#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 6.63 -0.44 0.00 -0.87 -1.26 -1.24 114.94 117.76 2ull s ASN 15 Ca 0.00 0.65 -0.27 0.00 -1.57 0.00 0.00 52.86 51.67 2ull s ASN 15 Cb 0.00 -2.39 0.03 0.00 -0.02 0.00 0.00 41.25 38.87 2ull s ASN 15 CO 0.00 -0.56 0.99 -0.63 -2.57 0.00 0.00 177.10 174.33 2ull s ILE 16 N 2.83 4.42 -0.02 0.60 -1.09 0.11 -4.97 121.20 123.08 2ull s ILE 16 Ca 0.30 1.00 0.04 0.00 -2.23 0.00 0.00 60.65 59.76 2ull s ILE 16 Cb -0.14 -4.46 -0.01 0.00 -1.58 0.00 0.00 42.46 36.27 2ull s ILE 16 CO 0.12 -0.81 -0.14 -0.69 -1.23 0.00 0.00 174.94 172.19 2ull s VAL 17 N 3.88 1.12 0.33 2.92 1.01 -1.26 -2.65 120.40 125.75 2ull s VAL 17 Ca 0.40 -0.58 -0.29 0.00 0.00 0.00 0.00 61.98 61.52 2ull s VAL 17 Cb -0.10 -0.95 -0.11 0.00 0.00 0.00 0.00 36.38 35.22 2ull s VAL 17 CO 0.26 0.32 1.51 -0.83 0.00 0.00 0.00 175.10 176.36 2ull s GLY 18 N -0.13 2.61 0.00 4.51 0.00 -0.09 -2.93 107.32 111.29 2ull s GLY 18 Ca 0.01 1.53 0.00 0.00 0.00 0.00 0.00 44.72 46.27 2ull s GLY 18 CO 0.00 2.34 0.00 0.61 0.00 0.00 0.00 173.10 176.05 2ull n GLY 19 N 1.21 2.48 3.83 0.20 0.00 0.54 -0.77 105.19 112.68 2ull n GLY 19 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.48 4.20 0.42 -0.61 -4.36 -1.15 -2.56 121.20 114.66 2ull s ILE 31 Ca 0.00 0.86 -0.23 0.00 -0.26 0.00 0.00 60.65 61.02 2ull s ILE 31 Cb 0.00 -3.55 -0.09 0.00 1.25 0.00 0.00 42.46 40.07 2ull s ILE 31 CO 0.00 -0.80 1.02 -0.70 0.24 0.00 0.00 174.94 174.70 2ull s GLU 32 N -4.64 4.12 -0.01 0.37 2.12 -1.26 -0.80 118.70 118.60 2ull s GLU 32 Ca 0.59 1.39 -0.18 0.00 0.36 0.00 0.00 54.97 57.13 2ull s GLU 32 Cb -0.13 -2.39 0.03 0.00 0.26 0.00 0.00 34.13 31.90 2ull s GLU 32 CO 0.46 -0.16 0.39 1.52 -0.54 0.00 0.00 175.26 176.92 2ull s TYR 33 N -1.82 -0.27 0.18 5.30 1.13 -0.81 -4.79 117.35 116.27 2ull s TYR 33 Ca 0.60 0.38 0.06 0.00 -1.41 0.00 0.00 57.07 56.70 2ull s TYR 33 Cb -0.18 0.17 -0.04 0.00 -1.10 0.00 0.00 41.96 40.81 2ull s TYR 33 CO 0.23 -0.46 0.08 -1.54 -2.51 0.00 0.00 175.55 171.34 2ull s SER 34 N -1.47 5.17 -0.22 -0.18 1.04 -0.36 -1.45 113.70 116.23 2ull s SER 34 Ca -0.11 -0.28 -0.01 0.00 0.48 0.00 0.00 55.95 56.03 2ull s SER 34 Cb -0.03 -1.24 0.02 0.00 0.10 0.00 0.00 66.02 64.87 2ull s SER 34 CO 0.04 0.06 -0.10 -0.63 0.98 0.00 0.00 173.24 173.59 2ull s ILE 35 N -1.82 2.70 -1.47 -1.02 1.09 -0.16 -1.43 121.20 119.09 2ull s ILE 35 Ca 0.30 -0.92 -0.12 0.00 -1.10 0.00 0.00 60.65 58.81 2ull s ILE 35 Cb -0.09 -2.29 0.08 0.00 -1.06 0.00 0.00 42.46 39.10 2ull s ILE 35 CO 0.21 0.33 0.75 0.59 -0.10 0.00 0.00 174.94 176.73 2ull n ASN 36 N 4.67 -4.37 -3.02 3.58 3.02 -0.33 -1.51 115.26 117.29 2ull n ASN 36 Ca -0.18 -0.63 -0.22 0.00 -0.03 0.00 0.00 54.58 53.52 2ull n ASN 36 Cb 0.48 -3.54 0.02 0.00 -0.61 0.00 0.00 39.78 36.14 2ull n ASN 36 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2ull n ASN 38 N -2.58 -5.58 0.00 6.41 2.85 -1.26 -4.85 115.26 110.24 2ull n ASN 38 Ca 0.01 -0.27 0.00 0.00 -0.11 0.00 0.00 54.58 54.21 2ull n ASN 38 Cb 0.53 -4.54 0.00 0.00 1.24 0.00 0.00 39.78 37.01 2ull n ASN 38 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2ull n ALA 39 N -3.40 1.33 -1.60 5.20 0.00 -0.57 -5.11 120.51 116.36 2ull n ALA 39 Ca -0.11 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.00 2ull n ALA 39 Cb 0.61 0.00 0.03 0.00 0.00 0.00 0.00 19.45 20.09 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 5.38 -0.12 0.00 0.01 -1.21 -4.77 113.70 113.99 2ull s SER 40 Ca 0.00 2.00 0.02 0.00 1.31 0.00 0.00 55.95 59.28 2ull s SER 40 Cb 0.00 -2.55 -0.01 0.00 0.21 0.00 0.00 66.02 63.67 2ull s SER 40 CO 0.00 -1.45 -0.18 -0.76 0.41 0.00 0.00 173.24 171.26 2ull s LEU 41 N -4.56 2.39 0.00 2.44 1.43 -1.26 -0.99 118.68 118.14 2ull s LEU 41 Ca 0.67 -0.45 0.02 0.00 -1.03 0.00 0.00 54.13 53.34 2ull s LEU 41 Cb -0.20 -1.51 -0.01 0.00 0.03 0.00 0.00 46.19 44.50 2ull s LEU 41 CO 0.37 0.15 0.06 0.00 0.23 0.00 0.00 176.35 177.16 2ull s SER 43 N -2.10 2.88 0.29 0.00 0.01 0.40 -1.93 113.70 113.26 2ull s SER 43 Ca 0.08 -0.61 -0.29 0.00 1.31 0.00 0.00 55.95 56.44 2ull s SER 43 Cb 0.00 -0.23 -0.10 0.00 0.21 0.00 0.00 66.02 65.91 2ull s SER 43 CO 0.06 0.18 1.20 -0.69 0.41 0.00 0.00 173.24 174.40 2ull s VAL 44 N -0.90 3.18 0.00 3.43 1.01 0.02 -3.00 120.40 124.13 2ull s VAL 44 Ca 0.10 1.16 0.00 0.00 0.00 0.00 0.00 61.98 63.24 2ull s VAL 44 Cb -0.10 -3.74 0.00 0.00 0.00 0.00 0.00 36.38 32.55 2ull s VAL 44 CO 0.03 0.26 0.00 0.61 0.00 0.00 0.00 175.10 176.00 2ull n GLY 44 N 1.19 1.03 3.18 4.51 0.00 -0.10 -0.34 105.19 114.66 2ull n GLY 44 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.18 0.21 1.61 0.08 -1.15 -4.06 117.98 114.49 2ull s PHE 45 Ca 0.00 0.37 -0.30 0.00 0.12 0.00 0.00 56.93 57.12 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 -0.27 1.28 -1.12 -0.10 0.00 0.00 175.22 175.01 2ull s SER 46 N -0.75 6.93 0.20 1.36 0.01 -1.26 -1.31 113.70 118.88 2ull s SER 46 Ca -0.08 2.39 -0.03 0.00 1.31 0.00 0.00 55.95 59.53 2ull s SER 46 Cb -0.04 -2.61 -0.03 0.00 0.21 0.00 0.00 66.02 63.54 2ull s SER 46 CO 0.02 -0.49 0.18 0.68 0.41 0.00 0.00 173.24 174.04 2ull s VAL 47 N -0.04 0.01 0.08 3.43 -7.23 -0.12 -2.04 120.40 114.49 2ull s VAL 47 Ca 0.55 -1.87 0.05 0.00 -1.81 0.00 0.00 61.98 58.90 2ull s VAL 47 Cb -0.36 -2.38 -0.03 0.00 0.56 0.00 0.00 36.38 34.18 2ull s VAL 47 CO 0.39 -0.06 -0.15 0.42 -0.31 0.00 0.00 175.10 175.39 2ull s THR 48 N -4.12 1.17 -0.41 5.32 -4.23 -0.16 -1.76 115.64 111.46 2ull s THR 48 Ca 0.34 -1.34 0.02 0.00 -1.18 0.00 0.00 61.69 59.52 2ull s THR 48 Cb 0.06 -1.13 0.15 0.00 1.34 0.00 0.00 72.50 72.91 2ull s THR 48 CO 0.10 -0.22 0.27 -0.60 -0.54 0.00 0.00 174.62 173.63 2ull s ARG 48 N -1.80 0.92 7.22 3.99 3.52 -0.33 -1.22 118.95 131.27 2ull s ARG 48 Ca -0.01 -1.82 0.00 0.00 -0.13 0.00 0.00 55.73 53.78 2ull s ARG 48 Cb -0.10 -1.69 0.00 0.00 -1.56 0.00 0.00 34.95 31.61 2ull s ARG 48 CO 0.02 -1.25 0.00 0.41 -0.81 0.00 0.00 175.30 173.67 2ull n GLY 48 N 3.47 2.31 0.20 8.12 0.00 -1.26 -2.20 105.19 115.83 2ull n GLY 48 Ca 0.17 -0.33 0.12 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.57 1.00 -2.43 4.61 0.00 -2.03 -3.45 119.26 116.39 2ull h ALA 48 Ca 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.36 2ull h ALA 48 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2ull h ALA 48 CO 0.00 0.00 0.36 0.99 0.00 0.00 0.00 179.25 180.60 2ull s THR 49 N -3.19 4.88 0.51 0.00 2.01 -0.93 -5.05 115.64 113.86 2ull s THR 49 Ca 0.08 1.92 -0.10 0.00 0.31 0.00 0.00 61.69 63.89 2ull s THR 49 Cb 0.06 -4.26 -0.05 0.00 0.01 0.00 0.00 72.50 68.26 2ull s THR 49 CO 0.65 0.13 0.89 -0.54 -0.69 0.00 0.00 174.62 175.07 2ull s LYS 50 N 1.26 3.70 0.03 4.92 1.02 -1.26 -1.19 119.74 128.22 2ull s LYS 50 Ca 0.48 0.57 -0.27 0.00 0.02 0.00 0.00 55.97 56.77 2ull s LYS 50 Cb -0.20 -2.25 0.09 0.00 -0.52 0.00 0.00 37.83 34.96 2ull s LYS 50 CO 0.23 -0.28 1.23 0.20 -0.92 0.00 0.00 175.35 175.81 2ull s GLY 51 N -3.68 -0.07 -0.04 -3.33 0.00 -0.72 -0.94 107.32 98.54 2ull s GLY 51 Ca 0.53 -0.04 -0.03 0.00 0.00 0.00 0.00 44.72 45.17 2ull s GLY 51 CO 0.41 4.83 0.09 -0.11 0.00 0.00 0.00 173.10 178.33 2ull s PHE 52 N -2.06 -0.10 0.37 1.90 -0.12 -0.74 -0.95 117.98 116.27 2ull s PHE 52 Ca 0.28 0.25 -0.14 0.00 -0.05 0.00 0.00 56.93 57.27 2ull s PHE 52 Cb -0.01 0.03 -0.08 0.00 -0.63 0.00 0.00 43.02 42.33 2ull s PHE 52 CO 0.01 -0.05 0.77 0.14 -0.05 0.00 0.00 175.22 176.04 2ull s VAL 53 N 0.06 4.69 0.03 -2.49 -7.23 -0.43 -0.94 120.40 114.10 2ull s VAL 53 Ca -0.00 0.88 -0.01 0.00 -1.81 0.00 0.00 61.98 61.04 2ull s VAL 53 Cb -0.01 -3.65 0.00 0.00 0.56 0.00 0.00 36.38 33.28 2ull s VAL 53 CO 0.00 -0.33 0.06 1.07 -0.31 0.00 0.00 175.10 175.59 2ull n THR 54 N -0.75 0.00 -3.05 5.32 5.66 -0.17 -0.93 114.28 120.36 2ull n THR 54 Ca 0.03 -0.07 -0.36 0.00 -3.05 0.00 0.00 64.05 60.60 2ull n THR 54 Cb 0.53 0.07 -0.06 0.00 -1.55 0.00 0.00 70.33 69.33 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 -1.08 3.38 0.30 1.79 0.00 -1.26 -1.61 121.76 123.28 2ull s ALA 55 Ca 0.01 0.22 0.19 0.00 0.00 0.00 0.00 51.96 52.39 2ull s ALA 55 Cb -0.00 -2.88 0.92 0.00 0.00 0.00 0.00 23.12 21.16 2ull s ALA 55 CO 0.01 0.30 1.86 0.78 0.00 0.00 0.00 175.76 178.71 2ull h GLY 56 N 3.35 0.00 1.17 0.00 0.00 -1.59 -2.59 103.07 103.41 2ull h GLY 56 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 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 -3.74 0.00 0.11 5.60 1.44 -1.26 -3.20 115.22 114.17 2ull n HIS 57 Ca -0.01 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.69 2ull n HIS 57 Cb 0.39 -0.09 -0.01 0.00 0.12 0.00 0.00 29.99 30.40 2ull n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2ull n GLY 59 N 1.24 1.96 3.31 0.00 0.00 -1.19 -4.82 105.19 105.68 2ull n GLY 59 Ca 0.01 -0.96 -0.18 0.00 0.00 0.00 0.00 46.02 44.89 2ull n GLY 59 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ull s THR 59 N -2.91 1.56 0.22 2.61 -4.23 -1.26 -4.95 115.64 106.69 2ull s THR 59 Ca 0.00 -2.06 -0.32 0.00 -1.18 0.00 0.00 61.69 58.14 2ull s THR 59 Cb 0.00 -1.89 -0.12 0.00 1.34 0.00 0.00 72.50 71.83 2ull s THR 59 CO 0.00 -0.56 1.63 0.52 -0.54 0.00 0.00 174.62 175.67 2ull n VAL 59 N -0.10 0.37 0.00 2.29 0.31 -1.26 -1.60 118.33 118.34 2ull n VAL 59 Ca -0.10 -0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.13 2ull n VAL 59 Cb 0.59 -1.83 0.00 0.00 -0.91 0.00 0.00 33.84 31.69 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 3.19 0.00 -4.76 4.52 5.03 0.00 -4.96 115.26 118.29 2ull n ASN 60 Ca 0.14 0.00 -0.41 0.00 0.87 0.00 0.00 54.58 55.18 2ull n ASN 60 Cb 0.34 0.00 -0.02 0.00 -1.02 0.00 0.00 39.78 39.08 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 -2.47 3.58 -0.01 5.41 0.00 -0.63 -4.63 121.76 123.01 2ull s ALA 61 Ca 0.00 1.38 -0.24 0.00 0.00 0.00 0.00 51.96 53.10 2ull s ALA 61 Cb 0.00 -3.55 -0.05 0.00 0.00 0.00 0.00 23.12 19.53 2ull s ALA 61 CO 0.00 -0.80 0.72 0.99 0.00 0.00 0.00 175.76 176.67 2ull s THR 62 N -0.65 4.90 -0.07 0.00 2.01 -1.26 -0.87 115.64 119.70 2ull s THR 62 Ca 0.54 1.51 -0.07 0.00 0.31 0.00 0.00 61.69 63.98 2ull s THR 62 Cb -0.43 -4.06 -0.04 0.00 0.01 0.00 0.00 72.50 67.98 2ull s THR 62 CO 0.51 0.31 0.20 0.00 -0.69 0.00 0.00 174.62 174.96 2ull s ALA 64 N 0.34 3.86 -0.04 7.40 0.00 -0.15 -1.19 121.76 131.99 2ull s ALA 64 Ca 0.37 -0.59 0.04 0.00 0.00 0.00 0.00 51.96 51.78 2ull s ALA 64 Cb -0.19 -2.03 -0.00 0.00 0.00 0.00 0.00 23.12 20.90 2ull s ALA 64 CO 0.20 0.62 -0.15 1.03 0.00 0.00 0.00 175.76 177.46 2ull s ARG 65 N -1.26 1.56 -0.05 0.00 0.52 -0.51 -1.35 118.95 117.87 2ull s ARG 65 Ca 0.19 -0.54 0.03 0.00 -0.52 0.00 0.00 55.73 54.89 2ull s ARG 65 Cb -0.13 -1.39 0.01 0.00 0.52 0.00 0.00 34.95 33.96 2ull s ARG 65 CO 0.09 0.22 -0.11 0.42 0.02 0.00 0.00 175.30 175.94 2ull s ILE 66 N 0.04 1.02 -1.43 1.52 1.01 -0.49 -1.22 121.20 121.65 2ull s ILE 66 Ca -0.03 -0.45 0.00 0.00 0.00 0.00 0.00 60.65 60.17 2ull s ILE 66 Cb -0.10 -0.92 0.00 0.00 0.01 0.00 0.00 42.46 41.45 2ull s ILE 66 CO 0.02 0.32 0.00 0.61 0.00 0.00 0.00 174.94 175.88 2ull n GLY 67 N 3.54 0.90 3.14 6.18 0.00 -1.26 -1.92 105.19 115.78 2ull n GLY 67 Ca -0.21 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.49 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 -1.15 1.76 3.82 -0.02 0.00 -1.26 -5.01 105.19 103.34 2ull n GLY 81 Ca -0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.62 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 -3.28 3.62 0.27 4.61 0.00 -0.81 -5.02 121.76 121.15 2ull s ALA 82 Ca 0.00 -1.25 -0.29 0.00 0.00 0.00 0.00 51.96 50.41 2ull s ALA 82 Cb 0.00 -1.39 -0.10 0.00 0.00 0.00 0.00 23.12 21.63 2ull s ALA 82 CO 0.00 0.43 1.30 0.08 0.00 0.00 0.00 175.76 177.57 2ull s VAL 83 N -1.86 2.97 0.00 0.00 1.01 -1.26 -1.40 120.40 119.85 2ull s VAL 83 Ca 0.32 0.88 0.00 0.00 0.00 0.00 0.00 61.98 63.18 2ull s VAL 83 Cb -0.10 -3.56 0.00 0.00 0.00 0.00 0.00 36.38 32.72 2ull s VAL 83 CO 0.24 0.18 0.00 1.33 0.00 0.00 0.00 175.10 176.85 2ull n VAL 84 N 1.67 0.00 -3.93 2.92 0.24 -0.46 -4.86 118.33 113.90 2ull n VAL 84 Ca 0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.33 2ull n VAL 84 Cb 0.42 -0.45 0.00 0.00 -1.47 0.00 0.00 33.84 32.34 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 2.07 0.44 3.05 7.63 0.00 -1.23 -1.61 105.19 115.54 2ull n GLY 85 Ca 0.00 -0.79 -0.12 0.00 0.00 0.00 0.00 46.02 45.11 2ull n GLY 85 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ull s THR 87 N -2.02 0.43 -0.42 2.61 -4.23 -0.63 -0.97 115.64 110.40 2ull s THR 87 Ca 0.00 -1.08 -0.28 0.00 -1.18 0.00 0.00 61.69 59.15 2ull s THR 87 Cb 0.00 -0.57 -0.02 0.00 1.34 0.00 0.00 72.50 73.24 2ull s THR 87 CO 0.00 -0.44 1.87 -0.36 -0.54 0.00 0.00 174.62 175.15 2ull s PHE 88 N -1.52 1.70 0.25 3.99 0.40 -0.05 -0.83 117.98 121.92 2ull s PHE 88 Ca -0.10 0.74 0.07 0.00 -0.60 0.00 0.00 56.93 57.03 2ull s PHE 88 Cb -0.09 -4.08 0.28 0.00 0.51 0.00 0.00 43.02 39.64 2ull s PHE 88 CO -0.00 -2.74 1.57 0.00 0.70 0.00 0.00 175.22 174.75 2ull h ALA 88 N 14.00 0.89 -1.53 5.36 0.00 -1.53 0.04 119.26 136.49 2ull h ALA 88 Ca -0.31 -0.56 0.11 0.00 0.00 0.00 0.00 54.91 54.16 2ull h ALA 88 Cb 1.17 -0.09 -0.23 0.00 0.00 0.00 0.00 17.79 18.64 2ull h ALA 88 CO 1.10 0.76 0.62 0.00 0.00 0.00 0.00 179.25 181.72 2ull s ALA 89 N -3.67 -1.96 -0.04 0.00 0.00 -1.22 -4.85 121.76 110.02 2ull s ALA 89 Ca -0.03 1.60 -0.27 0.00 0.00 0.00 0.00 51.96 53.27 2ull s ALA 89 Cb 0.12 -0.74 0.06 0.00 0.00 0.00 0.00 23.12 22.56 2ull s ALA 89 CO 0.78 -0.33 0.58 -0.98 0.00 0.00 0.00 175.76 175.81 2ull s ARG 90 N -1.27 0.96 -0.11 0.00 1.04 -1.26 -2.11 118.95 116.21 2ull s ARG 90 Ca 0.01 0.12 0.00 0.00 -1.04 0.00 0.00 55.73 54.82 2ull s ARG 90 Cb -0.01 0.45 0.02 0.00 -2.04 0.00 0.00 34.95 33.38 2ull s ARG 90 CO -0.01 -0.30 -0.09 0.08 -0.04 0.00 0.00 175.30 174.95 2ull s VAL 91 N -1.28 1.07 -0.29 4.99 1.01 -0.11 -5.00 120.40 120.80 2ull s VAL 91 Ca -0.11 -0.34 -0.16 0.00 0.00 0.00 0.00 61.98 61.37 2ull s VAL 91 Cb -0.01 -1.07 0.16 0.00 0.00 0.00 0.00 36.38 35.46 2ull s VAL 91 CO 0.08 0.37 1.04 0.12 0.00 0.00 0.00 175.10 176.71 2ull s PHE 94 N 1.52 -0.47 0.00 5.22 5.36 -1.24 -1.60 117.98 126.77 2ull s PHE 94 Ca 0.02 0.94 0.00 0.00 -0.96 0.00 0.00 56.93 56.93 2ull s PHE 94 Cb -0.13 0.29 0.00 0.00 -0.34 0.00 0.00 43.02 42.84 2ull s PHE 94 CO -0.06 -0.23 0.00 -0.35 -1.46 0.00 0.00 175.22 173.11 2ull n PRO 95 N 3.52 3.05 0.00 10.12 -0.04 -1.26 -4.99 135.00 145.39 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 5.00 2.12 3.79 0.55 0.00 0.03 -4.73 105.19 111.95 2ull n GLY 100 Ca 0.00 -0.22 -0.29 0.00 0.00 0.00 0.00 46.02 45.51 2ull n GLY 100 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2ull s ASN 101 N -0.66 4.33 -0.41 1.61 0.01 -1.26 -1.69 114.94 116.86 2ull s ASN 101 Ca 0.00 -1.40 0.05 0.00 -0.71 0.00 0.00 52.86 50.80 2ull s ASN 101 Cb 0.00 0.25 0.19 0.00 0.41 0.00 0.00 41.25 42.10 2ull s ASN 101 CO 0.00 -0.85 0.41 -0.67 -1.51 0.00 0.00 177.10 174.48 2ull n ASP 102 N -1.40 -0.58 -4.04 -1.22 -0.08 -1.22 -3.70 116.55 104.30 2ull n ASP 102 Ca -0.09 -2.49 -0.08 0.00 -1.51 0.00 0.00 54.79 50.62 2ull n ASP 102 Cb 0.66 -0.38 -0.10 0.00 2.34 0.00 0.00 41.12 43.63 2ull n ASP 102 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2ull s ARG 103 N -0.15 0.58 -0.07 -0.67 1.70 -0.63 -3.54 118.95 116.18 2ull s ARG 103 Ca 0.33 -1.08 -0.31 0.00 -0.47 0.00 0.00 55.73 54.20 2ull s ARG 103 Cb 0.07 0.21 0.12 0.00 -0.57 0.00 0.00 34.95 34.77 2ull s ARG 103 CO -0.17 -0.12 1.00 0.00 -1.08 0.00 0.00 175.30 174.93 2ull s ALA 104 N -3.47 -1.91 0.01 7.88 0.00 -0.63 -0.93 121.76 122.71 2ull s ALA 104 Ca 0.03 1.23 0.00 0.00 0.00 0.00 0.00 51.96 53.22 2ull s ALA 104 Cb 0.05 0.21 -0.01 0.00 0.00 0.00 0.00 23.12 23.36 2ull s ALA 104 CO -0.08 -0.65 -0.02 1.67 0.00 0.00 0.00 175.76 176.68 2ull s TRP 105 N -2.83 0.18 -0.22 0.00 1.48 -0.89 -1.00 118.94 115.65 2ull s TRP 105 Ca 0.06 -0.22 -0.05 0.00 -1.06 0.00 0.00 56.10 54.83 2ull s TRP 105 Cb -0.01 -0.12 -0.02 0.00 -1.16 0.00 0.00 33.47 32.16 2ull s TRP 105 CO -0.07 -0.07 -0.01 0.08 -4.06 0.00 0.00 176.95 172.82 2ull s VAL 106 N -0.59 3.69 -0.16 -0.66 1.01 -0.11 -1.28 120.40 122.30 2ull s VAL 106 Ca -0.06 -0.39 -0.25 0.00 0.00 0.00 0.00 61.98 61.28 2ull s VAL 106 Cb -0.04 -2.69 -0.02 0.00 0.00 0.00 0.00 36.38 33.63 2ull s VAL 106 CO -0.00 0.40 0.82 -0.94 0.00 0.00 0.00 175.10 175.38 2ull s SER 107 N 1.43 6.97 0.32 3.32 1.04 -0.01 -1.80 113.70 124.98 2ull s SER 107 Ca 0.05 1.18 0.05 0.00 0.48 0.00 0.00 55.95 57.71 2ull s SER 107 Cb -0.15 -2.45 -0.02 0.00 0.10 0.00 0.00 66.02 63.51 2ull s SER 107 CO -0.01 -0.37 0.47 -0.76 0.98 0.00 0.00 173.24 173.55 2ull s LEU 108 N 2.02 4.03 0.77 2.42 1.43 -0.11 -1.61 118.68 127.62 2ull s LEU 108 Ca 0.38 -0.01 -0.12 0.00 -1.03 0.00 0.00 54.13 53.36 2ull s LEU 108 Cb -0.17 -2.87 0.05 0.00 0.03 0.00 0.00 46.19 43.23 2ull s LEU 108 CO 0.13 -0.36 1.10 0.42 0.23 0.00 0.00 176.35 177.87 2ull s THR 109 N -2.18 3.16 0.44 5.49 -4.23 -0.63 -4.41 115.64 113.28 2ull s THR 109 Ca 0.42 0.38 0.12 0.00 -1.18 0.00 0.00 61.69 61.43 2ull s THR 109 Cb -0.09 -3.23 0.21 0.00 1.34 0.00 0.00 72.50 70.72 2ull s THR 109 CO 0.32 -0.49 2.01 0.77 -0.54 0.00 0.00 174.62 176.69 2ull h SER 110 N -0.93 0.14 0.23 3.99 4.64 -1.98 -2.45 113.55 117.20 2ull h SER 110 Ca -0.46 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 2ull h SER 110 Cb 1.27 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2ull h SER 110 CO 0.61 0.23 0.00 0.00 -0.87 0.00 0.00 176.83 176.80 2ull n ALA 111 N -2.50 1.54 -1.86 5.18 0.00 -1.26 -4.74 120.51 116.87 2ull n ALA 111 Ca -0.01 -0.04 -0.33 0.00 0.00 0.00 0.00 53.44 53.06 2ull n ALA 111 Cb 0.19 -1.15 -0.06 0.00 0.00 0.00 0.00 19.45 18.42 2ull n ALA 111 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2ull s GLN 112 N -2.74 4.17 -0.34 0.00 -1.52 -0.93 -4.07 119.66 114.23 2ull s GLN 112 Ca 0.07 1.05 -0.02 0.00 -1.95 0.00 0.00 55.36 54.52 2ull s GLN 112 Cb 0.06 -2.20 0.08 0.00 -0.22 0.00 0.00 33.01 30.73 2ull s GLN 112 CO 0.16 -0.04 0.08 0.99 -0.25 0.00 0.00 175.29 176.22 2ull s THR 113 N -2.22 3.03 0.13 -0.19 2.01 -0.37 -4.93 115.64 113.11 2ull s THR 113 Ca 0.61 -1.73 -0.30 0.00 0.31 0.00 0.00 61.69 60.58 2ull s THR 113 Cb -0.09 -2.92 -0.07 0.00 0.01 0.00 0.00 72.50 69.43 2ull s THR 113 CO 0.16 -0.37 1.17 -0.76 -0.69 0.00 0.00 174.62 174.13 2ull s LEU 114 N 1.18 4.43 -0.01 4.42 1.43 -1.26 -0.72 118.68 128.15 2ull s LEU 114 Ca 0.01 2.11 0.04 0.00 -1.03 0.00 0.00 54.13 55.26 2ull s LEU 114 Cb -0.21 -3.59 -0.01 0.00 0.03 0.00 0.00 46.19 42.41 2ull s LEU 114 CO -0.03 -0.37 -0.12 -0.76 0.23 0.00 0.00 176.35 175.29 2ull s LEU 119 N 0.25 2.02 -0.64 1.79 1.43 -1.09 -4.92 118.68 117.53 2ull s LEU 119 Ca 0.54 -0.23 -0.06 0.00 -1.03 0.00 0.00 54.13 53.36 2ull s LEU 119 Cb -0.30 -0.65 -0.06 0.00 0.03 0.00 0.00 46.19 45.21 2ull s LEU 119 CO 0.33 0.15 3.02 -0.81 0.23 0.00 0.00 176.35 179.28 2ull n PRO 120 N 2.79 2.85 -3.81 1.29 -0.04 -1.26 -4.42 135.00 132.41 2ull n PRO 120 Ca -0.14 -2.07 -0.11 0.00 -0.04 0.00 0.00 63.50 61.15 2ull n PRO 120 Cb 0.56 -2.28 -0.08 0.00 -0.04 0.00 0.00 33.50 31.66 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 -0.10 0.77 0.09 0.54 0.52 -1.26 -0.24 118.95 119.27 2ull s ARG 120 Ca 0.63 -0.64 0.09 0.00 -0.52 0.00 0.00 55.73 55.29 2ull s ARG 120 Cb 0.30 0.32 -0.03 0.00 0.52 0.00 0.00 34.95 36.06 2ull s ARG 120 CO -0.10 -0.24 -0.25 0.08 0.02 0.00 0.00 175.30 174.81 2ull s VAL 120 N -2.80 2.02 0.16 3.52 1.01 -0.03 -0.91 120.40 123.36 2ull s VAL 120 Ca -0.03 -1.56 -0.30 0.00 0.00 0.00 0.00 61.98 60.09 2ull s VAL 120 Cb 0.00 -1.78 -0.07 0.00 0.00 0.00 0.00 36.38 34.53 2ull s VAL 120 CO -0.05 0.13 0.99 0.00 0.00 0.00 0.00 175.10 176.16 2ull s ALA 120 N -1.00 3.30 -0.39 5.51 0.00 0.05 -0.84 121.76 128.39 2ull s ALA 120 Ca 0.11 0.64 0.03 0.00 0.00 0.00 0.00 51.96 52.74 2ull s ALA 120 Cb -0.10 -3.28 0.16 0.00 0.00 0.00 0.00 23.12 19.90 2ull s ALA 120 CO 0.04 -0.01 0.34 1.21 0.00 0.00 0.00 175.76 177.35 2ull s ASN 120 N -0.32 1.55 0.00 0.00 2.47 -1.26 -4.72 114.94 112.67 2ull s ASN 120 Ca 0.46 -2.17 0.00 0.00 0.42 0.00 0.00 52.86 51.57 2ull s ASN 120 Cb -0.25 0.12 0.00 0.00 -1.45 0.00 0.00 41.25 39.67 2ull s ASN 120 CO 0.32 -0.23 0.00 0.61 -3.72 0.00 0.00 177.10 174.07 2ull n GLY 120 N 3.71 0.68 0.23 1.21 0.00 -1.26 -4.41 105.19 105.36 2ull n GLY 120 Ca 0.17 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.29 2ull n GLY 120 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ull n SER 120 N 1.76 -0.19 -3.91 1.61 7.64 -1.26 -5.09 113.62 114.18 2ull n SER 120 Ca 0.00 0.02 -0.17 0.00 1.01 0.00 0.00 58.87 59.73 2ull n SER 120 Cb 0.00 -0.99 -0.15 0.00 -1.01 0.00 0.00 64.21 62.06 2ull n SER 120 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2ull s PHE 120 N -1.84 0.47 -0.28 1.43 0.08 -1.26 -4.54 117.98 112.04 2ull s PHE 120 Ca 0.00 -0.09 -0.13 0.00 0.12 0.00 0.00 56.93 56.83 2ull s PHE 120 Cb 0.00 -0.38 -0.04 0.00 -0.57 0.00 0.00 43.02 42.02 2ull s PHE 120 CO 0.00 -0.07 0.28 0.08 -0.10 0.00 0.00 175.22 175.41 2ull s VAL 120 N 0.33 5.24 -0.09 -0.44 1.01 -0.02 -4.90 120.40 121.54 2ull s VAL 120 Ca -0.04 0.32 -0.30 0.00 0.00 0.00 0.00 61.98 61.96 2ull s VAL 120 Cb -0.07 -3.63 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 2ull s VAL 120 CO -0.00 0.18 1.26 -0.89 0.00 0.00 0.00 175.10 175.64 2ull s THR 120 N 1.91 4.18 -0.11 3.92 2.01 -1.26 -0.85 115.64 125.43 2ull s THR 120 Ca 0.11 1.49 -0.30 0.00 0.31 0.00 0.00 61.69 63.30 2ull s THR 120 Cb -0.16 -3.96 -0.03 0.00 0.01 0.00 0.00 72.50 68.37 2ull s THR 120 CO 0.11 -0.05 1.29 -0.69 -0.69 0.00 0.00 174.62 174.59 2ull s VAL 121 N 2.73 4.16 -0.05 3.82 1.01 0.67 -4.25 120.40 128.49 2ull s VAL 121 Ca 0.57 1.44 0.02 0.00 0.00 0.00 0.00 61.98 64.01 2ull s VAL 121 Cb -0.25 -3.93 -0.02 0.00 0.00 0.00 0.00 36.38 32.18 2ull s VAL 121 CO 0.20 -0.08 0.06 0.54 0.00 0.00 0.00 175.10 175.82 2ull n ARG 122 N 6.19 4.20 -3.13 2.72 1.74 0.27 -0.92 116.66 127.73 2ull n ARG 122 Ca 0.13 -0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.21 2ull n ARG 122 Cb 0.45 -0.74 0.00 0.00 -1.02 0.00 0.00 32.46 31.15 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 1.52 -1.28 1.85 -0.13 0.00 -1.13 -4.80 105.19 101.22 2ull n GLY 123 Ca 0.00 -0.91 -0.03 0.00 0.00 0.00 0.00 46.02 45.08 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 0.38 2.18 -4.64 1.61 3.41 -1.26 -0.61 113.62 114.69 2ull n SER 124 Ca 0.00 -2.77 -0.43 0.00 -0.26 0.00 0.00 58.87 55.41 2ull n SER 124 Cb 0.00 -0.41 -0.03 0.00 -0.26 0.00 0.00 64.21 63.51 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 -2.82 3.37 -0.26 6.66 2.01 -1.26 -4.84 115.64 118.50 2ull s THR 125 Ca 0.36 0.43 -0.29 0.00 0.31 0.00 0.00 61.69 62.51 2ull s THR 125 Cb 0.37 -3.35 -0.02 0.00 0.01 0.00 0.00 72.50 69.51 2ull s THR 125 CO -0.06 -0.12 1.62 -0.70 -0.69 0.00 0.00 174.62 174.67 2ull s GLU 129 N 4.81 3.69 0.93 4.92 2.12 -1.26 -4.74 118.70 129.16 2ull s GLU 129 Ca 0.82 1.54 -0.11 0.00 0.36 0.00 0.00 54.97 57.57 2ull s GLU 129 Cb -0.33 -4.06 0.15 0.00 0.26 0.00 0.00 34.13 30.15 2ull s GLU 129 CO 0.33 -1.42 1.09 0.00 -0.54 0.00 0.00 175.26 174.72 2ull s ALA 130 N 5.53 1.31 0.36 6.30 0.00 -1.26 -5.07 121.76 128.93 2ull s ALA 130 Ca 0.72 0.02 0.08 0.00 0.00 0.00 0.00 51.96 52.78 2ull s ALA 130 Cb -0.23 -3.23 -0.05 0.00 0.00 0.00 0.00 23.12 19.61 2ull s ALA 130 CO 0.30 -2.56 0.10 0.00 0.00 0.00 0.00 175.76 173.59 2ull s ALA 131 N -2.84 3.39 0.11 0.00 0.00 -1.26 -5.04 121.76 116.12 2ull s ALA 131 Ca 0.64 -1.96 -0.35 0.00 0.00 0.00 0.00 51.96 50.29 2ull s ALA 131 Cb -0.19 -0.49 -0.17 0.00 0.00 0.00 0.00 23.12 22.27 2ull s ALA 131 CO 0.58 -0.00 1.19 0.28 0.00 0.00 0.00 175.76 177.81 2ull n VAL 132 N -1.09 0.45 0.00 0.00 0.31 -1.26 -1.61 118.33 115.13 2ull n VAL 132 Ca -0.03 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.19 2ull n VAL 132 Cb 0.63 -0.66 0.00 0.00 -0.91 0.00 0.00 33.84 32.90 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 2.13 2.54 3.77 2.92 0.00 0.11 -4.99 105.19 111.67 2ull n GLY 133 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.51 3.45 0.28 4.61 0.00 -0.63 -4.56 121.76 122.40 2ull s ALA 134 Ca 0.00 1.13 -0.29 0.00 0.00 0.00 0.00 51.96 52.80 2ull s ALA 134 Cb 0.00 -3.43 -0.10 0.00 0.00 0.00 0.00 23.12 19.60 2ull s ALA 134 CO 0.00 -0.48 1.30 0.00 0.00 0.00 0.00 175.76 176.58 2ull s ALA 135 N -1.16 3.51 -0.05 0.00 0.00 -1.26 -0.51 121.76 122.29 2ull s ALA 135 Ca 0.48 1.19 -0.13 0.00 0.00 0.00 0.00 51.96 53.50 2ull s ALA 135 Cb -0.37 -3.47 0.02 0.00 0.00 0.00 0.00 23.12 19.30 2ull s ALA 135 CO 0.48 -0.57 0.30 0.54 0.00 0.00 0.00 175.76 176.51 2ull s VAL 136 N -0.64 0.04 0.40 0.00 0.11 0.07 -4.74 120.40 115.64 2ull s VAL 136 Ca 0.52 -0.32 0.07 0.00 -2.93 0.00 0.00 61.98 59.33 2ull s VAL 136 Cb -0.38 -0.54 -0.08 0.00 -1.53 0.00 0.00 36.38 33.85 2ull s VAL 136 CO 0.46 -0.17 -0.00 0.00 -3.33 0.00 0.00 175.10 172.06 2ull s ARG 138 N -3.70 0.56 -0.03 0.00 1.70 0.25 -0.67 118.95 117.05 2ull s ARG 138 Ca 0.35 -0.86 0.02 0.00 -0.47 0.00 0.00 55.73 54.77 2ull s ARG 138 Cb 0.09 0.21 0.01 0.00 -0.57 0.00 0.00 34.95 34.69 2ull s ARG 138 CO 0.18 -0.13 -0.08 0.45 -1.08 0.00 0.00 175.30 174.64 2ull s SER 139 N -2.26 1.20 0.19 -2.89 0.15 0.33 -1.24 113.70 109.19 2ull s SER 139 Ca -0.03 -0.19 -0.21 0.00 0.70 0.00 0.00 55.95 56.22 2ull s SER 139 Cb 0.00 -0.39 0.05 0.00 -1.71 0.00 0.00 66.02 63.97 2ull s SER 139 CO -0.06 0.04 0.61 -0.83 1.20 0.00 0.00 173.24 174.20 2ull s GLY 140 N 0.36 -0.39 0.00 9.45 0.00 -0.62 -2.76 107.32 113.36 2ull s GLY 140 Ca -0.06 0.16 0.18 0.00 0.00 0.00 0.00 44.72 45.00 2ull s GLY 140 CO 0.01 0.01 1.56 -0.96 0.00 0.00 0.00 173.10 173.72 2ull n ARG 141 N -0.39 0.10 -0.03 2.90 -4.01 -1.06 -1.18 116.66 113.00 2ull n ARG 141 Ca -0.13 0.16 -0.03 0.00 -1.04 0.00 0.00 57.85 56.82 2ull n ARG 141 Cb 0.63 -1.50 -0.01 0.00 -3.04 0.00 0.00 32.46 28.54 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 -1.41 0.61 1.30 8.89 -1.04 -1.26 -4.74 114.28 116.62 2ull n THR 142 Ca 0.06 0.33 0.13 0.00 -2.04 0.00 0.00 64.05 62.53 2ull n THR 142 Cb 0.18 -1.78 0.41 0.00 -1.82 0.00 0.00 70.33 67.32 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 -3.26 0.00 -3.40 12.58 -2.24 -1.26 -5.05 114.28 111.66 2ull n THR 143 Ca -0.05 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 2ull n THR 143 Cb 0.19 0.43 0.00 0.00 -2.10 0.00 0.00 70.33 68.85 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 1.30 0.93 3.35 3.38 0.00 -0.32 -4.65 105.19 109.19 2ull n GLY 156 Ca 0.14 -0.77 -0.43 0.00 0.00 0.00 0.00 46.02 44.96 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 3.27 0.00 1.61 5.04 -1.26 -1.58 117.35 124.43 2ull s TYR 157 Ca 0.00 -1.10 0.07 0.00 -2.44 0.00 0.00 57.07 53.61 2ull s TYR 157 Cb 0.00 -3.08 -0.03 0.00 0.35 0.00 0.00 41.96 39.21 2ull s TYR 157 CO 0.00 -0.80 -0.23 -0.65 -1.34 0.00 0.00 175.55 172.53 2ull s GLN 158 N 1.58 2.10 0.40 4.97 -1.52 -0.37 -4.93 119.66 121.89 2ull s GLN 158 Ca 0.04 -0.94 0.08 0.00 -1.95 0.00 0.00 55.36 52.58 2ull s GLN 158 Cb -0.24 -2.12 -0.07 0.00 -0.22 0.00 0.00 33.01 30.37 2ull s GLN 158 CO 0.05 0.56 0.03 0.00 -0.25 0.00 0.00 175.29 175.69 2ull n GLY 160 N -1.01 -0.81 3.26 0.00 0.00 -0.33 -4.26 105.19 102.05 2ull n GLY 160 Ca -0.04 -0.27 -0.14 0.00 0.00 0.00 0.00 46.02 45.57 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 0.69 -0.08 2.61 -4.23 -1.26 -0.75 115.64 108.62 2ull s THR 161 Ca 0.00 -1.99 -0.29 0.00 -1.18 0.00 0.00 61.69 58.23 2ull s THR 161 Cb 0.00 -2.21 -0.02 0.00 1.34 0.00 0.00 72.50 71.61 2ull s THR 161 CO 0.00 -0.40 0.97 -0.63 -0.54 0.00 0.00 174.62 174.03 2ull s ILE 162 N -3.65 4.83 -0.28 2.99 1.01 0.34 -1.55 121.20 124.88 2ull s ILE 162 Ca 0.26 1.99 0.10 0.00 0.00 0.00 0.00 60.65 63.00 2ull s ILE 162 Cb 0.06 -4.29 -0.12 0.00 0.01 0.00 0.00 42.46 38.12 2ull s ILE 162 CO 0.06 0.06 0.33 0.35 0.00 0.00 0.00 174.94 175.74 2ull n THR 163 N 4.36 0.00 -3.59 2.92 -2.24 0.45 -0.71 114.28 115.46 2ull n THR 163 Ca 0.07 -0.26 -0.04 0.00 -2.27 0.00 0.00 64.05 61.56 2ull n THR 163 Cb 0.49 0.71 -0.02 0.00 -2.10 0.00 0.00 70.33 69.42 2ull n THR 163 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ull s ALA 164 N -2.21 -2.07 0.27 6.98 0.00 -0.90 -4.94 121.76 118.88 2ull s ALA 164 Ca 0.01 1.38 0.02 0.00 0.00 0.00 0.00 51.96 53.36 2ull s ALA 164 Cb 0.07 0.02 -0.05 0.00 0.00 0.00 0.00 23.12 23.16 2ull s ALA 164 CO 0.40 -0.68 0.09 0.15 0.00 0.00 0.00 175.76 175.72 2ull s LYS 165 N -2.50 1.45 -1.51 0.00 1.02 -1.26 -0.47 119.74 116.47 2ull s LYS 165 Ca 0.10 -1.79 -0.02 0.00 0.02 0.00 0.00 55.97 54.28 2ull s LYS 165 Cb -0.00 -0.33 0.01 0.00 -0.52 0.00 0.00 37.83 36.99 2ull s LYS 165 CO -0.05 -0.29 0.18 -1.71 -0.92 0.00 0.00 175.35 172.57 2ull n ASN 166 N -0.51 -5.28 -4.80 2.83 4.05 -0.74 -4.92 115.26 105.90 2ull n ASN 166 Ca -0.00 -0.06 -0.35 0.00 0.45 0.00 0.00 54.58 54.62 2ull n ASN 166 Cb 0.66 -4.38 -0.05 0.00 1.23 0.00 0.00 39.78 37.25 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 -2.96 3.96 -0.16 3.44 1.01 0.87 -4.33 120.40 122.23 2ull s VAL 167 Ca 0.10 1.36 -0.03 0.00 0.00 0.00 0.00 61.98 63.42 2ull s VAL 167 Cb -0.05 -3.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.68 2ull s VAL 167 CO 0.13 -0.13 -0.06 -0.89 0.00 0.00 0.00 175.10 174.15 2ull s THR 168 N -1.87 3.65 -0.07 3.92 2.01 -1.26 -1.31 115.64 120.71 2ull s THR 168 Ca 0.61 -0.44 -0.01 0.00 0.31 0.00 0.00 61.69 62.16 2ull s THR 168 Cb -0.17 -2.59 -0.03 0.00 0.01 0.00 0.00 72.50 69.72 2ull s THR 168 CO 0.21 0.49 -0.01 0.00 -0.69 0.00 0.00 174.62 174.62 2ull s ALA 169 N 0.48 3.23 -0.70 7.40 0.00 -0.06 -4.99 121.76 127.13 2ull s ALA 169 Ca -0.05 -0.84 0.02 0.00 0.00 0.00 0.00 51.96 51.09 2ull s ALA 169 Cb -0.15 -1.42 0.17 0.00 0.00 0.00 0.00 23.12 21.73 2ull s ALA 169 CO 0.03 0.59 0.50 -0.80 0.00 0.00 0.00 175.76 176.09 2ull s ASN 170 N -0.96 5.08 0.89 0.00 0.01 -1.26 -0.85 114.94 117.85 2ull s ASN 170 Ca 0.14 -3.45 -0.13 0.00 -0.71 0.00 0.00 52.86 48.71 2ull s ASN 170 Cb -0.11 -1.75 0.14 0.00 0.41 0.00 0.00 41.25 39.94 2ull s ASN 170 CO 0.03 -0.20 1.20 -0.31 -1.51 0.00 0.00 177.10 176.32 2ull s TYR 171 N -0.91 2.36 0.39 2.20 2.02 -0.74 -4.93 117.35 117.74 2ull s TYR 171 Ca 0.22 0.65 0.07 0.00 -0.37 0.00 0.00 57.07 57.64 2ull s TYR 171 Cb -0.13 -3.64 0.81 0.00 -0.40 0.00 0.00 41.96 38.61 2ull s TYR 171 CO -0.09 -2.26 1.99 0.00 -1.57 0.00 0.00 175.55 173.62 2ull h ALA 173 N -1.40 1.75 0.00 3.71 0.00 -2.03 -2.27 119.26 119.03 2ull h ALA 173 Ca -0.47 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2ull h ALA 173 Cb 1.30 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2ull h ALA 173 CO 0.56 0.16 -0.07 0.93 0.00 0.00 0.00 179.25 180.83 2ull h GLU 174 N 0.66 0.00 0.00 0.00 3.07 -2.02 -3.49 114.58 112.80 2ull h GLU 174 Ca 0.26 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.12 2ull h GLU 174 Cb 0.21 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.12 2ull h GLU 174 CO -0.08 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 177.94 2ull n GLY 175 N 1.27 0.67 3.77 -3.84 0.00 -0.85 -4.80 105.19 101.40 2ull n GLY 175 Ca 0.05 -1.89 -0.38 0.00 0.00 0.00 0.00 46.02 43.80 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 -1.09 3.28 -0.17 4.61 0.00 -1.26 -1.79 121.76 125.34 2ull s ALA 176 Ca 0.00 0.53 0.01 0.00 0.00 0.00 0.00 51.96 52.50 2ull s ALA 176 Cb 0.00 -3.16 0.03 0.00 0.00 0.00 0.00 23.12 19.98 2ull s ALA 176 CO 0.00 0.20 -0.16 0.08 0.00 0.00 0.00 175.76 175.88 2ull s VAL 177 N -1.42 1.79 0.40 0.00 1.01 -0.03 -0.79 120.40 121.37 2ull s VAL 177 Ca 0.45 -0.84 0.08 0.00 0.00 0.00 0.00 61.98 61.67 2ull s VAL 177 Cb -0.22 -1.68 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 2ull s VAL 177 CO 0.27 0.43 0.31 -0.13 0.00 0.00 0.00 175.10 175.98 2ull s ARG 178 N 1.39 2.47 -0.10 2.72 0.52 -0.68 -0.88 118.95 124.38 2ull s ARG 178 Ca 0.04 -1.58 0.00 0.00 -0.52 0.00 0.00 55.73 53.67 2ull s ARG 178 Cb -0.14 -2.28 0.00 0.00 0.52 0.00 0.00 34.95 33.05 2ull s ARG 178 CO -0.11 -0.12 0.00 0.41 0.02 0.00 0.00 175.30 175.50 2ull n GLY 179 N -1.43 0.49 3.83 -3.53 0.00 -0.97 -4.78 105.19 98.81 2ull n GLY 179 Ca 0.01 -0.30 -0.32 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.21 3.53 -0.10 0.99 1.43 -0.42 -4.42 118.68 119.47 2ull s LEU 180 Ca 0.00 1.63 -0.04 0.00 -1.03 0.00 0.00 54.13 54.69 2ull s LEU 180 Cb 0.00 -4.51 -0.04 0.00 0.03 0.00 0.00 46.19 41.67 2ull s LEU 180 CO 0.00 -0.82 0.07 -0.89 0.23 0.00 0.00 176.35 174.94 2ull s THR 181 N -2.64 4.91 -0.16 5.49 2.01 -0.22 -0.09 115.64 124.94 2ull s THR 181 Ca 0.60 -0.02 -0.03 0.00 0.31 0.00 0.00 61.69 62.55 2ull s THR 181 Cb -0.12 -3.11 -0.03 0.00 0.01 0.00 0.00 72.50 69.26 2ull s THR 181 CO 0.36 0.61 -0.04 -1.58 -0.69 0.00 0.00 174.62 173.28 2ull s GLN 182 N -0.93 3.64 0.44 4.92 0.74 0.38 -0.62 119.66 128.23 2ull s GLN 182 Ca 0.14 -0.53 0.03 0.00 0.05 0.00 0.00 55.36 55.05 2ull s GLN 182 Cb -0.12 -2.91 -0.04 0.00 1.10 0.00 0.00 33.01 31.05 2ull s GLN 182 CO 0.03 0.21 0.04 0.20 -0.55 0.00 0.00 175.29 175.23 2ull s GLY 183 N 0.43 2.68 -0.15 2.59 0.00 -0.08 -0.41 107.32 112.37 2ull s GLY 183 Ca -0.04 -1.25 0.18 0.00 0.00 0.00 0.00 44.72 43.61 2ull s GLY 183 CO 0.03 -2.04 1.25 1.16 0.00 0.00 0.00 173.10 173.50 2ull n ASN 184 N -1.12 2.80 -4.76 1.64 0.23 -0.60 -2.25 115.26 111.21 2ull n ASN 184 Ca -0.11 -3.12 -0.40 0.00 -0.53 0.00 0.00 54.58 50.42 2ull n ASN 184 Cb 0.66 -0.48 -0.05 0.00 -2.08 0.00 0.00 39.78 37.84 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 -2.89 3.35 0.78 -2.53 0.00 -1.26 -4.76 121.76 114.46 2ull s ALA 185 Ca 0.36 0.73 -0.12 0.00 0.00 0.00 0.00 51.96 52.93 2ull s ALA 185 Cb 0.31 -3.26 0.06 0.00 0.00 0.00 0.00 23.12 20.23 2ull s ALA 185 CO 0.04 0.04 1.11 0.00 0.00 0.00 0.00 175.76 176.96 2ull s MET 190 N -5.28 2.16 0.28 0.00 0.23 -1.26 -4.76 119.30 110.67 2ull s MET 190 Ca 0.60 -1.52 -0.20 0.00 -1.03 0.00 0.00 55.69 53.55 2ull s MET 190 Cb -0.13 0.58 0.06 0.00 -1.53 0.00 0.00 34.83 33.81 2ull s MET 190 CO 0.53 -0.99 0.88 0.20 -2.03 0.00 0.00 175.02 173.61 2ull s GLY 191 N -3.11 0.15 -0.64 3.16 0.00 -1.26 -1.75 107.32 103.86 2ull s GLY 191 Ca 0.19 -0.45 -0.32 0.00 0.00 0.00 0.00 44.72 44.15 2ull s GLY 191 CO 0.14 0.58 2.44 0.54 0.00 0.00 0.00 173.10 176.80 2ull n ARG 192 N -0.56 0.59 0.00 2.90 1.74 -0.82 -0.84 116.66 119.67 2ull n ARG 192 Ca -0.06 0.08 0.00 0.00 -0.77 0.00 0.00 57.85 57.10 2ull n ARG 192 Cb 0.60 -2.32 0.00 0.00 -1.02 0.00 0.00 32.46 29.72 2ull n ARG 192 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ull n GLY 193 N 6.45 1.93 0.08 -0.13 0.00 -1.26 -4.71 105.19 107.54 2ull n GLY 193 Ca 0.50 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.62 2ull n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ull n ASP 194 N 0.00 0.41 -4.49 1.61 8.00 -0.02 -3.26 116.55 118.79 2ull n ASP 194 Ca 0.00 0.59 -0.53 0.00 0.71 0.00 0.00 54.79 55.57 2ull n ASP 194 Cb 0.00 -0.68 -0.05 0.00 -0.02 0.00 0.00 41.12 40.37 2ull n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2ull n SER 195 N -1.94 0.02 0.00 -2.24 7.64 -1.26 -1.01 113.62 114.83 2ull n SER 195 Ca 0.03 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.05 2ull n SER 195 Cb 0.22 -1.02 0.00 0.00 -1.01 0.00 0.00 64.21 62.40 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 1.81 3.00 3.74 0.23 0.00 0.44 -0.45 105.19 113.95 2ull n GLY 196 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.93 1.74 0.34 -0.02 0.00 -0.18 -2.24 107.32 105.03 2ull s GLY 197 Ca 0.00 0.41 -0.29 0.00 0.00 0.00 0.00 44.72 44.84 2ull s GLY 197 CO 0.00 0.78 1.35 -0.56 0.00 0.00 0.00 173.10 174.67 2ull s SER 198 N -3.08 6.66 -0.17 1.64 0.01 -1.11 -0.64 113.70 117.02 2ull s SER 198 Ca 0.64 2.78 0.01 0.00 1.31 0.00 0.00 55.95 60.69 2ull s SER 198 Cb -0.19 -2.65 0.02 0.00 0.21 0.00 0.00 66.02 63.40 2ull s SER 198 CO 0.55 -0.62 -0.19 0.26 0.41 0.00 0.00 173.24 173.66 2ull s TRP 199 N -1.13 2.61 -0.02 2.43 0.52 -0.67 -0.51 118.94 122.17 2ull s TRP 199 Ca 0.50 -1.51 -0.16 0.00 0.02 0.00 0.00 56.10 54.95 2ull s TRP 199 Cb -0.41 -1.82 0.03 0.00 -1.15 0.00 0.00 33.47 30.11 2ull s TRP 199 CO 0.55 -0.75 0.34 -1.50 0.02 0.00 0.00 176.95 175.61 2ull s ILE 200 N 1.29 0.05 0.53 2.03 2.07 0.16 -0.33 121.20 127.01 2ull s ILE 200 Ca 0.04 -0.44 -0.07 0.00 -1.41 0.00 0.00 60.65 58.77 2ull s ILE 200 Cb -0.13 -0.65 -0.04 0.00 0.13 0.00 0.00 42.46 41.78 2ull s ILE 200 CO -0.11 -0.24 0.87 0.42 -1.91 0.00 0.00 174.94 173.97 2ull s THR 201 N -1.33 4.81 0.50 4.00 -4.23 -0.91 -1.15 115.64 117.34 2ull s THR 201 Ca -0.13 0.43 0.21 0.00 -1.18 0.00 0.00 61.69 61.02 2ull s THR 201 Cb -0.05 -3.86 0.27 0.00 1.34 0.00 0.00 72.50 70.21 2ull s THR 201 CO 0.05 -0.95 2.12 0.77 -0.54 0.00 0.00 174.62 176.07 2ull h SER 201 N 0.02 0.00 0.12 3.99 4.64 -1.92 -0.10 113.55 120.30 2ull h SER 201 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2ull h SER 201 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2ull h SER 201 CO 0.62 0.07 0.00 0.00 -0.87 0.00 0.00 176.83 176.65 2ull n ALA 202 N -2.43 2.11 -0.67 5.18 0.00 -1.26 -4.87 120.51 118.58 2ull n ALA 202 Ca -0.03 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.31 2ull n ALA 202 Cb 0.16 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.31 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 0.18 0.61 3.50 0.00 0.00 -0.05 -4.76 105.19 104.67 2ull n GLY 207 Ca 0.12 -0.52 -0.43 0.00 0.00 0.00 0.00 46.02 45.19 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 -1.04 3.20 0.19 1.61 -1.52 -1.25 -0.57 119.66 120.29 2ull s GLN 208 Ca 0.00 -0.55 -0.32 0.00 -1.95 0.00 0.00 55.36 52.55 2ull s GLN 208 Cb 0.00 -3.97 -0.11 0.00 -0.22 0.00 0.00 33.01 28.71 2ull s GLN 208 CO 0.00 -0.98 1.63 0.00 -0.25 0.00 0.00 175.29 175.69 2ull s ALA 209 N 2.58 3.85 -0.17 6.09 0.00 0.23 -2.15 121.76 132.18 2ull s ALA 209 Ca 0.18 1.47 0.03 0.00 0.00 0.00 0.00 51.96 53.64 2ull s ALA 209 Cb -0.16 -3.65 -0.12 0.00 0.00 0.00 0.00 23.12 19.19 2ull s ALA 209 CO 0.17 -0.85 -0.13 1.04 0.00 0.00 0.00 175.76 175.99 2ull n GLN 210 N 3.89 0.62 -3.55 0.00 1.13 0.56 -4.40 117.38 115.62 2ull n GLN 210 Ca 0.14 0.09 0.00 0.00 -1.94 0.00 0.00 57.00 55.29 2ull n GLN 210 Cb 0.37 -1.35 0.00 0.00 0.11 0.00 0.00 30.24 29.37 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 2.59 -1.01 3.31 1.08 0.00 -1.17 -1.47 105.19 108.53 2ull n GLY 211 Ca -0.30 -0.98 -0.29 0.00 0.00 0.00 0.00 46.02 44.46 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 0.18 1.61 -7.23 -0.32 -1.67 120.40 111.94 2ull s VAL 212 Ca 0.00 -1.31 -0.32 0.00 -1.81 0.00 0.00 61.98 58.54 2ull s VAL 212 Cb 0.00 -1.69 -0.12 0.00 0.56 0.00 0.00 36.38 35.13 2ull s VAL 212 CO 0.00 0.32 1.70 0.80 -0.31 0.00 0.00 175.10 177.61 2ull n MET 213 N 1.83 2.60 -0.01 4.82 1.56 0.18 -0.71 117.12 127.39 2ull n MET 213 Ca -0.17 0.94 -0.05 0.00 -0.27 0.00 0.00 57.70 58.15 2ull n MET 213 Cb 0.52 -2.77 -0.02 0.00 2.15 0.00 0.00 33.22 33.11 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 4.08 0.93 -3.22 6.12 2.88 0.06 -0.42 113.62 124.06 2ull n SER 214 Ca 0.17 0.14 -0.06 0.00 -1.33 0.00 0.00 58.87 57.79 2ull n SER 214 Cb 0.33 -0.33 0.02 0.00 -0.75 0.00 0.00 64.21 63.48 2ull n SER 214 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2ull s GLY 215 N -4.68 0.19 -0.06 0.46 0.00 -0.84 -4.90 107.32 97.49 2ull s GLY 215 Ca -0.09 -0.49 -0.31 0.00 0.00 0.00 0.00 44.72 43.83 2ull s GLY 215 CO 0.12 0.94 1.13 -0.32 0.00 0.00 0.00 173.10 174.97 2ull s GLY 216 N -3.20 -0.35 -1.46 0.20 0.00 -1.26 0.14 107.32 101.39 2ull s GLY 216 Ca 0.18 1.05 -0.12 0.00 0.00 0.00 0.00 44.72 45.83 2ull s GLY 216 CO 0.08 0.32 2.32 1.16 0.00 0.00 0.00 173.10 176.98 2ull n ASN 217 N -0.28 5.25 -4.77 1.64 6.94 -0.79 -4.96 115.26 118.31 2ull n ASN 217 Ca -0.05 -2.85 -0.40 0.00 -0.02 0.00 0.00 54.58 51.26 2ull n ASN 217 Cb 0.60 -1.59 -0.03 0.00 -2.36 0.00 0.00 39.78 36.40 2ull n ASN 217 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 2ull s VAL 218 N 2.30 3.03 0.00 3.53 -7.23 -1.26 -4.67 120.40 116.09 2ull s VAL 218 Ca 0.51 1.01 0.00 0.00 -1.81 0.00 0.00 61.98 61.69 2ull s VAL 218 Cb 0.14 -3.63 0.00 0.00 0.56 0.00 0.00 36.38 33.45 2ull s VAL 218 CO -0.07 0.22 0.00 0.00 -0.31 0.00 0.00 175.10 174.95 2ull n GLN 219 N 0.83 0.75 0.16 4.82 1.13 -0.41 -4.86 117.38 119.80 2ull n GLN 219 Ca 0.00 0.00 0.14 0.00 -1.94 0.00 0.00 57.00 55.20 2ull n GLN 219 Cb 0.43 0.00 0.69 0.00 0.11 0.00 0.00 30.24 31.48 2ull n GLN 219 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 2ull h SER 219 N 0.00 0.00 0.12 1.08 4.64 -1.97 -1.12 113.55 116.30 2ull h SER 219 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ull h SER 219 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2ull h SER 219 CO 0.00 0.00 -0.01 -0.46 -0.87 0.00 0.00 176.83 175.49 2ull n ASN 219 N -4.36 0.11 0.00 4.97 0.23 -1.26 -4.89 115.26 110.05 2ull n ASN 219 Ca 0.02 -0.85 0.00 0.00 -0.53 0.00 0.00 54.58 53.22 2ull n ASN 219 Cb 0.30 -0.06 0.00 0.00 -2.08 0.00 0.00 39.78 37.94 2ull n ASN 219 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2ull n GLY 219 N 1.08 0.75 3.24 4.83 0.00 -0.42 -4.96 105.19 109.71 2ull n GLY 219 Ca 0.21 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.09 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 -3.00 0.69 -0.18 1.61 2.20 -1.26 -1.94 114.94 113.06 2ull s ASN 219 Ca 0.00 -1.47 0.15 0.00 -0.94 0.00 0.00 52.86 50.60 2ull s ASN 219 Cb 0.00 0.38 0.40 0.00 -2.00 0.00 0.00 41.25 40.03 2ull s ASN 219 CO 0.00 -0.87 1.27 -0.46 -2.94 0.00 0.00 177.10 174.10 2ull n ASN 220 N -0.58 2.47 0.00 3.54 0.23 -0.72 -1.29 115.26 118.91 2ull n ASN 220 Ca 0.03 -3.40 0.13 0.00 -0.53 0.00 0.00 54.58 50.81 2ull n ASN 220 Cb 0.65 -0.51 0.59 0.00 -2.08 0.00 0.00 39.78 38.43 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 1.33 1.60 3.21 0.00 0.00 -1.26 -4.89 105.19 105.16 2ull n GLY 221 Ca 0.07 -0.57 -0.14 0.00 0.00 0.00 0.00 46.02 45.38 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 -1.46 0.99 0.83 -0.61 -4.36 -1.21 -5.15 121.20 110.24 2ull s ILE 222 Ca 0.35 -1.88 -0.13 0.00 -0.26 0.00 0.00 60.65 58.73 2ull s ILE 222 Cb 0.20 -1.63 0.06 0.00 1.25 0.00 0.00 42.46 42.33 2ull s ILE 222 CO 0.21 -0.70 0.91 -2.65 0.24 0.00 0.00 174.94 172.96 2ull n PRO 222 N 0.12 0.04 0.09 0.37 -0.02 -1.26 -4.86 135.00 129.48 2ull n PRO 222 Ca -0.13 0.08 0.10 0.00 -2.02 0.00 0.00 63.50 61.53 2ull n PRO 222 Cb 0.60 -2.20 0.42 0.00 -0.02 0.00 0.00 33.50 32.30 2ull n PRO 222 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ull n ALA 222 N -3.29 1.61 0.32 3.55 0.00 -1.26 -0.94 120.51 120.50 2ull n ALA 222 Ca 0.11 0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.72 2ull n ALA 222 Cb 0.51 -1.32 0.11 0.00 0.00 0.00 0.00 19.45 18.75 2ull n ALA 222 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2ull h SER 222 N 0.00 0.00 -0.26 0.00 4.64 -1.92 -3.35 113.55 112.66 2ull h SER 222 Ca 0.00 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 2ull h SER 222 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 2ull h SER 222 CO 0.00 0.04 0.00 0.00 -0.87 0.00 0.00 176.83 176.00 2ull n GLN 223 N -2.51 2.18 -2.89 4.77 6.02 -0.11 -5.02 117.38 119.82 2ull n GLN 223 Ca 0.02 -2.01 -0.27 0.00 -0.01 0.00 0.00 57.00 54.72 2ull n GLN 223 Cb 0.50 -1.42 -0.01 0.00 1.02 0.00 0.00 30.24 30.32 2ull n GLN 223 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2ull s ARG 224 N -1.41 3.59 -0.47 -1.09 0.52 -1.07 -4.92 118.95 114.09 2ull s ARG 224 Ca 0.31 0.13 0.06 0.00 -0.52 0.00 0.00 55.73 55.71 2ull s ARG 224 Cb 0.19 -2.46 0.18 0.00 0.52 0.00 0.00 34.95 33.38 2ull s ARG 224 CO 0.26 -0.06 0.56 0.45 0.02 0.00 0.00 175.30 176.53 2ull s SER 225 N -3.80 -0.23 -0.19 0.23 0.15 -1.26 -4.83 113.70 103.76 2ull s SER 225 Ca 0.46 -2.26 -0.09 0.00 0.70 0.00 0.00 55.95 54.76 2ull s SER 225 Cb -0.10 0.93 -0.05 0.00 -1.71 0.00 0.00 66.02 65.09 2ull s SER 225 CO 0.39 -0.11 0.12 -0.44 1.20 0.00 0.00 173.24 174.41 2ull s SER 226 N 0.57 6.17 -0.11 5.45 0.01 -0.95 -1.88 113.70 122.96 2ull s SER 226 Ca 0.31 0.25 0.03 0.00 1.31 0.00 0.00 55.95 57.84 2ull s SER 226 Cb 0.01 -2.07 0.01 0.00 0.21 0.00 0.00 66.02 64.18 2ull s SER 226 CO -0.11 0.21 -0.21 -0.76 0.41 0.00 0.00 173.24 172.78 2ull s LEU 227 N 0.16 2.01 0.13 2.44 1.43 0.12 -0.90 118.68 124.07 2ull s LEU 227 Ca 0.08 -0.53 0.10 0.00 -1.03 0.00 0.00 54.13 52.75 2ull s LEU 227 Cb -0.11 -1.33 -0.04 0.00 0.03 0.00 0.00 46.19 44.74 2ull s LEU 227 CO -0.01 0.10 -0.22 0.72 0.23 0.00 0.00 176.35 177.18 2ull s PHE 228 N 0.60 2.44 -0.17 0.29 -0.12 0.21 -0.76 117.98 120.48 2ull s PHE 228 Ca -0.13 -0.31 -0.24 0.00 -0.05 0.00 0.00 56.93 56.19 2ull s PHE 228 Cb -0.17 -1.30 -0.02 0.00 -0.63 0.00 0.00 43.02 40.91 2ull s PHE 228 CO 0.04 0.38 0.78 -2.00 -0.05 0.00 0.00 175.22 174.36 2ull s GLU 229 N -2.15 4.29 0.33 1.99 2.56 0.11 -1.06 118.70 124.77 2ull s GLU 229 Ca 0.17 0.92 -0.28 0.00 0.00 0.00 0.00 54.97 55.77 2ull s GLU 229 Cb -0.10 -3.57 -0.12 0.00 2.00 0.00 0.00 34.13 32.34 2ull s GLU 229 CO 0.09 -0.28 1.30 0.54 -0.56 0.00 0.00 175.26 176.34 2ull n ARG 230 N 5.08 2.10 -0.05 4.30 1.74 -1.26 -1.17 116.66 127.39 2ull n ARG 230 Ca 0.03 0.74 -0.15 0.00 -0.77 0.00 0.00 57.85 57.69 2ull n ARG 230 Cb 0.49 -2.32 -0.07 0.00 -1.02 0.00 0.00 32.46 29.54 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 2.74 0.75 -0.53 0.55 5.85 -1.59 -3.36 115.31 119.72 2ull h LEU 231 Ca -0.46 -0.58 0.11 0.00 0.84 0.00 0.00 57.88 57.79 2ull h LEU 231 Cb 1.28 -0.22 -0.10 0.00 0.37 0.00 0.00 40.66 41.99 2ull h LEU 231 CO 0.64 1.20 -0.18 1.56 -0.34 0.00 0.00 178.44 181.32 2ull h GLN 232 N 0.34 -0.05 0.00 1.25 4.20 -1.90 -0.69 115.11 118.26 2ull h GLN 232 Ca -0.01 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 2ull h GLN 232 Cb 1.11 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.90 2ull h GLN 232 CO 0.11 -0.04 -0.13 -1.00 -0.67 0.00 0.00 178.83 177.10 2ull h PRO 233 N -0.05 0.00 -0.11 1.46 0.13 -1.99 -1.91 132.00 129.53 2ull h PRO 233 Ca 0.25 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.31 2ull h PRO 233 Cb 0.44 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.57 2ull h PRO 233 CO -0.57 0.13 -0.21 0.82 -0.23 0.00 0.00 178.00 177.94 2ull h ILE 234 N 0.00 1.39 -0.49 -3.56 2.04 -1.31 -1.43 117.51 114.15 2ull h ILE 234 Ca -0.00 -1.49 0.02 0.00 1.00 0.00 0.00 64.86 64.38 2ull h ILE 234 Cb 0.38 2.10 -0.03 0.00 -0.74 0.00 0.00 36.82 38.53 2ull h ILE 234 CO 0.02 0.43 0.30 -0.07 0.00 0.00 0.00 178.15 178.83 2ull h LEU 235 N -0.11 0.49 -0.17 1.44 3.38 -0.84 -2.66 115.31 116.84 2ull h LEU 235 Ca 0.00 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.75 2ull h LEU 235 Cb 0.80 -0.11 0.01 0.00 0.09 0.00 0.00 40.66 41.45 2ull h LEU 235 CO 0.05 0.35 -0.86 0.77 0.09 0.00 0.00 178.44 178.83 2ull h SER 236 N 0.60 0.79 -0.62 -0.43 4.64 -1.41 0.32 113.55 117.44 2ull h SER 236 Ca 0.19 -0.56 -0.00 0.00 -0.47 0.00 0.00 61.79 60.95 2ull h SER 236 Cb -0.00 -0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 61.82 2ull h SER 236 CO -0.08 1.35 0.38 -0.61 -0.87 0.00 0.00 176.83 177.01 2ull h GLN 237 N 0.41 0.84 -0.50 4.77 4.15 -1.16 -2.75 115.11 120.88 2ull h GLN 237 Ca -0.07 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.28 2ull h GLN 237 Cb 1.49 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 29.00 2ull h GLN 237 CO 0.17 0.59 0.00 0.66 -1.93 0.00 0.00 178.83 178.31 2ull n TYR 238 N -4.41 0.66 -2.49 3.99 4.01 -1.01 -4.96 117.16 112.95 2ull n TYR 238 Ca 0.06 -0.50 -0.20 0.00 -0.16 0.00 0.00 57.90 57.11 2ull n TYR 238 Cb 0.07 -0.02 -0.00 0.00 -0.31 0.00 0.00 39.34 39.08 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 0.95 -0.43 3.85 2.72 0.00 -0.61 -4.98 105.19 106.69 2ull n GLY 239 Ca 0.17 -0.04 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 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 -5.70 4.23 -0.09 0.99 1.43 0.10 -4.70 118.68 114.94 2ull s LEU 240 Ca 0.06 1.08 0.02 0.00 -1.03 0.00 0.00 54.13 54.26 2ull s LEU 240 Cb -0.03 -3.59 0.01 0.00 0.03 0.00 0.00 46.19 42.62 2ull s LEU 240 CO 0.07 -0.02 -0.14 -0.44 0.23 0.00 0.00 176.35 176.05 2ull s SER 241 N -2.05 2.19 0.28 2.29 0.01 -0.35 -4.61 113.70 111.45 2ull s SER 241 Ca 0.45 -0.37 -0.30 0.00 1.31 0.00 0.00 55.95 57.04 2ull s SER 241 Cb -0.13 -0.98 -0.11 0.00 0.21 0.00 0.00 66.02 65.02 2ull s SER 241 CO 0.20 0.01 1.55 -0.22 0.41 0.00 0.00 173.24 175.19 2ull s LEU 242 N 0.91 4.36 -0.20 2.44 2.96 -1.26 -0.99 118.68 126.90 2ull s LEU 242 Ca -0.09 2.87 -0.26 0.00 -0.22 0.00 0.00 54.13 56.43 2ull s LEU 242 Cb -0.15 -3.63 -0.01 0.00 0.50 0.00 0.00 46.19 42.90 2ull s LEU 242 CO 0.00 -0.85 0.88 -0.69 -1.32 0.00 0.00 176.35 174.36 2ull s VAL 243 N 0.03 4.83 0.31 1.68 1.01 -0.86 -4.89 120.40 122.50 2ull s VAL 243 Ca 0.62 1.70 0.06 0.00 0.00 0.00 0.00 61.98 64.37 2ull s VAL 243 Cb -0.46 -4.17 -0.06 0.00 0.00 0.00 0.00 36.38 31.69 2ull s VAL 243 CO 0.46 -0.04 -0.03 0.42 0.00 0.00 0.00 175.10 175.90 2ull s THR 244 N 2.55 1.66 0.00 3.92 -4.23 -1.26 -4.35 115.64 113.93 2ull s THR 244 Ca 0.39 -2.10 0.00 0.00 -1.18 0.00 0.00 61.69 58.80 2ull s THR 244 Cb -0.16 -2.58 0.00 0.00 1.34 0.00 0.00 72.50 71.10 2ull s THR 244 CO 0.10 -0.21 0.00 0.61 -0.54 0.00 0.00 174.62 174.58