#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 6.51 -0.51 0.00 -0.87 -1.26 -1.00 114.94 117.80 2ull s ASN 15 Ca 0.00 0.61 -0.21 0.00 -1.57 0.00 0.00 52.86 51.69 2ull s ASN 15 Cb 0.00 -2.27 0.05 0.00 -0.02 0.00 0.00 41.25 39.01 2ull s ASN 15 CO 0.00 -0.14 0.74 -0.63 -2.57 0.00 0.00 177.10 174.50 2ull s ILE 16 N 1.49 4.70 -0.02 0.60 -1.09 0.40 -4.96 121.20 122.32 2ull s ILE 16 Ca 0.22 -0.16 0.05 0.00 -2.23 0.00 0.00 60.65 58.53 2ull s ILE 16 Cb -0.15 -4.37 -0.01 0.00 -1.58 0.00 0.00 42.46 36.34 2ull s ILE 16 CO 0.09 -0.89 -0.18 -0.69 -1.23 0.00 0.00 174.94 172.04 2ull s VAL 17 N 3.11 1.44 0.45 2.92 1.01 -1.26 -2.59 120.40 125.48 2ull s VAL 17 Ca 0.21 -0.76 -0.25 0.00 0.00 0.00 0.00 61.98 61.18 2ull s VAL 17 Cb -0.16 -1.21 -0.08 0.00 0.00 0.00 0.00 36.38 34.93 2ull s VAL 17 CO 0.15 0.41 1.43 -0.83 0.00 0.00 0.00 175.10 176.26 2ull s GLY 18 N -0.31 2.92 0.00 4.51 0.00 0.12 -2.97 107.32 111.59 2ull s GLY 18 Ca 0.04 1.46 0.00 0.00 0.00 0.00 0.00 44.72 46.23 2ull s GLY 18 CO 0.00 2.08 0.00 0.61 0.00 0.00 0.00 173.10 175.79 2ull n GLY 19 N 0.58 2.88 3.81 0.20 0.00 0.54 -0.73 105.19 112.47 2ull n GLY 19 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.27 4.00 0.41 -0.61 -4.36 -1.16 -2.58 121.20 114.62 2ull s ILE 31 Ca 0.00 0.89 -0.24 0.00 -0.26 0.00 0.00 60.65 61.04 2ull s ILE 31 Cb 0.00 -3.46 -0.09 0.00 1.25 0.00 0.00 42.46 40.16 2ull s ILE 31 CO 0.00 -0.62 1.06 -0.70 0.24 0.00 0.00 174.94 174.92 2ull s GLU 32 N -4.27 4.12 -0.08 0.37 2.12 -1.26 -0.78 118.70 118.91 2ull s GLU 32 Ca 0.62 1.53 -0.19 0.00 0.36 0.00 0.00 54.97 57.28 2ull s GLU 32 Cb -0.14 -2.51 0.04 0.00 0.26 0.00 0.00 34.13 31.78 2ull s GLU 32 CO 0.40 -0.19 0.45 1.52 -0.54 0.00 0.00 175.26 176.90 2ull s TYR 33 N -1.66 -0.41 0.26 5.30 1.13 -0.73 -4.79 117.35 116.45 2ull s TYR 33 Ca 0.59 0.81 0.07 0.00 -1.41 0.00 0.00 57.07 57.12 2ull s TYR 33 Cb -0.22 0.19 -0.03 0.00 -1.10 0.00 0.00 41.96 40.80 2ull s TYR 33 CO 0.28 -0.39 0.26 -1.54 -2.51 0.00 0.00 175.55 171.65 2ull s SER 34 N -0.75 5.74 -0.17 -0.18 1.04 -0.33 -1.43 113.70 117.62 2ull s SER 34 Ca -0.08 -0.18 0.01 0.00 0.48 0.00 0.00 55.95 56.17 2ull s SER 34 Cb -0.03 -1.48 0.02 0.00 0.10 0.00 0.00 66.02 64.63 2ull s SER 34 CO 0.04 -0.09 -0.16 -0.63 0.98 0.00 0.00 173.24 173.38 2ull s ILE 35 N -2.11 1.76 -1.58 -1.02 1.09 -0.16 -1.55 121.20 117.63 2ull s ILE 35 Ca 0.34 -0.80 -0.14 0.00 -1.10 0.00 0.00 60.65 58.95 2ull s ILE 35 Cb -0.08 -1.66 0.10 0.00 -1.06 0.00 0.00 42.46 39.77 2ull s ILE 35 CO 0.26 0.44 0.82 0.59 -0.10 0.00 0.00 174.94 176.96 2ull n ASN 36 N 4.70 -3.48 -2.03 3.58 3.02 0.24 -1.04 115.26 120.26 2ull n ASN 36 Ca -0.18 -0.90 -0.17 0.00 -0.03 0.00 0.00 54.58 53.30 2ull n ASN 36 Cb 0.49 -3.33 -0.03 0.00 -0.61 0.00 0.00 39.78 36.30 2ull n ASN 36 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2ull n ASN 38 N -2.79 -4.74 0.00 6.41 3.02 -1.26 -4.84 115.26 111.06 2ull n ASN 38 Ca -0.00 0.22 0.00 0.00 -0.03 0.00 0.00 54.58 54.77 2ull n ASN 38 Cb 0.54 -4.10 0.00 0.00 -0.61 0.00 0.00 39.78 35.61 2ull n ASN 38 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ull n ALA 39 N -0.84 0.72 -1.44 5.41 0.00 -0.20 -5.11 120.51 119.04 2ull n ALA 39 Ca -0.19 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 52.94 2ull n ALA 39 Cb 0.61 0.00 0.07 0.00 0.00 0.00 0.00 19.45 20.13 2ull n ALA 39 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2ull s SER 40 N 1.00 5.03 0.06 0.00 0.01 -1.21 -4.75 113.70 113.83 2ull s SER 40 Ca 0.00 1.71 0.07 0.00 1.31 0.00 0.00 55.95 59.04 2ull s SER 40 Cb 0.00 -2.51 -0.03 0.00 0.21 0.00 0.00 66.02 63.69 2ull s SER 40 CO 0.00 -1.68 -0.16 -0.76 0.41 0.00 0.00 173.24 171.05 2ull s LEU 41 N -5.67 2.73 0.35 2.44 1.43 -1.26 -0.99 118.68 117.71 2ull s LEU 41 Ca 0.59 -0.42 -0.00 0.00 -1.03 0.00 0.00 54.13 53.27 2ull s LEU 41 Cb -0.15 -1.59 -0.00 0.00 0.03 0.00 0.00 46.19 44.48 2ull s LEU 41 CO 0.55 0.24 0.45 0.00 0.23 0.00 0.00 176.35 177.81 2ull s SER 43 N -3.28 3.47 0.29 0.00 0.01 0.19 -1.77 113.70 112.61 2ull s SER 43 Ca 0.32 -0.60 -0.29 0.00 1.31 0.00 0.00 55.95 56.70 2ull s SER 43 Cb -0.00 -0.38 -0.10 0.00 0.21 0.00 0.00 66.02 65.75 2ull s SER 43 CO 0.22 0.22 1.22 -0.69 0.41 0.00 0.00 173.24 174.63 2ull s VAL 44 N -0.96 3.11 0.00 3.43 1.01 0.04 -2.76 120.40 124.28 2ull s VAL 44 Ca 0.14 1.08 0.00 0.00 0.00 0.00 0.00 61.98 63.20 2ull s VAL 44 Cb -0.10 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.59 2ull s VAL 44 CO 0.05 0.24 0.00 0.61 0.00 0.00 0.00 175.10 176.00 2ull n GLY 44 N 1.21 1.09 3.15 4.51 0.00 -0.04 -0.34 105.19 114.77 2ull n GLY 44 Ca 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 2ull n GLY 44 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ull s PHE 45 N 0.00 -0.15 0.19 1.61 0.08 -1.15 -4.03 117.98 114.53 2ull s PHE 45 Ca 0.00 0.30 -0.30 0.00 0.12 0.00 0.00 56.93 57.05 2ull s PHE 45 Cb 0.00 0.05 -0.09 0.00 -0.57 0.00 0.00 43.02 42.41 2ull s PHE 45 CO 0.00 -0.25 1.29 -1.12 -0.10 0.00 0.00 175.22 175.04 2ull s SER 46 N -0.75 6.93 0.17 1.36 0.01 -1.26 -1.30 113.70 118.86 2ull s SER 46 Ca -0.08 2.37 -0.08 0.00 1.31 0.00 0.00 55.95 59.47 2ull s SER 46 Cb -0.05 -2.61 -0.01 0.00 0.21 0.00 0.00 66.02 63.56 2ull s SER 46 CO 0.02 -0.50 0.25 0.68 0.41 0.00 0.00 173.24 174.10 2ull s VAL 47 N 0.10 0.06 0.10 3.43 -7.23 -0.10 -1.96 120.40 114.80 2ull s VAL 47 Ca 0.56 -1.51 0.06 0.00 -1.81 0.00 0.00 61.98 59.28 2ull s VAL 47 Cb -0.36 -1.94 -0.03 0.00 0.56 0.00 0.00 36.38 34.61 2ull s VAL 47 CO 0.38 -0.28 -0.15 0.42 -0.31 0.00 0.00 175.10 175.16 2ull s THR 48 N -4.00 1.25 -0.45 5.32 -4.23 -0.47 -1.07 115.64 111.99 2ull s THR 48 Ca 0.20 -1.51 0.02 0.00 -1.18 0.00 0.00 61.69 59.23 2ull s THR 48 Cb 0.04 -1.31 0.14 0.00 1.34 0.00 0.00 72.50 72.71 2ull s THR 48 CO 0.02 -0.30 0.26 -0.60 -0.54 0.00 0.00 174.62 173.46 2ull s ARG 48 N -2.17 1.33 6.60 3.99 3.52 -0.16 -1.08 118.95 130.97 2ull s ARG 48 Ca 0.03 -2.09 0.00 0.00 -0.13 0.00 0.00 55.73 53.54 2ull s ARG 48 Cb -0.08 -2.32 0.00 0.00 -1.56 0.00 0.00 34.95 30.99 2ull s ARG 48 CO 0.03 -1.19 0.00 0.41 -0.81 0.00 0.00 175.30 173.74 2ull n GLY 48 N 3.39 1.95 0.00 8.12 0.00 -1.26 -1.94 105.19 115.45 2ull n GLY 48 Ca 0.11 -0.44 0.13 0.00 0.00 0.00 0.00 46.02 45.81 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 10.49 2.22 -1.80 4.61 0.00 -1.26 -4.82 120.51 129.94 2ull n ALA 48 Ca 0.00 -0.09 -0.39 0.00 0.00 0.00 0.00 53.44 52.96 2ull n ALA 48 Cb 0.00 -1.43 -0.06 0.00 0.00 0.00 0.00 19.45 17.96 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 -3.01 4.16 0.14 0.00 2.01 -0.82 -5.05 115.64 113.07 2ull s THR 49 Ca 0.13 1.95 0.03 0.00 0.31 0.00 0.00 61.69 64.10 2ull s THR 49 Cb 0.17 -4.22 -0.04 0.00 0.01 0.00 0.00 72.50 68.42 2ull s THR 49 CO 0.49 0.42 0.24 -0.54 -0.69 0.00 0.00 174.62 174.54 2ull s LYS 50 N -1.38 3.33 0.00 4.92 1.02 -1.26 -0.99 119.74 125.38 2ull s LYS 50 Ca 0.42 -0.62 -0.22 0.00 0.02 0.00 0.00 55.97 55.57 2ull s LYS 50 Cb -0.24 -2.92 0.07 0.00 -0.52 0.00 0.00 37.83 34.23 2ull s LYS 50 CO 0.29 0.53 1.00 0.41 -0.92 0.00 0.00 175.35 176.67 2ull n GLY 51 N -0.35 0.36 3.01 -3.33 0.00 -0.23 -0.82 105.19 103.83 2ull n GLY 51 Ca -0.07 -1.02 -0.12 0.00 0.00 0.00 0.00 46.02 44.81 2ull n GLY 51 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2ull s PHE 52 N -2.31 -0.08 0.36 1.61 -0.12 -0.74 -0.92 117.98 115.77 2ull s PHE 52 Ca 0.23 0.20 -0.12 0.00 -0.05 0.00 0.00 56.93 57.19 2ull s PHE 52 Cb -0.01 0.02 -0.08 0.00 -0.63 0.00 0.00 43.02 42.32 2ull s PHE 52 CO 0.00 -0.11 0.74 0.14 -0.05 0.00 0.00 175.22 175.94 2ull s VAL 53 N -0.26 4.75 0.05 -2.49 -7.23 -0.42 -0.62 120.40 114.18 2ull s VAL 53 Ca -0.03 0.75 -0.02 0.00 -1.81 0.00 0.00 61.98 60.87 2ull s VAL 53 Cb -0.02 -3.67 0.01 0.00 0.56 0.00 0.00 36.38 33.25 2ull s VAL 53 CO 0.00 -0.34 0.10 1.07 -0.31 0.00 0.00 175.10 175.62 2ull n THR 54 N -0.81 0.00 -2.89 5.32 5.66 -0.12 -0.86 114.28 120.57 2ull n THR 54 Ca 0.03 -0.12 -0.36 0.00 -3.05 0.00 0.00 64.05 60.54 2ull n THR 54 Cb 0.53 0.13 -0.06 0.00 -1.55 0.00 0.00 70.33 69.38 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 -1.14 3.27 0.32 1.79 0.00 -1.26 -1.67 121.76 123.07 2ull s ALA 55 Ca 0.02 0.39 0.06 0.00 0.00 0.00 0.00 51.96 52.43 2ull s ALA 55 Cb -0.01 -3.05 0.56 0.00 0.00 0.00 0.00 23.12 20.62 2ull s ALA 55 CO 0.01 0.23 1.79 0.78 0.00 0.00 0.00 175.76 178.57 2ull h GLY 56 N 3.19 0.36 2.00 0.00 0.00 -1.58 -2.70 103.07 104.33 2ull h GLY 56 Ca -0.47 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 46.59 2ull h GLY 56 CO 0.65 0.25 0.00 -2.39 0.00 0.00 0.00 176.54 175.05 2ull n HIS 57 N -4.15 0.20 0.18 5.60 1.44 -1.26 -3.15 115.22 114.07 2ull n HIS 57 Ca -0.01 0.08 0.03 0.00 -2.01 0.00 0.00 57.72 55.81 2ull n HIS 57 Cb 0.37 -0.62 0.34 0.00 0.12 0.00 0.00 29.99 30.20 2ull n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2ull n GLY 59 N -0.16 2.75 3.31 0.00 0.00 -1.19 -4.83 105.19 105.07 2ull n GLY 59 Ca -0.01 -1.23 -0.16 0.00 0.00 0.00 0.00 46.02 44.61 2ull n GLY 59 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ull s THR 59 N -2.64 0.94 -0.51 2.61 -4.23 -1.26 -4.99 115.64 105.57 2ull s THR 59 Ca 0.00 -2.02 -0.35 0.00 -1.18 0.00 0.00 61.69 58.14 2ull s THR 59 Cb 0.00 -2.30 -0.14 0.00 1.34 0.00 0.00 72.50 71.40 2ull s THR 59 CO 0.00 -0.35 2.30 0.52 -0.54 0.00 0.00 174.62 176.55 2ull n VAL 59 N -0.38 0.09 -2.05 2.29 0.31 -1.26 -1.12 118.33 116.21 2ull n VAL 59 Ca -0.05 -0.24 -0.07 0.00 -0.01 0.00 0.00 64.34 63.96 2ull n VAL 59 Cb 0.64 -1.40 -0.01 0.00 -0.91 0.00 0.00 33.84 32.16 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 10.38 -2.86 -4.79 4.52 4.13 0.23 -4.95 115.26 121.92 2ull n ASN 60 Ca 0.48 0.01 -0.35 0.00 1.68 0.00 0.00 54.58 56.39 2ull n ASN 60 Cb 0.19 -2.07 -0.03 0.00 -1.54 0.00 0.00 39.78 36.33 2ull n ASN 60 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2ull s ALA 61 N -2.36 2.98 0.01 5.41 0.00 -0.27 -4.55 121.76 122.97 2ull s ALA 61 Ca 0.00 0.68 -0.29 0.00 0.00 0.00 0.00 51.96 52.36 2ull s ALA 61 Cb 0.00 -3.27 -0.04 0.00 0.00 0.00 0.00 23.12 19.81 2ull s ALA 61 CO 0.00 -0.30 0.92 0.99 0.00 0.00 0.00 175.76 177.37 2ull s THR 62 N -1.78 4.85 -0.10 0.00 2.01 -1.26 -1.21 115.64 118.14 2ull s THR 62 Ca 0.63 1.94 -0.03 0.00 0.31 0.00 0.00 61.69 64.54 2ull s THR 62 Cb -0.20 -4.27 -0.03 0.00 0.01 0.00 0.00 72.50 68.01 2ull s THR 62 CO 0.25 0.20 0.03 0.00 -0.69 0.00 0.00 174.62 174.41 2ull s ALA 64 N 0.80 3.40 0.01 7.40 0.00 0.04 -0.59 121.76 132.82 2ull s ALA 64 Ca 0.48 -0.77 0.05 0.00 0.00 0.00 0.00 51.96 51.72 2ull s ALA 64 Cb -0.21 -1.59 -0.02 0.00 0.00 0.00 0.00 23.12 21.30 2ull s ALA 64 CO 0.26 0.57 -0.15 1.03 0.00 0.00 0.00 175.76 177.48 2ull s ARG 65 N -0.85 1.08 -0.05 0.00 0.52 -0.60 -1.55 118.95 117.51 2ull s ARG 65 Ca 0.13 -0.64 0.01 0.00 -0.52 0.00 0.00 55.73 54.71 2ull s ARG 65 Cb -0.12 -1.08 0.02 0.00 0.52 0.00 0.00 34.95 34.30 2ull s ARG 65 CO 0.03 0.28 -0.05 0.42 0.02 0.00 0.00 175.30 176.00 2ull s ILE 66 N -0.57 0.62 -1.38 1.52 1.01 -0.44 -1.19 121.20 120.78 2ull s ILE 66 Ca 0.04 -0.16 0.00 0.00 0.00 0.00 0.00 60.65 60.53 2ull s ILE 66 Cb -0.07 -0.64 0.00 0.00 0.01 0.00 0.00 42.46 41.76 2ull s ILE 66 CO 0.00 0.25 0.00 0.61 0.00 0.00 0.00 174.94 175.80 2ull n GLY 67 N 4.13 0.56 3.08 6.18 0.00 -1.26 -1.92 105.19 115.96 2ull n GLY 67 Ca -0.23 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.49 2ull n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ull n GLY 81 N -1.10 0.84 3.70 -0.02 0.00 -1.26 -5.02 105.19 102.34 2ull n GLY 81 Ca -0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.55 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 -3.51 3.34 0.20 4.61 0.00 -0.81 -5.05 121.76 120.54 2ull s ALA 82 Ca 0.00 -1.04 -0.30 0.00 0.00 0.00 0.00 51.96 50.62 2ull s ALA 82 Cb 0.00 -1.29 -0.09 0.00 0.00 0.00 0.00 23.12 21.75 2ull s ALA 82 CO 0.00 0.69 1.30 0.08 0.00 0.00 0.00 175.76 177.83 2ull s VAL 83 N -1.25 3.24 0.00 0.00 1.01 -1.26 -1.32 120.40 120.82 2ull s VAL 83 Ca 0.24 1.03 0.00 0.00 0.00 0.00 0.00 61.98 63.25 2ull s VAL 83 Cb -0.12 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.61 2ull s VAL 83 CO 0.16 0.16 0.00 1.33 0.00 0.00 0.00 175.10 176.75 2ull n VAL 84 N 2.59 0.00 -2.97 2.92 0.24 -0.59 -4.90 118.33 115.61 2ull n VAL 84 Ca 0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.36 2ull n VAL 84 Cb 0.43 -0.97 0.00 0.00 -1.47 0.00 0.00 33.84 31.83 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 2.94 -1.26 3.23 7.63 0.00 -1.23 -1.68 105.19 114.82 2ull n GLY 85 Ca 0.00 -0.86 -0.13 0.00 0.00 0.00 0.00 46.02 45.02 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 -2.95 1.05 -0.50 2.61 -4.23 -0.63 -0.78 115.64 110.21 2ull s THR 87 Ca 0.00 -2.01 -0.27 0.00 -1.18 0.00 0.00 61.69 58.23 2ull s THR 87 Cb 0.00 -1.78 -0.01 0.00 1.34 0.00 0.00 72.50 72.05 2ull s THR 87 CO 0.00 -0.76 1.75 -0.36 -0.54 0.00 0.00 174.62 174.70 2ull s PHE 88 N -3.34 1.85 0.22 3.99 0.40 -0.35 -0.12 117.98 120.63 2ull s PHE 88 Ca 0.15 0.69 0.16 0.00 -0.60 0.00 0.00 56.93 57.33 2ull s PHE 88 Cb 0.03 -4.16 0.61 0.00 0.51 0.00 0.00 43.02 40.01 2ull s PHE 88 CO -0.01 -2.44 1.71 0.00 0.70 0.00 0.00 175.22 175.19 2ull h ALA 88 N 13.46 1.03 -2.00 5.36 0.00 -1.45 0.67 119.26 136.32 2ull h ALA 88 Ca -0.29 -0.40 0.17 0.00 0.00 0.00 0.00 54.91 54.40 2ull h ALA 88 Cb 1.15 -0.07 -0.15 0.00 0.00 0.00 0.00 17.79 18.72 2ull h ALA 88 CO 1.14 0.55 0.61 0.00 0.00 0.00 0.00 179.25 181.55 2ull s ALA 89 N -3.67 -1.91 -0.01 0.00 0.00 -1.21 -4.83 121.76 110.14 2ull s ALA 89 Ca -0.01 1.08 -0.28 0.00 0.00 0.00 0.00 51.96 52.75 2ull s ALA 89 Cb 0.12 0.28 0.10 0.00 0.00 0.00 0.00 23.12 23.62 2ull s ALA 89 CO 0.71 -0.72 0.85 -0.98 0.00 0.00 0.00 175.76 175.62 2ull s ARG 90 N -2.89 0.86 -0.22 0.00 1.04 -1.26 -2.37 118.95 114.12 2ull s ARG 90 Ca 0.08 -0.23 -0.04 0.00 -1.04 0.00 0.00 55.73 54.49 2ull s ARG 90 Cb -0.01 0.40 0.08 0.00 -2.04 0.00 0.00 34.95 33.38 2ull s ARG 90 CO -0.06 -0.36 0.13 0.08 -0.04 0.00 0.00 175.30 175.05 2ull s VAL 91 N -2.81 -0.13 -0.28 4.99 1.01 -0.09 -4.98 120.40 118.10 2ull s VAL 91 Ca 0.03 -0.35 -0.15 0.00 0.00 0.00 0.00 61.98 61.50 2ull s VAL 91 Cb -0.01 -0.73 0.10 0.00 0.00 0.00 0.00 36.38 35.74 2ull s VAL 91 CO -0.07 -0.42 0.73 0.12 0.00 0.00 0.00 175.10 175.47 2ull s PHE 94 N 2.16 -1.02 0.00 5.22 5.36 -1.26 -1.78 117.98 126.67 2ull s PHE 94 Ca 0.05 2.00 0.00 0.00 -0.96 0.00 0.00 56.93 58.02 2ull s PHE 94 Cb -0.16 0.61 0.00 0.00 -0.34 0.00 0.00 43.02 43.13 2ull s PHE 94 CO -0.19 -0.50 0.00 -0.35 -1.46 0.00 0.00 175.22 172.72 2ull n PRO 95 N 4.34 2.38 0.00 10.12 -0.04 -1.26 -4.98 135.00 145.56 2ull n PRO 95 Ca -0.19 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.27 2ull n PRO 95 Cb 0.58 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.04 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 0.11 0.55 0.00 0.79 -4.76 105.19 108.95 2ull n GLY 100 Ca 0.00 -0.36 -0.01 0.00 0.00 0.00 0.00 46.02 45.65 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 3.79 1.67 -2.92 1.61 3.02 -1.26 -1.95 115.26 119.22 2ull n ASN 101 Ca 0.00 -1.06 -0.11 0.00 -0.03 0.00 0.00 54.58 53.38 2ull n ASN 101 Cb 0.00 0.01 -0.01 0.00 -0.61 0.00 0.00 39.78 39.16 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 -1.38 -2.53 -3.95 6.41 2.03 -1.09 -4.18 116.55 111.85 2ull n ASP 102 Ca -0.00 -2.84 -0.08 0.00 0.52 0.00 0.00 54.79 52.38 2ull n ASP 102 Cb 0.02 1.12 -0.09 0.00 -0.72 0.00 0.00 41.12 41.46 2ull n ASP 102 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ull s ARG 103 N 0.55 0.70 -0.10 -0.67 1.70 -0.73 -3.49 118.95 116.90 2ull s ARG 103 Ca 0.31 -0.98 -0.32 0.00 -0.47 0.00 0.00 55.73 54.27 2ull s ARG 103 Cb 0.05 0.27 0.12 0.00 -0.57 0.00 0.00 34.95 34.82 2ull s ARG 103 CO -0.12 -0.18 1.04 0.00 -1.08 0.00 0.00 175.30 174.96 2ull s ALA 104 N -3.52 -1.94 -0.01 7.88 0.00 -0.67 -0.91 121.76 122.58 2ull s ALA 104 Ca 0.03 1.31 0.01 0.00 0.00 0.00 0.00 51.96 53.31 2ull s ALA 104 Cb 0.04 0.11 0.01 0.00 0.00 0.00 0.00 23.12 23.28 2ull s ALA 104 CO -0.09 -0.63 -0.02 1.67 0.00 0.00 0.00 175.76 176.69 2ull s TRP 105 N -2.71 0.29 -0.25 0.00 1.48 -1.00 -0.94 118.94 115.81 2ull s TRP 105 Ca 0.07 -0.04 -0.13 0.00 -1.06 0.00 0.00 56.10 54.94 2ull s TRP 105 Cb -0.01 -0.26 -0.04 0.00 -1.16 0.00 0.00 33.47 31.99 2ull s TRP 105 CO -0.07 -0.05 0.27 0.08 -4.06 0.00 0.00 176.95 173.12 2ull s VAL 106 N 0.32 5.27 -0.35 -0.66 1.01 0.20 -1.11 120.40 125.09 2ull s VAL 106 Ca -0.03 0.38 -0.25 0.00 0.00 0.00 0.00 61.98 62.08 2ull s VAL 106 Cb -0.06 -3.60 0.01 0.00 0.00 0.00 0.00 36.38 32.73 2ull s VAL 106 CO -0.01 0.25 0.88 -0.55 0.00 0.00 0.00 175.10 175.68 2ull s SER 107 N 1.40 6.68 0.29 3.32 0.15 0.83 -1.79 113.70 124.60 2ull s SER 107 Ca 0.12 0.62 -0.02 0.00 0.70 0.00 0.00 55.95 57.36 2ull s SER 107 Cb -0.15 -2.45 -0.04 0.00 -1.71 0.00 0.00 66.02 61.67 2ull s SER 107 CO 0.08 -0.78 0.52 -0.76 1.20 0.00 0.00 173.24 173.51 2ull s LEU 108 N 3.30 4.07 0.77 3.45 1.43 0.00 -1.61 118.68 130.09 2ull s LEU 108 Ca 0.36 0.57 -0.11 0.00 -1.03 0.00 0.00 54.13 53.92 2ull s LEU 108 Cb -0.13 -3.39 0.06 0.00 0.03 0.00 0.00 46.19 42.76 2ull s LEU 108 CO 0.16 -0.20 1.14 0.42 0.23 0.00 0.00 176.35 178.10 2ull s THR 109 N -2.13 2.52 0.12 5.49 -4.23 -0.67 -4.24 115.64 112.50 2ull s THR 109 Ca 0.42 0.13 0.33 0.00 -1.18 0.00 0.00 61.69 61.38 2ull s THR 109 Cb -0.10 -3.16 0.34 0.00 1.34 0.00 0.00 72.50 70.92 2ull s THR 109 CO 0.32 -0.20 1.99 0.77 -0.54 0.00 0.00 174.62 176.96 2ull h SER 110 N -0.88 0.00 0.67 3.99 4.64 -1.96 -2.97 113.55 117.03 2ull h SER 110 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2ull h SER 110 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 2ull h SER 110 CO 0.65 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.61 2ull h ALA 111 N 2.04 1.00 -2.31 5.18 0.00 -1.94 -3.44 119.26 119.80 2ull h ALA 111 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.42 2ull h ALA 111 Cb 0.17 0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.96 2ull h ALA 111 CO 0.00 0.00 0.14 -0.65 0.00 0.00 0.00 179.25 178.74 2ull s GLN 112 N -3.59 3.79 -0.30 0.00 -1.52 -1.13 -4.27 119.66 112.65 2ull s GLN 112 Ca 0.01 0.51 -0.05 0.00 -1.95 0.00 0.00 55.36 53.88 2ull s GLN 112 Cb 0.09 -2.37 0.03 0.00 -0.22 0.00 0.00 33.01 30.54 2ull s GLN 112 CO 0.43 -0.06 0.04 0.99 -0.25 0.00 0.00 175.29 176.44 2ull s THR 113 N -2.39 3.49 0.25 -0.19 2.01 -0.17 -4.93 115.64 113.71 2ull s THR 113 Ca 0.52 -1.00 -0.30 0.00 0.31 0.00 0.00 61.69 61.22 2ull s THR 113 Cb -0.10 -2.87 -0.09 0.00 0.01 0.00 0.00 72.50 69.44 2ull s THR 113 CO 0.31 0.01 0.99 -0.76 -0.69 0.00 0.00 174.62 174.48 2ull s LEU 114 N 1.39 4.62 0.02 4.42 1.43 -1.26 -0.45 118.68 128.85 2ull s LEU 114 Ca -0.00 2.04 0.01 0.00 -1.03 0.00 0.00 54.13 55.15 2ull s LEU 114 Cb -0.18 -3.62 -0.01 0.00 0.03 0.00 0.00 46.19 42.41 2ull s LEU 114 CO 0.00 0.07 -0.05 -0.76 0.23 0.00 0.00 176.35 175.84 2ull s LEU 119 N -1.27 2.13 -1.21 1.79 1.43 -1.07 -4.89 118.68 115.59 2ull s LEU 119 Ca 0.42 -0.29 -0.07 0.00 -1.03 0.00 0.00 54.13 53.16 2ull s LEU 119 Cb -0.28 -0.15 -0.01 0.00 0.03 0.00 0.00 46.19 45.79 2ull s LEU 119 CO 0.35 -0.09 2.78 -0.81 0.23 0.00 0.00 176.35 178.81 2ull n PRO 120 N 2.27 3.76 -4.17 1.29 -0.04 -1.26 -4.43 135.00 132.42 2ull n PRO 120 Ca -0.18 -2.61 -0.11 0.00 -0.04 0.00 0.00 63.50 60.56 2ull n PRO 120 Cb 0.57 -2.58 -0.10 0.00 -0.04 0.00 0.00 33.50 31.35 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 0.27 0.83 -0.03 0.54 0.52 -1.26 -1.00 118.95 118.81 2ull s ARG 120 Ca 0.62 -1.28 0.01 0.00 -0.52 0.00 0.00 55.73 54.55 2ull s ARG 120 Cb 0.22 -0.27 0.02 0.00 0.52 0.00 0.00 34.95 35.45 2ull s ARG 120 CO -0.09 0.00 -0.01 0.08 0.02 0.00 0.00 175.30 175.31 2ull s VAL 120 N -3.33 0.21 0.15 3.52 1.01 -0.38 -0.70 120.40 120.88 2ull s VAL 120 Ca 0.10 0.05 -0.31 0.00 0.00 0.00 0.00 61.98 61.83 2ull s VAL 120 Cb 0.03 -0.29 -0.08 0.00 0.00 0.00 0.00 36.38 36.04 2ull s VAL 120 CO -0.04 0.15 1.36 0.00 0.00 0.00 0.00 175.10 176.57 2ull s ALA 120 N 0.94 3.56 -0.36 5.51 0.00 0.09 -0.43 121.76 131.08 2ull s ALA 120 Ca -0.10 1.11 -0.00 0.00 0.00 0.00 0.00 51.96 52.97 2ull s ALA 120 Cb -0.13 -3.52 0.12 0.00 0.00 0.00 0.00 23.12 19.60 2ull s ALA 120 CO -0.01 -0.59 0.18 1.21 0.00 0.00 0.00 175.76 176.55 2ull s ASN 120 N 0.82 3.48 0.00 0.00 2.47 -1.26 -4.70 114.94 115.75 2ull s ASN 120 Ca 0.62 -2.04 0.00 0.00 0.42 0.00 0.00 52.86 51.86 2ull s ASN 120 Cb -0.37 -0.66 0.00 0.00 -1.45 0.00 0.00 41.25 38.77 2ull s ASN 120 CO 0.33 -0.34 0.00 0.61 -3.72 0.00 0.00 177.10 173.98 2ull n GLY 120 N 4.29 -0.08 1.15 1.21 0.00 -1.26 -4.18 105.19 106.31 2ull n GLY 120 Ca 0.05 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.24 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 0.59 0.00 -3.99 1.61 2.88 -1.26 -5.09 113.62 108.36 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 0.38 -0.14 0.66 0.08 -1.26 -4.57 117.98 113.13 2ull s PHE 120 Ca 0.00 -0.87 0.01 0.00 0.12 0.00 0.00 56.93 56.19 2ull s PHE 120 Cb 0.00 -0.25 -0.00 0.00 -0.57 0.00 0.00 43.02 42.20 2ull s PHE 120 CO 0.00 -0.46 -0.17 0.08 -0.10 0.00 0.00 175.22 174.57 2ull s VAL 120 N -3.90 2.54 0.08 -0.44 1.01 0.42 -4.84 120.40 115.27 2ull s VAL 120 Ca 0.07 -0.82 -0.30 0.00 0.00 0.00 0.00 61.98 60.93 2ull s VAL 120 Cb 0.07 -2.05 -0.05 0.00 0.00 0.00 0.00 36.38 34.34 2ull s VAL 120 CO -0.10 0.53 1.03 -0.89 0.00 0.00 0.00 175.10 175.67 2ull s THR 120 N 0.69 4.44 -0.35 3.92 2.01 -1.26 -1.24 115.64 123.84 2ull s THR 120 Ca -0.08 1.89 -0.28 0.00 0.31 0.00 0.00 61.69 63.53 2ull s THR 120 Cb -0.16 -4.21 0.02 0.00 0.01 0.00 0.00 72.50 68.16 2ull s THR 120 CO 0.02 0.23 1.01 -0.69 -0.69 0.00 0.00 174.62 174.49 2ull s VAL 121 N 0.47 4.52 -0.71 3.82 1.01 -0.17 -4.37 120.40 124.96 2ull s VAL 121 Ca 0.51 1.46 0.10 0.00 0.00 0.00 0.00 61.98 64.04 2ull s VAL 121 Cb -0.25 -4.39 -0.04 0.00 0.00 0.00 0.00 36.38 31.70 2ull s VAL 121 CO 0.30 -0.54 0.53 0.54 0.00 0.00 0.00 175.10 175.93 2ull n ARG 122 N 6.90 2.82 -3.52 2.72 1.74 0.34 -0.95 116.66 126.71 2ull n ARG 122 Ca 0.10 -0.36 0.00 0.00 -0.77 0.00 0.00 57.85 56.82 2ull n ARG 122 Cb 0.48 -1.02 0.00 0.00 -1.02 0.00 0.00 32.46 30.90 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 1.01 -1.00 1.15 -0.13 0.00 -1.19 -4.87 105.19 100.17 2ull n GLY 123 Ca 0.03 -0.96 0.04 0.00 0.00 0.00 0.00 46.02 45.13 2ull n GLY 123 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ull n SER 124 N 0.93 1.03 -4.68 1.61 3.41 -1.26 -0.81 113.62 113.85 2ull n SER 124 Ca 0.00 -2.37 -0.42 0.00 -0.26 0.00 0.00 58.87 55.82 2ull n SER 124 Cb 0.00 -0.33 -0.03 0.00 -0.26 0.00 0.00 64.21 63.59 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 -0.67 2.81 -0.05 6.66 2.01 -1.26 -4.81 115.64 120.34 2ull s THR 125 Ca 0.30 0.17 -0.30 0.00 0.31 0.00 0.00 61.69 62.17 2ull s THR 125 Cb 0.33 -3.11 -0.03 0.00 0.01 0.00 0.00 72.50 69.69 2ull s THR 125 CO -0.12 -0.00 1.20 -0.70 -0.69 0.00 0.00 174.62 174.30 2ull s GLU 129 N 3.19 4.36 0.37 4.92 2.12 -1.26 -4.72 118.70 127.68 2ull s GLU 129 Ca 0.81 1.68 -0.24 0.00 0.36 0.00 0.00 54.97 57.57 2ull s GLU 129 Cb -0.43 -3.54 -0.10 0.00 0.26 0.00 0.00 34.13 30.31 2ull s GLU 129 CO 0.36 -0.43 0.95 0.00 -0.54 0.00 0.00 175.26 175.60 2ull s ALA 130 N 2.11 3.14 0.64 6.30 0.00 -1.26 -5.06 121.76 127.63 2ull s ALA 130 Ca 0.56 0.48 -0.08 0.00 0.00 0.00 0.00 51.96 52.91 2ull s ALA 130 Cb -0.25 -3.17 0.01 0.00 0.00 0.00 0.00 23.12 19.71 2ull s ALA 130 CO 0.23 0.15 0.99 0.00 0.00 0.00 0.00 175.76 177.12 2ull s ALA 131 N -1.85 3.13 0.27 0.00 0.00 -1.26 -4.96 121.76 117.09 2ull s ALA 131 Ca 0.55 -0.57 -0.30 0.00 0.00 0.00 0.00 51.96 51.64 2ull s ALA 131 Cb -0.15 -2.77 -0.13 0.00 0.00 0.00 0.00 23.12 20.07 2ull s ALA 131 CO 0.19 -0.96 1.45 0.28 0.00 0.00 0.00 175.76 176.72 2ull n VAL 132 N -2.77 1.10 0.00 0.00 0.31 -1.26 -1.75 118.33 113.96 2ull n VAL 132 Ca 0.06 -0.28 0.00 0.00 -0.01 0.00 0.00 64.34 64.11 2ull n VAL 132 Cb 0.58 -1.64 0.00 0.00 -0.91 0.00 0.00 33.84 31.87 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 1.98 1.54 3.82 2.92 0.00 0.42 -4.99 105.19 110.87 2ull n GLY 133 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 2ull n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ull s ALA 134 N -2.37 2.96 0.51 4.61 0.00 -0.72 -4.71 121.76 122.04 2ull s ALA 134 Ca 0.00 0.38 -0.18 0.00 0.00 0.00 0.00 51.96 52.16 2ull s ALA 134 Cb 0.00 -3.18 -0.08 0.00 0.00 0.00 0.00 23.12 19.86 2ull s ALA 134 CO 0.00 -0.26 1.00 0.00 0.00 0.00 0.00 175.76 176.50 2ull s ALA 135 N -2.32 2.97 -0.27 0.00 0.00 -1.26 -1.08 121.76 119.80 2ull s ALA 135 Ca 0.63 0.33 -0.25 0.00 0.00 0.00 0.00 51.96 52.66 2ull s ALA 135 Cb -0.12 -3.17 0.10 0.00 0.00 0.00 0.00 23.12 19.93 2ull s ALA 135 CO 0.25 -0.27 0.91 0.54 0.00 0.00 0.00 175.76 177.19 2ull s VAL 136 N -2.40 0.00 0.41 0.00 0.11 -0.27 -4.76 120.40 113.49 2ull s VAL 136 Ca 0.62 0.00 0.07 0.00 -2.93 0.00 0.00 61.98 59.74 2ull s VAL 136 Cb -0.12 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.68 2ull s VAL 136 CO 0.27 0.00 0.19 0.00 -3.33 0.00 0.00 175.10 172.23 2ull s ARG 138 N -3.92 0.59 -0.03 0.00 1.70 0.64 -0.72 118.95 117.22 2ull s ARG 138 Ca 0.41 -0.93 0.02 0.00 -0.47 0.00 0.00 55.73 54.76 2ull s ARG 138 Cb 0.04 0.22 0.01 0.00 -0.57 0.00 0.00 34.95 34.64 2ull s ARG 138 CO 0.23 -0.14 -0.07 0.45 -1.08 0.00 0.00 175.30 174.69 2ull s SER 139 N -2.42 1.03 0.16 -2.89 0.15 0.51 -1.16 113.70 109.08 2ull s SER 139 Ca -0.01 -0.15 -0.24 0.00 0.70 0.00 0.00 55.95 56.25 2ull s SER 139 Cb 0.02 -0.32 0.06 0.00 -1.71 0.00 0.00 66.02 64.07 2ull s SER 139 CO -0.07 0.03 0.70 -0.83 1.20 0.00 0.00 173.24 174.27 2ull s GLY 140 N 0.34 -0.45 0.33 9.45 0.00 -0.60 -2.78 107.32 113.61 2ull s GLY 140 Ca -0.05 0.37 0.26 0.00 0.00 0.00 0.00 44.72 45.30 2ull s GLY 140 CO 0.00 0.12 1.78 0.07 0.00 0.00 0.00 173.10 175.07 2ull h ARG 141 N 2.00 0.00 0.00 2.90 -0.00 -1.69 -0.57 114.38 117.02 2ull h ARG 141 Ca -0.28 0.00 -0.01 0.00 -0.00 0.00 0.00 59.98 59.69 2ull h ARG 141 Cb 1.28 0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 31.25 2ull h ARG 141 CO 0.33 0.00 -0.73 2.41 -0.00 0.00 0.00 179.97 181.98 2ull n THR 142 N -2.46 1.45 0.47 0.08 -1.04 -1.26 -4.62 114.28 106.91 2ull n THR 142 Ca 0.02 0.18 0.12 0.00 -2.04 0.00 0.00 64.05 62.33 2ull n THR 142 Cb 0.27 -2.36 0.23 0.00 -1.82 0.00 0.00 70.33 66.64 2ull n THR 142 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 2ull n THR 143 N -4.55 0.43 -3.17 12.58 -2.24 -1.26 -5.03 114.28 111.05 2ull n THR 143 Ca -0.11 -0.68 0.00 0.00 -2.27 0.00 0.00 64.05 60.99 2ull n THR 143 Cb 0.37 0.95 0.00 0.00 -2.10 0.00 0.00 70.33 69.55 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 1.46 2.05 3.57 3.38 0.00 -0.22 -4.60 105.19 110.82 2ull n GLY 156 Ca 0.19 -0.51 -0.39 0.00 0.00 0.00 0.00 46.02 45.30 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 3.22 -0.00 1.61 5.04 -1.26 -1.56 117.35 124.40 2ull s TYR 157 Ca 0.00 0.08 0.04 0.00 -2.44 0.00 0.00 57.07 54.75 2ull s TYR 157 Cb 0.00 -2.50 -0.01 0.00 0.35 0.00 0.00 41.96 39.79 2ull s TYR 157 CO 0.00 -0.28 -0.13 -0.65 -1.34 0.00 0.00 175.55 173.15 2ull s GLN 158 N 1.87 1.05 0.28 4.97 -1.52 -0.31 -4.96 119.66 121.04 2ull s GLN 158 Ca 0.09 -0.51 0.11 0.00 -1.95 0.00 0.00 55.36 53.10 2ull s GLN 158 Cb -0.16 -1.02 -0.05 0.00 -0.22 0.00 0.00 33.01 31.56 2ull s GLN 158 CO 0.11 0.28 -0.10 0.00 -0.25 0.00 0.00 175.29 175.32 2ull n GLY 160 N -0.76 1.63 3.23 0.00 0.00 0.08 -4.31 105.19 105.06 2ull n GLY 160 Ca -0.05 -0.29 -0.13 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.93 0.76 -0.44 2.61 -4.23 -1.26 -1.11 115.64 111.03 2ull s THR 161 Ca 0.00 -1.98 -0.21 0.00 -1.18 0.00 0.00 61.69 58.32 2ull s THR 161 Cb 0.00 -1.99 0.03 0.00 1.34 0.00 0.00 72.50 71.88 2ull s THR 161 CO 0.00 -0.60 0.68 -0.63 -0.54 0.00 0.00 174.62 173.52 2ull s ILE 162 N -3.60 4.78 -0.19 2.99 1.01 -0.24 -0.77 121.20 125.18 2ull s ILE 162 Ca 0.20 0.17 0.21 0.00 0.00 0.00 0.00 60.65 61.23 2ull s ILE 162 Cb 0.05 -4.24 -0.06 0.00 0.01 0.00 0.00 42.46 38.23 2ull s ILE 162 CO 0.02 -0.63 0.95 0.35 0.00 0.00 0.00 174.94 175.62 2ull n THR 163 N 5.92 0.76 -3.63 2.92 -2.24 0.08 -0.44 114.28 117.65 2ull n THR 163 Ca -0.01 -0.59 -0.05 0.00 -2.27 0.00 0.00 64.05 61.13 2ull n THR 163 Cb 0.48 -0.44 -0.02 0.00 -2.10 0.00 0.00 70.33 68.25 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 -3.24 -1.79 0.25 6.98 0.00 -1.05 -4.92 121.76 117.99 2ull s ALA 164 Ca -0.02 0.60 0.03 0.00 0.00 0.00 0.00 51.96 52.58 2ull s ALA 164 Cb 0.09 0.49 -0.05 0.00 0.00 0.00 0.00 23.12 23.65 2ull s ALA 164 CO 0.80 -0.88 0.03 0.15 0.00 0.00 0.00 175.76 175.87 2ull s LYS 165 N -3.10 1.39 -1.49 0.00 1.02 -1.26 -0.56 119.74 115.74 2ull s LYS 165 Ca 0.09 -1.73 -0.07 0.00 0.02 0.00 0.00 55.97 54.29 2ull s LYS 165 Cb -0.01 -0.53 0.01 0.00 -0.52 0.00 0.00 37.83 36.78 2ull s LYS 165 CO -0.03 -0.17 0.83 -1.71 -0.92 0.00 0.00 175.35 173.35 2ull n ASN 166 N -0.46 -6.17 -4.82 2.83 4.05 -0.44 -4.93 115.26 105.32 2ull n ASN 166 Ca -0.03 -0.39 -0.34 0.00 0.45 0.00 0.00 54.58 54.26 2ull n ASN 166 Cb 0.65 -4.93 -0.06 0.00 1.23 0.00 0.00 39.78 36.66 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 -3.23 4.51 -0.05 3.44 1.01 0.52 -4.47 120.40 122.13 2ull s VAL 167 Ca 0.42 1.29 -0.03 0.00 0.00 0.00 0.00 61.98 63.66 2ull s VAL 167 Cb -0.19 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.44 2ull s VAL 167 CO 0.52 -0.10 0.11 -0.89 0.00 0.00 0.00 175.10 174.74 2ull s THR 168 N -1.89 5.02 -0.29 3.92 2.01 -1.26 -1.54 115.64 121.61 2ull s THR 168 Ca 0.53 -0.17 0.00 0.00 0.31 0.00 0.00 61.69 62.37 2ull s THR 168 Cb -0.12 -3.25 0.09 0.00 0.01 0.00 0.00 72.50 69.22 2ull s THR 168 CO 0.18 0.45 0.06 0.00 -0.69 0.00 0.00 174.62 174.62 2ull s ALA 169 N -1.13 1.78 -1.27 7.40 0.00 0.50 -4.98 121.76 124.07 2ull s ALA 169 Ca 0.20 -1.65 -0.15 0.00 0.00 0.00 0.00 51.96 50.36 2ull s ALA 169 Cb -0.12 -1.60 0.12 0.00 0.00 0.00 0.00 23.12 21.52 2ull s ALA 169 CO 0.11 -1.53 1.63 0.09 0.00 0.00 0.00 175.76 176.06 2ull n ASN 170 N 4.74 5.03 -4.77 0.00 3.02 -1.26 -0.28 115.26 121.73 2ull n ASN 170 Ca -0.04 -2.96 -0.29 0.00 -0.03 0.00 0.00 54.58 51.27 2ull n ASN 170 Cb 0.43 -1.64 0.12 0.00 -0.61 0.00 0.00 39.78 38.08 2ull n ASN 170 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2ull s TYR 171 N 2.67 2.57 0.42 3.10 2.02 -0.65 -4.90 117.35 122.57 2ull s TYR 171 Ca 0.47 1.04 0.16 0.00 -0.37 0.00 0.00 57.07 58.38 2ull s TYR 171 Cb 0.02 -3.24 1.04 0.00 -0.40 0.00 0.00 41.96 39.38 2ull s TYR 171 CO 0.03 -2.19 1.89 0.00 -1.57 0.00 0.00 175.55 173.71 2ull h ALA 173 N -1.38 2.12 0.00 3.71 0.00 -2.02 -1.45 119.26 120.24 2ull h ALA 173 Ca -0.49 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.40 2ull h ALA 173 Cb 1.30 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 2ull h ALA 173 CO 0.59 -0.37 -0.27 0.93 0.00 0.00 0.00 179.25 180.14 2ull h GLU 174 N 0.44 0.00 0.00 0.00 3.07 -1.99 -3.49 114.58 112.61 2ull h GLU 174 Ca 0.42 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.28 2ull h GLU 174 Cb 0.97 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.88 2ull h GLU 174 CO -0.15 0.11 0.00 0.41 -1.40 0.00 0.00 179.01 177.98 2ull n GLY 175 N 1.14 1.02 3.79 -3.84 0.00 -0.55 -4.86 105.19 101.90 2ull n GLY 175 Ca 0.03 -1.58 -0.34 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 -1.65 2.79 -0.26 4.61 0.00 -1.26 -1.64 121.76 124.34 2ull s ALA 176 Ca 0.00 0.67 -0.03 0.00 0.00 0.00 0.00 51.96 52.60 2ull s ALA 176 Cb 0.00 -3.29 0.08 0.00 0.00 0.00 0.00 23.12 19.91 2ull s ALA 176 CO 0.00 -0.54 0.09 0.08 0.00 0.00 0.00 175.76 175.39 2ull s VAL 177 N -1.95 0.37 0.29 0.00 1.01 0.61 -0.15 120.40 120.58 2ull s VAL 177 Ca 0.69 -0.83 0.06 0.00 0.00 0.00 0.00 61.98 61.91 2ull s VAL 177 Cb -0.19 -1.15 -0.02 0.00 0.00 0.00 0.00 36.38 35.02 2ull s VAL 177 CO 0.24 -0.52 0.37 -0.13 0.00 0.00 0.00 175.10 175.06 2ull s ARG 178 N 1.90 3.16 0.00 2.72 0.52 -0.82 -0.37 118.95 126.06 2ull s ARG 178 Ca 0.06 -0.96 0.00 0.00 -0.52 0.00 0.00 55.73 54.31 2ull s ARG 178 Cb -0.17 -2.76 0.00 0.00 0.52 0.00 0.00 34.95 32.54 2ull s ARG 178 CO -0.22 0.25 0.00 0.41 0.02 0.00 0.00 175.30 175.76 2ull n GLY 179 N -1.45 0.68 3.86 -3.53 0.00 -0.99 -4.74 105.19 99.02 2ull n GLY 179 Ca -0.05 -0.09 -0.31 0.00 0.00 0.00 0.00 46.02 45.57 2ull n GLY 179 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ull s LEU 180 N 0.00 3.15 -0.08 0.99 1.43 -0.59 -4.44 118.68 119.14 2ull s LEU 180 Ca 0.00 1.40 -0.01 0.00 -1.03 0.00 0.00 54.13 54.50 2ull s LEU 180 Cb 0.00 -4.38 -0.03 0.00 0.03 0.00 0.00 46.19 41.81 2ull s LEU 180 CO 0.00 -1.06 -0.03 -0.89 0.23 0.00 0.00 176.35 174.59 2ull s THR 181 N -3.18 4.02 -0.18 5.49 2.01 -0.30 -0.36 115.64 123.14 2ull s THR 181 Ca 0.56 -0.36 -0.04 0.00 0.31 0.00 0.00 61.69 62.17 2ull s THR 181 Cb -0.12 -2.67 -0.02 0.00 0.01 0.00 0.00 72.50 69.70 2ull s THR 181 CO 0.54 0.60 -0.04 -1.58 -0.69 0.00 0.00 174.62 173.45 2ull s GLN 182 N -0.80 3.54 0.41 4.92 0.74 0.28 -0.76 119.66 127.99 2ull s GLN 182 Ca 0.12 -0.57 0.07 0.00 0.05 0.00 0.00 55.36 55.03 2ull s GLN 182 Cb -0.11 -2.94 -0.07 0.00 1.10 0.00 0.00 33.01 30.98 2ull s GLN 182 CO 0.02 0.07 0.06 0.20 -0.55 0.00 0.00 175.29 175.09 2ull s GLY 183 N 0.81 2.46 -0.14 2.59 0.00 0.03 -0.74 107.32 112.33 2ull s GLY 183 Ca -0.01 -2.25 0.16 0.00 0.00 0.00 0.00 44.72 42.62 2ull s GLY 183 CO 0.02 -2.05 1.33 1.16 0.00 0.00 0.00 173.10 173.56 2ull n ASN 184 N -1.05 3.36 -4.79 1.64 0.23 0.05 -2.24 115.26 112.46 2ull n ASN 184 Ca -0.04 -2.89 -0.35 0.00 -0.53 0.00 0.00 54.58 50.76 2ull n ASN 184 Cb 0.66 -0.47 -0.03 0.00 -2.08 0.00 0.00 39.78 37.86 2ull n ASN 184 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2ull s ALA 185 N -2.59 2.96 0.66 -2.53 0.00 -1.26 -4.70 121.76 114.31 2ull s ALA 185 Ca 0.36 0.68 -0.09 0.00 0.00 0.00 0.00 51.96 52.92 2ull s ALA 185 Cb 0.29 -3.28 0.02 0.00 0.00 0.00 0.00 23.12 20.15 2ull s ALA 185 CO 0.08 -0.32 1.02 0.00 0.00 0.00 0.00 175.76 176.53 2ull s MET 190 N -5.21 1.33 0.33 0.00 0.23 -1.26 -4.78 119.30 109.94 2ull s MET 190 Ca 0.57 -0.70 -0.11 0.00 -1.03 0.00 0.00 55.69 54.41 2ull s MET 190 Cb -0.11 0.47 0.02 0.00 -1.53 0.00 0.00 34.83 33.69 2ull s MET 190 CO 0.48 -0.61 0.62 0.20 -2.03 0.00 0.00 175.02 173.69 2ull s GLY 191 N -2.88 0.73 -0.32 3.16 0.00 -1.26 -1.67 107.32 105.08 2ull s GLY 191 Ca 0.10 -0.99 -0.36 0.00 0.00 0.00 0.00 44.72 43.47 2ull s GLY 191 CO 0.01 -0.58 2.09 0.54 0.00 0.00 0.00 173.10 175.17 2ull n ARG 192 N -0.51 1.12 0.00 2.90 1.74 -0.89 -1.12 116.66 119.90 2ull n ARG 192 Ca -0.03 0.34 0.00 0.00 -0.77 0.00 0.00 57.85 57.38 2ull n ARG 192 Cb 0.61 -2.37 0.00 0.00 -1.02 0.00 0.00 32.46 29.68 2ull n ARG 192 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ull n GLY 193 N 6.07 1.71 0.17 -0.13 0.00 -1.26 -4.73 105.19 107.03 2ull n GLY 193 Ca 0.38 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.54 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 0.57 0.00 -1.75 1.61 3.32 -1.47 -3.26 116.42 115.44 2ull h ASP 194 Ca 0.00 0.00 -0.66 0.00 0.02 0.00 0.00 57.03 56.39 2ull h ASP 194 Cb 0.00 0.00 0.09 0.00 0.22 0.00 0.00 39.33 39.64 2ull h ASP 194 CO 0.00 0.00 0.09 -1.20 -1.72 0.00 0.00 179.24 176.41 2ull n SER 195 N -2.53 0.73 0.00 6.45 7.64 -1.26 -1.16 113.62 123.48 2ull n SER 195 Ca 0.03 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.05 2ull n SER 195 Cb 0.31 -1.15 0.00 0.00 -1.01 0.00 0.00 64.21 62.37 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 1.84 3.21 3.72 0.23 0.00 0.48 -0.63 105.19 114.04 2ull n GLY 196 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 2ull n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ull s GLY 197 N -1.93 1.84 0.35 -0.02 0.00 -0.31 -2.30 107.32 104.95 2ull s GLY 197 Ca 0.00 0.55 -0.28 0.00 0.00 0.00 0.00 44.72 44.99 2ull s GLY 197 CO 0.00 0.94 1.28 -0.56 0.00 0.00 0.00 173.10 174.76 2ull s SER 198 N -2.76 6.67 -0.17 1.64 0.01 -1.12 -0.65 113.70 117.32 2ull s SER 198 Ca 0.66 2.63 0.01 0.00 1.31 0.00 0.00 55.95 60.56 2ull s SER 198 Cb -0.22 -2.64 0.02 0.00 0.21 0.00 0.00 66.02 63.39 2ull s SER 198 CO 0.54 -0.60 -0.20 0.26 0.41 0.00 0.00 173.24 173.65 2ull s TRP 199 N -1.20 2.71 -0.01 2.43 0.52 -0.63 -0.36 118.94 122.41 2ull s TRP 199 Ca 0.51 -1.57 -0.12 0.00 0.02 0.00 0.00 56.10 54.95 2ull s TRP 199 Cb -0.38 -1.88 0.01 0.00 -1.15 0.00 0.00 33.47 30.08 2ull s TRP 199 CO 0.50 -0.77 0.24 -1.50 0.02 0.00 0.00 176.95 175.44 2ull s ILE 200 N 1.23 0.07 0.66 2.03 2.07 0.10 -0.33 121.20 127.03 2ull s ILE 200 Ca 0.03 -0.54 -0.10 0.00 -1.41 0.00 0.00 60.65 58.63 2ull s ILE 200 Cb -0.13 -0.53 0.01 0.00 0.13 0.00 0.00 42.46 41.93 2ull s ILE 200 CO -0.11 -0.30 1.03 0.42 -1.91 0.00 0.00 174.94 174.07 2ull s THR 201 N -1.29 3.65 -1.03 4.00 -4.23 -0.81 -0.80 115.64 115.12 2ull s THR 201 Ca -0.13 0.36 0.16 0.00 -1.18 0.00 0.00 61.69 60.90 2ull s THR 201 Cb -0.06 -3.50 0.15 0.00 1.34 0.00 0.00 72.50 70.42 2ull s THR 201 CO 0.03 -0.62 1.52 -1.54 -0.54 0.00 0.00 174.62 173.47 2ull n SER 201 N -2.85 0.00 -0.19 3.99 3.41 -1.26 -1.14 113.62 115.58 2ull n SER 201 Ca 0.06 0.47 0.13 0.00 -0.26 0.00 0.00 58.87 59.27 2ull n SER 201 Cb 0.57 -0.49 0.40 0.00 -0.26 0.00 0.00 64.21 64.44 2ull n SER 201 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ull n ALA 202 N -1.49 3.07 -0.37 7.33 0.00 -1.26 -4.96 120.51 122.84 2ull n ALA 202 Ca 0.04 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.11 2ull n ALA 202 Cb 0.19 -1.17 0.00 0.00 0.00 0.00 0.00 19.45 18.47 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 1.35 0.80 3.56 0.00 0.00 -0.29 -4.78 105.19 105.83 2ull n GLY 207 Ca 0.12 -0.16 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.67 3.63 0.10 1.61 -1.52 -1.26 -0.51 119.66 121.04 2ull s GLN 208 Ca 0.00 -0.05 -0.31 0.00 -1.95 0.00 0.00 55.36 53.05 2ull s GLN 208 Cb 0.00 -3.82 -0.09 0.00 -0.22 0.00 0.00 33.01 28.89 2ull s GLN 208 CO 0.00 -0.72 1.61 0.00 -0.25 0.00 0.00 175.29 175.94 2ull s ALA 209 N 2.59 3.71 -0.23 6.09 0.00 0.01 -1.93 121.76 132.00 2ull s ALA 209 Ca 0.22 1.25 0.02 0.00 0.00 0.00 0.00 51.96 53.45 2ull s ALA 209 Cb -0.15 -3.67 -0.15 0.00 0.00 0.00 0.00 23.12 19.15 2ull s ALA 209 CO 0.14 -0.99 -0.20 1.04 0.00 0.00 0.00 175.76 175.76 2ull n GLN 210 N 5.04 0.58 -3.52 0.00 1.13 0.55 -4.44 117.38 116.72 2ull n GLN 210 Ca 0.15 0.13 0.00 0.00 -1.94 0.00 0.00 57.00 55.34 2ull n GLN 210 Cb 0.40 -1.46 0.00 0.00 0.11 0.00 0.00 30.24 29.29 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 2.40 -0.95 3.30 1.08 0.00 -1.15 -1.50 105.19 108.37 2ull n GLY 211 Ca -0.41 -0.95 -0.28 0.00 0.00 0.00 0.00 46.02 44.38 2ull n GLY 211 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ull s VAL 212 N -3.00 1.93 -0.01 1.61 -7.23 -0.28 -1.60 120.40 111.82 2ull s VAL 212 Ca 0.00 -1.27 -0.32 0.00 -1.81 0.00 0.00 61.98 58.58 2ull s VAL 212 Cb 0.00 -1.66 -0.10 0.00 0.56 0.00 0.00 36.38 35.19 2ull s VAL 212 CO 0.00 0.33 1.95 0.80 -0.31 0.00 0.00 175.10 177.86 2ull n MET 213 N 1.89 2.62 -0.10 4.82 1.56 0.18 -0.69 117.12 127.39 2ull n MET 213 Ca -0.17 0.96 -0.16 0.00 -0.27 0.00 0.00 57.70 58.06 2ull n MET 213 Cb 0.52 -2.88 -0.05 0.00 2.15 0.00 0.00 33.22 32.96 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 7.25 1.89 -2.31 6.12 2.88 0.32 -0.38 113.62 129.39 2ull n SER 214 Ca 0.21 0.32 -0.01 0.00 -1.33 0.00 0.00 58.87 58.06 2ull n SER 214 Cb 0.37 -0.74 0.01 0.00 -0.75 0.00 0.00 64.21 63.10 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 1.48 0.79 3.65 0.46 0.00 -0.92 -4.89 105.19 105.75 2ull n GLY 215 Ca -0.28 -1.02 -0.01 0.00 0.00 0.00 0.00 46.02 44.72 2ull n GLY 215 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ull s GLY 216 N -2.87 -0.36 -1.28 -0.02 0.00 -1.26 -0.24 107.32 101.28 2ull s GLY 216 Ca 0.13 0.66 -0.18 0.00 0.00 0.00 0.00 44.72 45.33 2ull s GLY 216 CO 0.02 0.14 1.88 1.16 0.00 0.00 0.00 173.10 176.31 2ull n ASN 217 N -0.43 4.28 -4.71 1.64 6.94 -0.63 -4.93 115.26 117.42 2ull n ASN 217 Ca -0.07 -2.85 -0.42 0.00 -0.02 0.00 0.00 54.58 51.21 2ull n ASN 217 Cb 0.62 -1.69 -0.03 0.00 -2.36 0.00 0.00 39.78 36.32 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 5.14 2.89 0.67 3.53 -7.23 -1.26 -4.54 120.40 119.59 2ull s VAL 218 Ca 0.55 0.53 -0.10 0.00 -1.81 0.00 0.00 61.98 61.15 2ull s VAL 218 Cb 0.06 -3.34 0.15 0.00 0.56 0.00 0.00 36.38 33.81 2ull s VAL 218 CO 0.06 0.02 0.92 0.00 -0.31 0.00 0.00 175.10 175.79 2ull n GLN 219 N 4.64 -0.76 0.00 4.82 1.13 -0.31 -4.88 117.38 122.02 2ull n GLN 219 Ca 0.14 -1.57 0.07 0.00 -1.94 0.00 0.00 57.00 53.70 2ull n GLN 219 Cb 0.40 -0.90 0.47 0.00 0.11 0.00 0.00 30.24 30.32 2ull n GLN 219 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 2ull h SER 219 N -1.12 0.40 1.29 1.08 0.87 -1.95 -0.94 113.55 113.18 2ull h SER 219 Ca -0.30 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.26 2ull h SER 219 Cb 0.86 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.73 2ull h SER 219 CO 0.23 0.28 0.00 -0.46 -0.53 0.00 0.00 176.83 176.34 2ull n ASN 219 N -4.48 0.69 0.00 6.23 6.94 -1.26 -4.92 115.26 118.46 2ull n ASN 219 Ca 0.04 0.58 0.00 0.00 -0.02 0.00 0.00 54.58 55.19 2ull n ASN 219 Cb 0.15 -0.76 0.00 0.00 -2.36 0.00 0.00 39.78 36.81 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 1.09 1.44 2.54 4.83 0.00 -0.36 -5.03 105.19 109.72 2ull n GLY 219 Ca 0.05 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.35 -0.21 1.61 0.23 -1.26 -2.11 115.26 113.17 2ull n ASN 219 Ca 0.00 -2.73 0.09 0.00 -0.53 0.00 0.00 54.58 51.41 2ull n ASN 219 Cb 0.00 1.26 0.16 0.00 -2.08 0.00 0.00 39.78 39.12 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 -1.93 2.16 0.23 0.53 0.23 -0.67 -1.16 115.26 114.66 2ull n ASN 220 Ca 0.05 -3.29 0.13 0.00 -0.53 0.00 0.00 54.58 50.94 2ull n ASN 220 Cb 0.48 -0.45 0.33 0.00 -2.08 0.00 0.00 39.78 38.05 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 0.73 -1.55 3.64 0.00 0.00 -1.26 -4.83 105.19 101.92 2ull n GLY 221 Ca 0.03 -0.09 -0.26 0.00 0.00 0.00 0.00 46.02 45.70 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 -3.03 3.53 0.77 -0.61 -4.36 -1.21 -5.11 121.20 111.18 2ull s ILE 222 Ca 0.13 -1.59 -0.14 0.00 -0.26 0.00 0.00 60.65 58.78 2ull s ILE 222 Cb 0.17 -2.80 0.06 0.00 1.25 0.00 0.00 42.46 41.15 2ull s ILE 222 CO 0.56 -0.17 1.20 -2.84 0.24 0.00 0.00 174.94 173.93 2ull s PRO 222 N -3.09 1.88 0.49 0.37 0.02 -1.26 -4.87 135.00 128.53 2ull s PRO 222 Ca 0.28 1.74 0.22 0.00 0.02 0.00 0.00 61.00 63.26 2ull s PRO 222 Cb -0.08 -1.80 1.26 0.00 0.02 0.00 0.00 34.50 33.89 2ull s PRO 222 CO 0.18 -2.03 1.96 0.00 -0.33 0.00 0.00 177.00 176.78 2ull h ALA 222 N -0.63 2.37 0.00 -1.55 0.00 -1.91 -1.16 119.26 116.38 2ull h ALA 222 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2ull h ALA 222 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2ull h ALA 222 CO 0.48 -0.55 0.02 0.66 0.00 0.00 0.00 179.25 179.87 2ull h SER 222 N 0.17 0.00 -0.00 0.00 4.64 -1.90 -1.78 113.55 114.67 2ull h SER 222 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 2ull h SER 222 Cb 0.99 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 2ull h SER 222 CO -0.05 0.00 -0.53 0.00 -0.87 0.00 0.00 176.83 175.38 2ull n GLN 223 N -3.00 2.03 -2.72 4.77 6.02 -0.44 -5.00 117.38 119.04 2ull n GLN 223 Ca -0.03 -0.32 -0.42 0.00 -0.01 0.00 0.00 57.00 56.22 2ull n GLN 223 Cb 0.09 -1.21 -0.03 0.00 1.02 0.00 0.00 30.24 30.11 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 -2.15 4.53 -0.47 -1.09 0.52 -0.67 -5.00 118.95 114.62 2ull s ARG 224 Ca 0.08 1.39 0.04 0.00 -0.52 0.00 0.00 55.73 56.72 2ull s ARG 224 Cb 0.11 -3.48 0.12 0.00 0.52 0.00 0.00 34.95 32.23 2ull s ARG 224 CO 0.51 -0.10 0.21 0.45 0.02 0.00 0.00 175.30 176.39 2ull s SER 225 N 1.02 4.35 -0.20 0.23 0.15 -1.26 -4.59 113.70 113.40 2ull s SER 225 Ca 0.51 -2.79 -0.06 0.00 0.70 0.00 0.00 55.95 54.30 2ull s SER 225 Cb -0.20 -1.58 -0.03 0.00 -1.71 0.00 0.00 66.02 62.50 2ull s SER 225 CO 0.25 -0.27 0.03 -0.44 1.20 0.00 0.00 173.24 174.02 2ull s SER 226 N 0.03 5.18 -0.08 5.45 0.01 -0.95 -1.60 113.70 121.73 2ull s SER 226 Ca 0.16 -0.09 0.04 0.00 1.31 0.00 0.00 55.95 57.37 2ull s SER 226 Cb -0.24 -1.89 -0.01 0.00 0.21 0.00 0.00 66.02 64.09 2ull s SER 226 CO -0.02 0.10 -0.21 -0.76 0.41 0.00 0.00 173.24 172.76 2ull s LEU 227 N 0.82 2.30 0.08 2.44 1.43 0.66 -0.79 118.68 125.62 2ull s LEU 227 Ca 0.02 -0.44 0.08 0.00 -1.03 0.00 0.00 54.13 52.76 2ull s LEU 227 Cb -0.14 -1.46 -0.03 0.00 0.03 0.00 0.00 46.19 44.59 2ull s LEU 227 CO 0.02 0.22 -0.20 0.72 0.23 0.00 0.00 176.35 177.34 2ull s PHE 228 N -0.02 1.74 -0.16 0.29 -0.12 0.06 -0.52 117.98 119.25 2ull s PHE 228 Ca -0.07 -0.41 -0.25 0.00 -0.05 0.00 0.00 56.93 56.16 2ull s PHE 228 Cb -0.15 -0.98 -0.02 0.00 -0.63 0.00 0.00 43.02 41.25 2ull s PHE 228 CO 0.05 0.16 0.82 -2.00 -0.05 0.00 0.00 175.22 174.20 2ull s GLU 229 N -1.70 4.31 0.30 1.99 2.56 0.13 -1.14 118.70 125.14 2ull s GLU 229 Ca 0.06 1.00 -0.29 0.00 0.00 0.00 0.00 54.97 55.74 2ull s GLU 229 Cb -0.10 -3.56 -0.13 0.00 2.00 0.00 0.00 34.13 32.34 2ull s GLU 229 CO 0.03 -0.29 1.31 0.54 -0.56 0.00 0.00 175.26 176.29 2ull n ARG 230 N 5.11 2.04 -0.06 4.30 1.74 -1.26 -1.13 116.66 127.41 2ull n ARG 230 Ca 0.04 0.72 -0.15 0.00 -0.77 0.00 0.00 57.85 57.69 2ull n ARG 230 Cb 0.49 -2.31 -0.07 0.00 -1.02 0.00 0.00 32.46 29.55 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 3.14 0.64 -0.80 0.55 5.85 -1.60 -3.35 115.31 119.74 2ull h LEU 231 Ca -0.45 -0.56 0.14 0.00 0.84 0.00 0.00 57.88 57.85 2ull h LEU 231 Cb 1.28 -0.19 -0.09 0.00 0.37 0.00 0.00 40.66 42.03 2ull h LEU 231 CO 0.67 1.08 0.37 1.56 -0.34 0.00 0.00 178.44 181.78 2ull h GLN 232 N 0.23 0.52 0.00 1.25 4.20 -1.90 -0.47 115.11 118.94 2ull h GLN 232 Ca 0.00 -0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 2ull h GLN 232 Cb 0.98 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.64 2ull h GLN 232 CO 0.08 0.34 -0.20 -1.00 -0.67 0.00 0.00 178.83 177.39 2ull h PRO 233 N 0.53 0.00 -0.13 1.46 0.13 -1.99 -1.98 132.00 130.03 2ull h PRO 233 Ca 0.44 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.49 2ull h PRO 233 Cb 0.64 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.77 2ull h PRO 233 CO -0.38 0.20 -0.23 0.82 -0.23 0.00 0.00 178.00 178.18 2ull h ILE 234 N 0.00 1.37 -0.13 -3.56 2.04 -1.27 -1.72 117.51 114.25 2ull h ILE 234 Ca -0.00 -1.49 0.01 0.00 1.00 0.00 0.00 64.86 64.38 2ull h ILE 234 Cb 0.68 2.03 -0.01 0.00 -0.74 0.00 0.00 36.82 38.78 2ull h ILE 234 CO 0.03 0.44 0.05 -0.07 0.00 0.00 0.00 178.15 178.60 2ull h LEU 235 N -0.03 0.08 -0.55 1.44 3.38 -1.05 -2.66 115.31 115.92 2ull h LEU 235 Ca 0.01 0.01 -0.15 0.00 0.09 0.00 0.00 57.88 57.83 2ull h LEU 235 Cb 0.81 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 2ull h LEU 235 CO 0.05 0.06 -0.49 0.77 0.09 0.00 0.00 178.44 178.93 2ull h SER 236 N 0.13 0.66 -0.24 -0.43 4.64 -1.43 0.14 113.55 117.02 2ull h SER 236 Ca 0.05 -0.33 -0.06 0.00 -0.47 0.00 0.00 61.79 60.98 2ull h SER 236 Cb 0.02 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 61.90 2ull h SER 236 CO -0.04 1.04 -0.04 -0.61 -0.87 0.00 0.00 176.83 176.30 2ull h GLN 237 N 0.48 0.58 -0.41 4.77 4.15 -1.23 -2.99 115.11 120.46 2ull h GLN 237 Ca 0.02 -0.14 0.00 0.00 0.77 0.00 0.00 58.65 59.30 2ull h GLN 237 Cb 1.03 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.64 2ull h GLN 237 CO 0.10 0.63 0.00 0.66 -1.93 0.00 0.00 178.83 178.29 2ull n TYR 238 N -4.24 0.54 -3.54 3.99 4.01 -1.01 -4.98 117.16 111.93 2ull n TYR 238 Ca 0.01 -0.37 -0.22 0.00 -0.16 0.00 0.00 57.90 57.16 2ull n TYR 238 Cb 0.28 -0.01 0.08 0.00 -0.31 0.00 0.00 39.34 39.38 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 1.06 -0.48 3.90 2.72 0.00 -0.26 -4.99 105.19 107.14 2ull n GLY 239 Ca 0.16 0.21 -0.32 0.00 0.00 0.00 0.00 46.02 46.07 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 -7.00 4.31 -0.13 0.99 1.43 0.34 -4.66 118.68 113.95 2ull s LEU 240 Ca 0.49 0.55 0.00 0.00 -1.03 0.00 0.00 54.13 54.14 2ull s LEU 240 Cb -0.22 -3.11 -0.01 0.00 0.03 0.00 0.00 46.19 42.88 2ull s LEU 240 CO 0.71 0.12 -0.15 -0.44 0.23 0.00 0.00 176.35 176.82 2ull s SER 241 N -2.26 3.86 0.07 2.29 0.01 -0.24 -4.71 113.70 112.71 2ull s SER 241 Ca 0.37 -0.38 -0.31 0.00 1.31 0.00 0.00 55.95 56.95 2ull s SER 241 Cb -0.13 -1.58 -0.06 0.00 0.21 0.00 0.00 66.02 64.46 2ull s SER 241 CO 0.23 0.15 1.20 -0.22 0.41 0.00 0.00 173.24 175.02 2ull s LEU 242 N 0.43 4.38 -0.23 2.44 2.96 -1.26 -1.37 118.68 126.02 2ull s LEU 242 Ca -0.11 2.04 -0.29 0.00 -0.22 0.00 0.00 54.13 55.55 2ull s LEU 242 Cb -0.16 -3.58 0.01 0.00 0.50 0.00 0.00 46.19 42.96 2ull s LEU 242 CO 0.05 -0.47 1.04 -0.69 -1.32 0.00 0.00 176.35 174.97 2ull s VAL 243 N 0.98 4.68 0.29 1.68 1.01 -0.83 -4.94 120.40 123.26 2ull s VAL 243 Ca 0.58 2.02 0.08 0.00 0.00 0.00 0.00 61.98 64.67 2ull s VAL 243 Cb -0.30 -4.31 -0.06 0.00 0.00 0.00 0.00 36.38 31.72 2ull s VAL 243 CO 0.30 -0.18 -0.10 0.42 0.00 0.00 0.00 175.10 175.54 2ull s THR 244 N 3.19 1.91 0.00 3.92 -4.23 -1.26 -4.37 115.64 114.80 2ull s THR 244 Ca 0.44 -2.19 0.00 0.00 -1.18 0.00 0.00 61.69 58.76 2ull s THR 244 Cb -0.15 -2.42 0.00 0.00 1.34 0.00 0.00 72.50 71.26 2ull s THR 244 CO 0.06 -0.33 0.04 0.61 -0.54 0.00 0.00 174.62 174.47