#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 6.37 -0.47 0.00 -0.87 -1.26 -0.79 114.94 117.93 2ull s ASN 15 Ca 0.00 0.18 -0.28 0.00 -1.57 0.00 0.00 52.86 51.19 2ull s ASN 15 Cb 0.00 -2.28 0.03 0.00 -0.02 0.00 0.00 41.25 38.98 2ull s ASN 15 CO 0.00 -0.44 1.07 -0.63 -2.57 0.00 0.00 177.10 174.54 2ull s ILE 16 N 2.42 4.30 -0.02 0.60 -1.09 0.32 -4.97 121.20 122.76 2ull s ILE 16 Ca 0.20 1.11 0.04 0.00 -2.23 0.00 0.00 60.65 59.77 2ull s ILE 16 Cb -0.15 -4.55 -0.00 0.00 -1.58 0.00 0.00 42.46 36.18 2ull s ILE 16 CO 0.12 -0.94 -0.13 -0.69 -1.23 0.00 0.00 174.94 172.08 2ull s VAL 17 N 4.22 1.04 0.36 2.92 1.01 -1.26 -2.82 120.40 125.86 2ull s VAL 17 Ca 0.45 -0.53 -0.28 0.00 0.00 0.00 0.00 61.98 61.61 2ull s VAL 17 Cb -0.08 -0.89 -0.11 0.00 0.00 0.00 0.00 36.38 35.30 2ull s VAL 17 CO 0.29 0.30 1.50 -0.83 0.00 0.00 0.00 175.10 176.37 2ull s GLY 18 N -0.08 2.78 0.00 4.51 0.00 0.33 -2.95 107.32 111.91 2ull s GLY 18 Ca 0.01 1.56 0.00 0.00 0.00 0.00 0.00 44.72 46.29 2ull s GLY 18 CO 0.00 2.31 0.00 0.61 0.00 0.00 0.00 173.10 176.02 2ull n GLY 19 N 0.81 2.79 3.82 0.20 0.00 0.56 -0.78 105.19 112.59 2ull n GLY 19 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.50 4.05 0.34 -0.61 -4.36 -1.15 -2.86 121.20 114.10 2ull s ILE 31 Ca 0.00 0.75 -0.26 0.00 -0.26 0.00 0.00 60.65 60.88 2ull s ILE 31 Cb 0.00 -3.44 -0.10 0.00 1.25 0.00 0.00 42.46 40.17 2ull s ILE 31 CO 0.00 -0.79 0.96 -0.70 0.24 0.00 0.00 174.94 174.66 2ull s GLU 32 N -4.77 4.52 0.02 0.37 2.12 -1.26 -0.84 118.70 118.85 2ull s GLU 32 Ca 0.59 1.36 -0.11 0.00 0.36 0.00 0.00 54.97 57.17 2ull s GLU 32 Cb -0.14 -2.75 0.01 0.00 0.26 0.00 0.00 34.13 31.51 2ull s GLU 32 CO 0.49 0.21 0.23 1.52 -0.54 0.00 0.00 175.26 177.17 2ull s TYR 33 N -1.63 -0.03 0.22 5.30 1.13 -0.55 -4.75 117.35 117.03 2ull s TYR 33 Ca 0.51 -0.07 0.06 0.00 -1.41 0.00 0.00 57.07 56.17 2ull s TYR 33 Cb -0.19 0.02 -0.04 0.00 -1.10 0.00 0.00 41.96 40.65 2ull s TYR 33 CO 0.24 -0.40 0.20 -1.54 -2.51 0.00 0.00 175.55 171.54 2ull s SER 34 N -1.73 5.65 -0.19 -0.18 1.04 0.01 -1.24 113.70 117.06 2ull s SER 34 Ca -0.09 -0.16 0.01 0.00 0.48 0.00 0.00 55.95 56.18 2ull s SER 34 Cb -0.04 -1.49 0.04 0.00 0.10 0.00 0.00 66.02 64.64 2ull s SER 34 CO -0.00 -0.00 -0.10 -0.63 0.98 0.00 0.00 173.24 173.49 2ull s ILE 35 N -1.98 1.54 -1.56 -1.02 1.09 0.16 -1.85 121.20 117.58 2ull s ILE 35 Ca 0.32 -0.93 -0.15 0.00 -1.10 0.00 0.00 60.65 58.80 2ull s ILE 35 Cb -0.09 -1.63 0.10 0.00 -1.06 0.00 0.00 42.46 39.78 2ull s ILE 35 CO 0.25 0.17 0.96 0.59 -0.10 0.00 0.00 174.94 176.81 2ull n ASN 36 N 4.72 -4.60 -2.06 3.58 3.02 0.10 -1.28 115.26 118.73 2ull n ASN 36 Ca -0.14 -0.82 -0.17 0.00 -0.03 0.00 0.00 54.58 53.42 2ull n ASN 36 Cb 0.47 -3.71 -0.03 0.00 -0.61 0.00 0.00 39.78 35.90 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 -2.80 -4.92 0.00 6.41 3.02 -1.26 -4.82 115.26 110.88 2ull n ASN 38 Ca 0.05 0.21 0.00 0.00 -0.03 0.00 0.00 54.58 54.81 2ull n ASN 38 Cb 0.52 -4.24 0.00 0.00 -0.61 0.00 0.00 39.78 35.45 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 -0.90 1.07 -1.76 5.41 0.00 -0.41 -5.09 120.51 118.83 2ull n ALA 39 Ca -0.20 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 52.88 2ull n ALA 39 Cb 0.63 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.10 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 5.44 -0.19 0.00 0.01 -1.19 -4.75 113.70 114.02 2ull s SER 40 Ca 0.00 2.39 0.01 0.00 1.31 0.00 0.00 55.95 59.65 2ull s SER 40 Cb 0.00 -2.60 0.04 0.00 0.21 0.00 0.00 66.02 63.67 2ull s SER 40 CO 0.00 -1.43 -0.11 -0.76 0.41 0.00 0.00 173.24 171.35 2ull s LEU 41 N -3.80 2.22 0.00 2.44 1.43 -1.26 -0.66 118.68 119.05 2ull s LEU 41 Ca 0.74 -0.83 0.00 0.00 -1.03 0.00 0.00 54.13 53.01 2ull s LEU 41 Cb -0.30 -1.25 0.00 0.00 0.03 0.00 0.00 46.19 44.67 2ull s LEU 41 CO 0.34 -0.12 0.01 0.00 0.23 0.00 0.00 176.35 176.81 2ull s SER 43 N -1.32 3.80 0.27 0.00 0.01 -0.37 -1.49 113.70 114.60 2ull s SER 43 Ca 0.01 -0.52 -0.29 0.00 1.31 0.00 0.00 55.95 56.46 2ull s SER 43 Cb -0.00 -0.55 -0.09 0.00 0.21 0.00 0.00 66.02 65.59 2ull s SER 43 CO 0.01 0.21 1.11 -0.69 0.41 0.00 0.00 173.24 174.29 2ull s VAL 44 N -1.04 3.50 0.00 3.43 1.01 -0.02 -2.72 120.40 124.55 2ull s VAL 44 Ca 0.16 1.47 0.00 0.00 0.00 0.00 0.00 61.98 63.61 2ull s VAL 44 Cb -0.10 -3.94 0.00 0.00 0.00 0.00 0.00 36.38 32.34 2ull s VAL 44 CO 0.08 0.33 0.00 0.61 0.00 0.00 0.00 175.10 176.12 2ull n GLY 44 N 1.32 1.02 3.16 4.51 0.00 -0.10 -0.32 105.19 114.78 2ull n GLY 44 Ca -0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.16 0.20 1.61 0.08 -1.15 -4.01 117.98 114.56 2ull s PHE 45 Ca 0.00 0.32 -0.30 0.00 0.12 0.00 0.00 56.93 57.07 2ull s PHE 45 Cb 0.00 0.05 -0.09 0.00 -0.57 0.00 0.00 43.02 42.42 2ull s PHE 45 CO 0.00 -0.25 1.30 -1.12 -0.10 0.00 0.00 175.22 175.05 2ull s SER 46 N -0.73 6.91 0.17 1.36 0.01 -1.26 -1.31 113.70 118.85 2ull s SER 46 Ca -0.08 2.38 -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 -0.51 0.15 0.68 0.41 0.00 0.00 173.24 173.99 2ull s VAL 47 N 0.11 0.05 0.14 3.43 -7.23 -0.03 -1.90 120.40 114.97 2ull s VAL 47 Ca 0.56 -1.83 0.07 0.00 -1.81 0.00 0.00 61.98 58.97 2ull s VAL 47 Cb -0.36 -2.21 -0.04 0.00 0.56 0.00 0.00 36.38 34.33 2ull s VAL 47 CO 0.38 -0.22 -0.15 0.42 -0.31 0.00 0.00 175.10 175.23 2ull s THR 48 N -4.08 1.47 -0.41 5.32 -4.23 -0.17 -1.59 115.64 111.94 2ull s THR 48 Ca 0.29 -1.86 0.04 0.00 -1.18 0.00 0.00 61.69 58.98 2ull s THR 48 Cb 0.06 -1.70 0.17 0.00 1.34 0.00 0.00 72.50 72.37 2ull s THR 48 CO 0.06 -0.45 0.35 -0.60 -0.54 0.00 0.00 174.62 173.44 2ull s ARG 48 N -2.94 0.90 7.69 3.99 3.52 -0.15 -0.94 118.95 131.03 2ull s ARG 48 Ca 0.13 -2.05 0.00 0.00 -0.13 0.00 0.00 55.73 53.68 2ull s ARG 48 Cb -0.04 -1.35 0.00 0.00 -1.56 0.00 0.00 34.95 32.00 2ull s ARG 48 CO 0.04 -1.38 0.00 0.41 -0.81 0.00 0.00 175.30 173.56 2ull n GLY 48 N 2.87 3.21 2.53 8.12 0.00 -1.26 -2.42 105.19 118.24 2ull n GLY 48 Ca 0.29 -0.15 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 2ull n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ull n ALA 48 N 11.69 6.59 -3.42 4.61 0.00 -1.26 -4.80 120.51 133.92 2ull n ALA 48 Ca 0.00 -4.04 -0.12 0.00 0.00 0.00 0.00 53.44 49.28 2ull n ALA 48 Cb 0.00 -2.52 -0.10 0.00 0.00 0.00 0.00 19.45 16.83 2ull n ALA 48 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2ull s THR 49 N -2.17 -0.52 0.47 0.00 2.01 -1.01 -5.15 115.64 109.27 2ull s THR 49 Ca 0.52 -0.05 -0.20 0.00 0.31 0.00 0.00 61.69 62.26 2ull s THR 49 Cb 0.23 -0.75 -0.09 0.00 0.01 0.00 0.00 72.50 71.90 2ull s THR 49 CO -0.14 -0.12 1.01 -0.54 -0.69 0.00 0.00 174.62 174.15 2ull s LYS 50 N 2.48 3.92 0.08 4.92 1.02 -1.26 -0.98 119.74 129.92 2ull s LYS 50 Ca 0.10 1.29 -0.26 0.00 0.02 0.00 0.00 55.97 57.12 2ull s LYS 50 Cb -0.15 -2.12 0.09 0.00 -0.52 0.00 0.00 37.83 35.13 2ull s LYS 50 CO -0.14 -0.32 1.16 0.20 -0.92 0.00 0.00 175.35 175.33 2ull s GLY 51 N -2.06 -0.06 -0.05 -3.33 0.00 -0.62 -0.74 107.32 100.47 2ull s GLY 51 Ca 0.66 -0.05 -0.04 0.00 0.00 0.00 0.00 44.72 45.29 2ull s GLY 51 CO 0.18 3.37 0.12 -0.11 0.00 0.00 0.00 173.10 176.66 2ull s PHE 52 N -2.19 -0.13 0.37 1.90 -0.12 -0.74 -0.85 117.98 116.21 2ull s PHE 52 Ca 0.24 0.33 -0.14 0.00 -0.05 0.00 0.00 56.93 57.31 2ull s PHE 52 Cb -0.01 0.04 -0.08 0.00 -0.63 0.00 0.00 43.02 42.33 2ull s PHE 52 CO 0.02 -0.07 0.78 0.14 -0.05 0.00 0.00 175.22 176.04 2ull s VAL 53 N 0.14 4.67 0.06 -2.49 -7.23 -0.43 -0.74 120.40 114.39 2ull s VAL 53 Ca -0.01 0.92 -0.02 0.00 -1.81 0.00 0.00 61.98 61.06 2ull s VAL 53 Cb -0.02 -3.65 0.01 0.00 0.56 0.00 0.00 36.38 33.28 2ull s VAL 53 CO -0.00 -0.34 0.13 1.07 -0.31 0.00 0.00 175.10 175.65 2ull n THR 54 N -0.76 0.00 -2.85 5.32 5.66 -0.16 -0.92 114.28 120.57 2ull n THR 54 Ca 0.04 -0.16 -0.38 0.00 -3.05 0.00 0.00 64.05 60.50 2ull n THR 54 Cb 0.54 0.16 -0.06 0.00 -1.55 0.00 0.00 70.33 69.41 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 -1.17 3.31 0.24 1.79 0.00 -1.26 -1.74 121.76 122.93 2ull s ALA 55 Ca 0.03 0.48 -0.05 0.00 0.00 0.00 0.00 51.96 52.42 2ull s ALA 55 Cb -0.01 -3.11 0.26 0.00 0.00 0.00 0.00 23.12 20.26 2ull s ALA 55 CO 0.02 0.22 1.78 0.78 0.00 0.00 0.00 175.76 178.56 2ull h GLY 56 N 3.68 1.08 2.00 0.00 0.00 -1.58 -2.87 103.07 105.39 2ull h GLY 56 Ca -0.46 -0.64 0.00 0.00 0.00 0.00 0.00 47.33 46.23 2ull h GLY 56 CO 0.66 0.60 0.00 1.12 0.00 0.00 0.00 176.54 178.92 2ull h HIS 57 N 0.96 0.00 0.00 5.60 2.07 -1.86 -2.62 115.15 119.30 2ull h HIS 57 Ca 0.21 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.73 2ull h HIS 57 Cb 0.31 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.29 2ull h HIS 57 CO 0.02 0.00 0.00 0.00 -3.07 0.00 0.00 177.93 174.88 2ull s GLY 59 N -3.59 -0.01 0.26 0.00 0.00 -0.99 -4.84 107.32 98.15 2ull s GLY 59 Ca 0.05 2.67 0.02 0.00 0.00 0.00 0.00 44.72 47.46 2ull s GLY 59 CO 0.42 1.31 0.43 -0.51 0.00 0.00 0.00 173.10 174.74 2ull s THR 59 N -0.73 5.20 0.23 0.90 -4.23 -1.26 -4.87 115.64 110.87 2ull s THR 59 Ca 0.04 -0.66 -0.31 0.00 -1.18 0.00 0.00 61.69 59.59 2ull s THR 59 Cb -0.02 -3.83 -0.15 0.00 1.34 0.00 0.00 72.50 69.85 2ull s THR 59 CO -0.06 -0.36 1.19 0.52 -0.54 0.00 0.00 174.62 175.37 2ull n VAL 59 N -1.32 1.25 -1.11 2.29 0.31 -1.26 -2.11 118.33 116.37 2ull n VAL 59 Ca -0.07 -0.31 -0.04 0.00 -0.01 0.00 0.00 64.34 63.92 2ull n VAL 59 Cb 0.56 -1.07 -0.02 0.00 -0.91 0.00 0.00 33.84 32.40 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 1.79 -3.64 -4.86 4.52 5.03 0.18 -4.96 115.26 113.32 2ull n ASN 60 Ca 0.12 0.09 -0.31 0.00 0.87 0.00 0.00 54.58 55.35 2ull n ASN 60 Cb 0.29 -1.47 -0.04 0.00 -1.02 0.00 0.00 39.78 37.54 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 -2.07 3.22 -0.21 5.41 0.00 -0.90 -4.80 121.76 122.41 2ull s ALA 61 Ca 0.00 -0.00 -0.11 0.00 0.00 0.00 0.00 51.96 51.84 2ull s ALA 61 Cb 0.00 -2.89 -0.05 0.00 0.00 0.00 0.00 23.12 20.18 2ull s ALA 61 CO 0.00 -0.07 0.19 0.99 0.00 0.00 0.00 175.76 176.87 2ull s THR 62 N -2.43 5.36 -0.13 0.00 2.01 -1.26 -1.09 115.64 118.09 2ull s THR 62 Ca 0.55 0.28 -0.07 0.00 0.31 0.00 0.00 61.69 62.75 2ull s THR 62 Cb -0.10 -3.53 -0.04 0.00 0.01 0.00 0.00 72.50 68.84 2ull s THR 62 CO 0.29 0.38 0.13 0.00 -0.69 0.00 0.00 174.62 174.73 2ull s ALA 64 N 0.74 3.82 0.01 7.40 0.00 -0.27 -0.72 121.76 132.74 2ull s ALA 64 Ca 0.10 -0.66 0.04 0.00 0.00 0.00 0.00 51.96 51.44 2ull s ALA 64 Cb -0.13 -1.96 -0.01 0.00 0.00 0.00 0.00 23.12 21.02 2ull s ALA 64 CO 0.02 0.56 -0.12 1.03 0.00 0.00 0.00 175.76 177.25 2ull s ARG 65 N -0.85 0.92 -0.05 0.00 0.52 -0.77 -1.06 118.95 117.65 2ull s ARG 65 Ca 0.14 -0.54 -0.00 0.00 -0.52 0.00 0.00 55.73 54.80 2ull s ARG 65 Cb -0.12 -0.89 0.03 0.00 0.52 0.00 0.00 34.95 34.48 2ull s ARG 65 CO 0.03 0.24 -0.02 0.42 0.02 0.00 0.00 175.30 175.99 2ull s ILE 66 N -0.51 0.40 -1.27 1.52 1.01 -0.46 -0.81 121.20 121.08 2ull s ILE 66 Ca 0.03 0.02 -0.00 0.00 0.00 0.00 0.00 60.65 60.70 2ull s ILE 66 Cb -0.06 -0.50 0.00 0.00 0.01 0.00 0.00 42.46 41.91 2ull s ILE 66 CO 0.00 0.23 0.05 0.61 0.00 0.00 0.00 174.94 175.83 2ull n GLY 67 N 4.54 -0.24 2.63 6.18 0.00 -1.26 -2.51 105.19 114.53 2ull n GLY 67 Ca -0.17 -0.24 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 -1.05 2.07 3.58 -0.02 0.00 -1.26 -5.02 105.19 103.49 2ull n GLY 81 Ca -0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.52 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 -3.17 2.98 0.08 4.61 0.00 -1.04 -5.07 121.76 120.14 2ull s ALA 82 Ca 0.00 -0.93 -0.31 0.00 0.00 0.00 0.00 51.96 50.73 2ull s ALA 82 Cb 0.00 -1.19 -0.08 0.00 0.00 0.00 0.00 23.12 21.84 2ull s ALA 82 CO 0.00 0.58 1.62 0.08 0.00 0.00 0.00 175.76 178.05 2ull s VAL 83 N -0.85 3.04 -0.09 0.00 1.01 -1.26 -1.36 120.40 120.89 2ull s VAL 83 Ca 0.14 0.53 0.11 0.00 0.00 0.00 0.00 61.98 62.75 2ull s VAL 83 Cb -0.11 -3.34 -0.16 0.00 0.00 0.00 0.00 36.38 32.77 2ull s VAL 83 CO 0.03 0.00 0.11 1.33 0.00 0.00 0.00 175.10 176.58 2ull n VAL 84 N 4.63 0.57 -3.15 2.92 0.24 -0.22 -4.92 118.33 118.39 2ull n VAL 84 Ca 0.15 -0.44 0.00 0.00 -2.04 0.00 0.00 64.34 62.01 2ull n VAL 84 Cb 0.40 -0.41 0.00 0.00 -1.47 0.00 0.00 33.84 32.36 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 2.11 -0.85 3.04 7.63 0.00 -1.20 -1.91 105.19 114.01 2ull n GLY 85 Ca -0.14 -0.75 -0.09 0.00 0.00 0.00 0.00 46.02 45.03 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 -3.00 0.26 -0.27 2.61 -4.23 -0.57 -1.11 115.64 109.33 2ull s THR 87 Ca 0.00 -1.26 -0.29 0.00 -1.18 0.00 0.00 61.69 58.96 2ull s THR 87 Cb 0.00 -0.77 -0.03 0.00 1.34 0.00 0.00 72.50 73.05 2ull s THR 87 CO 0.00 -0.64 1.81 -0.36 -0.54 0.00 0.00 174.62 174.89 2ull s PHE 88 N -2.28 1.78 0.13 3.99 0.40 -0.25 -0.57 117.98 121.18 2ull s PHE 88 Ca -0.07 0.54 0.03 0.00 -0.60 0.00 0.00 56.93 56.83 2ull s PHE 88 Cb -0.04 -4.07 -0.15 0.00 0.51 0.00 0.00 43.02 39.27 2ull s PHE 88 CO -0.03 -3.21 1.28 0.00 0.70 0.00 0.00 175.22 173.96 2ull h ALA 88 N 12.47 0.36 -1.90 5.36 0.00 -1.58 0.54 119.26 134.51 2ull h ALA 88 Ca -0.35 -0.83 0.14 0.00 0.00 0.00 0.00 54.91 53.86 2ull h ALA 88 Cb 1.18 -0.09 -0.18 0.00 0.00 0.00 0.00 17.79 18.70 2ull h ALA 88 CO 1.01 1.06 0.59 0.00 0.00 0.00 0.00 179.25 181.90 2ull s ALA 89 N -2.88 -1.91 0.01 0.00 0.00 -1.22 -4.84 121.76 110.93 2ull s ALA 89 Ca -0.02 1.31 -0.28 0.00 0.00 0.00 0.00 51.96 52.98 2ull s ALA 89 Cb 0.09 -0.03 0.09 0.00 0.00 0.00 0.00 23.12 23.27 2ull s ALA 89 CO 0.84 -0.56 0.80 -0.98 0.00 0.00 0.00 175.76 175.85 2ull s ARG 90 N -2.40 0.95 -0.09 0.00 1.04 -1.26 -2.15 118.95 115.03 2ull s ARG 90 Ca 0.04 -0.21 -0.02 0.00 -1.04 0.00 0.00 55.73 54.50 2ull s ARG 90 Cb -0.01 0.44 0.03 0.00 -2.04 0.00 0.00 34.95 33.37 2ull s ARG 90 CO -0.05 -0.39 0.01 0.08 -0.04 0.00 0.00 175.30 174.91 2ull s VAL 91 N -2.76 0.38 -0.29 4.99 1.01 -0.01 -4.99 120.40 118.73 2ull s VAL 91 Ca 0.01 0.03 -0.16 0.00 0.00 0.00 0.00 61.98 61.86 2ull s VAL 91 Cb -0.01 -0.59 0.16 0.00 0.00 0.00 0.00 36.38 35.94 2ull s VAL 91 CO -0.06 0.19 1.03 0.12 0.00 0.00 0.00 175.10 176.37 2ull s PHE 94 N 1.96 -0.50 0.00 5.22 5.36 -1.26 -1.43 117.98 127.34 2ull s PHE 94 Ca 0.04 0.98 0.00 0.00 -0.96 0.00 0.00 56.93 56.99 2ull s PHE 94 Cb -0.13 0.30 0.00 0.00 -0.34 0.00 0.00 43.02 42.85 2ull s PHE 94 CO -0.06 -0.25 0.00 -0.35 -1.46 0.00 0.00 175.22 173.10 2ull n PRO 95 N 3.82 2.71 0.00 10.12 -0.04 -1.26 -4.96 135.00 145.38 2ull n PRO 95 Ca -0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 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 2.05 1.61 0.55 0.00 -0.06 -4.75 105.19 109.59 2ull n GLY 100 Ca 0.00 -0.28 -0.14 0.00 0.00 0.00 0.00 46.02 45.60 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 3.91 2.45 -3.04 1.61 3.02 -1.26 -1.17 115.26 120.78 2ull n ASN 101 Ca 0.00 -1.95 -0.16 0.00 -0.03 0.00 0.00 54.58 52.44 2ull n ASN 101 Cb 0.00 0.12 -0.03 0.00 -0.61 0.00 0.00 39.78 39.26 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 -1.30 -1.76 -4.06 6.41 2.03 -1.18 -3.98 116.55 112.72 2ull n ASP 102 Ca -0.08 -2.77 -0.07 0.00 0.52 0.00 0.00 54.79 52.39 2ull n ASP 102 Cb 0.28 0.59 -0.10 0.00 -0.72 0.00 0.00 41.12 41.17 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 0.21 0.54 -0.09 -0.67 1.70 -0.51 -3.48 118.95 116.65 2ull s ARG 103 Ca 0.32 -1.07 -0.31 0.00 -0.47 0.00 0.00 55.73 54.20 2ull s ARG 103 Cb 0.08 0.19 0.12 0.00 -0.57 0.00 0.00 34.95 34.77 2ull s ARG 103 CO -0.14 -0.10 1.03 0.00 -1.08 0.00 0.00 175.30 175.01 2ull s ALA 104 N -3.32 -1.93 0.00 7.88 0.00 -0.71 -0.83 121.76 122.85 2ull s ALA 104 Ca 0.01 1.29 0.01 0.00 0.00 0.00 0.00 51.96 53.27 2ull s ALA 104 Cb 0.04 0.12 -0.00 0.00 0.00 0.00 0.00 23.12 23.27 2ull s ALA 104 CO -0.08 -0.63 -0.03 1.67 0.00 0.00 0.00 175.76 176.70 2ull s TRP 105 N -2.71 0.23 -0.22 0.00 1.48 -0.91 -0.99 118.94 115.82 2ull s TRP 105 Ca 0.06 -0.11 -0.07 0.00 -1.06 0.00 0.00 56.10 54.92 2ull s TRP 105 Cb -0.01 -0.15 -0.04 0.00 -1.16 0.00 0.00 33.47 32.12 2ull s TRP 105 CO -0.07 -0.03 0.07 0.08 -4.06 0.00 0.00 176.95 172.95 2ull s VAL 106 N -0.27 4.57 -0.17 -0.66 1.01 0.08 -1.40 120.40 123.55 2ull s VAL 106 Ca -0.01 -0.10 -0.25 0.00 0.00 0.00 0.00 61.98 61.62 2ull s VAL 106 Cb -0.02 -3.10 -0.02 0.00 0.00 0.00 0.00 36.38 33.24 2ull s VAL 106 CO -0.00 0.39 0.81 -0.55 0.00 0.00 0.00 175.10 175.75 2ull s SER 107 N 1.05 6.93 0.31 3.32 0.15 0.27 -1.80 113.70 123.93 2ull s SER 107 Ca 0.04 1.14 0.07 0.00 0.70 0.00 0.00 55.95 57.90 2ull s SER 107 Cb -0.14 -2.44 -0.02 0.00 -1.71 0.00 0.00 66.02 61.70 2ull s SER 107 CO 0.03 -0.39 0.32 -0.76 1.20 0.00 0.00 173.24 173.64 2ull s LEU 108 N 2.15 3.79 0.59 3.45 1.43 0.08 -1.51 118.68 128.66 2ull s LEU 108 Ca 0.37 -0.33 -0.04 0.00 -1.03 0.00 0.00 54.13 53.10 2ull s LEU 108 Cb -0.16 -2.42 0.03 0.00 0.03 0.00 0.00 46.19 43.66 2ull s LEU 108 CO 0.12 -0.29 0.88 0.42 0.23 0.00 0.00 176.35 177.71 2ull s THR 109 N -2.22 3.15 0.59 5.49 -4.23 -0.80 -4.34 115.64 113.29 2ull s THR 109 Ca 0.40 -0.26 0.40 0.00 -1.18 0.00 0.00 61.69 61.04 2ull s THR 109 Cb -0.07 -3.25 0.42 0.00 1.34 0.00 0.00 72.50 70.93 2ull s THR 109 CO 0.27 -0.24 2.30 -1.28 -0.54 0.00 0.00 174.62 175.14 2ull h SER 110 N -0.17 0.00 0.90 3.99 0.87 -1.98 -2.23 113.55 114.93 2ull h SER 110 Ca -0.45 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.06 2ull h SER 110 Cb 1.28 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.23 2ull h SER 110 CO 0.59 0.01 -0.23 0.00 -0.53 0.00 0.00 176.83 176.66 2ull h ALA 111 N 1.99 1.03 -2.35 6.23 0.00 -1.95 -3.45 119.26 120.76 2ull h ALA 111 Ca -0.00 -0.21 -0.51 0.00 0.00 0.00 0.00 54.91 54.19 2ull h ALA 111 Cb 0.06 -0.04 0.10 0.00 0.00 0.00 0.00 17.79 17.92 2ull h ALA 111 CO 0.00 0.29 0.35 -0.65 0.00 0.00 0.00 179.25 179.24 2ull s GLN 112 N -3.67 2.62 -0.22 0.00 -1.52 -0.84 -4.18 119.66 111.85 2ull s GLN 112 Ca 0.00 0.91 0.01 0.00 -1.95 0.00 0.00 55.36 54.33 2ull s GLN 112 Cb 0.10 -1.96 0.05 0.00 -0.22 0.00 0.00 33.01 30.99 2ull s GLN 112 CO 0.64 -1.31 -0.07 0.99 -0.25 0.00 0.00 175.29 175.29 2ull s THR 113 N -3.05 1.61 0.12 -0.19 2.01 0.03 -4.90 115.64 111.28 2ull s THR 113 Ca 0.59 -1.17 -0.30 0.00 0.31 0.00 0.00 61.69 61.12 2ull s THR 113 Cb -0.15 -1.80 -0.06 0.00 0.01 0.00 0.00 72.50 70.50 2ull s THR 113 CO 0.55 -0.00 1.01 -0.76 -0.69 0.00 0.00 174.62 174.72 2ull s LEU 114 N 1.38 4.49 -0.01 4.42 1.43 -1.26 -0.52 118.68 128.60 2ull s LEU 114 Ca -0.04 1.87 0.02 0.00 -1.03 0.00 0.00 54.13 54.95 2ull s LEU 114 Cb -0.18 -3.59 -0.01 0.00 0.03 0.00 0.00 46.19 42.44 2ull s LEU 114 CO -0.07 -0.13 -0.07 -0.76 0.23 0.00 0.00 176.35 175.56 2ull s LEU 119 N -0.01 2.01 -1.57 1.79 1.43 -1.13 -4.93 118.68 116.27 2ull s LEU 119 Ca 0.48 -0.12 -0.09 0.00 -1.03 0.00 0.00 54.13 53.36 2ull s LEU 119 Cb -0.25 -0.36 -0.05 0.00 0.03 0.00 0.00 46.19 45.57 2ull s LEU 119 CO 0.31 0.08 2.83 -0.81 0.23 0.00 0.00 176.35 178.99 2ull n PRO 120 N 2.92 3.84 -4.04 1.29 -0.04 -1.26 -4.44 135.00 133.27 2ull n PRO 120 Ca -0.13 -2.45 -0.07 0.00 -0.04 0.00 0.00 63.50 60.80 2ull n PRO 120 Cb 0.58 -2.79 -0.09 0.00 -0.04 0.00 0.00 33.50 31.15 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 1.60 0.65 -0.02 0.54 0.52 -1.26 -1.21 118.95 119.77 2ull s ARG 120 Ca 0.66 -1.14 0.01 0.00 -0.52 0.00 0.00 55.73 54.74 2ull s ARG 120 Cb 0.18 0.23 0.01 0.00 0.52 0.00 0.00 34.95 35.89 2ull s ARG 120 CO -0.07 -0.14 -0.04 0.08 0.02 0.00 0.00 175.30 175.15 2ull s VAL 120 N -3.81 0.43 0.21 3.52 1.01 -0.30 -0.51 120.40 120.94 2ull s VAL 120 Ca 0.06 -0.16 -0.30 0.00 0.00 0.00 0.00 61.98 61.58 2ull s VAL 120 Cb 0.07 -0.41 -0.08 0.00 0.00 0.00 0.00 36.38 35.96 2ull s VAL 120 CO -0.10 0.15 1.18 0.00 0.00 0.00 0.00 175.10 176.33 2ull s ALA 120 N 0.30 3.43 -0.38 5.51 0.00 0.04 -0.45 121.76 130.21 2ull s ALA 120 Ca -0.03 0.95 0.02 0.00 0.00 0.00 0.00 51.96 52.89 2ull s ALA 120 Cb -0.07 -3.40 0.15 0.00 0.00 0.00 0.00 23.12 19.81 2ull s ALA 120 CO -0.00 -0.34 0.28 1.21 0.00 0.00 0.00 175.76 176.91 2ull s ASN 120 N -0.09 2.11 0.00 0.00 2.47 -1.26 -4.67 114.94 113.51 2ull s ASN 120 Ca 0.51 -2.56 0.00 0.00 0.42 0.00 0.00 52.86 51.23 2ull s ASN 120 Cb -0.33 -0.34 0.00 0.00 -1.45 0.00 0.00 41.25 39.14 2ull s ASN 120 CO 0.38 -0.24 0.00 0.61 -3.72 0.00 0.00 177.10 174.13 2ull n GLY 120 N 3.49 0.42 0.08 1.21 0.00 -1.26 -4.36 105.19 104.77 2ull n GLY 120 Ca 0.20 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.26 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 1.35 -0.06 -4.08 1.61 2.88 -1.26 -5.08 113.62 108.99 2ull n SER 120 Ca 0.00 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.42 2ull n SER 120 Cb 0.00 -0.67 -0.11 0.00 -0.75 0.00 0.00 64.21 62.68 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 -1.29 0.70 -0.19 0.66 0.08 -1.26 -4.59 117.98 112.09 2ull s PHE 120 Ca 0.00 -0.58 -0.02 0.00 0.12 0.00 0.00 56.93 56.45 2ull s PHE 120 Cb 0.00 -0.42 -0.00 0.00 -0.57 0.00 0.00 43.02 42.03 2ull s PHE 120 CO 0.00 -0.10 -0.10 0.08 -0.10 0.00 0.00 175.22 175.00 2ull s VAL 120 N -1.80 2.98 0.37 -0.44 1.01 0.40 -4.89 120.40 118.03 2ull s VAL 120 Ca -0.06 -0.64 -0.25 0.00 0.00 0.00 0.00 61.98 61.03 2ull s VAL 120 Cb -0.07 -2.31 -0.09 0.00 0.00 0.00 0.00 36.38 33.91 2ull s VAL 120 CO -0.01 0.47 1.06 -0.89 0.00 0.00 0.00 175.10 175.73 2ull s THR 120 N 1.19 3.68 -0.48 3.92 2.01 -1.26 -1.15 115.64 123.56 2ull s THR 120 Ca 0.02 1.37 -0.20 0.00 0.31 0.00 0.00 61.69 63.20 2ull s THR 120 Cb -0.14 -3.75 0.04 0.00 0.01 0.00 0.00 72.50 68.66 2ull s THR 120 CO -0.04 0.09 0.62 -0.69 -0.69 0.00 0.00 174.62 173.91 2ull s VAL 121 N -1.55 4.87 -0.11 3.82 1.01 -0.35 -4.26 120.40 123.84 2ull s VAL 121 Ca 0.55 -0.27 -0.27 0.00 0.00 0.00 0.00 61.98 61.99 2ull s VAL 121 Cb -0.24 -4.25 -0.26 0.00 0.00 0.00 0.00 36.38 31.63 2ull s VAL 121 CO 0.30 -0.71 0.85 0.03 0.00 0.00 0.00 175.10 175.58 2ull h ARG 122 N 8.94 0.06 0.00 2.72 3.08 -1.07 -0.72 114.38 127.39 2ull h ARG 122 Ca -0.27 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.70 2ull h ARG 122 Cb 1.10 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.18 2ull h ARG 122 CO 0.93 0.98 0.00 0.41 -1.07 0.00 0.00 179.97 181.22 2ull n GLY 123 N 1.45 1.95 2.70 0.04 0.00 -1.23 -4.67 105.19 105.43 2ull n GLY 123 Ca -0.10 -0.36 -0.06 0.00 0.00 0.00 0.00 46.02 45.50 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 0.00 2.00 -4.66 1.61 3.41 -1.26 -0.57 113.62 114.14 2ull n SER 124 Ca 0.00 -2.45 -0.42 0.00 -0.26 0.00 0.00 58.87 55.74 2ull n SER 124 Cb 0.00 -0.48 -0.03 0.00 -0.26 0.00 0.00 64.21 63.44 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 -3.78 3.63 -0.17 6.66 2.01 -1.26 -4.86 115.64 117.87 2ull s THR 125 Ca 0.30 0.75 -0.29 0.00 0.31 0.00 0.00 61.69 62.76 2ull s THR 125 Cb 0.37 -3.50 -0.03 0.00 0.01 0.00 0.00 72.50 69.35 2ull s THR 125 CO -0.02 -0.08 1.47 -0.70 -0.69 0.00 0.00 174.62 174.60 2ull s GLU 129 N 4.08 4.05 0.59 4.92 2.12 -1.26 -4.75 118.70 128.45 2ull s GLU 129 Ca 0.72 1.75 -0.17 0.00 0.36 0.00 0.00 54.97 57.63 2ull s GLU 129 Cb -0.32 -3.91 -0.04 0.00 0.26 0.00 0.00 34.13 30.12 2ull s GLU 129 CO 0.29 -0.96 1.09 0.00 -0.54 0.00 0.00 175.26 175.13 2ull s ALA 130 N 4.24 2.65 0.73 6.30 0.00 -1.26 -5.05 121.76 129.37 2ull s ALA 130 Ca 0.65 0.59 -0.07 0.00 0.00 0.00 0.00 51.96 53.13 2ull s ALA 130 Cb -0.25 -3.30 0.08 0.00 0.00 0.00 0.00 23.12 19.65 2ull s ALA 130 CO 0.24 -0.90 1.04 0.00 0.00 0.00 0.00 175.76 176.14 2ull s ALA 131 N -2.17 3.14 0.37 0.00 0.00 -1.26 -4.99 121.76 116.85 2ull s ALA 131 Ca 0.68 -1.04 -0.28 0.00 0.00 0.00 0.00 51.96 51.32 2ull s ALA 131 Cb -0.20 -2.55 -0.10 0.00 0.00 0.00 0.00 23.12 20.27 2ull s ALA 131 CO 0.34 -1.41 1.42 0.08 0.00 0.00 0.00 175.76 176.18 2ull s VAL 132 N -3.29 2.27 0.00 0.00 1.01 -1.26 -2.26 120.40 116.87 2ull s VAL 132 Ca 0.62 0.27 0.00 0.00 0.00 0.00 0.00 61.98 62.87 2ull s VAL 132 Cb -0.10 -3.17 0.00 0.00 0.00 0.00 0.00 36.38 33.12 2ull s VAL 132 CO 0.45 0.06 0.00 0.61 0.00 0.00 0.00 175.10 176.22 2ull n GLY 133 N 0.57 2.94 3.73 4.51 0.00 -0.04 -5.00 105.19 111.89 2ull n GLY 133 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.38 2.09 0.71 4.61 0.00 -0.96 -4.57 121.76 121.26 2ull s ALA 134 Ca 0.00 0.73 -0.11 0.00 0.00 0.00 0.00 51.96 52.58 2ull s ALA 134 Cb 0.00 -3.43 0.02 0.00 0.00 0.00 0.00 23.12 19.71 2ull s ALA 134 CO 0.00 -1.91 1.07 0.00 0.00 0.00 0.00 175.76 174.92 2ull s ALA 135 N -2.22 2.62 -0.08 0.00 0.00 -1.26 -0.30 121.76 120.52 2ull s ALA 135 Ca 0.71 0.03 -0.30 0.00 0.00 0.00 0.00 51.96 52.40 2ull s ALA 135 Cb -0.26 -3.16 0.11 0.00 0.00 0.00 0.00 23.12 19.82 2ull s ALA 135 CO 0.47 -1.29 0.96 0.54 0.00 0.00 0.00 175.76 176.44 2ull s VAL 136 N -3.07 0.00 0.21 0.00 0.11 -0.63 -4.71 120.40 112.31 2ull s VAL 136 Ca 0.58 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.65 2ull s VAL 136 Cb -0.14 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.66 2ull s VAL 136 CO 0.55 0.00 0.03 0.00 -3.33 0.00 0.00 175.10 172.35 2ull s ARG 138 N -3.95 0.52 -0.03 0.00 1.70 0.40 -0.38 118.95 117.21 2ull s ARG 138 Ca 0.29 -0.84 0.02 0.00 -0.47 0.00 0.00 55.73 54.74 2ull s ARG 138 Cb 0.07 0.19 0.01 0.00 -0.57 0.00 0.00 34.95 34.65 2ull s ARG 138 CO 0.08 -0.11 -0.08 0.45 -1.08 0.00 0.00 175.30 174.55 2ull s SER 139 N -2.16 1.13 0.25 -2.89 0.15 0.04 -0.88 113.70 109.34 2ull s SER 139 Ca -0.05 -0.17 -0.21 0.00 0.70 0.00 0.00 55.95 56.22 2ull s SER 139 Cb -0.01 -0.33 0.03 0.00 -1.71 0.00 0.00 66.02 64.00 2ull s SER 139 CO -0.05 0.05 0.69 -0.83 1.20 0.00 0.00 173.24 174.29 2ull s GLY 140 N 0.27 -0.20 0.00 9.45 0.00 -1.00 -2.96 107.32 112.89 2ull s GLY 140 Ca -0.04 -0.14 0.22 0.00 0.00 0.00 0.00 44.72 44.76 2ull s GLY 140 CO 0.00 -0.04 1.68 -0.96 0.00 0.00 0.00 173.10 173.78 2ull n ARG 141 N -0.44 0.68 0.00 2.90 -4.01 -1.14 -1.87 116.66 112.78 2ull n ARG 141 Ca -0.07 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.74 2ull n ARG 141 Cb 0.60 -1.50 0.00 0.00 -3.04 0.00 0.00 32.46 28.52 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 -1.00 0.00 0.35 8.89 -1.04 -1.26 -4.82 114.28 115.39 2ull n THR 142 Ca 0.16 0.00 0.07 0.00 -2.04 0.00 0.00 64.05 62.25 2ull n THR 142 Cb 0.08 -1.31 0.11 0.00 -1.82 0.00 0.00 70.33 67.38 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 -2.91 0.31 -4.69 12.58 -2.24 -1.26 -5.01 114.28 111.08 2ull n THR 143 Ca 0.00 -0.66 0.00 0.00 -2.27 0.00 0.00 64.05 61.12 2ull n THR 143 Cb 0.50 1.05 0.00 0.00 -2.10 0.00 0.00 70.33 69.78 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 0.84 1.25 3.67 3.38 0.00 -0.78 -4.66 105.19 108.88 2ull n GLY 156 Ca 0.11 -0.67 -0.40 0.00 0.00 0.00 0.00 46.02 45.05 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 3.40 0.00 1.61 5.04 -1.26 -2.36 117.35 123.78 2ull s TYR 157 Ca 0.00 1.02 0.02 0.00 -2.44 0.00 0.00 57.07 55.67 2ull s TYR 157 Cb 0.00 -2.84 -0.01 0.00 0.35 0.00 0.00 41.96 39.46 2ull s TYR 157 CO 0.00 -0.17 -0.06 -0.65 -1.34 0.00 0.00 175.55 173.33 2ull s GLN 158 N 1.88 0.46 0.25 4.97 -1.52 -0.06 -4.98 119.66 120.66 2ull s GLN 158 Ca 0.31 -0.28 0.11 0.00 -1.95 0.00 0.00 55.36 53.55 2ull s GLN 158 Cb -0.16 -0.41 -0.05 0.00 -0.22 0.00 0.00 33.01 32.17 2ull s GLN 158 CO 0.11 0.11 -0.19 0.00 -0.25 0.00 0.00 175.29 175.07 2ull n GLY 160 N -0.39 1.89 3.12 0.00 0.00 -0.21 -4.37 105.19 105.24 2ull n GLY 160 Ca -0.07 -0.09 -0.12 0.00 0.00 0.00 0.00 46.02 45.74 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 0.16 0.07 0.27 2.61 -4.23 -1.26 -1.61 115.64 111.65 2ull s THR 161 Ca 0.00 -0.59 -0.29 0.00 -1.18 0.00 0.00 61.69 59.63 2ull s THR 161 Cb 0.00 -0.45 -0.10 0.00 1.34 0.00 0.00 72.50 73.30 2ull s THR 161 CO 0.00 -0.32 1.29 -0.63 -0.54 0.00 0.00 174.62 174.41 2ull s ILE 162 N -1.23 3.00 -0.00 2.99 1.01 0.59 -1.79 121.20 125.77 2ull s ILE 162 Ca -0.13 0.92 0.00 0.00 0.00 0.00 0.00 60.65 61.44 2ull s ILE 162 Cb -0.07 -3.59 -0.00 0.00 0.01 0.00 0.00 42.46 38.82 2ull s ILE 162 CO 0.02 0.19 0.00 0.35 0.00 0.00 0.00 174.94 175.50 2ull n THR 163 N 1.60 0.00 -3.44 2.92 -2.24 -0.25 -0.86 114.28 112.01 2ull n THR 163 Ca 0.02 -0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.69 2ull n THR 163 Cb 0.42 -0.77 -0.02 0.00 -2.10 0.00 0.00 70.33 67.86 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 -2.00 -1.66 0.26 6.98 0.00 -1.24 -4.78 121.76 119.32 2ull s ALA 164 Ca -0.00 0.65 0.06 0.00 0.00 0.00 0.00 51.96 52.67 2ull s ALA 164 Cb 0.00 0.74 -0.06 0.00 0.00 0.00 0.00 23.12 23.80 2ull s ALA 164 CO 0.00 -0.73 -0.06 0.15 0.00 0.00 0.00 175.76 175.12 2ull s LYS 165 N -3.49 1.48 -1.35 0.00 1.02 -1.26 -0.41 119.74 115.73 2ull s LYS 165 Ca 0.01 -1.74 -0.08 0.00 0.02 0.00 0.00 55.97 54.18 2ull s LYS 165 Cb -0.01 -1.04 0.01 0.00 -0.52 0.00 0.00 37.83 36.27 2ull s LYS 165 CO -0.11 0.03 1.15 -1.71 -0.92 0.00 0.00 175.35 173.79 2ull n ASN 166 N -0.53 -5.77 -4.75 2.83 4.05 -1.21 -4.95 115.26 104.95 2ull n ASN 166 Ca -0.06 -0.56 -0.38 0.00 0.45 0.00 0.00 54.58 54.03 2ull n ASN 166 Cb 0.63 -5.00 -0.06 0.00 1.23 0.00 0.00 39.78 36.58 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 -3.33 5.16 -0.04 3.44 1.01 -0.19 -4.44 120.40 122.01 2ull s VAL 167 Ca 0.52 0.87 -0.19 0.00 0.00 0.00 0.00 61.98 63.18 2ull s VAL 167 Cb -0.23 -3.77 -0.05 0.00 0.00 0.00 0.00 36.38 32.33 2ull s VAL 167 CO 0.73 0.39 0.54 -0.89 0.00 0.00 0.00 175.10 175.88 2ull s THR 168 N 0.21 5.02 -0.22 3.92 2.01 -1.26 -1.06 115.64 124.26 2ull s THR 168 Ca 0.24 1.11 -0.03 0.00 0.31 0.00 0.00 61.69 63.32 2ull s THR 168 Cb -0.15 -3.87 0.00 0.00 0.01 0.00 0.00 72.50 68.49 2ull s THR 168 CO 0.10 0.40 -0.06 0.00 -0.69 0.00 0.00 174.62 174.37 2ull s ALA 169 N -0.00 2.75 -0.93 7.40 0.00 0.12 -4.96 121.76 126.14 2ull s ALA 169 Ca 0.29 -1.22 -0.16 0.00 0.00 0.00 0.00 51.96 50.87 2ull s ALA 169 Cb -0.17 -1.65 0.18 0.00 0.00 0.00 0.00 23.12 21.48 2ull s ALA 169 CO 0.15 -0.49 1.01 -0.80 0.00 0.00 0.00 175.76 175.63 2ull s ASN 170 N 1.44 6.77 0.98 0.00 0.01 -1.26 -0.65 114.94 122.23 2ull s ASN 170 Ca 0.05 -2.50 -0.15 0.00 -0.71 0.00 0.00 52.86 49.55 2ull s ASN 170 Cb -0.14 -2.31 0.21 0.00 0.41 0.00 0.00 41.25 39.41 2ull s ASN 170 CO -0.04 -0.79 1.26 -1.22 -1.51 0.00 0.00 177.10 174.80 2ull n TYR 171 N 5.19 -3.93 -0.16 2.20 4.01 -0.62 -4.93 117.16 118.93 2ull n TYR 171 Ca 0.21 -1.17 -0.03 0.00 -0.16 0.00 0.00 57.90 56.76 2ull n TYR 171 Cb 0.47 -0.97 0.19 0.00 -0.31 0.00 0.00 39.34 38.72 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 -1.72 1.24 -0.00 -0.72 0.00 -2.02 -2.74 119.26 113.30 2ull h ALA 173 Ca -0.41 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.32 2ull h ALA 173 Cb 1.14 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2ull h ALA 173 CO 0.30 0.55 -0.07 0.39 0.00 0.00 0.00 179.25 180.41 2ull n GLU 174 N -4.30 0.34 0.00 0.00 4.71 -1.26 -5.01 120.64 115.13 2ull n GLU 174 Ca 0.05 -0.06 0.00 0.00 -0.01 0.00 0.00 57.16 57.14 2ull n GLU 174 Cb 0.19 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.12 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 1.36 1.11 3.81 0.62 0.00 -1.03 -4.78 105.19 106.27 2ull n GLY 175 Ca 0.12 -2.09 -0.33 0.00 0.00 0.00 0.00 46.02 43.71 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 -1.07 2.89 -0.08 4.61 0.00 -1.26 -1.58 121.76 125.26 2ull s ALA 176 Ca 0.00 0.47 -0.00 0.00 0.00 0.00 0.00 51.96 52.43 2ull s ALA 176 Cb 0.00 -3.22 0.02 0.00 0.00 0.00 0.00 23.12 19.93 2ull s ALA 176 CO 0.00 -0.36 -0.05 0.08 0.00 0.00 0.00 175.76 175.43 2ull s VAL 177 N -2.21 0.76 0.34 0.00 1.01 0.17 -0.88 120.40 119.59 2ull s VAL 177 Ca 0.65 -0.16 0.07 0.00 0.00 0.00 0.00 61.98 62.54 2ull s VAL 177 Cb -0.14 -0.81 -0.02 0.00 0.00 0.00 0.00 36.38 35.41 2ull s VAL 177 CO 0.24 0.31 0.38 -0.13 0.00 0.00 0.00 175.10 175.90 2ull s ARG 178 N 1.53 2.87 -1.18 2.72 0.52 -0.32 -0.70 118.95 124.40 2ull s ARG 178 Ca 0.00 -1.19 0.00 0.00 -0.52 0.00 0.00 55.73 54.02 2ull s ARG 178 Cb -0.13 -2.62 0.00 0.00 0.52 0.00 0.00 34.95 32.72 2ull s ARG 178 CO -0.05 0.05 0.00 0.41 0.02 0.00 0.00 175.30 175.74 2ull n GLY 179 N -1.51 0.23 3.75 -3.53 0.00 -1.22 -4.81 105.19 98.10 2ull n GLY 179 Ca -0.00 -0.36 -0.39 0.00 0.00 0.00 0.00 46.02 45.26 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 -3.54 4.41 0.31 0.99 1.43 -0.23 -4.37 118.68 117.69 2ull s LEU 180 Ca 0.00 1.30 -0.23 0.00 -1.03 0.00 0.00 54.13 54.17 2ull s LEU 180 Cb 0.00 -3.09 -0.10 0.00 0.03 0.00 0.00 46.19 43.03 2ull s LEU 180 CO 0.00 0.03 0.87 -0.89 0.23 0.00 0.00 176.35 176.59 2ull s THR 181 N 0.04 4.36 0.02 5.49 2.01 -0.31 -1.03 115.64 126.22 2ull s THR 181 Ca 0.36 1.58 0.03 0.00 0.31 0.00 0.00 61.69 63.96 2ull s THR 181 Cb -0.19 -3.89 -0.04 0.00 0.01 0.00 0.00 72.50 68.40 2ull s THR 181 CO 0.20 0.07 -0.02 -1.58 -0.69 0.00 0.00 174.62 172.60 2ull s GLN 182 N -2.25 2.66 0.07 4.92 0.74 0.45 -0.50 119.66 125.75 2ull s GLN 182 Ca 0.50 -0.70 -0.06 0.00 0.05 0.00 0.00 55.36 55.15 2ull s GLN 182 Cb -0.16 -2.59 -0.01 0.00 1.10 0.00 0.00 33.01 31.35 2ull s GLN 182 CO 0.21 0.60 0.12 0.20 -0.55 0.00 0.00 175.29 175.87 2ull s GLY 183 N -1.68 0.21 -0.03 2.59 0.00 0.25 -1.09 107.32 107.56 2ull s GLY 183 Ca 0.20 -0.79 0.18 0.00 0.00 0.00 0.00 44.72 44.31 2ull s GLY 183 CO 0.11 -0.95 1.47 1.16 0.00 0.00 0.00 173.10 174.90 2ull n ASN 184 N 0.04 3.85 -4.75 1.64 0.23 -0.74 -0.98 115.26 114.54 2ull n ASN 184 Ca -0.15 -2.15 -0.41 0.00 -0.53 0.00 0.00 54.58 51.35 2ull n ASN 184 Cb 0.62 -0.44 -0.04 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 -1.27 3.42 0.81 -2.53 0.00 -1.26 -4.68 121.76 116.24 2ull s ALA 185 Ca 0.42 0.93 -0.12 0.00 0.00 0.00 0.00 51.96 53.19 2ull s ALA 185 Cb 0.24 -3.37 0.08 0.00 0.00 0.00 0.00 23.12 20.07 2ull s ALA 185 CO 0.25 -0.27 1.16 0.00 0.00 0.00 0.00 175.76 176.90 2ull s MET 190 N -5.47 1.86 0.28 0.00 0.23 -1.26 -4.82 119.30 110.12 2ull s MET 190 Ca 0.62 -1.11 -0.01 0.00 -1.03 0.00 0.00 55.69 54.16 2ull s MET 190 Cb -0.12 0.58 -0.02 0.00 -1.53 0.00 0.00 34.83 33.75 2ull s MET 190 CO 0.50 -0.86 0.32 0.20 -2.03 0.00 0.00 175.02 173.15 2ull s GLY 191 N -3.00 1.53 0.31 3.16 0.00 -1.26 -1.35 107.32 106.71 2ull s GLY 191 Ca 0.13 -1.61 -0.29 0.00 0.00 0.00 0.00 44.72 42.95 2ull s GLY 191 CO 0.08 -1.18 1.47 0.54 0.00 0.00 0.00 173.10 174.01 2ull n ARG 192 N -0.46 2.44 0.00 2.90 1.74 -0.36 -1.82 116.66 121.10 2ull n ARG 192 Ca 0.02 0.86 0.00 0.00 -0.77 0.00 0.00 57.85 57.97 2ull n ARG 192 Cb 0.63 -2.57 0.00 0.00 -1.02 0.00 0.00 32.46 29.51 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 1.50 2.97 0.30 -0.13 0.00 -1.26 -4.69 105.19 103.88 2ull n GLY 193 Ca 0.07 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.29 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 0.00 0.00 -2.39 1.61 3.32 -1.68 -3.15 116.42 114.13 2ull h ASP 194 Ca 0.00 0.00 -0.61 0.00 0.02 0.00 0.00 57.03 56.44 2ull h ASP 194 Cb 0.00 0.00 0.13 0.00 0.22 0.00 0.00 39.33 39.68 2ull h ASP 194 CO 0.00 0.00 -0.10 -1.20 -1.72 0.00 0.00 179.24 176.22 2ull n SER 195 N -2.90 0.32 0.00 6.45 7.64 -1.26 -1.46 113.62 122.41 2ull n SER 195 Ca -0.03 1.06 0.00 0.00 1.01 0.00 0.00 58.87 60.91 2ull n SER 195 Cb 0.07 -1.21 0.00 0.00 -1.01 0.00 0.00 64.21 62.06 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 1.48 2.85 3.70 0.23 0.00 0.46 -1.24 105.19 112.67 2ull n GLY 196 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.79 2.01 0.36 -0.02 0.00 -0.53 -2.20 107.32 105.15 2ull s GLY 197 Ca 0.00 0.73 -0.28 0.00 0.00 0.00 0.00 44.72 45.17 2ull s GLY 197 CO 0.00 1.14 1.37 -0.56 0.00 0.00 0.00 173.10 175.05 2ull s SER 198 N -2.38 6.53 -0.17 1.64 0.01 -1.15 -0.79 113.70 117.39 2ull s SER 198 Ca 0.70 2.81 0.01 0.00 1.31 0.00 0.00 55.95 60.78 2ull s SER 198 Cb -0.26 -2.65 0.02 0.00 0.21 0.00 0.00 66.02 63.34 2ull s SER 198 CO 0.52 -0.72 -0.16 0.26 0.41 0.00 0.00 173.24 173.55 2ull s TRP 199 N -1.16 2.52 -0.02 2.43 0.52 -0.60 -0.78 118.94 121.85 2ull s TRP 199 Ca 0.52 -1.50 -0.12 0.00 0.02 0.00 0.00 56.10 55.02 2ull s TRP 199 Cb -0.42 -1.76 0.02 0.00 -1.15 0.00 0.00 33.47 30.16 2ull s TRP 199 CO 0.56 -0.75 0.25 -1.50 0.02 0.00 0.00 176.95 175.52 2ull s ILE 200 N 1.37 0.06 0.61 2.03 2.07 0.49 -0.18 121.20 127.65 2ull s ILE 200 Ca 0.04 -0.48 -0.11 0.00 -1.41 0.00 0.00 60.65 58.69 2ull s ILE 200 Cb -0.14 -0.52 -0.04 0.00 0.13 0.00 0.00 42.46 41.89 2ull s ILE 200 CO -0.11 -0.26 1.03 0.42 -1.91 0.00 0.00 174.94 174.10 2ull s THR 201 N -1.13 4.70 0.54 4.00 -4.23 -0.71 -0.79 115.64 118.01 2ull s THR 201 Ca -0.12 0.90 0.23 0.00 -1.18 0.00 0.00 61.69 61.52 2ull s THR 201 Cb -0.06 -3.86 0.31 0.00 1.34 0.00 0.00 72.50 70.23 2ull s THR 201 CO 0.03 -1.12 2.18 0.77 -0.54 0.00 0.00 174.62 175.94 2ull h SER 201 N -0.25 0.00 1.16 3.99 4.64 -1.91 -0.13 113.55 121.04 2ull h SER 201 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2ull h SER 201 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2ull h SER 201 CO 0.62 0.02 0.00 0.00 -0.87 0.00 0.00 176.83 176.60 2ull n ALA 202 N -2.42 2.01 0.00 5.18 0.00 -1.26 -4.92 120.51 119.10 2ull n ALA 202 Ca -0.03 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2ull n ALA 202 Cb 0.11 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.12 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 0.73 0.78 3.61 0.00 0.00 -0.06 -4.67 105.19 105.58 2ull n GLY 207 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.45 3.84 0.03 1.61 -1.52 -1.26 -0.50 119.66 121.41 2ull s GLN 208 Ca 0.00 0.73 -0.30 0.00 -1.95 0.00 0.00 55.36 53.84 2ull s GLN 208 Cb 0.00 -3.85 -0.07 0.00 -0.22 0.00 0.00 33.01 28.86 2ull s GLN 208 CO 0.00 -1.23 1.62 0.00 -0.25 0.00 0.00 175.29 175.44 2ull s ALA 209 N 4.20 3.65 -0.23 6.09 0.00 0.26 -1.74 121.76 134.00 2ull s ALA 209 Ca 0.47 1.11 0.01 0.00 0.00 0.00 0.00 51.96 53.55 2ull s ALA 209 Cb -0.09 -3.69 -0.19 0.00 0.00 0.00 0.00 23.12 19.15 2ull s ALA 209 CO 0.26 -1.14 -0.08 1.04 0.00 0.00 0.00 175.76 175.84 2ull n GLN 210 N 5.90 0.68 -3.56 0.00 1.13 0.75 -4.41 117.38 117.86 2ull n GLN 210 Ca 0.16 0.17 0.00 0.00 -1.94 0.00 0.00 57.00 55.39 2ull n GLN 210 Cb 0.41 -1.56 0.00 0.00 0.11 0.00 0.00 30.24 29.20 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 -1.11 -1.54 105.19 108.20 2ull n GLY 211 Ca -0.42 -0.96 -0.29 0.00 0.00 0.00 0.00 46.02 44.34 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 1.99 0.10 1.61 -7.23 -0.29 -1.55 120.40 112.03 2ull s VAL 212 Ca 0.00 -1.26 -0.31 0.00 -1.81 0.00 0.00 61.98 58.60 2ull s VAL 212 Cb 0.00 -1.69 -0.10 0.00 0.56 0.00 0.00 36.38 35.14 2ull s VAL 212 CO 0.00 0.38 1.87 0.80 -0.31 0.00 0.00 175.10 177.84 2ull n MET 213 N 1.98 2.77 -0.05 4.82 1.56 0.03 -0.72 117.12 127.52 2ull n MET 213 Ca -0.17 1.01 -0.07 0.00 -0.27 0.00 0.00 57.70 58.20 2ull n MET 213 Cb 0.52 -2.91 -0.02 0.00 2.15 0.00 0.00 33.22 32.95 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 6.05 1.63 -0.49 6.12 2.88 -0.02 -0.40 113.62 129.39 2ull n SER 214 Ca 0.19 0.26 0.00 0.00 -1.33 0.00 0.00 58.87 57.99 2ull n SER 214 Cb 0.37 -0.60 0.00 0.00 -0.75 0.00 0.00 64.21 63.24 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 2.13 1.91 0.00 0.46 0.00 -0.81 -4.84 105.19 104.03 2ull n GLY 215 Ca -0.12 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.08 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 -0.86 2.45 -0.02 0.00 -1.26 -0.42 105.19 105.08 2ull n GLY 216 Ca 0.00 -1.17 -0.40 0.00 0.00 0.00 0.00 46.02 44.45 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 8.06 -4.72 1.61 6.94 -0.51 -4.96 115.26 121.68 2ull n ASN 217 Ca 0.00 -2.96 -0.42 0.00 -0.02 0.00 0.00 54.58 51.18 2ull n ASN 217 Cb 0.00 -1.43 -0.03 0.00 -2.36 0.00 0.00 39.78 35.96 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 0.02 3.36 0.00 3.53 -7.23 -1.26 -4.65 120.40 114.17 2ull s VAL 218 Ca 0.58 0.98 0.00 0.00 -1.81 0.00 0.00 61.98 61.73 2ull s VAL 218 Cb 0.18 -3.63 0.00 0.00 0.56 0.00 0.00 36.38 33.49 2ull s VAL 218 CO -0.08 0.08 0.00 0.00 -0.31 0.00 0.00 175.10 174.79 2ull n GLN 219 N 3.88 0.28 -0.19 4.82 1.13 -0.08 -4.83 117.38 122.38 2ull n GLN 219 Ca 0.11 0.00 0.05 0.00 -1.94 0.00 0.00 57.00 55.22 2ull n GLN 219 Cb 0.43 0.00 0.33 0.00 0.11 0.00 0.00 30.24 31.11 2ull n GLN 219 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 2ull h SER 219 N -0.15 0.71 0.00 1.08 0.87 -1.96 -1.94 113.55 112.16 2ull h SER 219 Ca 0.00 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2ull h SER 219 Cb 0.00 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 61.81 2ull h SER 219 CO 0.00 0.47 0.00 -0.46 -0.53 0.00 0.00 176.83 176.31 2ull n ASN 219 N -4.47 0.00 0.00 6.23 6.94 -1.26 -4.86 115.26 117.84 2ull n ASN 219 Ca 0.10 -0.99 0.00 0.00 -0.02 0.00 0.00 54.58 53.67 2ull n ASN 219 Cb 0.19 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.61 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 0.42 1.23 3.34 4.83 0.00 -0.73 -5.00 105.19 109.28 2ull n GLY 219 Ca 0.12 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.96 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 -2.87 1.52 -0.15 1.61 2.20 -1.26 -1.22 114.94 114.76 2ull s ASN 219 Ca 0.00 -1.53 0.18 0.00 -0.94 0.00 0.00 52.86 50.57 2ull s ASN 219 Cb 0.00 0.35 0.36 0.00 -2.00 0.00 0.00 41.25 39.96 2ull s ASN 219 CO 0.00 -0.86 1.22 -0.46 -2.94 0.00 0.00 177.10 174.06 2ull n ASN 220 N -0.86 2.63 0.01 3.54 0.23 -0.46 -0.90 115.26 119.45 2ull n ASN 220 Ca 0.01 -3.16 0.11 0.00 -0.53 0.00 0.00 54.58 51.02 2ull n ASN 220 Cb 0.65 -0.47 0.50 0.00 -2.08 0.00 0.00 39.78 38.38 2ull n ASN 220 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2ull h GLY 221 N 4.04 0.00 -2.86 0.00 0.00 -1.97 -3.46 103.07 98.82 2ull h GLY 221 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.83 2ull h GLY 221 CO 0.00 0.00 -0.13 -0.26 0.00 0.00 0.00 176.54 176.15 2ull s ILE 222 N -2.67 5.05 0.81 2.60 -4.36 -1.21 -5.08 121.20 116.33 2ull s ILE 222 Ca -0.01 -0.14 -0.11 0.00 -0.26 0.00 0.00 60.65 60.14 2ull s ILE 222 Cb 0.09 -3.80 0.08 0.00 1.25 0.00 0.00 42.46 40.08 2ull s ILE 222 CO 0.82 -0.48 1.10 -2.84 0.24 0.00 0.00 174.94 173.78 2ull s PRO 222 N -3.99 1.94 0.49 0.37 0.02 -1.26 -4.86 135.00 127.71 2ull s PRO 222 Ca 0.43 1.18 0.25 0.00 0.02 0.00 0.00 61.00 62.87 2ull s PRO 222 Cb -0.10 -1.86 1.31 0.00 0.02 0.00 0.00 34.50 33.87 2ull s PRO 222 CO 0.34 -1.87 1.91 0.00 -0.33 0.00 0.00 177.00 177.05 2ull h ALA 222 N -1.30 2.52 -0.95 -1.55 0.00 -1.91 -1.24 119.26 114.83 2ull h ALA 222 Ca -0.44 -0.01 0.24 0.00 0.00 0.00 0.00 54.91 54.69 2ull h ALA 222 Cb 1.24 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.99 2ull h ALA 222 CO 0.50 -0.75 0.64 0.66 0.00 0.00 0.00 179.25 180.30 2ull h SER 222 N 0.15 0.30 0.39 0.00 4.64 -1.91 -1.36 113.55 115.77 2ull h SER 222 Ca 0.39 0.04 -0.07 0.00 -0.47 0.00 0.00 61.79 61.69 2ull h SER 222 Cb 1.32 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 63.38 2ull h SER 222 CO -0.06 0.10 -1.67 0.00 -0.87 0.00 0.00 176.83 174.32 2ull n GLN 223 N -4.46 0.64 -1.68 4.77 6.02 -0.48 -4.96 117.38 117.23 2ull n GLN 223 Ca 0.21 -0.02 -0.39 0.00 -0.01 0.00 0.00 57.00 56.78 2ull n GLN 223 Cb 0.83 -1.65 -0.03 0.00 1.02 0.00 0.00 30.24 30.41 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 -3.27 2.60 -0.42 -1.09 0.52 -0.51 -4.97 118.95 111.80 2ull s ARG 224 Ca -0.05 1.50 -0.10 0.00 -0.52 0.00 0.00 55.73 56.55 2ull s ARG 224 Cb 0.11 -4.46 0.08 0.00 0.52 0.00 0.00 34.95 31.20 2ull s ARG 224 CO 0.85 -2.72 0.28 0.45 0.02 0.00 0.00 175.30 174.18 2ull s SER 225 N 9.89 5.71 -0.25 0.23 0.15 -1.26 -3.95 113.70 124.22 2ull s SER 225 Ca 0.93 -1.47 -0.00 0.00 0.70 0.00 0.00 55.95 56.10 2ull s SER 225 Cb -0.22 -2.01 0.03 0.00 -1.71 0.00 0.00 66.02 62.11 2ull s SER 225 CO 0.29 -0.55 -0.08 -0.44 1.20 0.00 0.00 173.24 173.65 2ull s SER 226 N 2.17 4.22 -0.21 5.45 0.01 -0.16 -1.43 113.70 123.76 2ull s SER 226 Ca 0.03 -0.98 -0.10 0.00 1.31 0.00 0.00 55.95 56.21 2ull s SER 226 Cb -0.23 -1.62 -0.05 0.00 0.21 0.00 0.00 66.02 64.33 2ull s SER 226 CO 0.03 -0.13 0.13 -0.76 0.41 0.00 0.00 173.24 172.92 2ull s LEU 227 N 1.27 4.17 0.13 2.44 1.43 0.44 -0.58 118.68 127.99 2ull s LEU 227 Ca -0.01 0.20 0.11 0.00 -1.03 0.00 0.00 54.13 53.39 2ull s LEU 227 Cb -0.17 -2.09 -0.04 0.00 0.03 0.00 0.00 46.19 43.92 2ull s LEU 227 CO -0.05 0.16 -0.26 0.72 0.23 0.00 0.00 176.35 177.15 2ull s PHE 228 N 0.47 2.22 -0.15 0.29 -0.12 0.34 -0.84 117.98 120.20 2ull s PHE 228 Ca 0.08 -0.39 -0.24 0.00 -0.05 0.00 0.00 56.93 56.33 2ull s PHE 228 Cb -0.11 -1.19 -0.02 0.00 -0.63 0.00 0.00 43.02 41.06 2ull s PHE 228 CO -0.01 0.34 0.75 -2.00 -0.05 0.00 0.00 175.22 174.25 2ull s GLU 229 N -2.11 4.30 0.34 1.99 2.56 0.10 -1.16 118.70 124.73 2ull s GLU 229 Ca 0.14 0.89 -0.28 0.00 0.00 0.00 0.00 54.97 55.71 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 -0.22 1.32 0.54 -0.56 0.00 0.00 175.26 176.39 2ull n ARG 230 N 4.88 2.19 -0.01 4.30 1.74 -1.26 -1.13 116.66 127.37 2ull n ARG 230 Ca 0.02 0.77 -0.17 0.00 -0.77 0.00 0.00 57.85 57.70 2ull n ARG 230 Cb 0.50 -2.37 -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 2.63 0.91 -0.44 0.55 5.85 -1.61 -3.36 115.31 119.85 2ull h LEU 231 Ca -0.47 -0.61 0.08 0.00 0.84 0.00 0.00 57.88 57.73 2ull h LEU 231 Cb 1.28 -0.27 -0.10 0.00 0.37 0.00 0.00 40.66 41.94 2ull h LEU 231 CO 0.63 1.41 -0.33 1.56 -0.34 0.00 0.00 178.44 181.37 2ull h GLN 232 N 0.51 -0.22 0.00 1.25 4.20 -1.89 -0.83 115.11 118.13 2ull h GLN 232 Ca -0.06 0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.64 2ull h GLN 232 Cb 1.43 0.05 -0.00 0.00 0.30 0.00 0.00 27.48 29.25 2ull h GLN 232 CO 0.16 -0.15 -0.11 -1.00 -0.67 0.00 0.00 178.83 177.06 2ull h PRO 233 N -0.23 0.00 -0.13 1.46 0.13 -1.99 -2.19 132.00 129.04 2ull h PRO 233 Ca 0.18 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.23 2ull h PRO 233 Cb 0.54 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.67 2ull h PRO 233 CO -0.57 0.11 -0.25 0.82 -0.23 0.00 0.00 178.00 177.89 2ull h ILE 234 N 0.00 1.37 -0.24 -3.56 2.04 -1.33 -0.80 117.51 114.99 2ull h ILE 234 Ca -0.00 -1.50 0.01 0.00 1.00 0.00 0.00 64.86 64.36 2ull h ILE 234 Cb 0.31 2.01 -0.01 0.00 -0.74 0.00 0.00 36.82 38.39 2ull h ILE 234 CO 0.01 0.44 0.14 -0.07 0.00 0.00 0.00 178.15 178.68 2ull h LEU 235 N 0.00 0.23 -0.60 1.44 3.38 -0.82 -2.57 115.31 116.37 2ull h LEU 235 Ca 0.01 -0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.82 2ull h LEU 235 Cb 0.83 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 2ull h LEU 235 CO 0.06 0.17 -0.67 0.77 0.09 0.00 0.00 178.44 178.86 2ull h SER 236 N 0.29 0.17 -0.19 -0.43 4.64 -1.47 0.22 113.55 116.78 2ull h SER 236 Ca 0.09 -0.11 0.04 0.00 -0.47 0.00 0.00 61.79 61.34 2ull h SER 236 Cb -0.01 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 61.99 2ull h SER 236 CO -0.04 0.79 -0.03 -0.61 -0.87 0.00 0.00 176.83 176.07 2ull h GLN 237 N 0.10 0.02 -0.59 4.77 5.75 -0.91 -3.01 115.11 121.25 2ull h GLN 237 Ca -0.01 -0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.49 2ull h GLN 237 Cb 1.20 -0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.74 2ull h GLN 237 CO 0.10 0.01 0.00 0.66 -2.65 0.00 0.00 178.83 176.95 2ull n TYR 238 N -5.17 0.84 -3.61 3.99 4.01 -0.99 -4.97 117.16 111.26 2ull n TYR 238 Ca -0.03 -0.52 -0.24 0.00 -0.16 0.00 0.00 57.90 56.96 2ull n TYR 238 Cb 0.11 -0.04 0.08 0.00 -0.31 0.00 0.00 39.34 39.19 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 1.18 -0.54 3.87 2.72 0.00 -0.04 -4.99 105.19 107.39 2ull n GLY 239 Ca 0.20 0.25 -0.34 0.00 0.00 0.00 0.00 46.02 46.13 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 -7.27 4.34 -0.19 0.99 1.43 0.57 -4.70 118.68 113.84 2ull s LEU 240 Ca 0.56 0.76 -0.04 0.00 -1.03 0.00 0.00 54.13 54.39 2ull s LEU 240 Cb -0.25 -3.02 -0.02 0.00 0.03 0.00 0.00 46.19 42.94 2ull s LEU 240 CO 0.74 0.16 -0.04 -0.44 0.23 0.00 0.00 176.35 177.00 2ull s SER 241 N -1.84 4.52 -0.00 2.29 0.01 -0.11 -4.71 113.70 113.86 2ull s SER 241 Ca 0.34 -0.28 -0.30 0.00 1.31 0.00 0.00 55.95 57.02 2ull s SER 241 Cb -0.14 -1.76 -0.06 0.00 0.21 0.00 0.00 66.02 64.28 2ull s SER 241 CO 0.19 0.06 1.44 -0.22 0.41 0.00 0.00 173.24 175.12 2ull s LEU 242 N 1.02 4.32 -0.20 2.44 2.96 -1.26 -1.00 118.68 126.95 2ull s LEU 242 Ca 0.01 2.14 -0.29 0.00 -0.22 0.00 0.00 54.13 55.77 2ull s LEU 242 Cb -0.15 -3.56 -0.02 0.00 0.50 0.00 0.00 46.19 42.97 2ull s LEU 242 CO 0.01 -0.76 1.40 -0.69 -1.32 0.00 0.00 176.35 174.99 2ull s VAL 243 N 2.60 4.03 0.21 1.68 1.01 -0.80 -4.94 120.40 124.18 2ull s VAL 243 Ca 0.65 1.21 0.10 0.00 0.00 0.00 0.00 61.98 63.94 2ull s VAL 243 Cb -0.32 -3.91 -0.04 0.00 0.00 0.00 0.00 36.38 32.11 2ull s VAL 243 CO 0.27 -0.25 -0.20 0.42 0.00 0.00 0.00 175.10 175.33 2ull s THR 244 N 4.16 2.16 0.00 3.92 -4.23 -1.26 -4.39 115.64 115.99 2ull s THR 244 Ca 0.61 -2.10 0.00 0.00 -1.18 0.00 0.00 61.69 59.02 2ull s THR 244 Cb -0.23 -2.07 0.00 0.00 1.34 0.00 0.00 72.50 71.54 2ull s THR 244 CO 0.22 -0.29 0.00 0.61 -0.54 0.00 0.00 174.62 174.62