#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l3i n PRO 3 N 0.00 1.91 -0.18 0.38 -0.02 -1.26 -4.88 135.00 130.94 1l3i n PRO 3 Ca 0.00 0.67 0.18 0.00 -2.02 0.00 0.00 63.50 62.33 1l3i n PRO 3 Cb 0.00 -2.21 0.54 0.00 -0.02 0.00 0.00 33.50 31.81 1l3i n PRO 3 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1l3i h ASP 4 N 2.34 0.33 0.08 2.55 3.32 -1.97 0.16 116.42 123.23 1l3i h ASP 4 Ca -0.45 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.63 1l3i h ASP 4 Cb 1.30 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.81 1l3i h ASP 4 CO 0.62 0.15 0.00 -0.90 -1.72 0.00 0.00 179.24 177.39 1l3i n ASP 5 N -4.47 0.00 -1.64 6.45 5.68 -1.26 -2.93 116.55 118.38 1l3i n ASP 5 Ca 0.16 -0.86 0.09 0.00 -0.50 0.00 0.00 54.79 53.69 1l3i n ASP 5 Cb 0.64 -0.04 0.37 0.00 -1.14 0.00 0.00 41.12 40.95 1l3i n ASP 5 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1l3i n GLU 6 N -1.04 3.91 -4.36 0.11 1.02 0.56 -4.86 120.64 115.99 1l3i n GLU 6 Ca 0.22 -2.94 -0.34 0.00 -0.02 0.00 0.00 57.16 54.08 1l3i n GLU 6 Cb 0.13 -1.95 -0.13 0.00 -0.02 0.00 0.00 31.44 29.46 1l3i n GLU 6 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 1l3i s PHE 7 N -1.97 2.95 -0.13 -0.32 0.40 -1.15 -5.00 117.98 112.76 1l3i s PHE 7 Ca 0.52 -0.56 -0.29 0.00 -0.60 0.00 0.00 56.93 56.00 1l3i s PHE 7 Cb 0.34 -1.97 -0.01 0.00 0.51 0.00 0.00 43.02 41.89 1l3i s PHE 7 CO 0.24 -0.23 1.01 0.42 0.70 0.00 0.00 175.22 177.36 1l3i s ILE 8 N 0.69 4.77 0.18 0.64 -1.09 -1.26 -4.98 121.20 120.15 1l3i s ILE 8 Ca -0.03 2.03 -0.01 0.00 -2.23 0.00 0.00 60.65 60.41 1l3i s ILE 8 Cb -0.15 -4.31 -0.04 0.00 -1.58 0.00 0.00 42.46 36.38 1l3i s ILE 8 CO 0.02 -0.02 0.36 -0.54 -1.23 0.00 0.00 174.94 173.53 1l3i s LYS 9 N 2.20 3.52 -0.03 2.79 1.02 -1.26 -4.94 119.74 123.03 1l3i s LYS 9 Ca 0.47 -0.35 0.07 0.00 0.02 0.00 0.00 55.97 56.18 1l3i s LYS 9 Cb -0.18 -2.87 -0.02 0.00 -0.52 0.00 0.00 37.83 34.25 1l3i s LYS 9 CO 0.16 0.44 -0.23 1.21 -0.92 0.00 0.00 175.35 176.00 1l3i s ASN 10 N -3.04 2.77 0.39 2.83 3.84 -1.26 -5.05 114.94 115.41 1l3i s ASN 10 Ca 0.38 -0.44 0.11 0.00 0.21 0.00 0.00 52.86 53.12 1l3i s ASN 10 Cb -0.11 -0.45 0.89 0.00 -0.55 0.00 0.00 41.25 41.03 1l3i s ASN 10 CO 0.28 0.27 1.92 -0.65 -2.79 0.00 0.00 177.10 176.13 1l3i h PRO 11 N 5.73 0.57 -0.01 0.43 0.11 -1.99 -2.06 132.00 134.77 1l3i h PRO 11 Ca -0.38 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1l3i h PRO 11 Cb 1.14 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1l3i h PRO 11 CO 0.47 0.38 -0.12 -1.13 -0.21 0.00 0.00 178.00 177.39 1l3i n SER 12 N -4.50 1.25 -4.23 -2.05 3.41 -1.26 -4.87 113.62 101.38 1l3i n SER 12 Ca 0.14 -1.19 -0.34 0.00 -0.26 0.00 0.00 58.87 57.21 1l3i n SER 12 Cb 0.42 0.06 -0.15 0.00 -0.26 0.00 0.00 64.21 64.28 1l3i n SER 12 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1l3i s VAL 13 N -2.24 2.87 0.72 -3.33 1.01 -0.78 -4.99 120.40 113.67 1l3i s VAL 13 Ca 0.31 -0.76 -0.12 0.00 0.00 0.00 0.00 61.98 61.42 1l3i s VAL 13 Cb 0.20 -2.32 0.03 0.00 0.00 0.00 0.00 36.38 34.29 1l3i s VAL 13 CO 0.42 0.40 1.10 -2.16 0.00 0.00 0.00 175.10 174.86 1l3i s PRO 14 N 1.39 2.50 0.00 2.72 0.04 -1.26 -4.44 135.00 135.94 1l3i s PRO 14 Ca 0.04 1.24 0.00 0.00 0.04 0.00 0.00 61.00 62.32 1l3i s PRO 14 Cb -0.14 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.47 1l3i s PRO 14 CO -0.06 -1.46 0.00 0.41 0.04 0.00 0.00 177.00 175.92 1l3i n GLY 15 N -0.98 1.08 3.82 0.56 0.00 -1.26 -2.79 105.19 105.62 1l3i n GLY 15 Ca 0.09 -2.23 -0.31 0.00 0.00 0.00 0.00 46.02 43.57 1l3i n GLY 15 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1l3i s PRO 16 N -1.24 3.05 0.32 1.61 0.04 -1.26 -4.90 135.00 132.63 1l3i s PRO 16 Ca 0.00 0.97 -0.29 0.00 0.04 0.00 0.00 61.00 61.72 1l3i s PRO 16 Cb 0.00 -2.00 -0.11 0.00 0.04 0.00 0.00 34.50 32.43 1l3i s PRO 16 CO 0.00 -1.01 1.42 0.99 0.04 0.00 0.00 177.00 178.44 1l3i s THR 17 N -2.97 2.42 0.00 1.26 2.01 -1.26 -5.01 115.64 112.09 1l3i s THR 17 Ca 0.58 0.40 0.00 0.00 0.31 0.00 0.00 61.69 62.98 1l3i s THR 17 Cb -0.14 -3.25 0.00 0.00 0.01 0.00 0.00 72.50 69.12 1l3i s THR 17 CO 0.52 0.09 0.00 0.00 -0.69 0.00 0.00 174.62 174.54 1l3i n ALA 18 N 1.16 0.00 0.00 7.40 0.00 -1.26 -4.63 120.51 123.19 1l3i n ALA 18 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1l3i n ALA 18 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.85 1l3i n ALA 18 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1l3i n GLU 20 N 0.00 0.00 0.04 0.00 4.71 -1.26 -0.69 120.64 123.44 1l3i n GLU 20 Ca 0.00 0.00 -0.20 0.00 -0.01 0.00 0.00 57.16 56.95 1l3i n GLU 20 Cb 0.00 0.00 -0.12 0.00 -1.01 0.00 0.00 31.44 30.31 1l3i n GLU 20 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 1l3i h VAL 21 N 0.00 1.38 -0.43 2.62 2.07 -1.99 -2.65 116.25 117.24 1l3i h VAL 21 Ca 0.00 -2.27 -0.02 0.00 0.82 0.00 0.00 66.70 65.22 1l3i h VAL 21 Cb 0.00 2.68 -0.02 0.00 -1.52 0.00 0.00 31.29 32.43 1l3i h VAL 21 CO 0.00 0.67 0.17 0.03 0.02 0.00 0.00 177.57 178.47 1l3i h ARG 22 N 0.03 0.60 -0.15 1.57 3.08 -1.16 0.10 114.38 118.45 1l3i h ARG 22 Ca -0.12 -0.08 -0.00 0.00 0.07 0.00 0.00 59.98 59.85 1l3i h ARG 22 Cb 1.58 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 31.51 1l3i h ARG 22 CO 0.17 0.50 0.08 0.00 -1.07 0.00 0.00 179.97 179.65 1l3i h LEU 24 N 0.15 0.84 -1.39 0.00 5.85 -1.01 -1.89 115.31 117.85 1l3i h LEU 24 Ca 0.05 -0.30 0.00 0.00 0.84 0.00 0.00 57.88 58.47 1l3i h LEU 24 Cb 0.08 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 40.88 1l3i h LEU 24 CO -0.01 1.03 0.00 -0.38 -0.34 0.00 0.00 178.44 178.74 1l3i n ILE 25 N -4.11 0.00 0.00 4.05 5.41 0.29 -0.99 119.36 124.01 1l3i n ILE 25 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 1l3i n ILE 25 Cb 0.44 -0.13 0.00 0.00 -0.71 0.00 0.00 39.64 39.24 1l3i n ILE 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1l3i h LEU 28 N 0.00 0.59 -0.60 0.00 3.38 -1.35 -3.28 115.31 114.05 1l3i h LEU 28 Ca 0.00 -0.45 -0.15 0.00 0.09 0.00 0.00 57.88 57.36 1l3i h LEU 28 Cb 0.00 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1l3i h LEU 28 CO 0.00 1.25 -0.64 0.00 0.09 0.00 0.00 178.44 179.14 1l3i h ALA 29 N 0.72 0.80 -6.08 1.53 0.00 -0.76 -3.48 119.26 111.98 1l3i h ALA 29 Ca -0.08 -0.56 -0.35 0.00 0.00 0.00 0.00 54.91 53.92 1l3i h ALA 29 Cb 1.55 -0.08 0.07 0.00 0.00 0.00 0.00 17.79 19.33 1l3i h ALA 29 CO 0.16 0.75 -0.79 0.39 0.00 0.00 0.00 179.25 179.76 1l3i n GLU 30 N -3.85 -1.37 -1.71 0.00 1.02 -1.24 -4.86 120.64 108.63 1l3i n GLU 30 Ca -0.03 0.71 -0.43 0.00 -0.02 0.00 0.00 57.16 57.40 1l3i n GLU 30 Cb 0.64 -4.30 -0.03 0.00 -0.02 0.00 0.00 31.44 27.72 1l3i n GLU 30 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1l3i n PRO 31 N -3.47 2.65 -4.40 3.49 -0.02 -1.26 -5.02 135.00 126.97 1l3i n PRO 31 Ca -0.11 0.96 -0.29 0.00 -2.02 0.00 0.00 63.50 62.04 1l3i n PRO 31 Cb 0.59 -2.78 -0.13 0.00 -0.02 0.00 0.00 33.50 31.16 1l3i n PRO 31 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1l3i s GLY 32 N 1.07 1.59 0.35 -1.23 0.00 -1.26 -4.91 107.32 102.92 1l3i s GLY 32 Ca 0.75 -1.44 0.23 0.00 0.00 0.00 0.00 44.72 44.27 1l3i s GLY 32 CO 0.35 -1.41 1.72 0.50 0.00 0.00 0.00 173.10 174.25 1l3i h LYS 33 N 3.91 0.00 -0.33 2.90 1.57 -1.88 -0.75 116.57 121.99 1l3i h LYS 33 Ca -0.51 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.27 1l3i h LYS 33 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 1l3i h LYS 33 CO 0.41 0.00 0.00 0.09 -0.57 0.00 0.00 179.45 179.38 1l3i n ASN 34 N -2.32 3.44 -4.86 0.86 3.02 -1.26 -2.89 115.26 111.25 1l3i n ASN 34 Ca -0.01 -2.44 -0.33 0.00 -0.03 0.00 0.00 54.58 51.77 1l3i n ASN 34 Cb 0.05 -0.38 -0.06 0.00 -0.61 0.00 0.00 39.78 38.78 1l3i n ASN 34 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1l3i s ASP 35 N -1.36 6.74 -0.21 6.41 1.01 -0.29 -4.79 116.67 124.19 1l3i s ASP 35 Ca 0.33 1.15 -0.03 0.00 0.71 0.00 0.00 52.55 54.70 1l3i s ASP 35 Cb 0.22 -2.32 -0.01 0.00 1.01 0.00 0.00 42.92 41.83 1l3i s ASP 35 CO 0.14 -0.12 -0.07 -0.69 0.21 0.00 0.00 175.17 174.64 1l3i s VAL 36 N -1.85 3.18 0.21 -1.27 1.01 -1.26 -0.91 120.40 119.50 1l3i s VAL 36 Ca 0.50 -0.56 0.11 0.00 0.00 0.00 0.00 61.98 62.03 1l3i s VAL 36 Cb -0.11 -2.42 -0.05 0.00 0.00 0.00 0.00 36.38 33.80 1l3i s VAL 36 CO 0.19 0.45 -0.23 0.00 0.00 0.00 0.00 175.10 175.51 1l3i s ALA 37 N 1.33 2.53 -0.05 5.51 0.00 0.21 -0.43 121.76 130.85 1l3i s ALA 37 Ca 0.04 -1.67 0.03 0.00 0.00 0.00 0.00 51.96 50.35 1l3i s ALA 37 Cb -0.14 -0.30 0.01 0.00 0.00 0.00 0.00 23.12 22.68 1l3i s ALA 37 CO -0.04 0.39 -0.13 0.54 0.00 0.00 0.00 175.76 176.53 1l3i s VAL 38 N -1.85 1.13 -0.43 0.00 0.11 -0.43 -0.71 120.40 118.21 1l3i s VAL 38 Ca 0.22 -0.50 -0.03 0.00 -2.93 0.00 0.00 61.98 58.74 1l3i s VAL 38 Cb -0.07 -1.01 0.11 0.00 -1.53 0.00 0.00 36.38 33.88 1l3i s VAL 38 CO 0.10 0.35 0.23 -0.62 -3.33 0.00 0.00 175.10 171.83 1l3i s ASP 39 N 0.47 5.29 -0.38 3.54 2.15 0.45 -1.40 116.67 126.79 1l3i s ASP 39 Ca -0.11 -2.08 -0.29 0.00 0.43 0.00 0.00 52.55 50.51 1l3i s ASP 39 Cb -0.14 -1.85 0.02 0.00 -0.30 0.00 0.00 42.92 40.65 1l3i s ASP 39 CO 0.03 -0.55 1.19 -0.69 -0.17 0.00 0.00 175.17 174.99 1l3i s VAL 40 N 1.08 4.24 0.00 1.11 1.01 0.26 -1.53 120.40 126.57 1l3i s VAL 40 Ca 0.09 1.36 0.00 0.00 0.00 0.00 0.00 61.98 63.42 1l3i s VAL 40 Cb -0.23 -4.39 0.00 0.00 0.00 0.00 0.00 36.38 31.76 1l3i s VAL 40 CO -0.04 -0.70 0.00 0.61 0.00 0.00 0.00 175.10 174.97 1l3i n GLY 41 N 4.46 0.21 0.29 4.51 0.00 0.54 0.40 105.19 115.60 1l3i n GLY 41 Ca 0.13 -0.28 0.18 0.00 0.00 0.00 0.00 46.02 46.06 1l3i n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l3i n GLY 43 N -0.28 3.31 0.25 0.00 0.00 -1.26 -0.58 105.19 106.63 1l3i n GLY 43 Ca -0.00 0.17 0.14 0.00 0.00 0.00 0.00 46.02 46.32 1l3i n GLY 43 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1l3i h THR 44 N 0.00 0.15 0.00 2.61 2.02 -1.80 -3.37 112.91 112.52 1l3i h THR 44 Ca 0.00 -0.83 0.00 0.00 0.77 0.00 0.00 66.41 66.35 1l3i h THR 44 Cb 0.00 1.72 0.00 0.00 -1.74 0.00 0.00 68.15 68.13 1l3i h THR 44 CO 0.00 0.06 0.00 0.61 0.37 0.00 0.00 175.52 176.56 1l3i n GLY 45 N 0.38 1.03 0.24 2.16 0.00 0.26 -3.78 105.19 105.48 1l3i n GLY 45 Ca 0.01 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.06 1l3i n GLY 45 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1l3i h GLY 46 N 0.00 0.87 1.18 -0.02 0.00 -1.92 -0.38 103.07 102.80 1l3i h GLY 46 Ca 0.00 -0.05 -0.34 0.00 0.00 0.00 0.00 47.33 46.93 1l3i h GLY 46 CO 0.00 -0.12 -1.55 -2.08 0.00 0.00 0.00 176.54 172.79 1l3i h VAL 47 N 0.30 1.20 -0.60 4.60 2.07 -1.94 -3.31 116.25 118.58 1l3i h VAL 47 Ca 0.35 -2.66 0.03 0.00 0.82 0.00 0.00 66.70 65.24 1l3i h VAL 47 Cb 0.52 2.98 -0.04 0.00 -1.52 0.00 0.00 31.29 33.24 1l3i h VAL 47 CO -0.41 0.82 0.36 0.74 0.02 0.00 0.00 177.57 179.09 1l3i h THR 48 N 0.14 1.05 -0.63 2.57 2.02 -1.78 -1.64 112.91 114.65 1l3i h THR 48 Ca -0.28 -0.24 -0.01 0.00 0.77 0.00 0.00 66.41 66.65 1l3i h THR 48 Cb 2.16 0.29 -0.03 0.00 -1.74 0.00 0.00 68.15 68.83 1l3i h THR 48 CO 0.26 0.13 0.35 -0.07 0.37 0.00 0.00 175.52 176.55 1l3i h LEU 49 N 0.70 0.78 -0.47 2.58 4.07 -1.22 0.16 115.31 121.91 1l3i h LEU 49 Ca 0.24 -0.09 -0.06 0.00 0.08 0.00 0.00 57.88 58.06 1l3i h LEU 49 Cb 0.05 -0.20 -0.02 0.00 1.08 0.00 0.00 40.66 41.57 1l3i h LEU 49 CO -0.11 0.65 0.07 -0.33 -1.08 0.00 0.00 178.44 177.64 1l3i h GLU 50 N 0.85 0.78 -0.46 1.13 4.39 -1.58 -2.84 114.58 116.86 1l3i h GLU 50 Ca 0.22 -0.21 -0.11 0.00 0.34 0.00 0.00 59.36 59.59 1l3i h GLU 50 Cb 0.04 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.58 1l3i h GLU 50 CO -0.04 0.79 -0.17 -0.07 -1.16 0.00 0.00 179.01 178.37 1l3i h LEU 51 N 0.65 0.90 -0.64 1.33 3.38 -1.11 -3.18 115.31 116.64 1l3i h LEU 51 Ca 0.14 -0.31 0.12 0.00 0.09 0.00 0.00 57.88 57.92 1l3i h LEU 51 Cb 0.39 -0.25 -0.09 0.00 0.09 0.00 0.00 40.66 40.80 1l3i h LEU 51 CO 0.01 1.06 0.16 0.00 0.09 0.00 0.00 178.44 179.76 1l3i h ALA 52 N 1.01 0.79 -0.06 1.53 0.00 -0.45 -0.57 119.26 121.51 1l3i h ALA 52 Ca 0.12 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1l3i h ALA 52 Cb 0.71 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.67 1l3i h ALA 52 CO 0.05 -0.30 0.00 0.41 0.00 0.00 0.00 179.25 179.42 1l3i n GLY 53 N -1.33 -0.66 0.00 0.00 0.00 -1.13 -4.10 105.19 97.97 1l3i n GLY 53 Ca 0.10 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1l3i n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1l3i n ARG 54 N -0.40 2.52 -4.22 1.61 1.74 -0.33 -5.10 116.66 112.47 1l3i n ARG 54 Ca 0.09 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.88 1l3i n ARG 54 Cb 0.10 -0.79 -0.03 0.00 -1.02 0.00 0.00 32.46 30.72 1l3i n ARG 54 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1l3i s VAL 55 N -1.20 1.47 -0.11 1.55 -7.23 -0.53 -2.92 120.40 111.43 1l3i s VAL 55 Ca 0.00 -1.69 -0.27 0.00 -1.81 0.00 0.00 61.98 58.22 1l3i s VAL 55 Cb 0.00 -2.16 -0.23 0.00 0.56 0.00 0.00 36.38 34.55 1l3i s VAL 55 CO 0.00 0.00 0.83 -0.09 -0.31 0.00 0.00 175.10 175.53 1l3i h ARG 56 N 0.99 -0.01 -3.40 4.82 2.43 -0.89 -3.47 114.38 114.84 1l3i h ARG 56 Ca -0.40 0.00 -0.23 0.00 -0.81 0.00 0.00 59.98 58.55 1l3i h ARG 56 Cb 1.31 0.00 -0.29 0.00 -0.42 0.00 0.00 29.97 30.57 1l3i h ARG 56 CO 0.64 0.82 -0.61 0.50 -1.51 0.00 0.00 179.97 179.80 1l3i s ARG 57 N -2.63 0.09 -0.06 0.20 6.06 -1.16 -4.77 118.95 116.68 1l3i s ARG 57 Ca -0.17 0.23 0.06 0.00 -2.50 0.00 0.00 55.73 53.35 1l3i s ARG 57 Cb -0.02 -0.06 -0.01 0.00 0.06 0.00 0.00 34.95 34.92 1l3i s ARG 57 CO 0.64 -0.09 -0.24 0.08 -2.50 0.00 0.00 175.30 173.20 1l3i s VAL 58 N 0.57 2.00 -0.33 7.11 1.01 0.04 -0.62 120.40 130.17 1l3i s VAL 58 Ca -0.04 -1.03 -0.05 0.00 0.00 0.00 0.00 61.98 60.86 1l3i s VAL 58 Cb -0.06 -1.69 0.04 0.00 0.00 0.00 0.00 36.38 34.67 1l3i s VAL 58 CO -0.02 0.56 0.08 -0.31 0.00 0.00 0.00 175.10 175.40 1l3i s TYR 59 N -0.09 3.27 -0.29 5.22 1.51 0.11 -0.81 117.35 126.27 1l3i s TYR 59 Ca -0.05 -1.56 -0.10 0.00 -1.01 0.00 0.00 57.07 54.34 1l3i s TYR 59 Cb -0.14 -2.27 -0.03 0.00 -0.11 0.00 0.00 41.96 39.41 1l3i s TYR 59 CO 0.04 -0.76 0.17 0.00 -1.11 0.00 0.00 175.55 173.90 1l3i s ALA 60 N 1.36 3.43 0.04 3.71 0.00 -0.60 -0.41 121.76 129.28 1l3i s ALA 60 Ca -0.02 -1.19 0.05 0.00 0.00 0.00 0.00 51.96 50.80 1l3i s ALA 60 Cb -0.20 -2.43 -0.04 0.00 0.00 0.00 0.00 23.12 20.46 1l3i s ALA 60 CO 0.02 -0.66 -0.10 0.42 0.00 0.00 0.00 175.76 175.44 1l3i s ILE 61 N 1.71 3.42 -0.28 0.00 1.01 -0.59 -4.37 121.20 122.10 1l3i s ILE 61 Ca 0.06 -1.00 -0.23 0.00 0.00 0.00 0.00 60.65 59.49 1l3i s ILE 61 Cb -0.16 -2.52 0.11 0.00 0.01 0.00 0.00 42.46 39.90 1l3i s ILE 61 CO 0.09 0.29 0.92 -0.62 0.00 0.00 0.00 174.94 175.62 1l3i s ASP 62 N -1.68 -0.57 0.08 3.58 -1.08 -1.26 -0.34 116.67 115.40 1l3i s ASP 62 Ca 0.18 1.05 -0.21 0.00 -0.52 0.00 0.00 52.55 53.05 1l3i s ASP 62 Cb -0.11 1.11 -0.12 0.00 -1.46 0.00 0.00 42.92 42.34 1l3i s ASP 62 CO 0.09 -0.18 1.60 0.03 0.52 0.00 0.00 175.17 177.23 1l3i h ARG 63 N 4.92 0.20 -6.34 4.34 3.08 -1.92 -0.24 114.38 118.42 1l3i h ARG 63 Ca -0.29 -0.04 -0.57 0.00 0.07 0.00 0.00 59.98 59.16 1l3i h ARG 63 Cb 1.18 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 31.16 1l3i h ARG 63 CO 0.11 0.31 1.04 1.21 -1.07 0.00 0.00 179.97 181.57 1l3i s ASN 64 N -5.54 6.54 0.57 7.04 3.04 -1.26 -4.38 114.94 120.94 1l3i s ASN 64 Ca -0.14 1.32 0.28 0.00 0.04 0.00 0.00 52.86 54.36 1l3i s ASN 64 Cb 0.06 -2.54 1.70 0.00 -1.54 0.00 0.00 41.25 38.93 1l3i s ASN 64 CO 0.70 -1.18 2.21 1.55 -3.04 0.00 0.00 177.10 177.34 1l3i h PRO 65 N 9.93 0.00 0.00 0.43 0.13 -2.00 0.17 132.00 140.66 1l3i h PRO 65 Ca -0.29 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.78 1l3i h PRO 65 Cb 1.12 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.24 1l3i h PRO 65 CO 1.03 0.03 -0.31 0.93 -0.23 0.00 0.00 178.00 179.44 1l3i h GLU 66 N 0.00 0.00 0.09 0.86 4.39 -1.97 -1.41 114.58 116.54 1l3i h GLU 66 Ca -0.00 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.48 1l3i h GLU 66 Cb 0.07 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 28.74 1l3i h GLU 66 CO 0.00 0.31 -0.91 0.00 -1.16 0.00 0.00 179.01 177.25 1l3i h ALA 67 N 1.69 -0.01 -0.81 3.43 0.00 -1.24 -2.53 119.26 119.80 1l3i h ALA 67 Ca -0.00 -0.68 -0.00 0.00 0.00 0.00 0.00 54.91 54.22 1l3i h ALA 67 Cb 0.91 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.74 1l3i h ALA 67 CO 0.04 0.48 0.50 0.82 0.00 0.00 0.00 179.25 181.09 1l3i h ILE 68 N -0.03 1.22 -0.51 0.00 1.08 -1.21 -0.81 117.51 117.25 1l3i h ILE 68 Ca -0.14 -0.47 -0.04 0.00 -0.39 0.00 0.00 64.86 63.82 1l3i h ILE 68 Cb 1.64 0.08 -0.02 0.00 -3.07 0.00 0.00 36.82 35.45 1l3i h ILE 68 CO 0.17 0.23 0.16 -1.28 -0.69 0.00 0.00 178.15 176.74 1l3i h SER 69 N 1.11 0.74 -0.32 1.72 0.87 -1.31 -1.85 113.55 114.50 1l3i h SER 69 Ca 0.29 -0.21 -0.17 0.00 -1.23 0.00 0.00 61.79 60.48 1l3i h SER 69 Cb -0.06 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 61.70 1l3i h SER 69 CO -0.06 0.75 -0.44 0.74 -0.53 0.00 0.00 176.83 177.30 1l3i h THR 70 N 0.69 1.27 -0.70 2.23 2.02 -1.16 -2.98 112.91 114.29 1l3i h THR 70 Ca 0.16 -1.62 -0.07 0.00 0.77 0.00 0.00 66.41 65.65 1l3i h THR 70 Cb 0.28 1.47 -0.03 0.00 -1.74 0.00 0.00 68.15 68.13 1l3i h THR 70 CO -0.00 0.53 0.15 0.74 0.37 0.00 0.00 175.52 177.31 1l3i h THR 71 N 0.71 1.26 0.00 3.16 2.02 -1.14 -1.07 112.91 117.86 1l3i h THR 71 Ca 0.05 -1.01 0.00 0.00 0.77 0.00 0.00 66.41 66.22 1l3i h THR 71 Cb 1.03 0.57 0.00 0.00 -1.74 0.00 0.00 68.15 68.01 1l3i h THR 71 CO 0.10 0.38 0.00 1.21 0.37 0.00 0.00 175.52 177.59 1l3i n GLU 72 N -4.22 0.36 0.00 6.66 4.07 -0.70 -1.83 120.64 124.98 1l3i n GLU 72 Ca 0.05 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.15 1l3i n GLU 72 Cb 0.28 -1.27 0.00 0.00 -0.06 0.00 0.00 31.44 30.39 1l3i n GLU 72 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1l3i n ASN 74 N 0.62 0.00 0.22 4.31 3.02 -0.40 -2.32 115.26 120.72 1l3i n ASN 74 Ca 0.00 0.00 -0.15 0.00 -0.03 0.00 0.00 54.58 54.40 1l3i n ASN 74 Cb 0.14 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.23 1l3i n ASN 74 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1l3i h LEU 75 N 0.00 -0.46 -0.35 3.41 3.38 -1.62 -2.04 115.31 117.63 1l3i h LEU 75 Ca 0.00 -0.07 0.07 0.00 0.09 0.00 0.00 57.88 57.97 1l3i h LEU 75 Cb 0.00 0.12 -0.07 0.00 0.09 0.00 0.00 40.66 40.80 1l3i h LEU 75 CO 0.00 -0.21 -0.08 1.56 0.09 0.00 0.00 178.44 179.81 1l3i h GLN 76 N -0.71 0.01 -0.45 1.13 1.08 -1.51 0.22 115.11 114.88 1l3i h GLN 76 Ca -0.06 -0.00 0.11 0.00 -1.45 0.00 0.00 58.65 57.25 1l3i h GLN 76 Cb 0.51 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.91 1l3i h GLN 76 CO 0.09 0.01 0.31 0.00 -0.95 0.00 0.00 178.83 178.29 1l3i h ARG 77 N 0.01 0.12 -0.52 1.46 3.08 -1.81 0.16 114.38 116.88 1l3i h ARG 77 Ca 0.17 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.21 1l3i h ARG 77 Cb 0.26 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.28 1l3i h ARG 77 CO -0.35 0.08 0.00 0.72 -1.07 0.00 0.00 179.97 179.35 1l3i n HIS 78 N -4.44 1.65 -2.97 3.04 8.25 0.31 -4.95 115.22 116.12 1l3i n HIS 78 Ca 0.07 -0.73 -0.22 0.00 -0.26 0.00 0.00 57.72 56.59 1l3i n HIS 78 Cb 0.43 -0.39 0.02 0.00 1.12 0.00 0.00 29.99 31.17 1l3i n HIS 78 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1l3i n GLY 79 N 0.49 -0.51 3.67 -1.41 0.00 0.54 -4.99 105.19 102.97 1l3i n GLY 79 Ca 0.25 0.10 -0.30 0.00 0.00 0.00 0.00 46.02 46.08 1l3i n GLY 79 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1l3i s LEU 80 N -6.53 2.40 0.00 0.99 1.43 0.49 -4.93 118.68 112.53 1l3i s LEU 80 Ca 0.27 -1.56 0.00 0.00 -1.03 0.00 0.00 54.13 51.81 1l3i s LEU 80 Cb -0.12 -0.66 0.00 0.00 0.03 0.00 0.00 46.19 45.43 1l3i s LEU 80 CO 0.33 -0.74 0.00 0.61 0.23 0.00 0.00 176.35 176.78 1l3i n GLY 81 N -1.09 0.99 0.23 -3.19 0.00 -1.26 -3.54 105.19 97.33 1l3i n GLY 81 Ca -0.12 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.03 1l3i n GLY 81 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1l3i h ASP 82 N 0.00 0.00 -0.32 1.61 2.03 -1.97 -2.90 116.42 114.87 1l3i h ASP 82 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1l3i h ASP 82 Cb 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 1l3i h ASP 82 CO 0.00 0.00 0.00 -0.46 -1.03 0.00 0.00 179.24 177.75 1l3i n ASN 83 N -3.09 3.46 -4.38 4.15 6.94 -1.26 -4.95 115.26 116.13 1l3i n ASN 83 Ca 0.03 -2.50 -0.35 0.00 -0.02 0.00 0.00 54.58 51.75 1l3i n ASN 83 Cb 0.48 -0.39 -0.13 0.00 -2.36 0.00 0.00 39.78 37.38 1l3i n ASN 83 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1l3i s VAL 84 N -1.89 3.56 -0.44 3.53 1.01 -1.10 -0.78 120.40 124.30 1l3i s VAL 84 Ca 0.33 -0.45 -0.11 0.00 0.00 0.00 0.00 61.98 61.76 1l3i s VAL 84 Cb 0.23 -2.60 0.08 0.00 0.00 0.00 0.00 36.38 34.10 1l3i s VAL 84 CO 0.13 0.44 0.30 -0.89 0.00 0.00 0.00 175.10 175.08 1l3i s THR 85 N 1.10 4.47 0.71 3.92 2.01 0.01 -4.97 115.64 122.89 1l3i s THR 85 Ca 0.01 -1.35 -0.12 0.00 0.31 0.00 0.00 61.69 60.54 1l3i s THR 85 Cb -0.15 -3.74 0.17 0.00 0.01 0.00 0.00 72.50 68.79 1l3i s THR 85 CO 0.00 -0.55 0.94 0.18 -0.69 0.00 0.00 174.62 174.50 1l3i n LEU 86 N 4.99 0.00 -3.74 4.42 4.77 -1.26 -1.56 117.00 124.61 1l3i n LEU 86 Ca -0.10 -1.03 -0.12 0.00 -0.03 0.00 0.00 56.01 54.72 1l3i n LEU 86 Cb 0.43 -0.73 -0.11 0.00 -2.33 0.00 0.00 43.42 40.68 1l3i n LEU 86 CO 0.41 -1.23 -0.01 -0.70 -1.33 0.00 0.00 177.39 174.54 1l3i s GLU 88 N -5.06 0.37 0.00 3.23 2.12 -1.26 -4.94 118.70 113.16 1l3i s GLU 88 Ca 0.54 0.53 0.00 0.00 0.36 0.00 0.00 54.97 56.39 1l3i s GLU 88 Cb -0.02 0.11 0.00 0.00 0.26 0.00 0.00 34.13 34.49 1l3i s GLU 88 CO 0.38 -0.08 0.00 0.41 -0.54 0.00 0.00 175.26 175.43 1l3i n GLY 89 N 3.30 2.67 3.74 -1.50 0.00 -0.10 -4.92 105.19 108.39 1l3i n GLY 89 Ca -0.16 -1.71 -0.41 0.00 0.00 0.00 0.00 46.02 43.74 1l3i n GLY 89 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1l3i s ASP 90 N 0.00 6.96 0.24 1.61 2.15 -1.26 -2.99 116.67 123.38 1l3i s ASP 90 Ca 0.00 2.38 -0.08 0.00 0.43 0.00 0.00 52.55 55.27 1l3i s ASP 90 Cb 0.00 -2.61 0.39 0.00 -0.30 0.00 0.00 42.92 40.39 1l3i s ASP 90 CO 0.00 -0.45 1.64 0.00 -0.17 0.00 0.00 175.17 176.18 1l3i h ALA 91 N 4.98 0.71 -0.28 3.66 0.00 -1.95 -2.88 119.26 123.50 1l3i h ALA 91 Ca -0.45 0.23 0.03 0.00 0.00 0.00 0.00 54.91 54.72 1l3i h ALA 91 Cb 1.22 0.41 -0.03 0.00 0.00 0.00 0.00 17.79 19.38 1l3i h ALA 91 CO 0.74 -0.42 0.08 -1.35 0.00 0.00 0.00 179.25 178.31 1l3i h PRO 92 N 0.09 0.19 -0.83 0.00 0.11 -1.95 0.29 132.00 129.90 1l3i h PRO 92 Ca 0.39 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.45 1l3i h PRO 92 Cb 0.66 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 31.69 1l3i h PRO 92 CO -0.64 0.13 0.38 1.05 -0.21 0.00 0.00 178.00 178.70 1l3i h GLU 93 N 0.20 1.21 -0.29 1.05 -0.00 -1.92 -2.83 114.58 111.99 1l3i h GLU 93 Ca 0.13 -0.19 -0.14 0.00 -0.00 0.00 0.00 59.36 59.16 1l3i h GLU 93 Cb 0.11 -0.21 -0.00 0.00 -0.00 0.00 0.00 28.75 28.65 1l3i h GLU 93 CO -0.14 0.94 -0.36 0.00 -0.00 0.00 0.00 179.01 179.44 1l3i h ALA 94 N 1.22 0.44 -0.46 1.06 0.00 -1.28 -3.08 119.26 117.15 1l3i h ALA 94 Ca 0.28 -0.44 0.06 0.00 0.00 0.00 0.00 54.91 54.81 1l3i h ALA 94 Cb 0.15 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1l3i h ALA 94 CO -0.03 0.51 0.31 -0.07 0.00 0.00 0.00 179.25 179.97 1l3i h LEU 95 N 0.52 0.34 -1.31 0.00 3.38 -0.27 -1.23 115.31 116.74 1l3i h LEU 95 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1l3i h LEU 95 Cb 0.95 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.63 1l3i h LEU 95 CO 0.09 0.22 0.00 0.00 0.09 0.00 0.00 178.44 178.84 1l3i n LYS 97 N -3.04 0.19 -3.35 0.00 5.02 -0.47 -4.94 118.16 111.58 1l3i n LYS 97 Ca 0.01 0.04 -0.24 0.00 -2.02 0.00 0.00 58.31 56.10 1l3i n LYS 97 Cb 0.32 -1.61 -0.01 0.00 -0.02 0.00 0.00 35.03 33.70 1l3i n LYS 97 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 1l3i s ILE 98 N -3.12 5.09 0.38 -0.18 -4.36 -1.18 -5.10 121.20 112.74 1l3i s ILE 98 Ca 0.07 -0.40 -0.06 0.00 -0.26 0.00 0.00 60.65 60.00 1l3i s ILE 98 Cb 0.15 -3.85 0.09 0.00 1.25 0.00 0.00 42.46 40.10 1l3i s ILE 98 CO 0.72 -0.55 0.39 -0.81 0.24 0.00 0.00 174.94 174.93 1l3i n PRO 99 N -1.73 -1.29 -2.13 0.37 -0.04 -1.26 -5.00 135.00 123.92 1l3i n PRO 99 Ca -0.04 -0.62 -0.35 0.00 -0.04 0.00 0.00 63.50 62.45 1l3i n PRO 99 Cb 0.56 -0.51 0.02 0.00 -0.04 0.00 0.00 33.50 33.52 1l3i n PRO 99 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1l3i s ASP 100 N -2.53 5.51 0.17 3.54 1.01 -1.26 -5.04 116.67 118.07 1l3i s ASP 100 Ca 0.24 2.20 0.11 0.00 0.71 0.00 0.00 52.55 55.81 1l3i s ASP 100 Cb -0.02 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.29 1l3i s ASP 100 CO 0.18 -1.37 -0.22 0.27 0.21 0.00 0.00 175.17 174.24 1l3i s ILE 101 N -1.81 2.48 -0.19 0.77 -4.36 -0.32 -4.85 121.20 112.92 1l3i s ILE 101 Ca 0.73 -1.89 0.15 0.00 -0.26 0.00 0.00 60.65 59.38 1l3i s ILE 101 Cb -0.25 -2.18 -0.24 0.00 1.25 0.00 0.00 42.46 41.05 1l3i s ILE 101 CO 0.30 -0.06 0.08 0.47 0.24 0.00 0.00 174.94 175.97 1l3i n ASP 102 N 0.40 0.37 -3.97 4.36 8.00 0.43 -0.49 116.55 125.65 1l3i n ASP 102 Ca -0.14 0.02 -0.19 0.00 0.71 0.00 0.00 54.79 55.19 1l3i n ASP 102 Cb 0.55 0.70 -0.15 0.00 -0.02 0.00 0.00 41.12 42.20 1l3i n ASP 102 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1l3i s ILE 103 N -2.50 0.64 -0.12 0.53 1.01 -1.02 -0.69 121.20 119.05 1l3i s ILE 103 Ca -0.13 -0.28 -0.02 0.00 0.00 0.00 0.00 60.65 60.22 1l3i s ILE 103 Cb 0.07 -0.59 0.04 0.00 0.01 0.00 0.00 42.46 41.99 1l3i s ILE 103 CO 0.80 0.21 -0.00 0.00 0.00 0.00 0.00 174.94 175.95 1l3i s ALA 104 N 0.24 0.90 -0.20 9.38 0.00 -0.06 -1.32 121.76 130.70 1l3i s ALA 104 Ca -0.03 -0.38 -0.03 0.00 0.00 0.00 0.00 51.96 51.52 1l3i s ALA 104 Cb -0.08 -0.91 -0.01 0.00 0.00 0.00 0.00 23.12 22.12 1l3i s ALA 104 CO 0.00 -0.68 -0.07 0.08 0.00 0.00 0.00 175.76 175.10 1l3i s VAL 105 N 1.89 3.25 -0.50 0.00 1.01 -0.50 -0.84 120.40 124.72 1l3i s VAL 105 Ca 0.03 -0.54 -0.14 0.00 0.00 0.00 0.00 61.98 61.33 1l3i s VAL 105 Cb -0.14 -2.46 0.11 0.00 0.00 0.00 0.00 36.38 33.90 1l3i s VAL 105 CO -0.07 0.45 0.43 -0.69 0.00 0.00 0.00 175.10 175.22 1l3i s VAL 106 N 1.27 4.92 -0.90 2.92 1.01 0.10 -0.57 120.40 129.15 1l3i s VAL 106 Ca 0.03 -1.47 0.25 0.00 0.00 0.00 0.00 61.98 60.80 1l3i s VAL 106 Cb -0.14 -4.11 0.05 0.00 0.00 0.00 0.00 36.38 32.17 1l3i s VAL 106 CO -0.03 -0.76 1.46 0.61 0.00 0.00 0.00 175.10 176.39 1l3i n GLY 107 N 5.14 -1.33 3.64 4.51 0.00 0.16 -1.80 105.19 115.51 1l3i n GLY 107 Ca -0.12 -0.28 -0.09 0.00 0.00 0.00 0.00 46.02 45.53 1l3i n GLY 107 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1l3i s GLY 108 N -3.18 -0.15 -0.01 -0.02 0.00 -1.06 -4.89 107.32 98.00 1l3i s GLY 108 Ca 0.10 2.70 0.02 0.00 0.00 0.00 0.00 44.72 47.54 1l3i s GLY 108 CO 0.68 1.88 0.04 -1.14 0.00 0.00 0.00 173.10 174.56 1l3i n SER 109 N 2.33 4.44 -3.30 1.64 3.41 -1.26 -4.44 113.62 116.45 1l3i n SER 109 Ca -0.13 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 58.25 1l3i n SER 109 Cb 0.56 0.91 0.01 0.00 -0.26 0.00 0.00 64.21 65.43 1l3i n SER 109 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1l3i n GLY 110 N 2.54 -0.50 0.91 5.00 0.00 -1.26 -1.30 105.19 110.59 1l3i n GLY 110 Ca -0.02 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1l3i n GLY 110 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l3i n GLY 111 N -1.32 0.98 1.33 -0.02 0.00 -1.26 -4.91 105.19 99.99 1l3i n GLY 111 Ca -0.04 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.92 1l3i n GLY 111 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1l3i n GLU 112 N -2.00 2.15 -0.01 1.61 1.02 -0.42 -4.78 120.64 118.22 1l3i n GLU 112 Ca 0.00 -3.11 -0.11 0.00 -0.02 0.00 0.00 57.16 53.93 1l3i n GLU 112 Cb 0.00 -1.90 -0.04 0.00 -0.02 0.00 0.00 31.44 29.48 1l3i n GLU 112 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1l3i h LEU 113 N 1.20 -1.05 -0.51 -4.62 5.85 -1.92 -0.69 115.31 113.58 1l3i h LEU 113 Ca 0.26 0.15 0.09 0.00 0.84 0.00 0.00 57.88 59.22 1l3i h LEU 113 Cb 1.85 0.45 -0.08 0.00 0.37 0.00 0.00 40.66 43.25 1l3i h LEU 113 CO 0.49 -0.37 0.07 -0.61 -0.34 0.00 0.00 178.44 177.69 1l3i h GLN 114 N -0.40 0.19 -0.18 1.25 4.15 -1.93 0.10 115.11 118.30 1l3i h GLN 114 Ca 0.10 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.50 1l3i h GLN 114 Cb 0.56 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.20 1l3i h GLN 114 CO -0.37 0.13 0.08 1.49 -1.93 0.00 0.00 178.83 178.22 1l3i h GLU 115 N 0.20 0.26 -0.74 1.69 4.81 -1.85 -1.04 114.58 117.91 1l3i h GLU 115 Ca 0.26 -0.04 0.05 0.00 -0.13 0.00 0.00 59.36 59.49 1l3i h GLU 115 Cb 0.36 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.65 1l3i h GLU 115 CO -0.36 0.32 0.45 0.82 -0.73 0.00 0.00 179.01 179.50 1l3i h ILE 116 N 0.15 1.04 -0.25 2.32 2.04 -0.60 -1.88 117.51 120.34 1l3i h ILE 116 Ca 0.06 -0.29 -0.16 0.00 1.00 0.00 0.00 64.86 65.47 1l3i h ILE 116 Cb 0.15 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.35 1l3i h ILE 116 CO -0.01 0.15 -0.50 -0.07 0.00 0.00 0.00 178.15 177.72 1l3i h LEU 117 N 0.84 0.75 -0.35 1.44 3.38 -0.61 -1.01 115.31 119.75 1l3i h LEU 117 Ca 0.31 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1l3i h LEU 117 Cb 0.11 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1l3i h LEU 117 CO -0.15 1.12 0.19 0.03 0.09 0.00 0.00 178.44 179.72 1l3i h ARG 118 N 0.54 0.50 -0.56 1.13 3.08 -0.92 -1.48 114.38 116.66 1l3i h ARG 118 Ca 0.02 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 59.98 1l3i h ARG 118 Cb 1.06 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.99 1l3i h ARG 118 CO 0.10 0.42 0.23 0.82 -1.07 0.00 0.00 179.97 180.47 1l3i h ILE 119 N 0.44 1.22 -0.61 2.04 2.04 -1.25 -2.51 117.51 118.89 1l3i h ILE 119 Ca 0.12 -0.69 0.01 0.00 1.00 0.00 0.00 64.86 65.31 1l3i h ILE 119 Cb 0.07 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 1l3i h ILE 119 CO -0.02 0.27 0.39 0.40 0.00 0.00 0.00 178.15 179.19 1l3i h ILE 120 N 0.77 1.12 -0.54 -0.67 2.04 -0.90 -2.43 117.51 116.90 1l3i h ILE 120 Ca 0.19 -0.27 0.02 0.00 1.00 0.00 0.00 64.86 65.80 1l3i h ILE 120 Cb 0.20 0.26 -0.03 0.00 -0.74 0.00 0.00 36.82 36.51 1l3i h ILE 120 CO -0.02 0.14 0.33 0.50 0.00 0.00 0.00 178.15 179.11 1l3i h LYS 121 N 0.79 0.65 0.00 2.37 3.64 -1.07 -0.49 116.57 122.46 1l3i h LYS 121 Ca 0.23 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.57 1l3i h LYS 121 Cb -0.05 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 31.63 1l3i h LYS 121 CO -0.07 0.43 -0.01 -0.44 -2.27 0.00 0.00 179.45 177.09 1l3i h ASP 122 N 0.66 0.00 -0.08 4.20 3.32 -1.00 -2.85 116.42 120.67 1l3i h ASP 122 Ca 0.21 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.26 1l3i h ASP 122 Cb -0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1l3i h ASP 122 CO -0.08 0.01 0.00 0.29 -1.72 0.00 0.00 179.24 177.74 1l3i n LYS 123 N -3.23 0.95 -2.63 3.56 5.02 -0.61 -5.02 118.16 116.20 1l3i n LYS 123 Ca -0.02 -1.27 -0.42 0.00 -2.02 0.00 0.00 58.31 54.57 1l3i n LYS 123 Cb 0.11 -1.18 -0.03 0.00 -0.02 0.00 0.00 35.03 33.92 1l3i n LYS 123 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1l3i s LEU 124 N -0.81 4.27 0.84 -0.35 2.96 -0.29 -1.17 118.68 124.13 1l3i s LEU 124 Ca 0.12 1.63 -0.11 0.00 -0.22 0.00 0.00 54.13 55.56 1l3i s LEU 124 Cb 0.08 -3.56 0.09 0.00 0.50 0.00 0.00 46.19 43.30 1l3i s LEU 124 CO 0.11 -0.46 1.10 -0.54 -1.32 0.00 0.00 176.35 175.24 1l3i s LYS 125 N 1.92 1.73 0.25 1.98 1.02 0.36 -4.89 119.74 122.11 1l3i s LYS 125 Ca 0.51 1.15 -0.30 0.00 0.02 0.00 0.00 55.97 57.34 1l3i s LYS 125 Cb -0.20 -1.84 -0.11 0.00 -0.52 0.00 0.00 37.83 35.16 1l3i s LYS 125 CO 0.20 -2.01 1.55 -2.14 -0.92 0.00 0.00 175.35 172.04 1l3i s PRO 126 N -4.85 4.19 0.00 -1.68 0.02 -1.26 -1.61 135.00 129.81 1l3i s PRO 126 Ca 0.63 2.45 0.00 0.00 0.02 0.00 0.00 61.00 64.10 1l3i s PRO 126 Cb -0.18 -3.08 0.00 0.00 0.02 0.00 0.00 34.50 31.25 1l3i s PRO 126 CO 0.57 -0.57 0.00 0.41 -0.33 0.00 0.00 177.00 177.08 1l3i n GLY 127 N 2.65 0.67 3.79 0.52 0.00 -1.26 -5.04 105.19 106.52 1l3i n GLY 127 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 1l3i n GLY 127 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1l3i s GLY 128 N -1.96 1.95 -0.04 -0.02 0.00 -0.63 -4.92 107.32 101.70 1l3i s GLY 128 Ca 0.00 0.34 0.07 0.00 0.00 0.00 0.00 44.72 45.13 1l3i s GLY 128 CO 0.00 0.67 -0.24 0.50 0.00 0.00 0.00 173.10 174.03 1l3i s ARG 129 N -4.44 2.26 -0.08 2.90 0.52 0.13 -4.73 118.95 115.53 1l3i s ARG 129 Ca 0.63 -0.88 0.05 0.00 -0.52 0.00 0.00 55.73 55.00 1l3i s ARG 129 Cb -0.17 -2.03 -0.01 0.00 0.52 0.00 0.00 34.95 33.26 1l3i s ARG 129 CO 0.45 0.44 -0.22 0.42 0.02 0.00 0.00 175.30 176.41 1l3i s ILE 130 N -0.34 2.29 -0.06 1.52 1.01 -1.26 -0.89 121.20 123.47 1l3i s ILE 130 Ca 0.02 -0.97 -0.01 0.00 0.00 0.00 0.00 60.65 59.69 1l3i s ILE 130 Cb -0.12 -1.87 0.03 0.00 0.01 0.00 0.00 42.46 40.51 1l3i s ILE 130 CO 0.02 0.56 0.01 -0.63 0.00 0.00 0.00 174.94 174.90 1l3i s ILE 131 N -0.03 0.28 -0.17 2.92 1.01 -0.02 -1.95 121.20 123.24 1l3i s ILE 131 Ca -0.07 0.18 -0.04 0.00 0.00 0.00 0.00 60.65 60.72 1l3i s ILE 131 Cb -0.15 -0.45 -0.03 0.00 0.01 0.00 0.00 42.46 41.84 1l3i s ILE 131 CO 0.05 0.24 -0.02 -0.69 0.00 0.00 0.00 174.94 174.52 1l3i s VAL 132 N 1.97 3.91 -0.32 2.92 1.01 0.46 -0.72 120.40 129.63 1l3i s VAL 132 Ca 0.04 -0.34 -0.16 0.00 0.00 0.00 0.00 61.98 61.52 1l3i s VAL 132 Cb -0.12 -2.73 -0.02 0.00 0.00 0.00 0.00 36.38 33.51 1l3i s VAL 132 CO -0.05 0.47 0.42 -0.89 0.00 0.00 0.00 175.10 175.06 1l3i s THR 133 N 0.60 5.12 -0.16 3.92 2.01 -0.75 -0.92 115.64 125.46 1l3i s THR 133 Ca -0.02 0.34 0.01 0.00 0.31 0.00 0.00 61.69 62.34 1l3i s THR 133 Cb -0.14 -3.83 0.01 0.00 0.01 0.00 0.00 72.50 68.55 1l3i s THR 133 CO 0.02 -0.05 -0.20 0.00 -0.69 0.00 0.00 174.62 173.71 1l3i s ALA 134 N 2.17 2.33 -0.02 7.40 0.00 0.11 -4.74 121.76 129.01 1l3i s ALA 134 Ca 0.15 -1.14 0.12 0.00 0.00 0.00 0.00 51.96 51.09 1l3i s ALA 134 Cb -0.16 -1.12 -0.18 0.00 0.00 0.00 0.00 23.12 21.66 1l3i s ALA 134 CO 0.12 -0.16 0.25 0.44 0.00 0.00 0.00 175.76 176.40 1l3i n ILE 135 N 4.30 0.04 -3.40 0.00 -5.35 -1.26 -1.39 119.36 112.29 1l3i n ILE 135 Ca -0.20 -0.28 -0.38 0.00 -0.27 0.00 0.00 62.75 61.62 1l3i n ILE 135 Cb 0.51 0.19 -0.06 0.00 -1.74 0.00 0.00 39.64 38.54 1l3i n ILE 135 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1l3i s LEU 136 N -3.87 4.40 0.29 7.28 1.43 -1.26 -4.97 118.68 121.99 1l3i s LEU 136 Ca -0.04 0.94 0.02 0.00 -1.03 0.00 0.00 54.13 54.02 1l3i s LEU 136 Cb 0.07 -2.67 0.58 0.00 0.03 0.00 0.00 46.19 44.20 1l3i s LEU 136 CO 0.49 0.19 1.85 0.25 0.23 0.00 0.00 176.35 179.36 1l3i h LEU 137 N 5.48 0.90 -0.73 1.79 5.85 -2.01 -1.59 115.31 125.00 1l3i h LEU 137 Ca -0.47 0.04 -0.07 0.00 0.84 0.00 0.00 57.88 58.22 1l3i h LEU 137 Cb 1.20 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 42.06 1l3i h LEU 137 CO 0.67 0.49 0.20 -0.33 -0.34 0.00 0.00 178.44 179.14 1l3i h GLU 138 N 0.97 1.16 -0.54 1.25 3.07 -2.00 -2.58 114.58 115.92 1l3i h GLU 138 Ca 0.47 -0.27 -0.06 0.00 -0.50 0.00 0.00 59.36 59.01 1l3i h GLU 138 Cb 0.46 -0.16 -0.02 0.00 -0.84 0.00 0.00 28.75 28.19 1l3i h GLU 138 CO -0.24 1.00 0.11 1.15 -1.40 0.00 0.00 179.01 179.63 1l3i h THR 139 N 1.10 1.23 -0.68 1.13 2.02 -1.71 0.25 112.91 116.26 1l3i h THR 139 Ca 0.23 -0.87 -0.03 0.00 0.77 0.00 0.00 66.41 66.52 1l3i h THR 139 Cb 0.35 0.70 -0.03 0.00 -1.74 0.00 0.00 68.15 67.43 1l3i h THR 139 CO -0.00 0.32 0.31 0.11 0.37 0.00 0.00 175.52 176.63 1l3i h LYS 140 N 0.81 0.99 -0.01 6.66 1.57 -1.07 0.76 116.57 126.29 1l3i h LYS 140 Ca 0.17 -0.15 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1l3i h LYS 140 Cb 0.33 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.47 1l3i h LYS 140 CO 0.00 0.79 -0.01 0.35 -0.57 0.00 0.00 179.45 180.02 1l3i h PHE 141 N 0.95 0.02 -0.85 -1.35 3.57 -1.16 -3.28 116.94 114.84 1l3i h PHE 141 Ca 0.23 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.76 1l3i h PHE 141 Cb 0.14 -0.00 -0.05 0.00 2.79 0.00 0.00 35.95 38.82 1l3i h PHE 141 CO 0.01 0.53 0.55 1.49 -2.23 0.00 0.00 178.31 178.65 1l3i h GLU 142 N -0.49 1.03 -0.70 1.11 4.57 -0.41 -1.31 114.58 118.38 1l3i h GLU 142 Ca 0.00 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 1l3i h GLU 142 Cb 0.52 -0.23 0.00 0.00 -0.16 0.00 0.00 28.75 28.88 1l3i h GLU 142 CO 0.00 0.68 0.00 0.00 -1.18 0.00 0.00 179.01 178.51 1l3i n ALA 143 N -2.34 1.65 0.00 2.92 0.00 0.25 -1.64 120.51 121.35 1l3i n ALA 143 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1l3i n ALA 143 Cb 0.09 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.54 1l3i n ALA 143 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1l3i n GLU 145 N 0.44 0.00 0.07 0.00 2.13 -0.50 -1.53 120.64 121.26 1l3i n GLU 145 Ca 0.00 0.00 -0.12 0.00 0.66 0.00 0.00 57.16 57.70 1l3i n GLU 145 Cb 0.12 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 31.78 1l3i n GLU 145 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1l3i h LEU 147 N -0.49 1.01 -0.17 0.00 3.38 -1.51 -0.18 115.31 117.35 1l3i h LEU 147 Ca 0.06 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1l3i h LEU 147 Cb 0.57 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1l3i h LEU 147 CO -0.26 0.62 0.05 0.03 0.09 0.00 0.00 178.44 178.97 1l3i h ARG 148 N 1.13 0.26 -0.09 1.13 3.08 -1.65 -1.43 114.38 116.81 1l3i h ARG 148 Ca 0.45 -0.06 0.03 0.00 0.07 0.00 0.00 59.98 60.47 1l3i h ARG 148 Cb 0.25 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.26 1l3i h ARG 148 CO -0.19 0.39 0.11 -0.44 -1.07 0.00 0.00 179.97 178.76 1l3i h ASP 149 N 0.09 0.00 -0.25 7.04 3.32 -0.03 0.29 116.42 126.88 1l3i h ASP 149 Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1l3i h ASP 149 Cb 0.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.79 1l3i h ASP 149 CO -0.00 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.70 1l3i n LEU 150 N -3.80 1.85 0.00 1.55 4.77 -0.17 -4.93 117.00 116.27 1l3i n LEU 150 Ca -0.01 -0.83 0.00 0.00 -0.03 0.00 0.00 56.01 55.14 1l3i n LEU 150 Cb 0.21 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1l3i n LEU 150 CO 0.27 0.42 0.00 0.61 -1.33 0.00 0.00 177.39 177.36 1l3i n GLY 151 N 1.13 0.65 3.94 -0.72 0.00 0.10 -5.06 105.19 105.23 1l3i n GLY 151 Ca 0.15 -0.27 -0.24 0.00 0.00 0.00 0.00 46.02 45.66 1l3i n GLY 151 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1l3i s PHE 152 N -2.00 3.38 -0.38 1.61 0.40 -0.60 -5.01 117.98 115.38 1l3i s PHE 152 Ca 0.00 0.39 -0.18 0.00 -0.60 0.00 0.00 56.93 56.54 1l3i s PHE 152 Cb 0.00 -2.18 0.01 0.00 0.51 0.00 0.00 43.02 41.35 1l3i s PHE 152 CO 0.00 -0.20 0.51 0.34 0.70 0.00 0.00 175.22 176.57 1l3i s ASP 153 N -4.14 6.28 -0.13 1.36 -1.08 -1.26 -4.37 116.67 113.34 1l3i s ASP 153 Ca 0.45 -0.25 -0.07 0.00 -0.52 0.00 0.00 52.55 52.16 1l3i s ASP 153 Cb -0.10 -2.26 -0.04 0.00 -1.46 0.00 0.00 42.92 39.06 1l3i s ASP 153 CO 0.39 -0.55 0.14 -0.69 0.52 0.00 0.00 175.17 174.97 1l3i s VAL 154 N 2.39 5.48 0.08 1.11 1.01 -1.26 -0.99 120.40 128.23 1l3i s VAL 154 Ca 0.17 0.20 0.04 0.00 0.00 0.00 0.00 61.98 62.40 1l3i s VAL 154 Cb -0.16 -3.40 -0.03 0.00 0.00 0.00 0.00 36.38 32.80 1l3i s VAL 154 CO 0.14 0.61 -0.12 0.20 0.00 0.00 0.00 175.10 175.93 1l3i s ASN 155 N -0.93 1.54 -0.00 3.32 0.01 -0.48 -5.01 114.94 113.39 1l3i s ASN 155 Ca 0.14 -0.71 0.00 0.00 -0.71 0.00 0.00 52.86 51.59 1l3i s ASN 155 Cb -0.12 -0.02 0.01 0.00 0.41 0.00 0.00 41.25 41.53 1l3i s ASN 155 CO 0.04 -0.17 0.00 -0.51 -1.51 0.00 0.00 177.10 174.95 1l3i s ILE 156 N -1.85 0.01 -0.04 0.60 2.07 -1.26 -1.14 121.20 119.58 1l3i s ILE 156 Ca 0.01 0.04 0.01 0.00 -1.41 0.00 0.00 60.65 59.30 1l3i s ILE 156 Cb -0.07 -0.04 0.02 0.00 0.13 0.00 0.00 42.46 42.50 1l3i s ILE 156 CO 0.01 0.03 -0.06 -0.89 -1.91 0.00 0.00 174.94 172.12 1l3i s THR 157 N 0.24 0.61 -0.23 4.00 2.01 -0.67 -4.97 115.64 116.62 1l3i s THR 157 Ca -0.02 -0.17 -0.02 0.00 0.31 0.00 0.00 61.69 61.79 1l3i s THR 157 Cb -0.03 -0.61 0.01 0.00 0.01 0.00 0.00 72.50 71.88 1l3i s THR 157 CO -0.01 0.24 -0.08 -0.70 -0.69 0.00 0.00 174.62 173.38 1l3i s GLU 158 N 0.83 3.07 -0.14 4.92 2.12 -1.26 0.18 118.70 128.42 1l3i s GLU 158 Ca -0.12 -0.81 -0.12 0.00 0.36 0.00 0.00 54.97 54.28 1l3i s GLU 158 Cb -0.14 -2.92 -0.05 0.00 0.26 0.00 0.00 34.13 31.28 1l3i s GLU 158 CO 0.01 -0.29 0.25 -0.51 -0.54 0.00 0.00 175.26 174.18 1l3i s LEU 159 N 1.38 4.30 -0.30 2.70 1.43 0.01 -4.95 118.68 123.25 1l3i s LEU 159 Ca 0.03 0.52 0.02 0.00 -1.03 0.00 0.00 54.13 53.67 1l3i s LEU 159 Cb -0.15 -2.30 0.07 0.00 0.03 0.00 0.00 46.19 43.85 1l3i s LEU 159 CO -0.06 0.20 -0.02 0.20 0.23 0.00 0.00 176.35 176.91 1l3i s ASN 160 N -0.05 4.68 -0.09 2.29 0.01 -1.26 -2.47 114.94 118.04 1l3i s ASN 160 Ca 0.16 -1.66 -0.02 0.00 -0.71 0.00 0.00 52.86 50.63 1l3i s ASN 160 Cb -0.13 -1.62 -0.03 0.00 0.41 0.00 0.00 41.25 39.88 1l3i s ASN 160 CO 0.04 -0.29 0.01 -0.63 -1.51 0.00 0.00 177.10 174.73 1l3i s ILE 161 N 1.07 4.38 -0.03 0.60 1.01 -1.26 -5.03 121.20 121.93 1l3i s ILE 161 Ca -0.01 -0.22 0.02 0.00 0.00 0.00 0.00 60.65 60.44 1l3i s ILE 161 Cb -0.20 -2.85 0.01 0.00 0.01 0.00 0.00 42.46 39.43 1l3i s ILE 161 CO -0.05 0.60 -0.09 0.00 0.00 0.00 0.00 174.94 175.40 1l3i s ALA 162 N -0.83 0.85 -0.03 9.38 0.00 -1.26 -0.66 121.76 129.22 1l3i s ALA 162 Ca 0.13 -0.29 0.06 0.00 0.00 0.00 0.00 51.96 51.85 1l3i s ALA 162 Cb -0.11 -0.34 -0.01 0.00 0.00 0.00 0.00 23.12 22.65 1l3i s ALA 162 CO 0.02 0.12 -0.22 1.03 0.00 0.00 0.00 175.76 176.71 1l3i s ARG 163 N 0.31 1.97 0.31 0.00 0.52 0.77 -4.85 118.95 117.98 1l3i s ARG 163 Ca -0.05 -0.78 -0.29 0.00 -0.52 0.00 0.00 55.73 54.09 1l3i s ARG 163 Cb -0.10 -1.80 -0.10 0.00 0.52 0.00 0.00 34.95 33.48 1l3i s ARG 163 CO 0.01 0.40 1.20 0.20 0.02 0.00 0.00 175.30 177.13 1l3i s GLY 164 N -0.32 3.02 0.00 -3.53 0.00 -1.26 -0.05 107.32 105.18 1l3i s GLY 164 Ca 0.03 1.07 0.01 0.00 0.00 0.00 0.00 44.72 45.83 1l3i s GLY 164 CO 0.01 1.68 -0.05 -1.60 0.00 0.00 0.00 173.10 173.14 1l3i s ARG 165 N -1.68 0.37 0.18 2.90 3.52 -1.26 -4.91 118.95 118.08 1l3i s ARG 165 Ca 0.48 -0.22 -0.30 0.00 -0.13 0.00 0.00 55.73 55.55 1l3i s ARG 165 Cb -0.35 -0.33 -0.09 0.00 -1.56 0.00 0.00 34.95 32.62 1l3i s ARG 165 CO 0.46 0.09 1.31 0.00 -0.81 0.00 0.00 175.30 176.35 1l3i s ALA 166 N -0.25 3.52 -0.30 6.12 0.00 -1.26 -4.37 121.76 125.22 1l3i s ALA 166 Ca 0.00 1.09 -0.10 0.00 0.00 0.00 0.00 51.96 52.95 1l3i s ALA 166 Cb -0.03 -3.48 0.15 0.00 0.00 0.00 0.00 23.12 19.76 1l3i s ALA 166 CO -0.00 -0.53 0.77 -1.17 0.00 0.00 0.00 175.76 174.82 1l3i s LEU 167 N 0.05 -0.97 -1.00 0.00 2.96 -0.08 -4.97 118.68 114.67 1l3i s LEU 167 Ca 0.57 1.16 -0.06 0.00 -0.22 0.00 0.00 54.13 55.58 1l3i s LEU 167 Cb -0.36 2.03 0.01 0.00 0.50 0.00 0.00 46.19 48.37 1l3i s LEU 167 CO 0.37 -0.18 0.85 0.47 -1.32 0.00 0.00 176.35 176.53 1l3i n ASP 168 N 5.31 -5.21 0.00 3.68 8.00 -1.26 -1.79 116.55 125.28 1l3i n ASP 168 Ca -0.09 -0.38 0.00 0.00 0.71 0.00 0.00 54.79 55.02 1l3i n ASP 168 Cb 0.51 -3.82 0.00 0.00 -0.02 0.00 0.00 41.12 37.79 1l3i n ASP 168 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1l3i n ARG 169 N -3.77 -1.62 -3.95 -1.24 0.63 -1.26 -4.93 116.66 100.51 1l3i n ARG 169 Ca 0.00 0.41 -0.23 0.00 -0.92 0.00 0.00 57.85 57.11 1l3i n ARG 169 Cb 0.55 -4.64 -0.05 0.00 0.45 0.00 0.00 32.46 28.77 1l3i n ARG 169 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1l3i n GLY 170 N 0.26 3.63 3.61 5.14 0.00 -0.74 -5.16 105.19 111.93 1l3i n GLY 170 Ca 0.00 -2.24 -0.25 0.00 0.00 0.00 0.00 46.02 43.53 1l3i n GLY 170 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1l3i s THR 171 N -2.49 2.63 0.00 2.61 2.01 -1.26 -0.90 115.64 118.24 1l3i s THR 171 Ca 0.05 -2.02 0.00 0.00 0.31 0.00 0.00 61.69 60.03 1l3i s THR 171 Cb 0.00 -2.75 0.00 0.00 0.01 0.00 0.00 72.50 69.76 1l3i s THR 171 CO 0.04 -0.23 0.00 0.52 -0.69 0.00 0.00 174.62 174.26 1l3i n VAL 174 N -0.91 0.00 -2.94 3.82 0.31 0.92 -4.81 118.33 114.73 1l3i n VAL 174 Ca -0.04 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 63.99 1l3i n VAL 174 Cb 0.62 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.52 1l3i n VAL 174 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1l3i s SER 175 N 0.00 6.47 0.12 4.52 1.04 -1.26 -0.17 113.70 124.42 1l3i s SER 175 Ca 0.00 1.01 0.07 0.00 0.48 0.00 0.00 55.95 57.51 1l3i s SER 175 Cb 0.00 -2.27 -0.04 0.00 0.10 0.00 0.00 66.02 63.81 1l3i s SER 175 CO 0.00 -0.37 -0.07 -0.13 0.98 0.00 0.00 173.24 173.64 1l3i s ARG 176 N -3.89 2.21 0.43 4.02 0.52 0.17 -4.96 118.95 117.45 1l3i s ARG 176 Ca 0.49 -1.03 -0.26 0.00 -0.52 0.00 0.00 55.73 54.41 1l3i s ARG 176 Cb -0.10 -2.33 -0.09 0.00 0.52 0.00 0.00 34.95 32.94 1l3i s ARG 176 CO 0.33 0.50 1.38 0.09 0.02 0.00 0.00 175.30 177.61 1l3i n ASN 177 N 0.51 3.08 -4.76 0.23 3.02 -1.26 -4.39 115.26 111.69 1l3i n ASN 177 Ca -0.12 1.13 -0.39 0.00 -0.03 0.00 0.00 54.58 55.17 1l3i n ASN 177 Cb 0.53 -1.56 0.01 0.00 -0.61 0.00 0.00 39.78 38.15 1l3i n ASN 177 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1l3i s PRO 178 N -2.29 3.64 -0.04 3.52 0.04 -1.26 -4.83 135.00 133.78 1l3i s PRO 178 Ca 0.60 2.13 0.02 0.00 0.04 0.00 0.00 61.00 63.79 1l3i s PRO 178 Cb -0.48 -2.52 0.01 0.00 0.04 0.00 0.00 34.50 31.55 1l3i s PRO 178 CO 0.59 -0.76 -0.09 0.08 0.04 0.00 0.00 177.00 176.86 1l3i s VAL 179 N -1.33 0.80 0.01 -0.36 1.01 -1.03 -4.79 120.40 114.70 1l3i s VAL 179 Ca 0.63 -0.34 0.02 0.00 0.00 0.00 0.00 61.98 62.29 1l3i s VAL 179 Cb -0.37 -0.73 -0.04 0.00 0.00 0.00 0.00 36.38 35.24 1l3i s VAL 179 CO 0.46 0.26 0.02 0.00 0.00 0.00 0.00 175.10 175.84 1l3i s ALA 180 N 0.40 3.35 -0.23 5.51 0.00 -0.49 -0.81 121.76 129.48 1l3i s ALA 180 Ca -0.07 -0.96 0.00 0.00 0.00 0.00 0.00 51.96 50.94 1l3i s ALA 180 Cb -0.11 -1.37 0.03 0.00 0.00 0.00 0.00 23.12 21.68 1l3i s ALA 180 CO 0.01 0.67 -0.11 -0.51 0.00 0.00 0.00 175.76 175.81 1l3i s LEU 181 N -1.72 2.97 -0.32 0.00 1.43 0.13 -0.71 118.68 120.45 1l3i s LEU 181 Ca 0.21 -0.96 -0.12 0.00 -1.03 0.00 0.00 54.13 52.24 1l3i s LEU 181 Cb -0.12 -1.58 -0.02 0.00 0.03 0.00 0.00 46.19 44.50 1l3i s LEU 181 CO 0.12 -0.11 0.22 -0.63 0.23 0.00 0.00 176.35 176.18 1l3i s ILE 182 N 1.25 5.20 0.10 -0.59 1.09 -0.10 -1.67 121.20 126.49 1l3i s ILE 182 Ca -0.01 -0.16 0.04 0.00 -1.10 0.00 0.00 60.65 59.41 1l3i s ILE 182 Cb -0.17 -3.63 -0.04 0.00 -1.06 0.00 0.00 42.46 37.57 1l3i s ILE 182 CO -0.07 0.05 -0.10 -0.72 -0.10 0.00 0.00 174.94 174.00 1l3i s TYR 183 N 1.72 1.09 0.28 3.97 -0.85 -0.29 -0.40 117.35 122.85 1l3i s TYR 183 Ca 0.06 -0.66 0.03 0.00 -0.52 0.00 0.00 57.07 55.98 1l3i s TYR 183 Cb -0.17 -0.59 -0.03 0.00 0.38 0.00 0.00 41.96 41.55 1l3i s TYR 183 CO 0.10 0.01 0.43 0.95 -1.52 0.00 0.00 175.55 175.52 1l3i s THR 184 N -2.51 5.20 0.38 -3.49 -4.23 -0.82 -1.38 115.64 108.79 1l3i s THR 184 Ca 0.06 -0.78 -0.28 0.00 -1.18 0.00 0.00 61.69 59.52 1l3i s THR 184 Cb -0.02 -3.86 -0.11 0.00 1.34 0.00 0.00 72.50 69.85 1l3i s THR 184 CO 0.00 -0.41 1.44 0.61 -0.54 0.00 0.00 174.62 175.72 1l3i n GLY 185 N -1.53 1.05 0.00 3.99 0.00 -0.16 -4.67 105.19 103.86 1l3i n GLY 185 Ca -0.07 0.29 0.14 0.00 0.00 0.00 0.00 46.02 46.39 1l3i n GLY 185 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70