#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ava n ASP 2 N 0.00 1.90 -4.76 0.00 9.92 -1.26 -4.96 116.55 117.39 1ava n ASP 2 Ca 0.00 0.33 -0.41 0.00 -0.53 0.00 0.00 54.79 54.18 1ava n ASP 2 Cb 0.00 -0.79 -0.02 0.00 -0.64 0.00 0.00 41.12 39.67 1ava n ASP 2 CO 0.00 0.00 0.00 -2.84 0.13 0.00 0.00 177.20 174.49 1ava s PRO 3 N -2.51 4.25 0.92 -0.24 0.02 -1.26 -4.96 135.00 131.22 1ava s PRO 3 Ca -0.37 2.36 -0.10 0.00 0.02 0.00 0.00 61.00 62.90 1ava s PRO 3 Cb 0.14 -3.06 0.15 0.00 0.02 0.00 0.00 34.50 31.75 1ava s PRO 3 CO 0.47 -0.40 1.14 -2.30 -0.33 0.00 0.00 177.00 175.59 1ava n PRO 4 N 1.56 -0.47 -1.77 5.54 -0.02 -1.26 -4.57 135.00 134.01 1ava n PRO 4 Ca 0.04 -0.07 -0.30 0.00 -2.02 0.00 0.00 63.50 61.15 1ava n PRO 4 Cb 0.40 -2.37 0.06 0.00 -0.02 0.00 0.00 33.50 31.57 1ava n PRO 4 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1ava s PRO 5 N -4.63 2.65 -0.02 0.52 0.02 -1.26 -1.06 135.00 131.22 1ava s PRO 5 Ca 0.67 0.54 -0.16 0.00 0.02 0.00 0.00 61.00 62.07 1ava s PRO 5 Cb -0.23 -1.99 -0.05 0.00 0.02 0.00 0.00 34.50 32.24 1ava s PRO 5 CO 0.58 -1.20 0.43 0.08 -0.33 0.00 0.00 177.00 176.56 1ava s VAL 6 N -3.28 5.05 0.06 3.83 1.01 -0.37 -4.63 120.40 122.07 1ava s VAL 6 Ca 0.59 0.88 0.05 0.00 0.00 0.00 0.00 61.98 63.49 1ava s VAL 6 Cb -0.12 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 1ava s VAL 6 CO 0.53 0.52 -0.04 -1.00 0.00 0.00 0.00 175.10 175.11 1ava s HIS 7 N -0.69 2.91 0.54 5.22 3.76 -1.26 -0.39 115.29 125.38 1ava s HIS 7 Ca 0.24 -0.05 -0.04 0.00 -0.15 0.00 0.00 55.06 55.06 1ava s HIS 7 Cb -0.16 -1.55 0.12 0.00 1.11 0.00 0.00 32.58 32.09 1ava s HIS 7 CO 0.13 0.43 0.74 -0.40 -0.85 0.00 0.00 174.74 174.80 1ava n ASP 8 N 0.97 0.58 0.30 1.40 5.68 0.72 -4.55 116.55 121.64 1ava n ASP 8 Ca -0.13 -1.59 0.18 0.00 -0.50 0.00 0.00 54.79 52.75 1ava n ASP 8 Cb 0.52 -0.52 0.96 0.00 -1.14 0.00 0.00 41.12 40.94 1ava n ASP 8 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 1ava h THR 9 N -0.90 0.26 -0.49 2.12 1.35 -0.32 -1.13 112.91 113.80 1ava h THR 9 Ca -0.24 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.40 1ava h THR 9 Cb 0.80 1.16 0.00 0.00 -1.73 0.00 0.00 68.15 68.38 1ava h THR 9 CO 0.22 0.03 0.00 0.47 -0.25 0.00 0.00 175.52 175.99 1ava n ASP 10 N -3.39 3.02 0.00 5.36 8.00 -1.26 -4.93 116.55 123.36 1ava n ASP 10 Ca -0.02 -2.12 0.00 0.00 0.71 0.00 0.00 54.79 53.35 1ava n ASP 10 Cb 0.15 -0.40 0.00 0.00 -0.02 0.00 0.00 41.12 40.85 1ava n ASP 10 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ava n GLY 11 N 1.14 1.72 3.87 0.44 0.00 -0.43 -5.01 105.19 106.93 1ava n GLY 11 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 1ava n GLY 11 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ava s HIS 12 N -3.30 3.55 0.53 1.61 3.76 -1.26 -4.71 115.29 115.46 1ava s HIS 12 Ca 0.00 1.20 -0.17 0.00 -0.15 0.00 0.00 55.06 55.94 1ava s HIS 12 Cb 0.00 -2.61 -0.07 0.00 1.11 0.00 0.00 32.58 31.01 1ava s HIS 12 CO 0.00 -0.43 1.02 -1.21 -0.85 0.00 0.00 174.74 173.27 1ava s GLU 13 N -4.60 3.69 0.16 1.40 8.01 -1.26 -0.20 118.70 125.89 1ava s GLU 13 Ca 0.54 1.16 -0.30 0.00 0.01 0.00 0.00 54.97 56.38 1ava s GLU 13 Cb -0.10 -2.09 -0.08 0.00 -4.31 0.00 0.00 34.13 27.55 1ava s GLU 13 CO 0.43 -0.50 1.22 -0.51 0.01 0.00 0.00 175.26 175.91 1ava s LEU 14 N -4.03 4.42 0.01 1.80 1.02 0.47 -4.76 118.68 117.61 1ava s LEU 14 Ca 0.63 2.21 0.02 0.00 0.02 0.00 0.00 54.13 57.01 1ava s LEU 14 Cb -0.14 -3.60 -0.04 0.00 0.02 0.00 0.00 46.19 42.44 1ava s LEU 14 CO 0.29 -0.43 -0.00 -0.13 0.02 0.00 0.00 176.35 176.10 1ava s ARG 15 N 0.13 2.75 0.00 1.70 1.81 -1.26 -0.57 118.95 123.51 1ava s ARG 15 Ca 0.55 -0.64 0.22 0.00 -1.72 0.00 0.00 55.73 54.14 1ava s ARG 15 Cb -0.33 -2.65 1.29 0.00 -0.45 0.00 0.00 34.95 32.81 1ava s ARG 15 CO 0.35 0.62 1.77 0.00 -0.68 0.00 0.00 175.30 177.36 1ava n ALA 16 N 1.32 2.54 -1.46 2.13 0.00 0.20 -2.91 120.51 122.34 1ava n ALA 16 Ca -0.14 -0.13 0.07 0.00 0.00 0.00 0.00 53.44 53.24 1ava n ALA 16 Cb 0.53 -1.35 0.15 0.00 0.00 0.00 0.00 19.45 18.77 1ava n ALA 16 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1ava n ASP 17 N -0.87 1.81 -4.23 0.00 5.68 -1.26 -4.83 116.55 112.85 1ava n ASP 17 Ca 0.16 -3.26 -0.15 0.00 -0.50 0.00 0.00 54.79 51.05 1ava n ASP 17 Cb 0.07 -0.44 -0.10 0.00 -1.14 0.00 0.00 41.12 39.51 1ava n ASP 17 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1ava s ALA 18 N -2.59 1.39 -0.07 2.12 0.00 -1.14 -5.09 121.76 116.37 1ava s ALA 18 Ca 0.32 -1.40 -0.02 0.00 0.00 0.00 0.00 51.96 50.86 1ava s ALA 18 Cb 0.30 0.03 -0.04 0.00 0.00 0.00 0.00 23.12 23.41 1ava s ALA 18 CO -0.03 -0.06 0.04 -0.80 0.00 0.00 0.00 175.76 174.92 1ava s ASN 19 N -2.92 5.50 0.05 0.00 0.01 -1.26 -4.51 114.94 111.82 1ava s ASN 19 Ca 0.13 0.18 0.02 0.00 -0.71 0.00 0.00 52.86 52.49 1ava s ASN 19 Cb 0.00 -1.59 -0.03 0.00 0.41 0.00 0.00 41.25 40.05 1ava s ASN 19 CO 0.01 0.35 -0.08 -0.31 -1.51 0.00 0.00 177.10 175.56 1ava s TYR 20 N -0.99 0.72 -0.09 2.20 1.51 -0.59 -0.50 117.35 119.61 1ava s TYR 20 Ca 0.16 -0.56 -0.12 0.00 -1.01 0.00 0.00 57.07 55.53 1ava s TYR 20 Cb -0.12 -0.43 -0.05 0.00 -0.11 0.00 0.00 41.96 41.26 1ava s TYR 20 CO 0.06 -0.09 0.30 0.71 -1.11 0.00 0.00 175.55 175.42 1ava s TYR 21 N -1.72 3.60 -0.53 2.71 2.02 0.54 -0.03 117.35 123.93 1ava s TYR 21 Ca -0.06 0.74 -0.11 0.00 -0.37 0.00 0.00 57.07 57.26 1ava s TYR 21 Cb -0.08 -2.22 0.13 0.00 -0.40 0.00 0.00 41.96 39.40 1ava s TYR 21 CO -0.00 0.52 0.43 0.54 -1.57 0.00 0.00 175.55 175.46 1ava s VAL 22 N -0.51 4.55 0.42 0.71 0.11 -1.26 -1.45 120.40 122.97 1ava s VAL 22 Ca 0.19 -1.85 0.05 0.00 -2.93 0.00 0.00 61.98 57.44 1ava s VAL 22 Cb -0.14 -3.95 0.01 0.00 -1.53 0.00 0.00 36.38 30.76 1ava s VAL 22 CO 0.08 -0.83 0.59 -0.76 -3.33 0.00 0.00 175.10 170.85 1ava s LEU 23 N 1.23 3.68 0.25 2.54 2.01 -0.49 -2.66 118.68 125.24 1ava s LEU 23 Ca 0.07 -0.18 -0.30 0.00 0.01 0.00 0.00 54.13 53.73 1ava s LEU 23 Cb -0.25 -2.79 -0.09 0.00 0.01 0.00 0.00 46.19 43.06 1ava s LEU 23 CO -0.01 -0.73 0.96 -0.44 1.01 0.00 0.00 176.35 177.14 1ava s SER 24 N -4.30 7.58 0.41 2.29 0.01 -1.26 -1.00 113.70 117.43 1ava s SER 24 Ca 0.52 1.98 0.12 0.00 1.31 0.00 0.00 55.95 59.87 1ava s SER 24 Cb -0.10 -2.61 0.87 0.00 0.21 0.00 0.00 66.02 64.39 1ava s SER 24 CO 0.34 0.11 1.94 0.00 0.41 0.00 0.00 173.24 176.04 1ava h ALA 25 N 4.04 1.58 -3.19 1.44 0.00 -1.34 -3.37 119.26 118.41 1ava h ALA 25 Ca -0.45 -0.20 -0.67 0.00 0.00 0.00 0.00 54.91 53.59 1ava h ALA 25 Cb 1.20 -0.06 -0.34 0.00 0.00 0.00 0.00 17.79 18.59 1ava h ALA 25 CO 0.68 0.31 -0.82 1.21 0.00 0.00 0.00 179.25 180.62 1ava s ASN 26 N -6.94 3.59 0.32 0.00 3.84 -1.26 -4.99 114.94 109.50 1ava s ASN 26 Ca -0.05 -0.75 0.23 0.00 0.21 0.00 0.00 52.86 52.50 1ava s ASN 26 Cb 0.15 -1.54 1.18 0.00 -0.55 0.00 0.00 41.25 40.49 1ava s ASN 26 CO 0.72 -0.04 1.69 -1.14 -2.79 0.00 0.00 177.10 175.54 1ava n ARG 27 N 4.62 0.16 0.24 0.43 0.63 -1.26 -1.42 116.66 120.07 1ava n ARG 27 Ca -0.19 0.60 0.17 0.00 -0.92 0.00 0.00 57.85 57.51 1ava n ARG 27 Cb 0.49 -1.96 0.74 0.00 0.45 0.00 0.00 32.46 32.17 1ava n ARG 27 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1ava h ALA 28 N 2.05 1.00 -0.06 5.13 0.00 -1.94 -1.99 119.26 123.44 1ava h ALA 28 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ava h ALA 28 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1ava h ALA 28 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 179.25 179.97 1ava n HIS 29 N -2.80 0.07 0.00 0.00 8.25 -0.50 -5.05 115.22 115.19 1ava n HIS 29 Ca 0.00 -0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 1ava n HIS 29 Cb 0.21 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.32 1ava n HIS 29 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ava n GLY 30 N 1.18 -1.21 0.00 -1.41 0.00 -0.75 -4.98 105.19 98.02 1ava n GLY 30 Ca 0.18 -2.21 0.00 0.00 0.00 0.00 0.00 46.02 43.99 1ava n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ava n GLY 31 N -0.29 0.48 3.77 -0.02 0.00 0.18 -4.28 105.19 105.03 1ava n GLY 31 Ca 0.00 -1.80 -0.30 0.00 0.00 0.00 0.00 46.02 43.92 1ava n GLY 31 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ava s GLY 32 N -0.93 1.68 0.49 -0.02 0.00 0.49 -4.24 107.32 104.80 1ava s GLY 32 Ca 0.00 -1.07 -0.13 0.00 0.00 0.00 0.00 44.72 43.52 1ava s GLY 32 CO 0.00 -0.25 0.91 1.08 0.00 0.00 0.00 173.10 174.84 1ava s LEU 33 N -6.37 3.64 0.00 0.66 1.02 -1.09 -1.02 118.68 115.52 1ava s LEU 33 Ca 0.72 1.37 0.00 0.00 0.02 0.00 0.00 54.13 56.25 1ava s LEU 33 Cb -0.07 -4.31 0.00 0.00 0.02 0.00 0.00 46.19 41.83 1ava s LEU 33 CO 0.54 -0.56 0.00 1.07 0.02 0.00 0.00 176.35 177.42 1ava n THR 34 N -1.68 0.00 -4.88 5.49 5.66 0.37 -0.68 114.28 118.56 1ava n THR 34 Ca 0.05 0.00 -0.27 0.00 -3.05 0.00 0.00 64.05 60.77 1ava n THR 34 Cb 0.54 0.00 -0.15 0.00 -1.55 0.00 0.00 70.33 69.17 1ava n THR 34 CO 0.00 0.00 0.00 -0.04 -3.05 0.00 0.00 175.07 171.98 1ava s MET 35 N -1.48 1.63 -0.08 1.09 -1.94 -1.26 -0.23 119.30 117.02 1ava s MET 35 Ca 0.00 -0.90 -0.23 0.00 -1.71 0.00 0.00 55.69 52.85 1ava s MET 35 Cb 0.00 -1.68 0.05 0.00 2.01 0.00 0.00 34.83 35.21 1ava s MET 35 CO 0.00 0.44 0.53 0.00 -0.01 0.00 0.00 175.02 175.98 1ava s ALA 36 N -0.67 -1.35 0.88 3.03 0.00 -0.65 -4.84 121.76 118.15 1ava s ALA 36 Ca 0.09 1.08 -0.13 0.00 0.00 0.00 0.00 51.96 52.99 1ava s ALA 36 Cb -0.09 -0.22 0.12 0.00 0.00 0.00 0.00 23.12 22.93 1ava s ALA 36 CO 0.01 -0.31 1.20 -1.25 0.00 0.00 0.00 175.76 175.41 1ava s PRO 37 N -0.83 1.41 0.00 0.00 0.04 -1.26 -0.24 135.00 134.11 1ava s PRO 37 Ca -0.09 0.03 0.00 0.00 0.04 0.00 0.00 61.00 60.98 1ava s PRO 37 Cb -0.03 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.62 1ava s PRO 37 CO 0.06 -1.96 0.00 0.41 0.04 0.00 0.00 177.00 175.54 1ava n GLY 38 N -3.11 0.98 2.28 0.56 0.00 -1.09 -4.82 105.19 100.00 1ava n GLY 38 Ca 0.09 -1.07 -0.15 0.00 0.00 0.00 0.00 46.02 44.89 1ava n GLY 38 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ava n HIS 39 N -0.71 -0.76 0.00 1.61 8.25 -0.33 -1.14 115.22 122.13 1ava n HIS 39 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1ava n HIS 39 Cb 0.00 -2.96 0.00 0.00 1.12 0.00 0.00 29.99 28.15 1ava n HIS 39 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ava n GLY 40 N -0.56 2.66 3.78 -1.41 0.00 -1.26 -5.02 105.19 103.38 1ava n GLY 40 Ca -0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.46 1ava n GLY 40 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ava s ARG 41 N -0.73 4.52 -0.17 1.61 0.52 -0.29 -4.96 118.95 119.46 1ava s ARG 41 Ca 0.00 1.10 -0.11 0.00 -0.52 0.00 0.00 55.73 56.21 1ava s ARG 41 Cb 0.00 -3.27 -0.23 0.00 0.52 0.00 0.00 34.95 31.98 1ava s ARG 41 CO 0.00 0.56 0.23 0.72 0.02 0.00 0.00 175.30 176.83 1ava n HIS 42 N 1.69 1.02 -3.85 -0.53 8.25 -1.26 -2.69 115.22 117.85 1ava n HIS 42 Ca -0.06 0.28 -0.12 0.00 -0.26 0.00 0.00 57.72 57.56 1ava n HIS 42 Cb 0.49 -1.12 -0.10 0.00 1.12 0.00 0.00 29.99 30.37 1ava n HIS 42 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ava s PRO 44 N -1.13 3.01 0.32 0.00 0.04 -1.26 -5.13 135.00 130.85 1ava s PRO 44 Ca -0.12 1.00 -0.26 0.00 0.04 0.00 0.00 61.00 61.65 1ava s PRO 44 Cb -0.06 -2.00 -0.10 0.00 0.04 0.00 0.00 34.50 32.38 1ava s PRO 44 CO 0.02 -1.04 0.96 -0.51 0.04 0.00 0.00 177.00 176.46 1ava s LEU 45 N -5.36 4.34 0.59 -3.56 1.02 -1.26 -4.86 118.68 109.59 1ava s LEU 45 Ca 0.59 1.88 -0.06 0.00 0.02 0.00 0.00 54.13 56.55 1ava s LEU 45 Cb -0.14 -4.00 0.00 0.00 0.02 0.00 0.00 46.19 42.07 1ava s LEU 45 CO 0.52 -0.10 0.90 -0.36 0.02 0.00 0.00 176.35 177.33 1ava s PHE 46 N -1.58 3.31 -0.27 0.29 0.40 0.66 -1.53 117.98 119.26 1ava s PHE 46 Ca 0.50 0.72 -0.21 0.00 -0.60 0.00 0.00 56.93 57.34 1ava s PHE 46 Cb -0.20 -2.70 -0.01 0.00 0.51 0.00 0.00 43.02 40.62 1ava s PHE 46 CO 0.25 -0.77 0.64 0.08 0.70 0.00 0.00 175.22 176.12 1ava s VAL 47 N -2.99 4.96 0.43 -0.44 1.01 -1.04 -1.64 120.40 120.68 1ava s VAL 47 Ca 0.53 1.06 0.07 0.00 0.00 0.00 0.00 61.98 63.64 1ava s VAL 47 Cb -0.11 -3.97 -0.04 0.00 0.00 0.00 0.00 36.38 32.27 1ava s VAL 47 CO 0.46 -0.04 0.21 -0.55 0.00 0.00 0.00 175.10 175.18 1ava s SER 48 N 1.53 4.47 -0.05 3.32 0.15 0.67 -1.07 113.70 122.72 1ava s SER 48 Ca 0.26 -1.11 0.04 0.00 0.70 0.00 0.00 55.95 55.84 1ava s SER 48 Cb -0.15 -0.32 -0.00 0.00 -1.71 0.00 0.00 66.02 63.83 1ava s SER 48 CO 0.10 -0.63 -0.17 -1.58 1.20 0.00 0.00 173.24 172.15 1ava s GLN 49 N -3.96 1.81 -0.10 5.44 0.74 -1.06 -0.48 119.66 122.04 1ava s GLN 49 Ca 0.39 -0.61 -0.30 0.00 0.05 0.00 0.00 55.36 54.89 1ava s GLN 49 Cb 0.03 -1.57 -0.02 0.00 1.10 0.00 0.00 33.01 32.55 1ava s GLN 49 CO 0.22 0.24 1.11 0.34 -0.55 0.00 0.00 175.29 176.64 1ava s ASP 50 N 0.06 7.13 0.58 6.67 -1.08 -0.19 -4.52 116.67 125.32 1ava s ASP 50 Ca -0.04 1.64 0.36 0.00 -0.52 0.00 0.00 52.55 53.98 1ava s ASP 50 Cb -0.12 -2.55 1.68 0.00 -1.46 0.00 0.00 42.92 40.46 1ava s ASP 50 CO 0.02 -0.54 2.11 1.55 0.52 0.00 0.00 175.17 178.83 1ava h PRO 51 N 7.35 0.00 -6.31 4.34 0.13 -1.90 0.52 132.00 136.13 1ava h PRO 51 Ca -0.31 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.25 1ava h PRO 51 Cb 1.14 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.20 1ava h PRO 51 CO 0.88 0.03 0.82 1.21 -0.23 0.00 0.00 178.00 180.72 1ava s ASN 52 N -5.63 6.89 0.52 1.44 3.84 -1.26 -4.02 114.94 116.72 1ava s ASN 52 Ca -0.01 0.97 0.24 0.00 0.21 0.00 0.00 52.86 54.26 1ava s ASN 52 Cb 0.11 -2.53 1.36 0.00 -0.55 0.00 0.00 41.25 39.64 1ava s ASN 52 CO 0.52 -0.90 2.00 1.23 -2.79 0.00 0.00 177.10 177.16 1ava h GLY 53 N 10.15 0.05 1.68 1.21 0.00 -1.82 -1.01 103.07 113.33 1ava h GLY 53 Ca -0.21 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1ava h GLY 53 CO 1.03 0.01 0.00 -1.06 0.00 0.00 0.00 176.54 176.52 1ava n GLN 54 N -4.40 0.30 -3.25 4.80 6.02 -1.26 -4.53 117.38 115.07 1ava n GLN 54 Ca 0.09 0.02 -0.40 0.00 -0.01 0.00 0.00 57.00 56.70 1ava n GLN 54 Cb 0.56 -1.50 -0.08 0.00 1.02 0.00 0.00 30.24 30.25 1ava n GLN 54 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 1ava s HIS 55 N -2.68 3.26 -0.55 1.08 3.76 -0.40 -4.95 115.29 114.82 1ava s HIS 55 Ca 0.24 0.60 0.26 0.00 -0.15 0.00 0.00 55.06 56.01 1ava s HIS 55 Cb 0.19 -2.70 0.84 0.00 1.11 0.00 0.00 32.58 32.01 1ava s HIS 55 CO 0.45 -0.28 1.75 -0.44 -0.85 0.00 0.00 174.74 175.38 1ava h ASP 56 N 8.04 0.00 0.00 1.40 3.32 -1.86 0.14 116.42 127.46 1ava h ASP 56 Ca -0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.76 1ava h ASP 56 Cb 1.14 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.69 1ava h ASP 56 CO 0.71 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.84 1ava n GLY 57 N 0.82 -0.38 3.85 2.75 0.00 -1.26 -4.01 105.19 106.96 1ava n GLY 57 Ca 0.04 -1.09 -0.36 0.00 0.00 0.00 0.00 46.02 44.61 1ava n GLY 57 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ava s PHE 58 N 0.00 3.52 0.49 1.61 0.08 0.15 -4.96 117.98 118.87 1ava s PHE 58 Ca 0.00 0.45 -0.22 0.00 0.12 0.00 0.00 56.93 57.28 1ava s PHE 58 Cb 0.00 -1.90 -0.07 0.00 -0.57 0.00 0.00 43.02 40.49 1ava s PHE 58 CO 0.00 0.69 1.17 -1.25 -0.10 0.00 0.00 175.22 175.73 1ava s PRO 59 N -1.16 3.58 0.14 0.24 0.04 -1.26 -4.67 135.00 131.91 1ava s PRO 59 Ca 0.17 1.76 0.10 0.00 0.04 0.00 0.00 61.00 63.07 1ava s PRO 59 Cb -0.12 -2.27 -0.04 0.00 0.04 0.00 0.00 34.50 32.11 1ava s PRO 59 CO 0.06 -0.70 -0.19 0.08 0.04 0.00 0.00 177.00 176.29 1ava s VAL 60 N -1.59 2.72 -0.22 -0.36 1.01 0.95 -0.87 120.40 122.05 1ava s VAL 60 Ca 0.67 -1.64 -0.02 0.00 0.00 0.00 0.00 61.98 60.99 1ava s VAL 60 Cb -0.28 -2.26 0.01 0.00 0.00 0.00 0.00 36.38 33.84 1ava s VAL 60 CO 0.33 0.04 -0.09 -0.60 0.00 0.00 0.00 175.10 174.79 1ava s ARG 61 N -2.29 3.11 -0.20 2.72 3.52 0.43 -1.54 118.95 124.70 1ava s ARG 61 Ca 0.19 -0.79 -0.08 0.00 -0.13 0.00 0.00 55.73 54.92 1ava s ARG 61 Cb -0.10 -2.88 -0.04 0.00 -1.56 0.00 0.00 34.95 30.37 1ava s ARG 61 CO 0.10 -0.26 0.07 0.42 -0.81 0.00 0.00 175.30 174.82 1ava s ILE 62 N 1.38 4.68 -0.06 4.11 1.01 -1.26 -1.92 121.20 129.15 1ava s ILE 62 Ca 0.04 -0.06 0.01 0.00 0.00 0.00 0.00 60.65 60.64 1ava s ILE 62 Cb -0.15 -3.14 0.02 0.00 0.01 0.00 0.00 42.46 39.21 1ava s ILE 62 CO -0.06 0.42 -0.07 -0.89 0.00 0.00 0.00 174.94 174.33 1ava s THR 63 N 0.76 0.76 0.09 2.92 2.01 -0.51 -4.47 115.64 117.20 1ava s THR 63 Ca 0.04 -0.24 -0.36 0.00 0.31 0.00 0.00 61.69 61.43 1ava s THR 63 Cb -0.13 -0.75 -0.16 0.00 0.01 0.00 0.00 72.50 71.47 1ava s THR 63 CO 0.02 0.28 1.41 -2.65 -0.69 0.00 0.00 174.62 172.99 1ava n PRO 64 N 4.05 1.39 -1.29 4.92 -0.02 -1.26 -0.22 135.00 142.56 1ava n PRO 64 Ca -0.23 0.50 -0.23 0.00 -2.02 0.00 0.00 63.50 61.52 1ava n PRO 64 Cb 0.51 -2.18 -0.18 0.00 -0.02 0.00 0.00 33.50 31.63 1ava n PRO 64 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 1ava n TYR 65 N 2.85 0.12 0.00 6.00 9.36 -0.42 -4.28 117.16 130.79 1ava n TYR 65 Ca 0.18 0.08 0.00 0.00 3.32 0.00 0.00 57.90 61.48 1ava n TYR 65 Cb 0.21 -0.82 0.00 0.00 -0.63 0.00 0.00 39.34 38.10 1ava n TYR 65 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1ava n GLY 66 N 4.94 0.28 1.65 2.98 0.00 -1.26 -2.87 105.19 110.90 1ava n GLY 66 Ca 0.58 0.19 -0.10 0.00 0.00 0.00 0.00 46.02 46.70 1ava n GLY 66 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1ava n VAL 67 N 0.00 2.27 -0.77 1.61 0.24 -1.26 -4.32 118.33 116.09 1ava n VAL 67 Ca 0.00 -1.06 0.05 0.00 -2.04 0.00 0.00 64.34 61.29 1ava n VAL 67 Cb 0.00 -1.23 0.07 0.00 -1.47 0.00 0.00 33.84 31.21 1ava n VAL 67 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ava n ALA 68 N 0.52 2.08 -1.75 2.33 0.00 -1.14 -5.08 120.51 117.48 1ava n ALA 68 Ca 0.19 -1.83 -0.36 0.00 0.00 0.00 0.00 53.44 51.44 1ava n ALA 68 Cb 0.64 -0.24 0.03 0.00 0.00 0.00 0.00 19.45 19.89 1ava n ALA 68 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1ava s PRO 69 N -1.86 3.03 0.00 0.00 0.02 -1.26 -4.90 135.00 130.03 1ava s PRO 69 Ca 0.17 1.87 0.00 0.00 0.02 0.00 0.00 61.00 63.06 1ava s PRO 69 Cb 0.15 -1.99 0.00 0.00 0.02 0.00 0.00 34.50 32.68 1ava s PRO 69 CO 0.02 -1.17 0.00 -1.13 -0.33 0.00 0.00 177.00 174.38 1ava n SER 70 N -1.46 0.00 -0.52 2.53 3.41 -1.26 -4.97 113.62 111.35 1ava n SER 70 Ca 0.13 0.00 0.05 0.00 -0.26 0.00 0.00 58.87 58.79 1ava n SER 70 Cb 0.49 0.19 0.11 0.00 -0.26 0.00 0.00 64.21 64.74 1ava n SER 70 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1ava n ASP 71 N -1.71 2.51 0.00 4.04 5.75 -1.26 -4.97 116.55 120.91 1ava n ASP 71 Ca 0.00 -1.82 0.00 0.00 -0.01 0.00 0.00 54.79 52.96 1ava n ASP 71 Cb 0.00 -0.14 0.00 0.00 -1.03 0.00 0.00 41.12 39.95 1ava n ASP 71 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1ava n LYS 72 N 0.45 -0.46 -3.34 0.11 4.76 -1.26 -4.98 118.16 113.43 1ava n LYS 72 Ca 0.09 0.12 -0.36 0.00 -2.87 0.00 0.00 58.31 55.29 1ava n LYS 72 Cb 0.36 -3.76 -0.06 0.00 -1.84 0.00 0.00 35.03 29.73 1ava n LYS 72 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1ava s ILE 73 N -2.01 4.84 -0.24 -0.18 -1.09 -1.26 0.61 121.20 121.86 1ava s ILE 73 Ca 0.00 0.89 -0.09 0.00 -2.23 0.00 0.00 60.65 59.22 1ava s ILE 73 Cb 0.00 -3.76 -0.04 0.00 -1.58 0.00 0.00 42.46 37.08 1ava s ILE 73 CO 0.00 0.28 0.11 -0.63 -1.23 0.00 0.00 174.94 173.48 1ava s ILE 74 N -1.42 4.84 0.33 2.92 1.01 0.27 -4.81 121.20 124.34 1ava s ILE 74 Ca 0.37 0.00 0.08 0.00 0.00 0.00 0.00 60.65 61.10 1ava s ILE 74 Cb -0.16 -3.26 -0.04 0.00 0.01 0.00 0.00 42.46 39.01 1ava s ILE 74 CO 0.19 0.34 0.11 -0.13 0.00 0.00 0.00 174.94 175.45 1ava s ARG 75 N 1.30 2.33 0.91 2.79 0.52 -1.26 -1.23 118.95 124.31 1ava s ARG 75 Ca 0.06 -1.56 -0.11 0.00 -0.52 0.00 0.00 55.73 53.60 1ava s ARG 75 Cb -0.15 -2.14 0.14 0.00 0.52 0.00 0.00 34.95 33.32 1ava s ARG 75 CO 0.05 0.14 1.09 -0.51 0.02 0.00 0.00 175.30 176.09 1ava s LEU 76 N -3.81 2.33 -1.23 2.53 1.02 -0.23 -3.96 118.68 115.33 1ava s LEU 76 Ca 0.37 1.67 -0.09 0.00 0.02 0.00 0.00 54.13 56.10 1ava s LEU 76 Cb -0.03 -4.08 0.07 0.00 0.02 0.00 0.00 46.19 42.18 1ava s LEU 76 CO 0.22 -2.80 0.44 -1.20 0.02 0.00 0.00 176.35 173.03 1ava n SER 77 N -4.00 -3.52 -4.05 2.29 7.64 -0.42 -4.74 113.62 106.81 1ava n SER 77 Ca 0.08 -0.34 -0.20 0.00 1.01 0.00 0.00 58.87 59.42 1ava n SER 77 Cb 0.54 -2.93 -0.15 0.00 -1.01 0.00 0.00 64.21 60.66 1ava n SER 77 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1ava s THR 78 N -2.88 0.84 0.25 0.44 2.01 -1.25 -5.03 115.64 110.02 1ava s THR 78 Ca 0.37 -0.48 -0.31 0.00 0.31 0.00 0.00 61.69 61.58 1ava s THR 78 Cb -0.20 -0.71 -0.13 0.00 0.01 0.00 0.00 72.50 71.48 1ava s THR 78 CO 0.46 0.22 1.49 0.47 -0.69 0.00 0.00 174.62 176.57 1ava n ASP 79 N 2.78 3.18 -3.82 3.53 8.00 -1.26 -4.48 116.55 124.48 1ava n ASP 79 Ca -0.14 1.14 -0.12 0.00 0.71 0.00 0.00 54.79 56.38 1ava n ASP 79 Cb 0.56 -1.49 -0.09 0.00 -0.02 0.00 0.00 41.12 40.09 1ava n ASP 79 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1ava s VAL 80 N 0.09 0.08 0.09 2.53 1.01 -0.08 -1.30 120.40 122.82 1ava s VAL 80 Ca 0.68 -0.65 0.05 0.00 0.00 0.00 0.00 61.98 62.06 1ava s VAL 80 Cb -0.60 -0.59 -0.04 0.00 0.00 0.00 0.00 36.38 35.15 1ava s VAL 80 CO 0.48 -0.36 -0.00 -0.13 0.00 0.00 0.00 175.10 175.09 1ava s ARG 81 N -1.60 2.53 -0.03 2.72 0.52 0.69 -1.13 118.95 122.65 1ava s ARG 81 Ca -0.12 -0.85 0.02 0.00 -0.52 0.00 0.00 55.73 54.25 1ava s ARG 81 Cb -0.05 -2.53 0.01 0.00 0.52 0.00 0.00 34.95 32.89 1ava s ARG 81 CO 0.02 0.54 -0.07 0.42 0.02 0.00 0.00 175.30 176.22 1ava s ILE 82 N -1.31 0.67 0.02 1.52 1.01 -1.26 -1.42 121.20 120.43 1ava s ILE 82 Ca 0.26 -0.29 0.03 0.00 0.00 0.00 0.00 60.65 60.65 1ava s ILE 82 Cb -0.12 -0.61 -0.02 0.00 0.01 0.00 0.00 42.46 41.72 1ava s ILE 82 CO 0.18 0.22 -0.09 -0.44 0.00 0.00 0.00 174.94 174.82 1ava s SER 83 N 0.30 0.98 -0.09 3.58 0.01 -0.81 -0.57 113.70 117.11 1ava s SER 83 Ca -0.04 -0.34 -0.25 0.00 1.31 0.00 0.00 55.95 56.63 1ava s SER 83 Cb -0.09 -0.05 -0.03 0.00 0.21 0.00 0.00 66.02 66.06 1ava s SER 83 CO 0.00 -0.03 0.78 -0.36 0.41 0.00 0.00 173.24 174.04 1ava s PHE 84 N -0.72 3.54 -1.16 2.43 0.08 -0.64 -0.43 117.98 121.07 1ava s PHE 84 Ca -0.02 1.31 -0.16 0.00 0.12 0.00 0.00 56.93 58.18 1ava s PHE 84 Cb -0.06 -2.91 0.15 0.00 -0.57 0.00 0.00 43.02 39.62 1ava s PHE 84 CO 0.00 -0.03 1.42 1.03 -0.10 0.00 0.00 175.22 177.55 1ava s ARG 85 N 1.25 3.97 0.16 0.44 1.81 -0.05 -4.84 118.95 121.69 1ava s ARG 85 Ca 0.40 -2.30 -0.23 0.00 -1.72 0.00 0.00 55.73 51.88 1ava s ARG 85 Cb -0.18 -5.11 0.07 0.00 -0.45 0.00 0.00 34.95 29.28 1ava s ARG 85 CO 0.18 -1.85 0.60 0.00 -0.68 0.00 0.00 175.30 173.55 1ava s ALA 86 N 2.27 -1.56 -0.01 2.13 0.00 -1.26 -4.54 121.76 118.78 1ava s ALA 86 Ca 0.43 0.43 -0.10 0.00 0.00 0.00 0.00 51.96 52.72 1ava s ALA 86 Cb -0.02 0.88 -0.05 0.00 0.00 0.00 0.00 23.12 23.93 1ava s ALA 86 CO -0.01 -0.78 0.30 -0.47 0.00 0.00 0.00 175.76 174.80 1ava s TYR 87 N -3.76 3.63 0.12 0.00 5.04 -1.26 -4.98 117.35 116.14 1ava s TYR 87 Ca 0.02 0.72 0.05 0.00 -2.44 0.00 0.00 57.07 55.42 1ava s TYR 87 Cb -0.01 -2.09 -0.04 0.00 0.35 0.00 0.00 41.96 40.17 1ava s TYR 87 CO -0.12 0.64 -0.13 0.95 -1.34 0.00 0.00 175.55 175.55 1ava s THR 88 N -1.18 1.27 0.26 4.34 -4.23 -1.26 -5.02 115.64 109.81 1ava s THR 88 Ca 0.24 -1.74 0.29 0.00 -1.18 0.00 0.00 61.69 59.29 1ava s THR 88 Cb -0.14 -1.54 0.30 0.00 1.34 0.00 0.00 72.50 72.46 1ava s THR 88 CO 0.13 -0.47 1.98 0.74 -0.54 0.00 0.00 174.62 176.46 1ava h THR 89 N 3.44 0.40 0.00 3.99 2.02 -1.99 -2.38 112.91 118.39 1ava h THR 89 Ca -0.39 -0.72 0.00 0.00 0.77 0.00 0.00 66.41 66.07 1ava h THR 89 Cb 1.20 1.52 0.00 0.00 -1.74 0.00 0.00 68.15 69.12 1ava h THR 89 CO 0.52 0.12 0.00 0.00 0.37 0.00 0.00 175.52 176.54 1ava n LEU 91 N -2.23 -2.11 -4.65 0.00 4.77 -0.90 -4.96 117.00 106.93 1ava n LEU 91 Ca 0.04 -0.97 -0.29 0.00 -0.03 0.00 0.00 56.01 54.76 1ava n LEU 91 Cb 0.35 -2.23 -0.09 0.00 -2.33 0.00 0.00 43.42 39.13 1ava n LEU 91 CO 0.26 0.39 -0.25 -1.10 -1.33 0.00 0.00 177.39 175.36 1ava s GLN 92 N -6.68 2.04 0.44 3.23 -0.21 -1.26 -5.10 119.66 112.12 1ava s GLN 92 Ca 0.36 -2.25 -0.26 0.00 0.02 0.00 0.00 55.36 53.23 1ava s GLN 92 Cb -0.19 -1.28 -0.09 0.00 1.00 0.00 0.00 33.01 32.46 1ava s GLN 92 CO 0.89 -0.32 1.44 0.45 -2.12 0.00 0.00 175.29 175.63 1ava s SER 93 N -3.75 5.93 -0.23 5.90 0.15 -1.26 -4.82 113.70 115.63 1ava s SER 93 Ca 0.18 2.94 0.14 0.00 0.70 0.00 0.00 55.95 59.91 1ava s SER 93 Cb 0.04 -2.66 0.65 0.00 -1.71 0.00 0.00 66.02 62.35 1ava s SER 93 CO 0.10 -1.14 1.58 1.07 1.20 0.00 0.00 173.24 176.05 1ava n THR 94 N -0.11 2.55 -3.32 6.45 5.66 -1.26 -0.13 114.28 124.12 1ava n THR 94 Ca 0.05 -1.76 -0.36 0.00 -3.05 0.00 0.00 64.05 58.93 1ava n THR 94 Cb 0.41 -0.28 -0.06 0.00 -1.55 0.00 0.00 70.33 68.85 1ava n THR 94 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 1ava s GLU 95 N -2.87 4.04 0.57 1.09 2.12 -1.26 -1.63 118.70 120.76 1ava s GLU 95 Ca 0.48 0.57 -0.15 0.00 0.36 0.00 0.00 54.97 56.24 1ava s GLU 95 Cb 0.38 -2.97 -0.06 0.00 0.26 0.00 0.00 34.13 31.75 1ava s GLU 95 CO 0.11 0.49 1.01 -1.58 -0.54 0.00 0.00 175.26 174.76 1ava s TRP 96 N -1.42 3.39 -0.25 5.30 0.52 0.27 -3.91 118.94 122.84 1ava s TRP 96 Ca 0.37 1.43 -0.27 0.00 0.02 0.00 0.00 56.10 57.65 1ava s TRP 96 Cb -0.16 -2.82 0.14 0.00 -1.15 0.00 0.00 33.47 29.49 1ava s TRP 96 CO 0.19 -0.63 1.12 -3.38 0.02 0.00 0.00 176.95 174.27 1ava s HIS 97 N -2.76 -0.34 0.23 -1.98 -3.43 -0.91 -4.45 115.29 101.64 1ava s HIS 97 Ca 0.59 0.77 -0.30 0.00 -0.80 0.00 0.00 55.06 55.32 1ava s HIS 97 Cb -0.11 0.42 -0.09 0.00 -1.43 0.00 0.00 32.58 31.36 1ava s HIS 97 CO 0.40 -0.21 1.29 -1.50 -2.00 0.00 0.00 174.74 172.71 1ava s ILE 98 N -0.23 3.17 0.49 -5.38 1.10 -0.29 -0.81 121.20 119.25 1ava s ILE 98 Ca 0.03 1.01 -0.22 0.00 -0.51 0.00 0.00 60.65 60.96 1ava s ILE 98 Cb -0.04 -3.64 -0.07 0.00 0.15 0.00 0.00 42.46 38.87 1ava s ILE 98 CO -0.06 0.17 1.18 -0.62 -2.11 0.00 0.00 174.94 173.50 1ava s ASP 99 N 0.11 5.93 0.10 4.50 -1.08 0.23 -4.85 116.67 121.61 1ava s ASP 99 Ca 0.54 2.32 0.23 0.00 -0.52 0.00 0.00 52.55 55.13 1ava s ASP 99 Cb -0.36 -2.60 0.05 0.00 -1.46 0.00 0.00 42.92 38.54 1ava s ASP 99 CO 0.41 -1.08 1.02 -1.54 0.52 0.00 0.00 175.17 174.50 1ava n SER 100 N -0.78 0.63 -4.66 -0.34 3.41 -1.26 -4.79 113.62 105.84 1ava n SER 100 Ca 0.09 0.01 -0.25 0.00 -0.26 0.00 0.00 58.87 58.46 1ava n SER 100 Cb 0.48 0.71 -0.08 0.00 -0.26 0.00 0.00 64.21 65.07 1ava n SER 100 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1ava s GLU 101 N -3.27 2.36 0.04 4.33 2.02 -1.26 -5.12 118.70 117.80 1ava s GLU 101 Ca 0.02 -1.22 -0.08 0.00 0.02 0.00 0.00 54.97 53.70 1ava s GLU 101 Cb 0.13 -2.28 -0.05 0.00 0.10 0.00 0.00 34.13 32.02 1ava s GLU 101 CO 0.80 0.42 0.33 -0.51 0.02 0.00 0.00 175.26 176.32 1ava s LEU 102 N -3.22 4.36 -0.19 1.80 1.43 -1.26 -4.63 118.68 116.96 1ava s LEU 102 Ca 0.29 0.66 0.01 0.00 -1.03 0.00 0.00 54.13 54.06 1ava s LEU 102 Cb -0.08 -2.84 0.04 0.00 0.03 0.00 0.00 46.19 43.34 1ava s LEU 102 CO 0.19 0.21 -0.11 0.00 0.23 0.00 0.00 176.35 176.87 1ava s ALA 103 N -1.36 1.98 -1.47 4.21 0.00 -0.32 -4.60 121.76 120.19 1ava s ALA 103 Ca 0.30 -1.17 -0.02 0.00 0.00 0.00 0.00 51.96 51.07 1ava s ALA 103 Cb -0.14 -1.26 0.00 0.00 0.00 0.00 0.00 23.12 21.73 1ava s ALA 103 CO 0.17 -0.78 0.24 0.00 0.00 0.00 0.00 175.76 175.40 1ava n ALA 104 N 4.69 -0.68 -1.00 0.00 0.00 -1.26 -1.73 120.51 120.54 1ava n ALA 104 Ca -0.15 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1ava n ALA 104 Cb 0.47 -2.66 0.00 0.00 0.00 0.00 0.00 19.45 17.26 1ava n ALA 104 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ava n GLY 105 N -1.20 0.39 3.43 0.00 0.00 -1.26 -5.01 105.19 101.52 1ava n GLY 105 Ca -0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.56 1ava n GLY 105 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ava s ARG 106 N -0.50 1.63 -0.27 1.61 0.52 -0.71 -5.01 118.95 116.22 1ava s ARG 106 Ca 0.00 -1.23 -0.11 0.00 -0.52 0.00 0.00 55.73 53.87 1ava s ARG 106 Cb 0.00 -2.01 -0.05 0.00 0.52 0.00 0.00 34.95 33.41 1ava s ARG 106 CO 0.00 0.47 0.18 0.50 0.02 0.00 0.00 175.30 176.47 1ava s ARG 107 N -1.95 3.98 0.35 3.54 3.52 -1.26 -1.17 118.95 125.95 1ava s ARG 107 Ca 0.15 -0.31 0.09 0.00 -0.13 0.00 0.00 55.73 55.53 1ava s ARG 107 Cb -0.10 -3.61 -0.05 0.00 -1.56 0.00 0.00 34.95 29.63 1ava s ARG 107 CO 0.07 -0.10 0.03 -1.01 -0.81 0.00 0.00 175.30 173.48 1ava s HIS 108 N 1.52 2.56 -0.18 5.12 3.76 -1.26 -1.18 115.29 125.63 1ava s HIS 108 Ca 0.07 -0.45 -0.12 0.00 -0.15 0.00 0.00 55.06 54.41 1ava s HIS 108 Cb -0.15 -1.54 -0.05 0.00 1.11 0.00 0.00 32.58 31.96 1ava s HIS 108 CO 0.09 0.45 0.22 0.14 -0.85 0.00 0.00 174.74 174.78 1ava s VAL 109 N -2.52 5.36 0.00 -0.90 -7.23 -0.95 -0.60 120.40 113.55 1ava s VAL 109 Ca 0.35 0.38 0.00 0.00 -1.81 0.00 0.00 61.98 60.90 1ava s VAL 109 Cb 0.00 -3.56 -0.00 0.00 0.56 0.00 0.00 36.38 33.39 1ava s VAL 109 CO 0.20 0.41 0.00 2.30 -0.31 0.00 0.00 175.10 177.70 1ava n ILE 110 N 3.55 0.00 -4.73 -0.62 -5.35 0.01 -2.51 119.36 109.71 1ava n ILE 110 Ca -0.14 -0.00 -0.32 0.00 -0.27 0.00 0.00 62.75 62.02 1ava n ILE 110 Cb 0.52 0.00 -0.07 0.00 -1.74 0.00 0.00 39.64 38.35 1ava n ILE 110 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 1ava n THR 111 N -0.00 0.00 -4.31 7.28 -1.04 -0.58 -2.14 114.28 113.49 1ava n THR 111 Ca -0.00 -2.47 0.00 0.00 -2.04 0.00 0.00 64.05 59.54 1ava n THR 111 Cb 0.00 0.56 0.00 0.00 -1.82 0.00 0.00 70.33 69.08 1ava n THR 111 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ava n GLY 112 N -1.18 -1.41 3.77 3.41 0.00 0.81 -4.69 105.19 105.91 1ava n GLY 112 Ca -0.19 -1.25 -0.41 0.00 0.00 0.00 0.00 46.02 44.17 1ava n GLY 112 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ava n PRO 113 N -0.41 2.66 -2.45 1.61 -0.02 -1.26 -4.75 135.00 130.38 1ava n PRO 113 Ca 0.00 0.93 -0.41 0.00 -2.02 0.00 0.00 63.50 62.00 1ava n PRO 113 Cb 0.00 -2.66 -0.03 0.00 -0.02 0.00 0.00 33.50 30.79 1ava n PRO 113 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1ava s VAL 114 N -1.04 3.77 0.12 -1.45 1.01 -1.26 -4.92 120.40 116.63 1ava s VAL 114 Ca 0.54 0.59 -0.30 0.00 0.00 0.00 0.00 61.98 62.81 1ava s VAL 114 Cb -0.48 -4.60 -0.08 0.00 0.00 0.00 0.00 36.38 31.21 1ava s VAL 114 CO 0.63 -1.40 1.58 0.50 0.00 0.00 0.00 175.10 176.41 1ava h LYS 115 N 10.77 -0.55 -3.12 2.72 3.64 -1.96 -3.34 116.57 124.72 1ava h LYS 115 Ca -0.27 0.04 -0.62 0.00 -1.27 0.00 0.00 60.65 58.53 1ava h LYS 115 Cb 1.08 0.13 -0.41 0.00 -0.41 0.00 0.00 32.23 32.61 1ava h LYS 115 CO 1.21 -0.37 -0.66 -0.51 -2.27 0.00 0.00 179.45 176.86 1ava s ASP 116 N -4.80 4.14 0.22 4.20 1.01 -1.26 -5.10 116.67 115.08 1ava s ASP 116 Ca -0.16 -3.24 -0.32 0.00 0.71 0.00 0.00 52.55 49.54 1ava s ASP 116 Cb 0.08 -1.42 -0.14 0.00 1.01 0.00 0.00 42.92 42.45 1ava s ASP 116 CO 0.63 -0.18 1.43 -2.65 0.21 0.00 0.00 175.17 174.61 1ava n PRO 117 N 2.77 2.00 -2.27 8.23 -0.02 -1.26 -4.98 135.00 139.48 1ava n PRO 117 Ca 0.13 0.71 -0.28 0.00 -2.02 0.00 0.00 63.50 62.04 1ava n PRO 117 Cb 0.35 -2.39 0.03 0.00 -0.02 0.00 0.00 33.50 31.47 1ava n PRO 117 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1ava s SER 118 N 0.41 5.75 0.28 2.55 1.04 -1.26 -4.94 113.70 117.53 1ava s SER 118 Ca 0.71 0.92 -0.02 0.00 0.48 0.00 0.00 55.95 58.04 1ava s SER 118 Cb -0.67 -1.94 0.42 0.00 0.10 0.00 0.00 66.02 63.93 1ava s SER 118 CO 0.47 -1.02 1.91 -0.65 0.98 0.00 0.00 173.24 174.94 1ava h PRO 119 N -0.23 1.13 0.00 4.02 0.11 -2.06 -1.82 132.00 133.15 1ava h PRO 119 Ca -0.45 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 65.52 1ava h PRO 119 Cb 1.24 -0.26 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 1ava h PRO 119 CO 0.62 0.75 -0.32 0.66 -0.21 0.00 0.00 178.00 179.50 1ava h SER 120 N 1.17 0.00 -1.19 -2.05 4.64 -1.99 -3.46 113.55 110.66 1ava h SER 120 Ca 0.39 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 61.34 1ava h SER 120 Cb 0.07 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 62.04 1ava h SER 120 CO -0.13 0.32 -0.36 0.61 -0.87 0.00 0.00 176.83 176.39 1ava n GLY 121 N -0.36 1.39 1.38 -0.77 0.00 -0.69 -4.88 105.19 101.27 1ava n GLY 121 Ca -0.02 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1ava n GLY 121 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ava n ARG 122 N -2.52 2.89 0.23 1.61 1.74 -1.26 -4.36 116.66 114.99 1ava n ARG 122 Ca -0.19 -1.76 0.07 0.00 -0.77 0.00 0.00 57.85 55.20 1ava n ARG 122 Cb 0.61 -1.88 0.56 0.00 -1.02 0.00 0.00 32.46 30.74 1ava n ARG 122 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1ava h GLU 123 N 1.89 0.00 -0.53 5.56 3.07 -1.90 -2.37 114.58 120.30 1ava h GLU 123 Ca 0.08 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.94 1ava h GLU 123 Cb 1.50 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.41 1ava h GLU 123 CO 0.35 0.16 0.00 0.27 -1.40 0.00 0.00 179.01 178.39 1ava n ASN 124 N -4.19 2.89 -4.67 1.42 6.94 -1.26 -1.14 115.26 115.24 1ava n ASN 124 Ca -0.02 -2.05 -0.39 0.00 -0.02 0.00 0.00 54.58 52.09 1ava n ASN 124 Cb 0.23 -0.37 -0.07 0.00 -2.36 0.00 0.00 39.78 37.22 1ava n ASN 124 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1ava s ALA 125 N -1.39 3.54 0.34 -2.53 0.00 -0.89 -4.43 121.76 116.39 1ava s ALA 125 Ca 0.35 -0.40 0.03 0.00 0.00 0.00 0.00 51.96 51.94 1ava s ALA 125 Cb 0.19 -2.74 -0.05 0.00 0.00 0.00 0.00 23.12 20.51 1ava s ALA 125 CO 0.22 -0.34 0.08 -0.06 0.00 0.00 0.00 175.76 175.67 1ava s PHE 126 N 1.39 1.85 -0.01 0.00 0.08 -0.29 -1.31 117.98 119.70 1ava s PHE 126 Ca 0.23 -1.07 -0.14 0.00 0.12 0.00 0.00 56.93 56.06 1ava s PHE 126 Cb -0.15 -1.20 0.02 0.00 -0.57 0.00 0.00 43.02 41.12 1ava s PHE 126 CO 0.09 -0.12 0.30 1.03 -0.10 0.00 0.00 175.22 176.43 1ava s ARG 127 N -3.87 0.68 -0.11 0.44 0.52 -0.68 -0.90 118.95 115.02 1ava s ARG 127 Ca 0.33 -0.23 -0.00 0.00 -0.52 0.00 0.00 55.73 55.31 1ava s ARG 127 Cb 0.07 0.30 -0.02 0.00 0.52 0.00 0.00 34.95 35.81 1ava s ARG 127 CO 0.15 -0.19 -0.09 0.42 0.02 0.00 0.00 175.30 175.61 1ava s ILE 128 N -1.45 3.45 0.05 1.52 1.01 -1.26 -1.19 121.20 123.34 1ava s ILE 128 Ca -0.13 -0.54 -0.02 0.00 0.00 0.00 0.00 60.65 59.96 1ava s ILE 128 Cb -0.05 -2.44 -0.03 0.00 0.01 0.00 0.00 42.46 39.95 1ava s ILE 128 CO 0.03 0.55 0.01 -1.61 0.00 0.00 0.00 174.94 173.92 1ava s GLU 129 N -0.12 0.64 0.40 2.79 0.41 -0.80 -1.30 118.70 120.72 1ava s GLU 129 Ca 0.00 -1.14 -0.25 0.00 -0.41 0.00 0.00 54.97 53.17 1ava s GLU 129 Cb -0.13 0.23 -0.08 0.00 -1.78 0.00 0.00 34.13 32.36 1ava s GLU 129 CO 0.03 -0.13 1.18 0.15 -0.49 0.00 0.00 175.26 176.00 1ava s LYS 130 N -3.78 4.05 0.14 1.61 1.02 -1.26 -0.85 119.74 120.66 1ava s LYS 130 Ca 0.05 1.86 -0.08 0.00 0.02 0.00 0.00 55.97 57.83 1ava s LYS 130 Cb 0.07 -2.68 -0.06 0.00 -0.52 0.00 0.00 37.83 34.64 1ava s LYS 130 CO -0.10 -0.33 1.37 -0.92 -0.92 0.00 0.00 175.35 174.46 1ava h TYR 131 N 2.64 0.88 -4.58 3.18 3.20 -1.65 -3.43 116.97 117.20 1ava h TYR 131 Ca -0.49 -0.37 -0.49 0.00 3.14 0.00 0.00 58.73 60.52 1ava h TYR 131 Cb 1.24 -0.14 -0.13 0.00 1.54 0.00 0.00 36.73 39.23 1ava h TYR 131 CO 0.55 1.17 -0.49 -1.54 -1.64 0.00 0.00 178.16 176.21 1ava s SER 132 N -7.04 1.87 0.00 -2.11 1.04 -1.26 -5.03 113.70 101.17 1ava s SER 132 Ca -0.09 -1.76 0.20 0.00 0.48 0.00 0.00 55.95 54.79 1ava s SER 132 Cb 0.10 0.56 1.21 0.00 0.10 0.00 0.00 66.02 67.99 1ava s SER 132 CO 0.88 -1.05 1.66 0.61 0.98 0.00 0.00 173.24 176.31 1ava n GLY 133 N -0.67 -0.79 3.83 7.32 0.00 -1.26 -4.86 105.19 108.75 1ava n GLY 133 Ca 0.06 -0.13 -0.31 0.00 0.00 0.00 0.00 46.02 45.64 1ava n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ava s ALA 134 N -2.00 2.80 0.12 4.61 0.00 -1.26 -4.98 121.76 121.05 1ava s ALA 134 Ca 0.30 0.09 0.20 0.00 0.00 0.00 0.00 51.96 52.56 1ava s ALA 134 Cb 0.14 -3.16 0.71 0.00 0.00 0.00 0.00 23.12 20.81 1ava s ALA 134 CO 0.23 -1.01 1.74 1.49 0.00 0.00 0.00 175.76 178.22 1ava h GLU 135 N -0.42 0.00 -6.43 0.00 4.57 -2.01 -3.46 114.58 106.82 1ava h GLU 135 Ca -0.44 0.00 -0.59 0.00 -1.18 0.00 0.00 59.36 57.15 1ava h GLU 135 Cb 1.21 0.00 0.16 0.00 -0.16 0.00 0.00 28.75 29.96 1ava h GLU 135 CO 0.58 0.32 -0.43 1.33 -1.18 0.00 0.00 179.01 179.64 1ava n VAL 136 N -3.44 1.98 -3.00 0.32 0.24 -1.26 -4.87 118.33 108.31 1ava n VAL 136 Ca 0.00 -0.50 -0.44 0.00 -2.04 0.00 0.00 64.34 61.36 1ava n VAL 136 Cb 0.50 -0.62 0.00 0.00 -1.47 0.00 0.00 33.84 32.25 1ava n VAL 136 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 1ava n HIS 137 N -1.44 4.85 -4.31 6.34 8.25 -1.26 -4.92 115.22 122.73 1ava n HIS 137 Ca 0.11 -3.43 -0.22 0.00 -0.26 0.00 0.00 57.72 53.92 1ava n HIS 137 Cb 0.45 -2.05 -0.16 0.00 1.12 0.00 0.00 29.99 29.35 1ava n HIS 137 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1ava s GLU 138 N 0.76 1.15 0.49 -0.41 2.02 -1.26 -4.85 118.70 116.60 1ava s GLU 138 Ca 0.40 -0.22 0.02 0.00 0.02 0.00 0.00 54.97 55.19 1ava s GLU 138 Cb -0.03 -1.05 -0.02 0.00 0.10 0.00 0.00 34.13 33.13 1ava s GLU 138 CO -0.01 -0.05 0.02 0.71 0.02 0.00 0.00 175.26 175.95 1ava s TYR 139 N 0.84 1.89 0.06 1.61 2.02 -0.30 -1.95 117.35 121.51 1ava s TYR 139 Ca -0.12 -0.98 -0.06 0.00 -0.37 0.00 0.00 57.07 55.54 1ava s TYR 139 Cb -0.15 -1.56 -0.01 0.00 -0.40 0.00 0.00 41.96 39.83 1ava s TYR 139 CO 0.01 0.18 0.10 -1.59 -1.57 0.00 0.00 175.55 172.68 1ava s LYS 140 N -3.85 0.69 0.01 -0.62 -2.85 -0.03 -0.09 119.74 113.00 1ava s LYS 140 Ca 0.09 -0.92 0.04 0.00 -1.00 0.00 0.00 55.97 54.18 1ava s LYS 140 Cb 0.02 0.27 -0.03 0.00 -2.06 0.00 0.00 37.83 36.02 1ava s LYS 140 CO 0.05 -0.18 -0.07 -0.51 0.10 0.00 0.00 175.35 174.74 1ava s LEU 141 N -2.56 3.14 0.03 2.77 1.43 -1.26 -1.90 118.68 120.34 1ava s LEU 141 Ca 0.01 -0.18 0.05 0.00 -1.03 0.00 0.00 54.13 52.98 1ava s LEU 141 Cb 0.03 -1.81 -0.02 0.00 0.03 0.00 0.00 46.19 44.42 1ava s LEU 141 CO -0.08 0.27 -0.14 -0.04 0.23 0.00 0.00 176.35 176.60 1ava s MET 142 N -1.49 0.92 -0.25 1.70 -1.94 -0.33 -1.75 119.30 116.16 1ava s MET 142 Ca 0.17 -0.72 -0.12 0.00 -1.71 0.00 0.00 55.69 53.31 1ava s MET 142 Cb -0.11 -0.91 -0.05 0.00 2.01 0.00 0.00 34.83 35.77 1ava s MET 142 CO 0.08 0.23 0.25 0.45 -0.01 0.00 0.00 175.02 176.02 1ava s SER 143 N -1.06 6.16 -0.65 3.03 0.15 -0.36 -1.69 113.70 119.27 1ava s SER 143 Ca 0.01 0.17 0.05 0.00 0.70 0.00 0.00 55.95 56.89 1ava s SER 143 Cb -0.08 -2.15 0.18 0.00 -1.71 0.00 0.00 66.02 62.27 1ava s SER 143 CO 0.01 -0.05 0.52 0.00 1.20 0.00 0.00 173.24 174.92 1ava n GLY 145 N 1.88 0.83 0.10 0.00 0.00 -1.26 -4.65 105.19 102.09 1ava n GLY 145 Ca 0.23 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.07 1ava n GLY 145 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ava h ASP 146 N 0.00 0.00 -2.71 1.61 3.32 -1.92 -3.47 116.42 113.25 1ava h ASP 146 Ca 0.00 -0.44 -0.52 0.00 0.02 0.00 0.00 57.03 56.09 1ava h ASP 146 Cb 0.00 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 39.41 1ava h ASP 146 CO 0.00 1.31 -0.70 0.26 -1.72 0.00 0.00 179.24 178.40 1ava s TRP 147 N -2.32 2.03 -0.12 4.55 0.52 -1.26 -5.13 118.94 117.21 1ava s TRP 147 Ca -0.25 -0.60 -0.14 0.00 0.02 0.00 0.00 56.10 55.13 1ava s TRP 147 Cb 0.05 -1.09 -0.05 0.00 -1.15 0.00 0.00 33.47 31.23 1ava s TRP 147 CO 0.52 0.40 0.33 0.00 0.02 0.00 0.00 176.95 178.23 1ava s GLN 149 N 0.10 2.06 0.52 0.00 -0.21 0.13 -4.94 119.66 117.33 1ava s GLN 149 Ca 0.19 -0.60 -0.20 0.00 0.02 0.00 0.00 55.36 54.77 1ava s GLN 149 Cb -0.14 -1.68 -0.06 0.00 1.00 0.00 0.00 33.01 32.12 1ava s GLN 149 CO 0.07 0.15 1.13 -0.51 -2.12 0.00 0.00 175.29 174.01 1ava s ASP 150 N 0.35 5.84 0.05 5.90 1.01 -1.26 -1.23 116.67 127.33 1ava s ASP 150 Ca -0.12 2.19 0.04 0.00 0.71 0.00 0.00 52.55 55.38 1ava s ASP 150 Cb -0.15 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.16 1ava s ASP 150 CO 0.04 -1.14 -0.05 -0.76 0.21 0.00 0.00 175.17 173.48 1ava s LEU 151 N -3.62 3.27 0.33 1.23 1.43 -0.71 -4.24 118.68 116.37 1ava s LEU 151 Ca 0.71 -0.18 0.05 0.00 -1.03 0.00 0.00 54.13 53.67 1ava s LEU 151 Cb -0.25 -1.95 -0.02 0.00 0.03 0.00 0.00 46.19 44.00 1ava s LEU 151 CO 0.28 0.23 0.32 -0.83 0.23 0.00 0.00 176.35 176.58 1ava s GLY 152 N -1.82 2.14 -0.04 -3.19 0.00 0.21 -2.00 107.32 102.62 1ava s GLY 152 Ca 0.21 -1.95 0.07 0.00 0.00 0.00 0.00 44.72 43.04 1ava s GLY 152 CO 0.12 -1.37 -0.23 -1.34 0.00 0.00 0.00 173.10 170.28 1ava s VAL 153 N -3.37 2.30 -0.47 1.40 -7.23 -1.26 -0.36 120.40 111.41 1ava s VAL 153 Ca 0.39 -1.01 -0.29 0.00 -1.81 0.00 0.00 61.98 59.26 1ava s VAL 153 Cb 0.02 -1.83 0.03 0.00 0.56 0.00 0.00 36.38 35.16 1ava s VAL 153 CO 0.26 0.58 1.17 -0.36 -0.31 0.00 0.00 175.10 176.44 1ava s PHE 154 N -0.54 2.77 -1.72 2.82 0.08 0.92 -4.74 117.98 117.58 1ava s PHE 154 Ca 0.07 0.71 0.20 0.00 0.12 0.00 0.00 56.93 58.04 1ava s PHE 154 Cb -0.11 -4.42 0.65 0.00 -0.57 0.00 0.00 43.02 38.58 1ava s PHE 154 CO 0.00 -1.36 1.55 0.54 -0.10 0.00 0.00 175.22 175.86 1ava n ARG 155 N 7.87 2.99 -0.17 0.44 1.74 -1.26 -2.54 116.66 125.73 1ava n ARG 155 Ca 0.13 -2.64 0.04 0.00 -0.77 0.00 0.00 57.85 54.61 1ava n ARG 155 Cb 0.49 -1.66 0.13 0.00 -1.02 0.00 0.00 32.46 30.40 1ava n ARG 155 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1ava n ASP 156 N 1.42 1.69 -1.55 0.55 5.68 -1.26 -4.91 116.55 118.17 1ava n ASP 156 Ca 0.24 -2.04 -0.19 0.00 -0.50 0.00 0.00 54.79 52.30 1ava n ASP 156 Cb 0.69 -0.23 -0.08 0.00 -1.14 0.00 0.00 41.12 40.36 1ava n ASP 156 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1ava n LEU 157 N 0.34 -1.45 -4.70 -2.12 4.77 -1.26 -4.94 117.00 107.64 1ava n LEU 157 Ca 0.10 0.44 -0.42 0.00 -0.03 0.00 0.00 56.01 56.09 1ava n LEU 157 Cb 0.28 -2.70 -0.03 0.00 -2.33 0.00 0.00 43.42 38.64 1ava n LEU 157 CO 0.07 -0.95 0.95 -0.75 -1.33 0.00 0.00 177.39 175.38 1ava s LYS 158 N -3.76 4.37 0.00 3.23 2.47 -1.26 -2.45 119.74 122.35 1ava s LYS 158 Ca 0.00 1.74 0.00 0.00 -1.56 0.00 0.00 55.97 56.15 1ava s LYS 158 Cb 0.00 -3.49 0.00 0.00 -1.46 0.00 0.00 37.83 32.88 1ava s LYS 158 CO 0.00 -0.40 0.00 0.41 0.16 0.00 0.00 175.35 175.52 1ava n GLY 159 N 3.35 0.74 0.00 5.54 0.00 -1.26 -4.28 105.19 109.28 1ava n GLY 159 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1ava n GLY 159 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ava n GLY 160 N -2.00 0.39 3.85 -0.02 0.00 -1.02 -1.19 105.19 105.20 1ava n GLY 160 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 1ava n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ava s ALA 161 N -2.00 -1.80 -0.07 4.61 0.00 -1.26 -5.02 121.76 116.22 1ava s ALA 161 Ca 0.00 -0.10 -0.26 0.00 0.00 0.00 0.00 51.96 51.60 1ava s ALA 161 Cb 0.00 0.72 -0.03 0.00 0.00 0.00 0.00 23.12 23.81 1ava s ALA 161 CO 0.00 -1.07 0.80 -1.58 0.00 0.00 0.00 175.76 173.91 1ava s TRP 162 N -2.36 3.56 0.10 0.00 0.52 -1.26 -4.15 118.94 115.36 1ava s TRP 162 Ca 0.21 1.37 0.09 0.00 0.02 0.00 0.00 56.10 57.79 1ava s TRP 162 Cb -0.01 -2.94 -0.03 0.00 -1.15 0.00 0.00 33.47 29.34 1ava s TRP 162 CO 0.03 -0.01 -0.24 -0.06 0.02 0.00 0.00 176.95 176.69 1ava s PHE 163 N 1.16 2.05 0.21 -1.98 0.08 -1.05 -2.58 117.98 115.86 1ava s PHE 163 Ca 0.42 -0.40 -0.29 0.00 0.12 0.00 0.00 56.93 56.78 1ava s PHE 163 Cb -0.18 -1.15 -0.08 0.00 -0.57 0.00 0.00 43.02 41.04 1ava s PHE 163 CO 0.19 0.23 0.90 -1.17 -0.10 0.00 0.00 175.22 175.28 1ava s LEU 164 N -1.78 4.62 0.00 -0.37 0.20 -0.23 -0.05 118.68 121.06 1ava s LEU 164 Ca 0.10 1.86 -0.13 0.00 0.69 0.00 0.00 54.13 56.65 1ava s LEU 164 Cb -0.10 -3.53 0.04 0.00 -0.43 0.00 0.00 46.19 42.18 1ava s LEU 164 CO 0.04 0.15 0.60 0.61 -0.29 0.00 0.00 176.35 177.46 1ava n GLY 165 N 1.61 0.54 3.55 7.98 0.00 0.51 -2.25 105.19 117.13 1ava n GLY 165 Ca -0.02 -0.96 -0.41 0.00 0.00 0.00 0.00 46.02 44.63 1ava n GLY 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ava s ALA 166 N -1.49 2.77 0.03 4.61 0.00 -0.33 -0.62 121.76 126.74 1ava s ALA 166 Ca 0.14 -1.72 -0.28 0.00 0.00 0.00 0.00 51.96 50.10 1ava s ALA 166 Cb -0.01 -4.32 0.09 0.00 0.00 0.00 0.00 23.12 18.89 1ava s ALA 166 CO 0.00 -3.36 0.97 -0.08 0.00 0.00 0.00 175.76 173.30 1ava s THR 167 N 5.32 0.00 0.14 0.00 -1.32 -1.26 -4.67 115.64 113.86 1ava s THR 167 Ca 0.38 -0.24 0.00 0.00 -1.21 0.00 0.00 61.69 60.62 1ava s THR 167 Cb -0.06 -1.41 -0.04 0.00 -1.51 0.00 0.00 72.50 69.48 1ava s THR 167 CO 0.06 0.00 0.31 -1.61 -2.21 0.00 0.00 174.62 171.17 1ava s GLU 168 N -3.06 3.49 0.23 7.08 0.41 -1.26 -2.92 118.70 122.66 1ava s GLU 168 Ca 0.09 -0.42 -0.19 0.00 -0.41 0.00 0.00 54.97 54.04 1ava s GLU 168 Cb -0.01 -2.93 -0.08 0.00 -1.78 0.00 0.00 34.13 29.33 1ava s GLU 168 CO -0.05 0.50 0.71 -1.25 -0.49 0.00 0.00 175.26 174.68 1ava s PRO 169 N -3.03 4.21 0.35 0.39 0.04 -1.26 -4.84 135.00 130.86 1ava s PRO 169 Ca 0.37 0.82 -0.29 0.00 0.04 0.00 0.00 61.00 61.94 1ava s PRO 169 Cb -0.12 -2.84 -0.11 0.00 0.04 0.00 0.00 34.50 31.47 1ava s PRO 169 CO 0.28 0.38 1.49 0.66 0.04 0.00 0.00 177.00 179.85 1ava n TYR 170 N 0.62 2.87 -2.78 0.56 4.01 -1.26 -4.03 117.16 117.15 1ava n TYR 170 Ca -0.02 0.41 -0.42 0.00 -0.16 0.00 0.00 57.90 57.71 1ava n TYR 170 Cb 0.51 -2.53 -0.03 0.00 -0.31 0.00 0.00 39.34 36.98 1ava n TYR 170 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 1ava s HIS 171 N -0.84 3.19 -0.31 -0.72 2.46 -0.85 -4.91 115.29 113.30 1ava s HIS 171 Ca 0.56 1.03 -0.19 0.00 0.47 0.00 0.00 55.06 56.93 1ava s HIS 171 Cb -0.49 -3.44 -0.01 0.00 -0.13 0.00 0.00 32.58 28.50 1ava s HIS 171 CO 0.60 -0.65 0.59 0.54 -2.47 0.00 0.00 174.74 173.34 1ava s VAL 172 N 3.29 4.97 0.29 0.89 0.11 -1.26 -4.46 120.40 124.24 1ava s VAL 172 Ca 0.39 0.74 0.08 0.00 -2.93 0.00 0.00 61.98 60.27 1ava s VAL 172 Cb -0.13 -3.97 -0.04 0.00 -1.53 0.00 0.00 36.38 30.71 1ava s VAL 172 CO 0.13 -0.13 0.12 -0.69 -3.33 0.00 0.00 175.10 171.21 1ava s VAL 173 N 2.53 3.57 0.02 2.04 1.01 0.87 -1.03 120.40 129.40 1ava s VAL 173 Ca 0.23 -1.67 0.00 0.00 0.00 0.00 0.00 61.98 60.55 1ava s VAL 173 Cb -0.15 -3.06 -0.02 0.00 0.00 0.00 0.00 36.38 33.16 1ava s VAL 173 CO 0.12 -0.29 -0.02 0.54 0.00 0.00 0.00 175.10 175.45 1ava s VAL 174 N -2.31 0.10 -0.19 2.92 0.11 -0.17 -1.15 120.40 119.71 1ava s VAL 174 Ca 0.35 -0.69 -0.04 0.00 -2.93 0.00 0.00 61.98 58.67 1ava s VAL 174 Cb -0.05 -0.21 -0.02 0.00 -1.53 0.00 0.00 36.38 34.56 1ava s VAL 174 CO 0.23 -0.37 -0.03 -0.36 -3.33 0.00 0.00 175.10 171.24 1ava s PHE 175 N -1.09 3.00 -0.14 1.54 0.40 -1.26 -1.39 117.98 119.04 1ava s PHE 175 Ca -0.12 -0.54 -0.04 0.00 -0.60 0.00 0.00 56.93 55.64 1ava s PHE 175 Cb -0.07 -2.04 -0.03 0.00 0.51 0.00 0.00 43.02 41.38 1ava s PHE 175 CO -0.01 -0.26 -0.01 0.21 0.70 0.00 0.00 175.22 175.86 1ava s LYS 176 N 0.91 3.49 0.07 0.44 2.20 -0.53 0.46 119.74 126.78 1ava s LYS 176 Ca 0.00 -0.45 -0.31 0.00 -0.36 0.00 0.00 55.97 54.86 1ava s LYS 176 Cb -0.14 -2.93 -0.08 0.00 -1.51 0.00 0.00 37.83 33.17 1ava s LYS 176 CO 0.01 0.41 1.61 0.21 -0.36 0.00 0.00 175.35 177.23 1ava s LYS 177 N -0.06 4.21 0.25 4.03 2.20 -1.26 -0.34 119.74 128.77 1ava s LYS 177 Ca 0.03 2.28 0.08 0.00 -0.36 0.00 0.00 55.97 58.00 1ava s LYS 177 Cb -0.13 -3.55 -0.04 0.00 -1.51 0.00 0.00 37.83 32.60 1ava s LYS 177 CO 0.02 -0.70 0.12 0.00 -0.36 0.00 0.00 175.35 174.43 1ava s ALA 178 N 2.44 3.42 0.58 3.13 0.00 0.34 -4.82 121.76 126.86 1ava s ALA 178 Ca 0.72 -1.49 -0.19 0.00 0.00 0.00 0.00 51.96 51.00 1ava s ALA 178 Cb -0.39 -1.11 -0.04 0.00 0.00 0.00 0.00 23.12 21.58 1ava s ALA 178 CO 0.31 0.28 1.20 -2.14 0.00 0.00 0.00 175.76 175.41 1ava s PRO 179 N -3.72 3.05 0.33 0.00 0.02 -1.26 -4.39 135.00 129.03 1ava s PRO 179 Ca 0.32 1.82 -0.29 0.00 0.02 0.00 0.00 61.00 62.87 1ava s PRO 179 Cb -0.07 -1.96 -0.11 0.00 0.02 0.00 0.00 34.50 32.38 1ava s PRO 179 CO 0.23 -1.14 1.44 -1.25 -0.33 0.00 0.00 177.00 175.94 1ava s PRO 180 N -3.29 4.21 0.00 5.54 0.04 -1.26 -4.75 135.00 135.49 1ava s PRO 180 Ca 0.76 2.42 0.00 0.00 0.04 0.00 0.00 61.00 64.22 1ava s PRO 180 Cb -0.30 -3.03 0.00 0.00 0.04 0.00 0.00 34.50 31.21 1ava s PRO 180 CO 0.33 -0.42 0.00 0.00 0.04 0.00 0.00 177.00 176.95