 0.00 0.00 0.00 0.00 51.96 52.49 2ull s ALA 55 Cb -0.00 -3.04 0.74 0.00 0.00 0.00 0.00 23.12 20.82 2ull s ALA 55 CO 0.00 0.24 1.82 0.78 0.00 0.00 0.00 175.76 178.61 2ull h GLY 56 N 3.42 0.00 2.00 0.00 0.00 -1.61 -2.70 103.07 104.18 2ull h GLY 56 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 2ull h GLY 56 CO 0.65 0.00 0.00 -2.39 0.00 0.00 0.00 176.54 174.80 2ull n HIS 57 N -4.01 0.69 0.28 5.60 1.44 -1.26 -3.04 115.22 114.92 2ull n HIS 57 Ca -0.02 0.25 0.17 0.00 -2.01 0.00 0.00 57.72 56.11 2ull n HIS 57 Cb 0.42 -0.90 0.79 0.00 0.12 0.00 0.00 29.99 30.41 2ull n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2ull s GLY 59 N -4.19 -0.27 0.37 0.00 0.00 -1.17 -4.84 107.32 97.22 2ull s GLY 59 Ca -0.01 1.71 0.07 0.00 0.00 0.00 0.00 44.72 46.49 2ull s GLY 59 CO 0.53 0.54 0.47 -0.51 0.00 0.00 0.00 173.10 174.13 2ull s THR 59 N -2.02 3.58 0.26 0.90 -4.23 -1.26 -4.84 115.64 108.03 2ull s THR 59 Ca 0.13 -1.08 -0.31 0.00 -1.18 0.00 0.00 61.69 59.25 2ull s THR 59 Cb 0.01 -3.23 -0.13 0.00 1.34 0.00 0.00 72.50 70.49 2ull s THR 59 CO -0.03 -0.10 1.44 0.52 -0.54 0.00 0.00 174.62 175.91 2ull n VAL 59 N -1.66 1.06 -0.49 2.29 0.31 -1.26 -1.75 118.33 116.83 2ull n VAL 59 Ca 0.02 -0.26 0.00 0.00 -0.01 0.00 0.00 64.34 64.09 2ull n VAL 59 Cb 0.59 -1.60 0.00 0.00 -0.91 0.00 0.00 33.84 31.92 2ull n VAL 59 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2ull n ASN 60 N 2.04 0.00 -4.72 4.52 5.03 -0.24 -4.97 115.26 116.93 2ull n ASN 60 Ca 0.10 0.00 -0.42 0.00 0.87 0.00 0.00 54.58 55.13 2ull n ASN 60 Cb 0.33 0.00 -0.03 0.00 -1.02 0.00 0.00 39.78 39.06 2ull n ASN 60 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2ull s ALA 61 N -3.24 3.53 0.01 5.41 0.00 -0.72 -4.70 121.76 122.05 2ull s ALA 61 Ca 0.00 1.04 -0.30 0.00 0.00 0.00 0.00 51.96 52.71 2ull s ALA 61 Cb 0.00 -3.51 -0.03 0.00 0.00 0.00 0.00 23.12 19.58 2ull s ALA 61 CO 0.00 -0.56 0.96 0.99 0.00 0.00 0.00 175.76 177.15 2ull s THR 62 N 1.05 4.85 -0.05 0.00 2.01 -1.26 -0.78 115.64 121.45 2ull s THR 62 Ca 0.63 2.02 -0.09 0.00 0.31 0.00 0.00 61.69 64.56 2ull s THR 62 Cb -0.35 -4.30 -0.05 0.00 0.01 0.00 0.00 72.50 67.82 2ull s THR 62 CO 0.30 0.18 0.24 0.00 -0.69 0.00 0.00 174.62 174.65 2ull s ALA 64 N 0.89 3.83 -0.02 7.40 0.00 -0.62 -1.22 121.76 132.02 2ull s ALA 64 Ca 0.50 -0.53 0.03 0.00 0.00 0.00 0.00 51.96 51.96 2ull s ALA 64 Cb -0.21 -2.09 0.00 0.00 0.00 0.00 0.00 23.12 20.82 2ull s ALA 64 CO 0.27 0.60 -0.09 1.03 0.00 0.00 0.00 175.76 177.57 2ull s ARG 65 N -1.26 0.92 -0.04 0.00 0.52 -0.60 -1.23 118.95 117.25 2ull s ARG 65 Ca 0.21 -0.32 0.03 0.00 -0.52 0.00 0.00 55.73 55.12 2ull s ARG 65 Cb -0.13 -0.87 0.01 0.00 0.52 0.00 0.00 34.95 34.47 2ull s ARG 65 CO 0.10 0.14 -0.11 0.42 0.02 0.00 0.00 175.30 175.87 2ull s ILE 66 N 0.07 0.95 -1.60 1.52 1.01 -0.46 -0.98 121.20 121.70 2ull s ILE 66 Ca -0.01 -0.42 0.00 0.00 0.00 0.00 0.00 60.65 60.21 2ull s ILE 66 Cb -0.07 -0.85 0.00 0.00 0.01 0.00 0.00 42.46 41.55 2ull s ILE 66 CO 0.00 0.30 0.00 0.61 0.00 0.00 0.00 174.94 175.85 2ull n GLY 67 N 3.45 0.72 3.02 6.18 0.00 -1.26 -1.86 105.19 115.44 2ull n GLY 67 Ca -0.20 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.61 2ull n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ull n GLY 81 N -0.97 2.55 3.88 -0.02 0.00 -1.26 -5.01 105.19 104.35 2ull n GLY 81 Ca -0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.56 2ull n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ull s ALA 82 N -3.18 3.84 0.08 4.61 0.00 -0.78 -5.03 121.76 121.29 2ull s ALA 82 Ca 0.00 -1.02 -0.31 0.00 0.00 0.00 0.00 51.96 50.63 2ull s ALA 82 Cb 0.00 -1.65 -0.07 0.00 0.00 0.00 0.00 23.12 21.39 2ull s ALA 82 CO 0.00 0.63 1.42 0.08 0.00 0.00 0.00 175.76 177.89 2ull s VAL 83 N -1.64 3.39 -0.04 0.00 1.01 -1.26 -1.36 120.40 120.50 2ull s VAL 83 Ca 0.33 0.93 0.04 0.00 0.00 0.00 0.00 61.98 63.28 2ull s VAL 83 Cb -0.11 -3.60 -0.06 0.00 0.00 0.00 0.00 36.38 32.61 2ull s VAL 83 CO 0.26 0.04 0.10 1.33 0.00 0.00 0.00 175.10 176.84 2ull n VAL 84 N 4.23 0.00 -3.22 2.92 0.24 -0.37 -4.89 118.33 117.24 2ull n VAL 84 Ca 0.12 -0.16 0.00 0.00 -2.04 0.00 0.00 64.34 62.27 2ull n VAL 84 Cb 0.42 0.54 0.00 0.00 -1.47 0.00 0.00 33.84 33.34 2ull n VAL 84 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2ull n GLY 85 N 2.02 -0.65 3.32 7.63 0.00 -1.19 -1.49 105.19 114.82 2ull n GLY 85 Ca -0.00 -0.73 -0.14 0.00 0.00 0.00 0.00 46.02 45.14 2ull n GLY 85 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ull s THR 87 N -3.00 0.02 -0.00 2.61 2.01 -0.54 -1.59 115.64 115.15 2ull s THR 87 Ca 0.00 -0.17 -0.30 0.00 0.31 0.00 0.00 61.69 61.53 2ull s THR 87 Cb 0.00 -0.66 -0.07 0.00 0.01 0.00 0.00 72.50 71.78 2ull s THR 87 CO 0.00 -0.09 1.80 -0.36 -0.69 0.00 0.00 174.62 175.28 2ull s PHE 88 N -0.50 1.69 -0.03 4.92 0.40 0.04 -0.58 117.98 123.92 2ull s PHE 88 Ca -0.06 -0.10 -0.05 0.00 -0.60 0.00 0.00 56.93 56.12 2ull s PHE 88 Cb -0.03 -4.08 -0.28 0.00 0.51 0.00 0.00 43.02 39.14 2ull s PHE 88 CO 0.03 -4.66 0.72 0.00 0.70 0.00 0.00 175.22 172.00 2ull h ALA 88 N 9.92 0.30 -1.74 5.36 0.00 -1.63 -0.62 119.26 130.84 2ull h ALA 88 Ca -0.44 -1.19 0.02 0.00 0.00 0.00 0.00 54.91 53.30 2ull h ALA 88 Cb 1.21 0.41 -0.22 0.00 0.00 0.00 0.00 17.79 19.19 2ull h ALA 88 CO 0.95 1.17 0.39 0.00 0.00 0.00 0.00 179.25 181.75 2ull s ALA 89 N -2.60 -1.87 0.04 0.00 0.00 -1.23 -4.82 121.76 111.28 2ull s ALA 89 Ca -0.13 1.52 -0.11 0.00 0.00 0.00 0.00 51.96 53.25 2ull s ALA 89 Cb 0.06 -0.51 0.01 0.00 0.00 0.00 0.00 23.12 22.68 2ull s ALA 89 CO 0.84 -0.33 0.22 -0.98 0.00 0.00 0.00 175.76 175.52 2ull s ARG 90 N -0.99 0.72 -0.17 0.00 1.04 -1.26 -2.29 118.95 115.99 2ull s ARG 90 Ca -0.05 -0.58 -0.05 0.00 -1.04 0.00 0.00 55.73 54.02 2ull s ARG 90 Cb -0.01 0.30 0.06 0.00 -2.04 0.00 0.00 34.95 33.26 2ull s ARG 90 CO 0.04 -0.21 0.08 0.08 -0.04 0.00 0.00 175.30 175.25 2ull s VAL 91 N -2.50 -0.01 -0.29 4.99 1.01 -0.23 -4.99 120.40 118.38 2ull s VAL 91 Ca -0.06 -0.19 -0.16 0.00 0.00 0.00 0.00 61.98 61.58 2ull s VAL 91 Cb -0.01 -0.62 0.13 0.00 0.00 0.00 0.00 36.38 35.88 2ull s VAL 91 CO -0.03 -0.25 0.91 0.12 0.00 0.00 0.00 175.10 175.84 2ull s PHE 94 N 2.10 -0.71 0.00 5.22 5.36 -1.26 -1.72 117.98 126.98 2ull s PHE 94 Ca 0.02 1.39 0.00 0.00 -0.96 0.00 0.00 56.93 57.38 2ull s PHE 94 Cb -0.16 0.43 0.00 0.00 -0.34 0.00 0.00 43.02 42.95 2ull s PHE 94 CO -0.09 -0.35 0.00 -0.35 -1.46 0.00 0.00 175.22 172.97 2ull n PRO 95 N 4.03 2.11 0.00 10.12 -0.04 -1.26 -4.95 135.00 145.00 2ull n PRO 95 Ca -0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 2ull n PRO 95 Cb 0.57 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.03 2ull n PRO 95 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ull n GLY 100 N 4.77 2.06 1.45 0.55 0.00 0.48 -4.75 105.19 109.74 2ull n GLY 100 Ca 0.00 -0.32 -0.11 0.00 0.00 0.00 0.00 46.02 45.59 2ull n GLY 100 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2ull n ASN 101 N 4.08 2.08 -3.05 1.61 3.02 -1.26 -1.87 115.26 119.88 2ull n ASN 101 Ca 0.00 -1.80 -0.15 0.00 -0.03 0.00 0.00 54.58 52.60 2ull n ASN 101 Cb 0.00 0.06 -0.04 0.00 -0.61 0.00 0.00 39.78 39.19 2ull n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2ull n ASP 102 N -1.56 -2.02 -3.87 6.41 2.03 -1.15 -3.99 116.55 112.40 2ull n ASP 102 Ca -0.04 -2.70 -0.09 0.00 0.52 0.00 0.00 54.79 52.48 2ull n ASP 102 Cb 0.25 0.68 -0.08 0.00 -0.72 0.00 0.00 41.12 41.24 2ull n ASP 102 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ull s ARG 103 N 0.43 0.75 -0.03 -0.67 1.70 -0.70 -3.59 118.95 116.84 2ull s ARG 103 Ca 0.32 -0.82 -0.30 0.00 -0.47 0.00 0.00 55.73 54.46 2ull s ARG 103 Cb 0.04 0.31 0.11 0.00 -0.57 0.00 0.00 34.95 34.83 2ull s ARG 103 CO -0.13 -0.22 0.98 0.00 -1.08 0.00 0.00 175.30 174.85 2ull s ALA 104 N -3.25 -1.88 0.00 7.88 0.00 -0.66 -1.07 121.76 122.79 2ull s ALA 104 Ca 0.00 1.04 0.01 0.00 0.00 0.00 0.00 51.96 53.02 2ull s ALA 104 Cb 0.02 0.32 -0.01 0.00 0.00 0.00 0.00 23.12 23.46 2ull s ALA 104 CO -0.08 -0.72 -0.04 1.67 0.00 0.00 0.00 175.76 176.60 2ull s TRP 105 N -2.96 0.35 -0.25 0.00 1.48 -0.97 -1.04 118.94 115.55 2ull s TRP 105 Ca 0.07 -0.13 -0.08 0.00 -1.06 0.00 0.00 56.10 54.90 2ull s TRP 105 Cb -0.01 -0.22 -0.04 0.00 -1.16 0.00 0.00 33.47 32.05 2ull s TRP 105 CO -0.07 -0.02 0.10 0.08 -4.06 0.00 0.00 176.95 172.98 2ull s VAL 106 N -0.29 4.62 -0.21 -0.66 1.01 0.08 -1.55 120.40 123.40 2ull s VAL 106 Ca -0.01 -0.07 -0.29 0.00 0.00 0.00 0.00 61.98 61.61 2ull s VAL 106 Cb -0.03 -3.16 0.01 0.00 0.00 0.00 0.00 36.38 33.19 2ull s VAL 106 CO -0.00 0.33 1.05 -0.55 0.00 0.00 0.00 175.10 175.93 2ull s SER 107 N 1.51 7.11 -0.12 3.32 0.15 0.25 -1.85 113.70 124.07 2ull s SER 107 Ca 0.06 1.42 -0.12 0.00 0.70 0.00 0.00 55.95 58.02 2ull s SER 107 Cb -0.15 -2.54 -0.05 0.00 -1.71 0.00 0.00 66.02 61.57 2ull s SER 107 CO 0.05 -0.64 0.25 -0.76 1.20 0.00 0.00 173.24 173.34 2ull s LEU 108 N 3.04 4.32 0.58 3.45 1.43 -0.31 -1.46 118.68 129.73 2ull s LEU 108 Ca 0.45 0.54 -0.21 0.00 -1.03 0.00 0.00 54.13 53.89 2ull s LEU 108 Cb -0.16 -2.29 -0.04 0.00 0.03 0.00 0.00 46.19 43.74 2ull s LEU 108 CO 0.08 0.24 1.34 0.42 0.23 0.00 0.00 176.35 178.67 2ull s THR 109 N -0.27 2.04 -0.32 5.49 -4.23 -0.55 -4.31 115.64 113.50 2ull s THR 109 Ca 0.16 0.03 0.00 0.00 -1.18 0.00 0.00 61.69 60.70 2ull s THR 109 Cb -0.13 -3.02 0.00 0.00 1.34 0.00 0.00 72.50 70.69 2ull s THR 109 CO 0.05 -0.00 0.18 -1.54 -0.54 0.00 0.00 174.62 172.77 2ull n SER 110 N -1.28 0.52 -0.01 3.99 3.41 -1.26 -2.10 113.62 116.88 2ull n SER 110 Ca 0.12 -0.44 0.01 0.00 -0.26 0.00 0.00 58.87 58.30 2ull n SER 110 Cb 0.46 -0.11 -0.04 0.00 -0.26 0.00 0.00 64.21 64.26 2ull n SER 110 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ull n ALA 111 N 0.73 2.09 -0.68 7.33 0.00 -1.26 -5.06 120.51 123.66 2ull n ALA 111 Ca 0.00 -0.21 -0.31 0.00 0.00 0.00 0.00 53.44 52.92 2ull n ALA 111 Cb 0.09 -0.08 0.17 0.00 0.00 0.00 0.00 19.45 19.63 2ull n ALA 111 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2ull n GLN 112 N -1.87 -0.46 -4.00 0.00 1.13 -0.89 -4.43 117.38 106.86 2ull n GLN 112 Ca -0.04 -0.07 -0.31 0.00 -1.94 0.00 0.00 57.00 54.64 2ull n GLN 112 Cb 0.33 -2.32 -0.15 0.00 0.11 0.00 0.00 30.24 28.21 2ull n GLN 112 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 2ull s THR 113 N -2.61 1.95 -0.20 5.09 2.01 0.54 -4.89 115.64 117.53 2ull s THR 113 Ca 0.66 -1.77 -0.29 0.00 0.31 0.00 0.00 61.69 60.60 2ull s THR 113 Cb -0.23 -2.26 -0.01 0.00 0.01 0.00 0.00 72.50 70.02 2ull s THR 113 CO 0.59 -0.29 1.26 -0.76 -0.69 0.00 0.00 174.62 174.73 2ull s LEU 114 N 1.14 4.10 0.03 4.42 1.43 -1.26 -0.68 118.68 127.86 2ull s LEU 114 Ca 0.00 1.55 0.08 0.00 -1.03 0.00 0.00 54.13 54.73 2ull s LEU 114 Cb -0.19 -3.54 -0.02 0.00 0.03 0.00 0.00 46.19 42.47 2ull s LEU 114 CO -0.08 -0.84 -0.24 -0.76 0.23 0.00 0.00 176.35 174.67 2ull s LEU 119 N 3.71 2.13 -1.08 1.79 1.43 -1.13 -4.98 118.68 120.56 2ull s LEU 119 Ca 0.54 -0.52 -0.07 0.00 -1.03 0.00 0.00 54.13 53.05 2ull s LEU 119 Cb -0.20 -1.16 -0.03 0.00 0.03 0.00 0.00 46.19 44.83 2ull s LEU 119 CO 0.16 0.23 2.86 -0.81 0.23 0.00 0.00 176.35 179.03 2ull n PRO 120 N 2.00 3.52 -4.04 1.29 -0.04 -1.26 -4.46 135.00 132.01 2ull n PRO 120 Ca -0.17 -2.44 -0.08 0.00 -0.04 0.00 0.00 63.50 60.78 2ull n PRO 120 Cb 0.52 -2.51 -0.10 0.00 -0.04 0.00 0.00 33.50 31.37 2ull n PRO 120 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2ull s ARG 120 N 0.29 0.52 -0.08 0.54 0.52 -1.26 -1.04 118.95 118.45 2ull s ARG 120 Ca 0.63 -1.00 -0.01 0.00 -0.52 0.00 0.00 55.73 54.83 2ull s ARG 120 Cb 0.24 0.18 0.03 0.00 0.52 0.00 0.00 34.95 35.92 2ull s ARG 120 CO -0.09 -0.10 -0.02 0.08 0.02 0.00 0.00 175.30 175.20 2ull s VAL 120 N -3.09 0.53 0.17 3.52 1.01 -0.13 -0.53 120.40 121.88 2ull s VAL 120 Ca -0.01 0.01 -0.33 0.00 0.00 0.00 0.00 61.98 61.65 2ull s VAL 120 Cb 0.02 -0.64 -0.13 0.00 0.00 0.00 0.00 36.38 35.63 2ull s VAL 120 CO -0.07 0.28 1.69 0.00 0.00 0.00 0.00 175.10 177.00 2ull n ALA 120 N 4.97 2.17 -3.65 5.51 0.00 0.55 -0.33 120.51 129.73 2ull n ALA 120 Ca -0.10 0.40 -0.29 0.00 0.00 0.00 0.00 53.44 53.45 2ull n ALA 120 Cb 0.50 -2.47 -0.13 0.00 0.00 0.00 0.00 19.45 17.35 2ull n ALA 120 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2ull s ASN 120 N 1.34 3.59 0.00 0.00 3.84 -1.26 -4.73 114.94 117.71 2ull s ASN 120 Ca 0.78 -2.21 0.00 0.00 0.21 0.00 0.00 52.86 51.64 2ull s ASN 120 Cb -0.57 -0.81 0.00 0.00 -0.55 0.00 0.00 41.25 39.32 2ull s ASN 120 CO 0.35 -0.32 0.00 0.61 -2.79 0.00 0.00 177.10 174.95 2ull n GLY 120 N 4.07 -0.09 0.00 1.21 0.00 -1.26 -4.24 105.19 104.88 2ull n GLY 120 Ca 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2ull n GLY 120 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2ull n SER 120 N 0.44 0.00 -4.07 1.61 2.88 -1.26 -5.11 113.62 108.11 2ull n SER 120 Ca 0.00 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.46 2ull n SER 120 Cb 0.00 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.36 2ull n SER 120 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 2ull s PHE 120 N 0.00 0.56 -0.16 0.66 0.08 -1.26 -4.55 117.98 113.30 2ull s PHE 120 Ca 0.00 -1.04 0.01 0.00 0.12 0.00 0.00 56.93 56.03 2ull s PHE 120 Cb 0.00 -0.36 0.02 0.00 -0.57 0.00 0.00 43.02 42.11 2ull s PHE 120 CO 0.00 -0.45 -0.20 0.08 -0.10 0.00 0.00 175.22 174.55 2ull s VAL 120 N -3.95 1.98 0.28 -0.44 1.01 0.55 -4.82 120.40 115.02 2ull s VAL 120 Ca 0.12 -0.90 -0.29 0.00 0.00 0.00 0.00 61.98 60.90 2ull s VAL 120 Cb 0.07 -1.78 -0.10 0.00 0.00 0.00 0.00 36.38 34.57 2ull s VAL 120 CO -0.07 0.53 1.14 -0.89 0.00 0.00 0.00 175.10 175.81 2ull s THR 120 N 1.16 3.35 -0.47 3.92 2.01 -1.26 -0.96 115.64 123.39 2ull s THR 120 Ca 0.01 1.35 -0.18 0.00 0.31 0.00 0.00 61.69 63.18 2ull s THR 120 Cb -0.14 -3.86 0.05 0.00 0.01 0.00 0.00 72.50 68.56 2ull s THR 120 CO -0.09 0.32 0.56 -0.69 -0.69 0.00 0.00 174.62 174.03 2ull s VAL 121 N -1.10 4.96 -0.36 3.82 1.01 -0.21 -4.05 120.40 124.46 2ull s VAL 121 Ca 0.46 -0.44 0.22 0.00 0.00 0.00 0.00 61.98 62.22 2ull s VAL 121 Cb -0.33 -4.21 -0.21 0.00 0.00 0.00 0.00 36.38 31.63 2ull s VAL 121 CO 0.43 -0.66 0.77 0.54 0.00 0.00 0.00 175.10 176.18 2ull n ARG 122 N 5.94 0.45 -3.12 2.72 1.74 0.25 -1.19 116.66 123.46 2ull n ARG 122 Ca -0.07 -0.07 0.00 0.00 -0.77 0.00 0.00 57.85 56.94 2ull n ARG 122 Cb 0.46 -1.58 0.00 0.00 -1.02 0.00 0.00 32.46 30.32 2ull n ARG 122 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ull n GLY 123 N 1.32 -0.84 1.72 -0.13 0.00 -1.12 -4.83 105.19 101.30 2ull n GLY 123 Ca -0.01 -0.73 0.01 0.00 0.00 0.00 0.00 46.02 45.29 2ull n GLY 123 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ull n SER 124 N 0.14 1.59 -4.69 1.61 3.41 -1.26 -0.77 113.62 113.66 2ull n SER 124 Ca 0.00 -2.48 -0.42 0.00 -0.26 0.00 0.00 58.87 55.71 2ull n SER 124 Cb 0.00 -0.39 -0.03 0.00 -0.26 0.00 0.00 64.21 63.53 2ull n SER 124 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2ull s THR 125 N -1.88 2.95 0.01 6.66 2.01 -1.26 -4.83 115.64 119.31 2ull s THR 125 Ca 0.34 0.44 -0.30 0.00 0.31 0.00 0.00 61.69 62.48 2ull s THR 125 Cb 0.37 -3.28 -0.04 0.00 0.01 0.00 0.00 72.50 69.56 2ull s THR 125 CO -0.10 0.00 1.09 -0.70 -0.69 0.00 0.00 174.62 174.22 2ull s GLU 129 N 2.53 4.48 0.37 4.92 2.12 -1.26 -4.70 118.70 127.16 2ull s GLU 129 Ca 0.74 1.59 -0.17 0.00 0.36 0.00 0.00 54.97 57.49 2ull s GLU 129 Cb -0.41 -3.43 -0.09 0.00 0.26 0.00 0.00 34.13 30.46 2ull s GLU 129 CO 0.33 -0.19 0.82 0.00 -0.54 0.00 0.00 175.26 175.67 2ull s ALA 130 N 1.22 3.22 0.54 6.30 0.00 -1.26 -5.08 121.76 126.70 2ull s ALA 130 Ca 0.55 0.14 -0.08 0.00 0.00 0.00 0.00 51.96 52.57 2ull s ALA 130 Cb -0.25 -2.90 -0.04 0.00 0.00 0.00 0.00 23.12 19.93 2ull s ALA 130 CO 0.27 0.22 0.89 0.00 0.00 0.00 0.00 175.76 177.14 2ull s ALA 131 N -2.10 3.27 0.13 0.00 0.00 -1.26 -4.97 121.76 116.81 2ull s ALA 131 Ca 0.57 -0.30 -0.32 0.00 0.00 0.00 0.00 51.96 51.90 2ull s ALA 131 Cb -0.10 -2.81 -0.12 0.00 0.00 0.00 0.00 23.12 20.09 2ull s ALA 131 CO 0.18 -0.47 1.75 0.28 0.00 0.00 0.00 175.76 177.49 2ull n VAL 132 N -2.40 0.22 0.00 0.00 0.31 -1.26 -1.63 118.33 113.57 2ull n VAL 132 Ca 0.03 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 2ull n VAL 132 Cb 0.55 -1.90 0.00 0.00 -0.91 0.00 0.00 33.84 31.57 2ull n VAL 132 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2ull n GLY 133 N 3.97 2.06 3.77 2.92 0.00 0.13 -4.99 105.19 113.05 2ull n GLY 133 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 2ull n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ull s ALA 134 N -2.00 3.08 0.48 4.61 0.00 -0.65 -4.58 121.76 122.70 2ull s ALA 134 Ca 0.00 1.00 -0.22 0.00 0.00 0.00 0.00 51.96 52.73 2ull s ALA 134 Cb 0.00 -3.40 -0.07 0.00 0.00 0.00 0.00 23.12 19.65 2ull s ALA 134 CO 0.00 -0.65 1.18 0.00 0.00 0.00 0.00 175.76 176.29 2ull s ALA 135 N -1.45 2.91 -0.10 0.00 0.00 -1.26 -0.85 121.76 121.02 2ull s ALA 135 Ca 0.60 0.95 -0.29 0.00 0.00 0.00 0.00 51.96 53.22 2ull s ALA 135 Cb -0.31 -3.39 0.07 0.00 0.00 0.00 0.00 23.12 19.48 2ull s ALA 135 CO 0.38 -0.74 0.68 0.54 0.00 0.00 0.00 175.76 176.62 2ull s VAL 136 N -1.56 0.00 0.31 0.00 0.11 -0.09 -4.73 120.40 114.45 2ull s VAL 136 Ca 0.66 -0.01 0.06 0.00 -2.93 0.00 0.00 61.98 59.76 2ull s VAL 136 Cb -0.29 -0.99 -0.06 0.00 -1.53 0.00 0.00 36.38 33.51 2ull s VAL 136 CO 0.35 -0.01 -0.03 0.00 -3.33 0.00 0.00 175.10 172.08 2ull s ARG 138 N -3.75 0.66 -0.01 0.00 1.70 0.40 -0.63 118.95 117.33 2ull s ARG 138 Ca 0.32 -1.21 0.01 0.00 -0.47 0.00 0.00 55.73 54.39 2ull s ARG 138 Cb 0.06 0.05 0.00 0.00 -0.57 0.00 0.00 34.95 34.49 2ull s ARG 138 CO 0.14 -0.07 -0.05 0.45 -1.08 0.00 0.00 175.30 174.69 2ull s SER 139 N -2.83 0.66 0.18 -2.89 0.15 0.17 -1.24 113.70 107.91 2ull s SER 139 Ca 0.07 -0.10 -0.24 0.00 0.70 0.00 0.00 55.95 56.38 2ull s SER 139 Cb 0.05 -0.15 0.05 0.00 -1.71 0.00 0.00 66.02 64.26 2ull s SER 139 CO -0.07 0.03 0.89 -0.83 1.20 0.00 0.00 173.24 174.46 2ull s GLY 140 N 0.17 -0.20 0.00 9.45 0.00 -0.73 -2.87 107.32 113.14 2ull s GLY 140 Ca -0.02 0.03 0.24 0.00 0.00 0.00 0.00 44.72 44.97 2ull s GLY 140 CO -0.00 -0.02 1.78 -0.96 0.00 0.00 0.00 173.10 173.90 2ull n ARG 141 N -0.46 0.25 -0.10 2.90 -4.01 -1.14 -1.53 116.66 112.56 2ull n ARG 141 Ca -0.06 0.07 -0.18 0.00 -1.04 0.00 0.00 57.85 56.64 2ull n ARG 141 Cb 0.60 -1.50 -0.06 0.00 -3.04 0.00 0.00 32.46 28.46 2ull n ARG 141 CO 0.00 0.00 0.00 2.41 -3.04 0.00 0.00 177.63 177.00 2ull n THR 142 N -1.34 1.37 0.61 8.89 -1.04 -1.26 -4.76 114.28 116.75 2ull n THR 142 Ca 0.10 -0.13 0.07 0.00 -2.04 0.00 0.00 64.05 62.05 2ull n THR 142 Cb 0.21 -1.99 0.01 0.00 -1.82 0.00 0.00 70.33 66.74 2ull n THR 142 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 2ull n THR 143 N -4.16 0.00 -2.68 12.58 -2.24 -1.26 -5.00 114.28 111.52 2ull n THR 143 Ca -0.33 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.08 2ull n THR 143 Cb 0.67 1.18 0.00 0.00 -2.10 0.00 0.00 70.33 70.09 2ull n THR 143 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ull n GLY 156 N 1.02 0.84 3.48 3.38 0.00 -0.58 -4.69 105.19 108.64 2ull n GLY 156 Ca 0.06 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.91 2ull n GLY 156 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2ull s TYR 157 N 0.00 3.24 0.05 1.61 5.04 -1.26 -1.77 117.35 124.26 2ull s TYR 157 Ca 0.00 -0.47 0.09 0.00 -2.44 0.00 0.00 57.07 54.25 2ull s TYR 157 Cb 0.00 -2.56 -0.03 0.00 0.35 0.00 0.00 41.96 39.73 2ull s TYR 157 CO 0.00 -0.52 -0.26 -0.65 -1.34 0.00 0.00 175.55 172.78 2ull s GLN 158 N 1.70 1.79 0.27 4.97 -1.52 -0.37 -4.95 119.66 121.55 2ull s GLN 158 Ca 0.05 -1.12 0.10 0.00 -1.95 0.00 0.00 55.36 52.44 2ull s GLN 158 Cb -0.18 -1.98 -0.05 0.00 -0.22 0.00 0.00 33.01 30.57 2ull s GLN 158 CO 0.10 0.51 -0.14 0.00 -0.25 0.00 0.00 175.29 175.51 2ull n GLY 160 N -0.58 -0.88 3.15 0.00 0.00 -0.28 -4.30 105.19 102.29 2ull n GLY 160 Ca -0.06 -0.18 -0.09 0.00 0.00 0.00 0.00 46.02 45.69 2ull n GLY 160 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ull s THR 161 N -4.00 0.46 -0.12 2.61 -4.23 -1.26 -0.92 115.64 108.18 2ull s THR 161 Ca 0.00 -1.89 -0.29 0.00 -1.18 0.00 0.00 61.69 58.32 2ull s THR 161 Cb 0.00 -1.70 -0.01 0.00 1.34 0.00 0.00 72.50 72.13 2ull s THR 161 CO 0.00 -0.84 1.06 -0.63 -0.54 0.00 0.00 174.62 173.67 2ull s ILE 162 N -3.78 4.64 -1.23 2.99 1.01 -0.03 -1.47 121.20 123.34 2ull s ILE 162 Ca 0.12 1.93 0.11 0.00 0.00 0.00 0.00 60.65 62.81 2ull s ILE 162 Cb 0.07 -4.24 0.06 0.00 0.01 0.00 0.00 42.46 38.35 2ull s ILE 162 CO -0.05 -0.03 0.78 0.35 0.00 0.00 0.00 174.94 175.99 2ull n THR 163 N 4.73 0.00 0.00 2.92 -2.24 0.08 0.18 114.28 119.95 2ull n THR 163 Ca 0.10 -0.47 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 2ull n THR 163 Cb 0.48 1.20 0.00 0.00 -2.10 0.00 0.00 70.33 69.90 2ull n THR 163 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ull n ALA 164 N 0.37 0.00 -2.36 6.98 0.00 -1.14 -4.96 120.51 119.40 2ull n ALA 164 Ca 0.06 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.31 2ull n ALA 164 Cb 0.25 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.60 2ull n ALA 164 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2ull s LYS 165 N -2.00 1.42 -1.00 0.00 1.02 -1.26 -0.31 119.74 117.61 2ull s LYS 165 Ca 0.00 -1.73 -0.07 0.00 0.02 0.00 0.00 55.97 54.18 2ull s LYS 165 Cb 0.00 -0.70 -0.04 0.00 -0.52 0.00 0.00 37.83 36.56 2ull s LYS 165 CO 0.00 -0.11 0.85 -1.71 -0.92 0.00 0.00 175.35 173.46 2ull n ASN 166 N -0.49 -6.61 -4.39 2.83 4.05 -0.98 -4.91 115.26 104.76 2ull n ASN 166 Ca -0.04 -0.65 -0.35 0.00 0.45 0.00 0.00 54.58 53.99 2ull n ASN 166 Cb 0.64 -4.83 -0.13 0.00 1.23 0.00 0.00 39.78 36.69 2ull n ASN 166 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 2ull s VAL 167 N -3.32 3.70 -0.33 3.44 1.01 0.79 -4.64 120.40 121.05 2ull s VAL 167 Ca 0.36 -0.40 -0.23 0.00 0.00 0.00 0.00 61.98 61.72 2ull s VAL 167 Cb -0.07 -2.67 0.00 0.00 0.00 0.00 0.00 36.38 33.65 2ull s VAL 167 CO 0.77 0.43 0.75 -0.89 0.00 0.00 0.00 175.10 176.16 2ull s THR 168 N 1.15 4.80 -0.18 3.92 2.01 -1.26 -1.73 115.64 124.36 2ull s THR 168 Ca 0.02 0.99 -0.13 0.00 0.31 0.00 0.00 61.69 62.88 2ull s THR 168 Cb -0.15 -4.14 -0.05 0.00 0.01 0.00 0.00 72.50 68.18 2ull s THR 168 CO 0.00 -0.30 0.27 0.00 -0.69 0.00 0.00 174.62 173.91 2ull s ALA 169 N 2.93 3.60 -0.43 7.40 0.00 0.65 -4.94 121.76 130.98 2ull s ALA 169 Ca 0.30 -0.53 -0.19 0.00 0.00 0.00 0.00 51.96 51.55 2ull s ALA 169 Cb -0.14 -2.38 0.02 0.00 0.00 0.00 0.00 23.12 20.62 2ull s ALA 169 CO 0.14 0.03 0.52 -0.80 0.00 0.00 0.00 175.76 175.65 2ull s ASN 170 N 0.57 6.25 0.32 0.00 0.01 -1.26 -1.29 114.94 119.54 2ull s ASN 170 Ca 0.15 -0.53 0.05 0.00 -0.71 0.00 0.00 52.86 51.82 2ull s ASN 170 Cb -0.13 -2.26 0.05 0.00 0.41 0.00 0.00 41.25 39.32 2ull s ASN 170 CO 0.03 -0.66 0.39 -1.22 -1.51 0.00 0.00 177.10 174.14 2ull n TYR 171 N 5.87 -2.18 -0.06 2.20 4.01 -0.77 -5.00 117.16 121.22 2ull n TYR 171 Ca -0.05 -1.22 -0.11 0.00 -0.16 0.00 0.00 57.90 56.36 2ull n TYR 171 Cb 0.48 -0.30 -0.04 0.00 -0.31 0.00 0.00 39.34 39.17 2ull n TYR 171 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2ull h ALA 173 N 0.39 0.26 0.00 -0.72 0.00 -2.03 -3.15 119.26 114.01 2ull h ALA 173 Ca -0.16 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2ull h ALA 173 Cb 0.71 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2ull h ALA 173 CO 0.24 -0.14 0.00 0.39 0.00 0.00 0.00 179.25 179.74 2ull n GLU 174 N -4.82 0.10 -0.28 0.00 4.71 -1.26 -5.00 120.64 114.10 2ull n GLU 174 Ca -0.04 0.19 0.00 0.00 -0.01 0.00 0.00 57.16 57.30 2ull n GLU 174 Cb 0.13 -1.65 0.00 0.00 -1.01 0.00 0.00 31.44 28.92 2ull n GLU 174 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2ull n GLY 175 N 0.86 0.77 3.77 0.62 0.00 -1.19 -4.82 105.19 105.20 2ull n GLY 175 Ca 0.05 -1.90 -0.38 0.00 0.00 0.00 0.00 46.02 43.79 2ull n GLY 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ull s ALA 176 N -1.05 3.26 -0.14 4.61 0.00 -1.26 -1.85 121.76 125.32 2ull s ALA 176 Ca 0.00 0.59 -0.00 0.00 0.00 0.00 0.00 51.96 52.55 2ull s ALA 176 Cb 0.00 -3.21 0.03 0.00 0.00 0.00 0.00 23.12 19.94 2ull s ALA 176 CO 0.00 0.14 -0.09 0.08 0.00 0.00 0.00 175.76 175.89 2ull s VAL 177 N -1.44 1.23 0.22 0.00 1.01 -0.41 -0.39 120.40 120.62 2ull s VAL 177 Ca 0.47 -0.53 0.09 0.00 0.00 0.00 0.00 61.98 62.01 2ull s VAL 177 Cb -0.22 -1.27 -0.04 0.00 0.00 0.00 0.00 36.38 34.84 2ull s VAL 177 CO 0.28 0.31 -0.02 0.00 0.00 0.00 0.00 175.10 175.67 2ull s ARG 178 N 1.61 2.29 0.00 2.72 1.70 -0.78 -0.25 118.95 126.23 2ull s ARG 178 Ca 0.03 -1.29 0.00 0.00 -0.47 0.00 0.00 55.73 54.00 2ull s ARG 178 Cb -0.14 -2.22 0.00 0.00 -0.57 0.00 0.00 34.95 32.02 2ull s ARG 178 CO -0.09 0.41 0.00 0.41 -1.08 0.00 0.00 175.30 174.95 2ull n GLY 179 N -0.48 0.66 3.80 3.88 0.00 -1.20 -4.82 105.19 107.03 2ull n GLY 179 Ca -0.08 -0.72 -0.38 0.00 0.00 0.00 0.00 46.02 44.84 2ull n GLY 179 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ull s LEU 180 N 0.00 4.47 0.01 0.99 1.43 -0.70 -4.41 118.68 120.46 2ull s LEU 180 Ca 0.00 1.54 -0.20 0.00 -1.03 0.00 0.00 54.13 54.44 2ull s LEU 180 Cb 0.00 -3.44 -0.06 0.00 0.03 0.00 0.00 46.19 42.72 2ull s LEU 180 CO 0.00 0.12 0.57 -0.89 0.23 0.00 0.00 176.35 176.39 2ull s THR 181 N -1.34 4.88 -0.13 5.49 2.01 -0.38 -0.15 115.64 126.03 2ull s THR 181 Ca 0.39 1.21 -0.05 0.00 0.31 0.00 0.00 61.69 63.55 2ull s THR 181 Cb -0.20 -3.91 -0.04 0.00 0.01 0.00 0.00 72.50 68.37 2ull s THR 181 CO 0.23 0.46 0.06 -1.58 -0.69 0.00 0.00 174.62 173.10 2ull s GLN 182 N -0.45 3.43 0.17 4.92 0.74 0.58 -0.70 119.66 128.35 2ull s GLN 182 Ca 0.30 -0.30 0.02 0.00 0.05 0.00 0.00 55.36 55.43 2ull s GLN 182 Cb -0.18 -3.04 -0.05 0.00 1.10 0.00 0.00 33.01 30.84 2ull s GLN 182 CO 0.17 0.60 -0.02 0.20 -0.55 0.00 0.00 175.29 175.69 2ull s GLY 183 N -0.55 1.18 -0.05 2.59 0.00 -0.17 -0.75 107.32 109.57 2ull s GLY 183 Ca 0.11 -1.57 0.16 0.00 0.00 0.00 0.00 44.72 43.42 2ull s GLY 183 CO 0.02 -1.54 1.42 1.16 0.00 0.00 0.00 173.10 174.16 2ull n ASN 184 N -0.23 3.68 -4.76 1.64 0.23 -0.54 -1.81 115.26 113.46 2ull n ASN 184 Ca -0.07 -2.25 -0.41 0.00 -0.53 0.00 0.00 54.58 51.32 2ull n ASN 184 Cb 0.63 -0.40 -0.03 0.00 -2.08 0.00 0.00 39.78 37.89 2ull n ASN 184 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2ull s ALA 185 N -1.46 3.45 0.82 -2.53 0.00 -1.26 -4.80 121.76 115.98 2ull s ALA 185 Ca 0.37 1.03 -0.12 0.00 0.00 0.00 0.00 51.96 53.24 2ull s ALA 185 Cb 0.23 -3.39 0.09 0.00 0.00 0.00 0.00 23.12 20.04 2ull s ALA 185 CO 0.20 -0.36 1.16 0.00 0.00 0.00 0.00 175.76 176.76 2ull s MET 190 N -5.47 1.98 0.24 0.00 0.23 -1.26 -4.76 119.30 110.26 2ull s MET 190 Ca 0.62 -1.27 -0.12 0.00 -1.03 0.00 0.00 55.69 53.89 2ull s MET 190 Cb -0.12 0.56 -0.01 0.00 -1.53 0.00 0.00 34.83 33.73 2ull s MET 190 CO 0.50 -0.93 0.44 0.20 -2.03 0.00 0.00 175.02 173.21 2ull s GLY 191 N -3.16 0.61 0.18 3.16 0.00 -1.26 -1.60 107.32 105.25 2ull s GLY 191 Ca 0.17 -0.95 -0.32 0.00 0.00 0.00 0.00 44.72 43.63 2ull s GLY 191 CO 0.10 -0.70 1.75 0.50 0.00 0.00 0.00 173.10 174.75 2ull s ARG 192 N -4.03 4.13 0.00 2.90 0.52 -0.51 -1.39 118.95 120.57 2ull s ARG 192 Ca 0.24 2.59 0.00 0.00 -0.52 0.00 0.00 55.73 58.03 2ull s ARG 192 Cb 0.00 -3.26 0.00 0.00 0.52 0.00 0.00 34.95 32.21 2ull s ARG 192 CO 0.09 -0.78 0.00 0.41 0.02 0.00 0.00 175.30 175.04 2ull n GLY 193 N 4.05 2.02 0.15 -3.53 0.00 -1.26 -4.73 105.19 101.89 2ull n GLY 193 Ca 0.16 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.31 2ull n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2ull h ASP 194 N 0.72 0.00 -1.93 1.61 3.32 -1.56 -3.24 116.42 115.33 2ull h ASP 194 Ca 0.00 0.00 -0.64 0.00 0.02 0.00 0.00 57.03 56.41 2ull h ASP 194 Cb 0.00 0.00 0.10 0.00 0.22 0.00 0.00 39.33 39.65 2ull h ASP 194 CO 0.00 0.00 0.01 -1.20 -1.72 0.00 0.00 179.24 176.33 2ull n SER 195 N -2.36 0.66 0.00 6.45 7.64 -1.26 -1.27 113.62 123.48 2ull n SER 195 Ca 0.02 1.16 0.00 0.00 1.01 0.00 0.00 58.87 61.05 2ull n SER 195 Cb 0.22 -1.18 0.00 0.00 -1.01 0.00 0.00 64.21 62.25 2ull n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ull n GLY 196 N 1.63 3.09 3.71 0.23 0.00 0.62 -0.79 105.19 113.68 2ull n GLY 196 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 2ull n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ull s GLY 197 N -1.81 1.88 0.35 -0.02 0.00 -0.39 -2.24 107.32 105.09 2ull s GLY 197 Ca 0.00 0.60 -0.28 0.00 0.00 0.00 0.00 44.72 45.04 2ull s GLY 197 CO 0.00 1.00 1.35 -0.56 0.00 0.00 0.00 173.10 174.89 2ull s SER 198 N -2.65 6.61 -0.18 1.64 0.01 -1.14 -0.66 113.70 117.33 2ull s SER 198 Ca 0.68 2.77 0.01 0.00 1.31 0.00 0.00 55.95 60.72 2ull s SER 198 Cb -0.23 -2.65 0.03 0.00 0.21 0.00 0.00 66.02 63.37 2ull s SER 198 CO 0.53 -0.66 -0.16 0.26 0.41 0.00 0.00 173.24 173.63 2ull s TRP 199 N -1.15 2.62 -0.02 2.43 0.52 -0.57 -0.66 118.94 122.11 2ull s TRP 199 Ca 0.51 -1.61 -0.09 0.00 0.02 0.00 0.00 56.10 54.93 2ull s TRP 199 Cb -0.41 -1.79 0.01 0.00 -1.15 0.00 0.00 33.47 30.13 2ull s TRP 199 CO 0.55 -0.77 0.20 -1.50 0.02 0.00 0.00 176.95 175.45 2ull s ILE 200 N 1.34 0.06 0.41 2.03 2.07 0.20 -0.20 121.20 127.11 2ull s ILE 200 Ca 0.02 -0.51 -0.20 0.00 -1.41 0.00 0.00 60.65 58.56 2ull s ILE 200 Cb -0.14 -0.46 -0.10 0.00 0.13 0.00 0.00 42.46 41.88 2ull s ILE 200 CO -0.11 -0.28 0.90 0.42 -1.91 0.00 0.00 174.94 173.97 2ull s THR 201 N -1.10 4.46 0.54 4.00 -4.23 -0.64 -1.20 115.64 117.48 2ull s THR 201 Ca -0.12 1.37 0.33 0.00 -1.18 0.00 0.00 61.69 62.09 2ull s THR 201 Cb -0.06 -3.60 0.49 0.00 1.34 0.00 0.00 72.50 70.67 2ull s THR 201 CO 0.02 -0.30 1.86 0.77 -0.54 0.00 0.00 174.62 176.43 2ull h SER 201 N 1.96 0.00 -0.57 3.99 4.64 -1.92 0.19 113.55 121.85 2ull h SER 201 Ca -0.49 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.45 2ull h SER 201 Cb 1.18 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.10 2ull h SER 201 CO 0.62 0.00 0.49 0.00 -0.87 0.00 0.00 176.83 177.07 2ull n ALA 202 N -2.70 5.29 -1.41 5.18 0.00 -1.26 -4.91 120.51 120.70 2ull n ALA 202 Ca 0.20 -1.96 -0.15 0.00 0.00 0.00 0.00 53.44 51.53 2ull n ALA 202 Cb 1.02 -1.43 -0.06 0.00 0.00 0.00 0.00 19.45 18.97 2ull n ALA 202 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ull n GLY 207 N 0.10 1.40 3.51 0.00 0.00 0.06 -4.83 105.19 105.43 2ull n GLY 207 Ca 0.36 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.95 2ull n GLY 207 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2ull s GLN 208 N -3.21 3.28 0.03 1.61 -1.52 -1.24 -0.58 119.66 118.03 2ull s GLN 208 Ca 0.00 -0.55 -0.30 0.00 -1.95 0.00 0.00 55.36 52.56 2ull s GLN 208 Cb 0.00 -3.91 -0.07 0.00 -0.22 0.00 0.00 33.01 28.80 2ull s GLN 208 CO 0.00 -0.79 1.66 0.00 -0.25 0.00 0.00 175.29 175.91 2ull s ALA 209 N 2.26 3.65 -0.24 6.09 0.00 0.05 -1.62 121.76 131.96 2ull s ALA 209 Ca 0.15 1.13 0.03 0.00 0.00 0.00 0.00 51.96 53.26 2ull s ALA 209 Cb -0.16 -3.71 -0.19 0.00 0.00 0.00 0.00 23.12 19.06 2ull s ALA 209 CO 0.14 -1.20 -0.14 1.04 0.00 0.00 0.00 175.76 175.60 2ull n GLN 210 N 6.12 0.66 -3.58 0.00 1.13 0.72 -4.44 117.38 117.99 2ull n GLN 210 Ca 0.16 0.14 0.00 0.00 -1.94 0.00 0.00 57.00 55.37 2ull n GLN 210 Cb 0.41 -1.54 0.00 0.00 0.11 0.00 0.00 30.24 29.22 2ull n GLN 210 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2ull n GLY 211 N 2.18 -0.91 3.31 1.08 0.00 -1.10 -1.44 105.19 108.31 2ull n GLY 211 Ca -0.43 -0.97 -0.29 0.00 0.00 0.00 0.00 46.02 44.33 2ull n GLY 211 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ull s VAL 212 N -3.00 1.97 0.07 1.61 -7.23 -0.27 -1.51 120.40 112.04 2ull s VAL 212 Ca 0.00 -1.31 -0.31 0.00 -1.81 0.00 0.00 61.98 58.55 2ull s VAL 212 Cb 0.00 -1.69 -0.10 0.00 0.56 0.00 0.00 36.38 35.15 2ull s VAL 212 CO 0.00 0.32 1.91 0.80 -0.31 0.00 0.00 175.10 177.81 2ull n MET 213 N 1.83 2.80 -0.08 4.82 1.56 0.17 -0.65 117.12 127.57 2ull n MET 213 Ca -0.17 1.02 -0.13 0.00 -0.27 0.00 0.00 57.70 58.16 2ull n MET 213 Cb 0.52 -2.95 -0.04 0.00 2.15 0.00 0.00 33.22 32.91 2ull n MET 213 CO 0.00 0.00 0.00 0.45 -0.73 0.00 0.00 175.97 175.69 2ull n SER 214 N 6.60 1.67 -0.55 6.12 2.88 -0.04 -0.28 113.62 130.02 2ull n SER 214 Ca 0.19 0.28 0.00 0.00 -1.33 0.00 0.00 58.87 58.01 2ull n SER 214 Cb 0.39 -0.64 0.00 0.00 -0.75 0.00 0.00 64.21 63.20 2ull n SER 214 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ull n GLY 215 N 1.82 1.43 0.00 0.46 0.00 -0.83 -4.89 105.19 103.19 2ull n GLY 215 Ca -0.22 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.00 2ull n GLY 215 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ull n GLY 216 N 0.00 1.80 2.92 -0.02 0.00 -1.26 -0.51 105.19 108.12 2ull n GLY 216 Ca 0.00 -1.09 -0.42 0.00 0.00 0.00 0.00 46.02 44.51 2ull n GLY 216 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2ull n ASN 217 N 0.00 3.63 -4.78 1.61 0.23 -0.69 -4.97 115.26 110.30 2ull n ASN 217 Ca 0.00 -2.81 -0.31 0.00 -0.53 0.00 0.00 54.58 50.94 2ull n ASN 217 Cb 0.00 -1.54 0.09 0.00 -2.08 0.00 0.00 39.78 36.24 2ull n ASN 217 CO 0.00 0.00 0.00 0.68 -0.93 0.00 0.00 177.26 177.01 2ull s VAL 218 N 3.94 3.37 0.00 3.53 -7.23 -1.26 -4.58 120.40 118.17 2ull s VAL 218 Ca 0.51 0.45 0.00 0.00 -1.81 0.00 0.00 61.98 61.12 2ull s VAL 218 Cb 0.13 -3.02 0.00 0.00 0.56 0.00 0.00 36.38 34.05 2ull s VAL 218 CO -0.02 -0.58 0.00 0.00 -0.31 0.00 0.00 175.10 174.19 2ull n GLN 219 N -3.48 2.09 0.26 4.82 1.13 -0.02 -4.87 117.38 117.32 2ull n GLN 219 Ca 0.08 0.00 0.10 0.00 -1.94 0.00 0.00 57.00 55.24 2ull n GLN 219 Cb 0.54 0.00 0.70 0.00 0.11 0.00 0.00 30.24 31.59 2ull n GLN 219 CO 0.00 0.00 0.00 0.77 -1.44 0.00 0.00 177.06 176.39 2ull h SER 219 N 0.00 0.00 -0.03 1.08 0.02 -1.98 -0.61 113.55 112.03 2ull h SER 219 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2ull h SER 219 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2ull h SER 219 CO 0.00 0.05 0.00 -0.46 -1.14 0.00 0.00 176.83 175.28 2ull n ASN 219 N -4.21 0.22 0.00 3.07 6.94 -1.26 -4.88 115.26 115.13 2ull n ASN 219 Ca -0.03 -1.66 0.00 0.00 -0.02 0.00 0.00 54.58 52.87 2ull n ASN 219 Cb 0.13 -0.02 0.00 0.00 -2.36 0.00 0.00 39.78 37.53 2ull n ASN 219 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2ull n GLY 219 N 0.73 0.81 3.43 4.83 0.00 -0.24 -5.00 105.19 109.76 2ull n GLY 219 Ca 0.09 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.97 2ull n GLY 219 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ull s ASN 219 N -2.64 0.78 -0.14 1.61 2.20 -1.26 -1.43 114.94 114.06 2ull s ASN 219 Ca 0.00 -1.43 0.16 0.00 -0.94 0.00 0.00 52.86 50.65 2ull s ASN 219 Cb 0.00 0.59 0.32 0.00 -2.00 0.00 0.00 41.25 40.16 2ull s ASN 219 CO 0.00 -1.17 1.16 -0.46 -2.94 0.00 0.00 177.10 173.69 2ull n ASN 220 N -1.11 2.01 0.16 3.54 0.23 -0.62 -0.84 115.26 118.62 2ull n ASN 220 Ca 0.02 -3.24 0.13 0.00 -0.53 0.00 0.00 54.58 50.96 2ull n ASN 220 Cb 0.62 -0.44 0.45 0.00 -2.08 0.00 0.00 39.78 38.33 2ull n ASN 220 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2ull n GLY 221 N 0.60 1.91 3.55 0.00 0.00 -1.26 -4.96 105.19 105.03 2ull n GLY 221 Ca 0.03 -0.67 -0.26 0.00 0.00 0.00 0.00 46.02 45.12 2ull n GLY 221 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2ull s ILE 222 N -1.18 2.07 0.43 -0.61 -4.36 -1.21 -5.12 121.20 111.22 2ull s ILE 222 Ca 0.42 -2.13 -0.25 0.00 -0.26 0.00 0.00 60.65 58.43 2ull s ILE 222 Cb 0.22 -2.74 -0.09 0.00 1.25 0.00 0.00 42.46 41.09 2ull s ILE 222 CO 0.28 -0.14 1.27 -2.65 0.24 0.00 0.00 174.94 173.94 2ull n PRO 222 N -0.82 1.89 -0.18 0.37 -0.02 -1.26 -4.87 135.00 130.10 2ull n PRO 222 Ca -0.05 0.68 -0.01 0.00 -2.02 0.00 0.00 63.50 62.09 2ull n PRO 222 Cb 0.65 -2.39 0.09 0.00 -0.02 0.00 0.00 33.50 31.83 2ull n PRO 222 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ull h ALA 222 N 2.02 0.68 -0.06 3.55 0.00 -1.94 0.66 119.26 124.17 2ull h ALA 222 Ca -0.48 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 2ull h ALA 222 Cb 1.30 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.17 2ull h ALA 222 CO 0.60 -0.24 0.03 0.66 0.00 0.00 0.00 179.25 180.29 2ull h SER 222 N 0.33 0.06 0.60 0.00 4.64 -1.92 -1.53 113.55 115.74 2ull h SER 222 Ca 0.28 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 2ull h SER 222 Cb 0.35 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 2ull h SER 222 CO -0.31 0.05 -0.10 0.00 -0.87 0.00 0.00 176.83 175.60 2ull n GLN 223 N -4.52 0.35 -3.46 4.77 3.00 0.17 -4.88 117.38 112.81 2ull n GLN 223 Ca -0.02 -0.08 -0.38 0.00 -0.01 0.00 0.00 57.00 56.51 2ull n GLN 223 Cb 0.09 -1.50 -0.06 0.00 0.00 0.00 0.00 30.24 28.77 2ull n GLN 223 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.06 178.09 2ull s ARG 224 N -2.70 3.95 -0.29 -1.09 0.52 -0.58 -4.94 118.95 113.82 2ull s ARG 224 Ca 0.23 0.44 -0.01 0.00 -0.52 0.00 0.00 55.73 55.87 2ull s ARG 224 Cb 0.19 -3.18 0.09 0.00 0.52 0.00 0.00 34.95 32.58 2ull s ARG 224 CO 0.52 0.66 0.09 0.45 0.02 0.00 0.00 175.30 177.03 2ull s SER 225 N -1.20 3.88 -0.29 0.23 0.15 -1.26 -4.65 113.70 110.55 2ull s SER 225 Ca 0.27 -1.51 -0.02 0.00 0.70 0.00 0.00 55.95 55.39 2ull s SER 225 Cb -0.17 -0.83 0.04 0.00 -1.71 0.00 0.00 66.02 63.36 2ull s SER 225 CO 0.15 -0.40 -0.01 -0.44 1.20 0.00 0.00 173.24 173.74 2ull s SER 226 N 1.65 4.77 -0.19 5.45 0.01 -0.75 -1.71 113.70 122.94 2ull s SER 226 Ca 0.08 -1.19 -0.09 0.00 1.31 0.00 0.00 55.95 56.06 2ull s SER 226 Cb -0.17 -1.70 -0.05 0.00 0.21 0.00 0.00 66.02 64.31 2ull s SER 226 CO -0.23 -0.23 0.10 -0.76 0.41 0.00 0.00 173.24 172.53 2ull s LEU 227 N 1.27 4.03 0.12 2.44 1.43 0.33 -1.00 118.68 127.29 2ull s LEU 227 Ca -0.04 0.17 0.10 0.00 -1.03 0.00 0.00 54.13 53.33 2ull s LEU 227 Cb -0.19 -2.03 -0.04 0.00 0.03 0.00 0.00 46.19 43.96 2ull s LEU 227 CO -0.02 0.18 -0.25 0.72 0.23 0.00 0.00 176.35 177.21 2ull s PHE 228 N 0.32 2.18 -0.15 0.29 -0.12 0.13 -0.86 117.98 119.77 2ull s PHE 228 Ca 0.06 -0.39 -0.24 0.00 -0.05 0.00 0.00 56.93 56.30 2ull s PHE 228 Cb -0.12 -1.18 -0.02 0.00 -0.63 0.00 0.00 43.02 41.07 2ull s PHE 228 CO -0.01 0.31 0.78 -2.00 -0.05 0.00 0.00 175.22 174.25 2ull s GLU 229 N -2.03 4.32 0.34 1.99 2.56 0.18 -1.25 118.70 124.81 2ull s GLU 229 Ca 0.12 0.95 -0.28 0.00 0.00 0.00 0.00 54.97 55.76 2ull s GLU 229 Cb -0.10 -3.55 -0.12 0.00 2.00 0.00 0.00 34.13 32.36 2ull s GLU 229 CO 0.06 -0.23 1.31 0.54 -0.56 0.00 0.00 175.26 176.38 2ull n ARG 230 N 4.87 2.17 -0.04 4.30 1.74 -1.26 -1.12 116.66 127.32 2ull n ARG 230 Ca 0.03 0.76 -0.16 0.00 -0.77 0.00 0.00 57.85 57.71 2ull n ARG 230 Cb 0.49 -2.36 -0.07 0.00 -1.02 0.00 0.00 32.46 29.50 2ull n ARG 230 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2ull h LEU 231 N 2.70 0.70 -0.54 0.55 5.85 -1.58 -3.36 115.31 119.63 2ull h LEU 231 Ca -0.46 -0.61 0.11 0.00 0.84 0.00 0.00 57.88 57.76 2ull h LEU 231 Cb 1.28 -0.20 -0.10 0.00 0.37 0.00 0.00 40.66 42.00 2ull h LEU 231 CO 0.64 1.19 -0.17 1.56 -0.34 0.00 0.00 178.44 181.31 2ull h GLN 232 N 0.25 -0.04 0.00 1.25 4.20 -1.90 -0.61 115.11 118.27 2ull h GLN 232 Ca -0.02 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.66 2ull h GLN 232 Cb 1.14 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.92 2ull h GLN 232 CO 0.11 -0.03 -0.13 -1.00 -0.67 0.00 0.00 178.83 177.11 2ull h PRO 233 N -0.04 0.00 -0.12 1.46 0.13 -1.99 -1.86 132.00 129.57 2ull h PRO 233 Ca 0.26 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.31 2ull h PRO 233 Cb 0.43 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.56 2ull h PRO 233 CO -0.58 0.13 -0.23 0.82 -0.23 0.00 0.00 178.00 177.92 2ull h ILE 234 N 0.00 1.38 -0.25 -3.56 2.04 -1.29 -1.41 117.51 114.41 2ull h ILE 234 Ca -0.00 -1.49 0.01 0.00 1.00 0.00 0.00 64.86 64.38 2ull h ILE 234 Cb 0.37 2.05 -0.02 0.00 -0.74 0.00 0.00 36.82 38.49 2ull h ILE 234 CO 0.02 0.44 0.15 -0.07 0.00 0.00 0.00 178.15 178.68 2ull h LEU 235 N -0.05 0.25 -0.67 1.44 3.38 -0.83 -2.58 115.31 116.24 2ull h LEU 235 Ca 0.01 -0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 2ull h LEU 235 Cb 0.81 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 2ull h LEU 235 CO 0.05 0.18 -0.62 0.77 0.09 0.00 0.00 178.44 178.91 2ull h SER 236 N 0.31 0.17 -0.73 -0.43 4.64 -1.41 0.17 113.55 116.26 2ull h SER 236 Ca 0.10 -0.10 -0.05 0.00 -0.47 0.00 0.00 61.79 61.26 2ull h SER 236 Cb -0.01 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 62.00 2ull h SER 236 CO -0.04 0.75 0.25 -0.61 -0.87 0.00 0.00 176.83 176.31 2ull h GLN 237 N 0.11 1.13 -0.43 4.77 4.15 -1.06 -3.14 115.11 120.64 2ull h GLN 237 Ca -0.01 -0.23 0.00 0.00 0.77 0.00 0.00 58.65 59.18 2ull h GLN 237 Cb 1.12 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 28.64 2ull h GLN 237 CO 0.09 0.95 0.00 0.66 -1.93 0.00 0.00 178.83 178.60 2ull n TYR 238 N -4.26 0.57 -3.34 3.99 4.01 -0.99 -4.97 117.16 112.17 2ull n TYR 238 Ca 0.06 -0.47 -0.22 0.00 -0.16 0.00 0.00 57.90 57.11 2ull n TYR 238 Cb 0.22 -0.02 0.06 0.00 -0.31 0.00 0.00 39.34 39.29 2ull n TYR 238 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2ull n GLY 239 N 0.81 -0.43 3.89 2.72 0.00 -0.40 -4.99 105.19 106.80 2ull n GLY 239 Ca 0.15 0.15 -0.33 0.00 0.00 0.00 0.00 46.02 45.98 2ull n GLY 239 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ull s LEU 240 N -6.63 4.31 -0.08 0.99 1.43 0.45 -4.66 118.68 114.48 2ull s LEU 240 Ca 0.46 0.63 0.05 0.00 -1.03 0.00 0.00 54.13 54.23 2ull s LEU 240 Cb -0.20 -3.11 -0.00 0.00 0.03 0.00 0.00 46.19 42.91 2ull s LEU 240 CO 0.57 0.12 -0.24 -0.44 0.23 0.00 0.00 176.35 176.59 2ull s SER 241 N -2.14 2.98 0.30 2.29 0.01 -0.40 -4.68 113.70 112.08 2ull s SER 241 Ca 0.36 -0.52 -0.29 0.00 1.31 0.00 0.00 55.95 56.81 2ull s SER 241 Cb -0.13 -1.13 -0.10 0.00 0.21 0.00 0.00 66.02 64.87 2ull s SER 241 CO 0.22 0.19 1.24 -0.22 0.41 0.00 0.00 173.24 175.07 2ull s LEU 242 N 0.14 4.47 -0.25 2.44 2.96 -1.26 -0.77 118.68 126.41 2ull s LEU 242 Ca -0.12 2.53 -0.25 0.00 -0.22 0.00 0.00 54.13 56.07 2ull s LEU 242 Cb -0.16 -3.64 -0.00 0.00 0.50 0.00 0.00 46.19 42.89 2ull s LEU 242 CO 0.06 -0.41 0.87 -0.69 -1.32 0.00 0.00 176.35 174.86 2ull s VAL 243 N -1.03 4.80 0.31 1.68 1.01 -0.76 -4.88 120.40 121.53 2ull s VAL 243 Ca 0.48 1.62 0.10 0.00 0.00 0.00 0.00 61.98 64.18 2ull s VAL 243 Cb -0.37 -4.16 -0.06 0.00 0.00 0.00 0.00 36.38 31.79 2ull s VAL 243 CO 0.48 -0.12 -0.13 0.42 0.00 0.00 0.00 175.10 175.75 2ull s THR 244 N 2.94 2.24 0.00 3.92 -4.23 -1.26 -4.32 115.64 114.93 2ull s THR 244 Ca 0.36 -2.26 0.00 0.00 -1.18 0.00 0.00 61.69 58.61 2ull s THR 244 Cb -0.15 -2.50 0.00 0.00 1.34 0.00 0.00 72.50 71.19 2ull s THR 244 CO 0.08 -0.29 0.00 0.61 -0.54 0.00 0.00 174.62 174.48