#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t89 s PRO 6 N 0.00 1.56 0.08 3.23 0.02 -1.26 -4.40 135.00 134.22 1t89 s PRO 6 Ca 0.00 0.32 -0.04 0.00 0.02 0.00 0.00 61.00 61.31 1t89 s PRO 6 Cb 0.00 -1.88 -0.05 0.00 0.02 0.00 0.00 34.50 32.59 1t89 s PRO 6 CO 0.00 -1.92 0.29 -1.59 -0.33 0.00 0.00 177.00 173.45 1t89 s LYS 7 N -5.32 3.55 0.74 5.54 -2.85 -1.26 -0.21 119.74 119.93 1t89 s LYS 7 Ca 0.63 -0.20 -0.11 0.00 -1.00 0.00 0.00 55.97 55.29 1t89 s LYS 7 Cb -0.14 -2.98 0.03 0.00 -2.06 0.00 0.00 37.83 32.69 1t89 s LYS 7 CO 0.53 0.57 1.08 0.00 0.10 0.00 0.00 175.35 177.62 1t89 s ALA 8 N -1.51 2.50 -0.01 0.59 0.00 -1.16 -4.82 121.76 117.35 1t89 s ALA 8 Ca 0.35 -0.05 0.03 0.00 0.00 0.00 0.00 51.96 52.30 1t89 s ALA 8 Cb -0.13 -3.14 -0.01 0.00 0.00 0.00 0.00 23.12 19.84 1t89 s ALA 8 CO 0.23 -1.43 -0.11 0.08 0.00 0.00 0.00 175.76 174.53 1t89 s VAL 9 N -3.10 0.88 -0.17 0.00 1.01 -0.93 -3.99 120.40 114.10 1t89 s VAL 9 Ca 0.59 -0.47 -0.07 0.00 0.00 0.00 0.00 61.98 62.03 1t89 s VAL 9 Cb -0.14 -0.74 -0.04 0.00 0.00 0.00 0.00 36.38 35.46 1t89 s VAL 9 CO 0.55 0.25 0.08 -0.69 0.00 0.00 0.00 175.10 175.29 1t89 s VAL 10 N -0.19 4.97 0.17 2.92 1.01 -1.26 -0.95 120.40 127.08 1t89 s VAL 10 Ca 0.03 0.03 0.10 0.00 0.00 0.00 0.00 61.98 62.14 1t89 s VAL 10 Cb -0.05 -3.23 -0.04 0.00 0.00 0.00 0.00 36.38 33.06 1t89 s VAL 10 CO -0.00 0.49 -0.23 -0.36 0.00 0.00 0.00 175.10 175.00 1t89 s PHE 11 N 0.09 2.11 0.07 5.22 0.40 0.30 -4.93 117.98 121.24 1t89 s PHE 11 Ca 0.06 -0.40 0.04 0.00 -0.60 0.00 0.00 56.93 56.04 1t89 s PHE 11 Cb -0.12 -1.07 -0.04 0.00 0.51 0.00 0.00 43.02 42.30 1t89 s PHE 11 CO 0.00 0.40 0.00 -0.51 0.70 0.00 0.00 175.22 175.82 1t89 s LEU 12 N -2.49 3.49 -0.22 -0.37 1.43 -1.26 -1.22 118.68 118.04 1t89 s LEU 12 Ca 0.17 -0.13 -0.03 0.00 -1.03 0.00 0.00 54.13 53.10 1t89 s LEU 12 Cb -0.08 -2.17 0.11 0.00 0.03 0.00 0.00 46.19 44.08 1t89 s LEU 12 CO 0.08 0.20 0.29 -0.70 0.23 0.00 0.00 176.35 176.45 1t89 s GLU 13 N -2.14 0.26 0.93 1.70 2.56 -0.91 -3.98 118.70 117.12 1t89 s GLU 13 Ca 0.25 0.34 -0.12 0.00 0.00 0.00 0.00 54.97 55.44 1t89 s GLU 13 Cb -0.12 -0.89 0.15 0.00 2.00 0.00 0.00 34.13 35.27 1t89 s GLU 13 CO 0.17 -0.65 1.11 -1.25 -0.56 0.00 0.00 175.26 174.07 1t89 s PRO 14 N 2.42 0.99 0.00 4.30 0.04 -1.26 -1.57 135.00 139.92 1t89 s PRO 14 Ca 0.09 0.50 0.01 0.00 0.04 0.00 0.00 61.00 61.64 1t89 s PRO 14 Cb -0.16 -1.80 0.09 0.00 0.04 0.00 0.00 34.50 32.66 1t89 s PRO 14 CO -0.14 -2.34 0.62 0.94 0.04 0.00 0.00 177.00 176.12 1t89 n GLN 15 N -3.90 0.55 -2.77 4.56 -0.06 -1.26 -4.76 117.38 109.74 1t89 n GLN 15 Ca 0.06 0.00 -0.42 0.00 -2.00 0.00 0.00 57.00 54.64 1t89 n GLN 15 Cb 0.57 -1.04 -0.03 0.00 -4.06 0.00 0.00 30.24 25.68 1t89 n GLN 15 CO 0.00 0.00 0.00 -1.58 -0.20 0.00 0.00 177.06 175.28 1t89 s TRP 16 N -2.00 3.35 -0.09 3.69 0.52 -1.26 -4.86 118.94 118.29 1t89 s TRP 16 Ca 0.02 1.33 0.13 0.00 0.02 0.00 0.00 56.10 57.61 1t89 s TRP 16 Cb 0.01 -3.16 -0.03 0.00 -1.15 0.00 0.00 33.47 29.15 1t89 s TRP 16 CO 0.02 -0.41 1.33 0.10 0.02 0.00 0.00 176.95 178.00 1t89 h TYR 17 N 7.50 0.00 -3.33 -1.98 -0.00 -1.86 -3.43 116.97 113.87 1t89 h TYR 17 Ca -0.22 0.00 -0.65 0.00 0.00 0.00 0.00 58.73 57.85 1t89 h TYR 17 Cb 1.08 0.00 -0.18 0.00 0.00 0.00 0.00 36.73 37.64 1t89 h TYR 17 CO 0.75 0.63 -0.63 0.45 -0.00 0.00 0.00 178.16 179.36 1t89 s SER 18 N -6.44 5.10 0.22 0.10 0.15 -1.26 -1.19 113.70 110.38 1t89 s SER 18 Ca 0.02 0.02 -0.08 0.00 0.70 0.00 0.00 55.95 56.62 1t89 s SER 18 Cb 0.08 -1.65 -0.02 0.00 -1.71 0.00 0.00 66.02 62.72 1t89 s SER 18 CO 0.77 0.27 0.31 0.68 1.20 0.00 0.00 173.24 176.47 1t89 s VAL 19 N -0.20 0.01 0.53 4.45 -7.23 0.22 -4.94 120.40 113.24 1t89 s VAL 19 Ca 0.05 -1.64 0.03 0.00 -1.81 0.00 0.00 61.98 58.61 1t89 s VAL 19 Cb -0.13 -2.26 0.03 0.00 0.56 0.00 0.00 36.38 34.58 1t89 s VAL 19 CO 0.02 -0.05 0.74 -0.76 -0.31 0.00 0.00 175.10 174.74 1t89 s LEU 20 N -3.07 3.34 0.87 1.32 1.43 -1.26 -0.03 118.68 121.28 1t89 s LEU 20 Ca 0.28 -0.12 -0.12 0.00 -1.03 0.00 0.00 54.13 53.14 1t89 s LEU 20 Cb 0.03 -2.79 0.12 0.00 0.03 0.00 0.00 46.19 43.58 1t89 s LEU 20 CO 0.09 -1.09 1.12 -1.61 0.23 0.00 0.00 176.35 175.10 1t89 s GLU 21 N -4.69 1.46 0.00 1.70 2.02 -0.60 -3.02 118.70 115.58 1t89 s GLU 21 Ca 0.57 0.40 0.00 0.00 0.02 0.00 0.00 54.97 55.96 1t89 s GLU 21 Cb -0.10 -1.87 0.00 0.00 0.10 0.00 0.00 34.13 32.26 1t89 s GLU 21 CO 0.37 -2.00 0.00 1.63 0.02 0.00 0.00 175.26 175.28 1t89 n LYS 22 N -3.65 0.00 -1.00 1.61 4.76 0.36 -4.56 118.16 115.69 1t89 n LYS 22 Ca 0.07 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.20 1t89 n LYS 22 Cb 0.58 -2.53 0.14 0.00 -1.84 0.00 0.00 35.03 31.38 1t89 n LYS 22 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1t89 s ASP 23 N -1.89 3.44 -0.14 4.39 1.11 -1.17 -4.50 116.67 117.93 1t89 s ASP 23 Ca 0.00 1.84 -0.01 0.00 0.18 0.00 0.00 52.55 54.56 1t89 s ASP 23 Cb 0.00 -2.44 -0.02 0.00 1.07 0.00 0.00 42.92 41.53 1t89 s ASP 23 CO 0.00 -2.71 -0.10 -0.44 1.18 0.00 0.00 175.17 173.09 1t89 s SER 24 N -3.09 4.27 0.16 0.27 0.01 -1.26 -0.17 113.70 113.88 1t89 s SER 24 Ca 0.64 -0.26 0.06 0.00 1.31 0.00 0.00 55.95 57.70 1t89 s SER 24 Cb -0.20 -1.65 -0.04 0.00 0.21 0.00 0.00 66.02 64.34 1t89 s SER 24 CO 0.58 0.17 -0.12 -0.69 0.41 0.00 0.00 173.24 173.59 1t89 s VAL 25 N 0.32 1.36 -0.11 3.43 1.01 0.52 -4.53 120.40 122.39 1t89 s VAL 25 Ca -0.08 -2.01 -0.04 0.00 0.00 0.00 0.00 61.98 59.85 1t89 s VAL 25 Cb -0.15 -1.81 0.06 0.00 0.00 0.00 0.00 36.38 34.48 1t89 s VAL 25 CO 0.05 -0.62 0.20 -0.89 0.00 0.00 0.00 175.10 173.84 1t89 s THR 26 N -2.91 -0.32 -0.31 3.92 2.01 -0.61 -0.13 115.64 117.30 1t89 s THR 26 Ca 0.16 0.27 -0.11 0.00 0.31 0.00 0.00 61.69 62.32 1t89 s THR 26 Cb -0.00 -0.39 -0.03 0.00 0.01 0.00 0.00 72.50 72.08 1t89 s THR 26 CO 0.03 0.09 0.20 -0.76 -0.69 0.00 0.00 174.62 173.49 1t89 s LEU 27 N 2.34 4.18 -0.12 4.42 1.43 0.57 -2.15 118.68 129.36 1t89 s LEU 27 Ca 0.03 -0.25 -0.02 0.00 -1.03 0.00 0.00 54.13 52.86 1t89 s LEU 27 Cb -0.12 -2.10 -0.03 0.00 0.03 0.00 0.00 46.19 43.97 1t89 s LEU 27 CO -0.07 -0.14 -0.04 -0.75 0.23 0.00 0.00 176.35 175.57 1t89 s LYS 28 N 1.71 3.29 -1.09 1.70 2.20 -0.35 -0.58 119.74 126.62 1t89 s LYS 28 Ca 0.06 -0.52 -0.05 0.00 -0.36 0.00 0.00 55.97 55.11 1t89 s LYS 28 Cb -0.17 -2.79 0.30 0.00 -1.51 0.00 0.00 37.83 33.67 1t89 s LYS 28 CO 0.10 0.43 1.47 0.00 -0.36 0.00 0.00 175.35 176.98 1t89 n GLN 30 N 1.51 -0.02 0.00 0.00 0.00 -0.12 -4.75 117.38 113.99 1t89 n GLN 30 Ca 0.26 0.07 0.00 0.00 -0.00 0.00 0.00 57.00 57.33 1t89 n GLN 30 Cb 0.34 -2.33 0.00 0.00 0.00 0.00 0.00 30.24 28.24 1t89 n GLN 30 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1t89 n GLY 31 N 0.63 0.93 3.81 1.69 0.00 -1.26 -2.19 105.19 108.80 1t89 n GLY 31 Ca 0.12 -2.05 -0.30 0.00 0.00 0.00 0.00 46.02 43.79 1t89 n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t89 s ALA 32 N -1.07 3.66 0.47 4.61 0.00 -1.26 -5.10 121.76 123.07 1t89 s ALA 32 Ca 0.00 -1.00 0.03 0.00 0.00 0.00 0.00 51.96 50.99 1t89 s ALA 32 Cb 0.00 -1.51 -0.04 0.00 0.00 0.00 0.00 23.12 21.57 1t89 s ALA 32 CO 0.00 0.74 0.02 0.71 0.00 0.00 0.00 175.76 177.22 1t89 s TYR 33 N -1.45 2.11 -0.08 0.00 1.51 -1.26 -4.39 117.35 113.78 1t89 s TYR 33 Ca 0.31 -0.84 -0.25 0.00 -1.01 0.00 0.00 57.07 55.28 1t89 s TYR 33 Cb -0.12 -1.69 -0.03 0.00 -0.11 0.00 0.00 41.96 40.01 1t89 s TYR 33 CO 0.23 0.29 0.77 -1.54 -1.11 0.00 0.00 175.55 174.20 1t89 s SER 34 N -3.83 7.03 0.63 2.29 1.04 -1.26 -4.86 113.70 114.74 1t89 s SER 34 Ca 0.18 1.25 0.25 0.00 0.48 0.00 0.00 55.95 58.11 1t89 s SER 34 Cb 0.05 -2.44 1.28 0.00 0.10 0.00 0.00 66.02 65.00 1t89 s SER 34 CO 0.09 -0.21 1.72 -0.65 0.98 0.00 0.00 173.24 175.17 1t89 h PRO 35 N 6.91 0.00 -4.50 4.02 0.11 -1.99 -3.32 132.00 133.23 1t89 h PRO 35 Ca -0.38 0.00 -0.71 0.00 0.11 0.00 0.00 66.00 65.02 1t89 h PRO 35 Cb 1.18 0.00 -0.31 0.00 0.11 0.00 0.00 31.00 31.99 1t89 h PRO 35 CO 0.77 0.00 -0.52 -1.21 -0.21 0.00 0.00 178.00 176.83 1t89 s GLU 36 N -4.35 2.40 0.07 1.05 2.02 -1.26 -4.87 118.70 113.77 1t89 s GLU 36 Ca -0.03 -1.55 0.00 0.00 0.02 0.00 0.00 54.97 53.41 1t89 s GLU 36 Cb 0.11 -3.65 0.00 0.00 0.10 0.00 0.00 34.13 30.70 1t89 s GLU 36 CO 0.38 -0.95 0.00 -3.47 0.02 0.00 0.00 175.26 171.24 1t89 n ASP 37 N 4.78 -7.90 -3.64 -0.19 -0.08 -1.25 -5.00 116.55 103.27 1t89 n ASP 37 Ca -0.08 1.36 -0.28 0.00 -1.51 0.00 0.00 54.79 54.28 1t89 n ASP 37 Cb 0.42 -4.33 -0.12 0.00 2.34 0.00 0.00 41.12 39.44 1t89 n ASP 37 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1t89 s ASN 38 N -0.46 3.18 0.23 1.67 4.22 -1.25 -4.36 114.94 118.17 1t89 s ASN 38 Ca 0.00 -3.15 0.07 0.00 -2.14 0.00 0.00 52.86 47.63 1t89 s ASN 38 Cb 0.00 -0.98 -0.04 0.00 1.28 0.00 0.00 41.25 41.52 1t89 s ASN 38 CO 0.00 -0.18 0.20 -0.44 -2.04 0.00 0.00 177.10 174.64 1t89 s SER 39 N -0.29 5.58 0.16 3.54 0.01 -1.26 -5.00 113.70 116.44 1t89 s SER 39 Ca 0.25 -0.21 0.08 0.00 1.31 0.00 0.00 55.95 57.39 1t89 s SER 39 Cb -0.08 -1.44 -0.04 0.00 0.21 0.00 0.00 66.02 64.67 1t89 s SER 39 CO -0.12 -0.02 -0.07 -0.89 0.41 0.00 0.00 173.24 172.55 1t89 s THR 40 N -2.05 3.39 -0.10 1.44 2.01 -1.24 -3.76 115.64 115.32 1t89 s THR 40 Ca 0.33 -1.50 0.03 0.00 0.31 0.00 0.00 61.69 60.86 1t89 s THR 40 Cb -0.08 -2.67 0.00 0.00 0.01 0.00 0.00 72.50 69.77 1t89 s THR 40 CO 0.25 -0.06 -0.22 -1.10 -0.69 0.00 0.00 174.62 172.80 1t89 s GLN 41 N -2.72 2.82 -0.01 4.92 -1.52 -0.11 -3.14 119.66 119.90 1t89 s GLN 41 Ca 0.25 -0.80 0.02 0.00 -1.95 0.00 0.00 55.36 52.88 1t89 s GLN 41 Cb -0.09 -2.17 -0.03 0.00 -0.22 0.00 0.00 33.01 30.49 1t89 s GLN 41 CO 0.16 0.13 -0.04 -1.58 -0.25 0.00 0.00 175.29 173.70 1t89 s TRP 42 N 0.47 2.97 -0.20 0.91 0.52 -1.26 -0.44 118.94 121.92 1t89 s TRP 42 Ca -0.16 0.02 0.00 0.00 0.02 0.00 0.00 56.10 55.98 1t89 s TRP 42 Cb -0.17 -1.65 0.05 0.00 -1.15 0.00 0.00 33.47 30.54 1t89 s TRP 42 CO 0.07 0.40 -0.08 -0.06 0.02 0.00 0.00 176.95 177.30 1t89 s PHE 43 N -1.00 2.21 -0.40 -1.98 2.99 0.18 -3.76 117.98 116.23 1t89 s PHE 43 Ca 0.17 -1.48 -0.17 0.00 0.00 0.00 0.00 56.93 55.45 1t89 s PHE 43 Cb -0.11 -1.54 0.01 0.00 0.00 0.00 0.00 43.02 41.38 1t89 s PHE 43 CO 0.07 -0.71 0.43 -1.58 -0.00 0.00 0.00 175.22 173.43 1t89 s HIS 44 N 1.46 3.18 -1.33 0.36 2.46 0.51 -1.29 115.29 120.63 1t89 s HIS 44 Ca -0.02 -0.22 -0.01 0.00 0.47 0.00 0.00 55.06 55.28 1t89 s HIS 44 Cb -0.16 -2.86 0.01 0.00 -0.13 0.00 0.00 32.58 29.43 1t89 s HIS 44 CO -0.08 -0.62 0.70 0.09 -2.47 0.00 0.00 174.74 172.36 1t89 n ASN 45 N 5.59 -1.39 -3.35 9.88 3.02 0.59 -2.57 115.26 127.03 1t89 n ASN 45 Ca -0.07 -0.83 -0.16 0.00 -0.03 0.00 0.00 54.58 53.49 1t89 n ASN 45 Cb 0.48 -3.98 0.04 0.00 -0.61 0.00 0.00 39.78 35.71 1t89 n ASN 45 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1t89 n GLU 46 N -4.31 -1.72 -3.52 3.52 1.02 -1.26 -5.01 120.64 109.35 1t89 n GLU 46 Ca -0.27 0.91 -0.09 0.00 -0.02 0.00 0.00 57.16 57.69 1t89 n GLU 46 Cb 0.67 -5.18 -0.02 0.00 -0.02 0.00 0.00 31.44 26.88 1t89 n GLU 46 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1t89 s SER 47 N -3.29 -0.38 0.00 1.62 0.01 -1.06 -5.11 113.70 105.49 1t89 s SER 47 Ca 0.33 -0.06 0.00 0.00 1.31 0.00 0.00 55.95 57.53 1t89 s SER 47 Cb -0.07 0.45 0.00 0.00 0.21 0.00 0.00 66.02 66.61 1t89 s SER 47 CO 0.78 -0.75 0.00 0.18 0.41 0.00 0.00 173.24 173.87 1t89 n LEU 48 N -0.30 0.00 0.00 2.44 4.32 -1.26 -0.36 117.00 121.83 1t89 n LEU 48 Ca -0.10 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.89 1t89 n LEU 48 Cb 0.62 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.42 1t89 n LEU 48 CO 0.11 0.00 0.00 2.30 -1.22 0.00 0.00 177.39 178.58 1t89 n ILE 49 N 0.00 0.00 -0.48 -0.08 -5.35 -1.25 -4.11 119.36 108.09 1t89 n ILE 49 Ca 0.00 0.00 -0.05 0.00 -0.27 0.00 0.00 62.75 62.43 1t89 n ILE 49 Cb 0.00 0.00 -0.05 0.00 -1.74 0.00 0.00 39.64 37.85 1t89 n ILE 49 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1t89 n SER 50 N 0.00 -0.62 -4.58 7.28 7.64 -1.26 -4.60 113.62 117.49 1t89 n SER 50 Ca 0.00 -0.32 -0.41 0.00 1.01 0.00 0.00 58.87 59.15 1t89 n SER 50 Cb 0.00 -0.20 -0.03 0.00 -1.01 0.00 0.00 64.21 62.97 1t89 n SER 50 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1t89 s SER 51 N 0.00 5.64 0.00 6.43 1.04 -1.26 -4.66 113.70 120.89 1t89 s SER 51 Ca 0.30 0.84 0.00 0.00 0.48 0.00 0.00 55.95 57.57 1t89 s SER 51 Cb -0.19 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.40 1t89 s SER 51 CO 0.13 -1.99 0.00 1.67 0.98 0.00 0.00 173.24 174.03 1t89 n GLN 52 N 8.73 0.00 0.00 4.02 7.27 -1.19 -4.73 117.38 131.48 1t89 n GLN 52 Ca 0.21 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.28 1t89 n GLN 52 Cb 0.49 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.14 1t89 n GLN 52 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1t89 n ALA 53 N -2.82 -0.07 0.27 1.69 0.00 -1.26 -3.72 120.51 114.60 1t89 n ALA 53 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.59 1t89 n ALA 53 Cb 0.00 0.00 0.68 0.00 0.00 0.00 0.00 19.45 20.13 1t89 n ALA 53 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1t89 h SER 54 N 0.00 0.00 -3.51 0.00 4.64 -1.95 -3.33 113.55 109.40 1t89 h SER 54 Ca 0.00 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.71 1t89 h SER 54 Cb 0.00 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 61.69 1t89 h SER 54 CO 0.00 0.08 -0.73 -0.44 -0.87 0.00 0.00 176.83 174.87 1t89 s SER 55 N -5.86 4.03 -0.05 4.97 0.01 -1.26 -1.07 113.70 114.47 1t89 s SER 55 Ca -0.00 -2.27 -0.30 0.00 1.31 0.00 0.00 55.95 54.69 1t89 s SER 55 Cb 0.10 -1.14 -0.05 0.00 0.21 0.00 0.00 66.02 65.14 1t89 s SER 55 CO 0.56 -0.33 1.60 -0.47 0.41 0.00 0.00 173.24 175.02 1t89 s TYR 56 N 0.79 2.15 -0.29 2.43 5.04 0.25 -4.85 117.35 122.87 1t89 s TYR 56 Ca 0.14 0.31 -0.09 0.00 -2.44 0.00 0.00 57.07 54.99 1t89 s TYR 56 Cb -0.21 -3.87 -0.02 0.00 0.35 0.00 0.00 41.96 38.21 1t89 s TYR 56 CO -0.09 -3.58 0.13 0.12 -1.34 0.00 0.00 175.55 170.79 1t89 s PHE 57 N 3.76 3.15 -0.88 4.97 5.36 -1.26 -0.31 117.98 132.77 1t89 s PHE 57 Ca 0.71 -0.45 -0.16 0.00 -0.96 0.00 0.00 56.93 56.07 1t89 s PHE 57 Cb -0.33 -2.32 0.18 0.00 -0.34 0.00 0.00 43.02 40.21 1t89 s PHE 57 CO 0.28 -0.39 0.94 0.42 -1.46 0.00 0.00 175.22 175.01 1t89 s ILE 58 N 1.63 5.19 0.12 3.12 1.01 0.81 -4.93 121.20 128.16 1t89 s ILE 58 Ca 0.05 -2.05 -0.18 0.00 0.00 0.00 0.00 60.65 58.47 1t89 s ILE 58 Cb -0.16 -4.62 -0.05 0.00 0.01 0.00 0.00 42.46 37.64 1t89 s ILE 58 CO 0.06 -1.26 1.70 -0.78 0.00 0.00 0.00 174.94 174.66 1t89 h ASP 59 N 8.27 0.37 -1.50 3.58 3.58 -1.88 0.15 116.42 129.00 1t89 h ASP 59 Ca 0.13 -0.11 -0.55 0.00 0.42 0.00 0.00 57.03 56.92 1t89 h ASP 59 Cb 1.03 -0.09 -0.42 0.00 1.72 0.00 0.00 39.33 41.57 1t89 h ASP 59 CO 0.92 0.38 -0.80 0.00 -2.88 0.00 0.00 179.24 176.86 1t89 n ALA 60 N -2.23 4.75 0.00 -0.78 0.00 -1.26 -4.24 120.51 116.75 1t89 n ALA 60 Ca -0.02 -4.16 0.00 0.00 0.00 0.00 0.00 53.44 49.26 1t89 n ALA 60 Cb 0.10 -0.62 0.00 0.00 0.00 0.00 0.00 19.45 18.93 1t89 n ALA 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1t89 n ALA 61 N -0.39 -0.15 -2.43 0.00 0.00 0.76 -3.79 120.51 114.50 1t89 n ALA 61 Ca 0.34 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.55 1t89 n ALA 61 Cb 0.67 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 20.03 1t89 n ALA 61 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1t89 s THR 62 N 0.00 0.50 0.25 0.00 -4.23 -1.26 0.14 115.64 111.04 1t89 s THR 62 Ca 0.00 -2.00 -0.03 0.00 -1.18 0.00 0.00 61.69 58.48 1t89 s THR 62 Cb 0.00 -2.44 0.23 0.00 1.34 0.00 0.00 72.50 71.63 1t89 s THR 62 CO 0.00 0.00 1.83 -0.37 -0.54 0.00 0.00 174.62 175.54 1t89 h VAL 63 N 1.97 0.97 -0.16 2.29 -1.51 -1.90 -2.54 116.25 115.37 1t89 h VAL 63 Ca -0.34 -0.31 -0.06 0.00 -1.23 0.00 0.00 66.70 64.75 1t89 h VAL 63 Cb 1.26 -0.03 -0.01 0.00 -2.13 0.00 0.00 31.29 30.38 1t89 h VAL 63 CO 0.54 0.17 -0.18 0.78 -1.23 0.00 0.00 177.57 177.65 1t89 h ASN 64 N 0.92 0.26 0.00 4.19 2.35 -1.97 -1.77 115.58 119.56 1t89 h ASN 64 Ca 0.41 -0.06 0.00 0.00 -0.55 0.00 0.00 56.30 56.10 1t89 h ASN 64 Cb 0.31 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.61 1t89 h ASN 64 CO -0.22 0.46 0.00 0.47 -1.65 0.00 0.00 177.43 176.49 1t89 n ASP 65 N -4.22 0.00 -4.86 5.81 8.00 -0.95 -4.66 116.55 115.66 1t89 n ASP 65 Ca -0.01 -0.13 -0.32 0.00 0.71 0.00 0.00 54.79 55.04 1t89 n ASP 65 Cb 0.31 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.36 1t89 n ASP 65 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1t89 s SER 66 N -1.95 6.71 0.00 -2.24 0.01 -0.67 -4.88 113.70 110.67 1t89 s SER 66 Ca 0.02 1.08 0.00 0.00 1.31 0.00 0.00 55.95 58.35 1t89 s SER 66 Cb 0.01 -2.29 0.00 0.00 0.21 0.00 0.00 66.02 63.95 1t89 s SER 66 CO 0.01 -0.11 0.00 0.61 0.41 0.00 0.00 173.24 174.17 1t89 n GLY 67 N -0.13 0.89 3.71 3.44 0.00 -0.64 -4.98 105.19 107.48 1t89 n GLY 67 Ca 0.01 -1.96 -0.40 0.00 0.00 0.00 0.00 46.02 43.67 1t89 n GLY 67 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1t89 s GLU 68 N -1.69 4.43 -0.15 1.61 2.12 -1.26 -1.37 118.70 122.40 1t89 s GLU 68 Ca 0.00 1.01 0.00 0.00 0.36 0.00 0.00 54.97 56.34 1t89 s GLU 68 Cb 0.00 -3.47 -0.01 0.00 0.26 0.00 0.00 34.13 30.91 1t89 s GLU 68 CO 0.00 -0.03 -0.15 0.71 -0.54 0.00 0.00 175.26 175.25 1t89 s TYR 69 N 1.10 2.79 0.16 5.30 1.51 0.29 -0.30 117.35 128.20 1t89 s TYR 69 Ca 0.41 -0.92 0.06 0.00 -1.01 0.00 0.00 57.07 55.60 1t89 s TYR 69 Cb -0.18 -1.88 -0.04 0.00 -0.11 0.00 0.00 41.96 39.75 1t89 s TYR 69 CO 0.19 -0.40 -0.12 1.03 -1.11 0.00 0.00 175.55 175.14 1t89 s ARG 70 N 0.69 1.15 -0.01 -0.62 0.52 -0.41 -0.69 118.95 119.57 1t89 s ARG 70 Ca -0.07 -1.46 -0.08 0.00 -0.52 0.00 0.00 55.73 53.60 1t89 s ARG 70 Cb -0.16 -0.85 0.01 0.00 0.52 0.00 0.00 34.95 34.47 1t89 s ARG 70 CO 0.02 0.13 0.17 0.00 0.02 0.00 0.00 175.30 175.64 1t89 s GLN 72 N -1.17 1.61 0.06 0.00 0.74 0.42 -1.08 119.66 120.24 1t89 s GLN 72 Ca -0.13 -1.92 -0.26 0.00 0.05 0.00 0.00 55.36 53.10 1t89 s GLN 72 Cb -0.06 0.04 0.09 0.00 1.10 0.00 0.00 33.01 34.17 1t89 s GLN 72 CO 0.02 -0.50 0.74 -0.08 -0.55 0.00 0.00 175.29 174.92 1t89 s THR 73 N -3.61 0.00 -0.91 -0.34 -1.32 -1.26 -0.94 115.64 107.26 1t89 s THR 73 Ca 0.37 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.85 1t89 s THR 73 Cb 0.04 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.03 1t89 s THR 73 CO 0.19 0.00 0.17 0.59 -2.21 0.00 0.00 174.62 173.36 1t89 n ASN 74 N -0.18 0.00 -2.64 8.08 3.02 -1.25 -0.85 115.26 121.45 1t89 n ASN 74 Ca -0.13 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.40 1t89 n ASN 74 Cb 0.63 0.00 0.11 0.00 -0.61 0.00 0.00 39.78 39.90 1t89 n ASN 74 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1t89 n LEU 75 N -0.60 -0.86 -3.68 3.41 4.77 -1.26 -4.47 117.00 114.32 1t89 n LEU 75 Ca 0.00 -3.13 -0.14 0.00 -0.03 0.00 0.00 56.01 52.71 1t89 n LEU 75 Cb 0.00 0.16 -0.08 0.00 -2.33 0.00 0.00 43.42 41.17 1t89 n LEU 75 CO 0.00 1.57 0.21 -0.44 -1.33 0.00 0.00 177.39 177.40 1t89 s SER 76 N -1.64 -0.48 0.68 -1.43 0.01 -0.03 -4.38 113.70 106.42 1t89 s SER 76 Ca 0.12 0.76 -0.11 0.00 1.31 0.00 0.00 55.95 58.04 1t89 s SER 76 Cb 0.41 0.79 -0.00 0.00 0.21 0.00 0.00 66.02 67.42 1t89 s SER 76 CO -0.11 -0.32 1.05 0.28 0.41 0.00 0.00 173.24 174.55 1t89 s THR 77 N -0.37 4.18 0.04 1.44 -1.32 0.71 -4.01 115.64 116.30 1t89 s THR 77 Ca -0.05 0.71 -0.38 0.00 -1.21 0.00 0.00 61.69 60.75 1t89 s THR 77 Cb -0.03 -3.55 -0.18 0.00 -1.51 0.00 0.00 72.50 67.23 1t89 s THR 77 CO 0.03 -0.92 1.24 -0.11 -2.21 0.00 0.00 174.62 172.65 1t89 n LEU 78 N -3.01 1.00 -4.40 9.08 7.94 -1.26 -2.97 117.00 123.38 1t89 n LEU 78 Ca 0.07 1.14 -0.29 0.00 -1.11 0.00 0.00 56.01 55.82 1t89 n LEU 78 Cb 0.54 -1.08 0.27 0.00 0.53 0.00 0.00 43.42 43.68 1t89 n LEU 78 CO 0.57 -1.37 0.44 -1.54 -1.11 0.00 0.00 177.39 174.38 1t89 n SER 79 N 2.19 -2.38 -4.90 1.96 3.41 -0.24 -4.66 113.62 108.99 1t89 n SER 79 Ca 0.19 -0.35 -0.29 0.00 -0.26 0.00 0.00 58.87 58.17 1t89 n SER 79 Cb 0.14 -1.19 0.06 0.00 -0.26 0.00 0.00 64.21 62.96 1t89 n SER 79 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1t89 s ASP 80 N -2.50 5.17 0.44 4.04 1.01 -1.26 -4.73 116.67 118.85 1t89 s ASP 80 Ca 0.68 0.88 -0.06 0.00 0.71 0.00 0.00 52.55 54.76 1t89 s ASP 80 Cb -0.23 -1.63 -0.04 0.00 1.01 0.00 0.00 42.92 42.03 1t89 s ASP 80 CO 0.64 -1.45 0.76 -2.16 0.21 0.00 0.00 175.17 173.17 1t89 s PRO 81 N -5.33 3.61 -0.04 8.23 0.04 -1.26 -4.58 135.00 135.67 1t89 s PRO 81 Ca 0.58 0.25 -0.00 0.00 0.04 0.00 0.00 61.00 61.87 1t89 s PRO 81 Cb -0.11 -2.41 0.03 0.00 0.04 0.00 0.00 34.50 32.05 1t89 s PRO 81 CO 0.49 -0.12 0.01 0.08 0.04 0.00 0.00 177.00 177.50 1t89 s VAL 82 N -2.58 0.17 -0.13 -0.36 1.01 0.13 -4.94 120.40 113.69 1t89 s VAL 82 Ca 0.48 0.14 -0.17 0.00 0.00 0.00 0.00 61.98 62.43 1t89 s VAL 82 Cb -0.10 -0.29 -0.04 0.00 0.00 0.00 0.00 36.38 35.94 1t89 s VAL 82 CO 0.40 0.17 0.41 -1.10 0.00 0.00 0.00 175.10 174.98 1t89 s GLN 83 N 1.32 4.31 -0.24 2.72 -1.52 -1.26 0.10 119.66 125.10 1t89 s GLN 83 Ca -0.06 0.33 0.01 0.00 -1.95 0.00 0.00 55.36 53.69 1t89 s GLN 83 Cb -0.13 -3.44 0.04 0.00 -0.22 0.00 0.00 33.01 29.26 1t89 s GLN 83 CO -0.02 0.18 -0.11 -1.17 -0.25 0.00 0.00 175.29 173.91 1t89 s LEU 84 N 0.60 3.05 -0.33 2.90 2.96 -0.47 -4.84 118.68 122.54 1t89 s LEU 84 Ca 0.23 -1.01 -0.10 0.00 -0.22 0.00 0.00 54.13 53.02 1t89 s LEU 84 Cb -0.14 -1.58 0.00 0.00 0.50 0.00 0.00 46.19 44.97 1t89 s LEU 84 CO 0.08 -0.12 0.18 -0.70 -1.32 0.00 0.00 176.35 174.47 1t89 s GLU 85 N 1.24 3.19 -0.16 1.98 2.12 -0.33 -1.62 118.70 125.13 1t89 s GLU 85 Ca -0.02 -0.82 -0.01 0.00 0.36 0.00 0.00 54.97 54.48 1t89 s GLU 85 Cb -0.17 -3.64 -0.01 0.00 0.26 0.00 0.00 34.13 30.57 1t89 s GLU 85 CO -0.07 -0.51 -0.11 0.08 -0.54 0.00 0.00 175.26 174.11 1t89 s VAL 86 N 1.61 3.07 0.41 3.70 1.01 -1.26 0.73 120.40 129.67 1t89 s VAL 86 Ca 0.04 -0.64 0.06 0.00 0.00 0.00 0.00 61.98 61.44 1t89 s VAL 86 Cb -0.18 -2.32 -0.07 0.00 0.00 0.00 0.00 36.38 33.82 1t89 s VAL 86 CO 0.07 0.50 0.02 -1.00 0.00 0.00 0.00 175.10 174.69 1t89 s HIS 87 N 0.70 2.32 -0.20 5.22 3.76 0.95 -4.55 115.29 123.49 1t89 s HIS 87 Ca -0.05 -0.77 -0.07 0.00 -0.15 0.00 0.00 55.06 54.01 1t89 s HIS 87 Cb -0.15 -1.67 -0.04 0.00 1.11 0.00 0.00 32.58 31.83 1t89 s HIS 87 CO 0.02 0.33 0.06 0.42 -0.85 0.00 0.00 174.74 174.72 1t89 s ILE 88 N -2.83 4.62 -1.58 0.60 -1.09 -1.26 -1.55 121.20 118.10 1t89 s ILE 88 Ca 0.30 -0.09 0.00 0.00 -2.23 0.00 0.00 60.65 58.64 1t89 s ILE 88 Cb 0.08 -3.10 0.00 0.00 -1.58 0.00 0.00 42.46 37.86 1t89 s ILE 88 CO 0.15 0.43 0.00 0.61 -1.23 0.00 0.00 174.94 174.90 1t89 n GLY 89 N 3.92 -1.63 0.11 6.18 0.00 -1.26 -4.97 105.19 107.55 1t89 n GLY 89 Ca -0.16 -1.09 -0.14 0.00 0.00 0.00 0.00 46.02 44.63 1t89 n GLY 89 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1t89 n TRP 90 N 0.06 0.22 -4.22 1.61 7.02 -1.26 -4.03 117.44 116.84 1t89 n TRP 90 Ca 0.00 0.06 -0.13 0.00 -1.02 0.00 0.00 57.50 56.41 1t89 n TRP 90 Cb 0.00 -1.03 -0.10 0.00 -2.42 0.00 0.00 31.31 27.76 1t89 n TRP 90 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1t89 s LEU 91 N -6.07 2.51 -0.19 -0.99 1.43 -1.24 0.14 118.68 114.28 1t89 s LEU 91 Ca -0.20 -1.02 -0.16 0.00 -1.03 0.00 0.00 54.13 51.73 1t89 s LEU 91 Cb 0.07 -0.24 0.05 0.00 0.03 0.00 0.00 46.19 46.10 1t89 s LEU 91 CO 0.74 -0.39 0.49 -0.22 0.23 0.00 0.00 176.35 177.21 1t89 s LEU 92 N -3.13 0.02 -0.16 1.79 2.96 0.95 -4.46 118.68 116.66 1t89 s LEU 92 Ca 0.15 1.01 -0.18 0.00 -0.22 0.00 0.00 54.13 54.89 1t89 s LEU 92 Cb 0.04 1.67 -0.04 0.00 0.50 0.00 0.00 46.19 48.36 1t89 s LEU 92 CO -0.01 -0.18 0.49 -0.76 -1.32 0.00 0.00 176.35 174.56 1t89 s LEU 93 N 0.52 4.21 0.41 -0.68 1.43 -1.26 0.42 118.68 123.73 1t89 s LEU 93 Ca -0.02 0.72 0.07 0.00 -1.03 0.00 0.00 54.13 53.88 1t89 s LEU 93 Cb -0.04 -2.68 -0.06 0.00 0.03 0.00 0.00 46.19 43.44 1t89 s LEU 93 CO -0.03 -0.08 0.13 -1.10 0.23 0.00 0.00 176.35 175.50 1t89 s GLN 94 N 1.11 2.16 0.00 1.70 -0.21 0.97 -4.92 119.66 120.47 1t89 s GLN 94 Ca 0.24 -1.89 0.00 0.00 0.02 0.00 0.00 55.36 53.73 1t89 s GLN 94 Cb -0.15 -1.90 0.00 0.00 1.00 0.00 0.00 33.01 31.95 1t89 s GLN 94 CO 0.10 -0.08 0.00 0.00 -2.12 0.00 0.00 175.29 173.19 1t89 n ALA 95 N -1.16 0.00 -0.35 6.09 0.00 -1.26 -2.24 120.51 121.59 1t89 n ALA 95 Ca -0.02 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.46 1t89 n ALA 95 Cb 0.65 0.00 0.19 0.00 0.00 0.00 0.00 19.45 20.29 1t89 n ALA 95 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1t89 h PRO 96 N 0.00 1.02 -2.68 0.00 0.13 -1.89 -3.45 132.00 125.14 1t89 h PRO 96 Ca 0.00 -0.06 -0.09 0.00 -0.87 0.00 0.00 66.00 64.98 1t89 h PRO 96 Cb 0.00 -0.23 -0.19 0.00 0.13 0.00 0.00 31.00 30.71 1t89 h PRO 96 CO 0.00 0.68 -0.08 -0.98 -0.23 0.00 0.00 178.00 177.39 1t89 s ARG 97 N -6.01 0.86 -0.01 0.86 1.70 -1.26 -4.91 118.95 110.17 1t89 s ARG 97 Ca -0.12 -0.07 0.22 0.00 -0.47 0.00 0.00 55.73 55.28 1t89 s ARG 97 Cb 0.21 0.39 -0.27 0.00 -0.57 0.00 0.00 34.95 34.70 1t89 s ARG 97 CO 0.81 -0.26 0.63 0.91 -1.08 0.00 0.00 175.30 176.31 1t89 n TRP 98 N 0.99 0.07 -2.67 5.89 7.02 -1.26 -4.75 117.44 122.73 1t89 n TRP 98 Ca -0.20 0.02 -0.42 0.00 -1.02 0.00 0.00 57.50 55.88 1t89 n TRP 98 Cb 0.57 -0.42 -0.03 0.00 -2.42 0.00 0.00 31.31 29.01 1t89 n TRP 98 CO 0.00 0.00 0.00 0.08 -2.02 0.00 0.00 177.69 175.75 1t89 s VAL 99 N -3.39 4.05 0.31 -0.99 1.01 -1.19 -1.52 120.40 118.68 1t89 s VAL 99 Ca -0.04 -0.42 0.11 0.00 0.00 0.00 0.00 61.98 61.63 1t89 s VAL 99 Cb 0.14 -4.90 -0.05 0.00 0.00 0.00 0.00 36.38 31.57 1t89 s VAL 99 CO 0.89 -1.76 -0.11 -0.36 0.00 0.00 0.00 175.10 173.76 1t89 s PHE 100 N 4.72 2.41 0.34 5.22 2.99 0.38 -5.00 117.98 129.04 1t89 s PHE 100 Ca 0.36 -0.38 0.00 0.00 0.00 0.00 0.00 56.93 56.91 1t89 s PHE 100 Cb -0.07 -1.20 0.00 0.00 0.00 0.00 0.00 43.02 41.75 1t89 s PHE 100 CO 0.02 0.63 0.00 1.63 -0.00 0.00 0.00 175.22 177.50 1t89 n LYS 101 N -0.75 0.00 -4.15 0.44 5.02 -1.26 -4.86 118.16 112.59 1t89 n LYS 101 Ca -0.05 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.14 1t89 n LYS 101 Cb 0.61 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.52 1t89 n LYS 101 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1t89 s GLU 102 N -2.00 0.96 -0.49 1.97 0.41 -1.26 -4.04 118.70 114.26 1t89 s GLU 102 Ca 0.00 -1.45 -0.05 0.00 -0.41 0.00 0.00 54.97 53.05 1t89 s GLU 102 Cb 0.00 0.25 0.01 0.00 -1.78 0.00 0.00 34.13 32.61 1t89 s GLU 102 CO 0.00 -0.28 0.40 -1.91 -0.49 0.00 0.00 175.26 172.98 1t89 n GLU 103 N -0.12 -1.05 0.00 1.61 2.13 -1.26 -4.93 120.64 117.02 1t89 n GLU 103 Ca -0.05 0.56 0.00 0.00 0.66 0.00 0.00 57.16 58.34 1t89 n GLU 103 Cb 0.64 -1.39 0.00 0.00 0.27 0.00 0.00 31.44 30.96 1t89 n GLU 103 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 1t89 n ASP 104 N -1.17 0.00 -4.62 4.31 2.03 -1.26 -4.98 116.55 110.85 1t89 n ASP 104 Ca -0.18 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.70 1t89 n ASP 104 Cb 0.45 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.82 1t89 n ASP 104 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1t89 s PRO 105 N 0.00 3.58 -0.41 -0.67 0.04 -1.26 -4.10 135.00 132.18 1t89 s PRO 105 Ca 0.00 1.93 -0.29 0.00 0.04 0.00 0.00 61.00 62.68 1t89 s PRO 105 Cb 0.00 -4.19 -0.08 0.00 0.04 0.00 0.00 34.50 30.26 1t89 s PRO 105 CO 0.00 -1.58 2.33 -0.89 0.04 0.00 0.00 177.00 176.90 1t89 n ILE 106 N 6.83 0.12 -3.07 0.56 5.41 -1.26 -4.66 119.36 123.29 1t89 n ILE 106 Ca 0.23 -0.52 -0.43 0.00 1.00 0.00 0.00 62.75 63.03 1t89 n ILE 106 Cb 0.45 -2.33 -0.06 0.00 -0.71 0.00 0.00 39.64 36.98 1t89 n ILE 106 CO 0.00 0.00 0.00 -2.28 0.00 0.00 0.00 176.55 174.27 1t89 s HIS 107 N 9.70 3.06 -0.21 1.39 2.46 -1.26 -3.27 115.29 127.17 1t89 s HIS 107 Ca 1.04 0.09 0.01 0.00 0.47 0.00 0.00 55.06 56.67 1t89 s HIS 107 Cb -0.44 -3.39 0.03 0.00 -0.13 0.00 0.00 32.58 28.64 1t89 s HIS 107 CO 0.35 -0.85 -0.16 -0.51 -2.47 0.00 0.00 174.74 171.11 1t89 s LEU 108 N 2.92 2.55 -0.12 8.88 1.43 -0.58 -4.30 118.68 129.47 1t89 s LEU 108 Ca 0.25 -0.80 -0.05 0.00 -1.03 0.00 0.00 54.13 52.50 1t89 s LEU 108 Cb -0.14 -1.53 -0.04 0.00 0.03 0.00 0.00 46.19 44.51 1t89 s LEU 108 CO 0.19 -0.05 0.07 -0.60 0.23 0.00 0.00 176.35 176.19 1t89 s ARG 109 N 1.27 3.36 -0.30 1.70 3.52 -0.95 0.79 118.95 128.34 1t89 s ARG 109 Ca 0.02 -0.29 -0.09 0.00 -0.13 0.00 0.00 55.73 55.25 1t89 s ARG 109 Cb -0.15 -3.03 -0.01 0.00 -1.56 0.00 0.00 34.95 30.20 1t89 s ARG 109 CO -0.10 0.65 0.13 0.00 -0.81 0.00 0.00 175.30 175.16 1t89 s HIS 111 N 1.59 3.04 -0.07 0.00 2.46 0.17 -4.88 115.29 117.60 1t89 s HIS 111 Ca 0.04 0.06 0.02 0.00 0.47 0.00 0.00 55.06 55.65 1t89 s HIS 111 Cb -0.17 -1.66 -0.02 0.00 -0.13 0.00 0.00 32.58 30.60 1t89 s HIS 111 CO 0.05 0.44 -0.13 -1.54 -2.47 0.00 0.00 174.74 171.10 1t89 s SER 112 N -1.53 4.12 0.48 9.88 1.04 -1.24 -0.03 113.70 126.41 1t89 s SER 112 Ca 0.19 -0.20 -0.20 0.00 0.48 0.00 0.00 55.95 56.21 1t89 s SER 112 Cb -0.11 -1.09 -0.12 0.00 0.10 0.00 0.00 66.02 64.80 1t89 s SER 112 CO 0.10 0.30 0.42 1.87 0.98 0.00 0.00 173.24 176.91 1t89 n TRP 113 N 2.61 -0.97 -0.58 5.02 -0.00 0.37 0.10 117.44 124.00 1t89 n TRP 113 Ca -0.17 0.54 -0.02 0.00 -0.00 0.00 0.00 57.50 57.84 1t89 n TRP 113 Cb 0.52 -1.93 -0.01 0.00 -0.00 0.00 0.00 31.31 29.90 1t89 n TRP 113 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 177.69 178.86 1t89 n LYS 114 N 0.57 -1.75 -2.20 5.87 3.00 -1.26 -0.73 118.16 121.66 1t89 n LYS 114 Ca 0.11 0.23 -0.21 0.00 -0.00 0.00 0.00 58.31 58.44 1t89 n LYS 114 Cb 0.43 -3.65 -0.03 0.00 0.00 0.00 0.00 35.03 31.78 1t89 n LYS 114 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 1t89 n ASN 115 N 1.30 -5.78 -4.46 3.14 2.85 0.28 -4.95 115.26 107.64 1t89 n ASN 115 Ca -0.02 0.11 -0.31 0.00 -0.11 0.00 0.00 54.58 54.25 1t89 n ASN 115 Cb 0.17 -4.87 0.19 0.00 1.24 0.00 0.00 39.78 36.52 1t89 n ASN 115 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1t89 n THR 116 N -3.63 0.00 -2.35 -0.44 -2.24 0.09 -4.85 114.28 100.86 1t89 n THR 116 Ca -0.24 -0.26 -0.43 0.00 -2.27 0.00 0.00 64.05 60.86 1t89 n THR 116 Cb 0.68 -0.83 -0.02 0.00 -2.10 0.00 0.00 70.33 68.06 1t89 n THR 116 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1t89 s ALA 117 N -2.42 3.54 -0.13 6.98 0.00 -1.26 -4.74 121.76 123.74 1t89 s ALA 117 Ca 0.63 0.42 -0.03 0.00 0.00 0.00 0.00 51.96 52.97 1t89 s ALA 117 Cb -0.21 -3.70 -0.03 0.00 0.00 0.00 0.00 23.12 19.18 1t89 s ALA 117 CO 0.64 -1.43 -0.00 -1.17 0.00 0.00 0.00 175.76 173.80 1t89 s LEU 118 N 3.95 3.51 0.27 0.00 2.96 -1.26 -4.06 118.68 124.05 1t89 s LEU 118 Ca 0.59 0.04 0.03 0.00 -0.22 0.00 0.00 54.13 54.57 1t89 s LEU 118 Cb -0.22 -1.83 -0.06 0.00 0.50 0.00 0.00 46.19 44.58 1t89 s LEU 118 CO 0.20 0.27 0.05 -1.00 -1.32 0.00 0.00 176.35 174.55 1t89 s HIS 119 N -0.26 1.67 -1.50 5.38 3.76 -0.99 -1.84 115.29 121.51 1t89 s HIS 119 Ca 0.06 -1.03 -0.02 0.00 -0.15 0.00 0.00 55.06 53.91 1t89 s HIS 119 Cb -0.12 -1.01 0.00 0.00 1.11 0.00 0.00 32.58 32.56 1t89 s HIS 119 CO 0.02 -0.14 0.12 1.63 -0.85 0.00 0.00 174.74 175.52 1t89 n LYS 120 N -0.51 -1.30 -2.88 1.40 5.02 0.27 -0.93 118.16 119.22 1t89 n LYS 120 Ca -0.02 0.15 -0.40 0.00 -2.02 0.00 0.00 58.31 56.01 1t89 n LYS 120 Cb 0.66 -3.68 -0.06 0.00 -0.02 0.00 0.00 35.03 31.93 1t89 n LYS 120 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1t89 s VAL 121 N -4.26 4.36 0.19 -0.18 1.01 0.10 -4.44 120.40 117.19 1t89 s VAL 121 Ca 0.04 1.85 0.11 0.00 0.00 0.00 0.00 61.98 63.97 1t89 s VAL 121 Cb -0.02 -4.21 -0.04 0.00 0.00 0.00 0.00 36.38 32.11 1t89 s VAL 121 CO 0.98 0.47 -0.20 -0.89 0.00 0.00 0.00 175.10 175.46 1t89 s THR 122 N -0.84 2.61 -0.13 3.92 2.01 -0.38 0.11 115.64 122.95 1t89 s THR 122 Ca 0.39 -1.91 0.03 0.00 0.31 0.00 0.00 61.69 60.51 1t89 s THR 122 Cb -0.24 -2.27 0.01 0.00 0.01 0.00 0.00 72.50 70.01 1t89 s THR 122 CO 0.28 -0.11 -0.23 -0.31 -0.69 0.00 0.00 174.62 173.56 1t89 s TYR 123 N -1.67 2.63 0.20 4.92 1.51 0.21 -2.66 117.35 122.49 1t89 s TYR 123 Ca 0.22 -1.24 0.11 0.00 -1.01 0.00 0.00 57.07 55.15 1t89 s TYR 123 Cb -0.08 -1.78 -0.04 0.00 -0.11 0.00 0.00 41.96 39.95 1t89 s TYR 123 CO 0.11 -0.55 -0.23 -0.51 -1.11 0.00 0.00 175.55 173.26 1t89 s LEU 124 N 0.65 2.45 -0.07 -1.29 1.02 -0.21 -0.33 118.68 120.89 1t89 s LEU 124 Ca -0.11 -0.88 -0.03 0.00 0.02 0.00 0.00 54.13 53.13 1t89 s LEU 124 Cb -0.16 -1.15 0.04 0.00 0.02 0.00 0.00 46.19 44.94 1t89 s LEU 124 CO 0.02 0.11 0.09 -1.58 0.02 0.00 0.00 176.35 175.01 1t89 s GLN 125 N -2.74 -0.03 -0.82 1.70 0.74 -0.51 -0.94 119.66 117.06 1t89 s GLN 125 Ca 0.21 0.37 -0.02 0.00 0.05 0.00 0.00 55.36 55.97 1t89 s GLN 125 Cb -0.08 -0.62 -0.02 0.00 1.10 0.00 0.00 33.01 33.39 1t89 s GLN 125 CO 0.10 -0.37 0.75 0.09 -0.55 0.00 0.00 175.29 175.31 1t89 n ASN 126 N 5.30 -7.42 -0.66 6.67 3.02 0.91 -2.27 115.26 120.81 1t89 n ASN 126 Ca -0.04 -0.26 0.00 0.00 -0.03 0.00 0.00 54.58 54.26 1t89 n ASN 126 Cb 0.50 -5.16 0.00 0.00 -0.61 0.00 0.00 39.78 34.51 1t89 n ASN 126 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1t89 n GLY 127 N -1.65 0.00 3.33 7.41 0.00 -1.26 -4.84 105.19 108.18 1t89 n GLY 127 Ca -0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 1t89 n GLY 127 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1t89 s LYS 128 N -1.33 3.10 -0.34 1.61 1.02 -0.96 -5.09 119.74 117.75 1t89 s LYS 128 Ca 0.00 -0.76 -0.29 0.00 0.02 0.00 0.00 55.97 54.94 1t89 s LYS 128 Cb 0.00 -2.46 -0.00 0.00 -0.52 0.00 0.00 37.83 34.84 1t89 s LYS 128 CO 0.00 0.27 1.48 -0.51 -0.92 0.00 0.00 175.35 175.67 1t89 s ASP 129 N 0.16 6.35 0.08 2.83 1.11 -1.26 -1.43 116.67 124.52 1t89 s ASP 129 Ca -0.10 1.11 0.21 0.00 0.18 0.00 0.00 52.55 53.96 1t89 s ASP 129 Cb -0.16 -2.54 -0.14 0.00 1.07 0.00 0.00 42.92 41.15 1t89 s ASP 129 CO 0.06 -1.37 0.78 0.54 1.18 0.00 0.00 175.17 176.36 1t89 n ARG 130 N 7.90 0.63 -3.62 8.23 5.12 0.55 -4.96 116.66 130.49 1t89 n ARG 130 Ca 0.17 0.03 -0.04 0.00 -1.93 0.00 0.00 57.85 56.09 1t89 n ARG 130 Cb 0.47 -1.71 -0.06 0.00 -1.16 0.00 0.00 32.46 30.00 1t89 n ARG 130 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 1t89 s LYS 131 N -3.29 0.56 0.09 5.56 2.47 -0.92 -4.94 119.74 119.27 1t89 s LYS 131 Ca -0.04 1.06 0.02 0.00 -1.56 0.00 0.00 55.97 55.46 1t89 s LYS 131 Cb 0.11 0.26 -0.04 0.00 -1.46 0.00 0.00 37.83 36.69 1t89 s LYS 131 CO 0.83 -0.13 0.15 -0.47 0.16 0.00 0.00 175.35 175.88 1t89 s TYR 132 N 1.81 3.31 -0.08 4.03 5.04 -1.26 0.67 117.35 130.88 1t89 s TYR 132 Ca -0.09 0.12 -0.05 0.00 -2.44 0.00 0.00 57.07 54.62 1t89 s TYR 132 Cb -0.06 -1.65 0.04 0.00 0.35 0.00 0.00 41.96 40.63 1t89 s TYR 132 CO -0.18 0.54 0.19 -0.06 -1.34 0.00 0.00 175.55 174.70 1t89 s PHE 133 N -1.50 -0.23 0.04 4.97 0.40 0.30 -4.95 117.98 117.00 1t89 s PHE 133 Ca 0.32 0.59 -0.22 0.00 -0.60 0.00 0.00 56.93 57.02 1t89 s PHE 133 Cb -0.12 0.00 -0.14 0.00 0.51 0.00 0.00 43.02 43.27 1t89 s PHE 133 CO 0.25 -0.17 1.44 0.45 0.70 0.00 0.00 175.22 177.88 1t89 h HIS 134 N 6.87 0.22 -4.28 0.36 3.86 -1.93 0.30 115.15 120.57 1t89 h HIS 134 Ca -0.38 -0.04 -0.69 0.00 -1.16 0.00 0.00 60.37 58.10 1t89 h HIS 134 Cb 1.16 -0.06 -0.26 0.00 1.06 0.00 0.00 27.41 29.32 1t89 h HIS 134 CO 0.40 0.48 -0.85 -1.01 0.86 0.00 0.00 177.93 177.81 1t89 s HIS 135 N -4.82 2.43 0.21 2.45 3.76 -1.26 0.96 115.29 119.02 1t89 s HIS 135 Ca -0.14 -0.35 -0.31 0.00 -0.15 0.00 0.00 55.06 54.11 1t89 s HIS 135 Cb 0.05 -1.47 -0.15 0.00 1.11 0.00 0.00 32.58 32.11 1t89 s HIS 135 CO 0.71 0.12 1.05 -1.71 -0.85 0.00 0.00 174.74 174.05 1t89 n ASN 136 N 1.99 1.04 -3.61 1.40 5.15 -0.76 -4.82 115.26 115.64 1t89 n ASN 136 Ca -0.16 1.15 -0.10 0.00 -0.60 0.00 0.00 54.58 54.87 1t89 n ASN 136 Cb 0.52 -1.20 -0.06 0.00 -0.53 0.00 0.00 39.78 38.50 1t89 n ASN 136 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 1t89 s SER 137 N -0.27 -0.44 0.71 1.20 0.01 -1.26 -5.06 113.70 108.59 1t89 s SER 137 Ca 0.68 0.70 -0.16 0.00 1.31 0.00 0.00 55.95 58.48 1t89 s SER 137 Cb -0.82 0.66 -0.03 0.00 0.21 0.00 0.00 66.02 66.03 1t89 s SER 137 CO 0.55 -0.25 0.61 0.47 0.41 0.00 0.00 173.24 175.04 1t89 n ASP 138 N 1.61 -0.86 -4.05 2.44 8.00 -1.26 -4.75 116.55 117.68 1t89 n ASP 138 Ca -0.12 0.62 -0.33 0.00 0.71 0.00 0.00 54.79 55.67 1t89 n ASP 138 Cb 0.57 -1.25 -0.13 0.00 -0.02 0.00 0.00 41.12 40.29 1t89 n ASP 138 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1t89 s PHE 139 N -1.88 3.56 0.67 1.24 5.36 0.24 -4.96 117.98 122.21 1t89 s PHE 139 Ca 0.67 -2.83 0.03 0.00 -0.96 0.00 0.00 56.93 53.84 1t89 s PHE 139 Cb -0.36 -3.03 0.11 0.00 -0.34 0.00 0.00 43.02 39.40 1t89 s PHE 139 CO 0.56 -0.90 0.93 -1.01 -1.46 0.00 0.00 175.22 173.33 1t89 s HIS 140 N 0.63 1.53 -0.09 10.12 3.76 -1.25 -1.52 115.29 128.47 1t89 s HIS 140 Ca 0.12 -0.43 -0.04 0.00 -0.15 0.00 0.00 55.06 54.57 1t89 s HIS 140 Cb -0.22 -2.74 0.05 0.00 1.11 0.00 0.00 32.58 30.79 1t89 s HIS 140 CO -0.05 -1.52 0.18 0.42 -0.85 0.00 0.00 174.74 172.92 1t89 s ILE 141 N -2.98 -0.28 0.00 0.60 1.01 -1.20 -4.89 121.20 113.45 1t89 s ILE 141 Ca 0.65 0.33 0.00 0.00 0.00 0.00 0.00 60.65 61.63 1t89 s ILE 141 Cb -0.05 -0.32 0.00 0.00 0.01 0.00 0.00 42.46 42.09 1t89 s ILE 141 CO 0.42 0.14 0.10 -2.65 0.00 0.00 0.00 174.94 172.96 1t89 n PRO 142 N 5.28 0.00 -4.15 2.79 -0.02 -1.26 -4.03 135.00 133.62 1t89 n PRO 142 Ca -0.06 0.10 -0.34 0.00 -2.02 0.00 0.00 63.50 61.18 1t89 n PRO 142 Cb 0.50 -0.42 -0.14 0.00 -0.02 0.00 0.00 33.50 33.42 1t89 n PRO 142 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1t89 s LYS 143 N -0.32 3.40 0.22 -0.52 1.02 -1.26 -4.49 119.74 117.79 1t89 s LYS 143 Ca 0.00 -0.63 -0.29 0.00 0.02 0.00 0.00 55.97 55.07 1t89 s LYS 143 Cb 0.00 -2.91 -0.16 0.00 -0.52 0.00 0.00 37.83 34.24 1t89 s LYS 143 CO 0.00 -0.06 0.87 0.00 -0.92 0.00 0.00 175.35 175.23 1t89 n ALA 144 N 4.39 -1.41 -3.33 5.17 0.00 -1.26 -4.98 120.51 119.09 1t89 n ALA 144 Ca -0.18 0.43 -0.13 0.00 0.00 0.00 0.00 53.44 53.56 1t89 n ALA 144 Cb 0.51 -1.86 -0.13 0.00 0.00 0.00 0.00 19.45 17.97 1t89 n ALA 144 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1t89 s THR 145 N -0.84 -0.02 -0.74 0.00 -1.32 -1.26 -4.57 115.64 106.90 1t89 s THR 145 Ca 0.64 0.07 0.00 0.00 -1.21 0.00 0.00 61.69 61.20 1t89 s THR 145 Cb -0.83 -0.24 0.00 0.00 -1.51 0.00 0.00 72.50 69.91 1t89 s THR 145 CO 0.57 0.03 0.81 0.18 -2.21 0.00 0.00 174.62 174.00 1t89 n LEU 146 N 3.50 0.00 -0.80 9.08 4.77 -1.26 -0.84 117.00 131.46 1t89 n LEU 146 Ca -0.18 0.32 0.03 0.00 -0.03 0.00 0.00 56.01 56.14 1t89 n LEU 146 Cb 0.56 -0.32 0.12 0.00 -2.33 0.00 0.00 43.42 41.45 1t89 n LEU 146 CO 0.19 -0.32 0.48 0.29 -1.33 0.00 0.00 177.39 176.71 1t89 n LYS 147 N -1.31 2.04 -1.41 3.23 5.02 -1.26 -3.93 118.16 120.53 1t89 n LYS 147 Ca 0.00 -0.94 -0.20 0.00 -2.02 0.00 0.00 58.31 55.15 1t89 n LYS 147 Cb 0.14 -1.59 0.10 0.00 -0.02 0.00 0.00 35.03 33.67 1t89 n LYS 147 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1t89 n ASP 148 N 0.19 4.70 -4.36 4.39 8.00 -0.02 -4.94 116.55 124.51 1t89 n ASP 148 Ca 0.08 -3.78 -0.46 0.00 0.71 0.00 0.00 54.79 51.35 1t89 n ASP 148 Cb 0.45 -0.62 -0.03 0.00 -0.02 0.00 0.00 41.12 40.91 1t89 n ASP 148 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1t89 s SER 149 N -2.74 6.59 0.00 -2.24 0.01 -1.25 -4.69 113.70 109.38 1t89 s SER 149 Ca 0.52 -2.26 0.00 0.00 1.31 0.00 0.00 55.95 55.52 1t89 s SER 149 Cb 0.44 -2.27 0.00 0.00 0.21 0.00 0.00 66.02 64.40 1t89 s SER 149 CO 0.01 -0.80 0.00 0.61 0.41 0.00 0.00 173.24 173.47 1t89 n GLY 150 N 4.65 2.45 3.28 3.44 0.00 -0.87 -5.03 105.19 113.12 1t89 n GLY 150 Ca 0.10 -0.80 -0.35 0.00 0.00 0.00 0.00 46.02 44.97 1t89 n GLY 150 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1t89 s SER 151 N 1.20 4.57 0.37 1.61 1.04 -1.26 0.82 113.70 122.05 1t89 s SER 151 Ca 0.00 -0.67 0.08 0.00 0.48 0.00 0.00 55.95 55.84 1t89 s SER 151 Cb 0.00 -1.76 -0.03 0.00 0.10 0.00 0.00 66.02 64.34 1t89 s SER 151 CO 0.00 -0.11 0.31 -0.31 0.98 0.00 0.00 173.24 174.10 1t89 s TYR 152 N 1.43 2.80 0.00 5.02 1.51 0.51 -0.06 117.35 128.56 1t89 s TYR 152 Ca 0.03 -0.39 0.00 0.00 -1.01 0.00 0.00 57.07 55.69 1t89 s TYR 152 Cb -0.16 -1.93 0.00 0.00 -0.11 0.00 0.00 41.96 39.76 1t89 s TYR 152 CO -0.02 0.08 0.00 1.97 -1.11 0.00 0.00 175.55 176.47 1t89 n PHE 153 N -1.41 0.00 -3.67 2.71 1.16 -0.11 -0.49 117.46 115.65 1t89 n PHE 153 Ca 0.00 0.00 -0.22 0.00 -1.87 0.00 0.00 57.45 55.36 1t89 n PHE 153 Cb 0.61 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 38.45 1t89 n PHE 153 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1t89 s ARG 155 N -4.17 0.59 0.00 0.00 1.70 -1.09 -0.79 118.95 115.19 1t89 s ARG 155 Ca 0.45 -0.16 0.00 0.00 -0.47 0.00 0.00 55.73 55.55 1t89 s ARG 155 Cb -0.02 0.27 0.00 0.00 -0.57 0.00 0.00 34.95 34.63 1t89 s ARG 155 CO 0.26 -0.25 0.00 0.41 -1.08 0.00 0.00 175.30 174.65 1t89 n GLY 156 N -0.03 2.96 3.00 3.88 0.00 -0.88 -1.25 105.19 112.87 1t89 n GLY 156 Ca -0.06 -0.43 -0.31 0.00 0.00 0.00 0.00 46.02 45.22 1t89 n GLY 156 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1t89 s LEU 157 N 0.00 3.80 -0.83 0.99 1.43 -0.11 -2.62 118.68 121.33 1t89 s LEU 157 Ca 0.00 -1.71 -0.20 0.00 -1.03 0.00 0.00 54.13 51.19 1t89 s LEU 157 Cb 0.00 -1.48 0.10 0.00 0.03 0.00 0.00 46.19 44.85 1t89 s LEU 157 CO 0.00 -0.30 1.08 -0.69 0.23 0.00 0.00 176.35 176.68 1t89 s VAL 158 N 1.10 4.53 0.00 -1.59 1.01 -0.44 -2.34 120.40 122.67 1t89 s VAL 158 Ca 0.01 -1.09 0.00 0.00 0.00 0.00 0.00 61.98 60.91 1t89 s VAL 158 Cb -0.19 -4.76 0.00 0.00 0.00 0.00 0.00 36.38 31.43 1t89 s VAL 158 CO -0.08 -1.51 0.00 0.61 0.00 0.00 0.00 175.10 174.12 1t89 n GLY 159 N 5.53 1.75 0.18 4.51 0.00 -1.26 -3.07 105.19 112.83 1t89 n GLY 159 Ca 0.14 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1t89 n GLY 159 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1t89 n SER 160 N 5.14 0.00 -4.39 1.61 3.41 -1.26 -5.05 113.62 113.08 1t89 n SER 160 Ca 0.00 -1.20 -0.30 0.00 -0.26 0.00 0.00 58.87 57.11 1t89 n SER 160 Cb 0.00 -0.04 -0.14 0.00 -0.26 0.00 0.00 64.21 63.77 1t89 n SER 160 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1t89 s LYS 161 N 0.00 1.66 0.26 4.33 -2.85 -1.17 -5.10 119.74 116.87 1t89 s LYS 161 Ca 0.00 -1.20 -0.19 0.00 -1.00 0.00 0.00 55.97 53.58 1t89 s LYS 161 Cb 0.00 -1.98 -0.09 0.00 -2.06 0.00 0.00 37.83 33.71 1t89 s LYS 161 CO 0.00 0.49 0.75 -0.80 0.10 0.00 0.00 175.35 175.88 1t89 s ASN 162 N -1.67 7.01 0.03 0.03 0.01 -1.26 -1.33 114.94 117.77 1t89 s ASN 162 Ca 0.13 1.42 0.00 0.00 -0.71 0.00 0.00 52.86 53.70 1t89 s ASN 162 Cb -0.10 -2.42 -0.03 0.00 0.41 0.00 0.00 41.25 39.11 1t89 s ASN 162 CO 0.05 -0.04 -0.04 0.68 -1.51 0.00 0.00 177.10 176.24 1t89 s VAL 163 N -1.65 0.22 0.20 1.60 -7.23 -1.08 -4.94 120.40 107.52 1t89 s VAL 163 Ca 0.46 -1.18 0.01 0.00 -1.81 0.00 0.00 61.98 59.46 1t89 s VAL 163 Cb -0.15 -0.65 -0.05 0.00 0.56 0.00 0.00 36.38 36.09 1t89 s VAL 163 CO 0.20 -0.61 0.07 -0.44 -0.31 0.00 0.00 175.10 174.00 1t89 s SER 164 N -1.87 0.85 0.09 4.85 0.01 -1.26 -2.06 113.70 114.31 1t89 s SER 164 Ca -0.09 -1.29 0.07 0.00 1.31 0.00 0.00 55.95 55.96 1t89 s SER 164 Cb -0.05 0.21 -0.04 0.00 0.21 0.00 0.00 66.02 66.35 1t89 s SER 164 CO -0.03 -0.70 -0.13 -0.94 0.41 0.00 0.00 173.24 171.85 1t89 s SER 165 N -3.19 4.19 0.74 2.44 1.04 0.03 -3.86 113.70 115.08 1t89 s SER 165 Ca 0.31 -0.43 -0.15 0.00 0.48 0.00 0.00 55.95 56.16 1t89 s SER 165 Cb 0.07 -0.74 0.04 0.00 0.10 0.00 0.00 66.02 65.50 1t89 s SER 165 CO 0.08 0.19 1.25 -1.61 0.98 0.00 0.00 173.24 174.13 1t89 s GLU 166 N -2.05 2.02 0.70 4.02 2.02 -1.26 -4.60 118.70 119.55 1t89 s GLU 166 Ca 0.19 1.90 -0.11 0.00 0.02 0.00 0.00 54.97 56.97 1t89 s GLU 166 Cb -0.11 -1.80 0.01 0.00 0.10 0.00 0.00 34.13 32.33 1t89 s GLU 166 CO 0.11 -1.96 1.06 0.95 0.02 0.00 0.00 175.26 175.44 1t89 s THR 167 N -1.81 4.00 0.11 3.63 -4.23 -1.26 -4.72 115.64 111.36 1t89 s THR 167 Ca 0.77 0.65 -0.06 0.00 -1.18 0.00 0.00 61.69 61.88 1t89 s THR 167 Cb -0.33 -3.45 -0.02 0.00 1.34 0.00 0.00 72.50 70.04 1t89 s THR 167 CO 0.46 -0.85 0.14 -0.69 -0.54 0.00 0.00 174.62 173.14 1t89 s VAL 168 N -3.10 0.13 -0.38 2.29 1.01 0.36 -4.98 120.40 115.74 1t89 s VAL 168 Ca 0.58 -1.52 -0.03 0.00 0.00 0.00 0.00 61.98 61.01 1t89 s VAL 168 Cb -0.13 -1.65 0.09 0.00 0.00 0.00 0.00 36.38 34.68 1t89 s VAL 168 CO 0.55 -0.59 0.15 0.20 0.00 0.00 0.00 175.10 175.41 1t89 s ASN 169 N -2.94 5.20 -0.91 3.32 0.01 -1.26 -0.36 114.94 118.01 1t89 s ASN 169 Ca 0.13 -1.75 -0.24 0.00 -0.71 0.00 0.00 52.86 50.28 1t89 s ASN 169 Cb 0.06 -1.82 0.03 0.00 0.41 0.00 0.00 41.25 39.93 1t89 s ASN 169 CO -0.05 -0.46 1.48 -0.63 -1.51 0.00 0.00 177.10 175.93 1t89 s ILE 170 N 1.21 3.78 -2.63 0.60 1.01 0.24 -4.77 121.20 120.64 1t89 s ILE 170 Ca 0.04 -0.34 0.27 0.00 0.00 0.00 0.00 60.65 60.62 1t89 s ILE 170 Cb -0.22 -4.84 0.46 0.00 0.01 0.00 0.00 42.46 37.88 1t89 s ILE 170 CO -0.03 -1.74 1.62 1.07 0.00 0.00 0.00 174.94 175.86