#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f88 s LYS 36 N 0.00 1.55 -0.28 -1.46 -2.85 -1.26 -4.73 119.74 110.71 3f88 s LYS 36 Ca 0.00 0.94 -0.03 0.00 -1.00 0.00 0.00 55.97 55.88 3f88 s LYS 36 Cb 0.00 -1.83 0.03 0.00 -2.06 0.00 0.00 37.83 33.97 3f88 s LYS 36 CO 0.00 -2.07 0.00 0.08 0.10 0.00 0.00 175.35 173.46 3f88 s VAL 37 N -2.92 3.24 -0.04 1.79 1.01 -1.26 -4.18 120.40 118.04 3f88 s VAL 37 Ca 0.63 -1.04 -0.19 0.00 0.00 0.00 0.00 61.98 61.38 3f88 s VAL 37 Cb -0.18 -2.72 -0.05 0.00 0.00 0.00 0.00 36.38 33.43 3f88 s VAL 37 CO 0.57 0.07 0.55 -0.89 0.00 0.00 0.00 175.10 175.39 3f88 s THR 38 N 1.36 5.01 -0.28 3.92 2.01 0.94 -4.91 115.64 123.68 3f88 s THR 38 Ca -0.01 1.13 0.02 0.00 0.31 0.00 0.00 61.69 63.14 3f88 s THR 38 Cb -0.18 -3.88 0.08 0.00 0.01 0.00 0.00 72.50 68.53 3f88 s THR 38 CO -0.01 0.40 -0.01 -0.89 -0.69 0.00 0.00 174.62 173.42 3f88 s THR 39 N -0.02 1.77 0.47 -0.82 2.01 -1.26 0.16 115.64 117.95 3f88 s THR 39 Ca 0.29 -1.66 0.02 0.00 0.31 0.00 0.00 61.69 60.64 3f88 s THR 39 Cb -0.17 -2.13 0.09 0.00 0.01 0.00 0.00 72.50 70.30 3f88 s THR 39 CO 0.15 -0.33 0.65 1.33 -0.69 0.00 0.00 174.62 175.73 3f88 n VAL 40 N 4.53 0.00 -3.97 3.82 0.24 -0.78 -4.93 118.33 117.23 3f88 n VAL 40 Ca -0.06 -1.14 -0.31 0.00 -2.04 0.00 0.00 64.34 60.79 3f88 n VAL 40 Cb 0.43 -0.95 -0.15 0.00 -1.47 0.00 0.00 33.84 31.70 3f88 n VAL 40 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3f88 s VAL 41 N -1.88 1.78 0.06 3.34 1.01 -1.26 -2.45 120.40 121.00 3f88 s VAL 41 Ca 0.44 -1.53 0.09 0.00 0.00 0.00 0.00 61.98 60.99 3f88 s VAL 41 Cb -0.03 -2.06 -0.03 0.00 0.00 0.00 0.00 36.38 34.26 3f88 s VAL 41 CO 0.29 -0.20 -0.26 0.00 0.00 0.00 0.00 175.10 174.93 3f88 s ALA 42 N 1.25 2.21 -0.18 5.51 0.00 0.85 -4.64 121.76 126.76 3f88 s ALA 42 Ca -0.03 -1.28 -0.15 0.00 0.00 0.00 0.00 51.96 50.50 3f88 s ALA 42 Cb -0.19 -0.43 -0.04 0.00 0.00 0.00 0.00 23.12 22.45 3f88 s ALA 42 CO -0.07 0.51 0.34 0.99 0.00 0.00 0.00 175.76 177.53 3f88 s THR 43 N -0.86 5.26 0.65 0.00 2.01 -0.11 -0.13 115.64 122.46 3f88 s THR 43 Ca 0.12 0.62 -0.17 0.00 0.31 0.00 0.00 61.69 62.56 3f88 s THR 43 Cb -0.10 -3.68 -0.04 0.00 0.01 0.00 0.00 72.50 68.70 3f88 s THR 43 CO 0.03 0.33 0.87 -2.65 -0.69 0.00 0.00 174.62 172.51 3f88 n PRO 44 N 3.95 0.68 0.06 4.92 -0.02 -1.26 -1.08 135.00 142.24 3f88 n PRO 44 Ca -0.10 0.27 0.13 0.00 -2.02 0.00 0.00 63.50 61.78 3f88 n PRO 44 Cb 0.52 -2.10 0.43 0.00 -0.02 0.00 0.00 33.50 32.33 3f88 n PRO 44 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3f88 n GLY 45 N 1.34 -1.56 0.00 -1.23 0.00 0.33 -4.21 105.19 99.86 3f88 n GLY 45 Ca 0.13 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3f88 n GLY 45 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3f88 n GLN 46 N -1.93 0.30 -0.05 1.61 3.00 -1.26 -4.59 117.38 114.46 3f88 n GLN 46 Ca 0.06 -0.26 0.00 0.00 -0.01 0.00 0.00 57.00 56.79 3f88 n GLN 46 Cb 0.39 -0.73 0.00 0.00 0.00 0.00 0.00 30.24 29.91 3f88 n GLN 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3f88 n GLY 47 N 0.12 0.84 3.87 1.08 0.00 -1.26 -5.10 105.19 104.74 3f88 n GLY 47 Ca 0.00 -1.88 -0.29 0.00 0.00 0.00 0.00 46.02 43.85 3f88 n GLY 47 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3f88 s PRO 48 N 1.47 1.25 -0.87 1.61 0.02 -1.26 -4.94 135.00 132.28 3f88 s PRO 48 Ca 0.00 -0.01 -0.25 0.00 0.02 0.00 0.00 61.00 60.77 3f88 s PRO 48 Cb 0.00 -1.88 -0.03 0.00 0.02 0.00 0.00 34.50 32.61 3f88 s PRO 48 CO 0.00 -2.06 1.87 -0.51 -0.33 0.00 0.00 177.00 175.97 3f88 s ASP 49 N -4.51 5.31 -0.38 2.53 1.01 -1.26 -4.78 116.67 114.59 3f88 s ASP 49 Ca 0.66 -0.59 0.02 0.00 0.71 0.00 0.00 52.55 53.35 3f88 s ASP 49 Cb -0.10 -2.56 0.16 0.00 1.01 0.00 0.00 42.92 41.43 3f88 s ASP 49 CO 0.51 -2.55 0.28 -0.60 0.21 0.00 0.00 175.17 173.02 3f88 s ARG 50 N 6.80 0.73 0.71 8.23 3.52 -1.26 -5.12 118.95 132.55 3f88 s ARG 50 Ca 0.67 -1.71 -0.16 0.00 -0.13 0.00 0.00 55.73 54.39 3f88 s ARG 50 Cb -0.07 -1.33 0.00 0.00 -1.56 0.00 0.00 34.95 31.99 3f88 s ARG 50 CO 0.02 -1.30 1.00 -2.30 -0.81 0.00 0.00 175.30 171.91 3f88 n PRO 51 N 3.43 0.58 -3.99 5.12 -0.02 -1.26 -4.50 135.00 134.35 3f88 n PRO 51 Ca 0.21 0.25 -0.09 0.00 -2.02 0.00 0.00 63.50 61.86 3f88 n PRO 51 Cb 0.43 -2.25 -0.11 0.00 -0.02 0.00 0.00 33.50 31.55 3f88 n PRO 51 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3f88 s GLN 52 N -3.31 0.36 -0.21 -0.52 -0.21 0.82 -4.91 119.66 111.68 3f88 s GLN 52 Ca 0.74 -0.70 -0.29 0.00 0.02 0.00 0.00 55.36 55.13 3f88 s GLN 52 Cb -0.35 0.13 -0.01 0.00 1.00 0.00 0.00 33.01 33.77 3f88 s GLN 52 CO 0.49 -0.06 1.28 -1.21 -2.12 0.00 0.00 175.29 173.67 3f88 s GLU 53 N -1.82 4.13 -0.18 2.91 2.02 -1.26 -0.10 118.70 124.39 3f88 s GLU 53 Ca -0.13 1.53 -0.00 0.00 0.02 0.00 0.00 54.97 56.39 3f88 s GLU 53 Cb -0.07 -3.80 0.01 0.00 0.10 0.00 0.00 34.13 30.36 3f88 s GLU 53 CO -0.02 -0.84 -0.16 0.08 0.02 0.00 0.00 175.26 174.34 3f88 s VAL 54 N 3.79 2.48 -0.15 2.63 1.01 -1.03 -4.96 120.40 124.18 3f88 s VAL 54 Ca 0.55 -0.81 -0.07 0.00 0.00 0.00 0.00 61.98 61.65 3f88 s VAL 54 Cb -0.20 -2.06 -0.04 0.00 0.00 0.00 0.00 36.38 34.08 3f88 s VAL 54 CO 0.17 0.51 0.09 -0.44 0.00 0.00 0.00 175.10 175.43 3f88 s SER 55 N 1.18 5.94 0.20 3.32 0.01 -1.26 -1.87 113.70 121.23 3f88 s SER 55 Ca 0.02 0.25 0.00 0.00 1.31 0.00 0.00 55.95 57.53 3f88 s SER 55 Cb -0.14 -1.94 -0.04 0.00 0.21 0.00 0.00 66.02 64.10 3f88 s SER 55 CO -0.07 0.29 0.09 -0.72 0.41 0.00 0.00 173.24 173.24 3f88 s TYR 56 N -0.33 1.24 0.33 2.43 -0.85 0.12 -2.05 117.35 118.24 3f88 s TYR 56 Ca 0.10 -1.25 -0.15 0.00 -0.52 0.00 0.00 57.07 55.25 3f88 s TYR 56 Cb -0.12 -0.67 0.03 0.00 0.38 0.00 0.00 41.96 41.58 3f88 s TYR 56 CO 0.01 -0.47 0.68 -0.08 -1.52 0.00 0.00 175.55 174.18 3f88 s THR 57 N -3.95 0.00 -1.53 -3.49 -1.32 0.96 -0.04 115.64 106.28 3f88 s THR 57 Ca 0.34 -1.14 0.00 0.00 -1.21 0.00 0.00 61.69 59.68 3f88 s THR 57 Cb 0.07 -2.48 0.00 0.00 -1.51 0.00 0.00 72.50 68.58 3f88 s THR 57 CO 0.10 0.00 0.00 0.47 -2.21 0.00 0.00 174.62 172.98 3f88 n ASP 58 N -0.97 -4.92 -4.55 8.08 8.00 -1.26 0.59 116.55 121.53 3f88 n ASP 58 Ca -0.05 0.14 -0.33 0.00 0.71 0.00 0.00 54.79 55.26 3f88 n ASP 58 Cb 0.60 -3.97 -0.04 0.00 -0.02 0.00 0.00 41.12 37.70 3f88 n ASP 58 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3f88 s THR 59 N -2.75 3.16 0.38 -3.53 2.01 -1.24 -4.31 115.64 109.36 3f88 s THR 59 Ca 0.00 0.03 0.08 0.00 0.31 0.00 0.00 61.69 62.10 3f88 s THR 59 Cb 0.00 -3.42 -0.02 0.00 0.01 0.00 0.00 72.50 69.08 3f88 s THR 59 CO 0.00 -0.40 0.37 -1.59 -0.69 0.00 0.00 174.62 172.31 3f88 s LYS 60 N 7.83 2.69 -0.19 4.92 -2.85 -0.01 -4.91 119.74 127.22 3f88 s LYS 60 Ca 0.84 -1.36 -0.06 0.00 -1.00 0.00 0.00 55.97 54.39 3f88 s LYS 60 Cb -0.14 -2.49 -0.03 0.00 -2.06 0.00 0.00 37.83 33.11 3f88 s LYS 60 CO 0.19 -0.06 0.02 0.54 0.10 0.00 0.00 175.35 176.14 3f88 s VAL 61 N -2.37 4.27 -0.06 1.79 0.11 -1.26 0.25 120.40 123.12 3f88 s VAL 61 Ca 0.46 -0.21 0.09 0.00 -2.93 0.00 0.00 61.98 59.39 3f88 s VAL 61 Cb -0.05 -2.93 -0.13 0.00 -1.53 0.00 0.00 36.38 31.74 3f88 s VAL 61 CO 0.28 0.44 0.11 2.30 -3.33 0.00 0.00 175.10 174.90 3f88 n ILE 62 N 3.98 0.38 -4.09 7.04 -5.35 0.33 -4.86 119.36 116.78 3f88 n ILE 62 Ca -0.17 -0.33 -0.07 0.00 -0.27 0.00 0.00 62.75 61.91 3f88 n ILE 62 Cb 0.52 -0.34 -0.10 0.00 -1.74 0.00 0.00 39.64 37.98 3f88 n ILE 62 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3f88 s GLY 63 N -3.75 0.48 -0.30 3.28 0.00 -0.20 -4.99 107.32 101.85 3f88 s GLY 63 Ca -0.04 -1.21 -0.01 0.00 0.00 0.00 0.00 44.72 43.45 3f88 s GLY 63 CO 0.40 -1.32 0.78 0.21 0.00 0.00 0.00 173.10 173.16 3f88 s ASN 64 N -2.92 -1.13 0.00 1.64 3.84 -1.26 -1.96 114.94 113.15 3f88 s ASN 64 Ca 0.07 0.08 0.00 0.00 0.21 0.00 0.00 52.86 53.22 3f88 s ASN 64 Cb 0.08 1.69 0.00 0.00 -0.55 0.00 0.00 41.25 42.47 3f88 s ASN 64 CO -0.10 -0.20 0.00 0.61 -2.79 0.00 0.00 177.10 174.62 3f88 n GLY 65 N 5.20 3.52 0.14 1.21 0.00 0.42 -4.99 105.19 110.69 3f88 n GLY 65 Ca 0.07 -0.62 0.07 0.00 0.00 0.00 0.00 46.02 45.54 3f88 n GLY 65 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3f88 n SER 66 N 0.00 0.34 -0.34 1.61 3.41 -1.26 0.52 113.62 117.90 3f88 n SER 66 Ca 0.00 0.57 0.12 0.00 -0.26 0.00 0.00 58.87 59.30 3f88 n SER 66 Cb 0.00 -0.55 0.12 0.00 -0.26 0.00 0.00 64.21 63.52 3f88 n SER 66 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 3f88 n PHE 67 N -2.00 0.00 0.00 7.33 -1.74 -1.26 -5.06 117.46 114.72 3f88 n PHE 67 Ca -0.01 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.88 3f88 n PHE 67 Cb 0.24 -0.05 0.00 0.00 1.52 0.00 0.00 39.48 41.19 3f88 n PHE 67 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 3f88 n GLY 68 N 1.41 0.52 3.12 4.97 0.00 0.18 -4.77 105.19 110.63 3f88 n GLY 68 Ca 0.09 -1.76 -0.31 0.00 0.00 0.00 0.00 46.02 44.05 3f88 n GLY 68 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3f88 s VAL 69 N 0.00 1.83 -0.15 1.61 1.01 -0.70 -0.44 120.40 123.56 3f88 s VAL 69 Ca 0.00 -0.84 -0.05 0.00 0.00 0.00 0.00 61.98 61.09 3f88 s VAL 69 Cb 0.00 -1.63 -0.04 0.00 0.00 0.00 0.00 36.38 34.71 3f88 s VAL 69 CO 0.00 0.50 0.02 -0.69 0.00 0.00 0.00 175.10 174.94 3f88 s VAL 70 N 0.87 4.45 0.07 2.92 1.01 -0.83 0.32 120.40 129.22 3f88 s VAL 70 Ca -0.07 -0.17 0.10 0.00 0.00 0.00 0.00 61.98 61.84 3f88 s VAL 70 Cb -0.15 -2.96 -0.03 0.00 0.00 0.00 0.00 36.38 33.24 3f88 s VAL 70 CO -0.01 0.51 -0.25 -0.31 0.00 0.00 0.00 175.10 175.03 3f88 s TYR 71 N 0.03 2.36 0.05 5.22 1.51 0.37 -0.52 117.35 126.37 3f88 s TYR 71 Ca 0.04 -0.38 -0.05 0.00 -1.01 0.00 0.00 57.07 55.67 3f88 s TYR 71 Cb -0.13 -1.35 -0.05 0.00 -0.11 0.00 0.00 41.96 40.32 3f88 s TYR 71 CO 0.02 0.22 0.29 -1.14 -1.11 0.00 0.00 175.55 173.83 3f88 s GLN 72 N -1.57 3.58 0.11 -0.62 0.74 0.14 -1.07 119.66 120.96 3f88 s GLN 72 Ca 0.13 -0.12 -0.15 0.00 0.05 0.00 0.00 55.36 55.27 3f88 s GLN 72 Cb -0.10 -3.02 0.03 0.00 1.10 0.00 0.00 33.01 31.02 3f88 s GLN 72 CO 0.04 0.60 0.37 0.00 -0.55 0.00 0.00 175.29 175.75 3f88 s ALA 73 N -1.42 -0.83 -0.13 1.58 0.00 -0.35 -0.83 121.76 119.77 3f88 s ALA 73 Ca 0.32 -0.09 0.02 0.00 0.00 0.00 0.00 51.96 52.21 3f88 s ALA 73 Cb -0.13 0.61 0.00 0.00 0.00 0.00 0.00 23.12 23.61 3f88 s ALA 73 CO 0.20 -0.60 -0.20 0.21 0.00 0.00 0.00 175.76 175.38 3f88 s LYS 74 N -3.62 3.12 -0.13 0.00 2.20 0.20 -0.61 119.74 120.89 3f88 s LYS 74 Ca 0.02 -0.82 -0.29 0.00 -0.36 0.00 0.00 55.97 54.52 3f88 s LYS 74 Cb 0.02 -2.47 -0.02 0.00 -1.51 0.00 0.00 37.83 33.85 3f88 s LYS 74 CO -0.11 0.07 1.31 -0.51 -0.36 0.00 0.00 175.35 175.75 3f88 s LEU 75 N 0.64 4.22 0.25 5.43 1.43 -0.45 -0.03 118.68 130.17 3f88 s LEU 75 Ca -0.10 1.80 -0.05 0.00 -1.03 0.00 0.00 54.13 54.74 3f88 s LEU 75 Cb -0.16 -3.54 0.46 0.00 0.03 0.00 0.00 46.19 42.98 3f88 s LEU 75 CO 0.02 -0.76 1.67 0.00 0.23 0.00 0.00 176.35 177.52 3f88 n ASP 77 N -5.20 0.59 0.01 0.00 3.85 -1.26 -4.27 116.55 110.27 3f88 n ASP 77 Ca 0.14 0.27 0.02 0.00 -0.71 0.00 0.00 54.79 54.51 3f88 n ASP 77 Cb 0.47 0.44 -0.10 0.00 -1.35 0.00 0.00 41.12 40.58 3f88 n ASP 77 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.20 174.65 3f88 n SER 78 N -2.85 0.58 0.00 -1.12 3.41 -1.19 -4.97 113.62 107.48 3f88 n SER 78 Ca -0.17 0.25 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 3f88 n SER 78 Cb 0.96 0.64 0.00 0.00 -0.26 0.00 0.00 64.21 65.55 3f88 n SER 78 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3f88 n GLY 79 N 1.40 1.55 3.77 5.00 0.00 -0.22 -5.02 105.19 111.67 3f88 n GLY 79 Ca -0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.51 3f88 n GLY 79 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3f88 s GLU 80 N -0.20 4.41 0.27 1.61 2.02 -1.25 -4.70 118.70 120.86 3f88 s GLU 80 Ca 0.00 1.96 -0.23 0.00 0.02 0.00 0.00 54.97 56.72 3f88 s GLU 80 Cb 0.00 -3.03 -0.09 0.00 0.10 0.00 0.00 34.13 31.11 3f88 s GLU 80 CO 0.00 -0.04 0.83 -0.51 0.02 0.00 0.00 175.26 175.56 3f88 s LEU 81 N -1.80 4.35 0.05 1.80 1.43 -1.26 -1.34 118.68 121.91 3f88 s LEU 81 Ca 0.49 1.63 -0.01 0.00 -1.03 0.00 0.00 54.13 55.21 3f88 s LEU 81 Cb -0.34 -3.79 -0.04 0.00 0.03 0.00 0.00 46.19 42.05 3f88 s LEU 81 CO 0.45 -0.01 -0.04 0.68 0.23 0.00 0.00 176.35 177.66 3f88 s VAL 82 N -1.56 0.27 0.13 -1.59 -7.23 0.22 -3.56 120.40 107.08 3f88 s VAL 82 Ca 0.46 -1.72 0.07 0.00 -1.81 0.00 0.00 61.98 58.98 3f88 s VAL 82 Cb -0.18 -1.40 -0.04 0.00 0.56 0.00 0.00 36.38 35.32 3f88 s VAL 82 CO 0.22 -0.92 -0.04 0.00 -0.31 0.00 0.00 175.10 174.05 3f88 s ALA 83 N -3.60 3.14 -0.11 1.32 0.00 0.00 -1.22 121.76 121.30 3f88 s ALA 83 Ca 0.05 -1.26 -0.02 0.00 0.00 0.00 0.00 51.96 50.73 3f88 s ALA 83 Cb 0.06 -1.01 0.04 0.00 0.00 0.00 0.00 23.12 22.20 3f88 s ALA 83 CO -0.08 0.60 0.02 0.42 0.00 0.00 0.00 175.76 176.71 3f88 s ILE 84 N -1.44 0.39 -0.29 0.00 1.01 -0.24 0.92 121.20 121.55 3f88 s ILE 84 Ca 0.25 -0.08 -0.11 0.00 0.00 0.00 0.00 60.65 60.71 3f88 s ILE 84 Cb -0.11 -0.67 -0.04 0.00 0.01 0.00 0.00 42.46 41.65 3f88 s ILE 84 CO 0.17 0.10 0.19 -0.75 0.00 0.00 0.00 174.94 174.64 3f88 s LYS 85 N 1.95 3.81 -0.30 2.79 2.20 -0.31 -0.48 119.74 129.39 3f88 s LYS 85 Ca 0.03 -0.41 -0.12 0.00 -0.36 0.00 0.00 55.97 55.11 3f88 s LYS 85 Cb -0.14 -3.65 -0.04 0.00 -1.51 0.00 0.00 37.83 32.50 3f88 s LYS 85 CO -0.06 -0.24 0.22 0.21 -0.36 0.00 0.00 175.35 175.12 3f88 s LYS 86 N 1.73 3.78 0.02 4.03 2.20 0.15 -0.41 119.74 131.24 3f88 s LYS 86 Ca 0.07 -0.42 0.05 0.00 -0.36 0.00 0.00 55.97 55.31 3f88 s LYS 86 Cb -0.16 -3.72 -0.02 0.00 -1.51 0.00 0.00 37.83 32.43 3f88 s LYS 86 CO 0.10 -0.29 -0.14 0.08 -0.36 0.00 0.00 175.35 174.74 3f88 s VAL 87 N 1.77 1.09 0.24 4.02 1.01 -0.03 -1.72 120.40 126.78 3f88 s VAL 87 Ca 0.07 -0.81 -0.31 0.00 0.00 0.00 0.00 61.98 60.93 3f88 s VAL 87 Cb -0.16 -0.95 -0.13 0.00 0.00 0.00 0.00 36.38 35.14 3f88 s VAL 87 CO 0.11 0.14 1.52 -0.11 0.00 0.00 0.00 175.10 176.75 3f88 n LEU 88 N 2.28 3.59 -3.96 3.92 7.94 -1.26 -0.76 117.00 128.75 3f88 n LEU 88 Ca -0.16 1.13 -0.27 0.00 -1.11 0.00 0.00 56.01 55.59 3f88 n LEU 88 Cb 0.55 -1.50 -0.17 0.00 0.53 0.00 0.00 43.42 42.84 3f88 n LEU 88 CO 0.24 -0.19 -0.46 -1.58 -1.11 0.00 0.00 177.39 174.28 3f88 s GLN 89 N -0.14 1.81 0.00 1.96 2.00 -1.09 -4.76 119.66 119.44 3f88 s GLN 89 Ca 0.69 -0.38 0.00 0.00 -2.00 0.00 0.00 55.36 53.67 3f88 s GLN 89 Cb -0.59 -1.72 0.00 0.00 0.80 0.00 0.00 33.01 31.50 3f88 s GLN 89 CO 0.46 -0.20 0.54 -0.25 -0.50 0.00 0.00 175.29 175.34 3f88 n ASP 90 N 4.69 0.00 0.00 6.67 9.92 -1.26 -4.26 116.55 132.31 3f88 n ASP 90 Ca -0.15 0.14 0.00 0.00 -0.53 0.00 0.00 54.79 54.25 3f88 n ASP 90 Cb 0.50 -0.14 0.00 0.00 -0.64 0.00 0.00 41.12 40.84 3f88 n ASP 90 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 3f88 n LYS 91 N -1.04 0.00 -0.46 -1.24 4.81 -1.26 -4.15 118.16 114.81 3f88 n LYS 91 Ca 0.00 0.00 0.05 0.00 -0.87 0.00 0.00 58.31 57.49 3f88 n LYS 91 Cb 0.08 -0.02 0.20 0.00 0.02 0.00 0.00 35.03 35.31 3f88 n LYS 91 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 3f88 n ARG 92 N 0.00 1.84 -4.18 1.64 1.74 -1.26 -5.00 116.66 111.44 3f88 n ARG 92 Ca 0.00 -2.96 -0.18 0.00 -0.77 0.00 0.00 57.85 53.94 3f88 n ARG 92 Cb 0.00 -1.68 -0.12 0.00 -1.02 0.00 0.00 32.46 29.64 3f88 n ARG 92 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3f88 s PHE 93 N -3.05 1.15 -0.05 -1.55 0.08 -1.26 -5.12 117.98 108.17 3f88 s PHE 93 Ca 0.39 -0.45 -0.30 0.00 0.12 0.00 0.00 56.93 56.69 3f88 s PHE 93 Cb 0.35 -0.65 -0.04 0.00 -0.57 0.00 0.00 43.02 42.10 3f88 s PHE 93 CO 0.01 0.04 1.40 0.15 -0.10 0.00 0.00 175.22 176.72 3f88 s LYS 94 N -1.63 4.26 -0.09 0.44 1.02 -1.26 -4.57 119.74 117.90 3f88 s LYS 94 Ca -0.02 1.92 -0.30 0.00 0.02 0.00 0.00 55.97 57.58 3f88 s LYS 94 Cb -0.10 -3.69 -0.02 0.00 -0.52 0.00 0.00 37.83 33.50 3f88 s LYS 94 CO 0.02 -0.64 1.20 1.21 -0.92 0.00 0.00 175.35 176.21 3f88 s ASN 95 N 2.14 7.04 -0.01 2.83 3.84 -1.26 -4.92 114.94 124.59 3f88 s ASN 95 Ca 0.63 1.75 -0.01 0.00 0.21 0.00 0.00 52.86 55.44 3f88 s ASN 95 Cb -0.29 -2.55 -0.27 0.00 -0.55 0.00 0.00 41.25 37.59 3f88 s ASN 95 CO 0.24 -0.63 0.80 -0.09 -2.79 0.00 0.00 177.10 174.64 3f88 h ARG 96 N 7.63 0.20 -0.07 0.43 2.43 -1.94 -3.28 114.38 119.78 3f88 h ARG 96 Ca -0.31 -0.35 0.00 0.00 -0.81 0.00 0.00 59.98 58.51 3f88 h ARG 96 Cb 1.14 0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.82 3f88 h ARG 96 CO 0.91 1.03 0.05 1.49 -1.51 0.00 0.00 179.97 181.94 3f88 h GLU 97 N 0.06 0.10 0.02 0.20 4.81 -1.86 -2.23 114.58 115.67 3f88 h GLU 97 Ca -0.25 -0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.00 3f88 h GLU 97 Cb 2.00 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 31.32 3f88 h GLU 97 CO 0.14 0.06 -0.28 1.25 -0.73 0.00 0.00 179.01 179.45 3f88 h LEU 98 N 0.10 -0.83 -1.37 1.64 5.85 -1.94 0.28 115.31 119.04 3f88 h LEU 98 Ca 0.03 0.11 -0.06 0.00 0.84 0.00 0.00 57.88 58.79 3f88 h LEU 98 Cb -0.01 0.33 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 3f88 h LEU 98 CO -0.01 -0.35 -0.31 1.56 -0.34 0.00 0.00 178.44 179.00 3f88 h GLN 99 N -0.44 0.00 -0.11 1.25 1.08 -1.60 0.18 115.11 115.46 3f88 h GLN 99 Ca 0.06 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.17 3f88 h GLN 99 Cb 0.51 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.95 3f88 h GLN 99 CO -0.23 0.31 -0.26 0.82 -0.95 0.00 0.00 178.83 178.51 3f88 h ILE 100 N 0.00 1.39 -0.70 2.54 2.04 -1.03 -3.23 117.51 118.52 3f88 h ILE 100 Ca -0.00 -1.56 -0.01 0.00 1.00 0.00 0.00 64.86 64.28 3f88 h ILE 100 Cb 0.60 2.11 -0.03 0.00 -0.74 0.00 0.00 36.82 38.76 3f88 h ILE 100 CO 0.04 0.46 0.40 0.24 0.00 0.00 0.00 178.15 179.29 3f88 h MET 101 N -0.05 0.96 0.00 2.37 2.86 0.63 -0.42 114.93 121.28 3f88 h MET 101 Ca -0.00 -0.09 0.00 0.00 -2.06 0.00 0.00 59.70 57.55 3f88 h MET 101 Cb 0.87 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 32.33 3f88 h MET 101 CO 0.06 0.69 0.00 0.54 1.06 0.00 0.00 176.91 179.26 3f88 n ARG 102 N -4.38 0.11 -0.08 1.72 1.74 -0.05 -3.41 116.66 112.30 3f88 n ARG 102 Ca 0.07 0.39 -0.16 0.00 -0.77 0.00 0.00 57.85 57.38 3f88 n ARG 102 Cb 0.08 -1.72 -0.12 0.00 -1.02 0.00 0.00 32.46 29.69 3f88 n ARG 102 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 3f88 h LYS 103 N 0.00 0.00 -7.05 5.56 1.57 -1.08 -3.44 116.57 112.13 3f88 h LYS 103 Ca 0.00 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.28 3f88 h LYS 103 Cb 0.26 0.00 0.06 0.00 0.08 0.00 0.00 32.23 32.64 3f88 h LYS 103 CO 0.00 0.94 0.45 -0.51 -0.57 0.00 0.00 179.45 179.75 3f88 s LEU 104 N -8.09 3.87 -0.42 2.94 1.43 -1.16 -5.04 118.68 112.21 3f88 s LEU 104 Ca -0.22 2.21 0.07 0.00 -1.03 0.00 0.00 54.13 55.15 3f88 s LEU 104 Cb 0.01 -4.44 0.18 0.00 0.03 0.00 0.00 46.19 41.97 3f88 s LEU 104 CO 0.61 -1.05 0.60 -0.62 0.23 0.00 0.00 176.35 176.12 3f88 s ASP 105 N -1.62 -1.04 -0.05 2.29 2.15 -1.26 -4.87 116.67 112.27 3f88 s ASP 105 Ca 0.69 -1.12 -0.04 0.00 0.43 0.00 0.00 52.55 52.51 3f88 s ASP 105 Cb -0.25 1.68 0.02 0.00 -0.30 0.00 0.00 42.92 44.07 3f88 s ASP 105 CO 0.29 -0.16 0.12 -2.28 -0.17 0.00 0.00 175.17 172.98 3f88 s HIS 106 N 1.57 -0.14 0.44 -5.34 2.46 -1.26 -5.05 115.29 107.97 3f88 s HIS 106 Ca 0.19 0.37 0.16 0.00 0.47 0.00 0.00 55.06 56.25 3f88 s HIS 106 Cb -0.05 -0.01 1.08 0.00 -0.13 0.00 0.00 32.58 33.47 3f88 s HIS 106 CO -0.06 -0.10 1.95 0.00 -2.47 0.00 0.00 174.74 174.06 3f88 n ASN 108 N -4.46 2.29 -4.25 0.00 5.03 -1.26 -4.77 115.26 107.82 3f88 n ASN 108 Ca 0.12 -2.19 -0.26 0.00 0.87 0.00 0.00 54.58 53.12 3f88 n ASN 108 Cb 0.48 -0.39 -0.14 0.00 -1.02 0.00 0.00 39.78 38.71 3f88 n ASN 108 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3f88 s ILE 109 N -1.66 1.70 -0.11 2.41 1.01 0.08 -0.32 121.20 124.31 3f88 s ILE 109 Ca 0.21 -1.19 -0.29 0.00 0.00 0.00 0.00 60.65 59.38 3f88 s ILE 109 Cb 0.14 -1.47 -0.03 0.00 0.01 0.00 0.00 42.46 41.11 3f88 s ILE 109 CO 0.10 0.24 1.46 -0.69 0.00 0.00 0.00 174.94 176.05 3f88 s VAL 110 N -0.78 3.93 0.18 2.92 1.01 -0.87 -4.70 120.40 122.09 3f88 s VAL 110 Ca 0.08 1.12 -0.30 0.00 0.00 0.00 0.00 61.98 62.88 3f88 s VAL 110 Cb -0.09 -3.73 -0.08 0.00 0.00 0.00 0.00 36.38 32.49 3f88 s VAL 110 CO 0.02 -0.10 1.07 -0.60 0.00 0.00 0.00 175.10 175.48 3f88 s ARG 111 N 3.79 4.63 -0.44 2.72 3.52 -1.26 -4.89 118.95 127.02 3f88 s ARG 111 Ca 0.64 1.67 -0.28 0.00 -0.13 0.00 0.00 55.73 57.63 3f88 s ARG 111 Cb -0.27 -3.29 0.03 0.00 -1.56 0.00 0.00 34.95 29.85 3f88 s ARG 111 CO 0.22 0.13 1.07 -1.17 -0.81 0.00 0.00 175.30 174.74 3f88 s LEU 112 N -0.42 3.78 -0.16 -0.88 2.96 -1.26 -2.41 118.68 120.28 3f88 s LEU 112 Ca 0.48 0.53 -0.17 0.00 -0.22 0.00 0.00 54.13 54.75 3f88 s LEU 112 Cb -0.28 -3.47 -0.14 0.00 0.50 0.00 0.00 46.19 42.80 3f88 s LEU 112 CO 0.34 -1.12 0.23 0.03 -1.32 0.00 0.00 176.35 174.52 3f88 h ARG 113 N 8.92 0.00 -4.89 1.98 3.08 -0.86 -3.34 114.38 119.26 3f88 h ARG 113 Ca -0.23 0.00 -0.34 0.00 0.07 0.00 0.00 59.98 59.48 3f88 h ARG 113 Cb 1.06 0.00 -0.14 0.00 0.08 0.00 0.00 29.97 30.97 3f88 h ARG 113 CO 1.08 0.63 -0.63 0.71 -1.07 0.00 0.00 179.97 180.69 3f88 s TYR 114 N -2.18 1.48 -0.01 3.04 1.51 -0.95 -0.52 117.35 119.72 3f88 s TYR 114 Ca -0.19 -1.11 -0.03 0.00 -1.01 0.00 0.00 57.07 54.72 3f88 s TYR 114 Cb 0.02 -0.86 0.00 0.00 -0.11 0.00 0.00 41.96 41.01 3f88 s TYR 114 CO 0.44 -0.27 0.07 -0.59 -1.11 0.00 0.00 175.55 174.10 3f88 s PHE 115 N -3.69 0.01 0.31 2.71 -0.12 -0.24 -1.16 117.98 115.81 3f88 s PHE 115 Ca 0.34 -0.02 -0.12 0.00 -0.05 0.00 0.00 56.93 57.08 3f88 s PHE 115 Cb 0.07 -0.03 0.02 0.00 -0.63 0.00 0.00 43.02 42.44 3f88 s PHE 115 CO 0.11 -0.13 0.59 -0.59 -0.05 0.00 0.00 175.22 175.15 3f88 s PHE 116 N -0.60 0.40 0.15 3.49 -0.12 -0.48 -0.93 117.98 119.89 3f88 s PHE 116 Ca -0.07 -0.82 0.10 0.00 -0.05 0.00 0.00 56.93 56.09 3f88 s PHE 116 Cb -0.04 0.37 -0.04 0.00 -0.63 0.00 0.00 43.02 42.67 3f88 s PHE 116 CO 0.00 -1.22 -0.24 0.71 -0.05 0.00 0.00 175.22 174.43 3f88 s TYR 117 N -3.31 2.14 0.00 3.49 1.51 -1.26 0.34 117.35 120.27 3f88 s TYR 117 Ca 0.21 -0.39 0.00 0.00 -1.01 0.00 0.00 57.07 55.88 3f88 s TYR 117 Cb -0.03 -1.12 0.00 0.00 -0.11 0.00 0.00 41.96 40.71 3f88 s TYR 117 CO 0.12 0.36 0.00 -1.13 -1.11 0.00 0.00 175.55 173.80 3f88 n SER 118 N 0.66 3.17 -3.78 2.29 3.41 -0.91 -4.95 113.62 113.50 3f88 n SER 118 Ca -0.16 0.00 -0.24 0.00 -0.26 0.00 0.00 58.87 58.21 3f88 n SER 118 Cb 0.55 0.00 -0.17 0.00 -0.26 0.00 0.00 64.21 64.32 3f88 n SER 118 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 3f88 s SER 119 N 2.00 1.78 0.19 4.04 0.01 -1.26 -1.51 113.70 118.96 3f88 s SER 119 Ca 0.00 -0.18 -0.30 0.00 1.31 0.00 0.00 55.95 56.78 3f88 s SER 119 Cb 0.00 -0.50 -0.08 0.00 0.21 0.00 0.00 66.02 65.65 3f88 s SER 119 CO 0.00 -0.20 0.98 0.54 0.41 0.00 0.00 173.24 174.97 3f88 s VAL 126 N 1.93 4.16 -0.03 3.43 0.11 -1.26 -5.04 120.40 123.70 3f88 s VAL 126 Ca 0.04 1.99 0.07 0.00 -2.93 0.00 0.00 61.98 61.15 3f88 s VAL 126 Cb -0.13 -4.27 -0.02 0.00 -1.53 0.00 0.00 36.38 30.43 3f88 s VAL 126 CO -0.06 0.40 -0.24 -0.31 -3.33 0.00 0.00 175.10 171.56 3f88 s TYR 127 N -0.66 2.41 -0.01 1.54 1.51 -0.57 -2.66 117.35 118.92 3f88 s TYR 127 Ca 0.44 -0.43 -0.22 0.00 -1.01 0.00 0.00 57.07 55.85 3f88 s TYR 127 Cb -0.26 -1.54 -0.05 0.00 -0.11 0.00 0.00 41.96 40.00 3f88 s TYR 127 CO 0.32 -0.02 0.66 -1.17 -1.11 0.00 0.00 175.55 174.23 3f88 s LEU 128 N -0.57 4.40 -0.20 -1.29 2.96 0.06 -2.14 118.68 121.90 3f88 s LEU 128 Ca 0.08 1.24 -0.01 0.00 -0.22 0.00 0.00 54.13 55.22 3f88 s LEU 128 Cb -0.11 -3.03 0.01 0.00 0.50 0.00 0.00 46.19 43.56 3f88 s LEU 128 CO -0.00 0.03 -0.13 0.20 -1.32 0.00 0.00 176.35 175.13 3f88 s ASN 129 N 0.08 3.68 -0.37 3.68 0.01 0.15 -0.85 114.94 121.33 3f88 s ASN 129 Ca 0.34 -0.53 -0.07 0.00 -0.71 0.00 0.00 52.86 51.90 3f88 s ASN 129 Cb -0.19 -1.60 0.06 0.00 0.41 0.00 0.00 41.25 39.93 3f88 s ASN 129 CO 0.19 -0.01 0.16 -0.76 -1.51 0.00 0.00 177.10 175.17 3f88 s LEU 130 N 1.36 4.66 -0.40 0.60 1.43 0.45 -1.38 118.68 125.39 3f88 s LEU 130 Ca 0.05 -1.33 -0.25 0.00 -1.03 0.00 0.00 54.13 51.57 3f88 s LEU 130 Cb -0.14 -1.90 0.02 0.00 0.03 0.00 0.00 46.19 44.20 3f88 s LEU 130 CO -0.08 -0.41 0.88 -0.69 0.23 0.00 0.00 176.35 176.28 3f88 s VAL 131 N 1.38 4.59 0.31 -1.59 1.01 -0.31 -1.17 120.40 124.63 3f88 s VAL 131 Ca 0.01 0.93 0.10 0.00 0.00 0.00 0.00 61.98 63.01 3f88 s VAL 131 Cb -0.21 -4.33 -0.05 0.00 0.00 0.00 0.00 36.38 31.79 3f88 s VAL 131 CO 0.02 -0.62 -0.06 -0.76 0.00 0.00 0.00 175.10 173.68 3f88 s LEU 132 N 3.46 2.88 0.64 3.92 1.43 0.26 -0.11 118.68 131.15 3f88 s LEU 132 Ca 0.36 -0.98 -0.17 0.00 -1.03 0.00 0.00 54.13 52.30 3f88 s LEU 132 Cb -0.12 -1.29 -0.03 0.00 0.03 0.00 0.00 46.19 44.78 3f88 s LEU 132 CO 0.21 -0.12 0.93 0.47 0.23 0.00 0.00 176.35 178.07 3f88 n ASP 133 N -0.83 0.54 -4.83 2.29 8.00 -1.01 -0.82 116.55 119.89 3f88 n ASP 133 Ca -0.05 0.75 -0.37 0.00 0.71 0.00 0.00 54.79 55.83 3f88 n ASP 133 Cb 0.61 -1.38 -0.06 0.00 -0.02 0.00 0.00 41.12 40.27 3f88 n ASP 133 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 3f88 s TYR 134 N -1.61 3.65 -0.05 1.24 5.04 -1.23 -3.81 117.35 120.57 3f88 s TYR 134 Ca 0.75 0.81 -0.02 0.00 -2.44 0.00 0.00 57.07 56.17 3f88 s TYR 134 Cb -0.39 -2.20 0.03 0.00 0.35 0.00 0.00 41.96 39.74 3f88 s TYR 134 CO 0.48 0.60 0.03 0.08 -1.34 0.00 0.00 175.55 175.40 3f88 s VAL 135 N -0.81 0.12 0.07 3.14 1.01 -1.26 -4.96 120.40 117.71 3f88 s VAL 135 Ca 0.20 0.27 -0.18 0.00 0.00 0.00 0.00 61.98 62.27 3f88 s VAL 135 Cb -0.15 -0.32 -0.11 0.00 0.00 0.00 0.00 36.38 35.80 3f88 s VAL 135 CO 0.09 0.21 1.42 1.55 0.00 0.00 0.00 175.10 178.37 3f88 h PRO 136 N 8.30 0.48 -6.17 2.72 0.13 -1.98 -3.45 132.00 132.03 3f88 h PRO 136 Ca -0.18 -0.22 -0.52 0.00 -0.87 0.00 0.00 66.00 64.22 3f88 h PRO 136 Cb 1.12 -0.01 -0.05 0.00 0.13 0.00 0.00 31.00 32.19 3f88 h PRO 136 CO 0.22 0.77 -0.50 -2.00 -0.23 0.00 0.00 178.00 176.26 3f88 s GLU 137 N -4.52 2.64 0.17 0.86 2.56 0.50 -4.95 118.70 115.95 3f88 s GLU 137 Ca -0.13 -1.32 0.10 0.00 0.00 0.00 0.00 54.97 53.61 3f88 s GLU 137 Cb 0.07 -2.39 -0.04 0.00 2.00 0.00 0.00 34.13 33.77 3f88 s GLU 137 CO 0.77 0.19 -0.21 0.95 -0.56 0.00 0.00 175.26 176.39 3f88 s THR 138 N -2.30 2.07 0.43 -1.70 -4.23 -1.26 0.32 115.64 108.97 3f88 s THR 138 Ca 0.38 -1.93 0.11 0.00 -1.18 0.00 0.00 61.69 59.07 3f88 s THR 138 Cb -0.05 -1.95 0.21 0.00 1.34 0.00 0.00 72.50 72.04 3f88 s THR 138 CO 0.25 -0.19 2.01 0.58 -0.54 0.00 0.00 174.62 176.72 3f88 h VAL 139 N 3.32 1.12 -0.34 2.29 2.07 -1.01 -1.68 116.25 122.02 3f88 h VAL 139 Ca -0.45 -0.48 -0.01 0.00 0.82 0.00 0.00 66.70 66.59 3f88 h VAL 139 Cb 1.20 1.07 -0.02 0.00 -1.52 0.00 0.00 31.29 32.03 3f88 h VAL 139 CO 0.48 0.15 0.19 0.22 0.02 0.00 0.00 177.57 178.63 3f88 h TYR 140 N 0.19 0.47 -0.11 1.57 3.20 -1.78 0.18 116.97 120.67 3f88 h TYR 140 Ca 0.04 -0.01 -0.22 0.00 3.14 0.00 0.00 58.73 61.68 3f88 h TYR 140 Cb 0.21 -0.15 0.01 0.00 1.54 0.00 0.00 36.73 38.34 3f88 h TYR 140 CO 0.00 0.37 -0.80 0.00 -1.64 0.00 0.00 178.16 176.09 3f88 h ARG 141 N 0.43 0.68 0.20 1.82 3.08 -1.73 -2.68 114.38 116.18 3f88 h ARG 141 Ca 0.12 -0.58 -0.01 0.00 0.07 0.00 0.00 59.98 59.58 3f88 h ARG 141 Cb 0.05 0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.24 3f88 h ARG 141 CO -0.02 1.19 -0.10 0.28 -1.07 0.00 0.00 179.97 180.26 3f88 h VAL 142 N 0.45 0.82 -0.27 2.04 2.07 -1.28 0.12 116.25 120.21 3f88 h VAL 142 Ca -0.06 -0.12 0.08 0.00 0.82 0.00 0.00 66.70 67.42 3f88 h VAL 142 Cb 1.42 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 32.08 3f88 h VAL 142 CO 0.16 0.03 0.25 0.00 0.02 0.00 0.00 177.57 178.02 3f88 h ALA 143 N 0.45 2.04 0.03 1.67 0.00 -0.60 -1.85 119.26 121.00 3f88 h ALA 143 Ca -0.03 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.57 3f88 h ALA 143 Cb 0.26 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 3f88 h ALA 143 CO 0.05 -0.39 -1.77 -2.13 0.00 0.00 0.00 179.25 175.01 3f88 n ARG 144 N -4.03 0.66 -0.27 0.00 0.63 -1.02 -1.24 116.66 111.39 3f88 n ARG 144 Ca 0.04 0.29 -0.01 0.00 -0.92 0.00 0.00 57.85 57.25 3f88 n ARG 144 Cb 0.40 -1.78 0.11 0.00 0.45 0.00 0.00 32.46 31.64 3f88 n ARG 144 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 3f88 h HIS 145 N 0.01 0.85 -0.18 -0.14 3.86 -0.18 0.44 115.15 119.81 3f88 h HIS 145 Ca -0.31 0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 58.86 3f88 h HIS 145 Cb 2.02 -0.27 -0.00 0.00 1.06 0.00 0.00 27.41 30.22 3f88 h HIS 145 CO 0.02 0.44 -0.14 1.88 0.86 0.00 0.00 177.93 180.98 3f88 h TYR 146 N 0.85 0.49 -0.70 2.45 -1.99 -1.37 -2.80 116.97 113.89 3f88 h TYR 146 Ca 0.33 -0.14 0.03 0.00 2.00 0.00 0.00 58.73 60.95 3f88 h TYR 146 Cb 0.14 -0.11 -0.04 0.00 2.00 0.00 0.00 36.73 38.72 3f88 h TYR 146 CO -0.05 0.76 0.44 1.03 -0.00 0.00 0.00 178.16 180.34 3f88 h SER 147 N 0.09 0.72 0.62 3.88 0.87 -1.00 -0.66 113.55 118.07 3f88 h SER 147 Ca 0.03 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 3f88 h SER 147 Cb 0.66 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.46 3f88 h SER 147 CO 0.04 0.50 0.00 0.54 -0.53 0.00 0.00 176.83 177.38 3f88 n ARG 148 N -4.66 0.05 -0.32 2.24 1.74 0.13 -2.03 116.66 113.80 3f88 n ARG 148 Ca 0.08 0.15 0.07 0.00 -0.77 0.00 0.00 57.85 57.38 3f88 n ARG 148 Cb 0.09 -1.50 0.21 0.00 -1.02 0.00 0.00 32.46 30.24 3f88 n ARG 148 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3f88 n ALA 149 N -1.46 2.67 -3.96 7.54 0.00 -0.34 -4.98 120.51 119.98 3f88 n ALA 149 Ca 0.06 -1.93 -0.26 0.00 0.00 0.00 0.00 53.44 51.30 3f88 n ALA 149 Cb 0.22 -0.58 -0.02 0.00 0.00 0.00 0.00 19.45 19.06 3f88 n ALA 149 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3f88 n LYS 150 N -0.27 -3.07 -3.82 0.00 4.01 -0.86 -4.95 118.16 109.20 3f88 n LYS 150 Ca 0.17 0.39 -0.15 0.00 -0.51 0.00 0.00 58.31 58.21 3f88 n LYS 150 Cb 0.71 -4.45 -0.16 0.00 -0.51 0.00 0.00 35.03 30.63 3f88 n LYS 150 CO 0.00 0.00 0.00 -0.65 -1.11 0.00 0.00 177.40 175.64 3f88 s GLN 151 N -6.57 0.06 0.57 1.97 -1.52 -0.68 -5.05 119.66 108.44 3f88 s GLN 151 Ca 0.02 0.15 -0.16 0.00 -1.95 0.00 0.00 55.36 53.42 3f88 s GLN 151 Cb -0.01 -0.30 -0.05 0.00 -0.22 0.00 0.00 33.01 32.43 3f88 s GLN 151 CO 0.89 -0.15 1.04 -0.08 -0.25 0.00 0.00 175.29 176.75 3f88 s THR 152 N 1.00 3.91 -0.23 -0.19 -1.32 -1.26 -4.00 115.64 113.55 3f88 s THR 152 Ca -0.09 0.95 -0.27 0.00 -1.21 0.00 0.00 61.69 61.06 3f88 s THR 152 Cb -0.12 -3.44 0.00 0.00 -1.51 0.00 0.00 72.50 67.43 3f88 s THR 152 CO -0.02 -0.49 0.96 -0.22 -2.21 0.00 0.00 174.62 172.64 3f88 s LEU 153 N -4.29 4.10 -0.46 9.08 2.96 -1.26 -4.94 118.68 123.86 3f88 s LEU 153 Ca 0.63 1.27 -0.46 0.00 -0.22 0.00 0.00 54.13 55.36 3f88 s LEU 153 Cb -0.15 -3.42 -0.20 0.00 0.50 0.00 0.00 46.19 42.92 3f88 s LEU 153 CO 0.34 -0.60 1.54 -2.65 -1.32 0.00 0.00 176.35 173.65 3f88 n PRO 154 N 6.13 0.00 -0.51 0.98 -0.02 -1.26 -4.69 135.00 135.63 3f88 n PRO 154 Ca 0.10 0.00 0.42 0.00 -2.02 0.00 0.00 63.50 61.99 3f88 n PRO 154 Cb 0.47 -1.47 0.71 0.00 -0.02 0.00 0.00 33.50 33.18 3f88 n PRO 154 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3f88 h VAL 155 N 4.78 0.09 -0.84 -1.45 2.07 -1.96 0.37 116.25 119.31 3f88 h VAL 155 Ca -0.43 -0.02 0.01 0.00 0.82 0.00 0.00 66.70 67.08 3f88 h VAL 155 Cb 1.34 0.04 -0.04 0.00 -1.52 0.00 0.00 31.29 31.11 3f88 h VAL 155 CO 0.94 0.01 0.55 -0.29 0.02 0.00 0.00 177.57 178.80 3f88 h ILE 156 N 0.05 1.22 0.00 4.57 6.09 -2.00 0.29 117.51 127.72 3f88 h ILE 156 Ca 0.85 -0.41 -0.16 0.00 -1.37 0.00 0.00 64.86 63.78 3f88 h ILE 156 Cb 2.91 -0.01 -0.02 0.00 0.47 0.00 0.00 36.82 40.17 3f88 h ILE 156 CO -0.30 0.21 -0.74 1.88 -3.07 0.00 0.00 178.15 176.13 3f88 h TYR 157 N 1.14 0.00 -0.51 2.19 0.05 -0.60 -2.23 116.97 117.01 3f88 h TYR 157 Ca 0.31 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 59.03 3f88 h TYR 157 Cb -0.12 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.60 3f88 h TYR 157 CO 0.00 0.74 0.11 0.28 -1.05 0.00 0.00 178.16 178.25 3f88 h VAL 158 N 0.00 1.24 -0.00 -2.88 2.07 -0.86 -0.30 116.25 115.52 3f88 h VAL 158 Ca -0.01 -0.87 -0.00 0.00 0.82 0.00 0.00 66.70 66.64 3f88 h VAL 158 Cb 1.37 0.84 -0.00 0.00 -1.52 0.00 0.00 31.29 31.97 3f88 h VAL 158 CO 0.10 0.31 0.00 0.11 0.02 0.00 0.00 177.57 178.11 3f88 h LYS 159 N 0.70 0.00 0.76 1.57 1.57 -0.36 0.40 116.57 121.21 3f88 h LYS 159 Ca 0.16 -0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.90 3f88 h LYS 159 Cb 0.35 -0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.66 3f88 h LYS 159 CO 0.00 0.06 -0.36 -0.07 -0.57 0.00 0.00 179.45 178.51 3f88 h LEU 160 N -0.06 -0.86 -0.32 2.94 3.38 -1.34 0.15 115.31 119.20 3f88 h LEU 160 Ca 0.00 0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.04 3f88 h LEU 160 Cb 0.06 0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.99 3f88 h LEU 160 CO -0.00 -0.59 0.06 1.88 0.09 0.00 0.00 178.44 179.88 3f88 h TYR 161 N -1.05 0.10 0.30 1.13 0.05 -1.07 -1.19 116.97 115.25 3f88 h TYR 161 Ca -0.10 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.68 3f88 h TYR 161 Cb 0.79 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.53 3f88 h TYR 161 CO -0.02 0.02 -0.17 0.52 -1.05 0.00 0.00 178.16 177.47 3f88 h MET 162 N 0.18 -0.42 -0.75 4.88 2.86 -0.88 -1.86 114.93 118.93 3f88 h MET 162 Ca 0.15 0.03 0.17 0.00 -2.06 0.00 0.00 59.70 57.99 3f88 h MET 162 Cb 0.17 0.10 -0.12 0.00 0.06 0.00 0.00 31.60 31.80 3f88 h MET 162 CO -0.20 -0.28 0.11 -0.92 1.06 0.00 0.00 176.91 176.68 3f88 h TYR 163 N -0.44 0.14 0.00 -0.22 3.20 -0.41 0.14 116.97 119.37 3f88 h TYR 163 Ca -0.03 0.05 -0.15 0.00 3.14 0.00 0.00 58.73 61.74 3f88 h TYR 163 Cb 0.35 0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.66 3f88 h TYR 163 CO -0.07 -0.17 -0.70 1.96 -1.64 0.00 0.00 178.16 177.54 3f88 h GLN 164 N 0.18 0.00 0.61 1.82 4.20 -1.05 0.12 115.11 121.01 3f88 h GLN 164 Ca 0.43 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 59.11 3f88 h GLN 164 Cb 0.76 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.55 3f88 h GLN 164 CO -0.59 0.70 -0.30 1.25 -0.67 0.00 0.00 178.83 179.23 3f88 h LEU 165 N 0.00 -0.70 -1.06 1.46 5.85 -0.33 -2.23 115.31 118.30 3f88 h LEU 165 Ca -0.01 -0.01 0.15 0.00 0.84 0.00 0.00 57.88 58.86 3f88 h LEU 165 Cb 1.28 0.18 -0.09 0.00 0.37 0.00 0.00 40.66 42.40 3f88 h LEU 165 CO 0.09 -0.43 0.62 -0.26 -0.34 0.00 0.00 178.44 178.12 3f88 h PHE 166 N -0.93 1.06 -0.62 1.25 0.04 -0.56 0.58 116.94 117.77 3f88 h PHE 166 Ca -0.08 0.03 -0.08 0.00 2.80 0.00 0.00 57.97 60.64 3f88 h PHE 166 Cb 0.67 -0.33 -0.02 0.00 2.20 0.00 0.00 35.95 38.46 3f88 h PHE 166 CO -0.01 0.35 0.07 0.00 -0.60 0.00 0.00 178.31 178.11 3f88 h ARG 167 N 0.86 1.04 -0.52 1.51 3.08 -0.96 -1.72 114.38 117.67 3f88 h ARG 167 Ca 0.52 -0.30 -0.11 0.00 0.07 0.00 0.00 59.98 60.17 3f88 h ARG 167 Cb 0.69 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.61 3f88 h ARG 167 CO -0.30 0.99 -0.11 0.66 -1.07 0.00 0.00 179.97 180.14 3f88 h SER 168 N 0.95 0.98 0.12 7.04 4.64 -0.44 -1.07 113.55 125.77 3f88 h SER 168 Ca 0.18 -0.32 -0.01 0.00 -0.47 0.00 0.00 61.79 61.18 3f88 h SER 168 Cb 0.47 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 3f88 h SER 168 CO 0.02 1.09 -0.06 -0.07 -0.87 0.00 0.00 176.83 176.94 3f88 h LEU 169 N 0.87 -0.14 -1.75 5.97 3.38 -0.86 -0.38 115.31 122.40 3f88 h LEU 169 Ca 0.14 -0.06 0.33 0.00 0.09 0.00 0.00 57.88 58.37 3f88 h LEU 169 Cb 0.66 0.04 -0.07 0.00 0.09 0.00 0.00 40.66 41.38 3f88 h LEU 169 CO 0.05 -0.02 0.80 0.00 0.09 0.00 0.00 178.44 179.35 3f88 h ALA 170 N 0.63 2.81 0.60 1.53 0.00 -1.10 0.73 119.26 124.47 3f88 h ALA 170 Ca -0.02 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 3f88 h ALA 170 Cb 0.19 0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.06 3f88 h ALA 170 CO 0.03 -1.19 -0.29 -0.92 0.00 0.00 0.00 179.25 176.87 3f88 h TYR 171 N 0.13 -0.75 0.00 0.00 5.03 0.24 -3.12 116.97 118.50 3f88 h TYR 171 Ca 0.59 -0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.88 3f88 h TYR 171 Cb 2.04 0.25 0.00 0.00 1.55 0.00 0.00 36.73 40.57 3f88 h TYR 171 CO -0.00 -0.46 0.00 0.44 -1.32 0.00 0.00 178.16 176.81 3f88 n ILE 172 N -5.31 0.86 0.05 1.81 -5.35 -0.61 -3.19 119.36 107.61 3f88 n ILE 172 Ca -0.10 0.24 -0.18 0.00 -0.27 0.00 0.00 62.75 62.43 3f88 n ILE 172 Cb 0.32 -1.14 -0.14 0.00 -1.74 0.00 0.00 39.64 36.94 3f88 n ILE 172 CO 0.00 0.00 0.00 0.45 -1.76 0.00 0.00 176.55 175.24 3f88 h HIS 173 N 0.00 0.48 -0.23 4.28 3.86 -0.97 0.97 115.15 123.53 3f88 h HIS 173 Ca 0.00 -0.35 0.07 0.00 -1.16 0.00 0.00 60.37 58.93 3f88 h HIS 173 Cb 0.34 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 28.79 3f88 h HIS 173 CO 0.00 1.48 0.26 0.66 0.86 0.00 0.00 177.93 181.18 3f88 h SER 174 N 0.07 0.00 0.01 2.45 4.64 -1.50 0.38 113.55 119.59 3f88 h SER 174 Ca -0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 3f88 h SER 174 Cb 2.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.13 3f88 h SER 174 CO 0.15 0.00 -0.04 0.49 -0.87 0.00 0.00 176.83 176.55 3f88 n PHE 175 N -3.77 0.00 -1.19 4.77 3.01 -1.21 -4.95 117.46 114.12 3f88 n PHE 175 Ca 0.03 0.00 -0.07 0.00 1.01 0.00 0.00 57.45 58.42 3f88 n PHE 175 Cb 0.39 -0.01 -0.03 0.00 -0.01 0.00 0.00 39.48 39.82 3f88 n PHE 175 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3f88 n GLY 176 N 1.24 0.88 3.66 1.37 0.00 0.13 -4.92 105.19 107.56 3f88 n GLY 176 Ca 0.17 -0.56 -0.39 0.00 0.00 0.00 0.00 46.02 45.24 3f88 n GLY 176 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3f88 s ILE 177 N -2.18 5.14 -0.16 -0.61 1.01 0.33 -1.64 121.20 123.08 3f88 s ILE 177 Ca 0.00 0.87 -0.03 0.00 0.00 0.00 0.00 60.65 61.49 3f88 s ILE 177 Cb 0.00 -3.80 -0.02 0.00 0.01 0.00 0.00 42.46 38.65 3f88 s ILE 177 CO 0.00 0.20 -0.05 0.00 0.00 0.00 0.00 174.94 175.09 3f88 h HIS 179 N 6.95 -0.62 -0.04 0.00 2.76 -1.91 -2.91 115.15 119.38 3f88 h HIS 179 Ca -0.32 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 57.83 3f88 h HIS 179 Cb 1.19 0.20 -0.00 0.00 1.55 0.00 0.00 27.41 30.35 3f88 h HIS 179 CO 0.54 -0.31 -0.01 0.54 -1.30 0.00 0.00 177.93 177.40 3f88 n ARG 180 N -5.30 -0.03 -1.52 5.26 1.74 -1.26 -2.66 116.66 112.89 3f88 n ARG 180 Ca -0.11 0.09 -0.02 0.00 -0.77 0.00 0.00 57.85 57.04 3f88 n ARG 180 Cb 0.31 -3.61 0.02 0.00 -1.02 0.00 0.00 32.46 28.17 3f88 n ARG 180 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3f88 n ASP 181 N 1.94 -0.59 -4.74 0.55 2.03 -1.26 -2.83 116.55 111.65 3f88 n ASP 181 Ca -0.00 -1.30 -0.41 0.00 0.52 0.00 0.00 54.79 53.59 3f88 n ASP 181 Cb 0.43 0.24 -0.03 0.00 -0.72 0.00 0.00 41.12 41.05 3f88 n ASP 181 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3f88 s ILE 182 N 0.04 3.22 0.00 5.18 -1.09 -1.26 -4.76 121.20 122.52 3f88 s ILE 182 Ca 0.02 1.03 0.00 0.00 -2.23 0.00 0.00 60.65 59.47 3f88 s ILE 182 Cb 0.12 -3.66 0.00 0.00 -1.58 0.00 0.00 42.46 37.35 3f88 s ILE 182 CO -0.04 0.17 0.00 2.29 -1.23 0.00 0.00 174.94 176.13 3f88 n LYS 183 N 2.40 0.00 -0.32 2.79 2.85 -1.26 -4.82 118.16 119.80 3f88 n LYS 183 Ca 0.05 0.00 0.10 0.00 -1.05 0.00 0.00 58.31 57.41 3f88 n LYS 183 Cb 0.43 0.00 0.21 0.00 -0.65 0.00 0.00 35.03 35.02 3f88 n LYS 183 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 177.40 176.00 3f88 h PRO 184 N 0.00 0.03 0.00 -1.58 0.11 -1.94 0.81 132.00 129.44 3f88 h PRO 184 Ca 0.00 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3f88 h PRO 184 Cb 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.10 3f88 h PRO 184 CO 0.00 0.02 0.00 1.96 -0.21 0.00 0.00 178.00 179.77 3f88 h GLN 185 N 0.03 0.00 -0.64 1.05 7.50 -1.95 -2.34 115.11 118.77 3f88 h GLN 185 Ca 0.51 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.66 3f88 h GLN 185 Cb 0.96 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.49 3f88 h GLN 185 CO -0.87 0.00 0.00 0.09 -1.50 0.00 0.00 178.83 176.55 3f88 n ASN 186 N -2.59 3.76 -4.18 1.46 3.02 0.28 -4.74 115.26 112.28 3f88 n ASN 186 Ca -0.01 -1.99 -0.37 0.00 -0.03 0.00 0.00 54.58 52.18 3f88 n ASN 186 Cb 0.11 -0.42 -0.12 0.00 -0.61 0.00 0.00 39.78 38.74 3f88 n ASN 186 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3f88 s LEU 187 N -1.07 4.87 0.15 3.41 1.43 -0.89 -1.30 118.68 125.28 3f88 s LEU 187 Ca 0.44 -1.69 -0.25 0.00 -1.03 0.00 0.00 54.13 51.61 3f88 s LEU 187 Cb 0.24 -1.84 -0.08 0.00 0.03 0.00 0.00 46.19 44.54 3f88 s LEU 187 CO 0.31 -0.47 0.75 -0.76 0.23 0.00 0.00 176.35 176.41 3f88 s LEU 188 N 1.25 4.59 0.05 1.79 1.43 -0.09 -0.83 118.68 126.87 3f88 s LEU 188 Ca 0.03 1.60 0.09 0.00 -1.03 0.00 0.00 54.13 54.82 3f88 s LEU 188 Cb -0.22 -3.25 -0.03 0.00 0.03 0.00 0.00 46.19 42.73 3f88 s LEU 188 CO -0.02 0.21 -0.25 -0.76 0.23 0.00 0.00 176.35 175.77 3f88 s LEU 189 N -1.12 2.19 -0.29 1.79 1.43 0.15 0.76 118.68 123.59 3f88 s LEU 189 Ca 0.35 -0.59 -0.08 0.00 -1.03 0.00 0.00 54.13 52.78 3f88 s LEU 189 Cb -0.23 -1.19 -0.00 0.00 0.03 0.00 0.00 46.19 44.80 3f88 s LEU 189 CO 0.25 0.22 0.09 -0.62 0.23 0.00 0.00 176.35 176.52 3f88 s ASP 190 N -1.32 5.20 0.33 2.29 -1.08 -0.44 -0.37 116.67 121.27 3f88 s ASP 190 Ca 0.11 -0.53 0.08 0.00 -0.52 0.00 0.00 52.55 51.69 3f88 s ASP 190 Cb -0.10 -1.92 0.58 0.00 -1.46 0.00 0.00 42.92 40.03 3f88 s ASP 190 CO 0.02 -0.15 1.77 -0.65 0.52 0.00 0.00 175.17 176.69 3f88 h PRO 191 N 8.26 0.20 0.00 4.34 0.11 -1.95 0.29 132.00 143.25 3f88 h PRO 191 Ca -0.34 -0.08 -0.20 0.00 0.11 0.00 0.00 66.00 65.50 3f88 h PRO 191 Cb 1.14 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 3f88 h PRO 191 CO 0.60 0.51 -0.87 -0.44 -0.21 0.00 0.00 178.00 177.60 3f88 h ASP 192 N 0.17 0.26 0.00 -2.05 3.32 -1.98 -3.31 116.42 112.83 3f88 h ASP 192 Ca 0.02 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 56.87 3f88 h ASP 192 Cb 0.68 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.15 3f88 h ASP 192 CO 0.05 1.00 -1.03 0.35 -1.72 0.00 0.00 179.24 177.89 3f88 n THR 193 N -3.66 0.00 -1.22 0.35 -2.24 -1.19 -4.99 114.28 101.33 3f88 n THR 193 Ca -0.04 -0.19 -0.07 0.00 -2.27 0.00 0.00 64.05 61.48 3f88 n THR 193 Cb 0.80 0.76 -0.03 0.00 -2.10 0.00 0.00 70.33 69.76 3f88 n THR 193 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3f88 n ALA 194 N -1.57 -0.11 -2.23 6.98 0.00 0.10 -4.25 120.51 119.42 3f88 n ALA 194 Ca 0.01 0.12 -0.42 0.00 0.00 0.00 0.00 53.44 53.15 3f88 n ALA 194 Cb 0.30 -1.40 -0.03 0.00 0.00 0.00 0.00 19.45 18.32 3f88 n ALA 194 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3f88 s VAL 195 N -1.87 3.77 -0.15 0.00 1.01 -1.15 -4.73 120.40 117.28 3f88 s VAL 195 Ca 0.00 1.12 -0.08 0.00 0.00 0.00 0.00 61.98 63.02 3f88 s VAL 195 Cb 0.00 -3.72 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 3f88 s VAL 195 CO 0.00 -0.02 0.13 -0.22 0.00 0.00 0.00 175.10 175.00 3f88 s LEU 196 N 2.59 4.31 -0.13 3.92 0.20 -1.26 -1.32 118.68 126.98 3f88 s LEU 196 Ca 0.63 0.38 -0.00 0.00 0.69 0.00 0.00 54.13 55.83 3f88 s LEU 196 Cb -0.30 -2.07 0.03 0.00 -0.43 0.00 0.00 46.19 43.41 3f88 s LEU 196 CO 0.26 0.33 -0.07 -0.54 -0.29 0.00 0.00 176.35 176.04 3f88 s LYS 197 N -0.52 1.48 0.36 1.98 1.02 0.23 -4.40 119.74 119.89 3f88 s LYS 197 Ca 0.12 -0.35 -0.28 0.00 0.02 0.00 0.00 55.97 55.48 3f88 s LYS 197 Cb -0.12 -1.74 -0.10 0.00 -0.52 0.00 0.00 37.83 35.34 3f88 s LYS 197 CO 0.02 -0.33 1.40 -1.17 -0.92 0.00 0.00 175.35 174.35 3f88 s LEU 198 N 1.68 4.35 0.31 3.17 2.96 0.56 -0.92 118.68 130.80 3f88 s LEU 198 Ca 0.03 2.87 0.01 0.00 -0.22 0.00 0.00 54.13 56.83 3f88 s LEU 198 Cb -0.14 -3.69 -0.02 0.00 0.50 0.00 0.00 46.19 42.85 3f88 s LEU 198 CO -0.08 -0.75 0.35 0.00 -1.32 0.00 0.00 176.35 174.55 3f88 n ASP 200 N -1.21 -3.24 -0.79 0.00 2.03 -1.26 -4.86 116.55 107.21 3f88 n ASP 200 Ca 0.03 0.97 0.06 0.00 0.52 0.00 0.00 54.79 56.38 3f88 n ASP 200 Cb 0.63 -4.00 0.23 0.00 -0.72 0.00 0.00 41.12 37.25 3f88 n ASP 200 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 3f88 n PHE 201 N 0.87 0.79 0.80 -0.67 3.01 -1.26 -4.67 117.46 116.33 3f88 n PHE 201 Ca -0.16 -1.04 0.09 0.00 1.01 0.00 0.00 57.45 57.35 3f88 n PHE 201 Cb 0.25 -0.32 0.45 0.00 -0.01 0.00 0.00 39.48 39.85 3f88 n PHE 201 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3f88 n GLY 202 N -0.80 -0.98 0.01 1.37 0.00 -1.26 -1.83 105.19 101.69 3f88 n GLY 202 Ca 0.23 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.17 3f88 n GLY 202 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3f88 n SER 203 N -1.36 0.78 -4.76 1.61 7.64 -1.26 -4.96 113.62 111.31 3f88 n SER 203 Ca 0.07 -0.89 -0.39 0.00 1.01 0.00 0.00 58.87 58.67 3f88 n SER 203 Cb 0.17 0.23 -0.05 0.00 -1.01 0.00 0.00 64.21 63.56 3f88 n SER 203 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3f88 s ALA 204 N -0.25 3.33 0.02 -0.43 0.00 -0.76 -4.70 121.76 118.96 3f88 s ALA 204 Ca 0.00 0.76 0.01 0.00 0.00 0.00 0.00 51.96 52.74 3f88 s ALA 204 Cb 0.00 -3.27 -0.01 0.00 0.00 0.00 0.00 23.12 19.83 3f88 s ALA 204 CO 0.00 -0.03 -0.05 0.21 0.00 0.00 0.00 175.76 175.89 3f88 s LYS 205 N -1.54 0.36 -0.65 0.00 2.20 -1.10 -4.77 119.74 114.24 3f88 s LYS 205 Ca 0.45 -0.40 -0.28 0.00 -0.36 0.00 0.00 55.97 55.39 3f88 s LYS 205 Cb -0.28 -0.21 0.03 0.00 -1.51 0.00 0.00 37.83 35.85 3f88 s LYS 205 CO 0.35 0.05 1.29 -1.14 -0.36 0.00 0.00 175.35 175.54 3f88 s GLN 206 N -0.78 3.30 -0.07 4.03 2.00 -1.26 -2.19 119.66 124.68 3f88 s GLN 206 Ca -0.05 0.07 -0.30 0.00 -2.00 0.00 0.00 55.36 53.09 3f88 s GLN 206 Cb -0.05 -4.12 -0.03 0.00 0.80 0.00 0.00 33.01 29.60 3f88 s GLN 206 CO -0.00 -1.98 1.28 -0.51 -0.50 0.00 0.00 175.29 173.59 3f88 s LEU 207 N 5.65 4.26 -0.14 3.68 1.43 -0.65 -5.00 118.68 127.91 3f88 s LEU 207 Ca 0.42 1.86 -0.04 0.00 -1.03 0.00 0.00 54.13 55.34 3f88 s LEU 207 Cb -0.08 -3.55 -0.03 0.00 0.03 0.00 0.00 46.19 42.55 3f88 s LEU 207 CO 0.20 -0.68 0.02 -0.69 0.23 0.00 0.00 176.35 175.43 3f88 s VAL 208 N 2.71 4.41 -0.24 -1.59 1.01 -1.26 -4.91 120.40 120.53 3f88 s VAL 208 Ca 0.58 -0.19 -0.29 0.00 0.00 0.00 0.00 61.98 62.08 3f88 s VAL 208 Cb -0.26 -2.92 0.00 0.00 0.00 0.00 0.00 36.38 33.20 3f88 s VAL 208 CO 0.21 0.53 1.12 -0.60 0.00 0.00 0.00 175.10 176.36 3f88 s ARG 209 N -0.12 4.19 0.00 2.72 3.52 -1.26 -1.59 118.95 126.41 3f88 s ARG 209 Ca 0.05 1.38 0.00 0.00 -0.13 0.00 0.00 55.73 57.02 3f88 s ARG 209 Cb -0.12 -3.71 0.00 0.00 -1.56 0.00 0.00 34.95 29.56 3f88 s ARG 209 CO 0.02 -0.74 0.00 0.41 -0.81 0.00 0.00 175.30 174.18 3f88 n GLY 210 N 3.57 0.65 3.78 8.12 0.00 -1.26 -5.10 105.19 114.95 3f88 n GLY 210 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 3f88 n GLY 210 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3f88 s GLU 211 N -0.59 3.50 0.20 1.61 0.41 -0.62 -5.10 118.70 118.11 3f88 s GLU 211 Ca 0.00 -0.24 -0.30 0.00 -0.41 0.00 0.00 54.97 54.02 3f88 s GLU 211 Cb 0.00 -3.12 -0.08 0.00 -1.78 0.00 0.00 34.13 29.15 3f88 s GLU 211 CO 0.00 0.63 1.03 -1.25 -0.49 0.00 0.00 175.26 175.18 3f88 s PRO 212 N -0.61 4.70 0.21 0.39 0.04 -1.26 -4.70 135.00 133.76 3f88 s PRO 212 Ca 0.12 1.63 0.07 0.00 0.04 0.00 0.00 61.00 62.86 3f88 s PRO 212 Cb -0.12 -3.28 -0.05 0.00 0.04 0.00 0.00 34.50 31.10 3f88 s PRO 212 CO 0.02 0.25 -0.13 -0.80 0.04 0.00 0.00 177.00 176.39 3f88 s ASN 213 N -0.55 2.50 0.30 6.66 0.01 0.25 -5.02 114.94 119.09 3f88 s ASN 213 Ca 0.46 -1.05 -0.29 0.00 -0.71 0.00 0.00 52.86 51.27 3f88 s ASN 213 Cb -0.28 -0.12 -0.10 0.00 0.41 0.00 0.00 41.25 41.16 3f88 s ASN 213 CO 0.35 -0.22 1.36 0.68 -1.51 0.00 0.00 177.10 177.76 3f88 s VAL 214 N -3.02 2.67 -1.13 1.60 -7.23 -1.26 -4.45 120.40 107.57 3f88 s VAL 214 Ca 0.23 0.63 -0.03 0.00 -1.81 0.00 0.00 61.98 60.99 3f88 s VAL 214 Cb 0.00 -3.40 0.26 0.00 0.56 0.00 0.00 36.38 33.80 3f88 s VAL 214 CO 0.07 0.13 1.88 -1.54 -0.31 0.00 0.00 175.10 175.34 3f88 n SER 215 N 1.32 7.10 0.00 4.85 3.41 -1.26 -4.97 113.62 124.07 3f88 n SER 215 Ca 0.02 -3.45 0.00 0.00 -0.26 0.00 0.00 58.87 55.18 3f88 n SER 215 Cb 0.41 -1.26 0.00 0.00 -0.26 0.00 0.00 64.21 63.10 3f88 n SER 215 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3f88 n ILE 217 N 0.96 0.00 -1.04 -1.33 0.13 -1.26 -4.51 119.36 112.31 3f88 n ILE 217 Ca 0.45 0.00 0.13 0.00 -1.10 0.00 0.00 62.75 62.23 3f88 n ILE 217 Cb 0.28 0.00 -0.06 0.00 -0.84 0.00 0.00 39.64 39.02 3f88 n ILE 217 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 3f88 s SER 219 N -6.50 7.23 0.28 0.00 0.01 -1.26 -4.79 113.70 108.66 3f88 s SER 219 Ca 0.00 1.76 0.00 0.00 1.31 0.00 0.00 55.95 59.03 3f88 s SER 219 Cb 0.00 -2.55 0.67 0.00 0.21 0.00 0.00 66.02 64.35 3f88 s SER 219 CO 0.00 -0.12 1.63 -0.09 0.41 0.00 0.00 173.24 175.07 3f88 h ARG 220 N 2.92 0.15 0.00 12.44 2.43 -1.96 0.18 114.38 130.54 3f88 h ARG 220 Ca -0.47 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 58.67 3f88 h ARG 220 Cb 1.19 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.70 3f88 h ARG 220 CO 0.64 0.10 -0.08 1.88 -1.51 0.00 0.00 179.97 180.99 3f88 h TYR 221 N 0.15 0.00 0.00 2.20 0.99 -1.92 -2.76 116.97 115.63 3f88 h TYR 221 Ca 0.54 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.27 3f88 h TYR 221 Cb 1.07 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.80 3f88 h TYR 221 CO -0.33 0.08 -1.03 0.66 -0.00 0.00 0.00 178.16 177.54 3f88 n TYR 222 N -3.21 0.00 -1.64 4.88 4.01 0.33 -4.62 117.16 116.90 3f88 n TYR 222 Ca 0.01 0.00 -0.51 0.00 -0.16 0.00 0.00 57.90 57.24 3f88 n TYR 222 Cb 0.37 -0.13 -0.06 0.00 -0.31 0.00 0.00 39.34 39.21 3f88 n TYR 222 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 3f88 n ARG 223 N -1.58 1.71 -1.98 -0.72 0.63 0.35 -3.58 116.66 111.49 3f88 n ARG 223 Ca 0.00 0.60 -0.38 0.00 -0.92 0.00 0.00 57.85 57.16 3f88 n ARG 223 Cb 0.26 -2.50 0.02 0.00 0.45 0.00 0.00 32.46 30.69 3f88 n ARG 223 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3f88 s ALA 224 N 4.74 2.83 0.19 5.13 0.00 -1.26 -4.84 121.76 128.54 3f88 s ALA 224 Ca 0.98 1.14 -0.11 0.00 0.00 0.00 0.00 51.96 53.97 3f88 s ALA 224 Cb -0.80 -3.49 0.12 0.00 0.00 0.00 0.00 23.12 18.95 3f88 s ALA 224 CO 0.54 -1.09 1.81 -1.00 0.00 0.00 0.00 175.76 176.01 3f88 h PRO 225 N 1.57 0.97 -0.83 0.00 0.13 -1.92 -1.23 132.00 130.69 3f88 h PRO 225 Ca -0.50 -0.12 0.21 0.00 -0.87 0.00 0.00 66.00 64.72 3f88 h PRO 225 Cb 1.28 -0.19 -0.14 0.00 0.13 0.00 0.00 31.00 32.08 3f88 h PRO 225 CO 0.58 0.73 0.10 1.05 -0.23 0.00 0.00 178.00 180.23 3f88 h GLU 226 N 0.95 0.14 -0.56 0.86 9.09 -1.90 0.88 114.58 124.04 3f88 h GLU 226 Ca 0.24 -0.01 0.03 0.00 0.05 0.00 0.00 59.36 59.68 3f88 h GLU 226 Cb 0.05 -0.03 -0.04 0.00 -1.65 0.00 0.00 28.75 27.08 3f88 h GLU 226 CO -0.04 0.09 0.33 -0.07 0.05 0.00 0.00 179.01 179.37 3f88 h LEU 227 N 0.14 0.52 0.08 3.06 3.38 -1.51 -1.67 115.31 119.30 3f88 h LEU 227 Ca 0.49 0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.49 3f88 h LEU 227 Cb 0.93 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.54 3f88 h LEU 227 CO -0.69 0.36 -0.42 0.40 0.09 0.00 0.00 178.44 178.18 3f88 h ILE 228 N 0.64 0.15 0.00 1.22 2.04 -0.61 -1.88 117.51 119.08 3f88 h ILE 228 Ca 0.23 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 66.04 3f88 h ILE 228 Cb 0.06 0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.27 3f88 h ILE 228 CO -0.11 0.00 0.12 0.49 0.00 0.00 0.00 178.15 178.65 3f88 n PHE 229 N -5.46 0.00 -2.19 1.37 3.72 -0.18 -4.73 117.46 109.99 3f88 n PHE 229 Ca -0.07 -0.51 -0.02 0.00 -0.05 0.00 0.00 57.45 56.81 3f88 n PHE 229 Cb 0.38 -0.71 -0.00 0.00 -0.94 0.00 0.00 39.48 38.20 3f88 n PHE 229 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3f88 n GLY 230 N 2.55 -0.36 3.73 1.37 0.00 -0.71 -4.83 105.19 106.93 3f88 n GLY 230 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 3f88 n GLY 230 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f88 s ALA 231 N -1.88 3.61 -1.39 4.61 0.00 -0.96 -4.88 121.76 120.87 3f88 s ALA 231 Ca 0.00 1.22 0.21 0.00 0.00 0.00 0.00 51.96 53.38 3f88 s ALA 231 Cb 0.00 -3.54 -0.13 0.00 0.00 0.00 0.00 23.12 19.45 3f88 s ALA 231 CO 0.00 -0.65 0.95 0.25 0.00 0.00 0.00 175.76 176.31 3f88 n THR 232 N 3.09 0.00 -1.39 0.00 -2.24 -1.26 -4.17 114.28 108.31 3f88 n THR 232 Ca 0.09 -0.12 0.08 0.00 -2.27 0.00 0.00 64.05 61.82 3f88 n THR 232 Cb 0.41 1.11 0.14 0.00 -2.10 0.00 0.00 70.33 69.89 3f88 n THR 232 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3f88 n ASP 233 N -0.86 1.85 -4.76 3.42 3.85 -1.26 0.84 116.55 119.63 3f88 n ASP 233 Ca 0.06 -3.16 -0.41 0.00 -0.71 0.00 0.00 54.79 50.57 3f88 n ASP 233 Cb 0.38 -0.43 -0.01 0.00 -1.35 0.00 0.00 41.12 39.71 3f88 n ASP 233 CO 0.00 0.00 0.00 -0.72 -1.01 0.00 0.00 177.20 175.47 3f88 s TYR 234 N -2.53 2.70 0.00 2.11 -0.85 -1.26 -5.02 117.35 112.50 3f88 s TYR 234 Ca 0.31 0.91 0.00 0.00 -0.52 0.00 0.00 57.07 57.76 3f88 s TYR 234 Cb 0.28 -4.05 0.00 0.00 0.38 0.00 0.00 41.96 38.57 3f88 s TYR 234 CO -0.01 -3.39 0.00 0.25 -1.52 0.00 0.00 175.55 170.87 3f88 n THR 235 N 1.62 0.00 -0.83 -3.49 -2.24 -1.26 -4.92 114.28 103.15 3f88 n THR 235 Ca 0.06 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.77 3f88 n THR 235 Cb 0.38 -1.07 0.26 0.00 -2.10 0.00 0.00 70.33 67.81 3f88 n THR 235 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3f88 n SER 236 N -2.67 4.48 -0.66 3.42 3.41 -1.26 -3.91 113.62 116.43 3f88 n SER 236 Ca 0.00 -3.12 0.11 0.00 -0.26 0.00 0.00 58.87 55.60 3f88 n SER 236 Cb 0.00 -0.73 0.36 0.00 -0.26 0.00 0.00 64.21 63.57 3f88 n SER 236 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3f88 n SER 237 N -0.18 2.01 -0.01 4.04 3.41 -1.26 -3.76 113.62 117.87 3f88 n SER 237 Ca 0.39 -1.74 -0.13 0.00 -0.26 0.00 0.00 58.87 57.13 3f88 n SER 237 Cb 1.32 -0.10 -0.09 0.00 -0.26 0.00 0.00 64.21 65.08 3f88 n SER 237 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 175.04 175.04 3f88 h ILE 238 N 2.76 1.32 -0.48 -1.33 3.07 -1.96 -2.71 117.51 118.18 3f88 h ILE 238 Ca 0.00 -0.96 0.10 0.00 1.55 0.00 0.00 64.86 65.55 3f88 h ILE 238 Cb 0.60 1.94 -0.09 0.00 -0.27 0.00 0.00 36.82 39.00 3f88 h ILE 238 CO 0.00 0.25 -0.14 0.44 -1.05 0.00 0.00 178.15 177.65 3f88 h ASP 239 N -0.37 -0.52 -1.00 2.16 3.32 -1.89 0.72 116.42 118.84 3f88 h ASP 239 Ca 0.00 0.15 0.21 0.00 0.02 0.00 0.00 57.03 57.42 3f88 h ASP 239 Cb 0.41 0.33 -0.10 0.00 0.22 0.00 0.00 39.33 40.19 3f88 h ASP 239 CO 0.00 -0.18 0.62 0.58 -1.72 0.00 0.00 179.24 178.54 3f88 h VAL 240 N -0.03 0.65 0.05 -1.35 2.07 -1.75 0.86 116.25 116.75 3f88 h VAL 240 Ca 0.23 -0.22 -0.00 0.00 0.82 0.00 0.00 66.70 67.53 3f88 h VAL 240 Cb 0.38 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.10 3f88 h VAL 240 CO -0.51 0.12 -0.02 -0.25 0.02 0.00 0.00 177.57 176.92 3f88 h TRP 241 N 0.65 -0.06 -0.83 1.57 2.91 0.74 0.31 115.95 121.24 3f88 h TRP 241 Ca 0.58 -0.00 0.09 0.00 1.13 0.00 0.00 58.89 60.69 3f88 h TRP 241 Cb 1.05 0.02 -0.06 0.00 -0.51 0.00 0.00 29.16 29.67 3f88 h TRP 241 CO -0.00 0.08 0.54 0.77 -1.03 0.00 0.00 178.44 178.80 3f88 h SER 242 N -0.20 0.73 0.30 2.65 0.02 0.93 0.05 113.55 118.04 3f88 h SER 242 Ca -0.01 0.02 -0.26 0.00 -0.84 0.00 0.00 61.79 60.70 3f88 h SER 242 Cb 0.17 -0.14 0.01 0.00 0.14 0.00 0.00 62.40 62.59 3f88 h SER 242 CO 0.01 0.44 -1.07 0.00 -1.14 0.00 0.00 176.83 175.07 3f88 h ALA 243 N 1.58 0.21 -0.58 3.77 0.00 0.98 -0.36 119.26 124.85 3f88 h ALA 243 Ca 0.38 -0.75 0.12 0.00 0.00 0.00 0.00 54.91 54.65 3f88 h ALA 243 Cb 0.38 0.02 -0.10 0.00 0.00 0.00 0.00 17.79 18.10 3f88 h ALA 243 CO -0.15 0.80 -0.05 0.78 0.00 0.00 0.00 179.25 180.64 3f88 h GLY 244 N 0.99 0.55 1.01 0.00 0.00 0.63 0.27 103.07 106.53 3f88 h GLY 244 Ca -0.12 0.11 -0.00 0.00 0.00 0.00 0.00 47.33 47.32 3f88 h GLY 244 CO 0.19 -0.20 0.54 0.00 0.00 0.00 0.00 176.54 177.08 3f88 h VAL 246 N 1.19 0.45 -0.18 0.00 2.07 0.24 0.50 116.25 120.52 3f88 h VAL 246 Ca 0.32 -0.02 0.04 0.00 0.82 0.00 0.00 66.70 67.86 3f88 h VAL 246 Cb -0.08 0.46 -0.07 0.00 -1.52 0.00 0.00 31.29 30.08 3f88 h VAL 246 CO -0.06 0.00 -0.49 0.25 0.02 0.00 0.00 177.57 177.29 3f88 h LEU 247 N -0.76 -1.56 -0.79 2.57 5.85 -0.24 -0.67 115.31 119.71 3f88 h LEU 247 Ca -0.08 0.20 0.11 0.00 0.84 0.00 0.00 57.88 58.95 3f88 h LEU 247 Cb 0.58 0.63 -0.08 0.00 0.37 0.00 0.00 40.66 42.15 3f88 h LEU 247 CO 0.13 -0.45 0.41 0.00 -0.34 0.00 0.00 178.44 178.19 3f88 h ALA 248 N -0.04 1.13 -0.98 1.25 0.00 -0.76 0.00 119.26 119.86 3f88 h ALA 248 Ca 0.06 0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.09 3f88 h ALA 248 Cb 0.65 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.32 3f88 h ALA 248 CO -0.45 -0.03 0.63 1.49 0.00 0.00 0.00 179.25 180.89 3f88 h GLU 249 N 0.65 1.14 0.00 0.00 4.81 -0.41 0.20 114.58 120.98 3f88 h GLU 249 Ca 0.40 -0.07 -0.05 0.00 -0.13 0.00 0.00 59.36 59.51 3f88 h GLU 249 Cb 0.46 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 3f88 h GLU 249 CO -0.30 0.76 -0.26 -0.07 -0.73 0.00 0.00 179.01 178.41 3f88 h LEU 250 N 1.18 0.00 0.15 1.64 3.38 0.54 0.16 115.31 122.36 3f88 h LEU 250 Ca 0.41 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 58.03 3f88 h LEU 250 Cb 0.11 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 3f88 h LEU 250 CO -0.16 0.26 -1.81 -0.07 0.09 0.00 0.00 178.44 176.76 3f88 h LEU 251 N 0.00 0.50 -0.41 1.67 3.38 -1.00 -3.37 115.31 116.07 3f88 h LEU 251 Ca -0.00 -0.85 -0.16 0.00 0.09 0.00 0.00 57.88 56.95 3f88 h LEU 251 Cb 0.48 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 3f88 h LEU 251 CO 0.03 1.74 -0.77 -0.07 0.09 0.00 0.00 178.44 179.46 3f88 h LEU 252 N 0.09 0.00 0.00 1.67 3.38 -0.48 -3.45 115.31 116.52 3f88 h LEU 252 Ca -0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.61 3f88 h LEU 252 Cb 2.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.82 3f88 h LEU 252 CO 0.14 0.77 0.00 0.61 0.09 0.00 0.00 178.44 180.06 3f88 n GLY 253 N 0.76 0.74 3.48 0.83 0.00 0.55 -5.00 105.19 106.55 3f88 n GLY 253 Ca -0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 3f88 n GLY 253 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3f88 s GLN 254 N -0.24 0.97 0.76 1.61 -2.07 -1.17 -4.79 119.66 114.73 3f88 s GLN 254 Ca 0.00 -0.27 -0.15 0.00 -1.82 0.00 0.00 55.36 53.12 3f88 s GLN 254 Cb 0.00 0.45 0.03 0.00 -1.09 0.00 0.00 33.01 32.40 3f88 s GLN 254 CO 0.00 -0.41 1.01 -2.30 -1.32 0.00 0.00 175.29 172.28 3f88 n PRO 255 N -0.11 0.39 -0.03 9.60 -0.02 -1.26 -4.24 135.00 139.33 3f88 n PRO 255 Ca -0.12 0.19 -0.08 0.00 -2.02 0.00 0.00 63.50 61.47 3f88 n PRO 255 Cb 0.62 -2.27 -0.14 0.00 -0.02 0.00 0.00 33.50 31.69 3f88 n PRO 255 CO 0.00 0.00 0.00 1.51 1.98 0.00 0.00 175.50 178.99 3f88 n ILE 256 N -2.78 1.55 -3.53 4.25 3.06 -1.26 -4.49 119.36 116.16 3f88 n ILE 256 Ca 0.13 -0.80 -0.27 0.00 -2.50 0.00 0.00 62.75 59.31 3f88 n ILE 256 Cb 0.50 -0.93 -0.09 0.00 0.54 0.00 0.00 39.64 39.66 3f88 n ILE 256 CO 0.00 0.00 0.00 0.49 -2.50 0.00 0.00 176.55 174.54 3f88 n PHE 257 N -2.99 2.64 -2.06 9.51 3.72 -1.26 -4.94 117.46 122.08 3f88 n PHE 257 Ca -0.19 -4.06 -0.41 0.00 -0.05 0.00 0.00 57.45 52.74 3f88 n PHE 257 Cb 1.06 -0.48 -0.00 0.00 -0.94 0.00 0.00 39.48 39.11 3f88 n PHE 257 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 3f88 n PRO 258 N 1.41 3.88 -1.97 -1.08 -0.04 -1.26 -4.52 135.00 131.41 3f88 n PRO 258 Ca 0.26 -3.28 -0.41 0.00 -0.04 0.00 0.00 63.50 60.03 3f88 n PRO 258 Cb 0.41 -2.85 -0.01 0.00 -0.04 0.00 0.00 33.50 31.01 3f88 n PRO 258 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3f88 s GLY 259 N 1.05 2.97 -0.07 0.55 0.00 -1.26 -4.91 107.32 105.65 3f88 s GLY 259 Ca 0.48 1.40 0.12 0.00 0.00 0.00 0.00 44.72 46.72 3f88 s GLY 259 CO -0.04 2.06 1.34 2.09 0.00 0.00 0.00 173.10 178.55 3f88 n ASP 260 N 0.55 3.28 -3.61 1.64 3.85 -1.26 -4.68 116.55 116.32 3f88 n ASP 260 Ca 0.01 -2.27 -0.05 0.00 -0.71 0.00 0.00 54.79 51.77 3f88 n ASP 260 Cb 0.41 -0.46 -0.02 0.00 -1.35 0.00 0.00 41.12 39.71 3f88 n ASP 260 CO 0.00 0.00 0.00 -0.94 -1.01 0.00 0.00 177.20 175.25 3f88 s SER 261 N -0.78 -0.22 0.36 -1.12 1.04 -1.26 -4.93 113.70 106.78 3f88 s SER 261 Ca 0.34 -0.14 0.10 0.00 0.48 0.00 0.00 55.95 56.74 3f88 s SER 261 Cb 0.22 0.34 0.86 0.00 0.10 0.00 0.00 66.02 67.54 3f88 s SER 261 CO 0.17 -0.58 1.84 1.23 0.98 0.00 0.00 173.24 176.87 3f88 h GLY 262 N 2.00 1.29 0.92 7.32 0.00 -2.00 0.11 103.07 112.72 3f88 h GLY 262 Ca -0.22 -0.29 -0.22 0.00 0.00 0.00 0.00 47.33 46.61 3f88 h GLY 262 CO 0.27 0.02 -0.89 -2.08 0.00 0.00 0.00 176.54 173.87 3f88 h VAL 263 N 0.64 1.40 0.00 4.60 2.07 -1.98 -3.25 116.25 119.73 3f88 h VAL 263 Ca 0.50 -2.34 -0.05 0.00 0.82 0.00 0.00 66.70 65.63 3f88 h VAL 263 Cb 0.90 2.79 -0.01 0.00 -1.52 0.00 0.00 31.29 33.46 3f88 h VAL 263 CO -0.25 0.69 -0.22 -0.78 0.02 0.00 0.00 177.57 177.03 3f88 h ASP 264 N -0.04 0.00 -1.03 0.57 3.58 -1.58 -3.10 116.42 114.82 3f88 h ASP 264 Ca -0.13 0.00 0.29 0.00 0.42 0.00 0.00 57.03 57.61 3f88 h ASP 264 Cb 1.62 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 42.62 3f88 h ASP 264 CO 0.17 0.22 0.73 -0.61 -2.88 0.00 0.00 179.24 176.87 3f88 h GLN 265 N 0.00 0.07 0.19 0.28 5.75 -0.86 0.68 115.11 121.23 3f88 h GLN 265 Ca -0.00 -0.00 -0.31 0.00 -0.15 0.00 0.00 58.65 58.18 3f88 h GLN 265 Cb 0.42 -0.02 0.03 0.00 1.07 0.00 0.00 27.48 28.98 3f88 h GLN 265 CO 0.03 0.05 -1.37 1.25 -2.65 0.00 0.00 178.83 176.14 3f88 h LEU 266 N 0.07 0.72 -0.98 -2.39 5.85 -1.72 -3.11 115.31 113.74 3f88 h LEU 266 Ca 0.51 -0.75 0.09 0.00 0.84 0.00 0.00 57.88 58.57 3f88 h LEU 266 Cb 1.89 -0.23 -0.07 0.00 0.37 0.00 0.00 40.66 42.61 3f88 h LEU 266 CO -0.05 1.58 0.62 0.58 -0.34 0.00 0.00 178.44 180.82 3f88 h VAL 267 N 0.14 1.00 -0.07 1.05 2.07 -1.04 0.07 116.25 119.47 3f88 h VAL 267 Ca -0.21 -0.36 -0.08 0.00 0.82 0.00 0.00 66.70 66.87 3f88 h VAL 267 Cb 2.07 -0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 3f88 h VAL 267 CO 0.25 0.19 -0.34 -0.33 0.02 0.00 0.00 177.57 177.36 3f88 h GLU 268 N 1.06 0.14 0.21 1.57 4.39 -1.37 -2.09 114.58 118.50 3f88 h GLU 268 Ca 0.45 -0.06 -0.30 0.00 0.34 0.00 0.00 59.36 59.80 3f88 h GLU 268 Cb 0.31 -0.01 0.03 0.00 -0.10 0.00 0.00 28.75 28.98 3f88 h GLU 268 CO -0.21 0.47 -1.34 0.82 -1.16 0.00 0.00 179.01 177.59 3f88 h ILE 269 N 0.13 1.29 -0.27 3.13 2.04 -1.20 -3.30 117.51 119.33 3f88 h ILE 269 Ca 0.02 -2.62 0.04 0.00 1.00 0.00 0.00 64.86 63.29 3f88 h ILE 269 Cb 0.67 3.05 -0.03 0.00 -0.74 0.00 0.00 36.82 39.76 3f88 h ILE 269 CO 0.05 0.79 0.06 0.40 0.00 0.00 0.00 178.15 179.44 3f88 h ILE 270 N -0.01 0.88 -1.55 -0.67 2.04 -1.04 0.62 117.51 117.78 3f88 h ILE 270 Ca -0.24 -0.06 0.45 0.00 1.00 0.00 0.00 64.86 66.01 3f88 h ILE 270 Cb 2.01 0.70 -0.06 0.00 -0.74 0.00 0.00 36.82 38.73 3f88 h ILE 270 CO 0.23 0.03 1.21 0.29 0.00 0.00 0.00 178.15 179.91 3f88 n LYS 271 N -5.08 0.00 0.00 2.37 5.02 -0.79 0.46 118.16 120.15 3f88 n LYS 271 Ca -0.01 0.94 0.00 0.00 -2.02 0.00 0.00 58.31 57.22 3f88 n LYS 271 Cb 0.12 -2.20 0.00 0.00 -0.02 0.00 0.00 35.03 32.93 3f88 n LYS 271 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3f88 n VAL 272 N -3.52 0.00 -0.23 -0.18 0.31 -0.72 -4.65 118.33 109.34 3f88 n VAL 272 Ca 0.35 0.34 -0.06 0.00 -0.01 0.00 0.00 64.34 64.96 3f88 n VAL 272 Cb 1.68 -1.34 0.04 0.00 -0.91 0.00 0.00 33.84 33.31 3f88 n VAL 272 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3f88 h LEU 273 N 0.00 0.77 0.00 7.52 3.38 -0.69 0.24 115.31 126.53 3f88 h LEU 273 Ca 0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.91 3f88 h LEU 273 Cb 0.00 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.55 3f88 h LEU 273 CO 0.00 0.61 0.00 0.61 0.09 0.00 0.00 178.44 179.75 3f88 n GLY 274 N -1.15 -1.06 3.72 0.83 0.00 0.17 -4.33 105.19 103.37 3f88 n GLY 274 Ca 0.05 -2.23 -0.42 0.00 0.00 0.00 0.00 46.02 43.42 3f88 n GLY 274 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3f88 s THR 275 N -0.66 3.87 0.18 2.61 2.01 -0.75 -4.28 115.64 118.61 3f88 s THR 275 Ca 0.00 1.37 -0.32 0.00 0.31 0.00 0.00 61.69 63.05 3f88 s THR 275 Cb 0.00 -3.88 -0.10 0.00 0.01 0.00 0.00 72.50 68.53 3f88 s THR 275 CO 0.00 0.12 1.60 -2.16 -0.69 0.00 0.00 174.62 173.49 3f88 s PRO 276 N 0.90 4.20 0.48 4.92 0.04 -1.26 -4.97 135.00 139.30 3f88 s PRO 276 Ca 0.59 2.41 -0.24 0.00 0.04 0.00 0.00 61.00 63.81 3f88 s PRO 276 Cb -0.31 -3.13 -0.07 0.00 0.04 0.00 0.00 34.50 31.03 3f88 s PRO 276 CO 0.30 -0.63 1.32 0.95 0.04 0.00 0.00 177.00 178.98 3f88 s THR 277 N 1.08 2.42 0.20 1.26 -4.23 -1.26 -4.70 115.64 110.40 3f88 s THR 277 Ca 0.70 0.34 -0.22 0.00 -1.18 0.00 0.00 61.69 61.33 3f88 s THR 277 Cb -0.45 -3.18 0.12 0.00 1.34 0.00 0.00 72.50 70.33 3f88 s THR 277 CO 0.32 0.02 1.56 0.03 -0.54 0.00 0.00 174.62 176.01 3f88 h ARG 278 N 2.00 -0.10 -0.55 3.99 3.08 -1.98 0.75 114.38 121.57 3f88 h ARG 278 Ca -0.50 0.01 0.05 0.00 0.07 0.00 0.00 59.98 59.60 3f88 h ARG 278 Cb 1.27 0.02 -0.07 0.00 0.08 0.00 0.00 29.97 31.28 3f88 h ARG 278 CO 0.60 -0.07 -0.32 -1.91 -1.07 0.00 0.00 179.97 177.20 3f88 n GLU 279 N -5.42 -0.24 -0.12 0.04 4.07 -1.26 0.14 120.64 117.84 3f88 n GLU 279 Ca 0.06 0.84 -0.09 0.00 -0.06 0.00 0.00 57.16 57.90 3f88 n GLU 279 Cb 0.36 -1.23 -0.01 0.00 -0.06 0.00 0.00 31.44 30.51 3f88 n GLU 279 CO 0.00 0.00 0.00 1.96 -0.06 0.00 0.00 177.13 179.03 3f88 h GLN 280 N 0.00 0.52 -0.49 5.31 4.20 0.02 0.12 115.11 124.79 3f88 h GLN 280 Ca 0.09 -0.06 0.07 0.00 0.06 0.00 0.00 58.65 58.81 3f88 h GLN 280 Cb 0.22 -0.10 -0.06 0.00 0.30 0.00 0.00 27.48 27.84 3f88 h GLN 280 CO -0.51 0.42 0.15 0.82 -0.67 0.00 0.00 178.83 179.04 3f88 h ILE 281 N 0.48 0.80 -0.37 2.54 2.04 0.15 0.24 117.51 123.39 3f88 h ILE 281 Ca 0.13 -0.11 -0.02 0.00 1.00 0.00 0.00 64.86 65.87 3f88 h ILE 281 Cb 0.05 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.58 3f88 h ILE 281 CO -0.02 0.06 0.15 -0.09 0.00 0.00 0.00 178.15 178.25 3f88 h ARG 282 N 0.31 0.55 0.00 2.37 2.43 -0.10 -1.16 114.38 118.79 3f88 h ARG 282 Ca 0.24 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 3f88 h ARG 282 Cb 0.27 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 3f88 h ARG 282 CO -0.26 0.52 0.00 0.39 -1.51 0.00 0.00 179.97 179.11 3f88 n GLU 283 N -4.68 0.02 -0.11 0.20 -0.58 0.38 -1.44 120.64 114.43 3f88 n GLU 283 Ca -0.01 0.32 -0.25 0.00 -0.42 0.00 0.00 57.16 56.81 3f88 n GLU 283 Cb 0.13 -1.53 -0.11 0.00 -0.57 0.00 0.00 31.44 29.36 3f88 n GLU 283 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 3f88 n MET 284 N -1.57 0.59 -3.48 3.49 2.81 0.71 -4.69 117.12 114.99 3f88 n MET 284 Ca 0.03 0.41 -0.00 0.00 -1.81 0.00 0.00 57.70 56.32 3f88 n MET 284 Cb 0.14 -1.63 -0.04 0.00 -0.71 0.00 0.00 33.22 30.98 3f88 n MET 284 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 3f88 s ASN 285 N -7.11 -1.12 -0.79 7.83 2.47 -0.45 -4.87 114.94 110.90 3f88 s ASN 285 Ca -0.33 1.27 -0.23 0.00 0.42 0.00 0.00 52.86 53.99 3f88 s ASN 285 Cb 0.10 2.16 -0.17 0.00 -1.45 0.00 0.00 41.25 41.89 3f88 s ASN 285 CO 0.57 -0.24 2.39 -2.65 -3.72 0.00 0.00 177.10 173.44 3f88 n PRO 286 N 5.44 0.51 0.00 0.43 -0.02 -1.02 -4.11 135.00 136.22 3f88 n PRO 286 Ca -0.08 -0.50 0.00 0.00 -2.02 0.00 0.00 63.50 60.90 3f88 n PRO 286 Cb 0.50 -3.03 0.00 0.00 -0.02 0.00 0.00 33.50 30.95 3f88 n PRO 286 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3f88 n ASN 287 N 15.32 0.00 0.00 2.55 5.15 -1.26 -5.09 115.26 131.93 3f88 n ASN 287 Ca 0.50 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.48 3f88 n ASN 287 Cb 0.37 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.62 3f88 n ASN 287 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 3f88 n GLU 290 N 0.00 0.00 -3.64 1.20 2.13 -1.26 -5.04 120.64 114.03 3f88 n GLU 290 Ca 0.00 0.00 -0.07 0.00 0.66 0.00 0.00 57.16 57.75 3f88 n GLU 290 Cb 0.00 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 31.64 3f88 n GLU 290 CO 0.00 0.00 0.00 0.12 -0.41 0.00 0.00 177.13 176.84 3f88 s PHE 291 N 0.00 -0.91 -0.22 4.31 2.19 -1.26 -5.14 117.98 116.96 3f88 s PHE 291 Ca 0.00 1.87 -0.29 0.00 0.33 0.00 0.00 56.93 58.84 3f88 s PHE 291 Cb 0.00 0.52 -0.02 0.00 -1.31 0.00 0.00 43.02 42.21 3f88 s PHE 291 CO 0.00 -0.45 1.53 0.15 1.83 0.00 0.00 175.22 178.28 3f88 s LYS 292 N 1.34 3.88 -0.02 10.12 3.01 -1.26 -5.00 119.74 131.81 3f88 s LYS 292 Ca -0.08 1.62 -0.09 0.00 -1.01 0.00 0.00 55.97 56.41 3f88 s LYS 292 Cb -0.05 -3.98 0.01 0.00 -1.01 0.00 0.00 37.83 32.80 3f88 s LYS 292 CO -0.16 -1.18 0.19 -0.06 0.51 0.00 0.00 175.35 174.66 3f88 s PHE 293 N 4.82 -0.07 0.73 3.18 0.08 -1.26 -5.17 117.98 120.29 3f88 s PHE 293 Ca 0.67 0.12 -0.01 0.00 0.12 0.00 0.00 56.93 57.84 3f88 s PHE 293 Cb -0.24 0.01 0.13 0.00 -0.57 0.00 0.00 43.02 42.36 3f88 s PHE 293 CO 0.27 -0.27 1.00 -1.25 -0.10 0.00 0.00 175.22 174.87 3f88 s PRO 294 N -1.02 1.64 -0.90 0.24 0.04 -1.26 -5.06 135.00 128.68 3f88 s PRO 294 Ca -0.11 -1.14 -0.05 0.00 0.04 0.00 0.00 61.00 59.74 3f88 s PRO 294 Cb -0.06 -2.33 0.22 0.00 0.04 0.00 0.00 34.50 32.38 3f88 s PRO 294 CO 0.02 -1.48 0.81 -1.14 0.04 0.00 0.00 177.00 175.25 3f88 s GLN 295 N -5.15 3.44 0.17 4.56 -0.44 -1.26 -4.87 119.66 116.11 3f88 s GLN 295 Ca 0.67 -3.04 -0.30 0.00 -2.50 0.00 0.00 55.36 50.19 3f88 s GLN 295 Cb -0.05 -4.13 -0.08 0.00 -1.64 0.00 0.00 33.01 27.10 3f88 s GLN 295 CO 0.45 -1.25 1.30 0.42 0.50 0.00 0.00 175.29 176.71 3f88 s ILE 296 N -0.92 3.33 0.84 -2.34 1.09 -1.26 -4.90 121.20 117.03 3f88 s ILE 296 Ca 0.25 1.06 -0.11 0.00 -1.10 0.00 0.00 60.65 60.75 3f88 s ILE 296 Cb -0.10 -3.68 0.10 0.00 -1.06 0.00 0.00 42.46 37.71 3f88 s ILE 296 CO -0.09 0.14 1.10 -0.75 -0.10 0.00 0.00 174.94 175.23 3f88 s LYS 297 N 0.19 1.72 1.04 2.79 2.47 -1.26 -1.81 119.74 124.87 3f88 s LYS 297 Ca 0.58 1.10 -0.13 0.00 -1.56 0.00 0.00 55.97 55.95 3f88 s LYS 297 Cb -0.36 -1.84 0.21 0.00 -1.46 0.00 0.00 37.83 34.38 3f88 s LYS 297 CO 0.36 -2.00 1.10 0.00 0.16 0.00 0.00 175.35 174.97 3f88 s ALA 298 N -2.87 0.88 -0.15 3.13 0.00 -1.26 -4.43 121.76 117.06 3f88 s ALA 298 Ca 0.63 -0.48 -0.00 0.00 0.00 0.00 0.00 51.96 52.10 3f88 s ALA 298 Cb -0.18 -3.07 0.03 0.00 0.00 0.00 0.00 23.12 19.90 3f88 s ALA 298 CO 0.57 -2.97 -0.09 -1.58 0.00 0.00 0.00 175.76 171.68 3f88 s HIS 299 N -2.99 1.86 0.36 0.00 2.46 0.84 -4.93 115.29 112.90 3f88 s HIS 299 Ca 0.66 -1.08 -0.25 0.00 0.47 0.00 0.00 55.06 54.87 3f88 s HIS 299 Cb -0.17 -1.41 -0.13 0.00 -0.13 0.00 0.00 32.58 30.73 3f88 s HIS 299 CO 0.57 -0.62 0.72 -2.30 -2.47 0.00 0.00 174.74 170.65 3f88 n PRO 300 N 4.84 0.80 -0.04 2.88 -0.02 -1.26 -4.77 135.00 137.42 3f88 n PRO 300 Ca -0.14 0.29 -0.12 0.00 -2.02 0.00 0.00 63.50 61.50 3f88 n PRO 300 Cb 0.49 -1.60 -0.07 0.00 -0.02 0.00 0.00 33.50 32.30 3f88 n PRO 300 CO 0.00 0.00 0.00 -1.49 1.98 0.00 0.00 175.50 175.99 3f88 h TRP 301 N 1.22 0.27 0.00 6.00 4.06 -1.97 -2.82 115.95 122.70 3f88 h TRP 301 Ca -0.39 -0.06 0.00 0.00 2.06 0.00 0.00 58.89 60.50 3f88 h TRP 301 Cb 1.38 -0.07 0.00 0.00 -1.00 0.00 0.00 29.16 29.48 3f88 h TRP 301 CO 0.41 0.54 0.00 1.79 -3.56 0.00 0.00 178.44 177.62 3f88 h THR 302 N -0.08 0.00 0.00 1.49 1.35 -1.95 -1.85 112.91 111.87 3f88 h THR 302 Ca 0.03 -0.10 -0.02 0.00 -0.55 0.00 0.00 66.41 65.76 3f88 h THR 302 Cb 0.46 0.72 -0.00 0.00 -1.73 0.00 0.00 68.15 67.59 3f88 h THR 302 CO 0.01 0.00 -0.11 0.50 -0.25 0.00 0.00 175.52 175.68 3f88 h LYS 303 N 0.00 0.00 0.02 4.72 1.63 -1.86 -3.35 116.57 117.74 3f88 h LYS 303 Ca 0.00 0.00 -0.09 0.00 -0.85 0.00 0.00 60.65 59.71 3f88 h LYS 303 Cb 0.15 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 31.79 3f88 h LYS 303 CO 0.00 0.11 -0.36 0.28 -3.45 0.00 0.00 179.45 176.02 3f88 h VAL 304 N 0.00 1.56 -2.93 2.00 2.07 -1.35 -3.47 116.25 114.13 3f88 h VAL 304 Ca -0.00 -2.13 -0.44 0.00 0.82 0.00 0.00 66.70 64.95 3f88 h VAL 304 Cb 1.05 2.91 0.06 0.00 -1.52 0.00 0.00 31.29 33.79 3f88 h VAL 304 CO 0.01 0.59 0.06 -0.36 0.02 0.00 0.00 177.57 177.89 3f88 s PHE 305 N -2.89 2.83 0.41 1.57 0.08 -1.25 -5.04 117.98 113.70 3f88 s PHE 305 Ca -0.16 0.13 -0.22 0.00 0.12 0.00 0.00 56.93 56.81 3f88 s PHE 305 Cb 0.01 -2.92 -0.13 0.00 -0.57 0.00 0.00 43.02 39.40 3f88 s PHE 305 CO 0.76 -1.09 0.45 0.54 -0.10 0.00 0.00 175.22 175.78 3f88 n ARG 306 N -2.56 0.44 0.33 0.44 1.74 -1.26 -4.84 116.66 110.95 3f88 n ARG 306 Ca 0.08 0.16 0.22 0.00 -0.77 0.00 0.00 57.85 57.54 3f88 n ARG 306 Cb 0.60 -1.39 1.18 0.00 -1.02 0.00 0.00 32.46 31.83 3f88 n ARG 306 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 3f88 h PRO 307 N 0.70 0.00 0.00 5.56 0.11 -1.96 -2.94 132.00 133.47 3f88 h PRO 307 Ca -0.39 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.69 3f88 h PRO 307 Cb 1.41 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.52 3f88 h PRO 307 CO 0.51 0.00 -0.95 0.00 -0.21 0.00 0.00 178.00 177.35 3f88 h ARG 308 N 0.00 0.00 -6.12 1.05 3.08 -1.97 -3.48 114.38 106.94 3f88 h ARG 308 Ca 0.00 0.00 -0.76 0.00 0.07 0.00 0.00 59.98 59.29 3f88 h ARG 308 Cb 0.00 0.00 0.04 0.00 0.08 0.00 0.00 29.97 30.10 3f88 h ARG 308 CO -0.00 0.04 0.41 2.41 -1.07 0.00 0.00 179.97 181.76 3f88 n THR 309 N -2.75 0.04 -1.30 2.04 -1.04 -1.11 -4.87 114.28 105.29 3f88 n THR 309 Ca -0.01 -0.01 -0.41 0.00 -2.04 0.00 0.00 64.05 61.59 3f88 n THR 309 Cb 0.59 -0.54 0.00 0.00 -1.82 0.00 0.00 70.33 68.56 3f88 n THR 309 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 3f88 n PRO 310 N 2.77 0.06 0.03 -2.82 -0.02 -1.26 -4.90 135.00 128.86 3f88 n PRO 310 Ca 0.22 0.02 -0.17 0.00 -2.02 0.00 0.00 63.50 61.55 3f88 n PRO 310 Cb 0.11 -1.07 -0.07 0.00 -0.02 0.00 0.00 33.50 32.45 3f88 n PRO 310 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 3f88 h PRO 311 N 0.26 0.63 -0.14 0.52 0.13 -2.00 -3.27 132.00 128.13 3f88 h PRO 311 Ca -0.39 -0.61 -0.06 0.00 -0.87 0.00 0.00 66.00 64.07 3f88 h PRO 311 Cb 1.44 0.16 -0.01 0.00 0.13 0.00 0.00 31.00 32.72 3f88 h PRO 311 CO 0.46 1.22 -0.17 1.49 -0.23 0.00 0.00 178.00 180.77 3f88 h GLU 312 N 0.38 0.24 -0.27 0.86 4.57 -1.98 -2.38 114.58 116.00 3f88 h GLU 312 Ca -0.09 -0.06 -0.04 0.00 -1.18 0.00 0.00 59.36 57.99 3f88 h GLU 312 Cb 1.56 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 30.11 3f88 h GLU 312 CO 0.18 0.41 0.01 0.00 -1.18 0.00 0.00 179.01 178.43 3f88 h ALA 313 N 1.61 0.36 -0.19 2.92 0.00 -1.93 -2.68 119.26 119.35 3f88 h ALA 313 Ca 0.04 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.66 3f88 h ALA 313 Cb 0.44 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3f88 h ALA 313 CO 0.03 0.09 -0.22 0.82 0.00 0.00 0.00 179.25 179.96 3f88 h ILE 314 N 0.26 1.24 -0.81 0.00 2.04 -1.56 -1.65 117.51 117.03 3f88 h ILE 314 Ca 0.08 -1.11 -0.00 0.00 1.00 0.00 0.00 64.86 64.82 3f88 h ILE 314 Cb 0.40 1.34 -0.04 0.00 -0.74 0.00 0.00 36.82 37.78 3f88 h ILE 314 CO 0.01 0.35 0.50 0.00 0.00 0.00 0.00 178.15 179.01 3f88 h ALA 315 N 1.47 1.36 0.01 1.87 0.00 -1.36 -2.66 119.26 119.94 3f88 h ALA 315 Ca 0.05 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3f88 h ALA 315 Cb 0.57 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3f88 h ALA 315 CO 0.04 0.56 -0.00 1.25 0.00 0.00 0.00 179.25 181.10 3f88 h LEU 316 N 1.11 -0.01 -0.29 0.00 5.85 -0.97 -2.95 115.31 118.05 3f88 h LEU 316 Ca 0.29 -0.36 0.07 0.00 0.84 0.00 0.00 57.88 58.72 3f88 h LEU 316 Cb -0.07 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 40.90 3f88 h LEU 316 CO -0.06 0.36 -0.19 0.00 -0.34 0.00 0.00 178.44 178.22 3f88 h SER 318 N -0.16 0.00 -0.02 0.00 4.64 -1.49 1.15 113.55 117.66 3f88 h SER 318 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 3f88 h SER 318 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 3f88 h SER 318 CO -0.39 0.00 -0.00 0.54 -0.87 0.00 0.00 176.83 176.11 3f88 n ARG 319 N -4.26 2.05 -0.09 4.77 5.12 0.16 -4.36 116.66 120.06 3f88 n ARG 319 Ca 0.14 -1.53 -0.11 0.00 -1.93 0.00 0.00 57.85 54.43 3f88 n ARG 319 Cb 0.81 -1.47 -0.04 0.00 -1.16 0.00 0.00 32.46 30.61 3f88 n ARG 319 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 3f88 n LEU 320 N 0.86 1.88 -4.56 0.55 4.77 0.27 -2.16 117.00 118.61 3f88 n LEU 320 Ca 0.16 0.32 -0.35 0.00 -0.03 0.00 0.00 56.01 56.11 3f88 n LEU 320 Cb 0.50 -0.72 -0.04 0.00 -2.33 0.00 0.00 43.42 40.83 3f88 n LEU 320 CO 0.16 -0.20 1.43 -0.76 -1.33 0.00 0.00 177.39 176.69 3f88 s LEU 321 N -7.79 3.36 -0.04 2.23 1.43 0.32 -4.58 118.68 113.61 3f88 s LEU 321 Ca -0.28 -1.13 0.02 0.00 -1.03 0.00 0.00 54.13 51.70 3f88 s LEU 321 Cb 0.05 -2.57 0.01 0.00 0.03 0.00 0.00 46.19 43.72 3f88 s LEU 321 CO 0.41 -2.03 -0.08 -1.61 0.23 0.00 0.00 176.35 173.27 3f88 s GLU 322 N 5.83 1.12 0.62 1.70 0.41 -1.26 -4.70 118.70 122.41 3f88 s GLU 322 Ca 0.56 -0.26 0.28 0.00 -0.41 0.00 0.00 54.97 55.14 3f88 s GLU 322 Cb -0.03 -1.01 1.45 0.00 -1.78 0.00 0.00 34.13 32.76 3f88 s GLU 322 CO -0.06 0.02 1.85 1.88 -0.49 0.00 0.00 175.26 178.46 3f88 h TYR 323 N 6.84 0.00 -3.76 1.61 0.99 -1.95 -3.39 116.97 117.31 3f88 h TYR 323 Ca -0.35 0.00 -0.69 0.00 2.00 0.00 0.00 58.73 59.70 3f88 h TYR 323 Cb 1.17 0.00 -0.32 0.00 1.00 0.00 0.00 36.73 38.58 3f88 h TYR 323 CO 0.48 0.00 -0.88 0.95 -0.00 0.00 0.00 178.16 178.71 3f88 s THR 324 N -4.43 2.12 0.07 -2.88 -4.23 -1.26 -4.73 115.64 100.30 3f88 s THR 324 Ca -0.04 -1.03 -0.23 0.00 -1.18 0.00 0.00 61.69 59.22 3f88 s THR 324 Cb 0.13 -1.79 -0.09 0.00 1.34 0.00 0.00 72.50 72.09 3f88 s THR 324 CO 0.44 0.57 1.37 1.55 -0.54 0.00 0.00 174.62 178.00 3f88 h PRO 325 N 6.29 -0.46 -0.84 3.99 0.13 -1.84 -0.50 132.00 138.77 3f88 h PRO 325 Ca -0.28 0.03 0.21 0.00 -0.87 0.00 0.00 66.00 65.10 3f88 h PRO 325 Cb 1.20 0.10 -0.14 0.00 0.13 0.00 0.00 31.00 32.29 3f88 h PRO 325 CO 0.47 -0.30 0.15 1.79 -0.23 0.00 0.00 178.00 179.88 3f88 h THR 326 N -0.47 0.32 -0.26 1.56 1.35 -1.95 0.33 112.91 113.78 3f88 h THR 326 Ca 0.00 -0.06 0.06 0.00 -0.55 0.00 0.00 66.41 65.87 3f88 h THR 326 Cb 0.49 0.13 -0.07 0.00 -1.73 0.00 0.00 68.15 66.97 3f88 h THR 326 CO -0.21 0.03 -0.26 0.00 -0.25 0.00 0.00 175.52 174.83 3f88 h ALA 327 N 1.76 -0.15 -2.68 6.62 0.00 -1.52 -3.44 119.26 119.85 3f88 h ALA 327 Ca 0.50 0.08 -0.56 0.00 0.00 0.00 0.00 54.91 54.93 3f88 h ALA 327 Cb 0.98 0.54 0.12 0.00 0.00 0.00 0.00 17.79 19.42 3f88 h ALA 327 CO -0.66 -0.68 0.50 0.54 0.00 0.00 0.00 179.25 178.94 3f88 n ARG 328 N -5.39 1.97 -1.49 0.00 1.74 0.11 -4.94 116.66 108.67 3f88 n ARG 328 Ca -0.01 0.70 -0.40 0.00 -0.77 0.00 0.00 57.85 57.37 3f88 n ARG 328 Cb 0.30 -2.38 0.02 0.00 -1.02 0.00 0.00 32.46 29.39 3f88 n ARG 328 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3f88 n LEU 329 N 0.31 0.81 -4.85 0.55 4.77 -0.92 -5.01 117.00 112.66 3f88 n LEU 329 Ca 0.06 0.86 -0.32 0.00 -0.03 0.00 0.00 56.01 56.58 3f88 n LEU 329 Cb 0.39 -1.18 -0.01 0.00 -2.33 0.00 0.00 43.42 40.28 3f88 n LEU 329 CO 0.60 -2.70 0.70 0.42 -1.33 0.00 0.00 177.39 175.08 3f88 s THR 330 N -1.54 4.52 0.23 -5.08 -4.23 -1.26 -4.87 115.64 103.41 3f88 s THR 330 Ca 0.66 1.07 -0.10 0.00 -1.18 0.00 0.00 61.69 62.13 3f88 s THR 330 Cb -0.53 -3.73 0.25 0.00 1.34 0.00 0.00 72.50 69.83 3f88 s THR 330 CO 0.56 -0.83 1.63 -0.65 -0.54 0.00 0.00 174.62 174.80 3f88 h PRO 331 N 0.44 0.06 -0.32 3.99 0.11 -1.95 0.24 132.00 134.57 3f88 h PRO 331 Ca -0.46 -0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.56 3f88 h PRO 331 Cb 1.19 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 3f88 h PRO 331 CO 0.61 0.04 -0.19 1.25 -0.21 0.00 0.00 178.00 179.50 3f88 h LEU 332 N 0.06 0.59 -0.56 2.35 5.85 -1.93 -1.67 115.31 119.99 3f88 h LEU 332 Ca 0.36 -0.19 -0.04 0.00 0.84 0.00 0.00 57.88 58.85 3f88 h LEU 332 Cb 0.59 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 3f88 h LEU 332 CO -0.65 0.78 0.18 -0.33 -0.34 0.00 0.00 178.44 178.08 3f88 h GLU 333 N 0.53 0.86 -0.78 1.25 5.08 -1.53 -2.69 114.58 117.30 3f88 h GLU 333 Ca 0.08 -0.18 0.06 0.00 -1.00 0.00 0.00 59.36 58.33 3f88 h GLU 333 Cb 0.63 -0.13 -0.05 0.00 0.50 0.00 0.00 28.75 29.70 3f88 h GLU 333 CO 0.04 0.78 0.51 0.00 -1.00 0.00 0.00 179.01 179.34 3f88 h ALA 334 N 1.04 1.64 -0.70 3.43 0.00 -0.35 -0.78 119.26 123.55 3f88 h ALA 334 Ca 0.18 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 3f88 h ALA 334 Cb 0.27 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 3f88 h ALA 334 CO -0.01 0.24 0.32 0.00 0.00 0.00 0.00 179.25 179.79 3f88 n ALA 336 N -2.44 1.69 -1.82 0.00 0.00 -0.32 -4.76 120.51 112.86 3f88 n ALA 336 Ca 0.06 0.01 -0.42 0.00 0.00 0.00 0.00 53.44 53.10 3f88 n ALA 336 Cb 0.15 -1.31 -0.02 0.00 0.00 0.00 0.00 19.45 18.27 3f88 n ALA 336 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3f88 s HIS 337 N -3.14 2.91 -0.50 0.00 2.46 -0.84 -4.84 115.29 111.34 3f88 s HIS 337 Ca 0.06 0.76 0.06 0.00 0.47 0.00 0.00 55.06 56.41 3f88 s HIS 337 Cb 0.10 -3.98 0.35 0.00 -0.13 0.00 0.00 32.58 28.91 3f88 s HIS 337 CO 0.33 -3.41 1.10 0.43 -2.47 0.00 0.00 174.74 170.73 3f88 n SER 338 N 2.82 0.17 0.28 9.88 7.64 -1.26 -0.23 113.62 132.92 3f88 n SER 338 Ca 0.10 0.49 0.15 0.00 1.01 0.00 0.00 58.87 60.61 3f88 n SER 338 Cb 0.38 -0.49 0.78 0.00 -1.01 0.00 0.00 64.21 63.88 3f88 n SER 338 CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 3f88 h PHE 339 N 0.00 0.00 -0.80 1.43 3.57 -1.88 -2.45 116.94 116.81 3f88 h PHE 339 Ca 0.00 0.00 -0.33 0.00 3.53 0.00 0.00 57.97 61.17 3f88 h PHE 339 Cb 0.27 0.00 -0.20 0.00 2.79 0.00 0.00 35.95 38.81 3f88 h PHE 339 CO 0.00 0.09 0.39 1.19 -2.23 0.00 0.00 178.31 177.75 3f88 n PHE 340 N -3.44 2.54 0.09 0.41 3.72 0.68 -4.49 117.46 116.98 3f88 n PHE 340 Ca -0.01 -1.50 -0.22 0.00 -0.05 0.00 0.00 57.45 55.67 3f88 n PHE 340 Cb 0.24 -0.77 -0.13 0.00 -0.94 0.00 0.00 39.48 37.88 3f88 n PHE 340 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3f88 h ASP 341 N 1.80 0.86 -1.00 4.37 3.32 -1.61 -2.99 116.42 121.18 3f88 h ASP 341 Ca 0.41 -0.79 0.23 0.00 0.02 0.00 0.00 57.03 56.90 3f88 h ASP 341 Cb 2.47 -0.27 -0.09 0.00 0.22 0.00 0.00 39.33 41.66 3f88 h ASP 341 CO 0.84 1.60 0.64 -0.08 -1.72 0.00 0.00 179.24 180.52 3f88 h GLU 342 N 0.27 0.46 0.00 3.56 4.81 -1.82 0.88 114.58 122.74 3f88 h GLU 342 Ca -0.18 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.02 3f88 h GLU 342 Cb 1.91 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 31.19 3f88 h GLU 342 CO 0.24 0.30 0.00 -0.07 -0.73 0.00 0.00 179.01 178.75 3f88 h LEU 343 N 0.47 0.00 -2.25 1.64 3.38 -1.87 -2.77 115.31 113.90 3f88 h LEU 343 Ca 0.56 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.53 3f88 h LEU 343 Cb 1.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.05 3f88 h LEU 343 CO -0.28 0.00 0.00 0.54 0.09 0.00 0.00 178.44 178.79 3f88 n ARG 344 N -2.50 2.84 -3.56 1.13 3.00 0.30 -4.90 116.66 112.97 3f88 n ARG 344 Ca 0.03 -1.97 -0.37 0.00 -0.01 0.00 0.00 57.85 55.54 3f88 n ARG 344 Cb 0.35 -1.67 -0.08 0.00 0.00 0.00 0.00 32.46 31.06 3f88 n ARG 344 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 3f88 s ASP 345 N -0.79 6.33 0.42 0.55 3.68 -0.97 -4.91 116.67 120.98 3f88 s ASP 345 Ca 0.35 0.38 0.10 0.00 2.13 0.00 0.00 52.55 55.51 3f88 s ASP 345 Cb 0.22 -2.16 0.93 0.00 -1.45 0.00 0.00 42.92 40.46 3f88 s ASP 345 CO 0.18 0.07 2.02 -0.65 0.13 0.00 0.00 175.17 176.91 3f88 h PRO 346 N 7.00 0.49 -0.56 4.34 0.11 -1.90 -2.99 132.00 138.49 3f88 h PRO 346 Ca -0.39 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.69 3f88 h PRO 346 Cb 1.16 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.16 3f88 h PRO 346 CO 0.73 0.32 0.00 0.09 -0.21 0.00 0.00 178.00 178.93 3f88 n ASN 347 N -4.47 2.62 -4.84 -2.05 3.02 -1.26 -4.93 115.26 103.35 3f88 n ASN 347 Ca 0.06 -2.21 -0.37 0.00 -0.03 0.00 0.00 54.58 52.04 3f88 n ASN 347 Cb 0.20 -0.41 -0.06 0.00 -0.61 0.00 0.00 39.78 38.91 3f88 n ASN 347 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3f88 s VAL 348 N -1.68 4.96 0.10 2.41 0.11 -1.13 -5.09 120.40 120.09 3f88 s VAL 348 Ca 0.26 0.79 0.02 0.00 -2.93 0.00 0.00 61.98 60.11 3f88 s VAL 348 Cb 0.17 -3.72 -0.04 0.00 -1.53 0.00 0.00 36.38 31.25 3f88 s VAL 348 CO 0.13 0.42 -0.07 -1.59 -3.33 0.00 0.00 175.10 170.66 3f88 s LYS 349 N -1.52 0.83 0.42 1.54 0.00 -1.26 -4.51 119.74 115.24 3f88 s LYS 349 Ca 0.30 -1.33 -0.25 0.00 0.00 0.00 0.00 55.97 54.69 3f88 s LYS 349 Cb -0.16 -0.22 -0.08 0.00 0.00 0.00 0.00 37.83 37.37 3f88 s LYS 349 CO 0.17 -0.01 1.23 -0.51 0.00 0.00 0.00 175.35 176.23 3f88 s LEU 350 N -3.02 4.16 0.30 2.77 1.43 0.18 -4.90 118.68 119.61 3f88 s LEU 350 Ca 0.12 2.49 0.05 0.00 -1.03 0.00 0.00 54.13 55.75 3f88 s LEU 350 Cb 0.05 -4.01 0.81 0.00 0.03 0.00 0.00 46.19 43.07 3f88 s LEU 350 CO -0.05 -0.82 1.63 -0.65 0.23 0.00 0.00 176.35 176.70 3f88 h PRO 351 N 2.53 0.17 -1.11 1.29 0.11 -1.98 0.71 132.00 133.72 3f88 h PRO 351 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3f88 h PRO 351 Cb 1.24 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3f88 h PRO 351 CO 0.62 0.12 0.00 0.27 -0.21 0.00 0.00 178.00 178.79 3f88 n ASN 352 N -5.24 1.71 0.00 -2.05 0.23 -1.26 -4.83 115.26 103.81 3f88 n ASN 352 Ca 0.24 -1.44 0.00 0.00 -0.53 0.00 0.00 54.58 52.85 3f88 n ASN 352 Cb 0.77 -0.36 0.00 0.00 -2.08 0.00 0.00 39.78 38.11 3f88 n ASN 352 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3f88 n GLY 353 N 0.49 2.59 3.58 4.83 0.00 0.25 -5.00 105.19 111.92 3f88 n GLY 353 Ca 0.00 -0.01 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 3f88 n GLY 353 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3f88 n ARG 354 N 0.00 -0.02 -2.46 1.61 1.74 -1.24 -4.60 116.66 111.69 3f88 n ARG 354 Ca 0.00 0.06 -0.30 0.00 -0.77 0.00 0.00 57.85 56.84 3f88 n ARG 354 Cb 0.00 -2.17 -0.02 0.00 -1.02 0.00 0.00 32.46 29.25 3f88 n ARG 354 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3f88 s ASP 355 N -2.05 6.42 0.64 0.55 3.68 -1.26 0.47 116.67 125.13 3f88 s ASP 355 Ca 0.67 1.26 -0.17 0.00 2.13 0.00 0.00 52.55 56.44 3f88 s ASP 355 Cb -0.27 -2.39 -0.01 0.00 -1.45 0.00 0.00 42.92 38.80 3f88 s ASP 355 CO 0.57 -0.59 1.20 0.42 0.13 0.00 0.00 175.17 176.90 3f88 s THR 356 N -2.70 2.60 1.02 1.71 -4.23 -1.26 -4.67 115.64 108.11 3f88 s THR 356 Ca 0.53 0.34 -0.17 0.00 -1.18 0.00 0.00 61.69 61.21 3f88 s THR 356 Cb -0.10 -3.02 0.25 0.00 1.34 0.00 0.00 72.50 70.97 3f88 s THR 356 CO 0.40 -0.12 1.06 -0.81 -0.54 0.00 0.00 174.62 174.61 3f88 n PRO 357 N -2.05 -2.27 -1.68 3.99 -0.04 -1.26 -4.91 135.00 126.78 3f88 n PRO 357 Ca 0.13 -1.68 -0.49 0.00 -0.04 0.00 0.00 63.50 61.43 3f88 n PRO 357 Cb 0.50 -1.38 -0.05 0.00 -0.04 0.00 0.00 33.50 32.53 3f88 n PRO 357 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3f88 n ALA 358 N -4.34 0.84 0.00 0.55 0.00 -1.26 -4.85 120.51 111.45 3f88 n ALA 358 Ca -0.19 0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.56 3f88 n ALA 358 Cb 0.53 -2.46 0.00 0.00 0.00 0.00 0.00 19.45 17.52 3f88 n ALA 358 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3f88 n LEU 359 N 6.17 0.00 0.00 0.00 4.77 -1.26 -4.86 117.00 121.82 3f88 n LEU 359 Ca 0.22 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 3f88 n LEU 359 Cb 0.28 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 3f88 n LEU 359 CO 0.73 0.00 0.28 0.49 -1.33 0.00 0.00 177.39 177.55 3f88 n PHE 360 N -0.95 0.00 -0.64 -1.77 3.01 -1.26 -4.84 117.46 111.01 3f88 n PHE 360 Ca 0.00 -0.06 -0.14 0.00 1.01 0.00 0.00 57.45 58.27 3f88 n PHE 360 Cb 0.00 -0.01 -0.06 0.00 -0.01 0.00 0.00 39.48 39.40 3f88 n PHE 360 CO 0.00 0.00 0.00 0.27 1.01 0.00 0.00 176.76 178.04 3f88 n ASN 361 N -0.06 3.87 -4.72 4.37 6.94 -1.26 -4.88 115.26 119.53 3f88 n ASN 361 Ca 0.00 -2.18 -0.42 0.00 -0.02 0.00 0.00 54.58 51.96 3f88 n ASN 361 Cb 0.03 -0.94 -0.03 0.00 -2.36 0.00 0.00 39.78 36.48 3f88 n ASN 361 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 3f88 s PHE 362 N 2.57 3.32 0.68 -2.53 0.40 -1.26 -5.03 117.98 116.12 3f88 s PHE 362 Ca 0.39 1.10 -0.11 0.00 -0.60 0.00 0.00 56.93 57.70 3f88 s PHE 362 Cb 0.14 -3.58 -0.00 0.00 0.51 0.00 0.00 43.02 40.09 3f88 s PHE 362 CO -0.02 -1.94 1.07 0.95 0.70 0.00 0.00 175.22 175.98 3f88 s THR 363 N 0.98 3.91 0.41 0.64 -4.23 -1.26 -4.94 115.64 111.15 3f88 s THR 363 Ca 0.62 0.62 0.13 0.00 -1.18 0.00 0.00 61.69 61.88 3f88 s THR 363 Cb -0.34 -3.61 0.14 0.00 1.34 0.00 0.00 72.50 70.03 3f88 s THR 363 CO 0.31 -0.81 1.91 0.71 -0.54 0.00 0.00 174.62 176.20 3f88 h THR 364 N -0.55 1.20 -0.69 3.99 1.35 -1.96 -1.82 112.91 114.43 3f88 h THR 364 Ca -0.45 -0.93 0.00 0.00 -0.55 0.00 0.00 66.41 64.48 3f88 h THR 364 Cb 1.23 1.49 -0.03 0.00 -1.73 0.00 0.00 68.15 69.11 3f88 h THR 364 CO 0.63 0.27 0.43 -0.61 -0.25 0.00 0.00 175.52 175.99 3f88 h GLN 365 N 0.01 0.92 -0.08 4.72 5.75 -2.01 -2.87 115.11 121.55 3f88 h GLN 365 Ca -0.00 -0.07 -0.12 0.00 -0.15 0.00 0.00 58.65 58.31 3f88 h GLN 365 Cb 0.48 -0.20 -0.01 0.00 1.07 0.00 0.00 27.48 28.82 3f88 h GLN 365 CO 0.03 0.63 -0.48 1.49 -2.65 0.00 0.00 178.83 177.86 3f88 h GLU 366 N 0.93 0.21 -2.22 1.69 4.81 -1.75 -3.20 114.58 115.06 3f88 h GLU 366 Ca 0.25 -0.11 -0.80 0.00 -0.13 0.00 0.00 59.36 58.56 3f88 h GLU 366 Cb -0.07 0.01 -0.27 0.00 0.63 0.00 0.00 28.75 29.05 3f88 h GLU 366 CO -0.05 0.65 1.07 1.28 -0.73 0.00 0.00 179.01 181.23 3f88 n LEU 367 N -3.97 7.41 0.00 1.64 4.77 -0.75 -4.50 117.00 121.60 3f88 n LEU 367 Ca -0.02 -5.29 0.00 0.00 -0.03 0.00 0.00 56.01 50.68 3f88 n LEU 367 Cb 0.52 -1.16 0.00 0.00 -2.33 0.00 0.00 43.42 40.46 3f88 n LEU 367 CO 0.42 2.00 -0.37 -1.54 -1.33 0.00 0.00 177.39 176.58 3f88 n SER 368 N -0.10 3.67 -0.11 -1.43 3.41 -1.21 -3.44 113.62 114.40 3f88 n SER 368 Ca 0.48 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.10 3f88 n SER 368 Cb 0.26 0.54 0.28 0.00 -0.26 0.00 0.00 64.21 65.02 3f88 n SER 368 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3f88 h SER 369 N 0.00 0.70 -0.82 4.04 4.64 -1.83 -3.40 113.55 116.88 3f88 h SER 369 Ca 0.00 -0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 61.25 3f88 h SER 369 Cb 0.39 -0.18 -0.19 0.00 -0.31 0.00 0.00 62.40 62.11 3f88 h SER 369 CO 0.00 0.59 -0.37 0.21 -0.87 0.00 0.00 176.83 176.40 3f88 s ASN 370 N -6.55 -1.27 0.37 4.97 2.47 -1.26 -5.06 114.94 108.61 3f88 s ASN 370 Ca -0.10 -0.58 0.09 0.00 0.42 0.00 0.00 52.86 52.69 3f88 s ASN 370 Cb 0.17 1.63 0.74 0.00 -1.45 0.00 0.00 41.25 42.34 3f88 s ASN 370 CO 0.77 -0.15 1.89 -0.65 -3.72 0.00 0.00 177.10 175.25 3f88 h PRO 371 N 6.73 0.25 -3.14 0.43 0.11 -1.78 -3.32 132.00 131.29 3f88 h PRO 371 Ca 0.03 -0.06 -0.62 0.00 0.11 0.00 0.00 66.00 65.45 3f88 h PRO 371 Cb 1.19 -0.03 0.02 0.00 0.11 0.00 0.00 31.00 32.29 3f88 h PRO 371 CO 0.06 0.41 3.59 -0.35 -0.21 0.00 0.00 178.00 181.51 3f88 n PRO 372 N -4.25 3.35 -0.24 1.05 -0.04 -1.26 -3.24 135.00 130.37 3f88 n PRO 372 Ca -0.01 -2.08 0.00 0.00 -0.04 0.00 0.00 63.50 61.37 3f88 n PRO 372 Cb 0.29 -2.76 0.00 0.00 -0.04 0.00 0.00 33.50 30.99 3f88 n PRO 372 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3f88 n LEU 373 N 3.85 0.00 0.16 1.53 4.77 -1.25 -4.91 117.00 121.15 3f88 n LEU 373 Ca 0.71 -0.53 0.03 0.00 -0.03 0.00 0.00 56.01 56.19 3f88 n LEU 373 Cb 0.22 0.00 0.39 0.00 -2.33 0.00 0.00 43.42 41.70 3f88 n LEU 373 CO 0.83 0.23 0.83 0.00 -1.33 0.00 0.00 177.39 177.95 3f88 h ALA 374 N 0.00 1.48 -0.90 -1.18 0.00 -1.85 -1.74 119.26 115.07 3f88 h ALA 374 Ca 0.00 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 54.70 3f88 h ALA 374 Cb 1.16 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.83 3f88 h ALA 374 CO 0.00 0.37 0.58 1.15 0.00 0.00 0.00 179.25 181.35 3f88 h THR 375 N 0.11 1.12 0.00 0.00 2.02 -1.90 0.58 112.91 114.85 3f88 h THR 375 Ca 0.02 -0.38 -0.21 0.00 0.77 0.00 0.00 66.41 66.62 3f88 h THR 375 Cb 0.48 -0.07 -0.04 0.00 -1.74 0.00 0.00 68.15 66.78 3f88 h THR 375 CO 0.03 0.20 -1.44 0.40 0.37 0.00 0.00 175.52 175.08 3f88 h ILE 376 N 1.10 0.68 0.11 3.11 5.03 -1.95 -3.39 117.51 122.19 3f88 h ILE 376 Ca 0.37 -2.29 -0.27 0.00 -0.12 0.00 0.00 64.86 62.54 3f88 h ILE 376 Cb 0.05 2.21 0.01 0.00 -3.03 0.00 0.00 36.82 36.06 3f88 h ILE 376 CO -0.13 0.38 -1.19 -0.07 -0.68 0.00 0.00 178.15 176.46 3f88 h LEU 377 N 0.00 0.58 -8.05 1.44 3.38 -0.74 -3.41 115.31 108.51 3f88 h LEU 377 Ca -0.19 -0.56 -0.69 0.00 0.09 0.00 0.00 57.88 56.53 3f88 h LEU 377 Cb 1.72 -0.19 -0.31 0.00 0.09 0.00 0.00 40.66 41.97 3f88 h LEU 377 CO 0.06 1.41 -0.61 -0.63 0.09 0.00 0.00 178.44 178.76 3f88 s ILE 378 N -2.87 3.47 1.25 1.22 1.01 0.20 -4.85 121.20 120.63 3f88 s ILE 378 Ca -0.06 -1.45 -0.20 0.00 0.00 0.00 0.00 60.65 58.94 3f88 s ILE 378 Cb 0.07 -3.08 0.30 0.00 0.01 0.00 0.00 42.46 39.76 3f88 s ILE 378 CO 0.90 -0.31 1.07 -2.16 0.00 0.00 0.00 174.94 174.44 3f88 s PRO 379 N 1.30 -1.60 0.13 2.79 0.04 -1.26 -4.65 135.00 131.75 3f88 s PRO 379 Ca -0.00 -0.02 -0.24 0.00 0.04 0.00 0.00 61.00 60.78 3f88 s PRO 379 Cb -0.21 -1.55 -0.04 0.00 0.04 0.00 0.00 34.50 32.75 3f88 s PRO 379 CO -0.00 -3.97 1.66 -1.35 0.04 0.00 0.00 177.00 173.38 3f88 h PRO 380 N -2.76 -0.26 0.00 0.56 0.11 -1.92 -3.16 132.00 124.56 3f88 h PRO 380 Ca -0.45 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3f88 h PRO 380 Cb 1.30 0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.47 3f88 h PRO 380 CO 0.33 -0.17 0.00 -2.39 -0.21 0.00 0.00 178.00 175.55 3f88 n HIS 381 N -5.32 0.00 -0.10 0.65 1.44 -1.26 -2.95 115.22 107.68 3f88 n HIS 381 Ca -0.04 0.00 -0.13 0.00 -2.01 0.00 0.00 57.72 55.54 3f88 n HIS 381 Cb 0.24 -0.41 -0.11 0.00 0.12 0.00 0.00 29.99 29.84 3f88 n HIS 381 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3f88 n ALA 382 N -1.41 1.55 1.82 1.59 0.00 -1.20 -5.22 120.51 117.65 3f88 n ALA 382 Ca 0.04 -0.95 0.15 0.00 0.00 0.00 0.00 53.44 52.68 3f88 n ALA 382 Cb 0.12 -0.02 0.87 0.00 0.00 0.00 0.00 19.45 20.42 3f88 n ALA 382 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39