#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p05 s ASN 15 N 0.00 6.78 -0.46 0.00 -0.87 -1.26 -2.42 114.94 116.70 1p05 s ASN 15 Ca 0.00 0.94 -0.19 0.00 -1.57 0.00 0.00 52.86 52.04 1p05 s ASN 15 Cb 0.00 -2.33 0.04 0.00 -0.02 0.00 0.00 41.25 38.94 1p05 s ASN 15 CO 0.00 -0.03 0.56 -0.63 -2.57 0.00 0.00 177.10 174.42 1p05 s ILE 16 N 0.66 4.95 0.05 0.60 -1.09 0.14 -4.98 121.20 121.53 1p05 s ILE 16 Ca 0.30 -0.36 0.08 0.00 -2.23 0.00 0.00 60.65 58.43 1p05 s ILE 16 Cb -0.16 -4.19 -0.03 0.00 -1.58 0.00 0.00 42.46 36.50 1p05 s ILE 16 CO 0.13 -0.63 -0.22 -0.69 -1.23 0.00 0.00 174.94 172.30 1p05 s VAL 17 N 2.46 1.75 0.35 2.92 1.01 -1.26 -2.16 120.40 125.47 1p05 s VAL 17 Ca 0.15 -1.25 -0.29 0.00 0.00 0.00 0.00 61.98 60.59 1p05 s VAL 17 Cb -0.18 -1.52 -0.11 0.00 0.00 0.00 0.00 36.38 34.57 1p05 s VAL 17 CO 0.14 0.22 1.50 0.61 0.00 0.00 0.00 175.10 177.56 1p05 n GLY 18 N 1.79 1.18 0.05 4.51 0.00 0.36 -3.07 105.19 110.01 1p05 n GLY 18 Ca -0.17 0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1p05 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p05 n GLY 19 N 0.91 3.26 3.86 -0.02 0.00 0.70 0.07 105.19 113.98 1p05 n GLY 19 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1p05 n GLY 19 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1p05 s ILE 29 N -2.91 4.67 0.44 -0.61 -4.36 -1.17 -2.21 121.20 115.05 1p05 s ILE 29 Ca 0.00 0.96 -0.21 0.00 -0.26 0.00 0.00 60.65 61.14 1p05 s ILE 29 Cb 0.00 -3.83 -0.10 0.00 1.25 0.00 0.00 42.46 39.78 1p05 s ILE 29 CO 0.00 -1.03 0.99 -0.70 0.24 0.00 0.00 174.94 174.44 1p05 s GLU 30 N -4.90 4.08 0.04 0.37 2.12 -1.26 -0.85 118.70 118.29 1p05 s GLU 30 Ca 0.56 1.25 -0.06 0.00 0.36 0.00 0.00 54.97 57.08 1p05 s GLU 30 Cb -0.11 -2.20 -0.01 0.00 0.26 0.00 0.00 34.13 32.07 1p05 s GLU 30 CO 0.48 -0.17 0.11 1.52 -0.54 0.00 0.00 175.26 176.66 1p05 s TYR 31 N -2.04 0.17 0.21 5.30 -0.85 -0.53 -4.75 117.35 114.86 1p05 s TYR 31 Ca 0.63 -0.45 0.09 0.00 -0.52 0.00 0.00 57.07 56.82 1p05 s TYR 31 Cb -0.13 -0.12 -0.04 0.00 0.38 0.00 0.00 41.96 42.04 1p05 s TYR 31 CO 0.17 -0.37 -0.07 -1.54 -1.52 0.00 0.00 175.55 172.23 1p05 s SER 32 N -2.08 4.35 -0.18 -0.18 1.04 -0.37 -1.03 113.70 115.25 1p05 s SER 32 Ca -0.06 -0.60 -0.01 0.00 0.48 0.00 0.00 55.95 55.77 1p05 s SER 32 Cb -0.02 -0.76 0.00 0.00 0.10 0.00 0.00 66.02 65.34 1p05 s SER 32 CO -0.04 0.07 -0.14 -0.63 0.98 0.00 0.00 173.24 173.48 1p05 s ILE 33 N -1.90 2.66 -1.58 -1.02 1.09 -0.15 -1.57 121.20 118.72 1p05 s ILE 33 Ca 0.27 -0.75 -0.13 0.00 -1.10 0.00 0.00 60.65 58.94 1p05 s ILE 33 Cb -0.08 -2.15 0.10 0.00 -1.06 0.00 0.00 42.46 39.27 1p05 s ILE 33 CO 0.17 0.50 0.80 0.59 -0.10 0.00 0.00 174.94 176.89 1p05 n ASN 34 N 4.42 -3.27 -2.43 3.58 3.02 0.59 -1.73 115.26 119.44 1p05 n ASN 34 Ca -0.19 -0.92 -0.14 0.00 -0.03 0.00 0.00 54.58 53.29 1p05 n ASN 34 Cb 0.51 -3.26 -0.01 0.00 -0.61 0.00 0.00 39.78 36.42 1p05 n ASN 34 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1p05 n ASN 35 N -2.79 -4.30 0.00 6.41 3.02 -1.26 -4.83 115.26 111.51 1p05 n ASN 35 Ca -0.01 0.16 0.00 0.00 -0.03 0.00 0.00 54.58 54.69 1p05 n ASN 35 Cb 0.54 -3.63 0.00 0.00 -0.61 0.00 0.00 39.78 36.08 1p05 n ASN 35 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1p05 n ALA 39 N -2.16 1.47 -1.50 5.41 0.00 -0.71 -5.12 120.51 117.90 1p05 n ALA 39 Ca -0.17 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 52.94 1p05 n ALA 39 Cb 0.63 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.13 1p05 n ALA 39 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1p05 s SER 40 N 1.00 5.00 0.06 0.00 0.01 -1.21 -4.79 113.70 113.77 1p05 s SER 40 Ca 0.00 2.07 0.09 0.00 1.31 0.00 0.00 55.95 59.43 1p05 s SER 40 Cb 0.00 -2.56 -0.03 0.00 0.21 0.00 0.00 66.02 63.64 1p05 s SER 40 CO 0.00 -1.71 -0.25 -0.76 0.41 0.00 0.00 173.24 170.93 1p05 s LEU 41 N -4.83 2.20 0.00 2.44 1.43 -1.26 -0.98 118.68 117.68 1p05 s LEU 41 Ca 0.69 -0.61 0.06 0.00 -1.03 0.00 0.00 54.13 53.23 1p05 s LEU 41 Cb -0.22 -1.21 -0.02 0.00 0.03 0.00 0.00 46.19 44.77 1p05 s LEU 41 CO 0.41 0.22 0.25 0.00 0.23 0.00 0.00 176.35 177.46 1p05 s SER 43 N -2.89 3.57 0.32 0.00 0.01 -0.49 -1.46 113.70 112.75 1p05 s SER 43 Ca 0.32 -0.69 -0.27 0.00 1.31 0.00 0.00 55.95 56.62 1p05 s SER 43 Cb 0.01 -0.36 -0.09 0.00 0.21 0.00 0.00 66.02 65.79 1p05 s SER 43 CO 0.23 0.17 1.05 -0.69 0.41 0.00 0.00 173.24 174.41 1p05 s VAL 44 N -1.17 3.69 0.00 3.43 1.01 -0.03 -3.12 120.40 124.21 1p05 s VAL 44 Ca 0.16 1.54 0.00 0.00 0.00 0.00 0.00 61.98 63.68 1p05 s VAL 44 Cb -0.10 -3.92 0.00 0.00 0.00 0.00 0.00 36.38 32.36 1p05 s VAL 44 CO 0.08 0.25 0.00 0.61 0.00 0.00 0.00 175.10 176.04 1p05 n GLY 45 N 0.91 1.01 2.96 4.51 0.00 -0.65 -0.21 105.19 113.71 1p05 n GLY 45 Ca 0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.92 1p05 n GLY 45 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1p05 s PHE 46 N 0.00 0.04 0.17 1.61 0.08 -1.11 -4.04 117.98 114.72 1p05 s PHE 46 Ca 0.00 -0.06 -0.31 0.00 0.12 0.00 0.00 56.93 56.68 1p05 s PHE 46 Cb 0.00 -0.04 -0.09 0.00 -0.57 0.00 0.00 43.02 42.32 1p05 s PHE 46 CO 0.00 -0.09 1.40 -1.12 -0.10 0.00 0.00 175.22 175.30 1p05 s SER 47 N -0.50 6.79 0.19 1.36 0.01 -1.26 -0.61 113.70 119.68 1p05 s SER 47 Ca -0.06 2.44 -0.06 0.00 1.31 0.00 0.00 55.95 59.59 1p05 s SER 47 Cb -0.04 -2.60 -0.02 0.00 0.21 0.00 0.00 66.02 63.57 1p05 s SER 47 CO -0.00 -0.64 0.24 0.68 0.41 0.00 0.00 173.24 173.93 1p05 s VAL 48 N 0.62 0.03 0.13 3.43 -7.23 -0.07 -1.31 120.40 116.00 1p05 s VAL 48 Ca 0.62 -1.69 0.04 0.00 -1.81 0.00 0.00 61.98 59.14 1p05 s VAL 48 Cb -0.38 -2.19 -0.04 0.00 0.56 0.00 0.00 36.38 34.32 1p05 s VAL 48 CO 0.35 -0.15 -0.10 0.42 -0.31 0.00 0.00 175.10 175.31 1p05 s THR 48 N -4.06 1.05 -0.39 5.32 -4.23 0.27 -1.28 115.64 112.32 1p05 s THR 48 Ca 0.27 -1.93 0.01 0.00 -1.18 0.00 0.00 61.69 58.86 1p05 s THR 48 Cb 0.04 -1.69 0.14 0.00 1.34 0.00 0.00 72.50 72.33 1p05 s THR 48 CO 0.07 -0.71 0.23 -0.60 -0.54 0.00 0.00 174.62 173.07 1p05 s ARG 48 N -3.49 0.81 4.30 3.99 3.00 0.51 -0.09 118.95 127.98 1p05 s ARG 48 Ca 0.13 -1.61 0.00 0.00 -1.00 0.00 0.00 55.73 53.25 1p05 s ARG 48 Cb 0.01 -1.63 0.00 0.00 0.00 0.00 0.00 34.95 33.33 1p05 s ARG 48 CO -0.00 -1.21 0.00 0.41 0.00 0.00 0.00 175.30 174.50 1p05 n GLY 48 N 3.78 1.06 0.00 8.12 0.00 -1.26 -1.73 105.19 115.16 1p05 n GLY 48 Ca 0.12 -0.74 0.08 0.00 0.00 0.00 0.00 46.02 45.49 1p05 n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p05 n ALA 48 N 6.76 2.04 -2.60 4.61 0.00 -1.26 -4.80 120.51 125.26 1p05 n ALA 48 Ca 0.00 -0.09 -0.39 0.00 0.00 0.00 0.00 53.44 52.96 1p05 n ALA 48 Cb 0.00 -1.25 -0.06 0.00 0.00 0.00 0.00 19.45 18.14 1p05 n ALA 48 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1p05 s THR 49 N -2.11 5.02 0.24 0.00 2.01 -0.70 -5.06 115.64 115.03 1p05 s THR 49 Ca 0.22 1.20 -0.07 0.00 0.31 0.00 0.00 61.69 63.35 1p05 s THR 49 Cb 0.11 -3.92 -0.06 0.00 0.01 0.00 0.00 72.50 68.64 1p05 s THR 49 CO 0.19 0.36 0.52 -0.54 -0.69 0.00 0.00 174.62 174.47 1p05 s LYS 50 N 0.20 3.70 0.16 4.92 1.02 -1.26 -0.36 119.74 128.12 1p05 s LYS 50 Ca 0.31 0.10 -0.19 0.00 0.02 0.00 0.00 55.97 56.21 1p05 s LYS 50 Cb -0.17 -2.68 0.07 0.00 -0.52 0.00 0.00 37.83 34.52 1p05 s LYS 50 CO 0.15 0.30 0.91 0.41 -0.92 0.00 0.00 175.35 176.21 1p05 n GLY 51 N -0.43 0.68 3.04 -3.33 0.00 -0.41 -0.98 105.19 103.76 1p05 n GLY 51 Ca -0.01 -1.12 -0.10 0.00 0.00 0.00 0.00 46.02 44.78 1p05 n GLY 51 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1p05 s PHE 52 N -2.56 0.11 0.19 1.61 -0.12 -1.05 -0.89 117.98 115.27 1p05 s PHE 52 Ca 0.20 -0.24 -0.04 0.00 -0.05 0.00 0.00 56.93 56.80 1p05 s PHE 52 Cb -0.02 -0.09 -0.05 0.00 -0.63 0.00 0.00 43.02 42.22 1p05 s PHE 52 CO 0.05 -0.22 0.43 0.14 -0.05 0.00 0.00 175.22 175.57 1p05 s VAL 53 N -1.25 5.12 0.01 -2.49 -7.23 0.22 -1.69 120.40 113.09 1p05 s VAL 53 Ca -0.13 0.00 -0.00 0.00 -1.81 0.00 0.00 61.98 60.04 1p05 s VAL 53 Cb -0.08 -3.67 0.00 0.00 0.56 0.00 0.00 36.38 33.20 1p05 s VAL 53 CO 0.00 -0.09 0.01 1.07 -0.31 0.00 0.00 175.10 175.79 1p05 n THR 54 N -0.29 0.00 -3.02 5.32 5.66 -0.00 -1.64 114.28 120.31 1p05 n THR 54 Ca -0.02 -0.02 -0.38 0.00 -3.05 0.00 0.00 64.05 60.58 1p05 n THR 54 Cb 0.53 0.01 -0.06 0.00 -1.55 0.00 0.00 70.33 69.26 1p05 n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1p05 s ALA 55 N -1.13 3.41 0.26 1.79 0.00 -1.26 -1.48 121.76 123.34 1p05 s ALA 55 Ca 0.00 0.28 0.01 0.00 0.00 0.00 0.00 51.96 52.25 1p05 s ALA 55 Cb -0.00 -2.91 0.34 0.00 0.00 0.00 0.00 23.12 20.55 1p05 s ALA 55 CO 0.00 0.30 1.67 0.78 0.00 0.00 0.00 175.76 178.51 1p05 h GLY 56 N 3.76 0.55 2.00 0.00 0.00 -1.60 -1.92 103.07 105.86 1p05 h GLY 56 Ca -0.47 -0.48 0.00 0.00 0.00 0.00 0.00 47.33 46.37 1p05 h GLY 56 CO 0.65 0.44 0.00 1.12 0.00 0.00 0.00 176.54 178.75 1p05 h HIS 57 N 0.44 0.00 -0.21 5.60 2.07 -1.87 -3.13 115.15 118.04 1p05 h HIS 57 Ca 0.05 0.00 -0.06 0.00 -2.85 0.00 0.00 60.37 57.51 1p05 h HIS 57 Cb 0.76 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.72 1p05 h HIS 57 CO 0.03 0.00 -0.15 0.00 -3.07 0.00 0.00 177.93 174.73 1p05 s GLY 59 N -4.01 0.12 0.31 0.00 0.00 -1.18 -4.86 107.32 97.69 1p05 s GLY 59 Ca -0.06 -0.50 0.07 0.00 0.00 0.00 0.00 44.72 44.23 1p05 s GLY 59 CO 0.76 -0.23 0.30 -0.51 0.00 0.00 0.00 173.10 173.41 1p05 s THR 62 N -3.64 3.91 0.36 0.90 -4.23 -1.26 -4.94 115.64 106.74 1p05 s THR 62 Ca 0.14 -1.31 -0.26 0.00 -1.18 0.00 0.00 61.69 59.08 1p05 s THR 62 Cb -0.05 -3.30 -0.12 0.00 1.34 0.00 0.00 72.50 70.37 1p05 s THR 62 CO 0.08 -0.22 0.99 0.52 -0.54 0.00 0.00 174.62 175.46 1p05 n VAL 63 N -1.37 2.17 -0.79 2.29 0.31 -1.26 -0.72 118.33 118.96 1p05 n VAL 63 Ca -0.03 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.80 1p05 n VAL 63 Cb 0.59 -1.07 0.00 0.00 -0.91 0.00 0.00 33.84 32.45 1p05 n VAL 63 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1p05 n ASN 64 N 0.88 -0.74 -4.75 4.52 5.03 0.17 -4.90 115.26 115.47 1p05 n ASN 64 Ca 0.09 0.00 -0.36 0.00 0.87 0.00 0.00 54.58 55.18 1p05 n ASN 64 Cb 0.36 -1.40 0.04 0.00 -1.02 0.00 0.00 39.78 37.76 1p05 n ASN 64 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1p05 s ALA 65 N -2.31 2.52 -0.19 5.41 0.00 0.10 -4.61 121.76 122.69 1p05 s ALA 65 Ca 0.00 1.02 -0.22 0.00 0.00 0.00 0.00 51.96 52.76 1p05 s ALA 65 Cb 0.00 -3.46 -0.02 0.00 0.00 0.00 0.00 23.12 19.64 1p05 s ALA 65 CO 0.00 -1.21 0.67 0.99 0.00 0.00 0.00 175.76 176.20 1p05 s THR 65 N -1.59 5.00 -0.03 0.00 2.01 -1.26 -0.56 115.64 119.20 1p05 s THR 65 Ca 0.78 1.28 -0.02 0.00 0.31 0.00 0.00 61.69 64.03 1p05 s THR 65 Cb -0.31 -3.98 -0.04 0.00 0.01 0.00 0.00 72.50 68.18 1p05 s THR 65 CO 0.34 0.10 0.11 0.00 -0.69 0.00 0.00 174.62 174.48 1p05 s ALA 66 N 1.89 3.70 0.01 7.40 0.00 -0.36 -0.30 121.76 134.10 1p05 s ALA 66 Ca 0.31 -0.80 0.02 0.00 0.00 0.00 0.00 51.96 51.49 1p05 s ALA 66 Cb -0.16 -1.71 -0.01 0.00 0.00 0.00 0.00 23.12 21.24 1p05 s ALA 66 CO 0.11 0.68 -0.07 1.03 0.00 0.00 0.00 175.76 177.52 1p05 s ARG 67 N -1.59 0.50 -0.11 0.00 0.52 -0.61 -2.11 118.95 115.55 1p05 s ARG 67 Ca 0.22 -0.40 -0.00 0.00 -0.52 0.00 0.00 55.73 55.02 1p05 s ARG 67 Cb -0.12 -0.41 0.02 0.00 0.52 0.00 0.00 34.95 34.96 1p05 s ARG 67 CO 0.12 0.10 -0.08 0.42 0.02 0.00 0.00 175.30 175.89 1p05 s ILE 80 N -0.56 1.03 -1.29 1.52 1.01 0.07 -1.24 121.20 121.74 1p05 s ILE 80 Ca -0.02 -0.29 -0.00 0.00 0.00 0.00 0.00 60.65 60.33 1p05 s ILE 80 Cb -0.05 -1.04 0.00 0.00 0.01 0.00 0.00 42.46 41.38 1p05 s ILE 80 CO 0.00 0.37 0.78 0.61 0.00 0.00 0.00 174.94 176.70 1p05 n GLY 81 N 4.90 -0.31 3.76 6.18 0.00 -1.26 -1.03 105.19 117.43 1p05 n GLY 81 Ca -0.13 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1p05 n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p05 n GLY 82 N -1.47 1.96 3.90 -0.02 0.00 -1.26 -5.01 105.19 103.28 1p05 n GLY 82 Ca -0.29 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.40 1p05 n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p05 s ALA 83 N -2.15 3.89 0.12 4.61 0.00 -0.20 -5.05 121.76 122.99 1p05 s ALA 83 Ca 0.00 -0.66 -0.30 0.00 0.00 0.00 0.00 51.96 50.99 1p05 s ALA 83 Cb 0.00 -1.99 -0.07 0.00 0.00 0.00 0.00 23.12 21.06 1p05 s ALA 83 CO 0.00 0.71 1.17 0.08 0.00 0.00 0.00 175.76 177.71 1p05 s VAL 84 N -1.38 3.91 0.00 0.00 1.01 -1.26 -0.75 120.40 121.92 1p05 s VAL 84 Ca 0.30 1.48 0.00 0.00 0.00 0.00 0.00 61.98 63.77 1p05 s VAL 84 Cb -0.13 -3.95 0.00 0.00 0.00 0.00 0.00 36.38 32.30 1p05 s VAL 84 CO 0.20 0.18 0.00 1.33 0.00 0.00 0.00 175.10 176.80 1p05 n VAL 85 N 3.21 0.00 -3.13 2.92 0.24 -0.90 -4.90 118.33 115.78 1p05 n VAL 85 Ca 0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.36 1p05 n VAL 85 Cb 0.46 -0.27 0.00 0.00 -1.47 0.00 0.00 33.84 32.56 1p05 n VAL 85 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1p05 n GLY 86 N 2.40 -1.09 3.14 7.63 0.00 -1.17 -0.51 105.19 115.59 1p05 n GLY 86 Ca 0.00 -0.81 -0.08 0.00 0.00 0.00 0.00 46.02 45.13 1p05 n GLY 86 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1p05 s THR 87 N -3.00 0.16 0.06 2.61 -4.23 -0.91 -1.23 115.64 109.11 1p05 s THR 87 Ca 0.00 -1.77 -0.31 0.00 -1.18 0.00 0.00 61.69 58.43 1p05 s THR 87 Cb 0.00 -1.73 -0.07 0.00 1.34 0.00 0.00 72.50 72.05 1p05 s THR 87 CO 0.00 -0.73 1.41 -0.36 -0.54 0.00 0.00 174.62 174.41 1p05 s PHE 88 N -3.97 3.01 -0.10 3.99 0.40 0.27 -0.21 117.98 121.37 1p05 s PHE 88 Ca 0.14 0.85 0.03 0.00 -0.60 0.00 0.00 56.93 57.35 1p05 s PHE 88 Cb 0.07 -3.69 -0.24 0.00 0.51 0.00 0.00 43.02 39.67 1p05 s PHE 88 CO -0.05 -2.51 0.43 0.00 0.70 0.00 0.00 175.22 173.79 1p05 n ALA 89 N 4.70 1.20 -3.47 5.36 0.00 -0.39 -0.66 120.51 127.26 1p05 n ALA 89 Ca 0.12 -0.73 -0.10 0.00 0.00 0.00 0.00 53.44 52.73 1p05 n ALA 89 Cb 0.43 -0.68 -0.02 0.00 0.00 0.00 0.00 19.45 19.17 1p05 n ALA 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1p05 s ALA 90 N -2.57 -1.70 0.11 0.00 0.00 -1.21 -4.84 121.76 111.56 1p05 s ALA 90 Ca -0.15 0.71 -0.25 0.00 0.00 0.00 0.00 51.96 52.26 1p05 s ALA 90 Cb 0.07 0.67 0.08 0.00 0.00 0.00 0.00 23.12 23.94 1p05 s ALA 90 CO 0.78 -0.74 0.76 -0.98 0.00 0.00 0.00 175.76 175.58 1p05 s ARG 91 N -3.46 1.15 -0.10 0.00 1.04 -1.26 -2.22 118.95 114.10 1p05 s ARG 91 Ca 0.03 -0.48 -0.01 0.00 -1.04 0.00 0.00 55.73 54.23 1p05 s ARG 91 Cb -0.01 0.49 0.03 0.00 -2.04 0.00 0.00 34.95 33.42 1p05 s ARG 91 CO -0.11 -0.51 -0.02 0.08 -0.04 0.00 0.00 175.30 174.71 1p05 s VAL 93 N -3.48 0.60 -0.28 4.99 1.01 0.58 -4.99 120.40 118.83 1p05 s VAL 93 Ca 0.05 -0.08 -0.19 0.00 0.00 0.00 0.00 61.98 61.75 1p05 s VAL 93 Cb -0.02 -0.75 0.11 0.00 0.00 0.00 0.00 36.38 35.73 1p05 s VAL 93 CO -0.08 0.24 0.89 0.12 0.00 0.00 0.00 175.10 176.27 1p05 s PHE 94 N 1.88 -0.70 0.00 5.22 2.19 -1.26 -1.21 117.98 124.10 1p05 s PHE 94 Ca 0.04 1.49 0.00 0.00 0.33 0.00 0.00 56.93 58.79 1p05 s PHE 94 Cb -0.13 0.42 0.00 0.00 -1.31 0.00 0.00 43.02 42.00 1p05 s PHE 94 CO -0.06 -0.34 0.00 -0.35 1.83 0.00 0.00 175.22 176.29 1p05 n PRO 99 N 3.41 1.37 0.00 10.12 -0.04 -1.26 -4.99 135.00 143.60 1p05 n PRO 99 Ca -0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 1p05 n PRO 99 Cb 0.57 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.03 1p05 n PRO 99 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1p05 n GLY 100 N 5.00 2.02 1.77 0.55 0.00 0.14 -4.80 105.19 109.86 1p05 n GLY 100 Ca 0.00 -0.36 -0.14 0.00 0.00 0.00 0.00 46.02 45.52 1p05 n GLY 100 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1p05 n ASN 101 N 4.05 2.19 -3.22 1.61 3.02 -1.26 -0.37 115.26 121.28 1p05 n ASN 101 Ca 0.00 -1.96 -0.21 0.00 -0.03 0.00 0.00 54.58 52.38 1p05 n ASN 101 Cb 0.00 0.06 -0.07 0.00 -0.61 0.00 0.00 39.78 39.16 1p05 n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1p05 n ASP 102 N -1.59 -1.21 -3.90 6.41 4.64 -1.22 -4.00 116.55 115.68 1p05 n ASP 102 Ca -0.05 -2.54 -0.09 0.00 -1.38 0.00 0.00 54.79 50.73 1p05 n ASP 102 Cb 0.30 0.03 -0.08 0.00 -1.04 0.00 0.00 41.12 40.33 1p05 n ASP 102 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1p05 s ARG 103 N 0.19 0.71 0.10 -0.67 1.70 -0.35 -3.43 118.95 117.21 1p05 s ARG 103 Ca 0.32 -0.87 -0.26 0.00 -0.47 0.00 0.00 55.73 54.46 1p05 s ARG 103 Cb 0.04 0.28 0.08 0.00 -0.57 0.00 0.00 34.95 34.78 1p05 s ARG 103 CO -0.16 -0.20 0.85 0.00 -1.08 0.00 0.00 175.30 174.71 1p05 s ALA 104 N -3.25 -1.68 -0.00 7.88 0.00 -0.55 -0.31 121.76 123.85 1p05 s ALA 104 Ca 0.00 0.51 -0.00 0.00 0.00 0.00 0.00 51.96 52.47 1p05 s ALA 104 Cb 0.02 0.60 -0.00 0.00 0.00 0.00 0.00 23.12 23.75 1p05 s ALA 104 CO -0.08 -0.85 0.01 1.67 0.00 0.00 0.00 175.76 176.51 1p05 s TRP 105 N -3.35 0.02 -0.17 0.00 1.48 -0.94 -0.82 118.94 115.16 1p05 s TRP 105 Ca 0.07 -0.04 -0.05 0.00 -1.06 0.00 0.00 56.10 55.02 1p05 s TRP 105 Cb -0.02 -0.02 -0.03 0.00 -1.16 0.00 0.00 33.47 32.24 1p05 s TRP 105 CO -0.04 -0.03 0.00 0.08 -4.06 0.00 0.00 176.95 172.90 1p05 s VAL 106 N -0.18 4.19 -0.05 -0.66 1.01 -0.68 -1.26 120.40 122.76 1p05 s VAL 106 Ca -0.02 -0.25 -0.13 0.00 0.00 0.00 0.00 61.98 61.59 1p05 s VAL 106 Cb -0.01 -2.86 -0.05 0.00 0.00 0.00 0.00 36.38 33.45 1p05 s VAL 106 CO -0.00 0.47 0.32 -0.94 0.00 0.00 0.00 175.10 174.95 1p05 s SER 107 N 0.46 6.66 0.29 3.32 1.04 0.70 -2.54 113.70 123.63 1p05 s SER 107 Ca -0.01 0.78 0.06 0.00 0.48 0.00 0.00 55.95 57.26 1p05 s SER 107 Cb -0.14 -2.19 -0.02 0.00 0.10 0.00 0.00 66.02 63.77 1p05 s SER 107 CO 0.02 0.32 0.36 -0.76 0.98 0.00 0.00 173.24 174.16 1p05 s LEU 108 N -0.90 4.01 0.89 2.42 1.43 -0.16 -2.14 118.68 124.23 1p05 s LEU 108 Ca 0.21 -0.15 -0.12 0.00 -1.03 0.00 0.00 54.13 53.03 1p05 s LEU 108 Cb -0.15 -2.64 0.12 0.00 0.03 0.00 0.00 46.19 43.55 1p05 s LEU 108 CO 0.10 -0.22 1.11 0.42 0.23 0.00 0.00 176.35 177.98 1p05 s THR 109 N -2.12 2.51 0.51 5.49 -4.23 0.33 -4.50 115.64 113.64 1p05 s THR 109 Ca 0.38 0.17 0.17 0.00 -1.18 0.00 0.00 61.69 61.23 1p05 s THR 109 Cb -0.08 -2.81 0.29 0.00 1.34 0.00 0.00 72.50 71.23 1p05 s THR 109 CO 0.29 -0.22 2.12 0.28 -0.54 0.00 0.00 174.62 176.55 1p05 h SER 110 N -1.44 0.03 0.72 3.99 0.02 -1.96 -2.75 113.55 112.15 1p05 h SER 110 Ca -0.50 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.45 1p05 h SER 110 Cb 1.30 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.83 1p05 h SER 110 CO 0.59 0.02 0.00 0.00 -1.14 0.00 0.00 176.83 176.30 1p05 n ALA 111 N -2.55 1.67 -1.78 3.77 0.00 -1.26 -4.79 120.51 115.57 1p05 n ALA 111 Ca -0.01 0.07 -0.32 0.00 0.00 0.00 0.00 53.44 53.18 1p05 n ALA 111 Cb 0.16 -1.37 -0.02 0.00 0.00 0.00 0.00 19.45 18.22 1p05 n ALA 111 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1p05 s GLN 112 N -3.28 3.75 -0.38 0.00 -1.52 -1.04 -4.54 119.66 112.66 1p05 s GLN 112 Ca 0.05 1.07 -0.09 0.00 -1.95 0.00 0.00 55.36 54.43 1p05 s GLN 112 Cb 0.09 -2.10 0.05 0.00 -0.22 0.00 0.00 33.01 30.83 1p05 s GLN 112 CO 0.38 -0.44 0.20 0.99 -0.25 0.00 0.00 175.29 176.17 1p05 s THR 113 N -2.51 4.19 0.16 -0.19 2.01 -1.02 -4.97 115.64 113.31 1p05 s THR 113 Ca 0.61 -1.16 -0.27 0.00 0.31 0.00 0.00 61.69 61.18 1p05 s THR 113 Cb -0.12 -3.44 -0.08 0.00 0.01 0.00 0.00 72.50 68.87 1p05 s THR 113 CO 0.32 -0.32 0.85 -0.76 -0.69 0.00 0.00 174.62 174.01 1p05 s LEU 114 N 1.46 4.57 0.03 4.42 1.43 -1.26 0.26 118.68 129.59 1p05 s LEU 114 Ca 0.01 1.73 0.05 0.00 -1.03 0.00 0.00 54.13 54.89 1p05 s LEU 114 Cb -0.21 -3.42 -0.02 0.00 0.03 0.00 0.00 46.19 42.57 1p05 s LEU 114 CO 0.04 0.12 -0.14 -0.76 0.23 0.00 0.00 176.35 175.84 1p05 s LEU 115 N -0.80 2.16 -0.16 1.79 1.43 -0.92 -4.90 118.68 117.28 1p05 s LEU 115 Ca 0.39 -0.44 -0.05 0.00 -1.03 0.00 0.00 54.13 53.01 1p05 s LEU 115 Cb -0.24 -0.60 -0.14 0.00 0.03 0.00 0.00 46.19 45.24 1p05 s LEU 115 CO 0.28 0.04 3.26 -0.81 0.23 0.00 0.00 176.35 179.35 1p05 n PRO 116 N 1.97 2.10 -4.14 1.29 -0.04 -1.26 -4.51 135.00 130.40 1p05 n PRO 116 Ca -0.18 -1.43 -0.09 0.00 -0.04 0.00 0.00 63.50 61.76 1p05 n PRO 116 Cb 0.55 -2.01 -0.10 0.00 -0.04 0.00 0.00 33.50 31.90 1p05 n PRO 116 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1p05 s ARG 117 N -0.00 0.77 -0.05 0.54 0.52 -1.26 -0.27 118.95 119.20 1p05 s ARG 117 Ca 0.61 -1.31 0.02 0.00 -0.52 0.00 0.00 55.73 54.54 1p05 s ARG 117 Cb 0.33 -0.03 0.01 0.00 0.52 0.00 0.00 34.95 35.77 1p05 s ARG 117 CO -0.08 -0.07 -0.11 0.08 0.02 0.00 0.00 175.30 175.15 1p05 s VAL 118 N -3.75 0.96 0.31 3.52 1.01 0.47 -0.48 120.40 122.43 1p05 s VAL 118 Ca 0.11 -0.41 -0.29 0.00 0.00 0.00 0.00 61.98 61.39 1p05 s VAL 118 Cb 0.06 -0.87 -0.10 0.00 0.00 0.00 0.00 36.38 35.47 1p05 s VAL 118 CO -0.06 0.30 1.35 0.00 0.00 0.00 0.00 175.10 176.70 1p05 s ALA 119 N 0.45 3.53 -0.34 5.51 0.00 0.11 -0.66 121.76 130.37 1p05 s ALA 119 Ca -0.09 1.30 -0.00 0.00 0.00 0.00 0.00 51.96 53.17 1p05 s ALA 119 Cb -0.13 -3.51 0.14 0.00 0.00 0.00 0.00 23.12 19.62 1p05 s ALA 119 CO 0.02 -0.70 0.24 1.21 0.00 0.00 0.00 175.76 176.53 1p05 s ASN 120 N -0.23 2.56 0.00 0.00 2.47 -1.26 -4.77 114.94 113.71 1p05 s ASN 120 Ca 0.52 -1.77 0.00 0.00 0.42 0.00 0.00 52.86 52.03 1p05 s ASN 120 Cb -0.41 -0.10 0.00 0.00 -1.45 0.00 0.00 41.25 39.30 1p05 s ASN 120 CO 0.51 -0.33 0.00 0.61 -3.72 0.00 0.00 177.10 174.17 1p05 n GLY 120 N 4.42 -0.21 3.02 1.21 0.00 -1.26 -4.30 105.19 108.07 1p05 n GLY 120 Ca 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1p05 n GLY 120 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1p05 n SER 120 N 0.22 0.00 -4.02 1.61 2.88 -1.26 -5.12 113.62 107.92 1p05 n SER 120 Ca 0.00 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.44 1p05 n SER 120 Cb 0.00 -0.03 -0.11 0.00 -0.75 0.00 0.00 64.21 63.32 1p05 n SER 120 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 1p05 s PHE 121 N -0.07 0.43 -0.21 0.66 0.08 -1.26 -4.63 117.98 112.97 1p05 s PHE 121 Ca 0.00 -0.60 -0.06 0.00 0.12 0.00 0.00 56.93 56.39 1p05 s PHE 121 Cb 0.00 -0.29 -0.03 0.00 -0.57 0.00 0.00 43.02 42.14 1p05 s PHE 121 CO 0.00 -0.18 0.03 0.08 -0.10 0.00 0.00 175.22 175.05 1p05 s VAL 122 N -1.82 4.16 0.09 -0.44 1.01 0.16 -4.89 120.40 118.66 1p05 s VAL 122 Ca -0.10 -0.24 -0.30 0.00 0.00 0.00 0.00 61.98 61.34 1p05 s VAL 122 Cb -0.07 -2.90 -0.05 0.00 0.00 0.00 0.00 36.38 33.35 1p05 s VAL 122 CO -0.02 0.40 0.95 -0.89 0.00 0.00 0.00 175.10 175.55 1p05 s THR 123 N 1.14 4.59 -0.16 3.92 2.01 -1.26 -0.40 115.64 125.47 1p05 s THR 123 Ca 0.03 2.04 -0.28 0.00 0.31 0.00 0.00 61.69 63.79 1p05 s THR 123 Cb -0.14 -4.31 -0.00 0.00 0.01 0.00 0.00 72.50 68.05 1p05 s THR 123 CO 0.02 0.29 0.98 -0.69 -0.69 0.00 0.00 174.62 174.53 1p05 s VAL 124 N 0.19 4.77 -0.41 3.82 1.01 0.63 -4.35 120.40 126.06 1p05 s VAL 124 Ca 0.47 1.95 0.11 0.00 0.00 0.00 0.00 61.98 64.52 1p05 s VAL 124 Cb -0.23 -4.28 -0.13 0.00 0.00 0.00 0.00 36.38 31.75 1p05 s VAL 124 CO 0.29 -0.06 0.42 0.54 0.00 0.00 0.00 175.10 176.29 1p05 n ARG 125 N 5.52 2.74 -3.53 2.72 5.12 0.24 -1.79 116.66 127.68 1p05 n ARG 125 Ca 0.09 -0.02 0.00 0.00 -1.93 0.00 0.00 57.85 55.99 1p05 n ARG 125 Cb 0.48 -1.07 0.00 0.00 -1.16 0.00 0.00 32.46 30.71 1p05 n ARG 125 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1p05 n GLY 126 N 1.39 -0.93 2.79 -0.13 0.00 -1.16 -4.91 105.19 102.24 1p05 n GLY 126 Ca 0.01 -0.95 -0.02 0.00 0.00 0.00 0.00 46.02 45.06 1p05 n GLY 126 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1p05 n SER 127 N 0.81 1.66 -4.72 1.61 3.41 -1.26 -0.53 113.62 114.60 1p05 n SER 127 Ca 0.00 -2.18 -0.42 0.00 -0.26 0.00 0.00 58.87 56.01 1p05 n SER 127 Cb 0.00 -0.48 -0.03 0.00 -0.26 0.00 0.00 64.21 63.44 1p05 n SER 127 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1p05 s THR 128 N -3.73 2.93 0.03 6.66 2.01 -1.26 -4.84 115.64 117.44 1p05 s THR 128 Ca 0.28 0.66 -0.30 0.00 0.31 0.00 0.00 61.69 62.63 1p05 s THR 128 Cb 0.34 -3.42 -0.04 0.00 0.01 0.00 0.00 72.50 69.39 1p05 s THR 128 CO -0.03 0.05 1.04 -0.70 -0.69 0.00 0.00 174.62 174.29 1p05 s GLU 129 N 1.20 4.54 0.58 4.92 2.12 -1.26 -4.71 118.70 126.09 1p05 s GLU 129 Ca 0.68 1.52 -0.11 0.00 0.36 0.00 0.00 54.97 57.42 1p05 s GLU 129 Cb -0.41 -3.42 -0.04 0.00 0.26 0.00 0.00 34.13 30.52 1p05 s GLU 129 CO 0.31 -0.07 0.98 0.00 -0.54 0.00 0.00 175.26 175.94 1p05 s ALA 130 N 0.87 3.15 0.62 6.30 0.00 -1.26 -5.08 121.76 126.36 1p05 s ALA 130 Ca 0.53 -0.13 0.02 0.00 0.00 0.00 0.00 51.96 52.38 1p05 s ALA 130 Cb -0.24 -3.00 0.08 0.00 0.00 0.00 0.00 23.12 19.96 1p05 s ALA 130 CO 0.29 -0.58 0.86 0.00 0.00 0.00 0.00 175.76 176.33 1p05 s ALA 131 N -3.04 4.00 0.25 0.00 0.00 -1.26 -5.00 121.76 116.70 1p05 s ALA 131 Ca 0.54 -1.67 -0.31 0.00 0.00 0.00 0.00 51.96 50.53 1p05 s ALA 131 Cb -0.11 -1.91 -0.11 0.00 0.00 0.00 0.00 23.12 20.99 1p05 s ALA 131 CO 0.50 -1.05 1.59 0.08 0.00 0.00 0.00 175.76 176.88 1p05 s VAL 132 N -2.88 2.26 0.00 0.00 1.01 -1.26 -2.06 120.40 117.46 1p05 s VAL 132 Ca 0.62 0.21 0.00 0.00 0.00 0.00 0.00 61.98 62.80 1p05 s VAL 132 Cb -0.07 -3.13 0.00 0.00 0.00 0.00 0.00 36.38 33.18 1p05 s VAL 132 CO 0.41 0.03 0.00 0.61 0.00 0.00 0.00 175.10 176.14 1p05 n GLY 133 N 2.80 1.28 3.79 4.51 0.00 -0.47 -5.01 105.19 112.08 1p05 n GLY 133 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1p05 n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p05 s ALA 134 N -2.32 2.63 0.41 4.61 0.00 -0.88 -4.68 121.76 121.53 1p05 s ALA 134 Ca 0.00 0.44 -0.22 0.00 0.00 0.00 0.00 51.96 52.18 1p05 s ALA 134 Cb 0.00 -3.26 -0.10 0.00 0.00 0.00 0.00 23.12 19.76 1p05 s ALA 134 CO 0.00 -1.01 0.98 0.00 0.00 0.00 0.00 175.76 175.73 1p05 s ALA 135 N -2.43 3.05 0.10 0.00 0.00 -1.26 -1.22 121.76 120.00 1p05 s ALA 135 Ca 0.65 0.51 -0.19 0.00 0.00 0.00 0.00 51.96 52.93 1p05 s ALA 135 Cb -0.18 -3.19 0.04 0.00 0.00 0.00 0.00 23.12 19.79 1p05 s ALA 135 CO 0.39 0.01 0.45 0.54 0.00 0.00 0.00 175.76 177.16 1p05 s VAL 136 N -1.96 0.05 0.26 0.00 0.11 0.11 -4.80 120.40 114.17 1p05 s VAL 136 Ca 0.60 -0.41 0.06 0.00 -2.93 0.00 0.00 61.98 59.30 1p05 s VAL 136 Cb -0.14 -1.06 -0.06 0.00 -1.53 0.00 0.00 36.38 33.59 1p05 s VAL 136 CO 0.18 -0.23 -0.06 0.00 -3.33 0.00 0.00 175.10 171.67 1p05 s ARG 138 N -3.74 0.50 -0.02 0.00 1.70 0.12 -0.06 118.95 117.44 1p05 s ARG 138 Ca 0.28 -0.45 0.05 0.00 -0.47 0.00 0.00 55.73 55.14 1p05 s ARG 138 Cb 0.04 0.21 -0.01 0.00 -0.57 0.00 0.00 34.95 34.61 1p05 s ARG 138 CO 0.11 -0.12 -0.16 0.45 -1.08 0.00 0.00 175.30 174.50 1p05 s SER 139 N -1.48 1.91 0.06 -2.89 0.15 -0.45 -1.10 113.70 109.91 1p05 s SER 139 Ca -0.14 -0.30 -0.27 0.00 0.70 0.00 0.00 55.95 55.95 1p05 s SER 139 Cb -0.07 -0.31 0.09 0.00 -1.71 0.00 0.00 66.02 64.01 1p05 s SER 139 CO 0.01 0.18 0.84 -0.83 1.20 0.00 0.00 173.24 174.64 1p05 s GLY 140 N -0.23 -0.43 0.44 9.45 0.00 -0.68 -3.06 107.32 112.80 1p05 s GLY 140 Ca 0.03 0.70 0.30 0.00 0.00 0.00 0.00 44.72 45.76 1p05 s GLY 140 CO 0.00 0.23 1.92 0.07 0.00 0.00 0.00 173.10 175.32 1p05 h ARG 141 N 2.00 0.00 0.00 2.90 -0.00 -1.64 -2.01 114.38 115.63 1p05 h ARG 141 Ca -0.24 0.00 -0.09 0.00 -0.00 0.00 0.00 59.98 59.64 1p05 h ARG 141 Cb 1.25 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 31.21 1p05 h ARG 141 CO 0.31 0.00 -1.19 2.41 -0.00 0.00 0.00 179.97 181.50 1p05 n THR 142 N -2.61 1.49 0.14 0.08 -1.04 -1.26 -4.67 114.28 106.42 1p05 n THR 142 Ca -0.01 0.05 0.10 0.00 -2.04 0.00 0.00 64.05 62.16 1p05 n THR 142 Cb 0.11 -2.26 0.21 0.00 -1.82 0.00 0.00 70.33 66.57 1p05 n THR 142 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1p05 n THR 143 N -4.45 0.61 -4.24 12.58 -2.24 -1.26 -5.00 114.28 110.28 1p05 n THR 143 Ca -0.21 -0.80 0.00 0.00 -2.27 0.00 0.00 64.05 60.77 1p05 n THR 143 Cb 0.54 0.87 0.00 0.00 -2.10 0.00 0.00 70.33 69.64 1p05 n THR 143 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1p05 n GLY 156 N 1.32 1.40 3.52 3.38 0.00 -0.75 -4.66 105.19 109.40 1p05 n GLY 156 Ca 0.18 -0.70 -0.39 0.00 0.00 0.00 0.00 46.02 45.11 1p05 n GLY 156 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1p05 s TYR 157 N 0.00 3.21 0.02 1.61 6.14 -1.26 -1.69 117.35 125.37 1p05 s TYR 157 Ca 0.00 -0.21 0.06 0.00 0.64 0.00 0.00 57.07 57.56 1p05 s TYR 157 Cb 0.00 -2.41 -0.02 0.00 0.42 0.00 0.00 41.96 39.95 1p05 s TYR 157 CO 0.00 -0.33 -0.18 -0.65 0.64 0.00 0.00 175.55 175.03 1p05 s GLN 158 N 1.70 1.33 0.33 4.97 -1.52 -0.26 -4.95 119.66 121.26 1p05 s GLN 158 Ca 0.06 -0.79 0.06 0.00 -1.95 0.00 0.00 55.36 52.74 1p05 s GLN 158 Cb -0.17 -1.36 -0.07 0.00 -0.22 0.00 0.00 33.01 31.19 1p05 s GLN 158 CO 0.09 0.36 -0.00 0.00 -0.25 0.00 0.00 175.29 175.49 1p05 n GLY 160 N -0.72 -0.73 3.21 0.00 0.00 0.25 -4.36 105.19 102.83 1p05 n GLY 160 Ca -0.04 -0.39 -0.12 0.00 0.00 0.00 0.00 46.02 45.46 1p05 n GLY 160 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1p05 s THR 161 N -3.90 0.52 -0.01 2.61 -4.23 -1.26 0.05 115.64 109.43 1p05 s THR 161 Ca 0.00 -1.95 -0.28 0.00 -1.18 0.00 0.00 61.69 58.27 1p05 s THR 161 Cb 0.00 -2.05 -0.03 0.00 1.34 0.00 0.00 72.50 71.75 1p05 s THR 161 CO 0.00 -0.52 0.90 -0.63 -0.54 0.00 0.00 174.62 173.84 1p05 s ILE 162 N -3.76 4.89 -0.17 2.99 1.01 -0.36 -1.49 121.20 124.32 1p05 s ILE 162 Ca 0.23 1.90 0.09 0.00 0.00 0.00 0.00 60.65 62.86 1p05 s ILE 162 Cb 0.06 -4.25 -0.13 0.00 0.01 0.00 0.00 42.46 38.16 1p05 s ILE 162 CO 0.02 0.20 0.27 0.35 0.00 0.00 0.00 174.94 175.78 1p05 n THR 163 N 3.78 0.00 -3.58 2.92 -2.24 0.37 -1.37 114.28 114.17 1p05 n THR 163 Ca 0.04 -0.24 -0.09 0.00 -2.27 0.00 0.00 64.05 61.49 1p05 n THR 163 Cb 0.51 0.56 -0.05 0.00 -2.10 0.00 0.00 70.33 69.25 1p05 n THR 163 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1p05 s ALA 164 N -2.35 -1.95 0.27 6.98 0.00 -1.12 -4.92 121.76 118.67 1p05 s ALA 164 Ca -0.01 1.57 0.11 0.00 0.00 0.00 0.00 51.96 53.64 1p05 s ALA 164 Cb 0.06 -0.68 -0.05 0.00 0.00 0.00 0.00 23.12 22.46 1p05 s ALA 164 CO 0.38 -0.35 -0.19 0.15 0.00 0.00 0.00 175.76 175.75 1p05 s LYS 165 N -1.34 1.63 -0.99 0.00 1.02 -1.26 0.13 119.74 118.93 1p05 s LYS 165 Ca 0.01 -1.74 -0.04 0.00 0.02 0.00 0.00 55.97 54.21 1p05 s LYS 165 Cb -0.01 -1.68 0.00 0.00 -0.52 0.00 0.00 37.83 35.63 1p05 s LYS 165 CO -0.01 0.31 0.85 -1.71 -0.92 0.00 0.00 175.35 173.88 1p05 n ASN 166 N -0.58 -4.06 -4.87 2.83 4.05 -0.12 -4.94 115.26 107.57 1p05 n ASN 166 Ca -0.05 -0.44 -0.35 0.00 0.45 0.00 0.00 54.58 54.19 1p05 n ASN 166 Cb 0.60 -4.01 -0.05 0.00 1.23 0.00 0.00 39.78 37.55 1p05 n ASN 166 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1p05 s VAL 167 N -3.26 5.21 -0.18 3.44 1.01 0.39 -4.57 120.40 122.44 1p05 s VAL 167 Ca 0.27 0.33 -0.12 0.00 0.00 0.00 0.00 61.98 62.46 1p05 s VAL 167 Cb -0.12 -3.60 -0.05 0.00 0.00 0.00 0.00 36.38 32.61 1p05 s VAL 167 CO 0.56 0.36 0.23 -0.89 0.00 0.00 0.00 175.10 175.36 1p05 s THR 168 N -1.31 5.35 -0.16 3.92 2.01 -1.26 0.11 115.64 124.30 1p05 s THR 168 Ca 0.29 0.40 -0.06 0.00 0.31 0.00 0.00 61.69 62.63 1p05 s THR 168 Cb -0.14 -3.57 -0.04 0.00 0.01 0.00 0.00 72.50 68.77 1p05 s THR 168 CO 0.16 0.40 0.04 0.00 -0.69 0.00 0.00 174.62 174.53 1p05 s ALA 169 N 0.48 3.33 -1.06 7.40 0.00 0.19 -4.94 121.76 127.16 1p05 s ALA 169 Ca 0.13 -0.76 -0.16 0.00 0.00 0.00 0.00 51.96 51.17 1p05 s ALA 169 Cb -0.12 -1.79 0.16 0.00 0.00 0.00 0.00 23.12 21.37 1p05 s ALA 169 CO 0.02 0.26 1.25 -0.80 0.00 0.00 0.00 175.76 176.49 1p05 s ASN 170 N 0.13 6.88 0.69 0.00 0.01 -1.26 -1.18 114.94 120.20 1p05 s ASN 170 Ca 0.03 -2.60 -0.11 0.00 -0.71 0.00 0.00 52.86 49.48 1p05 s ASN 170 Cb -0.13 -2.38 0.00 0.00 0.41 0.00 0.00 41.25 39.16 1p05 s ASN 170 CO 0.01 -0.85 1.08 -0.31 -1.51 0.00 0.00 177.10 175.51 1p05 s TYR 171 N 1.85 3.35 0.26 2.20 4.12 -1.10 -4.95 117.35 123.09 1p05 s TYR 171 Ca 0.37 1.14 -0.03 0.00 0.02 0.00 0.00 57.07 58.56 1p05 s TYR 171 Cb -0.04 -2.97 0.37 0.00 -1.52 0.00 0.00 41.96 37.79 1p05 s TYR 171 CO -0.05 -1.10 1.89 0.00 0.02 0.00 0.00 175.55 176.31 1p05 h ALA 172 N -0.60 1.36 0.00 3.71 0.00 -2.02 -1.58 119.26 120.12 1p05 h ALA 172 Ca -0.45 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1p05 h ALA 172 Cb 1.24 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1p05 h ALA 172 CO 0.63 0.49 0.00 0.93 0.00 0.00 0.00 179.25 181.30 1p05 h GLU 174 N 1.22 0.00 0.00 0.00 3.07 -2.00 -3.49 114.58 113.38 1p05 h GLU 174 Ca 0.42 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.28 1p05 h GLU 174 Cb 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.00 1p05 h GLU 174 CO -0.15 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 177.87 1p05 n GLY 175 N 0.13 2.70 3.79 -3.84 0.00 -0.60 -4.83 105.19 102.54 1p05 n GLY 175 Ca 0.02 -1.53 -0.35 0.00 0.00 0.00 0.00 46.02 44.16 1p05 n GLY 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p05 s ALA 176 N -1.96 2.93 -0.22 4.61 0.00 -1.26 -2.70 121.76 123.15 1p05 s ALA 176 Ca 0.00 0.71 0.02 0.00 0.00 0.00 0.00 51.96 52.69 1p05 s ALA 176 Cb 0.00 -3.29 0.04 0.00 0.00 0.00 0.00 23.12 19.87 1p05 s ALA 176 CO 0.00 -0.39 -0.13 0.08 0.00 0.00 0.00 175.76 175.32 1p05 s VAL 177 N -1.79 2.01 0.41 0.00 1.01 -0.33 0.24 120.40 121.94 1p05 s VAL 177 Ca 0.65 -1.29 0.04 0.00 0.00 0.00 0.00 61.98 61.38 1p05 s VAL 177 Cb -0.21 -2.02 -0.00 0.00 0.00 0.00 0.00 36.38 34.15 1p05 s VAL 177 CO 0.25 0.18 0.59 -0.13 0.00 0.00 0.00 175.10 175.99 1p05 s ARG 178 N 1.23 3.01 -1.40 2.72 0.52 0.51 0.56 118.95 126.10 1p05 s ARG 178 Ca -0.03 -0.82 0.00 0.00 -0.52 0.00 0.00 55.73 54.36 1p05 s ARG 178 Cb -0.17 -2.68 0.00 0.00 0.52 0.00 0.00 34.95 32.61 1p05 s ARG 178 CO -0.08 -0.17 0.00 0.41 0.02 0.00 0.00 175.30 175.47 1p05 n GLY 179 N -1.90 -0.04 3.84 -3.53 0.00 -1.10 -4.77 105.19 97.69 1p05 n GLY 179 Ca 0.02 -0.23 -0.32 0.00 0.00 0.00 0.00 46.02 45.49 1p05 n GLY 179 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1p05 s LEU 180 N -4.43 3.76 -0.09 0.99 1.43 0.30 -4.31 118.68 116.34 1p05 s LEU 180 Ca 0.00 1.52 -0.05 0.00 -1.03 0.00 0.00 54.13 54.58 1p05 s LEU 180 Cb 0.00 -4.42 -0.04 0.00 0.03 0.00 0.00 46.19 41.76 1p05 s LEU 180 CO 0.00 -0.48 0.11 -0.89 0.23 0.00 0.00 176.35 175.32 1p05 s THR 181 N -2.43 5.14 -0.13 5.49 2.01 -0.51 0.15 115.64 125.35 1p05 s THR 181 Ca 0.58 -0.01 -0.02 0.00 0.31 0.00 0.00 61.69 62.55 1p05 s THR 181 Cb -0.10 -3.26 -0.03 0.00 0.01 0.00 0.00 72.50 69.13 1p05 s THR 181 CO 0.26 0.55 -0.04 -1.58 -0.69 0.00 0.00 174.62 173.11 1p05 s GLN 182 N -1.19 3.40 0.34 4.92 0.74 0.35 -1.88 119.66 126.34 1p05 s GLN 182 Ca 0.17 -0.52 0.09 0.00 0.05 0.00 0.00 55.36 55.15 1p05 s GLN 182 Cb -0.12 -2.82 -0.06 0.00 1.10 0.00 0.00 33.01 31.10 1p05 s GLN 182 CO 0.07 0.38 -0.08 0.20 -0.55 0.00 0.00 175.29 175.31 1p05 s GLY 183 N -0.02 2.15 -0.14 2.59 0.00 -0.44 0.14 107.32 111.60 1p05 s GLY 183 Ca 0.01 -2.07 0.18 0.00 0.00 0.00 0.00 44.72 42.83 1p05 s GLY 183 CO 0.03 -2.00 1.24 1.16 0.00 0.00 0.00 173.10 173.52 1p05 n ASN 184 N -0.77 2.85 -4.78 1.64 0.23 -0.56 -2.45 115.26 111.42 1p05 n ASN 184 Ca -0.05 -3.03 -0.35 0.00 -0.53 0.00 0.00 54.58 50.62 1p05 n ASN 184 Cb 0.64 -0.46 -0.01 0.00 -2.08 0.00 0.00 39.78 37.87 1p05 n ASN 184 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1p05 s ALA 190 N -2.81 2.76 0.60 -2.53 0.00 -1.26 -4.79 121.76 113.73 1p05 s ALA 190 Ca 0.35 0.76 -0.05 0.00 0.00 0.00 0.00 51.96 53.01 1p05 s ALA 190 Cb 0.29 -3.33 0.02 0.00 0.00 0.00 0.00 23.12 20.10 1p05 s ALA 190 CO 0.05 -0.62 0.90 0.00 0.00 0.00 0.00 175.76 176.09 1p05 s MET 192 N -5.00 1.31 0.26 0.00 0.23 -1.26 -4.75 119.30 110.09 1p05 s MET 192 Ca 0.54 -0.62 -0.04 0.00 -1.03 0.00 0.00 55.69 54.55 1p05 s MET 192 Cb -0.11 0.51 -0.02 0.00 -1.53 0.00 0.00 34.83 33.69 1p05 s MET 192 CO 0.45 -0.59 0.32 0.20 -2.03 0.00 0.00 175.02 173.37 1p05 s GLY 192 N -2.79 1.31 0.20 3.16 0.00 -1.26 -2.47 107.32 105.47 1p05 s GLY 192 Ca 0.07 -1.48 -0.32 0.00 0.00 0.00 0.00 44.72 42.99 1p05 s GLY 192 CO -0.03 -1.10 1.64 0.54 0.00 0.00 0.00 173.10 174.15 1p05 n ARG 192 N -0.41 2.52 0.00 2.90 1.74 -0.41 -1.35 116.66 121.65 1p05 n ARG 192 Ca 0.01 0.91 0.00 0.00 -0.77 0.00 0.00 57.85 58.00 1p05 n ARG 192 Cb 0.63 -2.71 0.00 0.00 -1.02 0.00 0.00 32.46 29.37 1p05 n ARG 192 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1p05 n GLY 193 N 3.47 2.84 0.24 -0.13 0.00 -1.26 -4.72 105.19 105.62 1p05 n GLY 193 Ca 0.15 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.30 1p05 n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1p05 h ASP 194 N 0.00 0.00 -2.22 1.61 3.45 -1.56 -3.26 116.42 114.44 1p05 h ASP 194 Ca 0.00 0.00 -0.62 0.00 0.43 0.00 0.00 57.03 56.84 1p05 h ASP 194 Cb 0.00 0.00 0.10 0.00 -0.56 0.00 0.00 39.33 38.87 1p05 h ASP 194 CO 0.00 0.07 0.08 -1.20 -1.57 0.00 0.00 179.24 176.63 1p05 n SER 195 N -3.15 1.04 0.00 6.45 7.64 -1.26 -0.95 113.62 123.39 1p05 n SER 195 Ca 0.02 1.17 0.00 0.00 1.01 0.00 0.00 58.87 61.07 1p05 n SER 195 Cb 0.44 -1.24 0.00 0.00 -1.01 0.00 0.00 64.21 62.40 1p05 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1p05 n GLY 196 N 1.45 2.98 3.74 0.23 0.00 0.17 -1.40 105.19 112.36 1p05 n GLY 196 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 1p05 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1p05 s GLY 197 N -1.87 1.67 0.46 -0.02 0.00 -0.12 -2.45 107.32 104.98 1p05 s GLY 197 Ca 0.00 0.32 -0.24 0.00 0.00 0.00 0.00 44.72 44.80 1p05 s GLY 197 CO 0.00 0.69 1.24 -0.56 0.00 0.00 0.00 173.10 174.47 1p05 s SER 198 N -3.21 6.06 -0.14 1.64 0.01 -1.17 -0.86 113.70 116.02 1p05 s SER 198 Ca 0.63 2.48 0.02 0.00 1.31 0.00 0.00 55.95 60.39 1p05 s SER 198 Cb -0.19 -2.62 0.01 0.00 0.21 0.00 0.00 66.02 63.44 1p05 s SER 198 CO 0.57 -1.00 -0.21 0.26 0.41 0.00 0.00 173.24 173.26 1p05 s TRP 199 N -1.42 2.59 0.05 2.43 0.52 -0.21 -1.34 118.94 121.57 1p05 s TRP 199 Ca 0.63 -1.33 -0.15 0.00 0.02 0.00 0.00 56.10 55.26 1p05 s TRP 199 Cb -0.33 -1.78 0.03 0.00 -1.15 0.00 0.00 33.47 30.23 1p05 s TRP 199 CO 0.41 -0.62 0.35 -1.50 0.02 0.00 0.00 176.95 175.61 1p05 s ILE 200 N 0.90 0.07 0.51 2.03 2.07 0.91 -0.67 121.20 127.02 1p05 s ILE 200 Ca -0.06 -0.60 -0.02 0.00 -1.41 0.00 0.00 60.65 58.56 1p05 s ILE 200 Cb -0.15 -0.98 0.00 0.00 0.13 0.00 0.00 42.46 41.46 1p05 s ILE 200 CO -0.03 -0.33 0.76 0.42 -1.91 0.00 0.00 174.94 173.85 1p05 s THR 201 N -2.68 3.82 0.40 4.00 -4.23 -0.11 -1.50 115.64 115.33 1p05 s THR 201 Ca -0.04 -0.31 0.08 0.00 -1.18 0.00 0.00 61.69 60.24 1p05 s THR 201 Cb -0.00 -3.45 0.29 0.00 1.34 0.00 0.00 72.50 70.68 1p05 s THR 201 CO -0.04 -0.37 2.01 0.77 -0.54 0.00 0.00 174.62 176.45 1p05 h SER 202 N 0.17 0.50 0.14 3.99 4.64 -1.91 0.17 113.55 121.26 1p05 h SER 202 Ca -0.46 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1p05 h SER 202 Cb 1.26 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1p05 h SER 202 CO 0.58 0.34 0.00 0.00 -0.87 0.00 0.00 176.83 176.88 1p05 n ALA 203 N -2.48 2.12 -0.45 5.18 0.00 -1.26 -4.88 120.51 118.74 1p05 n ALA 203 Ca 0.07 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1p05 n ALA 203 Cb 0.19 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.33 1p05 n ALA 203 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p05 n GLY 207 N 0.24 0.76 3.61 0.00 0.00 0.05 -4.72 105.19 105.13 1p05 n GLY 207 Ca 0.12 -0.09 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 1p05 n GLY 207 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1p05 s GLN 208 N -0.61 4.00 -0.02 1.61 -1.52 -1.26 0.79 119.66 122.66 1p05 s GLN 208 Ca 0.00 0.16 -0.30 0.00 -1.95 0.00 0.00 55.36 53.26 1p05 s GLN 208 Cb 0.00 -3.67 -0.04 0.00 -0.22 0.00 0.00 33.01 29.07 1p05 s GLN 208 CO 0.00 -0.35 1.27 0.00 -0.25 0.00 0.00 175.29 175.96 1p05 s ALA 209 N 2.22 3.51 -0.21 6.09 0.00 0.31 -0.94 121.76 132.75 1p05 s ALA 209 Ca 0.18 0.75 0.12 0.00 0.00 0.00 0.00 51.96 53.02 1p05 s ALA 209 Cb -0.16 -3.53 -0.22 0.00 0.00 0.00 0.00 23.12 19.21 1p05 s ALA 209 CO 0.10 -0.77 0.02 1.04 0.00 0.00 0.00 175.76 176.15 1p05 n GLN 210 N 5.06 0.68 -3.83 0.00 1.13 0.15 -4.48 117.38 116.09 1p05 n GLN 210 Ca 0.11 0.07 0.00 0.00 -1.94 0.00 0.00 57.00 55.24 1p05 n GLN 210 Cb 0.45 -1.54 0.00 0.00 0.11 0.00 0.00 30.24 29.26 1p05 n GLN 210 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1p05 n GLY 211 N 1.91 -1.33 3.31 1.08 0.00 -1.18 -1.42 105.19 107.56 1p05 n GLY 211 Ca -0.36 -1.15 -0.27 0.00 0.00 0.00 0.00 46.02 44.24 1p05 n GLY 211 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1p05 s VAL 212 N -3.00 1.89 0.17 1.61 -7.23 -0.68 -1.05 120.40 112.11 1p05 s VAL 212 Ca 0.00 -1.43 -0.31 0.00 -1.81 0.00 0.00 61.98 58.43 1p05 s VAL 212 Cb 0.00 -1.66 -0.10 0.00 0.56 0.00 0.00 36.38 35.18 1p05 s VAL 212 CO 0.00 0.16 1.53 -0.32 -0.31 0.00 0.00 175.10 176.16 1p05 s MET 213 N -1.52 4.23 -0.06 4.82 1.75 -0.04 -0.76 119.30 127.71 1p05 s MET 213 Ca 0.09 2.32 -0.09 0.00 -1.25 0.00 0.00 55.69 56.76 1p05 s MET 213 Cb -0.10 -3.16 -0.03 0.00 2.84 0.00 0.00 34.83 34.38 1p05 s MET 213 CO 0.03 -0.57 -0.18 0.45 -0.65 0.00 0.00 175.02 174.10 1p05 n SER 214 N 3.79 1.37 -0.23 1.11 2.88 0.25 0.46 113.62 123.25 1p05 n SER 214 Ca 0.13 0.22 0.00 0.00 -1.33 0.00 0.00 58.87 57.88 1p05 n SER 214 Cb 0.39 -0.54 0.00 0.00 -0.75 0.00 0.00 64.21 63.31 1p05 n SER 214 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1p05 n GLY 215 N 2.25 0.88 0.00 0.46 0.00 -0.92 -4.85 105.19 103.01 1p05 n GLY 215 Ca -0.07 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.29 1p05 n GLY 215 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p05 n GLY 216 N 0.00 -0.78 3.37 -0.02 0.00 -1.26 0.64 105.19 107.14 1p05 n GLY 216 Ca 0.00 -1.15 -0.45 0.00 0.00 0.00 0.00 46.02 44.43 1p05 n GLY 216 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1p05 s ASN 217 N -4.00 6.18 0.00 1.61 4.22 -0.94 -5.02 114.94 117.00 1p05 s ASN 217 Ca 0.00 -1.47 -0.02 0.00 -2.14 0.00 0.00 52.86 49.23 1p05 s ASN 217 Cb 0.00 -2.29 -0.04 0.00 1.28 0.00 0.00 41.25 40.20 1p05 s ASN 217 CO 0.00 -1.09 0.19 0.68 -2.04 0.00 0.00 177.10 174.84 1p05 s VAL 217 N 2.58 5.42 0.67 3.54 -7.23 -1.26 -4.38 120.40 119.75 1p05 s VAL 217 Ca 0.11 -0.18 -0.05 0.00 -1.81 0.00 0.00 61.98 60.05 1p05 s VAL 217 Cb -0.25 -3.56 0.14 0.00 0.56 0.00 0.00 36.38 33.28 1p05 s VAL 217 CO 0.06 0.30 0.92 0.00 -0.31 0.00 0.00 175.10 176.07 1p05 n GLN 217 N 0.84 -0.34 0.25 4.82 1.13 -0.22 -4.90 117.38 118.96 1p05 n GLN 217 Ca -0.10 -2.09 0.17 0.00 -1.94 0.00 0.00 57.00 53.04 1p05 n GLN 217 Cb 0.52 -0.74 0.89 0.00 0.11 0.00 0.00 30.24 31.02 1p05 n GLN 217 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1p05 h SER 217 N -0.81 0.00 -0.08 1.08 4.64 -2.00 -0.52 113.55 115.87 1p05 h SER 217 Ca -0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 1p05 h SER 217 Cb 1.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 1p05 h SER 217 CO 0.28 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 175.78 1p05 n ASN 217 N -3.67 0.52 0.00 4.97 6.94 -1.26 -4.90 115.26 117.85 1p05 n ASN 217 Ca -0.00 -1.84 0.00 0.00 -0.02 0.00 0.00 54.58 52.72 1p05 n ASN 217 Cb 0.24 -0.06 0.00 0.00 -2.36 0.00 0.00 39.78 37.61 1p05 n ASN 217 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1p05 n GLY 217 N 0.73 0.79 3.31 4.83 0.00 -0.20 -5.02 105.19 109.64 1p05 n GLY 217 Ca 0.07 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 1p05 n GLY 217 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1p05 n ASN 218 N 0.00 -1.44 -0.34 1.61 0.23 -1.26 -1.29 115.26 112.77 1p05 n ASN 218 Ca 0.00 -2.80 0.08 0.00 -0.53 0.00 0.00 54.58 51.33 1p05 n ASN 218 Cb 0.00 2.63 0.15 0.00 -2.08 0.00 0.00 39.78 40.48 1p05 n ASN 218 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 1p05 n ASN 219 N -1.62 1.92 0.08 0.53 0.23 -1.03 -1.05 115.26 114.32 1p05 n ASN 219 Ca -0.01 -3.27 0.13 0.00 -0.53 0.00 0.00 54.58 50.90 1p05 n ASN 219 Cb 0.57 -0.45 0.35 0.00 -2.08 0.00 0.00 39.78 38.17 1p05 n ASN 219 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1p05 n GLY 221 N 1.33 1.96 3.38 0.00 0.00 -1.26 -4.88 105.19 105.72 1p05 n GLY 221 Ca 0.05 -0.66 -0.29 0.00 0.00 0.00 0.00 46.02 45.12 1p05 n GLY 221 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1p05 s ILE 221 N -1.43 2.21 0.54 -0.61 -4.36 -1.24 -5.11 121.20 111.20 1p05 s ILE 221 Ca 0.41 -1.68 -0.20 0.00 -0.26 0.00 0.00 60.65 58.92 1p05 s ILE 221 Cb 0.23 -1.94 -0.05 0.00 1.25 0.00 0.00 42.46 41.95 1p05 s ILE 221 CO 0.25 0.14 1.20 -2.16 0.24 0.00 0.00 174.94 174.60 1p05 s PRO 221 N -1.89 3.28 0.31 0.37 0.04 -1.26 -4.86 135.00 130.99 1p05 s PRO 221 Ca 0.13 1.83 0.07 0.00 0.04 0.00 0.00 61.00 63.07 1p05 s PRO 221 Cb -0.10 -2.11 0.84 0.00 0.04 0.00 0.00 34.50 33.17 1p05 s PRO 221 CO 0.05 -0.96 1.69 0.00 0.04 0.00 0.00 177.00 177.83 1p05 h ALA 221 N 1.33 1.62 -0.04 8.56 0.00 -1.93 0.17 119.26 128.98 1p05 h ALA 221 Ca -0.50 0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.58 1p05 h ALA 221 Cb 1.28 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 19.19 1p05 h ALA 221 CO 0.57 -0.38 0.09 0.66 0.00 0.00 0.00 179.25 180.19 1p05 h SER 222 N 0.42 0.00 -0.15 0.00 4.64 -1.91 -2.16 113.55 114.39 1p05 h SER 222 Ca 0.62 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.94 1p05 h SER 222 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1p05 h SER 222 CO -0.54 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.42 1p05 n GLN 223 N -3.38 1.57 -3.12 4.77 6.02 0.60 -5.00 117.38 118.85 1p05 n GLN 223 Ca -0.02 -1.63 -0.36 0.00 -0.01 0.00 0.00 57.00 54.98 1p05 n GLN 223 Cb 0.17 -1.30 -0.06 0.00 1.02 0.00 0.00 30.24 30.06 1p05 n GLN 223 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1p05 s ARG 224 N -1.15 4.22 -0.23 -1.09 0.52 -0.82 -4.98 118.95 115.42 1p05 s ARG 224 Ca 0.21 0.83 0.01 0.00 -0.52 0.00 0.00 55.73 56.26 1p05 s ARG 224 Cb 0.13 -2.87 0.06 0.00 0.52 0.00 0.00 34.95 32.79 1p05 s ARG 224 CO 0.19 0.40 -0.06 0.45 0.02 0.00 0.00 175.30 176.29 1p05 s SER 225 N -1.67 3.80 -0.18 0.23 0.15 -1.26 -4.67 113.70 110.10 1p05 s SER 225 Ca 0.43 -1.14 0.01 0.00 0.70 0.00 0.00 55.95 55.95 1p05 s SER 225 Cb -0.16 -1.21 0.03 0.00 -1.71 0.00 0.00 66.02 62.97 1p05 s SER 225 CO 0.21 -0.22 -0.14 -0.44 1.20 0.00 0.00 173.24 173.85 1p05 s SER 226 N 1.38 3.11 -0.08 5.45 0.01 -1.03 -2.21 113.70 120.34 1p05 s SER 226 Ca -0.05 -0.70 0.02 0.00 1.31 0.00 0.00 55.95 56.53 1p05 s SER 226 Cb -0.18 -1.29 -0.02 0.00 0.21 0.00 0.00 66.02 64.73 1p05 s SER 226 CO -0.06 -0.08 -0.13 -0.76 0.41 0.00 0.00 173.24 172.62 1p05 s LEU 227 N 1.39 2.81 0.08 2.44 1.43 0.21 -1.32 118.68 125.72 1p05 s LEU 227 Ca 0.02 -0.20 0.07 0.00 -1.03 0.00 0.00 54.13 53.00 1p05 s LEU 227 Cb -0.14 -1.60 -0.03 0.00 0.03 0.00 0.00 46.19 44.45 1p05 s LEU 227 CO -0.10 0.30 -0.20 0.72 0.23 0.00 0.00 176.35 177.30 1p05 s PHE 228 N -0.44 1.68 -0.09 0.29 -0.12 -0.79 -0.58 117.98 117.92 1p05 s PHE 228 Ca 0.06 -0.41 -0.26 0.00 -0.05 0.00 0.00 56.93 56.26 1p05 s PHE 228 Cb -0.12 -0.94 -0.02 0.00 -0.63 0.00 0.00 43.02 41.30 1p05 s PHE 228 CO 0.02 0.16 0.83 -2.00 -0.05 0.00 0.00 175.22 174.18 1p05 s GLU 229 N -1.72 4.41 0.39 1.99 2.56 0.06 -1.43 118.70 124.95 1p05 s GLU 229 Ca 0.05 1.09 -0.26 0.00 0.00 0.00 0.00 54.97 55.85 1p05 s GLU 229 Cb -0.10 -3.51 -0.11 0.00 2.00 0.00 0.00 34.13 32.42 1p05 s GLU 229 CO 0.03 -0.14 1.26 0.54 -0.56 0.00 0.00 175.26 176.39 1p05 n ARG 230 N 4.46 1.96 0.10 4.30 1.74 -1.26 -1.69 116.66 126.27 1p05 n ARG 230 Ca 0.03 0.69 -0.18 0.00 -0.77 0.00 0.00 57.85 57.63 1p05 n ARG 230 Cb 0.50 -2.34 -0.11 0.00 -1.02 0.00 0.00 32.46 29.49 1p05 n ARG 230 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1p05 h LEU 231 N 2.21 0.62 -0.72 0.55 5.85 -1.56 -3.38 115.31 118.89 1p05 h LEU 231 Ca -0.47 -0.59 0.10 0.00 0.84 0.00 0.00 57.88 57.76 1p05 h LEU 231 Cb 1.29 -0.20 -0.12 0.00 0.37 0.00 0.00 40.66 42.01 1p05 h LEU 231 CO 0.61 1.42 -0.43 1.56 -0.34 0.00 0.00 178.44 181.26 1p05 h GLN 232 N 0.18 -0.14 0.00 1.25 4.20 -1.89 -0.45 115.11 118.25 1p05 h GLN 232 Ca -0.15 0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.49 1p05 h GLN 232 Cb 1.86 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 29.66 1p05 h GLN 232 CO 0.21 -0.09 -0.39 -1.00 -0.67 0.00 0.00 178.83 176.88 1p05 h PRO 233 N -0.15 0.00 -0.40 1.46 0.13 -2.00 -1.60 132.00 129.45 1p05 h PRO 233 Ca 0.22 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 65.20 1p05 h PRO 233 Cb 0.55 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.68 1p05 h PRO 233 CO -0.78 0.39 -0.33 0.82 -0.23 0.00 0.00 178.00 177.87 1p05 h ILE 234 N 0.00 1.27 -0.66 -3.56 2.04 -1.33 0.15 117.51 115.42 1p05 h ILE 234 Ca -0.00 -1.50 -0.06 0.00 1.00 0.00 0.00 64.86 64.29 1p05 h ILE 234 Cb 0.71 1.31 -0.03 0.00 -0.74 0.00 0.00 36.82 38.08 1p05 h ILE 234 CO 0.05 0.50 0.16 -0.07 0.00 0.00 0.00 178.15 178.80 1p05 h LEU 235 N 0.76 0.99 0.07 1.44 3.38 -0.18 -2.08 115.31 119.68 1p05 h LEU 235 Ca 0.08 -0.20 -0.25 0.00 0.09 0.00 0.00 57.88 57.59 1p05 h LEU 235 Cb 0.91 -0.26 0.02 0.00 0.09 0.00 0.00 40.66 41.43 1p05 h LEU 235 CO 0.08 0.95 -1.04 0.77 0.09 0.00 0.00 178.44 179.29 1p05 h SER 235 N 1.00 0.79 -0.97 -0.43 4.64 -1.38 0.29 113.55 117.48 1p05 h SER 235 Ca 0.21 -0.80 0.13 0.00 -0.47 0.00 0.00 61.79 60.86 1p05 h SER 235 Cb 0.35 -0.25 -0.09 0.00 -0.31 0.00 0.00 62.40 62.10 1p05 h SER 235 CO 0.00 1.50 0.60 -0.61 -0.87 0.00 0.00 176.83 177.45 1p05 h GLN 236 N 0.18 0.89 -0.03 4.77 4.15 -0.64 -2.48 115.11 121.94 1p05 h GLN 236 Ca -0.15 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.22 1p05 h GLN 236 Cb 1.73 -0.20 0.00 0.00 0.21 0.00 0.00 27.48 29.22 1p05 h GLN 236 CO 0.20 0.59 0.00 0.66 -1.93 0.00 0.00 178.83 178.35 1p05 n TYR 237 N -4.67 0.01 -2.37 3.99 0.53 -0.79 -4.96 117.16 108.90 1p05 n TYR 237 Ca 0.19 -0.01 -0.08 0.00 -1.02 0.00 0.00 57.90 56.98 1p05 n TYR 237 Cb 0.38 -0.00 0.01 0.00 -1.03 0.00 0.00 39.34 38.70 1p05 n TYR 237 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1p05 n GLY 238 N 1.21 0.13 3.95 2.72 0.00 0.41 -5.02 105.19 108.60 1p05 n GLY 238 Ca 0.13 -0.48 -0.23 0.00 0.00 0.00 0.00 46.02 45.43 1p05 n GLY 238 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1p05 s LEU 239 N -2.63 4.12 -0.05 0.99 1.43 0.73 -4.71 118.68 118.55 1p05 s LEU 239 Ca 0.06 0.32 0.06 0.00 -1.03 0.00 0.00 54.13 53.55 1p05 s LEU 239 Cb -0.03 -3.16 -0.01 0.00 0.03 0.00 0.00 46.19 43.02 1p05 s LEU 239 CO 0.08 -0.22 -0.25 -0.44 0.23 0.00 0.00 176.35 175.75 1p05 s SER 240 N -4.00 3.00 0.31 2.29 0.01 0.86 -4.74 113.70 111.44 1p05 s SER 240 Ca 0.38 -0.50 -0.28 0.00 1.31 0.00 0.00 55.95 56.86 1p05 s SER 240 Cb -0.09 -0.76 -0.09 0.00 0.21 0.00 0.00 66.02 65.28 1p05 s SER 240 CO 0.34 0.25 1.13 -0.22 0.41 0.00 0.00 173.24 175.14 1p05 s LEU 241 N -0.21 4.45 0.07 2.44 2.96 -1.26 -0.57 118.68 126.56 1p05 s LEU 241 Ca -0.02 2.31 -0.24 0.00 -0.22 0.00 0.00 54.13 55.97 1p05 s LEU 241 Cb -0.13 -3.73 -0.06 0.00 0.50 0.00 0.00 46.19 42.77 1p05 s LEU 241 CO 0.03 -0.29 0.71 -0.69 -1.32 0.00 0.00 176.35 174.79 1p05 s VAL 242 N -1.24 4.68 0.15 1.68 1.01 -0.42 -4.86 120.40 121.40 1p05 s VAL 242 Ca 0.48 1.53 0.02 0.00 0.00 0.00 0.00 61.98 64.01 1p05 s VAL 242 Cb -0.32 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 31.96 1p05 s VAL 242 CO 0.41 0.43 -0.03 0.42 0.00 0.00 0.00 175.10 176.33 1p05 s THR 243 N -0.45 0.77 0.00 3.92 -4.23 -1.26 -4.49 115.64 109.90 1p05 s THR 243 Ca 0.35 -1.98 0.00 0.00 -1.18 0.00 0.00 61.69 58.88 1p05 s THR 243 Cb -0.21 -1.96 0.00 0.00 1.34 0.00 0.00 72.50 71.68 1p05 s THR 243 CO 0.22 -0.63 0.00 0.61 -0.54 0.00 0.00 174.62 174.28