#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 6.92 -0.44 0.00 -0.87 -1.26 -1.57 114.94 117.71 2ull s ASN 15 Ca 0.00 1.11 -0.18 0.00 -1.57 0.00 0.00 52.86 52.22 2ull s ASN 15 Cb 0.00 -2.38 0.03 0.00 -0.02 0.00 0.00 41.25 38.88 2ull s ASN 15 CO 0.00 -0.06 0.49 -0.63 -2.57 0.00 0.00 177.10 174.34 2ull s ILE 16 N 0.60 5.03 -0.03 0.60 -1.09 0.47 -4.95 121.20 121.84 2ull s ILE 16 Ca 0.34 -0.39 0.05 0.00 -2.23 0.00 0.00 60.65 58.42 2ull s ILE 16 Cb -0.17 -4.12 -0.01 0.00 -1.58 0.00 0.00 42.46 36.58 2ull s ILE 16 CO 0.16 -0.53 -0.17 -0.69 -1.23 0.00 0.00 174.94 172.49 2ull s VAL 17 N 2.26 1.35 0.37 2.92 1.01 -1.26 -2.71 120.40 124.34 2ull s VAL 17 Ca 0.13 -0.70 -0.28 0.00 0.00 0.00 0.00 61.98 61.13 2ull s VAL 17 Cb -0.18 -1.14 -0.11 0.00 0.00 0.00 0.00 36.38 34.95 2ull s VAL 17 CO 0.13 0.39 1.48 -0.83 0.00 0.00 0.00 175.10 176.27 2ull s GLY 18 N -0.16 2.90 0.00 4.51 0.00 0.32 -2.94 107.32 111.95 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 0.01 2.26 0.00 0.61 0.00 0.00 0.00 173.10 175.97 2ull n GLY 19 N 0.57 2.75 3.81 0.20 0.00 0.65 -0.81 105.19 112.36 2ull n GLY 19 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.46 4.10 0.53 -0.61 -4.36 -1.15 -2.61 121.20 114.64 2ull s ILE 31 Ca 0.00 1.24 -0.20 0.00 -0.26 0.00 0.00 60.65 61.43 2ull s ILE 31 Cb 0.00 -3.53 -0.06 0.00 1.25 0.00 0.00 42.46 40.12 2ull s ILE 31 CO 0.00 -0.35 1.15 -0.70 0.24 0.00 0.00 174.94 175.27 2ull s GLU 32 N -3.41 3.40 -0.15 0.37 2.12 -1.26 -0.89 118.70 118.88 2ull s GLU 32 Ca 0.64 1.67 -0.18 0.00 0.36 0.00 0.00 54.97 57.46 2ull s GLU 32 Cb -0.13 -2.08 0.05 0.00 0.26 0.00 0.00 34.13 32.23 2ull s GLU 32 CO 0.21 -0.83 0.49 1.52 -0.54 0.00 0.00 175.26 176.11 2ull s TYR 33 N -1.70 -0.50 0.21 5.30 1.13 -0.75 -4.79 117.35 116.24 2ull s TYR 33 Ca 0.71 1.16 0.04 0.00 -1.41 0.00 0.00 57.07 57.58 2ull s TYR 33 Cb -0.26 0.19 -0.03 0.00 -1.10 0.00 0.00 41.96 40.77 2ull s TYR 33 CO 0.29 -0.31 0.34 -1.54 -2.51 0.00 0.00 175.55 171.82 2ull s SER 34 N -0.09 6.33 -0.12 -0.18 1.04 -0.35 -1.52 113.70 118.80 2ull s SER 34 Ca -0.03 0.13 0.02 0.00 0.48 0.00 0.00 55.95 56.56 2ull s SER 34 Cb -0.03 -1.89 0.01 0.00 0.10 0.00 0.00 66.02 64.21 2ull s SER 34 CO 0.02 -0.04 -0.20 -0.63 0.98 0.00 0.00 173.24 173.38 2ull s ILE 35 N -1.91 1.84 -1.68 -1.02 1.09 0.18 -1.41 121.20 118.29 2ull s ILE 35 Ca 0.35 -0.86 -0.17 0.00 -1.10 0.00 0.00 60.65 58.87 2ull s ILE 35 Cb -0.10 -1.64 0.15 0.00 -1.06 0.00 0.00 42.46 39.81 2ull s ILE 35 CO 0.29 0.51 0.77 0.59 -0.10 0.00 0.00 174.94 177.00 2ull n ASN 36 N 4.03 -3.16 -2.76 3.58 3.02 -0.03 -0.73 115.26 119.21 2ull n ASN 36 Ca -0.20 -1.01 -0.19 0.00 -0.03 0.00 0.00 54.58 53.16 2ull n ASN 36 Cb 0.52 -2.81 0.00 0.00 -0.61 0.00 0.00 39.78 36.88 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 -2.68 -4.85 0.00 6.41 3.02 -1.26 -4.80 115.26 111.10 2ull n ASN 38 Ca 0.05 -0.08 0.00 0.00 -0.03 0.00 0.00 54.58 54.51 2ull n ASN 38 Cb 0.51 -4.02 0.00 0.00 -0.61 0.00 0.00 39.78 35.66 2ull n ASN 38 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ull n ALA 39 N -2.76 1.15 -1.76 5.41 0.00 0.09 -5.11 120.51 117.53 2ull n ALA 39 Ca -0.13 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 52.94 2ull n ALA 39 Cb 0.62 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.09 2ull n ALA 39 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2ull s SER 40 N 1.00 5.46 -0.03 0.00 0.01 -1.16 -4.74 113.70 114.24 2ull s SER 40 Ca 0.00 2.43 0.04 0.00 1.31 0.00 0.00 55.95 59.73 2ull s SER 40 Cb 0.00 -2.61 -0.03 0.00 0.21 0.00 0.00 66.02 63.60 2ull s SER 40 CO 0.00 -1.41 -0.14 -0.76 0.41 0.00 0.00 173.24 171.34 2ull s LEU 41 N -3.71 2.76 0.00 2.44 1.43 -1.26 -0.65 118.68 119.69 2ull s LEU 41 Ca 0.73 -0.22 0.04 0.00 -1.03 0.00 0.00 54.13 53.64 2ull s LEU 41 Cb -0.31 -1.58 -0.01 0.00 0.03 0.00 0.00 46.19 44.31 2ull s LEU 41 CO 0.36 0.33 0.21 0.00 0.23 0.00 0.00 176.35 177.48 2ull s SER 43 N -2.50 2.75 0.28 0.00 0.01 0.10 -1.81 113.70 112.54 2ull s SER 43 Ca 0.25 -0.59 -0.29 0.00 1.31 0.00 0.00 55.95 56.62 2ull s SER 43 Cb 0.01 -0.22 -0.10 0.00 0.21 0.00 0.00 66.02 65.93 2ull s SER 43 CO 0.17 0.17 1.25 -0.69 0.41 0.00 0.00 173.24 174.56 2ull s VAL 44 N -0.89 3.06 0.00 3.43 1.01 -0.07 -3.23 120.40 123.72 2ull s VAL 44 Ca 0.09 1.01 0.00 0.00 0.00 0.00 0.00 61.98 63.08 2ull s VAL 44 Cb -0.09 -3.64 0.00 0.00 0.00 0.00 0.00 36.38 32.64 2ull s VAL 44 CO 0.03 0.22 0.00 0.61 0.00 0.00 0.00 175.10 175.95 2ull n GLY 44 N 1.35 1.15 3.15 4.51 0.00 0.01 -0.25 105.19 115.11 2ull n GLY 44 Ca 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.91 2ull n GLY 44 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ull s PHE 45 N 0.00 -0.14 0.18 1.61 0.08 -1.12 -4.06 117.98 114.53 2ull s PHE 45 Ca 0.00 0.28 -0.30 0.00 0.12 0.00 0.00 56.93 57.03 2ull s PHE 45 Cb 0.00 0.05 -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 0.00 175.22 175.05 2ull s SER 46 N -0.79 6.91 0.16 1.36 0.01 -1.26 -1.19 113.70 118.90 2ull s SER 46 Ca -0.09 2.36 -0.03 0.00 1.31 0.00 0.00 55.95 59.51 2ull s SER 46 Cb -0.05 -2.61 -0.03 0.00 0.21 0.00 0.00 66.02 63.54 2ull s SER 46 CO 0.02 -0.52 0.14 0.68 0.41 0.00 0.00 173.24 173.96 2ull s VAL 47 N 0.24 0.06 0.14 3.43 -7.23 -0.11 -1.86 120.40 115.06 2ull s VAL 47 Ca 0.57 -1.83 0.07 0.00 -1.81 0.00 0.00 61.98 58.97 2ull s VAL 47 Cb -0.36 -2.17 -0.04 0.00 0.56 0.00 0.00 36.38 34.37 2ull s VAL 47 CO 0.37 -0.26 -0.15 0.42 -0.31 0.00 0.00 175.10 175.16 2ull s THR 48 N -4.07 1.49 -0.40 5.32 -4.23 0.28 -1.70 115.64 112.33 2ull s THR 48 Ca 0.28 -1.79 0.03 0.00 -1.18 0.00 0.00 61.69 59.03 2ull s THR 48 Cb 0.06 -1.64 0.16 0.00 1.34 0.00 0.00 72.50 72.42 2ull s THR 48 CO 0.05 -0.39 0.36 -0.60 -0.54 0.00 0.00 174.62 173.51 2ull s ARG 48 N -2.73 0.80 7.20 3.99 3.52 0.15 -1.16 118.95 130.73 2ull s ARG 48 Ca 0.11 -1.61 0.00 0.00 -0.13 0.00 0.00 55.73 54.10 2ull s ARG 48 Cb -0.05 -1.11 0.00 0.00 -1.56 0.00 0.00 34.95 32.23 2ull s ARG 48 CO 0.04 -1.31 0.00 0.41 -0.81 0.00 0.00 175.30 173.63 2ull n GLY 48 N 3.35 2.27 0.11 8.12 0.00 -1.26 -1.62 105.19 116.16 2ull n GLY 48 Ca 0.22 -0.34 0.15 0.00 0.00 0.00 0.00 46.02 46.05 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 11.13 2.66 -2.62 4.61 0.00 -1.26 -4.81 120.51 130.21 2ull n ALA 48 Ca 0.00 -0.25 -0.40 0.00 0.00 0.00 0.00 53.44 52.79 2ull n ALA 48 Cb 0.00 -1.43 -0.08 0.00 0.00 0.00 0.00 19.45 17.94 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 -2.07 5.09 0.34 0.00 2.01 -0.64 -4.97 115.64 115.39 2ull s THR 49 Ca 0.43 0.84 -0.18 0.00 0.31 0.00 0.00 61.69 63.09 2ull s THR 49 Cb 0.22 -3.81 -0.09 0.00 0.01 0.00 0.00 72.50 68.82 2ull s THR 49 CO 0.38 0.10 0.81 -0.54 -0.69 0.00 0.00 174.62 174.68 2ull s LYS 50 N 2.23 4.15 0.14 4.92 1.02 -1.26 -0.68 119.74 130.27 2ull s LYS 50 Ca 0.20 0.88 -0.23 0.00 0.02 0.00 0.00 55.97 56.84 2ull s LYS 50 Cb -0.16 -2.46 0.08 0.00 -0.52 0.00 0.00 37.83 34.77 2ull s LYS 50 CO 0.09 0.15 1.10 0.20 -0.92 0.00 0.00 175.35 175.98 2ull s GLY 51 N -2.10 0.08 -0.03 -3.33 0.00 -0.69 -0.89 107.32 100.37 2ull s GLY 51 Ca 0.54 -0.29 -0.02 0.00 0.00 0.00 0.00 44.72 44.94 2ull s GLY 51 CO 0.17 3.57 0.07 -0.11 0.00 0.00 0.00 173.10 176.80 2ull s PHE 52 N -2.05 -0.08 0.37 1.90 -0.12 -1.00 -0.94 117.98 116.07 2ull s PHE 52 Ca 0.25 0.20 -0.14 0.00 -0.05 0.00 0.00 56.93 57.18 2ull s PHE 52 Cb -0.02 0.02 -0.08 0.00 -0.63 0.00 0.00 43.02 42.30 2ull s PHE 52 CO 0.04 -0.04 0.79 0.14 -0.05 0.00 0.00 175.22 176.10 2ull s VAL 53 N 0.08 4.67 0.04 -2.49 -7.23 -0.34 -0.75 120.40 114.38 2ull s VAL 53 Ca -0.00 0.94 -0.01 0.00 -1.81 0.00 0.00 61.98 61.09 2ull s VAL 53 Cb -0.01 -3.65 0.01 0.00 0.56 0.00 0.00 36.38 33.29 2ull s VAL 53 CO -0.00 -0.33 0.07 1.07 -0.31 0.00 0.00 175.10 175.60 2ull n THR 54 N -0.75 0.00 -3.20 5.32 5.66 -0.14 -0.81 114.28 120.35 2ull n THR 54 Ca 0.04 -0.09 -0.35 0.00 -3.05 0.00 0.00 64.05 60.59 2ull n THR 54 Cb 0.54 0.09 -0.06 0.00 -1.55 0.00 0.00 70.33 69.35 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 -1.10 3.47 0.25 1.79 0.00 -1.26 -1.35 121.76 123.55 2ull s ALA 55 Ca 0.01 0.03 0.29 0.00 0.00 0.00 0.00 51.96 52.30 2ull s ALA 55 Cb -0.00 -2.70 1.31 0.00 0.00 0.00 0.00 23.12 21.73 2ull s ALA 55 CO 0.01 0.38 1.98 0.78 0.00 0.00 0.00 175.76 178.91 2ull h GLY 56 N 3.33 0.00 1.34 0.00 0.00 -1.59 -2.52 103.07 103.64 2ull h GLY 56 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 2ull h GLY 56 CO 0.66 0.00 0.00 -2.39 0.00 0.00 0.00 176.54 174.81 2ull n HIS 57 N -3.35 0.00 0.07 5.60 1.44 -1.26 -3.24 115.22 114.48 2ull n HIS 57 Ca -0.01 0.00 -0.04 0.00 -2.01 0.00 0.00 57.72 55.67 2ull n HIS 57 Cb 0.31 -0.17 -0.08 0.00 0.12 0.00 0.00 29.99 30.18 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 -4.71 -0.33 0.32 0.00 0.00 -1.20 -4.84 107.32 96.56 2ull s GLY 59 Ca 0.00 0.50 0.06 0.00 0.00 0.00 0.00 44.72 45.29 2ull s GLY 59 CO 0.80 0.14 0.46 -0.51 0.00 0.00 0.00 173.10 173.98 2ull s THR 59 N -3.14 4.23 0.14 0.90 -4.23 -1.26 -4.91 115.64 107.37 2ull s THR 59 Ca 0.10 -0.99 -0.33 0.00 -1.18 0.00 0.00 61.69 59.29 2ull s THR 59 Cb -0.01 -3.47 -0.13 0.00 1.34 0.00 0.00 72.50 70.23 2ull s THR 59 CO -0.02 -0.18 1.67 0.52 -0.54 0.00 0.00 174.62 176.07 2ull n VAL 59 N -1.61 0.11 -0.98 2.29 0.31 -1.26 -1.35 118.33 115.82 2ull n VAL 59 Ca -0.01 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.30 2ull n VAL 59 Cb 0.58 -1.74 0.00 0.00 -0.91 0.00 0.00 33.84 31.77 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 4.14 -0.26 -4.77 4.52 5.03 0.44 -4.95 115.26 119.42 2ull n ASN 60 Ca 0.17 0.00 -0.40 0.00 0.87 0.00 0.00 54.58 55.23 2ull n ASN 60 Cb 0.31 -0.04 -0.01 0.00 -1.02 0.00 0.00 39.78 39.02 2ull n ASN 60 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2ull s ALA 61 N -3.79 3.35 -0.10 5.41 0.00 -0.46 -4.58 121.76 121.59 2ull s ALA 61 Ca 0.00 1.28 -0.25 0.00 0.00 0.00 0.00 51.96 53.00 2ull s ALA 61 Cb 0.00 -3.50 -0.03 0.00 0.00 0.00 0.00 23.12 19.59 2ull s ALA 61 CO 0.00 -0.82 0.78 0.99 0.00 0.00 0.00 175.76 176.72 2ull s THR 62 N -1.21 4.96 -0.13 0.00 2.01 -1.26 -0.87 115.64 119.14 2ull s THR 62 Ca 0.54 1.58 -0.07 0.00 0.31 0.00 0.00 61.69 64.06 2ull s THR 62 Cb -0.40 -4.11 -0.04 0.00 0.01 0.00 0.00 72.50 67.97 2ull s THR 62 CO 0.52 0.15 0.12 0.00 -0.69 0.00 0.00 174.62 174.71 2ull s ALA 64 N 1.40 3.77 0.09 7.40 0.00 -0.10 -0.85 121.76 133.47 2ull s ALA 64 Ca 0.39 -0.67 0.06 0.00 0.00 0.00 0.00 51.96 51.75 2ull s ALA 64 Cb -0.18 -1.93 -0.03 0.00 0.00 0.00 0.00 23.12 20.99 2ull s ALA 64 CO 0.17 0.55 -0.17 1.03 0.00 0.00 0.00 175.76 177.34 2ull s ARG 65 N -0.82 0.95 -0.06 0.00 0.52 -0.50 -1.50 118.95 117.55 2ull s ARG 65 Ca 0.14 -1.06 -0.00 0.00 -0.52 0.00 0.00 55.73 54.29 2ull s ARG 65 Cb -0.12 -1.05 0.03 0.00 0.52 0.00 0.00 34.95 34.33 2ull s ARG 65 CO 0.03 0.24 -0.02 0.42 0.02 0.00 0.00 175.30 175.98 2ull s ILE 66 N -1.30 0.48 -0.79 1.52 1.01 -0.03 -1.21 121.20 120.87 2ull s ILE 66 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 60.65 60.66 2ull s ILE 66 Cb -0.10 -0.57 0.00 0.00 0.01 0.00 0.00 42.46 41.80 2ull s ILE 66 CO 0.03 0.25 0.00 0.61 0.00 0.00 0.00 174.94 175.83 2ull n GLY 67 N 4.64 0.84 1.12 6.18 0.00 -1.26 -2.20 105.19 114.51 2ull n GLY 67 Ca -0.16 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.70 2ull n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ull n GLY 81 N -0.66 1.01 3.01 -0.02 0.00 -1.26 -5.08 105.19 102.18 2ull n GLY 81 Ca -0.07 -0.50 -0.13 0.00 0.00 0.00 0.00 46.02 45.32 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 -2.16 -0.34 0.23 4.61 0.00 -0.94 -5.14 121.76 118.03 2ull s ALA 82 Ca 0.00 0.46 -0.30 0.00 0.00 0.00 0.00 51.96 52.12 2ull s ALA 82 Cb 0.00 -0.28 -0.09 0.00 0.00 0.00 0.00 23.12 22.75 2ull s ALA 82 CO 0.00 -0.08 1.27 0.08 0.00 0.00 0.00 175.76 177.02 2ull s VAL 83 N 0.28 3.20 -0.00 0.00 1.01 -1.26 -0.85 120.40 122.77 2ull s VAL 83 Ca -0.02 1.05 0.00 0.00 0.00 0.00 0.00 61.98 63.02 2ull s VAL 83 Cb -0.03 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.67 2ull s VAL 83 CO -0.01 0.19 0.01 1.33 0.00 0.00 0.00 175.10 176.62 2ull n VAL 84 N 2.06 0.00 -3.77 2.92 0.24 -0.56 -4.89 118.33 114.33 2ull n VAL 84 Ca 0.04 -0.06 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 2ull n VAL 84 Cb 0.43 0.55 0.00 0.00 -1.47 0.00 0.00 33.84 33.35 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 2.32 -0.93 3.17 7.63 0.00 -1.21 -2.11 105.19 114.06 2ull n GLY 85 Ca -0.00 -1.07 -0.11 0.00 0.00 0.00 0.00 46.02 44.85 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 0.34 0.01 2.61 -4.23 -0.51 -0.92 115.64 109.94 2ull s THR 87 Ca 0.00 -1.92 -0.30 0.00 -1.18 0.00 0.00 61.69 58.29 2ull s THR 87 Cb 0.00 -1.96 -0.06 0.00 1.34 0.00 0.00 72.50 71.82 2ull s THR 87 CO 0.00 -0.58 1.35 -0.36 -0.54 0.00 0.00 174.62 174.50 2ull s PHE 88 N -3.88 3.00 -0.16 3.99 0.40 -0.05 -0.02 117.98 121.27 2ull s PHE 88 Ca 0.21 0.93 -0.16 0.00 -0.60 0.00 0.00 56.93 57.31 2ull s PHE 88 Cb 0.07 -3.61 -0.13 0.00 0.51 0.00 0.00 43.02 39.86 2ull s PHE 88 CO 0.00 -2.18 0.19 0.00 0.70 0.00 0.00 175.22 173.93 2ull h ALA 88 N 7.56 0.09 -2.47 5.36 0.00 -1.63 0.13 119.26 128.29 2ull h ALA 88 Ca -0.38 -0.65 -0.10 0.00 0.00 0.00 0.00 54.91 53.78 2ull h ALA 88 Cb 1.18 0.38 -0.22 0.00 0.00 0.00 0.00 17.79 19.14 2ull h ALA 88 CO 0.89 0.37 -0.14 0.00 0.00 0.00 0.00 179.25 180.37 2ull s ALA 89 N -2.46 -1.15 -0.05 0.00 0.00 -1.24 -4.67 121.76 112.18 2ull s ALA 89 Ca -0.18 1.02 -0.28 0.00 0.00 0.00 0.00 51.96 52.53 2ull s ALA 89 Cb 0.02 -0.38 0.06 0.00 0.00 0.00 0.00 23.12 22.82 2ull s ALA 89 CO 0.40 -0.26 0.61 -0.98 0.00 0.00 0.00 175.76 175.53 2ull s ARG 90 N -0.48 0.98 -0.11 0.00 1.04 -1.26 -2.28 118.95 116.83 2ull s ARG 90 Ca -0.06 0.19 0.02 0.00 -1.04 0.00 0.00 55.73 54.84 2ull s ARG 90 Cb -0.03 0.46 0.01 0.00 -2.04 0.00 0.00 34.95 33.34 2ull s ARG 90 CO 0.03 -0.30 -0.19 0.08 -0.04 0.00 0.00 175.30 174.89 2ull s VAL 91 N -1.18 1.73 -0.30 4.99 1.01 -0.25 -4.99 120.40 121.41 2ull s VAL 91 Ca -0.11 -0.79 -0.16 0.00 0.00 0.00 0.00 61.98 60.91 2ull s VAL 91 Cb -0.01 -1.54 0.18 0.00 0.00 0.00 0.00 36.38 35.01 2ull s VAL 91 CO 0.09 0.49 1.13 0.12 0.00 0.00 0.00 175.10 176.92 2ull s PHE 94 N 0.78 -0.33 0.00 5.22 5.36 -1.24 -1.47 117.98 126.30 2ull s PHE 94 Ca -0.10 0.62 0.00 0.00 -0.96 0.00 0.00 56.93 56.49 2ull s PHE 94 Cb -0.16 0.20 0.00 0.00 -0.34 0.00 0.00 43.02 42.72 2ull s PHE 94 CO 0.01 -0.16 0.00 -0.35 -1.46 0.00 0.00 175.22 173.26 2ull n PRO 95 N 3.84 2.75 0.00 10.12 -0.04 -1.26 -4.99 135.00 145.42 2ull n PRO 95 Ca -0.14 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.32 2ull n PRO 95 Cb 0.56 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.02 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 3.73 0.55 0.00 0.68 -4.75 105.19 112.45 2ull n GLY 100 Ca 0.00 -0.28 -0.32 0.00 0.00 0.00 0.00 46.02 45.42 2ull n GLY 100 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2ull s ASN 101 N 0.00 3.93 -0.42 1.61 0.01 -1.26 -1.33 114.94 117.48 2ull s ASN 101 Ca 0.00 -1.68 0.05 0.00 -0.71 0.00 0.00 52.86 50.52 2ull s ASN 101 Cb 0.00 0.58 0.19 0.00 0.41 0.00 0.00 41.25 42.43 2ull s ASN 101 CO 0.00 -0.89 0.45 -0.67 -1.51 0.00 0.00 177.10 174.48 2ull n ASP 102 N -1.30 -0.81 -4.07 -1.22 -0.08 -1.22 -3.70 116.55 104.14 2ull n ASP 102 Ca -0.18 -2.55 -0.08 0.00 -1.51 0.00 0.00 54.79 50.48 2ull n ASP 102 Cb 0.67 -0.19 -0.10 0.00 2.34 0.00 0.00 41.12 43.83 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 -0.09 0.56 -0.07 -0.67 1.70 -0.54 -3.62 118.95 116.21 2ull s ARG 103 Ca 0.33 -1.09 -0.31 0.00 -0.47 0.00 0.00 55.73 54.19 2ull s ARG 103 Cb 0.07 0.16 0.12 0.00 -0.57 0.00 0.00 34.95 34.73 2ull s ARG 103 CO -0.16 -0.09 1.00 0.00 -1.08 0.00 0.00 175.30 174.96 2ull s ALA 104 N -3.36 -1.91 -0.00 7.88 0.00 -0.46 -1.09 121.76 122.82 2ull s ALA 104 Ca 0.02 1.24 0.00 0.00 0.00 0.00 0.00 51.96 53.23 2ull s ALA 104 Cb 0.04 0.16 -0.00 0.00 0.00 0.00 0.00 23.12 23.31 2ull s ALA 104 CO -0.08 -0.63 -0.01 1.67 0.00 0.00 0.00 175.76 176.71 2ull s TRP 105 N -2.75 0.11 -0.28 0.00 1.48 -0.97 -0.96 118.94 115.58 2ull s TRP 105 Ca 0.06 -0.03 -0.09 0.00 -1.06 0.00 0.00 56.10 54.98 2ull s TRP 105 Cb -0.01 -0.07 -0.03 0.00 -1.16 0.00 0.00 33.47 32.20 2ull s TRP 105 CO -0.07 -0.01 0.12 0.08 -4.06 0.00 0.00 176.95 173.02 2ull s VAL 106 N -0.06 4.62 -0.07 -0.66 1.01 0.07 -1.57 120.40 123.75 2ull s VAL 106 Ca 0.00 -0.19 -0.30 0.00 0.00 0.00 0.00 61.98 61.49 2ull s VAL 106 Cb -0.01 -3.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.10 2ull s VAL 106 CO -0.00 0.22 1.34 -0.44 0.00 0.00 0.00 175.10 176.22 2ull s SER 107 N 1.64 6.91 0.27 3.32 0.01 0.98 -2.38 113.70 124.44 2ull s SER 107 Ca 0.06 1.93 0.08 0.00 1.31 0.00 0.00 55.95 59.33 2ull s SER 107 Cb -0.16 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.48 2ull s SER 107 CO 0.06 -0.72 0.15 -0.76 0.41 0.00 0.00 173.24 172.38 2ull s LEU 108 N 2.86 3.61 0.62 2.44 1.43 -0.07 -1.43 118.68 128.15 2ull s LEU 108 Ca 0.60 -0.40 -0.13 0.00 -1.03 0.00 0.00 54.13 53.18 2ull s LEU 108 Cb -0.27 -2.14 -0.03 0.00 0.03 0.00 0.00 46.19 43.78 2ull s LEU 108 CO 0.22 -0.06 1.04 0.42 0.23 0.00 0.00 176.35 178.20 2ull s THR 109 N -2.21 4.26 -1.27 5.49 -4.23 -0.89 -4.34 115.64 112.45 2ull s THR 109 Ca 0.33 0.86 0.12 0.00 -1.18 0.00 0.00 61.69 61.83 2ull s THR 109 Cb -0.07 -3.58 0.17 0.00 1.34 0.00 0.00 72.50 70.36 2ull s THR 109 CO 0.24 -0.84 1.34 -1.54 -0.54 0.00 0.00 174.62 173.28 2ull n SER 110 N -2.52 0.00 0.19 3.99 3.41 -1.26 -2.07 113.62 115.36 2ull n SER 110 Ca 0.07 0.26 0.08 0.00 -0.26 0.00 0.00 58.87 59.02 2ull n SER 110 Cb 0.54 -0.37 0.26 0.00 -0.26 0.00 0.00 64.21 64.38 2ull n SER 110 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ull h ALA 111 N 2.52 0.89 -2.47 7.33 0.00 -1.96 -3.46 119.26 122.11 2ull h ALA 111 Ca 0.00 -0.26 -0.51 0.00 0.00 0.00 0.00 54.91 54.14 2ull h ALA 111 Cb 0.15 -0.05 0.11 0.00 0.00 0.00 0.00 17.79 18.01 2ull h ALA 111 CO 0.00 0.36 0.37 -0.65 0.00 0.00 0.00 179.25 179.33 2ull s GLN 112 N -3.33 2.69 -0.36 0.00 -1.52 -0.88 -4.65 119.66 111.61 2ull s GLN 112 Ca 0.03 1.42 -0.04 0.00 -1.95 0.00 0.00 55.36 54.82 2ull s GLN 112 Cb 0.08 -1.93 0.07 0.00 -0.22 0.00 0.00 33.01 31.01 2ull s GLN 112 CO 0.68 -1.34 0.13 0.99 -0.25 0.00 0.00 175.29 175.49 2ull s THR 113 N -2.33 3.48 0.11 -0.19 2.01 -0.61 -4.97 115.64 113.15 2ull s THR 113 Ca 0.67 -1.51 -0.30 0.00 0.31 0.00 0.00 61.69 60.86 2ull s THR 113 Cb -0.21 -3.13 -0.06 0.00 0.01 0.00 0.00 72.50 69.11 2ull s THR 113 CO 0.43 -0.36 1.09 -0.76 -0.69 0.00 0.00 174.62 174.33 2ull s LEU 114 N 1.29 4.44 0.02 4.42 1.43 -1.26 -0.39 118.68 128.62 2ull s LEU 114 Ca 0.01 1.97 0.04 0.00 -1.03 0.00 0.00 54.13 55.12 2ull s LEU 114 Cb -0.21 -3.59 -0.01 0.00 0.03 0.00 0.00 46.19 42.40 2ull s LEU 114 CO -0.00 -0.27 -0.11 -0.76 0.23 0.00 0.00 176.35 175.43 2ull s LEU 119 N 0.25 2.10 -1.28 1.79 1.43 -1.10 -4.91 118.68 116.96 2ull s LEU 119 Ca 0.52 -0.32 -0.08 0.00 -1.03 0.00 0.00 54.13 53.22 2ull s LEU 119 Cb -0.27 -0.49 -0.04 0.00 0.03 0.00 0.00 46.19 45.41 2ull s LEU 119 CO 0.32 0.05 2.86 -0.81 0.23 0.00 0.00 176.35 179.00 2ull n PRO 120 N 2.34 3.70 -4.02 1.29 -0.04 -1.26 -4.47 135.00 132.54 2ull n PRO 120 Ca -0.16 -2.45 -0.08 0.00 -0.04 0.00 0.00 63.50 60.77 2ull n PRO 120 Cb 0.56 -2.62 -0.10 0.00 -0.04 0.00 0.00 33.50 31.30 2ull n PRO 120 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2ull s ARG 120 N 0.80 0.59 -0.02 0.54 0.52 -1.26 -0.92 118.95 119.19 2ull s ARG 120 Ca 0.64 -1.03 0.02 0.00 -0.52 0.00 0.00 55.73 54.85 2ull s ARG 120 Cb 0.21 0.21 0.00 0.00 0.52 0.00 0.00 34.95 35.90 2ull s ARG 120 CO -0.07 -0.13 -0.07 0.08 0.02 0.00 0.00 175.30 175.13 2ull s VAL 120 N -3.35 0.65 0.11 3.52 1.01 -0.39 -0.52 120.40 121.44 2ull s VAL 120 Ca 0.02 -0.29 -0.31 0.00 0.00 0.00 0.00 61.98 61.40 2ull s VAL 120 Cb 0.04 -0.59 -0.07 0.00 0.00 0.00 0.00 36.38 35.76 2ull s VAL 120 CO -0.08 0.21 1.25 0.00 0.00 0.00 0.00 175.10 176.48 2ull s ALA 120 N 0.23 3.46 -0.40 5.51 0.00 0.01 -0.40 121.76 130.16 2ull s ALA 120 Ca -0.03 0.95 0.01 0.00 0.00 0.00 0.00 51.96 52.89 2ull s ALA 120 Cb -0.08 -3.46 0.13 0.00 0.00 0.00 0.00 23.12 19.71 2ull s ALA 120 CO 0.00 -0.46 0.21 1.21 0.00 0.00 0.00 175.76 176.72 2ull s ASN 120 N 0.80 3.49 0.00 0.00 2.47 -1.26 -4.73 114.94 115.71 2ull s ASN 120 Ca 0.58 -2.37 0.00 0.00 0.42 0.00 0.00 52.86 51.49 2ull s ASN 120 Cb -0.32 -0.82 0.00 0.00 -1.45 0.00 0.00 41.25 38.65 2ull s ASN 120 CO 0.32 -0.30 0.00 0.61 -3.72 0.00 0.00 177.10 174.01 2ull n GLY 120 N 3.85 -0.02 2.20 1.21 0.00 -1.26 -4.22 105.19 106.96 2ull n GLY 120 Ca 0.08 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2ull n GLY 120 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2ull n SER 120 N 0.70 0.00 -3.97 1.61 2.88 -1.26 -5.08 113.62 108.51 2ull n SER 120 Ca 0.00 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.46 2ull n SER 120 Cb 0.00 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.37 2ull n SER 120 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 2ull s PHE 120 N 0.00 0.30 -0.11 0.66 0.08 -1.26 -4.55 117.98 113.10 2ull s PHE 120 Ca 0.00 -0.72 0.01 0.00 0.12 0.00 0.00 56.93 56.34 2ull s PHE 120 Cb 0.00 -0.21 -0.02 0.00 -0.57 0.00 0.00 43.02 42.23 2ull s PHE 120 CO 0.00 -0.41 -0.14 0.08 -0.10 0.00 0.00 175.22 174.65 2ull s VAL 120 N -3.35 3.00 0.05 -0.44 1.01 0.46 -4.84 120.40 116.29 2ull s VAL 120 Ca 0.01 -0.70 -0.27 0.00 0.00 0.00 0.00 61.98 61.03 2ull s VAL 120 Cb 0.03 -2.23 -0.05 0.00 0.00 0.00 0.00 36.38 34.13 2ull s VAL 120 CO -0.08 0.54 0.83 -0.89 0.00 0.00 0.00 175.10 175.50 2ull s THR 120 N 0.10 4.70 -0.22 3.92 2.01 -1.26 -1.26 115.64 123.62 2ull s THR 120 Ca -0.06 1.77 -0.26 0.00 0.31 0.00 0.00 61.69 63.45 2ull s THR 120 Cb -0.15 -4.18 -0.00 0.00 0.01 0.00 0.00 72.50 68.18 2ull s THR 120 CO 0.05 0.33 0.90 -0.69 -0.69 0.00 0.00 174.62 174.52 2ull s VAL 121 N 0.09 4.79 -0.19 3.82 1.01 -0.10 -4.28 120.40 125.55 2ull s VAL 121 Ca 0.42 1.73 0.06 0.00 0.00 0.00 0.00 61.98 64.19 2ull s VAL 121 Cb -0.21 -4.18 -0.07 0.00 0.00 0.00 0.00 36.38 31.91 2ull s VAL 121 CO 0.25 -0.09 0.21 0.54 0.00 0.00 0.00 175.10 176.01 2ull n ARG 122 N 5.97 3.45 -3.63 2.72 1.74 0.36 -1.31 116.66 125.96 2ull n ARG 122 Ca 0.07 -0.02 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 2ull n ARG 122 Cb 0.47 -0.90 0.00 0.00 -1.02 0.00 0.00 32.46 31.01 2ull n ARG 122 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ull n GLY 123 N 1.48 -1.37 2.52 -0.13 0.00 -1.19 -4.85 105.19 101.65 2ull n GLY 123 Ca 0.00 -1.08 -0.10 0.00 0.00 0.00 0.00 46.02 44.84 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 1.88 2.90 -4.68 1.61 3.41 -1.26 -0.35 113.62 117.13 2ull n SER 124 Ca 0.00 -2.76 -0.42 0.00 -0.26 0.00 0.00 58.87 55.42 2ull n SER 124 Cb 0.00 -0.43 -0.03 0.00 -0.26 0.00 0.00 64.21 63.49 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 -4.12 3.47 -0.11 6.66 2.01 -1.26 -4.86 115.64 117.43 2ull s THR 125 Ca 0.36 0.79 -0.30 0.00 0.31 0.00 0.00 61.69 62.86 2ull s THR 125 Cb 0.37 -3.51 -0.02 0.00 0.01 0.00 0.00 72.50 69.34 2ull s THR 125 CO -0.01 -0.03 1.22 -0.70 -0.69 0.00 0.00 174.62 174.41 2ull s GLU 129 N 3.03 4.30 0.39 4.92 2.12 -1.26 -4.73 118.70 127.47 2ull s GLU 129 Ca 0.70 1.66 -0.24 0.00 0.36 0.00 0.00 54.97 57.45 2ull s GLU 129 Cb -0.34 -3.65 -0.09 0.00 0.26 0.00 0.00 34.13 30.31 2ull s GLU 129 CO 0.29 -0.56 1.01 0.00 -0.54 0.00 0.00 175.26 175.46 2ull s ALA 130 N 2.77 3.09 0.53 6.30 0.00 -1.26 -5.06 121.76 128.14 2ull s ALA 130 Ca 0.55 0.61 -0.07 0.00 0.00 0.00 0.00 51.96 53.05 2ull s ALA 130 Cb -0.23 -3.23 -0.03 0.00 0.00 0.00 0.00 23.12 19.62 2ull s ALA 130 CO 0.18 -0.08 0.87 0.00 0.00 0.00 0.00 175.76 176.73 2ull s ALA 131 N -1.75 3.30 0.30 0.00 0.00 -1.26 -4.98 121.76 117.38 2ull s ALA 131 Ca 0.57 -0.39 -0.29 0.00 0.00 0.00 0.00 51.96 51.85 2ull s ALA 131 Cb -0.19 -2.74 -0.12 0.00 0.00 0.00 0.00 23.12 20.06 2ull s ALA 131 CO 0.24 -0.48 1.39 0.28 0.00 0.00 0.00 175.76 177.19 2ull n VAL 132 N -2.43 1.50 0.00 0.00 0.31 -1.26 -1.91 118.33 114.53 2ull n VAL 132 Ca 0.02 -0.37 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 2ull n VAL 132 Cb 0.55 -1.63 0.00 0.00 -0.91 0.00 0.00 33.84 31.84 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 1.42 1.66 3.83 2.92 0.00 0.36 -5.02 105.19 110.36 2ull n GLY 133 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.30 3.02 0.56 4.61 0.00 -0.81 -4.78 121.76 122.07 2ull s ALA 134 Ca 0.00 0.27 -0.15 0.00 0.00 0.00 0.00 51.96 52.08 2ull s ALA 134 Cb 0.00 -3.14 -0.06 0.00 0.00 0.00 0.00 23.12 19.92 2ull s ALA 134 CO 0.00 -0.20 1.01 0.00 0.00 0.00 0.00 175.76 176.57 2ull s ALA 135 N -2.47 2.99 0.23 0.00 0.00 -1.26 -1.02 121.76 120.23 2ull s ALA 135 Ca 0.60 0.16 -0.18 0.00 0.00 0.00 0.00 51.96 52.54 2ull s ALA 135 Cb -0.11 -3.13 0.02 0.00 0.00 0.00 0.00 23.12 19.90 2ull s ALA 135 CO 0.27 -0.49 0.58 0.54 0.00 0.00 0.00 175.76 176.65 2ull s VAL 136 N -2.74 0.01 0.04 0.00 0.11 -0.78 -4.76 120.40 112.28 2ull s VAL 136 Ca 0.59 -0.98 -0.01 0.00 -2.93 0.00 0.00 61.98 58.64 2ull s VAL 136 Cb -0.11 -1.85 -0.03 0.00 -1.53 0.00 0.00 36.38 32.85 2ull s VAL 136 CO 0.38 -0.05 -0.02 0.00 -3.33 0.00 0.00 175.10 172.09 2ull s ARG 138 N -2.86 0.39 -0.04 0.00 1.70 0.63 -0.27 118.95 118.50 2ull s ARG 138 Ca -0.03 -0.62 0.03 0.00 -0.47 0.00 0.00 55.73 54.65 2ull s ARG 138 Cb 0.00 -0.09 0.00 0.00 -0.57 0.00 0.00 34.95 34.30 2ull s ARG 138 CO -0.06 0.00 -0.14 0.45 -1.08 0.00 0.00 175.30 174.48 2ull s SER 139 N -1.37 1.77 0.22 -2.89 0.15 0.19 -1.14 113.70 110.63 2ull s SER 139 Ca -0.12 -0.29 -0.22 0.00 0.70 0.00 0.00 55.95 56.03 2ull s SER 139 Cb -0.09 -0.54 0.04 0.00 -1.71 0.00 0.00 66.02 63.72 2ull s SER 139 CO -0.00 0.10 0.66 -0.83 1.20 0.00 0.00 173.24 174.37 2ull s GLY 140 N 0.20 -0.33 0.22 9.45 0.00 -0.54 -2.60 107.32 113.71 2ull s GLY 140 Ca -0.05 0.06 0.24 0.00 0.00 0.00 0.00 44.72 44.97 2ull s GLY 140 CO 0.02 0.02 1.74 -0.96 0.00 0.00 0.00 173.10 173.92 2ull n ARG 141 N -0.42 0.21 -0.04 2.90 -4.01 -1.07 -1.20 116.66 113.02 2ull n ARG 141 Ca -0.10 0.32 -0.03 0.00 -1.04 0.00 0.00 57.85 57.00 2ull n ARG 141 Cb 0.62 -1.82 -0.01 0.00 -3.04 0.00 0.00 32.46 28.21 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 -2.19 0.65 1.19 8.89 -1.04 -1.26 -4.61 114.28 115.91 2ull n THR 142 Ca 0.04 0.36 0.12 0.00 -2.04 0.00 0.00 64.05 62.52 2ull n THR 142 Cb 0.31 -1.89 0.38 0.00 -1.82 0.00 0.00 70.33 67.31 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 -3.34 0.17 -0.90 12.58 -2.24 -1.26 -5.03 114.28 114.26 2ull n THR 143 Ca -0.05 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 2ull n THR 143 Cb 0.17 0.54 0.00 0.00 -2.10 0.00 0.00 70.33 68.94 2ull n THR 143 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ull n GLY 156 N 1.20 2.59 3.70 3.38 0.00 -0.34 -4.65 105.19 111.06 2ull n GLY 156 Ca 0.17 -0.32 -0.37 0.00 0.00 0.00 0.00 46.02 45.50 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 3.42 -0.04 1.61 5.04 -1.26 -1.46 117.35 124.67 2ull s TYR 157 Ca 0.00 0.62 -0.02 0.00 -2.44 0.00 0.00 57.07 55.23 2ull s TYR 157 Cb 0.00 -2.44 0.02 0.00 0.35 0.00 0.00 41.96 39.89 2ull s TYR 157 CO 0.00 0.11 0.08 -0.65 -1.34 0.00 0.00 175.55 173.75 2ull s GLN 158 N 0.88 0.04 0.02 4.97 -1.52 -0.30 -4.98 119.66 118.78 2ull s GLN 158 Ca 0.18 0.22 0.08 0.00 -1.95 0.00 0.00 55.36 53.88 2ull s GLN 158 Cb -0.14 -0.13 -0.03 0.00 -0.22 0.00 0.00 33.01 32.50 2ull s GLN 158 CO 0.06 -0.11 -0.22 0.00 -0.25 0.00 0.00 175.29 174.77 2ull n GLY 160 N 1.91 4.53 2.94 0.00 0.00 0.07 -4.63 105.19 110.01 2ull n GLY 160 Ca -0.17 -0.45 -0.13 0.00 0.00 0.00 0.00 46.02 45.27 2ull n GLY 160 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ull s THR 161 N 0.97 0.22 -0.31 2.61 2.01 -1.26 -1.86 115.64 118.01 2ull s THR 161 Ca 0.00 -0.38 -0.29 0.00 0.31 0.00 0.00 61.69 61.33 2ull s THR 161 Cb 0.00 -0.24 0.02 0.00 0.01 0.00 0.00 72.50 72.29 2ull s THR 161 CO 0.00 -0.11 1.06 -0.63 -0.69 0.00 0.00 174.62 174.25 2ull s ILE 162 N -0.49 4.53 -0.18 1.82 1.01 -0.19 -1.20 121.20 126.50 2ull s ILE 162 Ca -0.04 1.74 0.10 0.00 0.00 0.00 0.00 60.65 62.46 2ull s ILE 162 Cb -0.04 -4.40 -0.18 0.00 0.01 0.00 0.00 42.46 37.85 2ull s ILE 162 CO -0.00 -0.45 -0.02 0.35 0.00 0.00 0.00 174.94 174.82 2ull n THR 163 N 5.81 1.16 -3.72 2.92 -2.24 0.38 -0.49 114.28 118.10 2ull n THR 163 Ca 0.12 -0.62 -0.11 0.00 -2.27 0.00 0.00 64.05 61.16 2ull n THR 163 Cb 0.47 -0.79 -0.07 0.00 -2.10 0.00 0.00 70.33 67.84 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 -2.41 -0.77 0.12 6.98 0.00 -0.99 -4.88 121.76 119.82 2ull s ALA 164 Ca -0.15 0.02 0.07 0.00 0.00 0.00 0.00 51.96 51.90 2ull s ALA 164 Cb 0.06 0.41 -0.04 0.00 0.00 0.00 0.00 23.12 23.55 2ull s ALA 164 CO 0.61 -0.47 -0.18 0.15 0.00 0.00 0.00 175.76 175.87 2ull s LYS 165 N -2.88 1.11 -1.07 0.00 1.02 -1.26 -0.23 119.74 116.43 2ull s LYS 165 Ca -0.03 -1.24 -0.06 0.00 0.02 0.00 0.00 55.97 54.66 2ull s LYS 165 Cb 0.00 -1.18 0.01 0.00 -0.52 0.00 0.00 37.83 36.13 2ull s LYS 165 CO -0.05 0.25 0.82 -1.71 -0.92 0.00 0.00 175.35 173.74 2ull n ASN 166 N 0.71 -5.32 -4.80 2.83 4.05 -0.86 -4.97 115.26 106.90 2ull n ASN 166 Ca -0.17 -0.37 -0.39 0.00 0.45 0.00 0.00 54.58 54.10 2ull n ASN 166 Cb 0.56 -3.97 -0.06 0.00 1.23 0.00 0.00 39.78 37.54 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 -3.20 4.75 -0.15 3.44 1.01 0.30 -4.42 120.40 122.13 2ull s VAL 167 Ca 0.41 1.26 -0.10 0.00 0.00 0.00 0.00 61.98 63.54 2ull s VAL 167 Cb -0.18 -3.92 -0.05 0.00 0.00 0.00 0.00 36.38 32.23 2ull s VAL 167 CO 0.50 0.53 0.18 -0.89 0.00 0.00 0.00 175.10 175.42 2ull s THR 168 N -0.94 5.40 -0.13 3.92 2.01 -1.26 -0.92 115.64 123.72 2ull s THR 168 Ca 0.30 0.31 -0.04 0.00 0.31 0.00 0.00 61.69 62.57 2ull s THR 168 Cb -0.19 -3.49 -0.04 0.00 0.01 0.00 0.00 72.50 68.79 2ull s THR 168 CO 0.19 0.50 0.03 0.00 -0.69 0.00 0.00 174.62 174.65 2ull s ALA 169 N -0.22 3.33 -1.04 7.40 0.00 0.13 -4.95 121.76 126.41 2ull s ALA 169 Ca 0.13 -0.77 -0.11 0.00 0.00 0.00 0.00 51.96 51.21 2ull s ALA 169 Cb -0.12 -1.68 0.25 0.00 0.00 0.00 0.00 23.12 21.57 2ull s ALA 169 CO 0.02 0.40 1.04 -0.80 0.00 0.00 0.00 175.76 176.42 2ull s ASN 170 N -0.29 7.15 0.70 0.00 0.01 -1.26 -1.24 114.94 120.01 2ull s ASN 170 Ca 0.07 -3.30 -0.11 0.00 -0.71 0.00 0.00 52.86 48.81 2ull s ASN 170 Cb -0.12 -2.22 0.02 0.00 0.41 0.00 0.00 41.25 39.33 2ull s ASN 170 CO 0.02 -0.40 1.09 -0.31 -1.51 0.00 0.00 177.10 175.99 2ull s TYR 171 N -0.65 3.32 0.31 2.20 2.02 -0.82 -4.95 117.35 118.77 2ull s TYR 171 Ca 0.28 1.03 0.05 0.00 -0.37 0.00 0.00 57.07 58.06 2ull s TYR 171 Cb -0.09 -3.07 0.67 0.00 -0.40 0.00 0.00 41.96 39.07 2ull s TYR 171 CO -0.08 -1.18 1.83 0.00 -1.57 0.00 0.00 175.55 174.55 2ull h ALA 173 N -0.65 1.64 -0.00 3.71 0.00 -2.03 -2.07 119.26 119.87 2ull h ALA 173 Ca -0.45 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2ull h ALA 173 Cb 1.25 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2ull h ALA 173 CO 0.64 0.07 -0.19 0.39 0.00 0.00 0.00 179.25 180.16 2ull n GLU 174 N -4.65 0.17 0.00 0.00 4.71 -1.26 -5.02 120.64 114.59 2ull n GLU 174 Ca 0.20 -0.05 0.00 0.00 -0.01 0.00 0.00 57.16 57.30 2ull n GLU 174 Cb 0.45 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.38 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 1.44 1.41 3.77 0.62 0.00 -0.78 -4.81 105.19 106.85 2ull n GLY 175 Ca 0.08 -1.72 -0.38 0.00 0.00 0.00 0.00 46.02 44.00 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 -1.52 3.27 -0.21 4.61 0.00 -1.26 -1.95 121.76 124.71 2ull s ALA 176 Ca 0.00 0.64 0.01 0.00 0.00 0.00 0.00 51.96 52.61 2ull s ALA 176 Cb 0.00 -3.23 0.04 0.00 0.00 0.00 0.00 23.12 19.94 2ull s ALA 176 CO 0.00 0.08 -0.10 0.08 0.00 0.00 0.00 175.76 175.82 2ull s VAL 177 N -1.40 1.68 0.57 0.00 1.01 -0.38 -0.23 120.40 121.66 2ull s VAL 177 Ca 0.47 -1.07 0.01 0.00 0.00 0.00 0.00 61.98 61.39 2ull s VAL 177 Cb -0.24 -1.77 0.05 0.00 0.00 0.00 0.00 36.38 34.42 2ull s VAL 177 CO 0.30 0.14 0.80 -0.13 0.00 0.00 0.00 175.10 176.21 2ull s ARG 178 N 1.37 2.43 -1.81 2.72 0.52 -0.44 -0.69 118.95 123.04 2ull s ARG 178 Ca -0.02 -0.83 0.00 0.00 -0.52 0.00 0.00 55.73 54.36 2ull s ARG 178 Cb -0.17 -2.47 0.00 0.00 0.52 0.00 0.00 34.95 32.84 2ull s ARG 178 CO -0.08 -0.81 0.00 0.41 0.02 0.00 0.00 175.30 174.84 2ull n GLY 179 N -2.41 1.41 3.82 -3.53 0.00 -1.20 -4.80 105.19 98.49 2ull n GLY 179 Ca 0.09 -0.17 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 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 -4.17 3.98 -0.18 0.99 1.43 -0.10 -4.33 118.68 116.30 2ull s LEU 180 Ca 0.00 1.64 -0.09 0.00 -1.03 0.00 0.00 54.13 54.65 2ull s LEU 180 Cb 0.00 -4.45 -0.05 0.00 0.03 0.00 0.00 46.19 41.73 2ull s LEU 180 CO 0.00 -0.32 0.12 -0.89 0.23 0.00 0.00 176.35 175.49 2ull s THR 181 N -2.12 5.32 -0.14 5.49 2.01 -0.32 -0.54 115.64 125.34 2ull s THR 181 Ca 0.60 0.15 -0.07 0.00 0.31 0.00 0.00 61.69 62.68 2ull s THR 181 Cb -0.10 -3.40 -0.04 0.00 0.01 0.00 0.00 72.50 68.97 2ull s THR 181 CO 0.14 0.48 0.12 -1.58 -0.69 0.00 0.00 174.62 173.10 2ull s GLN 182 N 0.07 3.64 0.33 4.92 0.74 0.68 -0.60 119.66 129.44 2ull s GLN 182 Ca 0.09 -0.19 0.03 0.00 0.05 0.00 0.00 55.36 55.34 2ull s GLN 182 Cb -0.11 -3.22 -0.05 0.00 1.10 0.00 0.00 33.01 30.72 2ull s GLN 182 CO -0.00 0.62 0.09 0.20 -0.55 0.00 0.00 175.29 175.64 2ull s GLY 183 N -0.57 2.13 -0.00 2.59 0.00 0.15 -0.47 107.32 111.15 2ull s GLY 183 Ca 0.12 -1.81 0.09 0.00 0.00 0.00 0.00 44.72 43.12 2ull s GLY 183 CO 0.02 -1.77 1.20 1.16 0.00 0.00 0.00 173.10 173.72 2ull n ASN 184 N -0.80 2.74 -4.77 1.64 0.23 -0.34 -1.92 115.26 112.05 2ull n ASN 184 Ca -0.03 -2.01 -0.40 0.00 -0.53 0.00 0.00 54.58 51.62 2ull n ASN 184 Cb 0.66 -0.19 -0.02 0.00 -2.08 0.00 0.00 39.78 38.15 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 -1.02 3.32 0.79 -2.53 0.00 -1.26 -4.74 121.76 116.32 2ull s ALA 185 Ca 0.19 1.11 -0.12 0.00 0.00 0.00 0.00 51.96 53.15 2ull s ALA 185 Cb 0.10 -3.43 0.07 0.00 0.00 0.00 0.00 23.12 19.86 2ull s ALA 185 CO 0.12 -0.59 1.10 0.00 0.00 0.00 0.00 175.76 176.40 2ull s MET 190 N -5.20 0.90 0.15 0.00 0.23 -1.26 -4.80 119.30 109.32 2ull s MET 190 Ca 0.61 -0.43 -0.08 0.00 -1.03 0.00 0.00 55.69 54.76 2ull s MET 190 Cb -0.14 0.35 -0.01 0.00 -1.53 0.00 0.00 34.83 33.50 2ull s MET 190 CO 0.54 -0.40 0.26 0.20 -2.03 0.00 0.00 175.02 173.58 2ull s GLY 191 N -2.69 0.45 -0.06 3.16 0.00 -1.26 -1.41 107.32 105.51 2ull s GLY 191 Ca 0.09 -0.88 -0.36 0.00 0.00 0.00 0.00 44.72 43.57 2ull s GLY 191 CO -0.04 -0.86 1.72 0.54 0.00 0.00 0.00 173.10 174.46 2ull n ARG 192 N -0.19 1.79 0.00 2.90 1.74 0.14 -1.29 116.66 121.76 2ull n ARG 192 Ca -0.08 0.65 0.00 0.00 -0.77 0.00 0.00 57.85 57.65 2ull n ARG 192 Cb 0.63 -2.42 0.00 0.00 -1.02 0.00 0.00 32.46 29.65 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 3.91 3.37 0.11 -0.13 0.00 -1.26 -4.76 105.19 106.43 2ull n GLY 193 Ca 0.22 -0.94 0.10 0.00 0.00 0.00 0.00 46.02 45.40 2ull n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ull n ASP 194 N 0.00 0.49 -3.67 1.61 8.00 -0.41 -3.67 116.55 118.89 2ull n ASP 194 Ca 0.00 0.65 -0.50 0.00 0.71 0.00 0.00 54.79 55.65 2ull n ASP 194 Cb 0.00 -0.74 -0.07 0.00 -0.02 0.00 0.00 41.12 40.29 2ull n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2ull n SER 195 N -2.08 0.40 0.00 -2.24 7.64 -1.26 -0.58 113.62 115.51 2ull n SER 195 Ca 0.01 0.94 0.00 0.00 1.01 0.00 0.00 58.87 60.83 2ull n SER 195 Cb 0.15 -0.72 0.00 0.00 -1.01 0.00 0.00 64.21 62.63 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 2.03 0.88 3.83 0.23 0.00 0.46 0.01 105.19 112.63 2ull n GLY 196 Ca 0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.00 1.62 0.35 -0.02 0.00 0.26 -2.48 107.32 105.04 2ull s GLY 197 Ca 0.00 -0.31 -0.28 0.00 0.00 0.00 0.00 44.72 44.13 2ull s GLY 197 CO 0.00 0.12 1.33 -0.56 0.00 0.00 0.00 173.10 173.99 2ull s SER 198 N -4.08 6.65 -0.16 1.64 0.01 -1.07 -0.49 113.70 116.21 2ull s SER 198 Ca 0.61 2.73 0.01 0.00 1.31 0.00 0.00 55.95 60.61 2ull s SER 198 Cb -0.13 -2.65 0.02 0.00 0.21 0.00 0.00 66.02 63.47 2ull s SER 198 CO 0.53 -0.62 -0.16 0.26 0.41 0.00 0.00 173.24 173.66 2ull s TRP 199 N -1.16 2.38 -0.01 2.43 0.52 -0.59 -0.64 118.94 121.86 2ull s TRP 199 Ca 0.50 -1.35 -0.13 0.00 0.02 0.00 0.00 56.10 55.14 2ull s TRP 199 Cb -0.40 -1.70 0.02 0.00 -1.15 0.00 0.00 33.47 30.23 2ull s TRP 199 CO 0.54 -0.71 0.27 -1.50 0.02 0.00 0.00 176.95 175.57 2ull s ILE 200 N 1.38 0.06 0.67 2.03 2.07 0.63 -0.19 121.20 127.85 2ull s ILE 200 Ca 0.04 -0.50 -0.11 0.00 -1.41 0.00 0.00 60.65 58.67 2ull s ILE 200 Cb -0.13 -0.57 -0.01 0.00 0.13 0.00 0.00 42.46 41.88 2ull s ILE 200 CO -0.11 -0.27 1.07 0.42 -1.91 0.00 0.00 174.94 174.13 2ull s THR 201 N -1.27 4.06 -0.29 4.00 -4.23 -0.68 -0.45 115.64 116.77 2ull s THR 201 Ca -0.13 0.67 0.26 0.00 -1.18 0.00 0.00 61.69 61.30 2ull s THR 201 Cb -0.06 -3.66 0.27 0.00 1.34 0.00 0.00 72.50 70.40 2ull s THR 201 CO 0.04 -0.87 1.77 0.28 -0.54 0.00 0.00 174.62 175.30 2ull h SER 201 N -0.50 0.00 -0.41 3.99 0.02 -1.91 -1.24 113.55 113.50 2ull h SER 201 Ca -0.44 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 2ull h SER 201 Cb 1.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.76 2ull h SER 201 CO 0.63 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 176.32 2ull n ALA 202 N -1.84 2.44 -0.62 3.77 0.00 -1.26 -4.95 120.51 118.05 2ull n ALA 202 Ca 0.01 -0.77 0.00 0.00 0.00 0.00 0.00 53.44 52.68 2ull n ALA 202 Cb 0.20 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.67 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 1.24 0.65 3.52 0.00 0.00 -0.47 -4.82 105.19 105.31 2ull n GLY 207 Ca 0.16 -0.35 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 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 -0.83 3.38 0.05 1.61 -1.52 -1.26 -0.48 119.66 120.61 2ull s GLN 208 Ca 0.00 -0.42 -0.30 0.00 -1.95 0.00 0.00 55.36 52.68 2ull s GLN 208 Cb 0.00 -3.89 -0.08 0.00 -0.22 0.00 0.00 33.01 28.83 2ull s GLN 208 CO 0.00 -0.76 1.70 0.00 -0.25 0.00 0.00 175.29 175.97 2ull s ALA 209 N 2.35 3.67 -0.24 6.09 0.00 0.53 -1.68 121.76 132.47 2ull s ALA 209 Ca 0.16 1.19 0.03 0.00 0.00 0.00 0.00 51.96 53.34 2ull s ALA 209 Cb -0.16 -3.73 -0.19 0.00 0.00 0.00 0.00 23.12 19.05 2ull s ALA 209 CO 0.14 -1.22 -0.14 1.04 0.00 0.00 0.00 175.76 175.59 2ull n GLN 210 N 6.10 0.66 -3.60 0.00 1.13 0.74 -4.43 117.38 117.98 2ull n GLN 210 Ca 0.17 0.15 0.00 0.00 -1.94 0.00 0.00 57.00 55.38 2ull n GLN 210 Cb 0.41 -1.54 0.00 0.00 0.11 0.00 0.00 30.24 29.22 2ull n GLN 210 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2ull n GLY 211 N 2.18 -0.91 3.32 1.08 0.00 -1.12 -1.47 105.19 108.28 2ull n GLY 211 Ca -0.43 -0.98 -0.29 0.00 0.00 0.00 0.00 46.02 44.32 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 2.02 0.04 1.61 -7.23 -0.23 -1.55 120.40 112.06 2ull s VAL 212 Ca 0.00 -1.37 -0.31 0.00 -1.81 0.00 0.00 61.98 58.49 2ull s VAL 212 Cb 0.00 -1.74 -0.10 0.00 0.56 0.00 0.00 36.38 35.10 2ull s VAL 212 CO 0.00 0.30 1.93 0.80 -0.31 0.00 0.00 175.10 177.82 2ull n MET 213 N 1.73 2.78 -0.10 4.82 1.56 0.36 -0.64 117.12 127.61 2ull n MET 213 Ca -0.17 1.02 -0.22 0.00 -0.27 0.00 0.00 57.70 58.06 2ull n MET 213 Cb 0.52 -2.95 -0.07 0.00 2.15 0.00 0.00 33.22 32.87 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 6.97 1.50 0.00 6.12 2.88 0.12 -0.40 113.62 130.81 2ull n SER 214 Ca 0.20 0.23 0.00 0.00 -1.33 0.00 0.00 58.87 57.97 2ull n SER 214 Cb 0.39 -0.59 0.00 0.00 -0.75 0.00 0.00 64.21 63.26 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 1.76 -0.92 0.00 0.46 0.00 -0.75 -4.88 105.19 100.86 2ull n GLY 215 Ca -0.40 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.52 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 0.99 2.55 -0.02 0.00 -1.26 -1.10 105.19 106.36 2ull n GLY 216 Ca 0.00 -1.90 -0.41 0.00 0.00 0.00 0.00 46.02 43.72 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 1.73 6.68 -4.59 1.61 6.94 -0.44 -4.93 115.26 122.24 2ull n ASN 217 Ca 0.00 -2.86 -0.42 0.00 -0.02 0.00 0.00 54.58 51.28 2ull n ASN 217 Cb 0.00 -1.53 -0.03 0.00 -2.36 0.00 0.00 39.78 35.86 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 1.44 3.52 1.29 3.53 -7.23 -1.26 -4.44 120.40 117.25 2ull s VAL 218 Ca 0.55 0.52 -0.21 0.00 -1.81 0.00 0.00 61.98 61.02 2ull s VAL 218 Cb 0.16 -3.75 0.33 0.00 0.56 0.00 0.00 36.38 33.67 2ull s VAL 218 CO -0.06 -0.51 0.84 0.00 -0.31 0.00 0.00 175.10 175.06 2ull n GLN 219 N 8.45 -4.22 0.06 4.82 1.13 0.33 -4.73 117.38 123.22 2ull n GLN 219 Ca 0.22 -1.40 0.06 0.00 -1.94 0.00 0.00 57.00 53.94 2ull n GLN 219 Cb 0.47 -1.67 0.29 0.00 0.11 0.00 0.00 30.24 29.45 2ull n GLN 219 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 2ull n SER 219 N -5.36 0.25 -1.39 1.08 3.41 -1.26 -1.13 113.62 109.22 2ull n SER 219 Ca 0.13 0.60 0.12 0.00 -0.26 0.00 0.00 58.87 59.45 2ull n SER 219 Cb 0.54 -0.64 0.33 0.00 -0.26 0.00 0.00 64.21 64.19 2ull n SER 219 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2ull n ASN 219 N -1.82 4.07 0.00 4.04 6.94 -1.26 -4.95 115.26 122.28 2ull n ASN 219 Ca 0.01 -2.05 0.00 0.00 -0.02 0.00 0.00 54.58 52.51 2ull n ASN 219 Cb 0.07 -0.50 0.00 0.00 -2.36 0.00 0.00 39.78 36.99 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 1.60 1.21 3.20 4.83 0.00 -0.28 -5.02 105.19 110.73 2ull n GLY 219 Ca 0.25 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.13 2ull n GLY 219 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2ull n ASN 219 N 0.00 -1.26 -0.67 1.61 0.23 -1.25 -0.68 115.26 113.24 2ull n ASN 219 Ca 0.00 -2.83 0.06 0.00 -0.53 0.00 0.00 54.58 51.28 2ull n ASN 219 Cb 0.00 2.37 0.16 0.00 -2.08 0.00 0.00 39.78 40.23 2ull n ASN 219 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 2ull n ASN 220 N -1.66 1.63 0.11 0.53 0.23 -0.50 -0.51 115.26 115.09 2ull n ASN 220 Ca 0.01 -3.44 -0.02 0.00 -0.53 0.00 0.00 54.58 50.61 2ull n ASN 220 Cb 0.56 -0.47 -0.00 0.00 -2.08 0.00 0.00 39.78 37.79 2ull n ASN 220 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2ull n GLY 221 N 1.13 -0.72 3.31 0.00 0.00 -1.26 -4.83 105.19 102.82 2ull n GLY 221 Ca 0.01 -0.09 -0.21 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.93 1.72 0.90 -0.61 -4.36 -1.25 -5.14 121.20 110.53 2ull s ILE 222 Ca 0.09 -1.82 -0.13 0.00 -0.26 0.00 0.00 60.65 58.52 2ull s ILE 222 Cb 0.04 -1.74 0.02 0.00 1.25 0.00 0.00 42.46 42.03 2ull s ILE 222 CO 0.07 -0.29 0.47 -2.65 0.24 0.00 0.00 174.94 172.78 2ull n PRO 222 N 0.46 -0.14 -0.27 0.37 -0.02 -1.26 -4.87 135.00 129.26 2ull n PRO 222 Ca -0.15 0.01 -0.05 0.00 -2.02 0.00 0.00 63.50 61.29 2ull n PRO 222 Cb 0.56 -1.88 0.06 0.00 -0.02 0.00 0.00 33.50 32.23 2ull n PRO 222 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ull h ALA 222 N -1.28 0.95 0.00 3.55 0.00 -1.95 -1.61 119.26 118.93 2ull h ALA 222 Ca -0.44 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2ull h ALA 222 Cb 1.30 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2ull h ALA 222 CO 0.37 0.40 0.00 -1.13 0.00 0.00 0.00 179.25 178.88 2ull n SER 222 N -4.53 0.00 -0.05 0.00 3.41 -1.26 -2.15 113.62 109.03 2ull n SER 222 Ca 0.07 -0.79 0.03 0.00 -0.26 0.00 0.00 58.87 57.93 2ull n SER 222 Cb 0.04 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.04 2ull n SER 222 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ull n GLN 223 N -0.83 2.46 -4.54 4.33 6.02 -0.61 -5.05 117.38 119.16 2ull n GLN 223 Ca 0.09 -1.87 -0.33 0.00 -0.01 0.00 0.00 57.00 54.89 2ull n GLN 223 Cb 0.04 -1.17 -0.11 0.00 1.02 0.00 0.00 30.24 30.02 2ull n GLN 223 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2ull s ARG 224 N -1.61 2.67 -0.23 -1.09 0.52 -0.92 -4.92 118.95 113.38 2ull s ARG 224 Ca 0.11 -0.62 0.01 0.00 -0.52 0.00 0.00 55.73 54.72 2ull s ARG 224 Cb 0.09 -2.56 0.05 0.00 0.52 0.00 0.00 34.95 33.06 2ull s ARG 224 CO 0.01 0.64 -0.09 0.45 0.02 0.00 0.00 175.30 176.34 2ull s SER 225 N -1.08 3.89 -0.25 0.23 0.15 -1.26 -4.61 113.70 110.77 2ull s SER 225 Ca 0.15 -1.15 0.01 0.00 0.70 0.00 0.00 55.95 55.65 2ull s SER 225 Cb -0.11 -1.32 0.07 0.00 -1.71 0.00 0.00 66.02 62.95 2ull s SER 225 CO 0.04 -0.19 -0.01 -0.44 1.20 0.00 0.00 173.24 173.84 2ull s SER 226 N 1.30 3.88 -0.12 5.45 0.01 -0.81 -1.33 113.70 122.07 2ull s SER 226 Ca -0.05 -1.30 -0.11 0.00 1.31 0.00 0.00 55.95 55.79 2ull s SER 226 Cb -0.18 -1.12 -0.05 0.00 0.21 0.00 0.00 66.02 64.88 2ull s SER 226 CO -0.07 -0.28 0.23 -0.76 0.41 0.00 0.00 173.24 172.77 2ull s LEU 227 N 1.42 4.33 0.06 2.44 1.43 -0.26 -0.67 118.68 127.43 2ull s LEU 227 Ca -0.02 0.53 0.06 0.00 -1.03 0.00 0.00 54.13 53.67 2ull s LEU 227 Cb -0.18 -2.25 -0.03 0.00 0.03 0.00 0.00 46.19 43.76 2ull s LEU 227 CO -0.09 0.27 -0.16 0.72 0.23 0.00 0.00 176.35 177.31 2ull s PHE 228 N -0.38 1.42 -0.14 0.29 -0.12 0.23 -0.70 117.98 118.57 2ull s PHE 228 Ca 0.16 -0.39 -0.26 0.00 -0.05 0.00 0.00 56.93 56.39 2ull s PHE 228 Cb -0.13 -0.82 -0.02 0.00 -0.63 0.00 0.00 43.02 41.42 2ull s PHE 228 CO 0.05 0.08 0.85 -2.00 -0.05 0.00 0.00 175.22 174.14 2ull s GLU 229 N -1.40 4.35 0.34 1.99 2.56 0.18 -1.18 118.70 125.54 2ull s GLU 229 Ca 0.03 1.07 -0.28 0.00 0.00 0.00 0.00 54.97 55.78 2ull s GLU 229 Cb -0.09 -3.55 -0.12 0.00 2.00 0.00 0.00 34.13 32.37 2ull s GLU 229 CO 0.02 -0.26 1.33 0.54 -0.56 0.00 0.00 175.26 176.33 2ull n ARG 230 N 4.94 2.20 -0.02 4.30 1.74 -1.26 -1.07 116.66 127.49 2ull n ARG 230 Ca 0.04 0.77 -0.15 0.00 -0.77 0.00 0.00 57.85 57.75 2ull n ARG 230 Cb 0.49 -2.38 -0.03 0.00 -1.02 0.00 0.00 32.46 29.52 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 2.78 0.84 -0.36 0.55 5.85 -1.59 -3.36 115.31 120.03 2ull h LEU 231 Ca -0.46 -0.51 0.07 0.00 0.84 0.00 0.00 57.88 57.81 2ull h LEU 231 Cb 1.28 -0.25 -0.09 0.00 0.37 0.00 0.00 40.66 41.97 2ull h LEU 231 CO 0.64 1.30 -0.36 1.56 -0.34 0.00 0.00 178.44 181.24 2ull h GLN 232 N 0.52 -0.29 0.00 1.25 4.20 -1.90 -1.20 115.11 117.69 2ull h GLN 232 Ca -0.03 0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 2ull h GLN 232 Cb 1.30 0.07 -0.00 0.00 0.30 0.00 0.00 27.48 29.14 2ull h GLN 232 CO 0.14 -0.19 -0.08 -1.00 -0.67 0.00 0.00 178.83 177.02 2ull h PRO 233 N -0.30 0.00 -0.09 1.46 0.13 -1.99 -1.72 132.00 129.48 2ull h PRO 233 Ca 0.15 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.22 2ull h PRO 233 Cb 0.56 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.69 2ull h PRO 233 CO -0.52 0.08 -0.18 0.82 -0.23 0.00 0.00 178.00 177.97 2ull h ILE 234 N 0.00 1.40 -0.39 -3.56 2.04 -1.40 -0.94 117.51 114.64 2ull h ILE 234 Ca -0.00 -1.46 0.01 0.00 1.00 0.00 0.00 64.86 64.41 2ull h ILE 234 Cb 0.23 2.13 -0.02 0.00 -0.74 0.00 0.00 36.82 38.41 2ull h ILE 234 CO 0.01 0.42 0.26 -0.07 0.00 0.00 0.00 178.15 178.76 2ull h LEU 235 N -0.17 0.44 -0.48 1.44 3.38 -0.77 -2.62 115.31 116.53 2ull h LEU 235 Ca 0.00 -0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 2ull h LEU 235 Cb 0.76 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 2ull h LEU 235 CO 0.04 0.32 -0.73 0.77 0.09 0.00 0.00 178.44 178.92 2ull h SER 236 N 0.52 0.26 -0.27 -0.43 4.64 -1.38 0.16 113.55 117.05 2ull h SER 236 Ca 0.15 -0.17 -0.09 0.00 -0.47 0.00 0.00 61.79 61.20 2ull h SER 236 Cb -0.05 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 61.95 2ull h SER 236 CO -0.04 0.90 -0.14 -0.61 -0.87 0.00 0.00 176.83 176.06 2ull h GLN 237 N 0.14 0.70 -0.43 4.77 4.15 -1.02 -3.17 115.11 120.24 2ull h GLN 237 Ca -0.02 -0.24 0.00 0.00 0.77 0.00 0.00 58.65 59.16 2ull h GLN 237 Cb 1.29 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.93 2ull h GLN 237 CO 0.11 0.81 0.00 0.66 -1.93 0.00 0.00 178.83 178.48 2ull n TYR 238 N -4.16 0.57 -3.19 3.99 4.01 -1.00 -4.97 117.16 112.41 2ull n TYR 238 Ca 0.01 -0.41 -0.21 0.00 -0.16 0.00 0.00 57.90 57.13 2ull n TYR 238 Cb 0.37 -0.01 0.05 0.00 -0.31 0.00 0.00 39.34 39.44 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 1.00 -0.38 3.89 2.72 0.00 -0.43 -5.00 105.19 107.00 2ull n GLY 239 Ca 0.16 0.09 -0.32 0.00 0.00 0.00 0.00 46.02 45.94 2ull n GLY 239 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ull s LEU 240 N -6.27 4.28 -0.06 0.99 1.43 0.44 -4.68 118.68 114.81 2ull s LEU 240 Ca 0.39 0.66 0.05 0.00 -1.03 0.00 0.00 54.13 54.19 2ull s LEU 240 Cb -0.17 -3.25 -0.00 0.00 0.03 0.00 0.00 46.19 42.80 2ull s LEU 240 CO 0.48 0.08 -0.22 -0.44 0.23 0.00 0.00 176.35 176.48 2ull s SER 241 N -2.25 2.73 0.33 2.29 0.01 -0.31 -4.68 113.70 111.82 2ull s SER 241 Ca 0.39 -0.46 -0.28 0.00 1.31 0.00 0.00 55.95 56.91 2ull s SER 241 Cb -0.12 -0.91 -0.10 0.00 0.21 0.00 0.00 66.02 65.10 2ull s SER 241 CO 0.23 0.18 1.21 -0.22 0.41 0.00 0.00 173.24 175.04 2ull s LEU 242 N 0.07 4.42 -0.23 2.44 2.96 -1.26 -0.56 118.68 126.52 2ull s LEU 242 Ca -0.08 2.47 -0.23 0.00 -0.22 0.00 0.00 54.13 56.07 2ull s LEU 242 Cb -0.14 -3.73 -0.01 0.00 0.50 0.00 0.00 46.19 42.81 2ull s LEU 242 CO 0.05 -0.43 0.76 -0.69 -1.32 0.00 0.00 176.35 174.71 2ull s VAL 243 N -1.21 4.90 0.43 1.68 1.01 -0.78 -4.86 120.40 121.57 2ull s VAL 243 Ca 0.49 1.44 0.04 0.00 0.00 0.00 0.00 61.98 63.95 2ull s VAL 243 Cb -0.35 -4.06 -0.05 0.00 0.00 0.00 0.00 36.38 31.92 2ull s VAL 243 CO 0.46 -0.01 0.02 0.42 0.00 0.00 0.00 175.10 175.99 2ull s THR 244 N 2.52 1.51 0.00 3.92 -4.23 -1.26 -4.33 115.64 113.77 2ull s THR 244 Ca 0.33 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.84 2ull s THR 244 Cb -0.16 -2.66 0.00 0.00 1.34 0.00 0.00 72.50 71.03 2ull s THR 244 CO 0.09 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.78