#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 6.49 -0.45 0.00 -0.87 -1.26 -1.41 114.94 117.43 2ull s ASN 15 Ca 0.00 0.39 -0.27 0.00 -1.57 0.00 0.00 52.86 51.42 2ull s ASN 15 Cb 0.00 -2.33 0.03 0.00 -0.02 0.00 0.00 41.25 38.93 2ull s ASN 15 CO 0.00 -0.49 1.00 -0.63 -2.57 0.00 0.00 177.10 174.41 2ull s ILE 16 N 2.62 4.40 -0.02 0.60 -1.09 0.30 -4.98 121.20 123.02 2ull s ILE 16 Ca 0.25 0.97 0.03 0.00 -2.23 0.00 0.00 60.65 59.67 2ull s ILE 16 Cb -0.15 -4.48 -0.00 0.00 -1.58 0.00 0.00 42.46 36.25 2ull s ILE 16 CO 0.12 -0.85 -0.12 -0.69 -1.23 0.00 0.00 174.94 172.17 2ull s VAL 17 N 3.95 0.95 0.34 2.92 1.01 -1.26 -2.62 120.40 125.69 2ull s VAL 17 Ca 0.41 -0.48 -0.29 0.00 0.00 0.00 0.00 61.98 61.62 2ull s VAL 17 Cb -0.09 -0.82 -0.11 0.00 0.00 0.00 0.00 36.38 35.36 2ull s VAL 17 CO 0.27 0.28 1.53 -0.83 0.00 0.00 0.00 175.10 176.35 2ull s GLY 18 N -0.04 2.61 0.00 4.51 0.00 -0.13 -3.00 107.32 111.27 2ull s GLY 18 Ca 0.00 1.57 0.00 0.00 0.00 0.00 0.00 44.72 46.29 2ull s GLY 18 CO 0.00 2.37 0.00 0.61 0.00 0.00 0.00 173.10 176.09 2ull n GLY 19 N 1.15 3.21 3.82 0.20 0.00 0.59 -0.80 105.19 113.36 2ull n GLY 19 Ca 0.04 0.00 -0.33 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 -2.76 4.06 0.49 -0.61 -4.36 -1.16 -2.59 121.20 114.26 2ull s ILE 31 Ca 0.00 1.01 -0.20 0.00 -0.26 0.00 0.00 60.65 61.20 2ull s ILE 31 Cb 0.00 -3.51 -0.08 0.00 1.25 0.00 0.00 42.46 40.12 2ull s ILE 31 CO 0.00 -0.55 1.05 -0.70 0.24 0.00 0.00 174.94 174.98 2ull s GLU 32 N -4.00 3.77 -0.06 0.37 2.12 -1.26 -0.78 118.70 118.86 2ull s GLU 32 Ca 0.62 1.38 -0.17 0.00 0.36 0.00 0.00 54.97 57.16 2ull s GLU 32 Cb -0.14 -2.09 0.04 0.00 0.26 0.00 0.00 34.13 32.19 2ull s GLU 32 CO 0.33 -0.46 0.40 1.52 -0.54 0.00 0.00 175.26 176.52 2ull s TYR 33 N -1.96 -0.33 0.21 5.30 1.13 -0.69 -4.77 117.35 116.24 2ull s TYR 33 Ca 0.68 0.63 0.05 0.00 -1.41 0.00 0.00 57.07 57.02 2ull s TYR 33 Cb -0.17 0.16 -0.03 0.00 -1.10 0.00 0.00 41.96 40.82 2ull s TYR 33 CO 0.20 -0.38 0.23 -1.54 -2.51 0.00 0.00 175.55 171.55 2ull s SER 34 N -0.91 5.82 -0.20 -0.18 1.04 -0.15 -1.64 113.70 117.49 2ull s SER 34 Ca -0.10 -0.09 0.01 0.00 0.48 0.00 0.00 55.95 56.25 2ull s SER 34 Cb -0.04 -1.59 0.02 0.00 0.10 0.00 0.00 66.02 64.51 2ull s SER 34 CO 0.04 -0.01 -0.16 -0.63 0.98 0.00 0.00 173.24 173.47 2ull s ILE 35 N -1.95 2.29 -1.45 -1.02 1.09 -0.02 -1.75 121.20 118.39 2ull s ILE 35 Ca 0.33 -1.02 -0.12 0.00 -1.10 0.00 0.00 60.65 58.74 2ull s ILE 35 Cb -0.09 -2.06 0.09 0.00 -1.06 0.00 0.00 42.46 39.35 2ull s ILE 35 CO 0.26 0.40 0.69 0.59 -0.10 0.00 0.00 174.94 176.78 2ull n ASN 36 N 4.61 -4.06 -2.25 3.58 3.02 0.12 -0.72 115.26 119.57 2ull n ASN 36 Ca -0.19 -0.61 -0.21 0.00 -0.03 0.00 0.00 54.58 53.54 2ull n ASN 36 Cb 0.48 -3.31 -0.02 0.00 -0.61 0.00 0.00 39.78 36.32 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 -2.51 -5.82 0.00 6.41 3.02 -1.26 -4.87 115.26 110.22 2ull n ASN 38 Ca 0.02 0.09 0.00 0.00 -0.03 0.00 0.00 54.58 54.65 2ull n ASN 38 Cb 0.53 -4.90 0.00 0.00 -0.61 0.00 0.00 39.78 34.80 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 -1.39 0.80 -1.24 5.41 0.00 0.11 -5.12 120.51 119.08 2ull n ALA 39 Ca -0.24 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 52.90 2ull n ALA 39 Cb 0.69 0.00 0.12 0.00 0.00 0.00 0.00 19.45 20.26 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 3.78 0.12 0.00 0.01 -1.19 -4.72 113.70 112.69 2ull s SER 40 Ca 0.00 1.56 0.10 0.00 1.31 0.00 0.00 55.95 58.92 2ull s SER 40 Cb 0.00 -2.25 -0.04 0.00 0.21 0.00 0.00 66.02 63.95 2ull s SER 40 CO 0.00 -2.45 -0.25 -0.76 0.41 0.00 0.00 173.24 170.19 2ull s LEU 41 N -6.12 2.30 0.00 2.44 1.43 -1.26 -0.84 118.68 116.63 2ull s LEU 41 Ca 0.63 -0.72 -0.05 0.00 -1.03 0.00 0.00 54.13 52.96 2ull s LEU 41 Cb -0.18 -1.12 0.02 0.00 0.03 0.00 0.00 46.19 44.95 2ull s LEU 41 CO 0.57 0.15 0.57 0.00 0.23 0.00 0.00 176.35 177.86 2ull s SER 43 N -3.20 3.38 0.27 0.00 0.01 0.29 -1.71 113.70 112.74 2ull s SER 43 Ca 0.27 -0.61 -0.29 0.00 1.31 0.00 0.00 55.95 56.63 2ull s SER 43 Cb -0.02 -0.35 -0.09 0.00 0.21 0.00 0.00 66.02 65.77 2ull s SER 43 CO 0.19 0.23 1.25 -0.69 0.41 0.00 0.00 173.24 174.63 2ull s VAL 44 N -0.93 3.11 0.00 3.43 1.01 0.04 -2.79 120.40 124.26 2ull s VAL 44 Ca 0.13 1.03 0.00 0.00 0.00 0.00 0.00 61.98 63.15 2ull s VAL 44 Cb -0.10 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.62 2ull s VAL 44 CO 0.04 0.21 0.00 0.61 0.00 0.00 0.00 175.10 175.97 2ull n GLY 44 N 1.47 1.21 3.15 4.51 0.00 -0.07 -0.30 105.19 115.17 2ull n GLY 44 Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.14 0.18 1.61 0.08 -1.14 -4.04 117.98 114.53 2ull s PHE 45 Ca 0.00 0.27 -0.30 0.00 0.12 0.00 0.00 56.93 57.02 2ull s PHE 45 Cb 0.00 0.04 -0.08 0.00 -0.57 0.00 0.00 43.02 42.41 2ull s PHE 45 CO 0.00 -0.26 1.30 -1.12 -0.10 0.00 0.00 175.22 175.04 2ull s SER 46 N -0.80 6.92 0.13 1.36 0.01 -1.26 -1.31 113.70 118.75 2ull s SER 46 Ca -0.09 2.35 -0.07 0.00 1.31 0.00 0.00 55.95 59.45 2ull s SER 46 Cb -0.05 -2.60 -0.02 0.00 0.21 0.00 0.00 66.02 63.56 2ull s SER 46 CO 0.02 -0.52 0.20 0.68 0.41 0.00 0.00 173.24 174.02 2ull s VAL 47 N 0.27 0.10 0.18 3.43 -7.23 -0.15 -1.98 120.40 115.03 2ull s VAL 47 Ca 0.57 -1.48 0.08 0.00 -1.81 0.00 0.00 61.98 59.35 2ull s VAL 47 Cb -0.36 -1.75 -0.04 0.00 0.56 0.00 0.00 36.38 34.79 2ull s VAL 47 CO 0.36 -0.45 -0.17 0.42 -0.31 0.00 0.00 175.10 174.95 2ull s THR 48 N -3.96 1.81 -0.38 5.32 -4.23 -0.31 -1.28 115.64 112.62 2ull s THR 48 Ca 0.15 -2.03 0.02 0.00 -1.18 0.00 0.00 61.69 58.65 2ull s THR 48 Cb 0.05 -1.92 0.15 0.00 1.34 0.00 0.00 72.50 72.12 2ull s THR 48 CO -0.03 -0.41 0.26 -0.60 -0.54 0.00 0.00 174.62 173.30 2ull s ARG 48 N -3.09 0.69 6.50 3.99 3.52 0.14 -1.05 118.95 129.66 2ull s ARG 48 Ca 0.18 -1.64 0.00 0.00 -0.13 0.00 0.00 55.73 54.14 2ull s ARG 48 Cb -0.04 -1.36 0.00 0.00 -1.56 0.00 0.00 34.95 31.99 2ull s ARG 48 CO 0.07 -1.28 0.00 0.41 -0.81 0.00 0.00 175.30 173.69 2ull n GLY 48 N 3.57 1.77 0.24 8.12 0.00 -1.26 -1.88 105.19 115.74 2ull n GLY 48 Ca 0.19 -0.48 0.12 0.00 0.00 0.00 0.00 46.02 45.85 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 10.40 2.59 -2.70 4.61 0.00 -1.26 -4.83 120.51 129.32 2ull n ALA 48 Ca 0.00 -0.30 -0.39 0.00 0.00 0.00 0.00 53.44 52.75 2ull n ALA 48 Cb 0.00 -1.26 -0.06 0.00 0.00 0.00 0.00 19.45 18.13 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 -1.94 5.14 0.27 0.00 2.01 -0.79 -5.05 115.64 115.29 2ull s THR 49 Ca 0.35 1.03 -0.10 0.00 0.31 0.00 0.00 61.69 63.27 2ull s THR 49 Cb 0.17 -3.86 -0.07 0.00 0.01 0.00 0.00 72.50 68.75 2ull s THR 49 CO 0.28 0.27 0.61 -0.54 -0.69 0.00 0.00 174.62 174.55 2ull s LYS 50 N 0.96 3.83 0.08 4.92 1.02 -1.26 -0.68 119.74 128.61 2ull s LYS 50 Ca 0.27 0.36 -0.25 0.00 0.02 0.00 0.00 55.97 56.37 2ull s LYS 50 Cb -0.16 -2.57 0.09 0.00 -0.52 0.00 0.00 37.83 34.67 2ull s LYS 50 CO 0.11 0.24 1.17 0.20 -0.92 0.00 0.00 175.35 176.15 2ull s GLY 51 N -2.48 0.01 -0.03 -3.33 0.00 -0.41 -0.97 107.32 100.11 2ull s GLY 51 Ca 0.49 -0.18 -0.03 0.00 0.00 0.00 0.00 44.72 45.00 2ull s GLY 51 CO 0.22 4.34 0.08 -0.11 0.00 0.00 0.00 173.10 177.63 2ull s PHE 52 N -2.05 -0.08 0.36 1.90 -0.12 -0.82 -0.97 117.98 116.20 2ull s PHE 52 Ca 0.27 0.19 -0.13 0.00 -0.05 0.00 0.00 56.93 57.20 2ull s PHE 52 Cb -0.02 0.02 -0.08 0.00 -0.63 0.00 0.00 43.02 42.31 2ull s PHE 52 CO 0.02 -0.06 0.76 0.14 -0.05 0.00 0.00 175.22 176.04 2ull s VAL 53 N -0.06 4.71 0.04 -2.49 -7.23 -0.43 -0.71 120.40 114.23 2ull s VAL 53 Ca -0.01 0.84 -0.02 0.00 -1.81 0.00 0.00 61.98 60.98 2ull s VAL 53 Cb -0.01 -3.66 0.01 0.00 0.56 0.00 0.00 36.38 33.27 2ull s VAL 53 CO 0.00 -0.34 0.09 1.07 -0.31 0.00 0.00 175.10 175.62 2ull n THR 54 N -0.78 0.00 -2.89 5.32 5.66 -0.16 -0.89 114.28 120.54 2ull n THR 54 Ca 0.03 -0.11 -0.37 0.00 -3.05 0.00 0.00 64.05 60.55 2ull n THR 54 Cb 0.53 0.11 -0.06 0.00 -1.55 0.00 0.00 70.33 69.37 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 -1.13 3.28 0.31 1.79 0.00 -1.26 -1.71 121.76 123.05 2ull s ALA 55 Ca 0.02 0.41 0.05 0.00 0.00 0.00 0.00 51.96 52.44 2ull s ALA 55 Cb -0.01 -3.06 0.53 0.00 0.00 0.00 0.00 23.12 20.58 2ull s ALA 55 CO 0.01 0.23 1.78 0.78 0.00 0.00 0.00 175.76 178.56 2ull h GLY 56 N 3.28 0.39 1.92 0.00 0.00 -1.58 -2.69 103.07 104.38 2ull h GLY 56 Ca -0.47 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 46.56 2ull h GLY 56 CO 0.65 0.27 0.00 -2.39 0.00 0.00 0.00 176.54 175.07 2ull n HIS 57 N -4.14 0.00 0.23 5.60 1.44 -1.26 -2.64 115.22 114.43 2ull n HIS 57 Ca -0.01 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.81 2ull n HIS 57 Cb 0.38 -0.46 0.44 0.00 0.12 0.00 0.00 29.99 30.47 2ull n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2ull s GLY 59 N -4.27 -0.03 0.56 0.00 0.00 -1.08 -4.85 107.32 97.64 2ull s GLY 59 Ca 0.01 2.52 -0.07 0.00 0.00 0.00 0.00 44.72 47.19 2ull s GLY 59 CO 0.63 1.03 0.90 -0.51 0.00 0.00 0.00 173.10 175.15 2ull s THR 59 N -1.17 4.42 0.11 0.90 -4.23 -1.26 -4.87 115.64 109.53 2ull s THR 59 Ca 0.06 0.32 -0.34 0.00 -1.18 0.00 0.00 61.69 60.56 2ull s THR 59 Cb -0.01 -3.73 -0.14 0.00 1.34 0.00 0.00 72.50 69.97 2ull s THR 59 CO -0.05 -0.80 1.62 0.52 -0.54 0.00 0.00 174.62 175.37 2ull n VAL 59 N -2.52 0.11 -0.25 2.29 0.31 -1.26 -1.65 118.33 115.36 2ull n VAL 59 Ca 0.03 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 2ull n VAL 59 Cb 0.56 -1.56 0.00 0.00 -0.91 0.00 0.00 33.84 31.92 2ull n VAL 59 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2ull n ASN 60 N 3.99 0.00 -4.75 4.52 2.85 0.78 -4.93 115.26 117.72 2ull n ASN 60 Ca 0.18 0.00 -0.41 0.00 -0.11 0.00 0.00 54.58 54.24 2ull n ASN 60 Cb 0.28 0.00 -0.02 0.00 1.24 0.00 0.00 39.78 41.29 2ull n ASN 60 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2ull s ALA 61 N -2.73 3.75 -0.18 5.20 0.00 -0.66 -4.45 121.76 122.70 2ull s ALA 61 Ca 0.00 1.56 -0.29 0.00 0.00 0.00 0.00 51.96 53.22 2ull s ALA 61 Cb 0.00 -3.65 0.00 0.00 0.00 0.00 0.00 23.12 19.48 2ull s ALA 61 CO 0.00 -0.96 1.04 0.99 0.00 0.00 0.00 175.76 176.83 2ull s THR 62 N 0.07 4.69 -0.04 0.00 2.01 -1.26 -1.02 115.64 120.10 2ull s THR 62 Ca 0.64 2.01 -0.16 0.00 0.31 0.00 0.00 61.69 64.48 2ull s THR 62 Cb -0.47 -4.29 -0.05 0.00 0.01 0.00 0.00 72.50 67.69 2ull s THR 62 CO 0.47 -0.11 0.44 0.00 -0.69 0.00 0.00 174.62 174.73 2ull s ALA 64 N 2.76 3.61 -0.03 7.40 0.00 0.06 -0.71 121.76 134.86 2ull s ALA 64 Ca 0.46 -0.19 0.03 0.00 0.00 0.00 0.00 51.96 52.26 2ull s ALA 64 Cb -0.17 -2.49 0.00 0.00 0.00 0.00 0.00 23.12 20.46 2ull s ALA 64 CO 0.11 0.31 -0.11 1.03 0.00 0.00 0.00 175.76 177.09 2ull s ARG 65 N -0.48 1.16 -0.11 0.00 0.52 -0.72 -1.08 118.95 118.24 2ull s ARG 65 Ca 0.25 -0.39 -0.01 0.00 -0.52 0.00 0.00 55.73 55.06 2ull s ARG 65 Cb -0.16 -1.06 0.03 0.00 0.52 0.00 0.00 34.95 34.27 2ull s ARG 65 CO 0.12 0.16 -0.07 0.42 0.02 0.00 0.00 175.30 175.96 2ull s ILE 66 N 0.12 0.97 -0.95 1.52 1.01 -0.20 -0.97 121.20 122.69 2ull s ILE 66 Ca -0.03 -0.28 -0.04 0.00 0.00 0.00 0.00 60.65 60.30 2ull s ILE 66 Cb -0.09 -1.02 0.00 0.00 0.01 0.00 0.00 42.46 41.37 2ull s ILE 66 CO 0.01 0.33 0.49 0.61 0.00 0.00 0.00 174.94 176.38 2ull n GLY 67 N 4.96 -0.05 3.25 6.18 0.00 -1.26 -2.63 105.19 115.64 2ull n GLY 67 Ca -0.12 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.31 1.94 3.73 -0.02 0.00 -1.26 -5.00 105.19 103.27 2ull n GLY 81 Ca -0.05 0.00 -0.35 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 -3.00 3.44 0.07 4.61 0.00 -1.08 -5.06 121.76 120.75 2ull s ALA 82 Ca 0.00 -0.76 -0.31 0.00 0.00 0.00 0.00 51.96 50.89 2ull s ALA 82 Cb 0.00 -1.61 -0.07 0.00 0.00 0.00 0.00 23.12 21.44 2ull s ALA 82 CO 0.00 0.59 1.43 0.08 0.00 0.00 0.00 175.76 177.86 2ull s VAL 83 N -0.90 3.41 -0.18 0.00 1.01 -1.26 -1.03 120.40 121.44 2ull s VAL 83 Ca 0.14 0.93 0.05 0.00 0.00 0.00 0.00 61.98 63.10 2ull s VAL 83 Cb -0.12 -3.60 -0.06 0.00 0.00 0.00 0.00 36.38 32.60 2ull s VAL 83 CO 0.03 0.04 0.19 1.33 0.00 0.00 0.00 175.10 176.68 2ull n VAL 84 N 4.31 0.00 -3.85 2.92 0.24 -0.24 -4.93 118.33 116.78 2ull n VAL 84 Ca 0.13 -0.31 0.00 0.00 -2.04 0.00 0.00 64.34 62.12 2ull n VAL 84 Cb 0.42 0.83 0.00 0.00 -1.47 0.00 0.00 33.84 33.63 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 1.41 -0.91 3.19 7.63 0.00 -1.22 -1.34 105.19 113.95 2ull n GLY 85 Ca 0.00 -1.21 -0.12 0.00 0.00 0.00 0.00 46.02 44.70 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 -2.98 0.22 -0.16 2.61 -4.23 -0.79 -0.76 115.64 109.55 2ull s THR 87 Ca 0.00 -1.95 -0.29 0.00 -1.18 0.00 0.00 61.69 58.26 2ull s THR 87 Cb 0.00 -2.23 -0.02 0.00 1.34 0.00 0.00 72.50 71.59 2ull s THR 87 CO 0.00 -0.31 1.40 -0.36 -0.54 0.00 0.00 174.62 174.81 2ull s PHE 88 N -3.98 2.54 0.05 3.99 0.40 -0.19 -0.58 117.98 120.21 2ull s PHE 88 Ca 0.29 0.75 0.00 0.00 -0.60 0.00 0.00 56.93 57.37 2ull s PHE 88 Cb 0.07 -3.69 -0.26 0.00 0.51 0.00 0.00 43.02 39.65 2ull s PHE 88 CO 0.06 -2.35 1.03 0.00 0.70 0.00 0.00 175.22 174.65 2ull h ALA 88 N 8.88 0.29 -1.94 5.36 0.00 -1.55 0.22 119.26 130.52 2ull h ALA 88 Ca -0.30 -1.03 0.05 0.00 0.00 0.00 0.00 54.91 53.63 2ull h ALA 88 Cb 1.13 0.11 -0.19 0.00 0.00 0.00 0.00 17.79 18.83 2ull h ALA 88 CO 0.98 1.16 0.44 0.00 0.00 0.00 0.00 179.25 181.82 2ull s ALA 89 N -2.65 -1.85 -0.08 0.00 0.00 -1.22 -4.84 121.76 111.12 2ull s ALA 89 Ca -0.05 1.31 -0.28 0.00 0.00 0.00 0.00 51.96 52.94 2ull s ALA 89 Cb 0.08 -0.15 0.06 0.00 0.00 0.00 0.00 23.12 23.11 2ull s ALA 89 CO 0.85 -0.45 0.64 -0.98 0.00 0.00 0.00 175.76 175.82 2ull s ARG 90 N -1.83 0.98 -0.16 0.00 1.04 -1.26 -2.20 118.95 115.51 2ull s ARG 90 Ca -0.02 0.33 -0.01 0.00 -1.04 0.00 0.00 55.73 54.99 2ull s ARG 90 Cb -0.01 0.46 0.04 0.00 -2.04 0.00 0.00 34.95 33.41 2ull s ARG 90 CO -0.00 -0.28 -0.03 0.08 -0.04 0.00 0.00 175.30 175.03 2ull s VAL 91 N -0.95 0.90 -0.29 4.99 1.01 -0.08 -4.98 120.40 121.00 2ull s VAL 91 Ca -0.09 -0.52 -0.16 0.00 0.00 0.00 0.00 61.98 61.21 2ull s VAL 91 Cb -0.01 -1.14 0.14 0.00 0.00 0.00 0.00 36.38 35.36 2ull s VAL 91 CO 0.08 0.08 0.92 0.12 0.00 0.00 0.00 175.10 176.30 2ull s PHE 94 N 1.72 -0.68 0.00 5.22 5.36 -1.25 -1.61 117.98 126.73 2ull s PHE 94 Ca 0.01 1.33 0.00 0.00 -0.96 0.00 0.00 56.93 57.31 2ull s PHE 94 Cb -0.15 0.41 0.00 0.00 -0.34 0.00 0.00 43.02 42.94 2ull s PHE 94 CO -0.07 -0.34 0.00 -0.35 -1.46 0.00 0.00 175.22 173.00 2ull n PRO 95 N 3.99 3.04 0.00 10.12 -0.04 -1.26 -4.98 135.00 145.87 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 2.07 2.57 0.55 0.00 -0.02 -4.74 105.19 110.62 2ull n GLY 100 Ca 0.00 -0.23 -0.22 0.00 0.00 0.00 0.00 46.02 45.57 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 3.95 2.84 -3.13 1.61 3.02 -1.26 -1.33 115.26 120.96 2ull n ASN 101 Ca 0.00 -2.51 -0.19 0.00 -0.03 0.00 0.00 54.58 51.85 2ull n ASN 101 Cb 0.00 0.20 -0.05 0.00 -0.61 0.00 0.00 39.78 39.31 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 -1.34 -1.39 -3.96 6.41 -0.08 -1.18 -3.91 116.55 111.10 2ull n ASP 102 Ca -0.12 -2.65 -0.08 0.00 -1.51 0.00 0.00 54.79 50.42 2ull n ASP 102 Cb 0.45 0.26 -0.09 0.00 2.34 0.00 0.00 41.12 44.08 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 0.13 0.66 -0.10 -0.67 1.70 -0.63 -3.48 118.95 116.56 2ull s ARG 103 Ca 0.32 -0.96 -0.32 0.00 -0.47 0.00 0.00 55.73 54.31 2ull s ARG 103 Cb 0.07 0.25 0.12 0.00 -0.57 0.00 0.00 34.95 34.82 2ull s ARG 103 CO -0.15 -0.17 1.04 0.00 -1.08 0.00 0.00 175.30 174.94 2ull s ALA 104 N -3.37 -1.94 -0.01 7.88 0.00 -0.69 -0.90 121.76 122.72 2ull s ALA 104 Ca 0.02 1.31 0.01 0.00 0.00 0.00 0.00 51.96 53.29 2ull s ALA 104 Cb 0.03 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 0.00 175.76 176.69 2ull s TRP 105 N -2.71 0.33 -0.26 0.00 1.48 -0.94 -0.99 118.94 115.85 2ull s TRP 105 Ca 0.07 -0.06 -0.10 0.00 -1.06 0.00 0.00 56.10 54.95 2ull s TRP 105 Cb -0.01 -0.24 -0.05 0.00 -1.16 0.00 0.00 33.47 32.01 2ull s TRP 105 CO -0.07 -0.02 0.17 0.08 -4.06 0.00 0.00 176.95 173.05 2ull s VAL 106 N 0.06 5.25 -0.20 -0.66 1.01 0.11 -1.34 120.40 124.62 2ull s VAL 106 Ca -0.00 0.15 -0.26 0.00 0.00 0.00 0.00 61.98 61.86 2ull s VAL 106 Cb -0.03 -3.47 -0.01 0.00 0.00 0.00 0.00 36.38 32.87 2ull s VAL 106 CO -0.00 0.30 0.90 -0.55 0.00 0.00 0.00 175.10 175.75 2ull s SER 107 N 1.41 6.97 0.27 3.32 0.15 0.25 -1.95 113.70 124.12 2ull s SER 107 Ca 0.07 1.21 0.04 0.00 0.70 0.00 0.00 55.95 57.96 2ull s SER 107 Cb -0.15 -2.48 -0.03 0.00 -1.71 0.00 0.00 66.02 61.65 2ull s SER 107 CO 0.07 -0.51 0.41 -0.76 1.20 0.00 0.00 173.24 173.66 2ull s LEU 108 N 2.63 4.23 0.71 3.45 1.43 -0.15 -1.89 118.68 129.09 2ull s LEU 108 Ca 0.39 0.18 -0.11 0.00 -1.03 0.00 0.00 54.13 53.56 2ull s LEU 108 Cb -0.16 -2.99 0.02 0.00 0.03 0.00 0.00 46.19 43.09 2ull s LEU 108 CO 0.10 -0.13 1.07 0.42 0.23 0.00 0.00 176.35 178.03 2ull s THR 109 N -2.07 3.74 0.51 5.49 -4.23 -0.45 -4.47 115.64 114.15 2ull s THR 109 Ca 0.36 0.61 0.23 0.00 -1.18 0.00 0.00 61.69 61.70 2ull s THR 109 Cb -0.09 -3.23 0.28 0.00 1.34 0.00 0.00 72.50 70.81 2ull s THR 109 CO 0.31 -0.70 2.14 0.77 -0.54 0.00 0.00 174.62 176.60 2ull h SER 110 N -0.67 0.00 0.31 3.99 4.64 -1.96 -2.66 113.55 117.20 2ull h SER 110 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2ull h SER 110 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2ull h SER 110 CO 0.55 0.07 0.00 0.00 -0.87 0.00 0.00 176.83 176.58 2ull n ALA 111 N -2.41 2.23 -1.49 5.18 0.00 -1.26 -4.84 120.51 117.91 2ull n ALA 111 Ca -0.03 -0.12 -0.32 0.00 0.00 0.00 0.00 53.44 52.97 2ull n ALA 111 Cb 0.15 -1.37 0.05 0.00 0.00 0.00 0.00 19.45 18.28 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 -2.41 2.79 -0.38 0.00 -1.52 -1.00 -4.57 119.66 112.56 2ull s GLN 112 Ca 0.25 1.28 -0.02 0.00 -1.95 0.00 0.00 55.36 54.93 2ull s GLN 112 Cb 0.16 -1.96 0.10 0.00 -0.22 0.00 0.00 33.01 31.09 2ull s GLN 112 CO 0.33 -1.24 0.15 0.99 -0.25 0.00 0.00 175.29 175.26 2ull s THR 113 N -2.53 3.11 0.02 -0.19 2.01 -0.50 -4.96 115.64 112.60 2ull s THR 113 Ca 0.65 -1.97 -0.30 0.00 0.31 0.00 0.00 61.69 60.37 2ull s THR 113 Cb -0.19 -3.09 -0.04 0.00 0.01 0.00 0.00 72.50 69.19 2ull s THR 113 CO 0.45 -0.58 1.14 -0.76 -0.69 0.00 0.00 174.62 174.18 2ull s LEU 114 N 1.13 4.35 0.02 4.42 1.43 -1.26 -0.54 118.68 128.22 2ull s LEU 114 Ca 0.06 1.87 0.06 0.00 -1.03 0.00 0.00 54.13 55.10 2ull s LEU 114 Cb -0.22 -3.57 -0.02 0.00 0.03 0.00 0.00 46.19 42.41 2ull s LEU 114 CO -0.04 -0.44 -0.18 -0.76 0.23 0.00 0.00 176.35 175.16 2ull s LEU 119 N 1.33 2.11 -1.36 1.79 1.43 -1.08 -4.94 118.68 117.96 2ull s LEU 119 Ca 0.56 -0.41 -0.08 0.00 -1.03 0.00 0.00 54.13 53.17 2ull s LEU 119 Cb -0.26 -0.86 -0.02 0.00 0.03 0.00 0.00 46.19 45.08 2ull s LEU 119 CO 0.27 0.16 2.80 -0.81 0.23 0.00 0.00 176.35 178.99 2ull n PRO 120 N 2.22 3.87 -3.48 1.29 -0.04 -1.26 -4.49 135.00 133.10 2ull n PRO 120 Ca -0.16 -2.58 -0.11 0.00 -0.04 0.00 0.00 63.50 60.60 2ull n PRO 120 Cb 0.54 -2.66 -0.02 0.00 -0.04 0.00 0.00 33.50 31.32 2ull n PRO 120 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 2ull s ARG 120 N 0.74 1.28 0.09 0.54 1.70 -1.26 -0.63 118.95 121.41 2ull s ARG 120 Ca 0.64 -0.54 0.09 0.00 -0.47 0.00 0.00 55.73 55.45 2ull s ARG 120 Cb 0.20 0.57 -0.03 0.00 -0.57 0.00 0.00 34.95 35.12 2ull s ARG 120 CO -0.08 -0.56 -0.25 0.08 -1.08 0.00 0.00 175.30 173.42 2ull s VAL 120 N -3.77 2.03 -0.00 4.99 1.01 0.05 -0.95 120.40 123.75 2ull s VAL 120 Ca 0.02 -1.54 -0.30 0.00 0.00 0.00 0.00 61.98 60.16 2ull s VAL 120 Cb -0.01 -1.78 -0.03 0.00 0.00 0.00 0.00 36.38 34.56 2ull s VAL 120 CO -0.12 0.14 1.01 0.00 0.00 0.00 0.00 175.10 176.14 2ull s ALA 120 N -0.98 3.21 -0.41 5.51 0.00 0.02 -0.91 121.76 128.21 2ull s ALA 120 Ca 0.11 0.56 0.01 0.00 0.00 0.00 0.00 51.96 52.65 2ull s ALA 120 Cb -0.10 -3.36 0.13 0.00 0.00 0.00 0.00 23.12 19.79 2ull s ALA 120 CO 0.04 -0.29 0.22 1.21 0.00 0.00 0.00 175.76 176.94 2ull s ASN 120 N 1.03 3.50 0.00 0.00 2.47 -1.26 -4.67 114.94 116.01 2ull s ASN 120 Ca 0.53 -2.44 0.00 0.00 0.42 0.00 0.00 52.86 51.37 2ull s ASN 120 Cb -0.22 -0.86 0.00 0.00 -1.45 0.00 0.00 41.25 38.72 2ull s ASN 120 CO 0.27 -0.29 0.00 0.61 -3.72 0.00 0.00 177.10 173.97 2ull n GLY 120 N 3.77 0.67 7.00 1.21 0.00 -1.26 -4.28 105.19 112.30 2ull n GLY 120 Ca 0.09 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.28 2ull n GLY 120 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ull n SER 120 N 1.75 -1.32 -3.93 1.61 3.41 -1.26 -5.06 113.62 108.83 2ull n SER 120 Ca 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.51 2ull n SER 120 Cb 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 63.85 2ull n SER 120 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2ull s PHE 120 N 0.00 0.18 -0.21 7.33 0.08 -1.26 -4.55 117.98 119.55 2ull s PHE 120 Ca 0.00 -0.42 -0.03 0.00 0.12 0.00 0.00 56.93 56.60 2ull s PHE 120 Cb 0.00 -0.13 -0.00 0.00 -0.57 0.00 0.00 43.02 42.31 2ull s PHE 120 CO 0.00 -0.31 -0.08 0.08 -0.10 0.00 0.00 175.22 174.81 2ull s VAL 120 N -2.08 3.07 -0.03 -0.44 1.01 -0.08 -4.87 120.40 116.98 2ull s VAL 120 Ca -0.10 -0.60 -0.30 0.00 0.00 0.00 0.00 61.98 60.99 2ull s VAL 120 Cb -0.04 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.92 2ull s VAL 120 CO -0.02 0.46 1.25 -0.89 0.00 0.00 0.00 175.10 175.89 2ull s THR 120 N 1.35 4.10 0.06 3.92 2.01 -1.26 -0.77 115.64 125.05 2ull s THR 120 Ca 0.04 1.45 -0.30 0.00 0.31 0.00 0.00 61.69 63.19 2ull s THR 120 Cb -0.14 -3.93 -0.05 0.00 0.01 0.00 0.00 72.50 68.39 2ull s THR 120 CO -0.05 0.01 1.13 -0.69 -0.69 0.00 0.00 174.62 174.33 2ull s VAL 121 N 2.17 4.24 0.00 3.82 1.01 0.20 -4.29 120.40 127.55 2ull s VAL 121 Ca 0.58 1.64 0.00 0.00 0.00 0.00 0.00 61.98 64.20 2ull s VAL 121 Cb -0.27 -4.05 0.00 0.00 0.00 0.00 0.00 36.38 32.06 2ull s VAL 121 CO 0.24 0.15 0.10 0.54 0.00 0.00 0.00 175.10 176.12 2ull n ARG 122 N 3.74 0.96 -3.37 2.72 1.74 0.34 -0.52 116.66 122.27 2ull n ARG 122 Ca 0.07 -0.10 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 2ull n ARG 122 Cb 0.48 -0.45 0.00 0.00 -1.02 0.00 0.00 32.46 31.47 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 0.16 -1.52 1.46 -0.13 0.00 -1.14 -4.81 105.19 99.22 2ull n GLY 123 Ca 0.00 -1.04 0.02 0.00 0.00 0.00 0.00 46.02 45.00 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 1.10 1.63 -4.69 1.61 3.41 -1.26 -0.49 113.62 114.93 2ull n SER 124 Ca 0.00 -2.72 -0.42 0.00 -0.26 0.00 0.00 58.87 55.46 2ull n SER 124 Cb 0.00 -0.40 -0.03 0.00 -0.26 0.00 0.00 64.21 63.52 2ull n SER 124 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2ull s THR 125 N -1.89 2.97 -0.09 6.66 2.01 -1.26 -4.83 115.64 119.21 2ull s THR 125 Ca 0.36 0.38 -0.30 0.00 0.31 0.00 0.00 61.69 62.45 2ull s THR 125 Cb 0.38 -3.25 -0.02 0.00 0.01 0.00 0.00 72.50 69.62 2ull s THR 125 CO -0.10 -0.01 1.16 -0.70 -0.69 0.00 0.00 174.62 174.28 2ull s GLU 129 N 2.87 4.34 0.39 4.92 2.12 -1.26 -4.72 118.70 127.36 2ull s GLU 129 Ca 0.76 1.60 -0.23 0.00 0.36 0.00 0.00 54.97 57.46 2ull s GLU 129 Cb -0.41 -3.59 -0.10 0.00 0.26 0.00 0.00 34.13 30.29 2ull s GLU 129 CO 0.33 -0.48 0.97 0.00 -0.54 0.00 0.00 175.26 175.55 2ull s ALA 130 N 2.45 3.09 0.59 6.30 0.00 -1.26 -5.06 121.76 127.87 2ull s ALA 130 Ca 0.53 0.51 -0.10 0.00 0.00 0.00 0.00 51.96 52.91 2ull s ALA 130 Cb -0.22 -3.19 -0.04 0.00 0.00 0.00 0.00 23.12 19.67 2ull s ALA 130 CO 0.19 0.05 0.98 0.00 0.00 0.00 0.00 175.76 176.98 2ull s ALA 131 N -1.89 3.16 0.15 0.00 0.00 -1.26 -4.95 121.76 116.97 2ull s ALA 131 Ca 0.58 -0.20 -0.34 0.00 0.00 0.00 0.00 51.96 52.00 2ull s ALA 131 Cb -0.15 -2.96 -0.14 0.00 0.00 0.00 0.00 23.12 19.87 2ull s ALA 131 CO 0.20 -0.64 1.60 0.28 0.00 0.00 0.00 175.76 177.19 2ull n VAL 132 N -2.66 0.03 0.00 0.00 0.31 -1.26 -1.64 118.33 113.11 2ull n VAL 132 Ca 0.05 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 2ull n VAL 132 Cb 0.54 -1.59 0.00 0.00 -0.91 0.00 0.00 33.84 31.89 2ull n VAL 132 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2ull n GLY 133 N 3.50 0.70 3.81 2.92 0.00 0.97 -4.98 105.19 112.10 2ull n GLY 133 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 2ull n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ull s ALA 134 N -2.00 3.13 0.04 4.61 0.00 -0.65 -4.70 121.76 122.18 2ull s ALA 134 Ca 0.00 0.43 -0.30 0.00 0.00 0.00 0.00 51.96 52.08 2ull s ALA 134 Cb 0.00 -3.14 -0.05 0.00 0.00 0.00 0.00 23.12 19.93 2ull s ALA 134 CO 0.00 0.16 1.14 0.00 0.00 0.00 0.00 175.76 177.06 2ull s ALA 135 N -1.94 3.33 0.02 0.00 0.00 -1.26 -0.97 121.76 120.95 2ull s ALA 135 Ca 0.57 0.76 0.01 0.00 0.00 0.00 0.00 51.96 53.29 2ull s ALA 135 Cb -0.13 -3.42 -0.02 0.00 0.00 0.00 0.00 23.12 19.55 2ull s ALA 135 CO 0.17 -0.39 -0.04 0.54 0.00 0.00 0.00 175.76 176.05 2ull s VAL 136 N 1.08 0.21 0.36 0.00 0.11 -0.53 -4.69 120.40 116.93 2ull s VAL 136 Ca 0.57 -0.94 0.07 0.00 -2.93 0.00 0.00 61.98 58.75 2ull s VAL 136 Cb -0.27 -0.34 -0.07 0.00 -1.53 0.00 0.00 36.38 34.17 2ull s VAL 136 CO 0.29 -0.47 -0.01 0.00 -3.33 0.00 0.00 175.10 171.58 2ull s ARG 138 N -3.74 0.55 -0.06 0.00 1.70 0.47 -0.44 118.95 117.43 2ull s ARG 138 Ca 0.34 -0.67 0.02 0.00 -0.47 0.00 0.00 55.73 54.95 2ull s ARG 138 Cb 0.07 0.22 0.02 0.00 -0.57 0.00 0.00 34.95 34.68 2ull s ARG 138 CO 0.16 -0.13 -0.10 0.45 -1.08 0.00 0.00 175.30 174.59 2ull s SER 139 N -1.92 1.58 0.01 -2.89 0.15 0.37 -1.07 113.70 109.93 2ull s SER 139 Ca -0.08 -0.26 -0.25 0.00 0.70 0.00 0.00 55.95 56.06 2ull s SER 139 Cb -0.03 -0.74 0.06 0.00 -1.71 0.00 0.00 66.02 63.60 2ull s SER 139 CO -0.03 0.01 0.57 -0.83 1.20 0.00 0.00 173.24 174.16 2ull s GLY 140 N 0.73 -0.48 0.60 9.45 0.00 -0.78 -2.68 107.32 114.16 2ull s GLY 140 Ca -0.14 0.84 0.36 0.00 0.00 0.00 0.00 44.72 45.78 2ull s GLY 140 CO 0.03 0.53 2.24 0.07 0.00 0.00 0.00 173.10 175.96 2ull h ARG 141 N 2.91 0.00 0.06 2.90 -0.00 -1.69 0.11 114.38 118.67 2ull h ARG 141 Ca -0.29 0.00 -0.32 0.00 -0.00 0.00 0.00 59.98 59.36 2ull h ARG 141 Cb 1.19 0.00 -0.03 0.00 -0.00 0.00 0.00 29.97 31.13 2ull h ARG 141 CO 0.40 0.03 -1.77 2.41 -0.00 0.00 0.00 179.97 181.03 2ull n THR 142 N -3.43 1.64 -0.36 0.08 -1.04 -1.26 -4.51 114.28 105.40 2ull n THR 142 Ca -0.02 -0.37 0.06 0.00 -2.04 0.00 0.00 64.05 61.68 2ull n THR 142 Cb 0.13 -1.85 0.18 0.00 -1.82 0.00 0.00 70.33 66.97 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 -3.92 1.29 -4.95 12.58 -2.24 -1.23 -5.06 114.28 110.75 2ull n THR 143 Ca -0.35 -1.19 0.00 0.00 -2.27 0.00 0.00 64.05 60.24 2ull n THR 143 Cb 0.88 0.33 0.00 0.00 -2.10 0.00 0.00 70.33 69.45 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 0.31 2.26 3.67 3.38 0.00 0.40 -4.56 105.19 110.64 2ull n GLY 156 Ca 0.14 -0.47 -0.38 0.00 0.00 0.00 0.00 46.02 45.31 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 3.36 0.01 1.61 5.04 -1.26 -1.87 117.35 124.24 2ull s TYR 157 Ca 0.00 0.56 0.02 0.00 -2.44 0.00 0.00 57.07 55.20 2ull s TYR 157 Cb 0.00 -2.50 -0.01 0.00 0.35 0.00 0.00 41.96 39.80 2ull s TYR 157 CO 0.00 -0.01 -0.05 -0.65 -1.34 0.00 0.00 175.55 173.50 2ull s GLN 158 N 1.31 0.41 0.32 4.97 -1.52 -0.23 -4.98 119.66 119.94 2ull s GLN 158 Ca 0.17 -0.37 0.09 0.00 -1.95 0.00 0.00 55.36 53.31 2ull s GLN 158 Cb -0.15 -0.30 -0.06 0.00 -0.22 0.00 0.00 33.01 32.28 2ull s GLN 158 CO 0.08 0.07 -0.11 0.00 -0.25 0.00 0.00 175.29 175.08 2ull n GLY 160 N -0.71 1.71 3.17 0.00 0.00 0.14 -4.30 105.19 105.19 2ull n GLY 160 Ca -0.05 -0.09 -0.11 0.00 0.00 0.00 0.00 46.02 45.77 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 0.14 0.55 -0.31 2.61 -4.23 -1.26 -1.45 115.64 111.70 2ull s THR 161 Ca 0.00 -1.92 -0.22 0.00 -1.18 0.00 0.00 61.69 58.37 2ull s THR 161 Cb 0.00 -1.79 -0.00 0.00 1.34 0.00 0.00 72.50 72.05 2ull s THR 161 CO 0.00 -0.77 0.70 -0.63 -0.54 0.00 0.00 174.62 173.38 2ull s ILE 162 N -3.72 4.87 -0.11 2.99 1.01 -0.14 -1.41 121.20 124.68 2ull s ILE 162 Ca 0.15 1.00 0.20 0.00 0.00 0.00 0.00 60.65 61.99 2ull s ILE 162 Cb 0.06 -4.07 -0.29 0.00 0.01 0.00 0.00 42.46 38.17 2ull s ILE 162 CO -0.03 -0.20 0.30 0.35 0.00 0.00 0.00 174.94 175.36 2ull n THR 163 N 5.47 0.70 -3.54 2.92 -2.24 -0.01 -0.02 114.28 117.56 2ull n THR 163 Ca 0.01 -0.68 -0.09 0.00 -2.27 0.00 0.00 64.05 61.03 2ull n THR 163 Cb 0.48 -0.24 -0.02 0.00 -2.10 0.00 0.00 70.33 68.45 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 -3.01 -1.67 0.10 6.98 0.00 -1.16 -4.92 121.76 118.07 2ull s ALA 164 Ca -0.09 0.59 0.05 0.00 0.00 0.00 0.00 51.96 52.52 2ull s ALA 164 Cb 0.10 0.64 -0.03 0.00 0.00 0.00 0.00 23.12 23.83 2ull s ALA 164 CO 0.87 -0.80 -0.14 0.15 0.00 0.00 0.00 175.76 175.84 2ull s LYS 165 N -3.42 0.93 -1.15 0.00 1.02 -1.26 -0.65 119.74 115.19 2ull s LYS 165 Ca 0.05 -1.11 -0.07 0.00 0.02 0.00 0.00 55.97 54.86 2ull s LYS 165 Cb -0.01 -0.85 0.01 0.00 -0.52 0.00 0.00 37.83 36.45 2ull s LYS 165 CO -0.07 0.17 1.01 -1.71 -0.92 0.00 0.00 175.35 173.83 2ull n ASN 166 N 0.85 -5.43 -4.76 2.83 2.85 -0.68 -4.97 115.26 105.95 2ull n ASN 166 Ca -0.18 -0.47 -0.40 0.00 -0.11 0.00 0.00 54.58 53.42 2ull n ASN 166 Cb 0.56 -4.40 -0.05 0.00 1.24 0.00 0.00 39.78 37.12 2ull n ASN 166 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 2ull s VAL 167 N -3.28 4.51 -0.17 3.44 1.01 0.11 -4.34 120.40 121.68 2ull s VAL 167 Ca 0.46 1.73 -0.15 0.00 0.00 0.00 0.00 61.98 64.02 2ull s VAL 167 Cb -0.20 -4.16 -0.04 0.00 0.00 0.00 0.00 36.38 31.98 2ull s VAL 167 CO 0.63 0.44 0.35 -0.89 0.00 0.00 0.00 175.10 175.62 2ull s THR 168 N -0.59 5.26 -0.09 3.92 2.01 -1.26 -1.45 115.64 123.43 2ull s THR 168 Ca 0.38 0.64 -0.05 0.00 0.31 0.00 0.00 61.69 62.97 2ull s THR 168 Cb -0.22 -3.68 -0.04 0.00 0.01 0.00 0.00 72.50 68.57 2ull s THR 168 CO 0.26 0.34 0.12 0.00 -0.69 0.00 0.00 174.62 174.64 2ull s ALA 169 N 0.77 3.76 -0.82 7.40 0.00 0.45 -4.96 121.76 128.35 2ull s ALA 169 Ca 0.18 -0.70 -0.01 0.00 0.00 0.00 0.00 51.96 51.44 2ull s ALA 169 Cb -0.14 -1.85 0.20 0.00 0.00 0.00 0.00 23.12 21.34 2ull s ALA 169 CO 0.06 0.63 0.68 -0.80 0.00 0.00 0.00 175.76 176.33 2ull s ASN 170 N -1.14 5.67 0.70 0.00 0.01 -1.26 -0.84 114.94 118.09 2ull s ASN 170 Ca 0.16 -3.62 -0.11 0.00 -0.71 0.00 0.00 52.86 48.58 2ull s ASN 170 Cb -0.12 -1.85 0.01 0.00 0.41 0.00 0.00 41.25 39.70 2ull s ASN 170 CO 0.06 -0.19 1.09 -0.31 -1.51 0.00 0.00 177.10 176.23 2ull s TYR 171 N -1.18 3.31 0.42 2.20 2.02 -0.96 -4.95 117.35 118.20 2ull s TYR 171 Ca 0.25 1.10 0.18 0.00 -0.37 0.00 0.00 57.07 58.24 2ull s TYR 171 Cb -0.09 -3.02 1.10 0.00 -0.40 0.00 0.00 41.96 39.55 2ull s TYR 171 CO -0.12 -1.18 1.85 0.00 -1.57 0.00 0.00 175.55 174.53 2ull h ALA 173 N -0.66 2.23 0.00 3.71 0.00 -2.03 -1.68 119.26 120.84 2ull h ALA 173 Ca -0.45 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.42 2ull h ALA 173 Cb 1.24 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 2ull h ALA 173 CO 0.63 -0.53 -0.33 0.93 0.00 0.00 0.00 179.25 179.94 2ull h GLU 174 N 0.39 0.00 0.00 0.00 3.07 -2.01 -3.49 114.58 112.54 2ull h GLU 174 Ca 0.48 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.34 2ull h GLU 174 Cb 1.23 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.14 2ull h GLU 174 CO -0.18 0.28 0.00 0.41 -1.40 0.00 0.00 179.01 178.11 2ull n GLY 175 N 1.18 0.46 3.75 -3.84 0.00 -0.63 -4.86 105.19 101.24 2ull n GLY 175 Ca 0.02 -1.53 -0.40 0.00 0.00 0.00 0.00 46.02 44.12 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 -1.69 3.35 -0.16 4.61 0.00 -1.26 -2.27 121.76 124.34 2ull s ALA 176 Ca 0.00 0.60 0.01 0.00 0.00 0.00 0.00 51.96 52.56 2ull s ALA 176 Cb 0.00 -3.19 0.00 0.00 0.00 0.00 0.00 23.12 19.93 2ull s ALA 176 CO 0.00 0.21 -0.17 0.08 0.00 0.00 0.00 175.76 175.88 2ull s VAL 177 N -1.15 2.47 0.43 0.00 1.01 -0.02 -0.84 120.40 122.31 2ull s VAL 177 Ca 0.41 -0.83 0.08 0.00 0.00 0.00 0.00 61.98 61.63 2ull s VAL 177 Cb -0.26 -2.04 -0.02 0.00 0.00 0.00 0.00 36.38 34.07 2ull s VAL 177 CO 0.31 0.52 0.39 -0.13 0.00 0.00 0.00 175.10 176.19 2ull s ARG 178 N 0.91 2.50 -1.44 2.72 0.52 -0.44 -0.41 118.95 123.32 2ull s ARG 178 Ca -0.04 -1.58 0.00 0.00 -0.52 0.00 0.00 55.73 53.59 2ull s ARG 178 Cb -0.15 -2.36 0.00 0.00 0.52 0.00 0.00 34.95 32.96 2ull s ARG 178 CO -0.02 -0.24 0.00 0.41 0.02 0.00 0.00 175.30 175.47 2ull n GLY 179 N -1.57 1.34 3.80 -3.53 0.00 -1.22 -4.80 105.19 99.20 2ull n GLY 179 Ca 0.03 -0.38 -0.36 0.00 0.00 0.00 0.00 46.02 45.32 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 -3.17 4.23 0.05 0.99 1.43 -0.53 -4.35 118.68 117.33 2ull s LEU 180 Ca 0.00 1.66 -0.12 0.00 -1.03 0.00 0.00 54.13 54.64 2ull s LEU 180 Cb 0.00 -4.04 -0.06 0.00 0.03 0.00 0.00 46.19 42.13 2ull s LEU 180 CO 0.00 -0.12 0.41 -0.89 0.23 0.00 0.00 176.35 175.98 2ull s THR 181 N -1.75 5.06 -0.11 5.49 2.01 -0.14 0.04 115.64 126.24 2ull s THR 181 Ca 0.51 0.62 -0.02 0.00 0.31 0.00 0.00 61.69 63.11 2ull s THR 181 Cb -0.15 -3.67 -0.03 0.00 0.01 0.00 0.00 72.50 68.66 2ull s THR 181 CO 0.20 0.40 -0.03 -1.58 -0.69 0.00 0.00 174.62 172.92 2ull s GLN 182 N -1.59 3.22 0.18 4.92 0.74 0.17 -0.59 119.66 126.72 2ull s GLN 182 Ca 0.30 -0.50 0.02 0.00 0.05 0.00 0.00 55.36 55.23 2ull s GLN 182 Cb -0.15 -2.79 -0.05 0.00 1.10 0.00 0.00 33.01 31.12 2ull s GLN 182 CO 0.16 0.49 -0.01 0.20 -0.55 0.00 0.00 175.29 175.58 2ull s GLY 183 N -0.32 1.25 -0.08 2.59 0.00 0.09 -0.83 107.32 110.02 2ull s GLY 183 Ca 0.05 -1.60 0.14 0.00 0.00 0.00 0.00 44.72 43.32 2ull s GLY 183 CO 0.02 -1.55 1.40 1.16 0.00 0.00 0.00 173.10 174.12 2ull n ASN 184 N -0.26 3.66 -4.77 1.64 0.23 -0.50 -1.54 115.26 113.71 2ull n ASN 184 Ca -0.07 -2.43 -0.38 0.00 -0.53 0.00 0.00 54.58 51.18 2ull n ASN 184 Cb 0.63 -0.41 -0.03 0.00 -2.08 0.00 0.00 39.78 37.88 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 -1.78 3.14 0.71 -2.53 0.00 -1.26 -4.66 121.76 115.38 2ull s ALA 185 Ca 0.36 0.82 -0.11 0.00 0.00 0.00 0.00 51.96 53.04 2ull s ALA 185 Cb 0.24 -3.32 0.03 0.00 0.00 0.00 0.00 23.12 20.07 2ull s ALA 185 CO 0.16 -0.33 1.09 0.00 0.00 0.00 0.00 175.76 176.67 2ull n MET 190 N -3.01 0.00 0.00 0.00 0.00 -1.26 -4.82 117.12 108.03 2ull n MET 190 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.77 2ull n MET 190 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.80 2ull n MET 190 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2ull n GLY 191 N 0.00 2.56 3.68 3.17 0.00 -1.26 -1.27 105.19 112.07 2ull n GLY 191 Ca 0.00 -0.02 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 2ull n GLY 191 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ull s ARG 192 N 4.82 3.77 0.00 1.61 0.52 -0.40 -4.32 118.95 124.95 2ull s ARG 192 Ca 0.00 -0.31 0.00 0.00 -0.52 0.00 0.00 55.73 54.90 2ull s ARG 192 Cb 0.00 -3.16 0.00 0.00 0.52 0.00 0.00 34.95 32.31 2ull s ARG 192 CO 0.00 0.41 0.00 0.41 0.02 0.00 0.00 175.30 176.14 2ull n GLY 193 N 3.10 2.91 0.14 -3.53 0.00 -1.26 -4.67 105.19 101.88 2ull n GLY 193 Ca -0.17 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.98 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 0.18 0.00 -1.55 1.61 3.32 -1.92 -3.30 116.42 114.77 2ull h ASP 194 Ca 0.00 0.00 -0.69 0.00 0.02 0.00 0.00 57.03 56.36 2ull h ASP 194 Cb 0.00 0.00 0.08 0.00 0.22 0.00 0.00 39.33 39.63 2ull h ASP 194 CO 0.00 0.00 0.07 -1.20 -1.72 0.00 0.00 179.24 176.39 2ull n SER 195 N -2.42 0.54 0.00 6.45 7.64 -1.26 -1.28 113.62 123.30 2ull n SER 195 Ca 0.04 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.06 2ull n SER 195 Cb 0.35 -1.10 0.00 0.00 -1.01 0.00 0.00 64.21 62.45 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 1.89 2.89 3.72 0.23 0.00 0.64 -0.55 105.19 114.01 2ull n GLY 196 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 2ull n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ull s GLY 197 N -1.81 1.79 0.40 -0.02 0.00 -0.40 -2.30 107.32 104.97 2ull s GLY 197 Ca 0.00 0.49 -0.26 0.00 0.00 0.00 0.00 44.72 44.95 2ull s GLY 197 CO 0.00 0.88 1.32 -0.56 0.00 0.00 0.00 173.10 174.74 2ull s SER 198 N -2.88 6.34 -0.17 1.64 0.01 -1.09 -0.59 113.70 116.95 2ull s SER 198 Ca 0.65 2.71 0.01 0.00 1.31 0.00 0.00 55.95 60.63 2ull s SER 198 Cb -0.21 -2.64 0.03 0.00 0.21 0.00 0.00 66.02 63.40 2ull s SER 198 CO 0.55 -0.83 -0.15 0.26 0.41 0.00 0.00 173.24 173.48 2ull s TRP 199 N -1.23 2.46 -0.01 2.43 0.52 -0.62 -0.48 118.94 122.01 2ull s TRP 199 Ca 0.56 -1.49 -0.12 0.00 0.02 0.00 0.00 56.10 55.07 2ull s TRP 199 Cb -0.39 -1.72 0.02 0.00 -1.15 0.00 0.00 33.47 30.22 2ull s TRP 199 CO 0.51 -0.74 0.25 -1.50 0.02 0.00 0.00 176.95 175.49 2ull s ILE 200 N 1.39 0.06 0.58 2.03 2.07 0.41 -0.17 121.20 127.57 2ull s ILE 200 Ca 0.03 -0.54 -0.08 0.00 -1.41 0.00 0.00 60.65 58.65 2ull s ILE 200 Cb -0.14 -0.54 -0.02 0.00 0.13 0.00 0.00 42.46 41.89 2ull s ILE 200 CO -0.11 -0.29 0.93 0.42 -1.91 0.00 0.00 174.94 173.98 2ull s THR 201 N -1.29 4.43 0.49 4.00 -4.23 -0.89 -1.07 115.64 117.07 2ull s THR 201 Ca -0.13 0.44 0.20 0.00 -1.18 0.00 0.00 61.69 61.02 2ull s THR 201 Cb -0.06 -3.74 0.26 0.00 1.34 0.00 0.00 72.50 70.29 2ull s THR 201 CO 0.03 -0.86 2.10 0.77 -0.54 0.00 0.00 174.62 176.12 2ull h SER 201 N -0.15 0.00 0.45 3.99 4.64 -1.92 0.05 113.55 120.61 2ull h SER 201 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 2ull h SER 201 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2ull h SER 201 CO 0.62 0.09 0.00 0.00 -0.87 0.00 0.00 176.83 176.67 2ull n ALA 202 N -2.43 1.50 -0.52 5.18 0.00 -1.26 -4.87 120.51 118.10 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 0.18 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.36 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 -0.36 0.87 3.48 0.00 0.00 0.00 -4.80 105.19 104.38 2ull n GLY 207 Ca 0.02 -0.45 -0.43 0.00 0.00 0.00 0.00 46.02 45.16 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 -1.18 3.09 0.20 1.61 -1.52 -1.25 -0.51 119.66 120.10 2ull s GLN 208 Ca 0.00 -0.84 -0.31 0.00 -1.95 0.00 0.00 55.36 52.25 2ull s GLN 208 Cb 0.00 -3.96 -0.11 0.00 -0.22 0.00 0.00 33.01 28.73 2ull s GLN 208 CO 0.00 -0.77 1.61 0.00 -0.25 0.00 0.00 175.29 175.87 2ull s ALA 209 N 1.92 3.81 -0.16 6.09 0.00 0.36 -2.09 121.76 131.69 2ull s ALA 209 Ca 0.09 1.45 0.03 0.00 0.00 0.00 0.00 51.96 53.53 2ull s ALA 209 Cb -0.18 -3.64 -0.12 0.00 0.00 0.00 0.00 23.12 19.18 2ull s ALA 209 CO 0.12 -0.84 -0.12 1.04 0.00 0.00 0.00 175.76 175.96 2ull n GLN 210 N 3.63 0.64 -3.55 0.00 1.13 0.76 -4.39 117.38 115.59 2ull n GLN 210 Ca 0.13 0.08 0.00 0.00 -1.94 0.00 0.00 57.00 55.27 2ull n GLN 210 Cb 0.38 -1.33 0.00 0.00 0.11 0.00 0.00 30.24 29.39 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 2.63 -1.02 3.32 1.08 0.00 -1.15 -1.37 105.19 108.68 2ull n GLY 211 Ca -0.28 -0.98 -0.29 0.00 0.00 0.00 0.00 46.02 44.47 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 2.00 0.04 1.61 -7.23 -0.28 -1.59 120.40 111.96 2ull s VAL 212 Ca 0.00 -1.34 -0.31 0.00 -1.81 0.00 0.00 61.98 58.52 2ull s VAL 212 Cb 0.00 -1.72 -0.10 0.00 0.56 0.00 0.00 36.38 35.12 2ull s VAL 212 CO 0.00 0.31 1.94 0.80 -0.31 0.00 0.00 175.10 177.84 2ull n MET 213 N 1.77 2.79 -0.09 4.82 1.56 0.24 -0.65 117.12 127.56 2ull n MET 213 Ca -0.17 1.02 -0.16 0.00 -0.27 0.00 0.00 57.70 58.12 2ull n MET 213 Cb 0.52 -2.95 -0.05 0.00 2.15 0.00 0.00 33.22 32.89 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 7.03 1.72 -0.39 6.12 2.88 -0.05 -0.26 113.62 130.66 2ull n SER 214 Ca 0.20 0.29 0.00 0.00 -1.33 0.00 0.00 58.87 58.03 2ull n SER 214 Cb 0.39 -0.68 0.00 0.00 -0.75 0.00 0.00 64.21 63.17 2ull n SER 214 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ull n GLY 215 N 1.67 1.60 0.00 0.46 0.00 -0.75 -4.88 105.19 103.29 2ull n GLY 215 Ca -0.29 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 44.97 2ull n GLY 215 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ull n GLY 216 N 0.00 1.76 3.08 -0.02 0.00 -1.26 -0.63 105.19 108.12 2ull n GLY 216 Ca 0.00 -1.05 -0.42 0.00 0.00 0.00 0.00 46.02 44.56 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 4.09 -4.77 1.61 6.94 -0.81 -4.96 115.26 117.37 2ull n ASN 217 Ca 0.00 -2.85 -0.39 0.00 -0.02 0.00 0.00 54.58 51.32 2ull n ASN 217 Cb 0.00 -1.65 -0.03 0.00 -2.36 0.00 0.00 39.78 35.73 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 4.01 3.31 0.10 3.53 -7.23 -1.26 -4.55 120.40 118.31 2ull s VAL 218 Ca 0.51 1.23 -0.01 0.00 -1.81 0.00 0.00 61.98 61.90 2ull s VAL 218 Cb 0.10 -3.75 0.02 0.00 0.56 0.00 0.00 36.38 33.31 2ull s VAL 218 CO -0.01 0.23 0.14 0.00 -0.31 0.00 0.00 175.10 175.15 2ull n GLN 219 N 0.74 0.01 0.21 4.82 1.13 -0.24 -4.84 117.38 119.20 2ull n GLN 219 Ca 0.01 -0.24 0.15 0.00 -1.94 0.00 0.00 57.00 54.98 2ull n GLN 219 Cb 0.45 -0.13 0.65 0.00 0.11 0.00 0.00 30.24 31.32 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 -0.16 0.00 0.56 1.08 4.64 -1.96 -1.95 113.55 115.75 2ull h SER 219 Ca -0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 2ull h SER 219 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 2ull h SER 219 CO 0.03 0.00 -0.12 -0.46 -0.87 0.00 0.00 176.83 175.42 2ull n ASN 219 N -2.61 0.29 0.00 4.97 6.94 -1.26 -4.93 115.26 118.66 2ull n ASN 219 Ca 0.01 -0.22 0.00 0.00 -0.02 0.00 0.00 54.58 54.35 2ull n ASN 219 Cb 0.21 -0.16 0.00 0.00 -2.36 0.00 0.00 39.78 37.47 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 1.36 0.83 3.66 4.83 0.00 -0.73 -5.04 105.19 110.10 2ull n GLY 219 Ca 0.12 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.04 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 -2.22 -0.02 -0.17 1.61 2.20 -1.26 -1.27 114.94 113.81 2ull s ASN 219 Ca 0.00 -0.94 0.16 0.00 -0.94 0.00 0.00 52.86 51.14 2ull s ASN 219 Cb 0.00 0.66 0.38 0.00 -2.00 0.00 0.00 41.25 40.28 2ull s ASN 219 CO 0.00 -1.26 1.24 -0.46 -2.94 0.00 0.00 177.10 173.68 2ull n ASN 220 N -0.61 2.46 0.23 3.54 0.23 -0.40 -1.08 115.26 119.63 2ull n ASN 220 Ca -0.03 -3.33 0.12 0.00 -0.53 0.00 0.00 54.58 50.81 2ull n ASN 220 Cb 0.61 -0.49 0.34 0.00 -2.08 0.00 0.00 39.78 38.15 2ull n ASN 220 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2ull n GLY 221 N 0.69 -0.74 3.29 0.00 0.00 -1.26 -4.81 105.19 102.36 2ull n GLY 221 Ca 0.02 -0.15 -0.21 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.95 1.66 0.53 -0.61 -4.36 -1.23 -5.12 121.20 110.12 2ull s ILE 222 Ca 0.24 -1.75 -0.22 0.00 -0.26 0.00 0.00 60.65 58.66 2ull s ILE 222 Cb 0.11 -1.67 -0.05 0.00 1.25 0.00 0.00 42.46 42.10 2ull s ILE 222 CO 0.19 -0.26 1.34 -2.16 0.24 0.00 0.00 174.94 174.29 2ull s PRO 222 N -2.47 3.25 0.43 0.37 0.04 -1.26 -4.87 135.00 130.48 2ull s PRO 222 Ca 0.11 2.19 0.29 0.00 0.04 0.00 0.00 61.00 63.63 2ull s PRO 222 Cb -0.07 -2.30 1.41 0.00 0.04 0.00 0.00 34.50 33.58 2ull s PRO 222 CO 0.05 -1.09 1.62 0.00 0.04 0.00 0.00 177.00 177.62 2ull h ALA 222 N 1.58 2.68 -0.67 8.56 0.00 -1.92 -1.26 119.26 128.23 2ull h ALA 222 Ca -0.51 0.13 0.07 0.00 0.00 0.00 0.00 54.91 54.60 2ull h ALA 222 Cb 1.29 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 19.24 2ull h ALA 222 CO 0.58 -1.33 0.36 0.66 0.00 0.00 0.00 179.25 179.52 2ull h SER 222 N 0.08 0.51 1.04 0.00 4.64 -1.89 -2.05 113.55 115.89 2ull h SER 222 Ca 0.82 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 62.18 2ull h SER 222 Cb 2.54 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 64.58 2ull h SER 222 CO -0.45 0.32 0.00 0.00 -0.87 0.00 0.00 176.83 175.83 2ull n GLN 223 N -4.82 0.15 -2.78 4.77 6.02 -0.48 -4.84 117.38 115.41 2ull n GLN 223 Ca 0.09 0.23 -0.41 0.00 -0.01 0.00 0.00 57.00 56.90 2ull n GLN 223 Cb 0.20 -1.71 -0.04 0.00 1.02 0.00 0.00 30.24 29.71 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 -3.12 4.60 -0.34 -1.09 0.52 -0.77 -5.01 118.95 113.74 2ull s ARG 224 Ca 0.09 1.34 0.02 0.00 -0.52 0.00 0.00 55.73 56.67 2ull s ARG 224 Cb 0.13 -3.41 0.10 0.00 0.52 0.00 0.00 34.95 32.29 2ull s ARG 224 CO 0.48 0.12 0.08 0.45 0.02 0.00 0.00 175.30 176.45 2ull s SER 225 N 0.42 4.47 -0.29 0.23 0.15 -1.26 -4.54 113.70 112.89 2ull s SER 225 Ca 0.47 -2.05 -0.05 0.00 0.70 0.00 0.00 55.95 55.02 2ull s SER 225 Cb -0.22 -1.36 0.02 0.00 -1.71 0.00 0.00 66.02 62.75 2ull s SER 225 CO 0.27 -0.38 0.03 -0.44 1.20 0.00 0.00 173.24 173.92 2ull s SER 226 N 1.05 4.87 -0.19 5.45 0.01 -0.59 -1.92 113.70 122.38 2ull s SER 226 Ca 0.11 -0.88 -0.08 0.00 1.31 0.00 0.00 55.95 56.41 2ull s SER 226 Cb -0.19 -1.79 -0.04 0.00 0.21 0.00 0.00 66.02 64.20 2ull s SER 226 CO -0.13 -0.20 0.09 -0.76 0.41 0.00 0.00 173.24 172.65 2ull s LEU 227 N 1.40 3.93 0.13 2.44 1.43 0.20 -0.73 118.68 127.49 2ull s LEU 227 Ca 0.00 0.12 0.11 0.00 -1.03 0.00 0.00 54.13 53.33 2ull s LEU 227 Cb -0.18 -2.01 -0.04 0.00 0.03 0.00 0.00 46.19 44.00 2ull s LEU 227 CO -0.00 0.17 -0.27 0.72 0.23 0.00 0.00 176.35 177.20 2ull s PHE 228 N 0.42 2.30 -0.16 0.29 -0.12 0.25 -0.87 117.98 120.09 2ull s PHE 228 Ca 0.05 -0.38 -0.24 0.00 -0.05 0.00 0.00 56.93 56.30 2ull s PHE 228 Cb -0.12 -1.25 -0.02 0.00 -0.63 0.00 0.00 43.02 41.00 2ull s PHE 228 CO -0.00 0.33 0.77 -2.00 -0.05 0.00 0.00 175.22 174.27 2ull s GLU 229 N -2.04 4.31 0.32 1.99 2.56 0.18 -0.97 118.70 125.04 2ull s GLU 229 Ca 0.14 0.92 -0.29 0.00 0.00 0.00 0.00 54.97 55.74 2ull s GLU 229 Cb -0.10 -3.55 -0.13 0.00 2.00 0.00 0.00 34.13 32.35 2ull s GLU 229 CO 0.06 -0.24 1.29 0.54 -0.56 0.00 0.00 175.26 176.35 2ull n ARG 230 N 4.93 2.06 -0.06 4.30 1.74 -1.26 -1.13 116.66 127.25 2ull n ARG 230 Ca 0.02 0.73 -0.14 0.00 -0.77 0.00 0.00 57.85 57.69 2ull n ARG 230 Cb 0.49 -2.31 -0.06 0.00 -1.02 0.00 0.00 32.46 29.56 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 2.83 0.62 -0.58 0.55 5.85 -1.55 -3.36 115.31 119.66 2ull h LEU 231 Ca -0.45 -0.54 0.10 0.00 0.84 0.00 0.00 57.88 57.82 2ull h LEU 231 Cb 1.28 -0.18 -0.08 0.00 0.37 0.00 0.00 40.66 42.06 2ull h LEU 231 CO 0.65 1.05 0.16 1.56 -0.34 0.00 0.00 178.44 181.51 2ull h GLN 232 N 0.22 0.30 0.00 1.25 4.20 -1.90 -0.76 115.11 118.41 2ull h GLN 232 Ca 0.01 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 2ull h GLN 232 Cb 0.93 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 28.64 2ull h GLN 232 CO 0.08 0.20 -0.11 -1.00 -0.67 0.00 0.00 178.83 177.33 2ull h PRO 233 N 0.31 0.00 -0.09 1.46 0.13 -1.99 -0.84 132.00 130.97 2ull h PRO 233 Ca 0.30 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.35 2ull h PRO 233 Cb 0.41 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.54 2ull h PRO 233 CO -0.35 0.11 -0.24 0.82 -0.23 0.00 0.00 178.00 178.11 2ull h ILE 234 N 0.00 1.40 -0.33 -3.56 2.04 -1.33 -1.49 117.51 114.25 2ull h ILE 234 Ca -0.00 -1.57 0.00 0.00 1.00 0.00 0.00 64.86 64.30 2ull h ILE 234 Cb 0.33 2.19 -0.02 0.00 -0.74 0.00 0.00 36.82 38.58 2ull h ILE 234 CO 0.01 0.45 0.22 -0.07 0.00 0.00 0.00 178.15 178.76 2ull h LEU 235 N -0.14 0.38 -0.54 1.44 3.38 -0.62 -2.63 115.31 116.57 2ull h LEU 235 Ca -0.00 -0.01 -0.16 0.00 0.09 0.00 0.00 57.88 57.80 2ull h LEU 235 Cb 0.85 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 2ull h LEU 235 CO 0.05 0.28 -0.70 0.77 0.09 0.00 0.00 178.44 178.92 2ull h SER 236 N 0.45 0.19 -0.51 -0.43 4.64 -1.24 0.19 113.55 116.83 2ull h SER 236 Ca 0.12 -0.13 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 2ull h SER 236 Cb -0.05 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 61.96 2ull h SER 236 CO -0.03 0.83 0.10 -0.61 -0.87 0.00 0.00 176.83 176.26 2ull h GLN 237 N 0.11 0.84 -0.68 4.77 4.15 -1.14 -3.14 115.11 120.00 2ull h GLN 237 Ca -0.02 -0.21 0.00 0.00 0.77 0.00 0.00 58.65 59.19 2ull h GLN 237 Cb 1.25 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.84 2ull h GLN 237 CO 0.10 0.81 0.00 0.66 -1.93 0.00 0.00 178.83 178.48 2ull n TYR 238 N -4.42 0.91 -3.47 3.99 4.01 -1.00 -4.96 117.16 112.22 2ull n TYR 238 Ca 0.02 -0.50 -0.24 0.00 -0.16 0.00 0.00 57.90 57.01 2ull n TYR 238 Cb 0.24 -0.01 0.06 0.00 -0.31 0.00 0.00 39.34 39.33 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 1.50 -0.54 3.87 2.72 0.00 -0.36 -4.99 105.19 107.39 2ull n GLY 239 Ca 0.23 0.22 -0.34 0.00 0.00 0.00 0.00 46.02 46.12 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 -7.14 4.33 -0.14 0.99 1.43 0.52 -4.69 118.68 113.99 2ull s LEU 240 Ca 0.52 0.79 -0.01 0.00 -1.03 0.00 0.00 54.13 54.40 2ull s LEU 240 Cb -0.23 -3.07 -0.02 0.00 0.03 0.00 0.00 46.19 42.90 2ull s LEU 240 CO 0.64 0.14 -0.11 -0.44 0.23 0.00 0.00 176.35 176.82 2ull s SER 241 N -1.87 4.21 0.13 2.29 0.01 -0.21 -4.70 113.70 113.56 2ull s SER 241 Ca 0.35 -0.28 -0.30 0.00 1.31 0.00 0.00 55.95 57.03 2ull s SER 241 Cb -0.14 -1.65 -0.07 0.00 0.21 0.00 0.00 66.02 64.37 2ull s SER 241 CO 0.19 0.17 1.18 -0.22 0.41 0.00 0.00 173.24 174.96 2ull s LEU 242 N 0.36 4.42 -0.28 2.44 2.96 -1.26 -1.16 118.68 126.16 2ull s LEU 242 Ca -0.09 2.12 -0.27 0.00 -0.22 0.00 0.00 54.13 55.67 2ull s LEU 242 Cb -0.15 -3.59 0.01 0.00 0.50 0.00 0.00 46.19 42.95 2ull s LEU 242 CO 0.05 -0.38 0.95 -0.69 -1.32 0.00 0.00 176.35 174.96 2ull s VAL 243 N 0.37 4.67 0.45 1.68 1.01 -0.84 -4.92 120.40 122.82 2ull s VAL 243 Ca 0.55 1.63 0.05 0.00 0.00 0.00 0.00 61.98 64.21 2ull s VAL 243 Cb -0.31 -4.27 -0.05 0.00 0.00 0.00 0.00 36.38 31.75 2ull s VAL 243 CO 0.33 -0.29 0.05 0.42 0.00 0.00 0.00 175.10 175.61 2ull s THR 244 N 3.24 1.78 0.00 3.92 -4.23 -1.26 -4.41 115.64 114.68 2ull s THR 244 Ca 0.40 -1.93 0.00 0.00 -1.18 0.00 0.00 61.69 58.97 2ull s THR 244 Cb -0.14 -2.72 0.00 0.00 1.34 0.00 0.00 72.50 70.98 2ull s THR 244 CO 0.11 0.00 0.30 0.61 -0.54 0.00 0.00 174.62 175.10