#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3im5 s PHE 13 N 0.00 2.76 0.02 3.69 0.08 -1.26 -2.16 117.98 121.11 3im5 s PHE 13 Ca 0.00 -0.18 -0.30 0.00 0.12 0.00 0.00 56.93 56.57 3im5 s PHE 13 Cb 0.00 -1.32 -0.04 0.00 -0.57 0.00 0.00 43.02 41.09 3im5 s PHE 13 CO 0.00 0.53 1.11 -0.51 -0.10 0.00 0.00 175.22 176.25 3im5 s LEU 14 N -3.04 4.35 0.11 -0.37 1.43 0.08 -4.71 118.68 116.54 3im5 s LEU 14 Ca 0.27 1.84 0.10 0.00 -1.03 0.00 0.00 54.13 55.32 3im5 s LEU 14 Cb -0.09 -3.57 -0.04 0.00 0.03 0.00 0.00 46.19 42.52 3im5 s LEU 14 CO 0.18 -0.40 -0.25 -0.13 0.23 0.00 0.00 176.35 175.97 3im5 s ARG 15 N 1.21 1.53 0.54 1.70 1.81 -1.26 -0.54 118.95 123.94 3im5 s ARG 15 Ca 0.55 -1.28 -0.21 0.00 -1.72 0.00 0.00 55.73 53.07 3im5 s ARG 15 Cb -0.25 -1.95 -0.05 0.00 -0.45 0.00 0.00 34.95 32.25 3im5 s ARG 15 CO 0.27 0.47 1.27 0.95 -0.68 0.00 0.00 175.30 177.58 3im5 s THR 16 N -1.04 2.46 0.00 0.02 -4.23 0.67 -2.20 115.64 111.32 3im5 s THR 16 Ca 0.14 0.33 0.00 0.00 -1.18 0.00 0.00 61.69 60.98 3im5 s THR 16 Cb -0.10 -3.16 0.00 0.00 1.34 0.00 0.00 72.50 70.58 3im5 s THR 16 CO 0.06 -0.02 0.00 0.47 -0.54 0.00 0.00 174.62 174.59 3im5 n ASP 17 N -1.10 0.00 -4.75 3.99 8.00 0.41 -4.48 116.55 118.61 3im5 n ASP 17 Ca 0.11 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.19 3im5 n ASP 17 Cb 0.47 -0.11 -0.02 0.00 -0.02 0.00 0.00 41.12 41.45 3im5 n ASP 17 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 3im5 s ASP 18 N -3.70 6.38 -0.16 -2.24 1.11 -0.93 -4.74 116.67 112.38 3im5 s ASP 18 Ca 0.00 2.94 -0.18 0.00 0.18 0.00 0.00 52.55 55.49 3im5 s ASP 18 Cb 0.00 -2.63 -0.04 0.00 1.07 0.00 0.00 42.92 41.32 3im5 s ASP 18 CO 0.00 -0.91 0.47 -0.70 1.18 0.00 0.00 175.17 175.20 3im5 s GLU 19 N -0.42 4.26 0.08 8.23 2.12 -1.26 -1.60 118.70 130.12 3im5 s GLU 19 Ca 0.64 0.38 -0.00 0.00 0.36 0.00 0.00 54.97 56.35 3im5 s GLU 19 Cb -0.48 -3.49 -0.04 0.00 0.26 0.00 0.00 34.13 30.38 3im5 s GLU 19 CO 0.47 0.04 -0.02 0.14 -0.54 0.00 0.00 175.26 175.34 3im5 s VAL 20 N 1.04 0.35 0.06 3.70 -7.23 0.24 -1.55 120.40 117.00 3im5 s VAL 20 Ca 0.24 -1.87 0.09 0.00 -1.81 0.00 0.00 61.98 58.63 3im5 s VAL 20 Cb -0.15 -1.68 -0.03 0.00 0.56 0.00 0.00 36.38 35.07 3im5 s VAL 20 CO 0.09 -0.85 -0.26 0.68 -0.31 0.00 0.00 175.10 174.46 3im5 s VAL 21 N -3.85 2.22 -0.26 1.32 -7.23 0.39 -1.13 120.40 111.87 3im5 s VAL 21 Ca 0.12 -1.42 -0.08 0.00 -1.81 0.00 0.00 61.98 58.79 3im5 s VAL 21 Cb 0.07 -1.89 -0.03 0.00 0.56 0.00 0.00 36.38 35.09 3im5 s VAL 21 CO -0.06 0.33 0.09 -0.76 -0.31 0.00 0.00 175.10 174.39 3im5 s LEU 22 N -1.37 3.56 0.03 1.32 1.02 -1.26 -1.79 118.68 120.18 3im5 s LEU 22 Ca 0.12 -0.19 0.08 0.00 0.02 0.00 0.00 54.13 54.16 3im5 s LEU 22 Cb -0.10 -1.96 -0.02 0.00 0.02 0.00 0.00 46.19 44.13 3im5 s LEU 22 CO 0.03 -0.04 -0.23 -1.10 0.02 0.00 0.00 176.35 175.02 3im5 s GLN 23 N 1.64 1.65 0.17 1.70 -0.21 0.01 -0.35 119.66 124.26 3im5 s GLN 23 Ca 0.06 -0.98 0.06 0.00 0.02 0.00 0.00 55.36 54.53 3im5 s GLN 23 Cb -0.15 -1.75 -0.05 0.00 1.00 0.00 0.00 33.01 32.07 3im5 s GLN 23 CO 0.05 0.46 -0.12 0.00 -2.12 0.00 0.00 175.29 173.55 3im5 s THR 25 N -3.15 4.97 -0.19 0.00 2.01 -1.26 -1.16 115.64 116.86 3im5 s THR 25 Ca 0.19 0.03 0.01 0.00 0.31 0.00 0.00 61.69 62.23 3im5 s THR 25 Cb 0.01 -3.24 0.03 0.00 0.01 0.00 0.00 72.50 69.31 3im5 s THR 25 CO 0.03 0.47 -0.17 0.00 -0.69 0.00 0.00 174.62 174.25 3im5 s ALA 26 N 0.27 2.33 -0.10 7.40 0.00 0.56 -5.00 121.76 127.22 3im5 s ALA 26 Ca 0.05 -1.30 0.04 0.00 0.00 0.00 0.00 51.96 50.75 3im5 s ALA 26 Cb -0.12 -1.25 -0.00 0.00 0.00 0.00 0.00 23.12 21.75 3im5 s ALA 26 CO -0.00 -0.53 -0.24 0.99 0.00 0.00 0.00 175.76 175.98 3im5 s THR 27 N 1.27 2.05 -0.28 0.00 2.01 -1.26 -1.90 115.64 117.54 3im5 s THR 27 Ca 0.02 -1.02 -0.22 0.00 0.31 0.00 0.00 61.69 60.78 3im5 s THR 27 Cb -0.14 -1.77 0.09 0.00 0.01 0.00 0.00 72.50 70.69 3im5 s THR 27 CO -0.11 0.56 0.83 -0.51 -0.69 0.00 0.00 174.62 174.69 3im5 s ILE 28 N 0.33 0.00 -1.42 1.82 2.07 -0.63 -4.97 121.20 118.40 3im5 s ILE 28 Ca -0.18 0.00 -0.06 0.00 -1.41 0.00 0.00 60.65 59.00 3im5 s ILE 28 Cb -0.18 -1.00 0.04 0.00 0.13 0.00 0.00 42.46 41.45 3im5 s ILE 28 CO 0.09 0.00 0.75 1.41 -1.91 0.00 0.00 174.94 175.28 3im5 n HIS 29 N 3.04 -1.99 -2.04 3.50 8.25 -1.26 -2.06 115.22 122.66 3im5 n HIS 29 Ca -0.15 0.84 -0.20 0.00 -0.26 0.00 0.00 57.72 57.95 3im5 n HIS 29 Cb 0.56 -4.08 -0.04 0.00 1.12 0.00 0.00 29.99 27.55 3im5 n HIS 29 CO 0.00 0.00 0.00 0.36 0.64 0.00 0.00 176.34 177.34 3im5 n LYS 30 N -4.44 -1.54 -4.48 -0.41 0.00 -1.26 -4.97 118.16 101.06 3im5 n LYS 30 Ca -0.17 1.09 -0.25 0.00 -0.00 0.00 0.00 58.31 58.99 3im5 n LYS 30 Cb 0.62 -5.61 -0.17 0.00 -0.00 0.00 0.00 35.03 29.87 3im5 n LYS 30 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.40 175.57 3im5 s GLU 31 N -4.45 1.66 0.01 -1.58 4.04 -0.87 -5.14 118.70 112.36 3im5 s GLU 31 Ca 0.00 -0.38 0.08 0.00 0.04 0.00 0.00 54.97 54.70 3im5 s GLU 31 Cb 0.00 -1.42 -0.02 0.00 0.02 0.00 0.00 34.13 32.71 3im5 s GLU 31 CO 0.00 -0.02 -0.23 -1.14 -1.84 0.00 0.00 175.26 172.03 3im5 s GLN 32 N 0.82 1.73 0.08 -4.83 0.74 -1.26 -1.60 119.66 115.34 3im5 s GLN 32 Ca -0.12 -0.92 -0.10 0.00 0.05 0.00 0.00 55.36 54.28 3im5 s GLN 32 Cb -0.15 -1.77 0.00 0.00 1.10 0.00 0.00 33.01 32.19 3im5 s GLN 32 CO 0.02 0.47 0.21 1.14 -0.55 0.00 0.00 175.29 176.58 3im5 s GLN 33 N -0.85 0.83 -0.08 1.67 -2.07 -0.80 -5.01 119.66 113.35 3im5 s GLN 33 Ca 0.09 -0.85 -0.03 0.00 -1.82 0.00 0.00 55.36 52.75 3im5 s GLN 33 Cb -0.09 0.34 -0.04 0.00 -1.09 0.00 0.00 33.01 32.13 3im5 s GLN 33 CO 0.00 -0.26 0.06 0.15 -1.32 0.00 0.00 175.29 173.92 3im5 s LYS 34 N -3.53 3.15 0.11 9.60 1.02 -1.26 -0.32 119.74 128.50 3im5 s LYS 34 Ca 0.02 -0.33 0.09 0.00 0.02 0.00 0.00 55.97 55.77 3im5 s LYS 34 Cb 0.03 -2.94 -0.04 0.00 -0.52 0.00 0.00 37.83 34.37 3im5 s LYS 34 CO -0.09 0.72 -0.22 -0.51 -0.92 0.00 0.00 175.35 174.32 3im5 s LEU 35 N -1.08 2.31 0.08 3.17 1.43 -0.30 -1.95 118.68 122.33 3im5 s LEU 35 Ca 0.16 -0.71 0.06 0.00 -1.03 0.00 0.00 54.13 52.61 3im5 s LEU 35 Cb -0.12 -0.96 -0.04 0.00 0.03 0.00 0.00 46.19 45.11 3im5 s LEU 35 CO 0.05 0.08 -0.08 0.00 0.23 0.00 0.00 176.35 176.63 3im5 s LEU 37 N -2.05 4.33 0.14 0.00 2.96 0.52 -1.64 118.68 122.95 3im5 s LEU 37 Ca 0.21 2.07 0.07 0.00 -0.22 0.00 0.00 54.13 56.26 3im5 s LEU 37 Cb -0.11 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 42.97 3im5 s LEU 37 CO 0.13 -0.63 -0.16 0.00 -1.32 0.00 0.00 176.35 174.38 3im5 s ALA 38 N 1.86 1.72 0.11 5.97 0.00 0.21 -4.23 121.76 127.39 3im5 s ALA 38 Ca 0.61 -1.39 -0.20 0.00 0.00 0.00 0.00 51.96 50.98 3im5 s ALA 38 Cb -0.31 -0.12 0.05 0.00 0.00 0.00 0.00 23.12 22.75 3im5 s ALA 38 CO 0.27 0.15 0.49 0.00 0.00 0.00 0.00 175.76 176.67 3im5 s ALA 39 N -2.16 -1.24 0.04 0.00 0.00 -0.85 -1.91 121.76 115.64 3im5 s ALA 39 Ca 0.12 0.31 0.06 0.00 0.00 0.00 0.00 51.96 52.46 3im5 s ALA 39 Cb -0.05 0.63 -0.02 0.00 0.00 0.00 0.00 23.12 23.68 3im5 s ALA 39 CO 0.04 -0.63 -0.18 -1.21 0.00 0.00 0.00 175.76 173.79 3im5 s GLU 40 N -3.31 1.21 -0.00 0.00 2.02 -1.26 -4.71 118.70 112.65 3im5 s GLU 40 Ca -0.00 -0.85 0.04 0.00 0.02 0.00 0.00 54.97 54.18 3im5 s GLU 40 Cb 0.00 -1.28 0.11 0.00 0.10 0.00 0.00 34.13 33.06 3im5 s GLU 40 CO -0.09 0.32 1.06 0.41 0.02 0.00 0.00 175.26 176.99 3im5 n GLY 41 N 1.93 -0.30 3.56 -1.39 0.00 -1.26 -4.29 105.19 103.44 3im5 n GLY 41 Ca -0.17 -0.13 -0.24 0.00 0.00 0.00 0.00 46.02 45.47 3im5 n GLY 41 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3im5 s PHE 42 N -1.80 2.53 0.00 1.61 -0.12 -1.26 -4.92 117.98 114.01 3im5 s PHE 42 Ca 0.08 -0.26 0.00 0.00 -0.05 0.00 0.00 56.93 56.70 3im5 s PHE 42 Cb 0.04 -1.15 0.00 0.00 -0.63 0.00 0.00 43.02 41.29 3im5 s PHE 42 CO 0.05 0.62 0.00 0.41 -0.05 0.00 0.00 175.22 176.25 3im5 n GLY 43 N -0.52 -0.05 0.00 1.99 0.00 -1.26 -3.64 105.19 101.70 3im5 n GLY 43 Ca -0.07 -1.01 0.09 0.00 0.00 0.00 0.00 46.02 45.02 3im5 n GLY 43 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3im5 n ASN 44 N 0.92 0.00 -1.65 1.61 0.23 -1.26 -4.89 115.26 110.22 3im5 n ASN 44 Ca 0.00 -1.18 -0.18 0.00 -0.53 0.00 0.00 54.58 52.69 3im5 n ASN 44 Cb 0.00 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 37.63 3im5 n ASN 44 CO 0.00 0.00 0.00 -2.11 -0.93 0.00 0.00 177.26 174.22 3im5 n ARG 45 N -0.82 -1.46 -2.75 -3.83 -4.01 -1.24 -4.82 116.66 97.73 3im5 n ARG 45 Ca 0.14 1.03 -0.37 0.00 -1.04 0.00 0.00 57.85 57.61 3im5 n ARG 45 Cb 0.06 -5.40 -0.06 0.00 -3.04 0.00 0.00 32.46 24.02 3im5 n ARG 45 CO 0.00 0.00 0.00 -0.51 -3.04 0.00 0.00 177.63 174.08 3im5 s LEU 46 N -4.58 4.28 0.53 2.89 1.43 -1.26 -0.76 118.68 121.21 3im5 s LEU 46 Ca 0.00 1.86 -0.17 0.00 -1.03 0.00 0.00 54.13 54.79 3im5 s LEU 46 Cb 0.00 -4.08 -0.07 0.00 0.03 0.00 0.00 46.19 42.07 3im5 s LEU 46 CO 0.00 -0.15 1.01 0.00 0.23 0.00 0.00 176.35 177.44 3im5 n PHE 48 N -1.58 -1.57 -4.73 0.00 1.16 -0.80 -4.71 117.46 105.23 3im5 n PHE 48 Ca 0.08 -1.37 -0.24 0.00 -1.87 0.00 0.00 57.45 54.05 3im5 n PHE 48 Cb 0.53 0.51 -0.15 0.00 -1.61 0.00 0.00 39.48 38.76 3im5 n PHE 48 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 3im5 s LEU 49 N 0.00 1.98 -0.11 5.98 1.43 -1.26 -0.62 118.68 126.08 3im5 s LEU 49 Ca 0.14 -0.29 -0.09 0.00 -1.03 0.00 0.00 54.13 52.86 3im5 s LEU 49 Cb -0.02 -0.82 -0.04 0.00 0.03 0.00 0.00 46.19 45.33 3im5 s LEU 49 CO 0.10 0.17 0.19 -1.61 0.23 0.00 0.00 176.35 175.44 3im5 s GLU 50 N -0.23 3.63 0.38 1.70 2.02 -0.65 -4.91 118.70 120.64 3im5 s GLU 50 Ca 0.03 -0.04 -0.26 0.00 0.02 0.00 0.00 54.97 54.72 3im5 s GLU 50 Cb -0.07 -3.23 -0.09 0.00 0.10 0.00 0.00 34.13 30.84 3im5 s GLU 50 CO 0.00 0.69 1.16 -1.12 0.02 0.00 0.00 175.26 176.01 3im5 s SER 51 N -0.83 6.63 0.16 -0.19 0.01 -1.26 -0.88 113.70 117.35 3im5 s SER 51 Ca 0.16 2.32 0.07 0.00 1.31 0.00 0.00 55.95 59.81 3im5 s SER 51 Cb -0.13 -2.61 -0.04 0.00 0.21 0.00 0.00 66.02 63.45 3im5 s SER 51 CO 0.05 -0.60 0.02 0.42 0.41 0.00 0.00 173.24 173.54 3im5 s THR 52 N -1.40 3.86 0.23 1.44 -4.23 -0.82 -4.23 115.64 110.49 3im5 s THR 52 Ca 0.55 -1.33 -0.14 0.00 -1.18 0.00 0.00 61.69 59.59 3im5 s THR 52 Cb -0.30 -2.94 0.27 0.00 1.34 0.00 0.00 72.50 70.87 3im5 s THR 52 CO 0.38 -0.09 1.59 0.77 -0.54 0.00 0.00 174.62 176.73 3im5 h SER 53 N 2.72 -0.95 -4.86 3.99 4.64 -1.98 -3.44 113.55 113.69 3im5 h SER 53 Ca -0.47 0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 3im5 h SER 53 Cb 1.20 0.55 -0.04 0.00 -0.31 0.00 0.00 62.40 63.80 3im5 h SER 53 CO 0.59 -0.28 -0.89 0.55 -0.87 0.00 0.00 176.83 175.93 3im5 n VAL 58 N -5.49 -9.56 -2.21 0.95 3.14 -1.26 -4.92 118.33 98.97 3im5 n VAL 58 Ca 0.09 2.16 -0.41 0.00 -2.96 0.00 0.00 64.34 63.23 3im5 n VAL 58 Cb 0.39 -5.03 -0.03 0.00 -1.06 0.00 0.00 33.84 28.12 3im5 n VAL 58 CO 0.00 0.00 0.00 -2.84 -6.46 0.00 0.00 176.83 167.53 3im5 s PRO 59 N -0.45 4.42 0.35 1.45 0.02 -1.26 -4.96 135.00 134.58 3im5 s PRO 59 Ca -0.09 2.10 0.04 0.00 0.02 0.00 0.00 61.00 63.08 3im5 s PRO 59 Cb 0.01 -3.12 0.68 0.00 0.02 0.00 0.00 34.50 32.08 3im5 s PRO 59 CO 0.23 -0.12 1.97 -1.00 -0.33 0.00 0.00 177.00 177.75 3im5 h PRO 60 N 3.89 0.80 -3.81 5.54 0.13 -1.97 -3.36 132.00 133.23 3im5 h PRO 60 Ca -0.48 -0.05 -0.63 0.00 -0.87 0.00 0.00 66.00 63.98 3im5 h PRO 60 Cb 1.22 -0.18 -0.40 0.00 0.13 0.00 0.00 31.00 31.77 3im5 h PRO 60 CO 0.68 0.53 -0.72 0.34 -0.23 0.00 0.00 178.00 178.61 3im5 s ASP 61 N -6.28 4.27 0.15 1.44 -1.08 -1.26 -5.02 116.67 108.90 3im5 s ASP 61 Ca -0.10 -2.29 -0.07 0.00 -0.52 0.00 0.00 52.55 49.57 3im5 s ASP 61 Cb 0.19 -1.32 -0.01 0.00 -1.46 0.00 0.00 42.92 40.32 3im5 s ASP 61 CO 0.77 -0.34 1.43 0.25 0.52 0.00 0.00 175.17 177.81 3im5 h LEU 62 N 7.34 0.79 -0.92 -1.34 5.85 -2.00 -3.30 115.31 121.73 3im5 h LEU 62 Ca -0.07 -0.44 0.15 0.00 0.84 0.00 0.00 57.88 58.36 3im5 h LEU 62 Cb 0.98 -0.23 -0.09 0.00 0.37 0.00 0.00 40.66 41.68 3im5 h LEU 62 CO 0.53 1.21 0.52 0.77 -0.34 0.00 0.00 178.44 181.13 3im5 h SER 63 N 0.53 0.69 1.04 1.25 4.64 -1.96 -1.59 113.55 118.14 3im5 h SER 63 Ca -0.00 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 3im5 h SER 63 Cb 1.18 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 3im5 h SER 63 CO 0.12 0.30 0.00 0.16 -0.87 0.00 0.00 176.83 176.55 3im5 h ILE 64 N 0.75 0.00 -0.01 0.95 3.07 -1.84 -2.88 117.51 117.55 3im5 h ILE 64 Ca 0.49 -0.50 0.00 0.00 1.55 0.00 0.00 64.86 66.40 3im5 h ILE 64 Cb 0.65 1.48 0.00 0.00 -0.27 0.00 0.00 36.82 38.68 3im5 h ILE 64 CO -0.34 0.00 -0.20 0.00 -1.05 0.00 0.00 178.15 176.56 3im5 s THR 66 N -2.35 4.97 0.01 0.00 2.01 -1.09 -4.40 115.64 114.79 3im5 s THR 66 Ca 0.27 1.57 0.03 0.00 0.31 0.00 0.00 61.69 63.87 3im5 s THR 66 Cb 0.20 -4.10 -0.01 0.00 0.01 0.00 0.00 72.50 68.59 3im5 s THR 66 CO 0.47 0.15 -0.10 -0.36 -0.69 0.00 0.00 174.62 174.09 3im5 s PHE 67 N 1.38 0.88 -0.16 4.92 0.08 -0.28 -1.29 117.98 123.51 3im5 s PHE 67 Ca 0.39 -0.24 -0.07 0.00 0.12 0.00 0.00 56.93 57.13 3im5 s PHE 67 Cb -0.18 -0.55 -0.04 0.00 -0.57 0.00 0.00 43.02 41.68 3im5 s PHE 67 CO 0.17 -0.01 0.09 0.08 -0.10 0.00 0.00 175.22 175.44 3im5 s VAL 68 N -0.49 5.03 -0.92 -0.44 1.01 -0.01 0.80 120.40 125.38 3im5 s VAL 68 Ca 0.01 0.04 -0.24 0.00 0.00 0.00 0.00 61.98 61.79 3im5 s VAL 68 Cb -0.05 -3.24 0.04 0.00 0.00 0.00 0.00 36.38 33.13 3im5 s VAL 68 CO 0.00 0.51 1.41 -0.76 0.00 0.00 0.00 175.10 176.26 3im5 s LEU 69 N -0.10 3.37 -0.04 3.92 1.43 -0.63 -1.25 118.68 125.40 3im5 s LEU 69 Ca 0.08 -1.07 -0.26 0.00 -1.03 0.00 0.00 54.13 51.85 3im5 s LEU 69 Cb -0.12 -2.57 -0.21 0.00 0.03 0.00 0.00 46.19 43.32 3im5 s LEU 69 CO 0.01 -1.66 1.18 -0.33 0.23 0.00 0.00 176.35 175.77 3im5 h GLU 70 N 9.99 0.02 -4.62 1.70 4.39 -1.56 1.18 114.58 125.67 3im5 h GLU 70 Ca 0.03 -0.01 -0.30 0.00 0.34 0.00 0.00 59.36 59.42 3im5 h GLU 70 Cb 1.03 0.00 -0.22 0.00 -0.10 0.00 0.00 28.75 29.45 3im5 h GLU 70 CO 1.37 0.60 -0.74 -0.65 -1.16 0.00 0.00 179.01 178.43 3im5 s GLN 71 N -3.87 0.55 -0.21 2.33 -1.52 -1.23 -4.54 119.66 111.17 3im5 s GLN 71 Ca -0.16 -0.70 -0.04 0.00 -1.95 0.00 0.00 55.36 52.51 3im5 s GLN 71 Cb 0.01 -0.38 0.09 0.00 -0.22 0.00 0.00 33.01 32.51 3im5 s GLN 71 CO 0.68 0.08 0.18 0.45 -0.25 0.00 0.00 175.29 176.43 3im5 s SER 72 N -1.38 1.95 0.12 5.90 0.15 -1.26 -1.67 113.70 117.51 3im5 s SER 72 Ca -0.07 -0.52 0.07 0.00 0.70 0.00 0.00 55.95 56.12 3im5 s SER 72 Cb -0.09 0.13 -0.04 0.00 -1.71 0.00 0.00 66.02 64.31 3im5 s SER 72 CO 0.01 -0.35 -0.17 -0.76 1.20 0.00 0.00 173.24 173.16 3im5 s LEU 73 N 2.25 2.37 0.52 3.45 1.43 0.46 -4.93 118.68 124.22 3im5 s LEU 73 Ca 0.06 -0.76 -0.21 0.00 -1.03 0.00 0.00 54.13 52.19 3im5 s LEU 73 Cb -0.16 -0.70 -0.06 0.00 0.03 0.00 0.00 46.19 45.31 3im5 s LEU 73 CO -0.17 -0.06 1.20 -0.94 0.23 0.00 0.00 176.35 176.62 3im5 s SER 74 N -2.26 5.71 0.23 2.29 1.04 -1.26 0.14 113.70 119.59 3im5 s SER 74 Ca 0.08 2.37 -0.08 0.00 0.48 0.00 0.00 55.95 58.80 3im5 s SER 74 Cb -0.07 -2.60 0.37 0.00 0.10 0.00 0.00 66.02 63.81 3im5 s SER 74 CO 0.04 -1.24 1.67 0.58 0.98 0.00 0.00 173.24 175.27 3im5 h VAL 75 N 1.44 0.50 -0.21 5.02 2.07 -1.92 -0.32 116.25 122.82 3im5 h VAL 75 Ca -0.50 -0.06 0.05 0.00 0.82 0.00 0.00 66.70 67.00 3im5 h VAL 75 Cb 1.27 0.30 -0.04 0.00 -1.52 0.00 0.00 31.29 31.30 3im5 h VAL 75 CO 0.58 0.03 -0.07 -0.09 0.02 0.00 0.00 177.57 178.04 3im5 h ARG 76 N 0.18 -0.03 -0.78 1.57 2.43 -1.96 0.03 114.38 115.83 3im5 h ARG 76 Ca 0.36 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.48 3im5 h ARG 76 Cb 0.60 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.13 3im5 h ARG 76 CO -0.52 -0.02 0.29 0.00 -1.51 0.00 0.00 179.97 178.21 3im5 h ALA 77 N 1.18 1.04 -0.51 2.80 0.00 -1.75 -0.52 119.26 121.50 3im5 h ALA 77 Ca 0.11 -0.21 -0.12 0.00 0.00 0.00 0.00 54.91 54.69 3im5 h ALA 77 Cb 0.19 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3im5 h ALA 77 CO -0.24 0.67 -0.15 1.25 0.00 0.00 0.00 179.25 180.78 3im5 h LEU 78 N 1.14 1.02 -0.36 0.00 5.85 -0.76 -1.16 115.31 121.04 3im5 h LEU 78 Ca 0.26 -0.37 -0.19 0.00 0.84 0.00 0.00 57.88 58.42 3im5 h LEU 78 Cb 0.25 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 41.00 3im5 h LEU 78 CO -0.02 1.16 -0.65 1.56 -0.34 0.00 0.00 178.44 180.15 3im5 h GLN 79 N 0.87 0.64 -0.26 1.25 4.20 -0.81 -1.64 115.11 119.36 3im5 h GLN 79 Ca 0.13 -0.46 0.02 0.00 0.06 0.00 0.00 58.65 58.40 3im5 h GLN 79 Cb 0.73 0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.56 3im5 h GLN 79 CO 0.06 1.08 0.10 1.49 -0.67 0.00 0.00 178.83 180.88 3im5 h GLU 80 N 0.46 0.22 -0.49 1.46 4.81 -1.07 0.43 114.58 120.39 3im5 h GLU 80 Ca -0.02 -0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.23 3im5 h GLU 80 Cb 1.23 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.53 3im5 h GLU 80 CO 0.13 0.14 0.29 0.52 -0.73 0.00 0.00 179.01 179.36 3im5 h MET 81 N 0.22 0.55 -0.45 1.92 2.86 -1.04 -0.92 114.93 118.08 3im5 h MET 81 Ca 0.11 -0.03 -0.14 0.00 -2.06 0.00 0.00 59.70 57.58 3im5 h MET 81 Cb 0.07 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.59 3im5 h MET 81 CO -0.11 0.36 -0.27 -0.07 1.06 0.00 0.00 176.91 177.89 3im5 h LEU 82 N 0.57 0.99 -0.98 1.22 3.38 -1.17 -3.00 115.31 116.32 3im5 h LEU 82 Ca 0.20 -0.40 0.05 0.00 0.09 0.00 0.00 57.88 57.82 3im5 h LEU 82 Cb 0.04 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 40.45 3im5 h LEU 82 CO -0.10 1.19 0.63 0.00 0.09 0.00 0.00 178.44 180.25 3im5 h ALA 83 N 0.87 1.33 0.00 1.53 0.00 -0.65 -2.59 119.26 119.74 3im5 h ALA 83 Ca 0.09 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3im5 h ALA 83 Cb 0.85 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 3im5 h ALA 83 CO 0.07 0.47 -0.06 -0.91 0.00 0.00 0.00 179.25 178.83 3im5 h ASN 84 N 1.19 0.00 1.39 0.00 4.21 -1.03 -2.82 115.58 118.53 3im5 h ASN 84 Ca 0.41 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.92 3im5 h ASN 84 Cb 0.09 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.29 3im5 h ASN 84 CO -0.15 0.06 -0.23 0.71 -1.29 0.00 0.00 177.43 176.53 3im5 h THR 85 N 0.00 0.00 0.00 2.81 1.35 -1.40 -3.51 112.91 112.15 3im5 h THR 85 Ca -0.00 -0.63 0.00 0.00 -0.55 0.00 0.00 66.41 65.23 3im5 h THR 85 Cb 0.50 1.48 0.00 0.00 -1.73 0.00 0.00 68.15 68.40 3im5 h THR 85 CO 0.01 0.00 0.00 0.52 -0.25 0.00 0.00 175.52 175.80 3im5 n VAL 86 N -2.43 0.00 -1.26 6.82 0.31 -1.07 -5.14 118.33 115.56 3im5 n VAL 86 Ca 0.04 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 64.01 3im5 n VAL 86 Cb 0.46 -0.37 -0.02 0.00 -0.91 0.00 0.00 33.84 33.00 3im5 n VAL 86 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 3im5 n HIS 110 N -0.82 2.37 -2.01 3.52 8.25 -1.26 -5.08 115.22 120.19 3im5 n HIS 110 Ca 0.14 -2.66 -0.40 0.00 -0.26 0.00 0.00 57.72 54.54 3im5 n HIS 110 Cb 0.06 -2.23 -0.00 0.00 1.12 0.00 0.00 29.99 28.94 3im5 n HIS 110 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 3im5 s ARG 111 N 3.02 3.96 0.29 -0.41 1.70 -1.26 -4.46 118.95 121.79 3im5 s ARG 111 Ca 0.56 2.22 -0.29 0.00 -0.47 0.00 0.00 55.73 57.75 3im5 s ARG 111 Cb 0.15 -2.78 -0.09 0.00 -0.57 0.00 0.00 34.95 31.66 3im5 s ARG 111 CO -0.04 -0.52 1.06 0.99 -1.08 0.00 0.00 175.30 175.71 3im5 s THR 112 N -1.24 3.63 0.06 4.99 2.01 -1.26 -0.24 115.64 123.59 3im5 s THR 112 Ca 0.57 1.58 -0.30 0.00 0.31 0.00 0.00 61.69 63.85 3im5 s THR 112 Cb -0.39 -3.99 -0.05 0.00 0.01 0.00 0.00 72.50 68.08 3im5 s THR 112 CO 0.51 0.34 1.15 -0.76 -0.69 0.00 0.00 174.62 175.17 3im5 s LEU 113 N -1.56 4.38 0.02 4.42 1.02 0.30 -4.91 118.68 122.34 3im5 s LEU 113 Ca 0.46 1.96 0.04 0.00 0.02 0.00 0.00 54.13 56.60 3im5 s LEU 113 Cb -0.29 -3.58 -0.03 0.00 0.02 0.00 0.00 46.19 42.30 3im5 s LEU 113 CO 0.37 -0.41 -0.07 -0.76 0.02 0.00 0.00 176.35 175.50 3im5 s LEU 114 N 0.91 3.14 0.21 1.79 1.43 -1.26 -0.69 118.68 124.21 3im5 s LEU 114 Ca 0.57 -0.18 -0.31 0.00 -1.03 0.00 0.00 54.13 53.18 3im5 s LEU 114 Cb -0.28 -1.82 -0.10 0.00 0.03 0.00 0.00 46.19 44.03 3im5 s LEU 114 CO 0.30 0.27 1.47 -0.31 0.23 0.00 0.00 176.35 178.30 3im5 s TYR 115 N -1.02 3.06 0.00 0.29 2.02 0.06 -2.36 117.35 119.40 3im5 s TYR 115 Ca 0.18 0.91 0.00 0.00 -0.37 0.00 0.00 57.07 57.79 3im5 s TYR 115 Cb -0.11 -3.83 0.00 0.00 -0.40 0.00 0.00 41.96 37.62 3im5 s TYR 115 CO 0.08 -2.84 0.00 0.41 -1.57 0.00 0.00 175.55 171.64 3im5 n GLY 116 N 2.76 2.70 3.81 0.71 0.00 0.22 -0.14 105.19 115.26 3im5 n GLY 116 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 3im5 n GLY 116 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3im5 s HIS 117 N -2.75 3.14 -0.07 1.61 3.76 -0.99 -4.42 115.29 115.56 3im5 s HIS 117 Ca 0.00 1.55 -0.17 0.00 -0.15 0.00 0.00 55.06 56.28 3im5 s HIS 117 Cb 0.00 -2.96 -0.05 0.00 1.11 0.00 0.00 32.58 30.68 3im5 s HIS 117 CO 0.00 -0.67 0.47 0.00 -0.85 0.00 0.00 174.74 173.69 3im5 s ALA 118 N -2.26 3.54 0.23 -1.40 0.00 0.37 -1.77 121.76 120.47 3im5 s ALA 118 Ca 0.64 -0.18 0.11 0.00 0.00 0.00 0.00 51.96 52.53 3im5 s ALA 118 Cb -0.14 -2.58 -0.05 0.00 0.00 0.00 0.00 23.12 20.36 3im5 s ALA 118 CO 0.25 0.16 -0.21 0.96 0.00 0.00 0.00 175.76 176.92 3im5 s ILE 119 N 0.05 2.50 -0.15 0.00 -4.36 0.51 -0.40 121.20 119.35 3im5 s ILE 119 Ca 0.25 -2.14 0.02 0.00 -0.26 0.00 0.00 60.65 58.52 3im5 s ILE 119 Cb -0.16 -2.25 0.01 0.00 1.25 0.00 0.00 42.46 41.31 3im5 s ILE 119 CO 0.12 -0.23 -0.20 -0.22 0.24 0.00 0.00 174.94 174.65 3im5 s LEU 120 N -3.03 2.23 -0.35 0.37 2.96 -0.67 -1.51 118.68 118.67 3im5 s LEU 120 Ca 0.25 -0.57 -0.02 0.00 -0.22 0.00 0.00 54.13 53.56 3im5 s LEU 120 Cb -0.07 -1.49 0.08 0.00 0.50 0.00 0.00 46.19 45.21 3im5 s LEU 120 CO 0.12 0.07 0.10 -0.76 -1.32 0.00 0.00 176.35 174.56 3im5 s LEU 121 N 0.91 4.57 -0.32 -0.68 1.43 -1.26 -1.38 118.68 121.95 3im5 s LEU 121 Ca -0.04 -1.63 -0.23 0.00 -1.03 0.00 0.00 54.13 51.20 3im5 s LEU 121 Cb -0.15 -1.78 0.00 0.00 0.03 0.00 0.00 46.19 44.30 3im5 s LEU 121 CO -0.03 -0.40 0.78 -0.60 0.23 0.00 0.00 176.35 176.33 3im5 s ARG 122 N 1.20 3.92 -0.07 1.70 3.52 -0.38 -1.39 118.95 127.45 3im5 s ARG 122 Ca 0.02 0.51 -0.29 0.00 -0.13 0.00 0.00 55.73 55.84 3im5 s ARG 122 Cb -0.21 -3.74 -0.07 0.00 -1.56 0.00 0.00 34.95 29.36 3im5 s ARG 122 CO -0.02 -0.71 2.04 -1.58 -0.81 0.00 0.00 175.30 174.22 3im5 s HIS 123 N 2.97 1.28 0.09 5.12 5.65 0.16 -0.83 115.29 129.73 3im5 s HIS 123 Ca 0.32 -0.06 -0.19 0.00 0.25 0.00 0.00 55.06 55.38 3im5 s HIS 123 Cb -0.14 -4.12 -0.08 0.00 -1.18 0.00 0.00 32.58 27.06 3im5 s HIS 123 CO 0.13 -4.92 1.56 1.03 -0.65 0.00 0.00 174.74 171.90 3im5 h SER 124 N 12.18 0.38 0.00 9.88 0.87 -1.48 0.32 113.55 135.70 3im5 h SER 124 Ca -0.46 -0.26 -0.00 0.00 -1.23 0.00 0.00 61.79 59.85 3im5 h SER 124 Cb 1.23 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 63.09 3im5 h SER 124 CO 0.95 0.54 -0.00 1.88 -0.53 0.00 0.00 176.83 179.67 3im5 h TYR 125 N 0.21 -0.01 0.00 2.24 -1.99 -1.81 -3.30 116.97 112.31 3im5 h TYR 125 Ca 0.07 -0.00 -0.07 0.00 2.00 0.00 0.00 58.73 60.73 3im5 h TYR 125 Cb 0.32 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.04 3im5 h TYR 125 CO 0.02 0.30 -0.33 0.66 -0.00 0.00 0.00 178.16 178.81 3im5 h SER 126 N -0.31 0.00 0.00 3.88 4.64 -1.93 -3.47 113.55 116.35 3im5 h SER 126 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3im5 h SER 126 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 3im5 h SER 126 CO 0.00 0.33 0.00 0.61 -0.87 0.00 0.00 176.83 176.90 3im5 n GLY 127 N 0.80 2.54 1.09 -0.77 0.00 0.10 -4.99 105.19 103.96 3im5 n GLY 127 Ca 0.02 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.96 3im5 n GLY 127 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3im5 n MET 128 N -2.00 0.02 -4.59 1.61 2.81 -1.23 -4.75 117.12 108.99 3im5 n MET 128 Ca 0.00 -0.67 -0.22 0.00 -1.81 0.00 0.00 57.70 55.00 3im5 n MET 128 Cb 0.00 -0.29 -0.15 0.00 -0.71 0.00 0.00 33.22 32.07 3im5 n MET 128 CO 0.00 0.00 0.00 0.71 1.51 0.00 0.00 175.97 178.19 3im5 s TYR 129 N -1.27 1.19 0.12 2.03 2.02 -0.46 0.39 117.35 121.37 3im5 s TYR 129 Ca 0.20 -0.24 -0.31 0.00 -0.37 0.00 0.00 57.07 56.35 3im5 s TYR 129 Cb -0.01 -0.78 -0.10 0.00 -0.40 0.00 0.00 41.96 40.68 3im5 s TYR 129 CO 0.14 -0.04 1.67 -1.17 -1.57 0.00 0.00 175.55 174.58 3im5 s LEU 130 N -0.24 4.37 0.01 -1.29 2.96 -0.49 -0.76 118.68 123.25 3im5 s LEU 130 Ca 0.04 2.61 0.00 0.00 -0.22 0.00 0.00 54.13 56.56 3im5 s LEU 130 Cb -0.06 -3.58 -0.01 0.00 0.50 0.00 0.00 46.19 43.05 3im5 s LEU 130 CO -0.00 -0.90 -0.02 0.00 -1.32 0.00 0.00 176.35 174.11 3im5 s LEU 133 N 2.54 4.26 0.00 0.00 1.43 -0.18 -4.81 118.68 121.92 3im5 s LEU 133 Ca 0.35 0.34 0.29 0.00 -1.03 0.00 0.00 54.13 54.08 3im5 s LEU 133 Cb -0.16 -3.10 1.65 0.00 0.03 0.00 0.00 46.19 44.61 3im5 s LEU 133 CO 0.09 -0.00 2.07 -1.20 0.23 0.00 0.00 176.35 177.54 3im5 n SER 134 N -0.56 0.29 -4.81 2.29 7.64 -1.26 -4.04 113.62 113.17 3im5 n SER 134 Ca -0.05 -1.15 -0.36 0.00 1.01 0.00 0.00 58.87 58.32 3im5 n SER 134 Cb 0.54 -0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.66 3im5 n SER 134 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3im5 s THR 135 N -1.99 5.31 1.19 0.44 -4.23 -1.26 -4.98 115.64 110.12 3im5 s THR 135 Ca 0.44 0.14 -0.13 0.00 -1.18 0.00 0.00 61.69 60.96 3im5 s THR 135 Cb 0.21 -3.34 0.30 0.00 1.34 0.00 0.00 72.50 71.01 3im5 s THR 135 CO 0.34 0.57 1.02 -0.44 -0.54 0.00 0.00 174.62 175.57 3im5 s SER 136 N -0.60 0.75 0.00 3.99 0.01 -1.26 -0.45 113.70 116.14 3im5 s SER 136 Ca 0.12 1.47 0.00 0.00 1.31 0.00 0.00 55.95 58.86 3im5 s SER 136 Cb -0.12 -2.28 0.00 0.00 0.21 0.00 0.00 66.02 63.83 3im5 s SER 136 CO 0.02 -4.34 0.00 0.00 0.41 0.00 0.00 173.24 169.33 3im5 n LEU 143 N -5.01 0.00 -4.78 2.44 -0.00 -1.26 -4.80 117.00 103.59 3im5 n LEU 143 Ca 0.02 0.00 -0.37 0.00 -0.00 0.00 0.00 56.01 55.66 3im5 n LEU 143 Cb 0.54 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.90 3im5 n LEU 143 CO 0.58 0.00 0.64 0.00 -0.00 0.00 0.00 177.39 178.61 3im5 s ALA 144 N -0.69 3.22 0.31 1.47 0.00 -1.26 -4.91 121.76 119.90 3im5 s ALA 144 Ca 0.00 0.51 0.02 0.00 0.00 0.00 0.00 51.96 52.50 3im5 s ALA 144 Cb 0.00 -3.17 -0.03 0.00 0.00 0.00 0.00 23.12 19.92 3im5 s ALA 144 CO 0.00 0.18 0.48 -0.06 0.00 0.00 0.00 175.76 176.36 3im5 s PHE 145 N -1.60 3.46 0.50 0.00 0.08 -0.28 -4.93 117.98 115.20 3im5 s PHE 145 Ca 0.50 0.18 -0.18 0.00 0.12 0.00 0.00 56.93 57.54 3im5 s PHE 145 Cb -0.19 -1.79 -0.08 0.00 -0.57 0.00 0.00 43.02 40.39 3im5 s PHE 145 CO 0.24 0.22 0.99 -0.51 -0.10 0.00 0.00 175.22 176.07 3im5 s ASP 146 N -4.03 6.54 -0.08 1.36 1.01 0.41 -1.21 116.67 120.68 3im5 s ASP 146 Ca 0.38 1.70 0.03 0.00 0.71 0.00 0.00 52.55 55.37 3im5 s ASP 146 Cb -0.09 -2.53 -0.02 0.00 1.01 0.00 0.00 42.92 41.29 3im5 s ASP 146 CO 0.33 -0.64 -0.17 -0.69 0.21 0.00 0.00 175.17 174.21 3im5 s VAL 147 N -2.37 2.80 0.00 -1.27 1.01 -1.26 -1.02 120.40 118.29 3im5 s VAL 147 Ca 0.62 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.80 3im5 s VAL 147 Cb -0.12 -2.10 0.00 0.00 0.00 0.00 0.00 36.38 34.16 3im5 s VAL 147 CO 0.25 0.56 0.00 0.61 0.00 0.00 0.00 175.10 176.53 3im5 n GLY 148 N 2.85 2.39 3.80 4.51 0.00 -0.79 -1.47 105.19 116.47 3im5 n GLY 148 Ca -0.18 -0.83 -0.36 0.00 0.00 0.00 0.00 46.02 44.65 3im5 n GLY 148 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3im5 s LEU 149 N 0.00 4.08 0.02 0.99 1.43 0.06 -0.50 118.68 124.76 3im5 s LEU 149 Ca 0.00 0.33 0.03 0.00 -1.03 0.00 0.00 54.13 53.46 3im5 s LEU 149 Cb 0.00 -1.98 -0.01 0.00 0.03 0.00 0.00 46.19 44.23 3im5 s LEU 149 CO 0.00 0.38 -0.09 -1.58 0.23 0.00 0.00 176.35 175.30 3im5 s GLN 150 N -0.88 0.63 -0.07 1.70 2.00 0.06 -4.89 119.66 118.21 3im5 s GLN 150 Ca 0.14 -0.51 -0.15 0.00 -2.00 0.00 0.00 55.36 52.83 3im5 s GLN 150 Cb -0.12 -0.56 -0.11 0.00 0.80 0.00 0.00 33.01 33.02 3im5 s GLN 150 CO 0.03 0.14 0.60 0.93 -0.50 0.00 0.00 175.29 176.49 3im5 h GLU 151 N 5.31 -0.22 -6.86 1.67 5.08 -1.96 -1.23 114.58 116.37 3im5 h GLU 151 Ca -0.33 0.01 -0.47 0.00 -1.00 0.00 0.00 59.36 57.57 3im5 h GLU 151 Cb 1.19 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.47 3im5 h GLU 151 CO 0.46 0.11 0.25 -0.51 -1.00 0.00 0.00 179.01 178.32 3im5 s ASP 152 N -5.44 7.02 0.00 1.42 1.11 -1.26 -4.79 116.67 114.74 3im5 s ASP 152 Ca -0.09 1.59 0.08 0.00 0.18 0.00 0.00 52.55 54.31 3im5 s ASP 152 Cb 0.00 -2.49 -0.00 0.00 1.07 0.00 0.00 42.92 41.50 3im5 s ASP 152 CO 0.33 -0.19 0.56 0.35 1.18 0.00 0.00 175.17 177.40 3im5 n THR 153 N -0.05 0.00 -2.06 -1.27 -2.24 -1.26 -4.92 114.28 102.48 3im5 n THR 153 Ca 0.03 -0.42 -0.42 0.00 -2.27 0.00 0.00 64.05 60.97 3im5 n THR 153 Cb 0.52 1.09 -0.03 0.00 -2.10 0.00 0.00 70.33 69.82 3im5 n THR 153 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3im5 s THR 154 N -1.17 3.50 0.00 4.28 -4.23 -1.26 -4.71 115.64 112.05 3im5 s THR 154 Ca 0.07 0.78 0.00 0.00 -1.18 0.00 0.00 61.69 61.36 3im5 s THR 154 Cb 0.06 -3.51 0.00 0.00 1.34 0.00 0.00 72.50 70.40 3im5 s THR 154 CO 0.20 -0.03 0.00 0.61 -0.54 0.00 0.00 174.62 174.86 3im5 n GLY 155 N 3.94 1.33 0.02 3.99 0.00 -1.26 -4.91 105.19 108.30 3im5 n GLY 155 Ca 0.16 -2.25 0.11 0.00 0.00 0.00 0.00 46.02 44.04 3im5 n GLY 155 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3im5 n GLU 156 N -0.77 0.31 0.21 1.61 1.02 -1.26 -4.59 120.64 117.16 3im5 n GLU 156 Ca 0.00 -0.06 0.15 0.00 -0.02 0.00 0.00 57.16 57.23 3im5 n GLU 156 Cb 0.00 -1.54 0.79 0.00 -0.02 0.00 0.00 31.44 30.67 3im5 n GLU 156 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3im5 h ALA 157 N 2.53 1.87 -0.50 0.62 0.00 -1.91 -1.34 119.26 120.53 3im5 h ALA 157 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3im5 h ALA 157 Cb 0.74 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3im5 h ALA 157 CO 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 179.25 179.04 3im5 s TRP 159 N -1.34 3.06 -0.14 0.00 0.52 -0.51 -4.48 118.94 116.05 3im5 s TRP 159 Ca 0.39 0.01 -0.00 0.00 0.02 0.00 0.00 56.10 56.52 3im5 s TRP 159 Cb 0.21 -1.82 0.03 0.00 -1.15 0.00 0.00 33.47 30.75 3im5 s TRP 159 CO 0.29 0.28 -0.07 -1.58 0.02 0.00 0.00 176.95 175.89 3im5 s TRP 160 N -0.49 1.66 0.18 -1.98 0.52 -0.57 -1.56 118.94 116.69 3im5 s TRP 160 Ca 0.08 -0.96 -0.30 0.00 0.02 0.00 0.00 56.10 54.94 3im5 s TRP 160 Cb -0.12 -1.31 -0.08 0.00 -1.15 0.00 0.00 33.47 30.82 3im5 s TRP 160 CO 0.02 -0.58 1.04 0.95 0.02 0.00 0.00 176.95 178.40 3im5 s THR 161 N 1.65 4.02 -0.15 2.01 -4.23 0.23 -0.36 115.64 118.81 3im5 s THR 161 Ca 0.03 1.79 -0.14 0.00 -1.18 0.00 0.00 61.69 62.19 3im5 s THR 161 Cb -0.14 -4.14 -0.05 0.00 1.34 0.00 0.00 72.50 69.51 3im5 s THR 161 CO -0.08 0.33 0.30 0.27 -0.54 0.00 0.00 174.62 174.89 3im5 s ILE 162 N -0.40 5.29 0.13 2.99 -4.36 -0.73 -1.74 121.20 122.38 3im5 s ILE 162 Ca 0.47 0.56 0.10 0.00 -0.26 0.00 0.00 60.65 61.52 3im5 s ILE 162 Cb -0.28 -3.63 -0.04 0.00 1.25 0.00 0.00 42.46 39.76 3im5 s ILE 162 CO 0.34 0.41 -0.23 -1.00 0.24 0.00 0.00 174.94 174.69 3im5 s HIS 163 N 0.31 2.05 0.26 1.37 3.76 0.57 -0.61 115.29 123.01 3im5 s HIS 163 Ca 0.17 -0.40 -0.30 0.00 -0.15 0.00 0.00 55.06 54.38 3im5 s HIS 163 Cb -0.13 -1.10 -0.09 0.00 1.11 0.00 0.00 32.58 32.37 3im5 s HIS 163 CO 0.05 0.30 1.26 -1.25 -0.85 0.00 0.00 174.74 174.25 3im5 s PRO 164 N -2.13 4.43 0.11 8.40 0.04 -1.26 -1.22 135.00 143.36 3im5 s PRO 164 Ca 0.12 2.05 -0.17 0.00 0.04 0.00 0.00 61.00 63.04 3im5 s PRO 164 Cb -0.09 -3.16 -0.05 0.00 0.04 0.00 0.00 34.50 31.24 3im5 s PRO 164 CO 0.06 -0.14 1.59 0.00 0.04 0.00 0.00 177.00 178.55 3im5 h ALA 165 N 4.43 0.41 -5.97 8.56 0.00 -1.90 -3.45 119.26 121.33 3im5 h ALA 165 Ca -0.46 -0.18 -0.49 0.00 0.00 0.00 0.00 54.91 53.77 3im5 h ALA 165 Cb 1.22 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 3im5 h ALA 165 CO 0.71 0.08 -0.17 -1.13 0.00 0.00 0.00 179.25 178.74 3im5 n SER 166 N -4.64 2.34 -0.13 0.00 3.41 -1.26 -5.03 113.62 108.30 3im5 n SER 166 Ca -0.02 -2.60 0.13 0.00 -0.26 0.00 0.00 58.87 56.12 3im5 n SER 166 Cb 0.20 -0.18 0.50 0.00 -0.26 0.00 0.00 64.21 64.47 3im5 n SER 166 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 3im5 n LYS 167 N -1.87 0.58 -0.03 4.33 0.00 -1.26 -3.94 118.16 115.97 3im5 n LYS 167 Ca 0.05 -0.26 0.12 0.00 -0.00 0.00 0.00 58.31 58.22 3im5 n LYS 167 Cb 0.56 -1.49 0.14 0.00 -0.00 0.00 0.00 35.03 34.24 3im5 n LYS 167 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 3im5 n GLN 168 N -0.99 2.33 -3.65 -1.58 3.00 -1.26 -4.78 117.38 110.45 3im5 n GLN 168 Ca 0.12 -1.95 -0.36 0.00 -0.01 0.00 0.00 57.00 54.80 3im5 n GLN 168 Cb 0.31 -1.47 -0.06 0.00 0.00 0.00 0.00 30.24 29.02 3im5 n GLN 168 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.06 178.09 3im5 s ARG 169 N -1.91 3.71 0.14 -1.09 1.81 -1.25 -5.11 118.95 115.24 3im5 s ARG 169 Ca 0.30 0.12 0.08 0.00 -1.72 0.00 0.00 55.73 54.52 3im5 s ARG 169 Cb 0.21 -3.11 -0.04 0.00 -0.45 0.00 0.00 34.95 31.56 3im5 s ARG 169 CO 0.30 0.65 -0.19 0.45 -0.68 0.00 0.00 175.30 175.83 3im5 s SER 170 N -1.46 2.65 0.18 0.23 0.15 -1.26 -4.84 113.70 109.34 3im5 s SER 170 Ca 0.26 -0.80 -0.32 0.00 0.70 0.00 0.00 55.95 55.80 3im5 s SER 170 Cb -0.14 -0.15 -0.11 0.00 -1.71 0.00 0.00 66.02 63.91 3im5 s SER 170 CO 0.14 0.00 1.67 -1.83 1.20 0.00 0.00 173.24 174.43 3im5 s GLU 171 N -2.47 4.16 0.00 5.44 1.03 -1.26 -1.93 118.70 123.68 3im5 s GLU 171 Ca 0.12 2.50 0.00 0.00 0.03 0.00 0.00 54.97 57.63 3im5 s GLU 171 Cb -0.07 -3.17 0.00 0.00 -0.80 0.00 0.00 34.13 30.09 3im5 s GLU 171 CO 0.06 -0.70 0.00 0.41 -1.33 0.00 0.00 175.26 173.69 3im5 n GLY 172 N 3.92 2.15 3.77 -3.83 0.00 0.80 -4.95 105.19 107.05 3im5 n GLY 172 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 3im5 n GLY 172 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3im5 s GLU 173 N -0.82 3.26 0.29 1.61 2.02 -0.81 -4.59 118.70 119.66 3im5 s GLU 173 Ca 0.00 1.68 -0.30 0.00 0.02 0.00 0.00 54.97 56.37 3im5 s GLU 173 Cb 0.00 -2.00 -0.11 0.00 0.10 0.00 0.00 34.13 32.13 3im5 s GLU 173 CO 0.00 -0.94 1.47 0.15 0.02 0.00 0.00 175.26 175.96 3im5 s LYS 174 N -3.28 4.22 -0.36 1.61 1.02 -1.26 -0.76 119.74 120.94 3im5 s LYS 174 Ca 0.74 2.39 -0.24 0.00 0.02 0.00 0.00 55.97 58.88 3im5 s LYS 174 Cb -0.26 -3.07 0.01 0.00 -0.52 0.00 0.00 37.83 33.99 3im5 s LYS 174 CO 0.29 -0.46 0.81 0.08 -0.92 0.00 0.00 175.35 175.15 3im5 s VAL 175 N -0.28 4.72 0.39 3.17 1.01 0.14 -4.86 120.40 124.68 3im5 s VAL 175 Ca 0.58 0.99 -0.25 0.00 0.00 0.00 0.00 61.98 63.30 3im5 s VAL 175 Cb -0.44 -4.22 -0.09 0.00 0.00 0.00 0.00 36.38 31.63 3im5 s VAL 175 CO 0.48 -0.42 1.07 -0.13 0.00 0.00 0.00 175.10 176.10 3im5 s ARG 176 N 3.15 4.18 0.22 2.72 3.00 -1.26 -0.74 118.95 130.21 3im5 s ARG 176 Ca 0.33 1.59 -0.31 0.00 0.00 0.00 0.00 55.73 57.34 3im5 s ARG 176 Cb -0.13 -2.62 -0.11 0.00 0.00 0.00 0.00 34.95 32.08 3im5 s ARG 176 CO 0.16 -0.14 1.65 0.08 0.00 0.00 0.00 175.30 177.05 3im5 s VAL 177 N -1.57 2.19 0.00 3.52 1.01 -0.92 -2.22 120.40 122.41 3im5 s VAL 177 Ca 0.56 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.69 3im5 s VAL 177 Cb -0.24 -3.09 0.00 0.00 0.00 0.00 0.00 36.38 33.04 3im5 s VAL 177 CO 0.31 0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.03 3im5 n GLY 178 N 3.43 2.74 3.76 4.51 0.00 -1.26 -4.97 105.19 113.40 3im5 n GLY 178 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 3im5 n GLY 178 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3im5 s ASP 179 N -1.40 7.23 -0.27 1.61 1.11 -0.94 -5.03 116.67 118.98 3im5 s ASP 179 Ca 0.00 2.21 -0.20 0.00 0.18 0.00 0.00 52.55 54.74 3im5 s ASP 179 Cb 0.00 -2.62 -0.02 0.00 1.07 0.00 0.00 42.92 41.35 3im5 s ASP 179 CO 0.00 -0.16 0.61 -1.81 1.18 0.00 0.00 175.17 174.99 3im5 s ASP 180 N -1.00 6.54 0.10 0.27 1.01 -1.26 -4.25 116.67 118.06 3im5 s ASP 180 Ca 0.46 0.61 -0.03 0.00 0.71 0.00 0.00 52.55 54.30 3im5 s ASP 180 Cb -0.30 -2.33 -0.05 0.00 1.01 0.00 0.00 42.92 41.25 3im5 s ASP 180 CO 0.38 -0.39 0.31 -0.76 0.21 0.00 0.00 175.17 174.92 3im5 s LEU 181 N 2.50 4.31 -0.11 1.23 1.43 0.23 -3.26 118.68 125.02 3im5 s LEU 181 Ca 0.25 0.47 -0.01 0.00 -1.03 0.00 0.00 54.13 53.81 3im5 s LEU 181 Cb -0.15 -3.11 -0.03 0.00 0.03 0.00 0.00 46.19 42.92 3im5 s LEU 181 CO 0.09 0.12 -0.06 -0.63 0.23 0.00 0.00 176.35 176.10 3im5 s ILE 182 N -1.56 3.76 -0.12 -0.59 1.01 -0.36 0.09 121.20 123.42 3im5 s ILE 182 Ca 0.37 -0.43 0.02 0.00 0.00 0.00 0.00 60.65 60.61 3im5 s ILE 182 Cb -0.13 -2.59 -0.01 0.00 0.01 0.00 0.00 42.46 39.75 3im5 s ILE 182 CO 0.25 0.55 -0.18 -0.76 0.00 0.00 0.00 174.94 174.80 3im5 s LEU 183 N -0.21 2.41 -0.07 2.97 1.02 -1.26 -0.31 118.68 123.22 3im5 s LEU 183 Ca 0.03 -0.45 0.04 0.00 0.02 0.00 0.00 54.13 53.78 3im5 s LEU 183 Cb -0.13 -1.52 -0.00 0.00 0.02 0.00 0.00 46.19 44.56 3im5 s LEU 183 CO 0.03 0.15 -0.21 -0.69 0.02 0.00 0.00 176.35 175.64 3im5 s VAL 184 N 0.43 1.81 0.03 -1.59 1.01 -0.71 -0.75 120.40 120.62 3im5 s VAL 184 Ca -0.13 -0.90 -0.30 0.00 0.00 0.00 0.00 61.98 60.64 3im5 s VAL 184 Cb -0.17 -1.56 -0.06 0.00 0.00 0.00 0.00 36.38 34.58 3im5 s VAL 184 CO 0.06 0.51 1.46 -0.55 0.00 0.00 0.00 175.10 176.57 3im5 s SER 185 N 0.20 6.79 0.14 3.32 0.15 0.72 -0.60 113.70 124.43 3im5 s SER 185 Ca -0.12 2.22 -0.14 0.00 0.70 0.00 0.00 55.95 58.61 3im5 s SER 185 Cb -0.15 -2.56 0.02 0.00 -1.71 0.00 0.00 66.02 61.61 3im5 s SER 185 CO 0.06 -0.75 1.67 0.58 1.20 0.00 0.00 173.24 175.99 3im5 h VAL 186 N 4.81 1.22 -0.54 4.45 2.07 -1.48 -1.02 116.25 125.77 3im5 h VAL 186 Ca -0.39 -0.75 -0.09 0.00 0.82 0.00 0.00 66.70 66.29 3im5 h VAL 186 Cb 1.19 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 3im5 h VAL 186 CO 0.90 0.27 -0.02 0.77 0.02 0.00 0.00 177.57 179.52 3im5 h SER 187 N 0.61 0.90 -0.00 0.57 4.64 -1.81 -3.36 113.55 115.11 3im5 h SER 187 Ca 0.15 -0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.22 3im5 h SER 187 Cb 0.27 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 3im5 h SER 187 CO -0.00 0.97 -0.11 -1.54 -0.87 0.00 0.00 176.83 175.27 3im5 n SER 188 N -4.19 0.59 -1.19 4.97 3.41 -1.23 -5.01 113.62 110.97 3im5 n SER 188 Ca 0.03 -0.79 -0.16 0.00 -0.26 0.00 0.00 58.87 57.69 3im5 n SER 188 Cb 0.33 0.65 -0.07 0.00 -0.26 0.00 0.00 64.21 64.87 3im5 n SER 188 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 3im5 n GLU 189 N -0.62 -1.17 -4.08 4.33 -0.00 -0.39 -4.99 120.64 113.71 3im5 n GLU 189 Ca 0.01 1.04 -0.25 0.00 -0.00 0.00 0.00 57.16 57.96 3im5 n GLU 189 Cb 0.07 -5.24 -0.05 0.00 -0.00 0.00 0.00 31.44 26.22 3im5 n GLU 189 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 3im5 s ARG 190 N -3.29 2.94 0.25 3.44 0.52 -1.26 -4.82 118.95 116.74 3im5 s ARG 190 Ca 0.00 -0.88 -0.14 0.00 -0.52 0.00 0.00 55.73 54.19 3im5 s ARG 190 Cb 0.00 -2.65 -0.08 0.00 0.52 0.00 0.00 34.95 32.74 3im5 s ARG 190 CO 0.00 0.47 0.65 0.71 0.02 0.00 0.00 175.30 177.15 3im5 s TYR 191 N -1.82 3.46 -0.28 -0.53 2.02 0.11 -0.20 117.35 120.12 3im5 s TYR 191 Ca 0.31 1.11 -0.28 0.00 -0.37 0.00 0.00 57.07 57.84 3im5 s TYR 191 Cb -0.10 -2.44 -0.03 0.00 -0.40 0.00 0.00 41.96 39.00 3im5 s TYR 191 CO 0.24 0.24 1.84 -1.17 -1.57 0.00 0.00 175.55 175.12 3im5 s LEU 192 N -2.63 3.58 -0.01 -1.29 2.96 0.07 -1.14 118.68 120.23 3im5 s LEU 192 Ca 0.48 1.49 0.06 0.00 -0.22 0.00 0.00 54.13 55.94 3im5 s LEU 192 Cb -0.12 -3.52 -0.02 0.00 0.50 0.00 0.00 46.19 43.03 3im5 s LEU 192 CO 0.19 -1.65 -0.20 -2.28 -1.32 0.00 0.00 176.35 171.10 3im5 s HIS 193 N 6.74 1.76 -0.09 5.38 5.65 0.29 -3.73 115.29 131.30 3im5 s HIS 193 Ca 0.82 -0.34 -0.22 0.00 0.25 0.00 0.00 55.06 55.57 3im5 s HIS 193 Cb -0.25 -1.12 -0.04 0.00 -1.18 0.00 0.00 32.58 29.99 3im5 s HIS 193 CO 0.34 -0.02 0.64 -1.17 -0.65 0.00 0.00 174.74 173.88 3im5 s LEU 194 N -0.53 4.30 -0.05 8.88 2.96 -1.26 -1.81 118.68 131.16 3im5 s LEU 194 Ca 0.07 1.08 0.04 0.00 -0.22 0.00 0.00 54.13 55.10 3im5 s LEU 194 Cb -0.08 -2.98 0.00 0.00 0.50 0.00 0.00 46.19 43.63 3im5 s LEU 194 CO -0.00 -0.10 -0.16 -0.55 -1.32 0.00 0.00 176.35 174.22 3im5 s SER 195 N 0.78 2.04 -0.59 3.68 0.15 0.08 -4.99 113.70 114.86 3im5 s SER 195 Ca 0.34 -0.34 -0.20 0.00 0.70 0.00 0.00 55.95 56.46 3im5 s SER 195 Cb -0.17 -0.65 0.09 0.00 -1.71 0.00 0.00 66.02 63.57 3im5 s SER 195 CO 0.16 0.12 0.75 -0.47 1.20 0.00 0.00 173.24 175.00 3im5 s TYR 196 N 0.19 2.94 0.00 3.44 5.04 -1.26 -0.19 117.35 127.51 3im5 s TYR 196 Ca -0.07 -0.77 0.00 0.00 -2.44 0.00 0.00 57.07 53.79 3im5 s TYR 196 Cb -0.12 -3.98 0.00 0.00 0.35 0.00 0.00 41.96 38.21 3im5 s TYR 196 CO 0.03 -1.32 0.00 0.41 -1.34 0.00 0.00 175.55 173.33 3im5 n GLY 197 N 5.27 1.04 0.00 8.97 0.00 -0.41 -4.95 105.19 115.10 3im5 n GLY 197 Ca -0.08 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 44.11 3im5 n GLY 197 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3im5 n ASN 198 N 0.00 0.00 -0.92 1.61 5.03 -1.26 -2.93 115.26 116.78 3im5 n ASN 198 Ca 0.00 0.64 0.03 0.00 0.87 0.00 0.00 54.58 56.13 3im5 n ASN 198 Cb 0.00 -0.31 0.05 0.00 -1.02 0.00 0.00 39.78 38.50 3im5 n ASN 198 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.26 175.19 3im5 n SER 199 N -2.56 0.88 -3.84 6.41 2.88 -1.26 -5.11 113.62 111.01 3im5 n SER 199 Ca 0.00 -2.33 -0.24 0.00 -1.33 0.00 0.00 58.87 54.96 3im5 n SER 199 Cb 0.00 -0.31 -0.08 0.00 -0.75 0.00 0.00 64.21 63.08 3im5 n SER 199 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 3im5 s SER 200 N -1.90 2.57 -0.09 -3.46 1.04 -1.15 -5.16 113.70 105.55 3im5 s SER 200 Ca 0.23 -1.74 -0.02 0.00 0.48 0.00 0.00 55.95 54.90 3im5 s SER 200 Cb 0.25 0.59 -0.03 0.00 0.10 0.00 0.00 66.02 66.92 3im5 s SER 200 CO -0.08 -1.01 -0.00 0.26 0.98 0.00 0.00 173.24 173.39 3im5 s TRP 201 N -3.25 3.15 0.26 5.02 0.52 -1.26 -1.29 118.94 122.10 3im5 s TRP 201 Ca 0.27 0.18 0.01 0.00 0.02 0.00 0.00 56.10 56.59 3im5 s TRP 201 Cb 0.02 -1.79 -0.05 0.00 -1.15 0.00 0.00 33.47 30.50 3im5 s TRP 201 CO 0.19 0.46 0.10 -1.01 0.02 0.00 0.00 176.95 176.71 3im5 s HIS 202 N -0.87 1.52 -0.06 -1.98 3.76 0.74 -4.60 115.29 113.80 3im5 s HIS 202 Ca 0.13 -1.21 0.02 0.00 -0.15 0.00 0.00 55.06 53.86 3im5 s HIS 202 Cb -0.11 -0.88 0.01 0.00 1.11 0.00 0.00 32.58 32.71 3im5 s HIS 202 CO 0.02 -0.37 -0.13 0.54 -0.85 0.00 0.00 174.74 173.95 3im5 s VAL 203 N -3.77 1.17 0.22 -0.90 0.11 -1.26 -0.74 120.40 115.24 3im5 s VAL 203 Ca 0.38 -0.51 0.02 0.00 -2.93 0.00 0.00 61.98 58.94 3im5 s VAL 203 Cb 0.08 -1.06 -0.01 0.00 -1.53 0.00 0.00 36.38 33.85 3im5 s VAL 203 CO 0.14 0.36 0.24 -0.90 -3.33 0.00 0.00 175.10 171.61 3im5 n ASP 204 N 3.74 -0.65 -4.23 3.54 5.68 -0.75 -4.42 116.55 119.46 3im5 n ASP 204 Ca -0.22 -2.36 -0.37 0.00 -0.50 0.00 0.00 54.79 51.34 3im5 n ASP 204 Cb 0.52 1.34 -0.13 0.00 -1.14 0.00 0.00 41.12 41.72 3im5 n ASP 204 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3im5 s ALA 205 N -2.67 2.98 0.31 2.12 0.00 -0.35 -0.54 121.76 123.61 3im5 s ALA 205 Ca 0.23 -1.82 0.05 0.00 0.00 0.00 0.00 51.96 50.43 3im5 s ALA 205 Cb 0.00 -2.18 -0.02 0.00 0.00 0.00 0.00 23.12 20.92 3im5 s ALA 205 CO 0.17 -1.36 0.20 0.00 0.00 0.00 0.00 175.76 174.77 3im5 n ALA 206 N 4.74 0.57 1.35 0.00 0.00 -0.29 -1.13 120.51 125.76 3im5 n ALA 206 Ca -0.12 -1.74 0.14 0.00 0.00 0.00 0.00 53.44 51.72 3im5 n ALA 206 Cb 0.44 1.31 0.47 0.00 0.00 0.00 0.00 19.45 21.67 3im5 n ALA 206 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3im5 n PHE 207 N -0.65 0.00 -4.42 0.00 3.72 -1.26 0.10 117.46 114.94 3im5 n PHE 207 Ca 0.02 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.12 3im5 n PHE 207 Cb 0.53 -0.11 -0.11 0.00 -0.94 0.00 0.00 39.48 38.85 3im5 n PHE 207 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 3im5 s GLN 208 N -2.38 2.02 0.65 -1.08 -0.21 -1.26 -4.87 119.66 112.54 3im5 s GLN 208 Ca 0.29 -1.04 -0.15 0.00 0.02 0.00 0.00 55.36 54.48 3im5 s GLN 208 Cb 0.20 -2.21 -0.00 0.00 1.00 0.00 0.00 33.01 31.99 3im5 s GLN 208 CO 0.47 0.52 1.11 -0.65 -2.12 0.00 0.00 175.29 174.62 3im5 s GLN 209 N -1.85 2.83 -0.02 2.91 -0.21 -1.26 -4.64 119.66 117.42 3im5 s GLN 209 Ca 0.17 1.41 0.01 0.00 0.02 0.00 0.00 55.36 56.97 3im5 s GLN 209 Cb -0.11 -1.95 0.02 0.00 1.00 0.00 0.00 33.01 31.97 3im5 s GLN 209 CO 0.09 -1.23 -0.01 0.99 -2.12 0.00 0.00 175.29 173.01 3im5 s THR 210 N -2.29 0.20 -0.08 -0.19 2.01 -1.24 -4.77 115.64 109.28 3im5 s THR 210 Ca 0.68 0.01 -0.30 0.00 0.31 0.00 0.00 61.69 62.39 3im5 s THR 210 Cb -0.21 -0.26 -0.03 0.00 0.01 0.00 0.00 72.50 72.01 3im5 s THR 210 CO 0.40 0.12 1.21 -0.76 -0.69 0.00 0.00 174.62 174.90 3im5 s LEU 211 N 0.68 4.26 -0.07 4.42 1.43 -1.26 -4.53 118.68 123.60 3im5 s LEU 211 Ca -0.07 1.78 0.01 0.00 -1.03 0.00 0.00 54.13 54.82 3im5 s LEU 211 Cb -0.10 -3.55 -0.03 0.00 0.03 0.00 0.00 46.19 42.54 3im5 s LEU 211 CO -0.01 -0.62 -0.08 0.26 0.23 0.00 0.00 176.35 176.13 3im5 s TRP 212 N 2.47 2.90 -0.34 0.29 0.52 0.11 -4.58 118.94 120.31 3im5 s TRP 212 Ca 0.55 -0.05 -0.08 0.00 0.02 0.00 0.00 56.10 56.55 3im5 s TRP 212 Cb -0.24 -1.72 0.03 0.00 -1.15 0.00 0.00 33.47 30.40 3im5 s TRP 212 CO 0.20 0.27 0.13 0.45 0.02 0.00 0.00 176.95 178.01 3im5 s SER 213 N -0.67 5.40 -0.46 2.95 0.15 0.21 0.77 113.70 122.05 3im5 s SER 213 Ca 0.10 -1.08 -0.14 0.00 0.70 0.00 0.00 55.95 55.53 3im5 s SER 213 Cb -0.11 -1.91 0.07 0.00 -1.71 0.00 0.00 66.02 62.36 3im5 s SER 213 CO 0.02 -0.33 0.36 -0.69 1.20 0.00 0.00 173.24 173.80 3im5 s VAL 214 N 1.44 5.08 0.00 4.45 1.01 -1.26 -0.81 120.40 130.32 3im5 s VAL 214 Ca -0.01 -1.06 0.06 0.00 0.00 0.00 0.00 61.98 60.98 3im5 s VAL 214 Cb -0.19 -4.01 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 3im5 s VAL 214 CO 0.04 -0.53 -0.17 0.00 0.00 0.00 0.00 175.10 174.43 3im5 s ALA 215 N 1.61 2.57 0.13 5.51 0.00 -0.74 -4.55 121.76 126.30 3im5 s ALA 215 Ca 0.04 -1.10 -0.31 0.00 0.00 0.00 0.00 51.96 50.58 3im5 s ALA 215 Cb -0.23 -0.80 -0.09 0.00 0.00 0.00 0.00 23.12 21.99 3im5 s ALA 215 CO 0.06 0.56 1.48 -2.14 0.00 0.00 0.00 175.76 175.73 3im5 s PRO 216 N -1.08 4.27 0.00 0.00 0.02 -1.26 -0.46 135.00 136.49 3im5 s PRO 216 Ca 0.13 2.21 0.00 0.00 0.02 0.00 0.00 61.00 63.36 3im5 s PRO 216 Cb -0.10 -3.23 0.00 0.00 0.02 0.00 0.00 34.50 31.19 3im5 s PRO 216 CO 0.03 -0.53 0.00 -0.89 -0.33 0.00 0.00 177.00 175.28