#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q4i s VAL 21 N 0.00 4.48 -0.26 3.15 1.01 -1.26 -4.59 120.40 122.93 2q4i s VAL 21 Ca 0.00 -0.12 -0.09 0.00 0.00 0.00 0.00 61.98 61.77 2q4i s VAL 21 Cb 0.00 -3.07 -0.04 0.00 0.00 0.00 0.00 36.38 33.27 2q4i s VAL 21 CO 0.00 0.38 0.13 -1.10 0.00 0.00 0.00 175.10 174.51 2q4i s GLN 22 N 1.18 3.78 -0.23 2.72 -0.21 -0.65 -4.93 119.66 121.33 2q4i s GLN 22 Ca 0.04 -0.41 -0.21 0.00 0.02 0.00 0.00 55.36 54.81 2q4i s GLN 22 Cb -0.14 -3.48 -0.02 0.00 1.00 0.00 0.00 33.01 30.36 2q4i s GLN 22 CO 0.03 -0.19 0.65 -1.21 -2.12 0.00 0.00 175.29 172.45 2q4i s GLU 23 N 1.68 4.17 -0.10 2.91 2.02 -1.26 -1.82 118.70 126.30 2q4i s GLU 23 Ca 0.07 0.62 0.04 0.00 0.02 0.00 0.00 54.97 55.71 2q4i s GLU 23 Cb -0.16 -3.61 0.00 0.00 0.10 0.00 0.00 34.13 30.46 2q4i s GLU 23 CO 0.07 -0.34 -0.23 -1.17 0.02 0.00 0.00 175.26 173.61 2q4i s LEU 24 N 2.25 2.06 -0.02 1.80 2.96 -0.79 -4.97 118.68 121.98 2q4i s LEU 24 Ca 0.28 -0.54 0.07 0.00 -0.22 0.00 0.00 54.13 53.72 2q4i s LEU 24 Cb -0.16 -1.37 -0.02 0.00 0.50 0.00 0.00 46.19 45.14 2q4i s LEU 24 CO 0.09 0.15 -0.22 -0.44 -1.32 0.00 0.00 176.35 174.61 2q4i s SER 25 N 0.37 2.58 0.39 3.68 0.01 -1.26 -1.03 113.70 118.43 2q4i s SER 25 Ca -0.19 -0.40 0.04 0.00 1.31 0.00 0.00 55.95 56.72 2q4i s SER 25 Cb -0.18 -0.29 -0.03 0.00 0.21 0.00 0.00 66.02 65.73 2q4i s SER 25 CO 0.09 0.27 0.15 0.68 0.41 0.00 0.00 173.24 174.84 2q4i s VAL 26 N -0.51 0.50 -0.03 3.43 -7.23 -1.22 -1.30 120.40 114.03 2q4i s VAL 26 Ca 0.08 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.28 2q4i s VAL 26 Cb -0.08 -2.38 0.00 0.00 0.56 0.00 0.00 36.38 34.48 2q4i s VAL 26 CO -0.01 0.00 -0.11 -0.31 -0.31 0.00 0.00 175.10 174.36 2q4i s TYR 27 N -3.27 1.16 -0.17 2.82 2.02 0.12 -3.27 117.35 116.77 2q4i s TYR 27 Ca 0.27 -0.32 0.00 0.00 -0.37 0.00 0.00 57.07 56.66 2q4i s TYR 27 Cb 0.03 -0.82 0.01 0.00 -0.40 0.00 0.00 41.96 40.77 2q4i s TYR 27 CO 0.16 -0.13 -0.17 -2.00 -1.57 0.00 0.00 175.55 171.84 2q4i s GLU 28 N 0.22 3.11 -0.03 -0.62 2.12 -1.05 -0.65 118.70 121.81 2q4i s GLU 28 Ca -0.04 -0.79 0.02 0.00 0.36 0.00 0.00 54.97 54.52 2q4i s GLU 28 Cb -0.10 -2.61 0.01 0.00 0.26 0.00 0.00 34.13 31.69 2q4i s GLU 28 CO 0.01 -0.10 -0.06 0.42 -0.54 0.00 0.00 175.26 174.99 2q4i s ILE 29 N 1.08 0.53 -0.58 -3.70 1.01 -0.79 -2.34 121.20 116.42 2q4i s ILE 29 Ca -0.00 -0.20 -0.21 0.00 0.00 0.00 0.00 60.65 60.24 2q4i s ILE 29 Cb -0.14 -0.51 0.07 0.00 0.01 0.00 0.00 42.46 41.89 2q4i s ILE 29 CO -0.06 0.19 0.79 0.21 0.00 0.00 0.00 174.94 176.08 2q4i s ASN 30 N 0.41 6.22 -0.17 3.58 3.84 -1.06 -2.27 114.94 125.49 2q4i s ASN 30 Ca -0.05 -0.97 0.06 0.00 0.21 0.00 0.00 52.86 52.11 2q4i s ASN 30 Cb -0.09 -2.35 0.44 0.00 -0.55 0.00 0.00 41.25 38.70 2q4i s ASN 30 CO 0.00 -1.16 1.31 -0.62 -2.79 0.00 0.00 177.10 173.84 2q4i n GLU 31 N 6.85 2.79 -3.78 0.43 1.02 -1.26 -4.90 120.64 121.78 2q4i n GLU 31 Ca -0.05 -1.78 -0.27 0.00 -0.02 0.00 0.00 57.16 55.04 2q4i n GLU 31 Cb 0.45 -1.86 0.04 0.00 -0.02 0.00 0.00 31.44 30.05 2q4i n GLU 31 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2q4i n LEU 32 N 0.12 -2.93 -0.15 -4.62 4.77 -1.26 -4.89 117.00 108.03 2q4i n LEU 32 Ca 0.21 -0.72 0.00 0.00 -0.03 0.00 0.00 56.01 55.48 2q4i n LEU 32 Cb 0.91 -2.72 0.00 0.00 -2.33 0.00 0.00 43.42 39.27 2q4i n LEU 32 CO 0.24 0.50 0.25 -0.90 -1.33 0.00 0.00 177.39 176.15 2q4i n ASP 33 N -2.93 0.00 -0.20 -1.43 5.75 -1.26 -4.84 116.55 111.64 2q4i n ASP 33 Ca -0.04 -1.30 0.07 0.00 -0.01 0.00 0.00 54.79 53.50 2q4i n ASP 33 Cb 0.57 -0.06 0.09 0.00 -1.03 0.00 0.00 41.12 40.69 2q4i n ASP 33 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2q4i n ARG 34 N 0.00 0.93 -1.95 0.11 1.74 -1.26 -4.98 116.66 111.24 2q4i n ARG 34 Ca 0.00 -2.05 -0.16 0.00 -0.77 0.00 0.00 57.85 54.87 2q4i n ARG 34 Cb 0.56 -1.17 -0.03 0.00 -1.02 0.00 0.00 32.46 30.79 2q4i n ARG 34 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2q4i n HIS 35 N -0.96 -0.44 -4.31 -1.55 8.25 -1.26 -4.87 115.22 110.07 2q4i n HIS 35 Ca 0.11 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.33 2q4i n HIS 35 Cb 0.65 -3.07 -0.12 0.00 1.12 0.00 0.00 29.99 28.57 2q4i n HIS 35 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2q4i s SER 36 N -2.51 2.65 0.61 0.41 0.15 -1.26 -4.15 113.70 109.60 2q4i s SER 36 Ca 0.00 -0.76 -0.12 0.00 0.70 0.00 0.00 55.95 55.77 2q4i s SER 36 Cb 0.00 -0.15 -0.04 0.00 -1.71 0.00 0.00 66.02 64.11 2q4i s SER 36 CO 0.00 0.03 1.02 -2.16 1.20 0.00 0.00 173.24 173.34 2q4i s PRO 37 N -2.27 3.63 -0.23 5.44 0.04 -1.26 -4.85 135.00 135.50 2q4i s PRO 37 Ca 0.11 0.78 -0.05 0.00 0.04 0.00 0.00 61.00 61.88 2q4i s PRO 37 Cb -0.08 -2.09 -0.02 0.00 0.04 0.00 0.00 34.50 32.36 2q4i s PRO 37 CO 0.05 -0.54 -0.00 0.21 0.04 0.00 0.00 177.00 176.76 2q4i s LYS 38 N -5.03 3.49 -0.20 4.56 2.47 -0.79 -5.04 119.74 119.20 2q4i s LYS 38 Ca 0.56 -0.57 -0.14 0.00 -1.56 0.00 0.00 55.97 54.26 2q4i s LYS 38 Cb -0.11 -3.12 -0.04 0.00 -1.46 0.00 0.00 37.83 33.10 2q4i s LYS 38 CO 0.51 -0.18 0.33 0.42 0.16 0.00 0.00 175.35 176.59 2q4i s ILE 39 N 1.49 5.26 -0.43 5.43 1.01 -1.26 -3.02 121.20 129.68 2q4i s ILE 39 Ca 0.06 0.57 -0.06 0.00 0.00 0.00 0.00 60.65 61.22 2q4i s ILE 39 Cb -0.15 -3.66 0.11 0.00 0.01 0.00 0.00 42.46 38.77 2q4i s ILE 39 CO -0.01 0.31 0.26 -0.76 0.00 0.00 0.00 174.94 174.74 2q4i s LEU 40 N 1.03 5.41 -0.17 2.97 1.43 -0.23 -5.01 118.68 124.10 2q4i s LEU 40 Ca 0.16 -1.94 -0.21 0.00 -1.03 0.00 0.00 54.13 51.11 2q4i s LEU 40 Cb -0.14 -1.91 -0.03 0.00 0.03 0.00 0.00 46.19 44.14 2q4i s LEU 40 CO 0.06 -0.60 0.61 -0.75 0.23 0.00 0.00 176.35 175.90 2q4i s LYS 41 N 1.25 4.25 0.00 1.70 2.47 -1.26 -1.74 119.74 126.40 2q4i s LYS 41 Ca 0.07 0.61 0.00 0.00 -1.56 0.00 0.00 55.97 55.09 2q4i s LYS 41 Cb -0.24 -3.55 0.00 0.00 -1.46 0.00 0.00 37.83 32.58 2q4i s LYS 41 CO -0.02 -0.15 0.00 0.09 0.16 0.00 0.00 175.35 175.42 2q4i n ASN 42 N 4.72 1.60 -4.77 1.43 3.02 -1.25 -4.96 115.26 115.06 2q4i n ASN 42 Ca -0.02 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.13 2q4i n ASN 42 Cb 0.50 0.31 -0.02 0.00 -0.61 0.00 0.00 39.78 39.96 2q4i n ASN 42 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2q4i s ALA 43 N -0.70 3.32 -1.29 5.41 0.00 -1.26 -4.87 121.76 122.38 2q4i s ALA 43 Ca 0.00 1.06 -0.12 0.00 0.00 0.00 0.00 51.96 52.90 2q4i s ALA 43 Cb 0.00 -3.41 0.14 0.00 0.00 0.00 0.00 23.12 19.85 2q4i s ALA 43 CO 0.00 -0.51 1.78 1.19 0.00 0.00 0.00 175.76 178.22 2q4i n PHE 44 N 0.52 3.81 -3.58 0.00 3.72 -1.26 -4.84 117.46 115.84 2q4i n PHE 44 Ca 0.02 -2.99 -0.11 0.00 -0.05 0.00 0.00 57.45 54.32 2q4i n PHE 44 Cb 0.44 -2.17 -0.05 0.00 -0.94 0.00 0.00 39.48 36.76 2q4i n PHE 44 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2q4i s SER 45 N 2.11 -0.37 0.00 4.37 0.15 -1.26 -5.13 113.70 113.57 2q4i s SER 45 Ca 0.43 0.41 -0.02 0.00 0.70 0.00 0.00 55.95 57.47 2q4i s SER 45 Cb 0.06 0.31 -0.11 0.00 -1.71 0.00 0.00 66.02 64.57 2q4i s SER 45 CO -0.00 -0.34 2.22 0.18 1.20 0.00 0.00 173.24 176.50 2q4i n LEU 46 N 0.76 3.92 -4.85 3.45 4.77 -1.26 -4.92 117.00 118.87 2q4i n LEU 46 Ca -0.10 -2.18 -0.35 0.00 -0.03 0.00 0.00 56.01 53.35 2q4i n LEU 46 Cb 0.58 -0.96 -0.06 0.00 -2.33 0.00 0.00 43.42 40.66 2q4i n LEU 46 CO 0.16 0.96 0.17 -0.36 -1.33 0.00 0.00 177.39 176.99 2q4i s PHE 48 N 1.07 3.59 0.29 -1.77 0.08 -1.26 -5.23 117.98 114.75 2q4i s PHE 48 Ca 0.27 0.94 -0.18 0.00 0.12 0.00 0.00 56.93 58.08 2q4i s PHE 48 Cb 0.13 -2.28 0.02 0.00 -0.57 0.00 0.00 43.02 40.33 2q4i s PHE 48 CO 0.00 0.46 0.68 0.20 -0.10 0.00 0.00 175.22 176.46 2q4i s GLY 49 N -1.76 0.17 0.27 4.36 0.00 -1.26 -3.80 107.32 105.28 2q4i s GLY 49 Ca 0.36 -0.54 -0.29 0.00 0.00 0.00 0.00 44.72 44.25 2q4i s GLY 49 CO 0.19 -0.26 1.10 -0.10 0.00 0.00 0.00 173.10 174.02 2q4i n LEU 50 N -0.46 1.99 0.00 0.66 7.94 -1.26 -1.89 117.00 123.98 2q4i n LEU 50 Ca -0.04 1.17 0.00 0.00 -1.11 0.00 0.00 56.01 56.03 2q4i n LEU 50 Cb 0.60 -1.30 0.00 0.00 0.53 0.00 0.00 43.42 43.25 2q4i n LEU 50 CO 0.19 -1.23 0.00 0.61 -1.11 0.00 0.00 177.39 175.85 2q4i n GLY 51 N 1.44 2.80 3.73 -3.96 0.00 -1.26 -4.04 105.19 103.89 2q4i n GLY 51 Ca 0.10 -0.95 -0.41 0.00 0.00 0.00 0.00 46.02 44.76 2q4i n GLY 51 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2q4i s ASP 52 N -0.07 7.41 -0.05 1.61 1.01 -0.79 -3.91 116.67 121.88 2q4i s ASP 52 Ca 0.00 1.88 0.06 0.00 0.71 0.00 0.00 52.55 55.19 2q4i s ASP 52 Cb 0.00 -2.59 -0.01 0.00 1.01 0.00 0.00 42.92 41.33 2q4i s ASP 52 CO 0.00 -0.14 -0.23 -0.76 0.21 0.00 0.00 175.17 174.25 2q4i s LEU 53 N 0.01 2.03 -0.46 1.23 1.43 -0.71 -2.02 118.68 120.19 2q4i s LEU 53 Ca 0.48 -0.47 0.03 0.00 -1.03 0.00 0.00 54.13 53.14 2q4i s LEU 53 Cb -0.25 -1.28 0.13 0.00 0.03 0.00 0.00 46.19 44.82 2q4i s LEU 53 CO 0.31 0.23 0.24 -0.69 0.23 0.00 0.00 176.35 176.66 2q4i s VAL 54 N -0.13 1.84 0.63 -1.59 1.01 0.38 -1.07 120.40 121.47 2q4i s VAL 54 Ca -0.03 -2.81 -0.17 0.00 0.00 0.00 0.00 61.98 58.97 2q4i s VAL 54 Cb -0.13 -2.29 -0.02 0.00 0.00 0.00 0.00 36.38 33.94 2q4i s VAL 54 CO 0.03 -0.85 1.14 -2.84 0.00 0.00 0.00 175.10 172.58 2q4i s PRO 55 N 0.15 2.88 0.15 2.72 0.02 -1.17 -1.65 135.00 138.11 2q4i s PRO 55 Ca 0.17 1.56 -0.18 0.00 0.02 0.00 0.00 61.00 62.57 2q4i s PRO 55 Cb -0.25 -1.95 0.04 0.00 0.02 0.00 0.00 34.50 32.37 2q4i s PRO 55 CO -0.00 -1.22 0.47 -0.59 -0.33 0.00 0.00 177.00 175.33 2q4i s PHE 56 N -2.04 -0.25 -0.29 6.54 -0.12 -1.04 -1.89 117.98 118.89 2q4i s PHE 56 Ca 0.71 -0.05 0.01 0.00 -0.05 0.00 0.00 56.93 57.55 2q4i s PHE 56 Cb -0.24 0.35 0.19 0.00 -0.63 0.00 0.00 43.02 42.70 2q4i s PHE 56 CO 0.37 -0.79 0.68 -0.08 -0.05 0.00 0.00 175.22 175.35 2q4i s THR 57 N -3.81 -0.87 0.35 -4.49 -1.32 -1.26 -2.96 115.64 101.28 2q4i s THR 57 Ca 0.04 0.00 0.08 0.00 -1.21 0.00 0.00 61.69 60.60 2q4i s THR 57 Cb 0.01 -0.91 -0.04 0.00 -1.51 0.00 0.00 72.50 70.05 2q4i s THR 57 CO -0.10 0.00 0.21 0.20 -2.21 0.00 0.00 174.62 172.72 2q4i s ASN 58 N 2.86 4.90 0.70 8.08 0.01 -1.22 -4.72 114.94 125.54 2q4i s ASN 58 Ca 0.14 -0.69 -0.11 0.00 -0.71 0.00 0.00 52.86 51.49 2q4i s ASN 58 Cb -0.10 -0.79 0.01 0.00 0.41 0.00 0.00 41.25 40.78 2q4i s ASN 58 CO -0.23 -0.35 1.07 -0.54 -1.51 0.00 0.00 177.10 175.53 2q4i s LYS 59 N -3.92 2.93 -0.08 -0.60 1.02 -0.96 -1.53 119.74 116.60 2q4i s LYS 59 Ca 0.40 0.77 0.00 0.00 0.02 0.00 0.00 55.97 57.16 2q4i s LYS 59 Cb -0.03 -2.00 0.02 0.00 -0.52 0.00 0.00 37.83 35.29 2q4i s LYS 59 CO 0.24 -1.05 -0.06 -1.17 -0.92 0.00 0.00 175.35 172.39 2q4i s LEU 60 N -5.47 1.20 0.10 3.17 2.96 0.13 -1.88 118.68 118.89 2q4i s LEU 60 Ca 0.58 -0.22 0.10 0.00 -0.22 0.00 0.00 54.13 54.37 2q4i s LEU 60 Cb -0.13 -0.66 -0.04 0.00 0.50 0.00 0.00 46.19 45.86 2q4i s LEU 60 CO 0.54 -0.08 -0.27 -0.31 -1.32 0.00 0.00 176.35 174.91 2q4i s TYR 61 N 1.34 2.31 0.91 5.38 2.02 0.18 -0.62 117.35 128.87 2q4i s TYR 61 Ca -0.03 -0.39 -0.12 0.00 -0.37 0.00 0.00 57.07 56.16 2q4i s TYR 61 Cb -0.14 -1.30 0.08 0.00 -0.40 0.00 0.00 41.96 40.20 2q4i s TYR 61 CO -0.03 0.26 0.76 0.25 -1.57 0.00 0.00 175.55 175.22 2q4i n THR 62 N 1.25 0.28 0.10 -0.71 -2.24 0.26 -0.70 114.28 112.52 2q4i n THR 62 Ca -0.18 -0.13 0.05 0.00 -2.27 0.00 0.00 64.05 61.52 2q4i n THR 62 Cb 0.53 -0.82 0.48 0.00 -2.10 0.00 0.00 70.33 68.41 2q4i n THR 62 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2q4i h GLY 63 N -1.57 0.34 0.58 3.38 0.00 -1.47 0.91 103.07 105.24 2q4i h GLY 63 Ca -0.44 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 46.75 2q4i h GLY 63 CO 0.38 0.14 0.00 2.09 0.00 0.00 0.00 176.54 179.15 2q4i n ASP 64 N -4.45 0.00 0.00 0.19 5.68 -1.26 -2.44 116.55 114.28 2q4i n ASP 64 Ca 0.00 -1.41 0.00 0.00 -0.50 0.00 0.00 54.79 52.88 2q4i n ASP 64 Cb 0.12 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.10 2q4i n ASP 64 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 2q4i n LEU 65 N -0.79 0.98 0.13 -2.12 4.77 0.31 -4.80 117.00 115.49 2q4i n LEU 65 Ca 0.14 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.24 2q4i n LEU 65 Cb 0.06 -2.23 0.13 0.00 -2.33 0.00 0.00 43.42 39.06 2q4i n LEU 65 CO 0.10 -0.87 0.43 0.11 -1.33 0.00 0.00 177.39 175.84 2q4i h LYS 66 N 0.03 0.00 -4.53 3.23 1.57 -1.90 0.78 116.57 115.75 2q4i h LYS 66 Ca 0.00 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.49 2q4i h LYS 66 Cb 0.75 0.00 -0.23 0.00 0.08 0.00 0.00 32.23 32.83 2q4i h LYS 66 CO 0.00 0.00 -0.74 0.15 -0.57 0.00 0.00 179.45 178.29 2q4i s LYS 67 N -3.25 0.52 -0.16 3.15 1.02 -1.25 -4.25 119.74 115.52 2q4i s LYS 67 Ca 0.04 -0.62 -0.19 0.00 0.02 0.00 0.00 55.97 55.22 2q4i s LYS 67 Cb 0.09 -0.34 -0.03 0.00 -0.52 0.00 0.00 37.83 37.02 2q4i s LYS 67 CO 0.72 0.07 0.53 0.50 -0.92 0.00 0.00 175.35 176.25 2q4i s ARG 68 N -1.22 4.26 -0.18 1.68 6.06 0.12 0.90 118.95 130.58 2q4i s ARG 68 Ca -0.07 0.48 0.03 0.00 -2.50 0.00 0.00 55.73 53.68 2q4i s ARG 68 Cb -0.08 -3.51 -0.13 0.00 0.06 0.00 0.00 34.95 31.29 2q4i s ARG 68 CO 0.00 -0.04 -0.13 1.33 -2.50 0.00 0.00 175.30 173.96 2q4i n VAL 69 N 4.20 1.05 0.00 7.11 0.24 0.21 -1.80 118.33 129.35 2q4i n VAL 69 Ca -0.05 -0.43 0.00 0.00 -2.04 0.00 0.00 64.34 61.82 2q4i n VAL 69 Cb 0.51 -1.08 0.00 0.00 -1.47 0.00 0.00 33.84 31.80 2q4i n VAL 69 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2q4i n GLY 70 N 2.55 -0.94 3.21 7.63 0.00 -1.03 -0.82 105.19 115.79 2q4i n GLY 70 Ca -0.32 -0.10 -0.12 0.00 0.00 0.00 0.00 46.02 45.48 2q4i n GLY 70 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2q4i s ILE 71 N -4.00 0.20 0.18 -0.61 -4.36 -1.14 0.19 121.20 111.66 2q4i s ILE 71 Ca 0.00 -1.97 0.04 0.00 -0.26 0.00 0.00 60.65 58.46 2q4i s ILE 71 Cb 0.00 -2.35 -0.03 0.00 1.25 0.00 0.00 42.46 41.32 2q4i s ILE 71 CO 0.00 -0.18 0.25 0.42 0.24 0.00 0.00 174.94 175.67 2q4i s THR 72 N -4.01 5.02 -0.24 8.37 -4.23 -0.59 0.01 115.64 119.97 2q4i s THR 72 Ca 0.33 -0.91 -0.12 0.00 -1.18 0.00 0.00 61.69 59.81 2q4i s THR 72 Cb 0.07 -3.62 0.09 0.00 1.34 0.00 0.00 72.50 70.38 2q4i s THR 72 CO 0.08 -0.16 0.57 0.00 -0.54 0.00 0.00 174.62 174.57 2q4i s ALA 73 N -1.82 -1.60 0.00 3.99 0.00 -0.29 -3.45 121.76 118.59 2q4i s ALA 73 Ca 0.33 2.05 0.00 0.00 0.00 0.00 0.00 51.96 54.35 2q4i s ALA 73 Cb -0.10 -1.36 0.00 0.00 0.00 0.00 0.00 23.12 21.66 2q4i s ALA 73 CO 0.27 -0.51 0.00 0.41 0.00 0.00 0.00 175.76 175.93 2q4i n GLY 74 N 4.68 -0.60 2.79 0.00 0.00 -1.15 -0.43 105.19 110.47 2q4i n GLY 74 Ca -0.18 -0.66 -0.18 0.00 0.00 0.00 0.00 46.02 45.01 2q4i n GLY 74 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2q4i s LEU 75 N 0.00 0.96 -0.25 0.99 2.96 -0.98 -2.48 118.68 119.88 2q4i s LEU 75 Ca 0.00 -0.00 -0.10 0.00 -0.22 0.00 0.00 54.13 53.80 2q4i s LEU 75 Cb 0.00 -0.20 -0.05 0.00 0.50 0.00 0.00 46.19 46.44 2q4i s LEU 75 CO 0.00 -0.13 0.15 0.00 -1.32 0.00 0.00 176.35 175.05 2q4i s VAL 77 N 1.29 5.35 0.13 0.00 1.01 0.01 -0.47 120.40 127.71 2q4i s VAL 77 Ca 0.07 0.26 -0.30 0.00 0.00 0.00 0.00 61.98 62.01 2q4i s VAL 77 Cb -0.14 -3.53 -0.07 0.00 0.00 0.00 0.00 36.38 32.64 2q4i s VAL 77 CO 0.06 0.36 1.14 -0.69 0.00 0.00 0.00 175.10 175.96 2q4i s VAL 78 N 0.92 3.94 -0.25 2.92 1.01 -0.86 -0.35 120.40 127.73 2q4i s VAL 78 Ca 0.09 1.55 -0.04 0.00 0.00 0.00 0.00 61.98 63.59 2q4i s VAL 78 Cb -0.13 -3.99 -0.14 0.00 0.00 0.00 0.00 36.38 32.12 2q4i s VAL 78 CO 0.04 0.21 -0.26 -0.38 0.00 0.00 0.00 175.10 174.70 2q4i n ILE 79 N 2.99 1.41 -3.63 2.22 2.08 0.31 -4.15 119.36 120.58 2q4i n ILE 79 Ca 0.05 -0.47 -0.06 0.00 0.56 0.00 0.00 62.75 62.84 2q4i n ILE 79 Cb 0.46 -1.56 -0.06 0.00 -0.75 0.00 0.00 39.64 37.73 2q4i n ILE 79 CO 0.00 0.00 0.00 -1.83 0.56 0.00 0.00 176.55 175.28 2q4i s GLU 80 N -2.48 0.26 0.42 0.38 -1.05 -1.14 -4.09 118.70 111.00 2q4i s GLU 80 Ca -0.34 0.22 -0.23 0.00 -0.15 0.00 0.00 54.97 54.47 2q4i s GLU 80 Cb 0.11 0.13 -0.09 0.00 -0.44 0.00 0.00 34.13 33.83 2q4i s GLU 80 CO 0.52 -0.05 1.02 -1.58 0.95 0.00 0.00 175.26 176.12 2q4i s HIS 81 N -0.29 3.23 -0.41 4.83 5.65 -1.25 -0.54 115.29 126.52 2q4i s HIS 81 Ca 0.05 1.63 0.03 0.00 0.25 0.00 0.00 55.06 57.03 2q4i s HIS 81 Cb -0.04 -3.05 0.11 0.00 -1.18 0.00 0.00 32.58 28.42 2q4i s HIS 81 CO -0.09 -0.55 0.14 0.08 -0.65 0.00 0.00 174.74 173.67 2q4i s VAL 82 N -1.82 2.20 0.18 0.89 1.01 0.55 -4.90 120.40 118.51 2q4i s VAL 82 Ca 0.60 -2.61 0.03 0.00 0.00 0.00 0.00 61.98 60.00 2q4i s VAL 82 Cb -0.18 -2.59 -0.12 0.00 0.00 0.00 0.00 36.38 33.49 2q4i s VAL 82 CO 0.23 -0.70 1.42 1.55 0.00 0.00 0.00 175.10 177.60 2q4i h PRO 83 N 7.21 0.20 0.00 2.72 0.13 -1.96 -0.75 132.00 139.56 2q4i h PRO 83 Ca -0.06 -0.20 -0.01 0.00 -0.87 0.00 0.00 66.00 64.86 2q4i h PRO 83 Cb 0.97 0.05 -0.00 0.00 0.13 0.00 0.00 31.00 32.15 2q4i h PRO 83 CO 0.57 0.91 -0.03 1.05 -0.23 0.00 0.00 178.00 180.27 2q4i h GLU 84 N 0.12 0.00 -0.35 0.86 9.09 -1.95 -0.76 114.58 121.59 2q4i h GLU 84 Ca -0.03 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.38 2q4i h GLU 84 Cb 1.41 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.51 2q4i h GLU 84 CO 0.12 0.03 0.00 1.63 0.05 0.00 0.00 179.01 180.85 2q4i n LYS 85 N -3.53 2.29 -3.96 1.06 4.76 -1.00 -4.98 118.16 112.78 2q4i n LYS 85 Ca -0.02 -2.07 -0.29 0.00 -2.87 0.00 0.00 58.31 53.06 2q4i n LYS 85 Cb 0.13 -1.40 -0.02 0.00 -1.84 0.00 0.00 35.03 31.91 2q4i n LYS 85 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2q4i n LYS 86 N 1.07 -2.29 -1.65 1.97 4.76 -0.29 -4.89 118.16 116.84 2q4i n LYS 86 Ca 0.15 0.34 -0.02 0.00 -2.87 0.00 0.00 58.31 55.91 2q4i n LYS 86 Cb 0.50 -4.13 0.00 0.00 -1.84 0.00 0.00 35.03 29.56 2q4i n LYS 86 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2q4i n GLY 87 N -2.02 1.95 3.50 0.72 0.00 -0.41 -4.82 105.19 104.11 2q4i n GLY 87 Ca -0.25 -1.12 -0.24 0.00 0.00 0.00 0.00 46.02 44.40 2q4i n GLY 87 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2q4i s GLU 88 N -2.04 1.76 -0.21 1.61 0.41 -1.26 -0.33 118.70 118.63 2q4i s GLU 88 Ca 0.04 -1.80 0.01 0.00 -0.41 0.00 0.00 54.97 52.81 2q4i s GLU 88 Cb -0.01 -1.77 0.05 0.00 -1.78 0.00 0.00 34.13 30.61 2q4i s GLU 88 CO 0.03 0.28 -0.10 0.50 -0.49 0.00 0.00 175.26 175.47 2q4i s ARG 89 N -3.55 2.02 0.15 1.61 3.52 0.30 -2.78 118.95 120.23 2q4i s ARG 89 Ca 0.31 -0.95 0.07 0.00 -0.13 0.00 0.00 55.73 55.03 2q4i s ARG 89 Cb -0.03 -2.53 -0.04 0.00 -1.56 0.00 0.00 34.95 30.79 2q4i s ARG 89 CO 0.16 -0.47 0.01 -0.06 -0.81 0.00 0.00 175.30 174.13 2q4i s PHE 90 N 1.35 2.91 -0.22 5.12 0.08 -0.54 0.11 117.98 126.78 2q4i s PHE 90 Ca -0.03 -0.10 -0.05 0.00 0.12 0.00 0.00 56.93 56.86 2q4i s PHE 90 Cb -0.17 -1.43 -0.02 0.00 -0.57 0.00 0.00 43.02 40.83 2q4i s PHE 90 CO -0.07 0.51 0.01 -2.00 -0.10 0.00 0.00 175.22 173.56 2q4i s GLU 91 N -2.81 3.55 0.09 0.44 2.56 0.52 -1.64 118.70 121.42 2q4i s GLU 91 Ca 0.27 -0.54 0.08 0.00 0.00 0.00 0.00 54.97 54.78 2q4i s GLU 91 Cb -0.10 -3.14 -0.04 0.00 2.00 0.00 0.00 34.13 32.86 2q4i s GLU 91 CO 0.19 -0.12 -0.14 0.00 -0.56 0.00 0.00 175.26 174.62 2q4i s ALA 92 N 1.36 2.79 -0.24 6.30 0.00 0.15 -0.81 121.76 131.31 2q4i s ALA 92 Ca 0.04 -1.26 -0.03 0.00 0.00 0.00 0.00 51.96 50.71 2q4i s ALA 92 Cb -0.15 -0.79 0.12 0.00 0.00 0.00 0.00 23.12 22.31 2q4i s ALA 92 CO 0.01 0.61 0.31 0.99 0.00 0.00 0.00 175.76 177.68 2q4i s THR 93 N -1.13 -0.47 0.27 0.00 2.01 -1.12 -0.06 115.64 115.14 2q4i s THR 93 Ca 0.19 -0.15 -0.20 0.00 0.31 0.00 0.00 61.69 61.84 2q4i s THR 93 Cb -0.11 -0.79 0.02 0.00 0.01 0.00 0.00 72.50 71.63 2q4i s THR 93 CO 0.11 -0.20 0.68 -0.72 -0.69 0.00 0.00 174.62 173.79 2q4i s TYR 94 N 2.44 -0.12 0.30 4.92 -0.85 -1.00 -2.32 117.35 120.73 2q4i s TYR 94 Ca 0.10 -0.32 0.11 0.00 -0.52 0.00 0.00 57.07 56.44 2q4i s TYR 94 Cb -0.15 0.62 -0.05 0.00 0.38 0.00 0.00 41.96 42.75 2q4i s TYR 94 CO -0.17 -1.18 -0.13 -1.12 -1.52 0.00 0.00 175.55 171.43 2q4i s SER 95 N -2.93 3.80 -0.19 -0.18 0.01 0.43 -0.87 113.70 113.77 2q4i s SER 95 Ca 0.12 -1.02 0.01 0.00 1.31 0.00 0.00 55.95 56.37 2q4i s SER 95 Cb -0.05 -0.40 0.03 0.00 0.21 0.00 0.00 66.02 65.81 2q4i s SER 95 CO 0.06 -0.06 -0.14 -0.36 0.41 0.00 0.00 173.24 173.15 2q4i s PHE 96 N -2.51 2.58 -0.14 2.43 0.08 0.20 -1.14 117.98 119.48 2q4i s PHE 96 Ca 0.31 -1.61 -0.05 0.00 0.12 0.00 0.00 56.93 55.70 2q4i s PHE 96 Cb -0.03 -1.75 -0.04 0.00 -0.57 0.00 0.00 43.02 40.63 2q4i s PHE 96 CO 0.16 -0.76 0.05 0.71 -0.10 0.00 0.00 175.22 175.28 2q4i s TYR 97 N 1.35 3.27 -0.48 0.36 2.02 0.10 0.08 117.35 124.05 2q4i s TYR 97 Ca 0.01 0.16 0.07 0.00 -0.37 0.00 0.00 57.07 56.95 2q4i s TYR 97 Cb -0.15 -1.95 0.38 0.00 -0.40 0.00 0.00 41.96 39.84 2q4i s TYR 97 CO -0.10 0.34 0.99 1.19 -1.57 0.00 0.00 175.55 176.40 2q4i n PHE 98 N 2.82 3.13 -2.19 2.71 3.72 -0.67 -2.45 117.46 124.52 2q4i n PHE 98 Ca -0.18 -3.51 0.00 0.00 -0.05 0.00 0.00 57.45 53.71 2q4i n PHE 98 Cb 0.53 -0.31 0.00 0.00 -0.94 0.00 0.00 39.48 38.76 2q4i n PHE 98 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2q4i n GLY 99 N -0.27 2.90 0.08 1.37 0.00 -0.00 -2.25 105.19 107.03 2q4i n GLY 99 Ca 0.31 -0.23 0.11 0.00 0.00 0.00 0.00 46.02 46.21 2q4i n GLY 99 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2q4i n ASP 100 N 1.84 0.47 0.07 1.61 8.00 -1.19 -3.39 116.55 123.95 2q4i n ASP 100 Ca 0.00 0.60 -0.05 0.00 0.71 0.00 0.00 54.79 56.05 2q4i n ASP 100 Cb 0.00 -0.71 0.15 0.00 -0.02 0.00 0.00 41.12 40.55 2q4i n ASP 100 CO 0.00 0.00 0.00 1.88 -0.39 0.00 0.00 177.20 178.69 2q4i h TYR 101 N 0.00 0.37 0.00 1.24 0.05 -1.78 -3.47 116.97 113.39 2q4i h TYR 101 Ca 0.00 -0.12 0.00 0.00 0.05 0.00 0.00 58.73 58.66 2q4i h TYR 101 Cb 0.39 -0.07 0.00 0.00 1.01 0.00 0.00 36.73 38.06 2q4i h TYR 101 CO 0.00 0.75 0.00 0.41 -1.05 0.00 0.00 178.16 178.27 2q4i n GLY 102 N 0.06 0.71 3.42 3.88 0.00 -1.22 -0.07 105.19 111.98 2q4i n GLY 102 Ca -0.02 -1.75 -0.10 0.00 0.00 0.00 0.00 46.02 44.15 2q4i n GLY 102 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2q4i s HIS 103 N -3.04 -0.01 -0.01 1.61 -3.43 -0.90 -1.67 115.29 107.83 2q4i s HIS 103 Ca 0.00 -0.34 0.08 0.00 -0.80 0.00 0.00 55.06 54.00 2q4i s HIS 103 Cb 0.00 0.24 -0.02 0.00 -1.43 0.00 0.00 32.58 31.37 2q4i s HIS 103 CO 0.00 -0.81 -0.25 -0.51 -2.00 0.00 0.00 174.74 171.17 2q4i s LEU 104 N -2.88 2.12 0.09 5.38 1.43 0.11 -2.46 118.68 122.48 2q4i s LEU 104 Ca 0.09 -0.46 0.09 0.00 -1.03 0.00 0.00 54.13 52.82 2q4i s LEU 104 Cb 0.01 -1.35 -0.04 0.00 0.03 0.00 0.00 46.19 44.84 2q4i s LEU 104 CO -0.05 0.31 -0.21 -0.44 0.23 0.00 0.00 176.35 176.20 2q4i s SER 105 N -0.71 3.64 0.17 2.29 0.01 -0.67 0.62 113.70 119.06 2q4i s SER 105 Ca 0.10 -0.57 -0.04 0.00 1.31 0.00 0.00 55.95 56.75 2q4i s SER 105 Cb -0.10 -0.45 -0.03 0.00 0.21 0.00 0.00 66.02 65.65 2q4i s SER 105 CO -0.00 0.21 0.17 0.68 0.41 0.00 0.00 173.24 174.70 2q4i s VAL 106 N -1.03 0.05 -0.17 3.43 -7.23 -0.05 -2.03 120.40 113.38 2q4i s VAL 106 Ca 0.15 -1.79 -0.13 0.00 -1.81 0.00 0.00 61.98 58.41 2q4i s VAL 106 Cb -0.10 -2.17 0.05 0.00 0.56 0.00 0.00 36.38 34.72 2q4i s VAL 106 CO 0.07 -0.23 0.43 -1.58 -0.31 0.00 0.00 175.10 173.48 2q4i s GLN 107 N -4.07 0.46 0.00 4.82 0.74 -0.28 -2.36 119.66 118.97 2q4i s GLN 107 Ca 0.27 0.69 0.00 0.00 0.05 0.00 0.00 55.36 56.38 2q4i s GLN 107 Cb 0.06 0.13 0.00 0.00 1.10 0.00 0.00 33.01 34.30 2q4i s GLN 107 CO 0.05 -0.10 0.00 0.41 -0.55 0.00 0.00 175.29 175.10 2q4i n GLY 108 N 3.46 -0.43 3.72 2.59 0.00 0.91 -0.57 105.19 114.88 2q4i n GLY 108 Ca -0.18 -1.43 -0.41 0.00 0.00 0.00 0.00 46.02 44.00 2q4i n GLY 108 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2q4i s PRO 109 N -2.00 4.58 -0.23 1.61 0.04 -1.26 0.30 135.00 138.03 2q4i s PRO 109 Ca 0.00 1.61 0.02 0.00 0.04 0.00 0.00 61.00 62.66 2q4i s PRO 109 Cb 0.00 -3.35 0.05 0.00 0.04 0.00 0.00 34.50 31.24 2q4i s PRO 109 CO 0.00 0.01 -0.10 -0.47 0.04 0.00 0.00 177.00 176.49 2q4i s TYR 110 N 0.34 2.78 -0.23 0.56 5.04 -0.65 -4.59 117.35 120.61 2q4i s TYR 110 Ca 0.51 -1.95 -0.07 0.00 -2.44 0.00 0.00 57.07 53.12 2q4i s TYR 110 Cb -0.26 -1.76 -0.03 0.00 0.35 0.00 0.00 41.96 40.26 2q4i s TYR 110 CO 0.31 -0.81 0.06 -0.51 -1.34 0.00 0.00 175.55 173.26 2q4i s LEU 111 N 1.27 3.51 0.42 6.97 1.43 -1.26 -1.47 118.68 129.54 2q4i s LEU 111 Ca -0.05 -0.14 0.29 0.00 -1.03 0.00 0.00 54.13 53.20 2q4i s LEU 111 Cb -0.18 -1.92 1.42 0.00 0.03 0.00 0.00 46.19 45.53 2q4i s LEU 111 CO -0.07 0.02 1.89 0.71 0.23 0.00 0.00 176.35 179.14 2q4i h THR 112 N 5.37 0.00 0.00 5.49 1.35 -1.91 -3.18 112.91 120.03 2q4i h THR 112 Ca -0.37 -0.17 0.00 0.00 -0.55 0.00 0.00 66.41 65.32 2q4i h THR 112 Cb 1.18 0.93 0.00 0.00 -1.73 0.00 0.00 68.15 68.52 2q4i h THR 112 CO 0.60 0.00 -1.83 0.00 -0.25 0.00 0.00 175.52 174.04 2q4i n TYR 113 N -2.58 0.00 -3.95 4.73 0.18 -1.26 -4.93 117.16 109.34 2q4i n TYR 113 Ca -0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 2q4i n TYR 113 Cb 0.15 -0.42 0.00 0.00 -0.38 0.00 0.00 39.34 38.69 2q4i n TYR 113 CO 0.00 0.00 0.00 -0.85 -2.08 0.00 0.00 176.86 173.93 2q4i n GLU 114 N -2.13 0.00 -3.94 -3.48 0.28 -1.20 -5.09 120.64 105.07 2q4i n GLU 114 Ca -0.03 0.00 -0.31 0.00 -0.16 0.00 0.00 57.16 56.66 2q4i n GLU 114 Cb 0.53 0.00 -0.05 0.00 1.43 0.00 0.00 31.44 33.35 2q4i n GLU 114 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 2q4i s ASP 115 N -0.98 6.21 0.34 -1.84 1.01 -1.26 -4.55 116.67 115.60 2q4i s ASP 115 Ca 0.00 0.23 0.06 0.00 0.71 0.00 0.00 52.55 53.55 2q4i s ASP 115 Cb 0.00 -1.88 -0.03 0.00 1.01 0.00 0.00 42.92 42.02 2q4i s ASP 115 CO 0.00 0.19 0.24 -0.94 0.21 0.00 0.00 175.17 174.87 2q4i s SER 116 N -2.39 1.78 -0.12 0.27 1.04 -0.17 -4.96 113.70 109.16 2q4i s SER 116 Ca 0.33 -1.72 0.01 0.00 0.48 0.00 0.00 55.95 55.05 2q4i s SER 116 Cb -0.13 0.54 0.02 0.00 0.10 0.00 0.00 66.02 66.55 2q4i s SER 116 CO 0.25 -1.03 -0.14 -0.36 0.98 0.00 0.00 173.24 172.94 2q4i s PHE 117 N -3.45 1.95 0.22 5.02 0.08 -1.26 -0.18 117.98 120.35 2q4i s PHE 117 Ca 0.38 -0.96 0.08 0.00 0.12 0.00 0.00 56.93 56.55 2q4i s PHE 117 Cb 0.03 -1.43 -0.04 0.00 -0.57 0.00 0.00 43.02 41.01 2q4i s PHE 117 CO 0.24 -0.51 0.03 -0.51 -0.10 0.00 0.00 175.22 174.37 2q4i s LEU 118 N 1.15 3.36 0.19 -0.37 1.02 -0.77 -4.40 118.68 118.87 2q4i s LEU 118 Ca -0.03 -0.45 -0.26 0.00 0.02 0.00 0.00 54.13 53.41 2q4i s LEU 118 Cb -0.14 -1.95 -0.08 0.00 0.02 0.00 0.00 46.19 44.04 2q4i s LEU 118 CO -0.04 0.04 0.81 0.00 0.02 0.00 0.00 176.35 177.18 2q4i s ALA 119 N -2.01 3.42 -0.44 4.21 0.00 0.27 -1.49 121.76 125.72 2q4i s ALA 119 Ca 0.30 0.40 -0.23 0.00 0.00 0.00 0.00 51.96 52.43 2q4i s ALA 119 Cb -0.08 -3.00 0.02 0.00 0.00 0.00 0.00 23.12 20.06 2q4i s ALA 119 CO 0.20 0.28 0.77 0.42 0.00 0.00 0.00 175.76 177.43 2q4i s ILE 120 N -1.21 4.68 -0.45 0.00 1.01 -0.36 -1.13 121.20 123.73 2q4i s ILE 120 Ca 0.38 0.45 0.23 0.00 0.00 0.00 0.00 60.65 61.71 2q4i s ILE 120 Cb -0.23 -4.30 0.23 0.00 0.01 0.00 0.00 42.46 38.17 2q4i s ILE 120 CO 0.27 -0.67 1.48 0.71 0.00 0.00 0.00 174.94 176.72 2q4i h THR 121 N 5.94 0.00 0.00 2.92 1.35 -1.70 -3.38 112.91 118.05 2q4i h THR 121 Ca -0.25 -0.88 0.00 0.00 -0.55 0.00 0.00 66.41 64.73 2q4i h THR 121 Cb 1.09 1.72 0.00 0.00 -1.73 0.00 0.00 68.15 69.23 2q4i h THR 121 CO 0.95 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.83 2q4i n GLY 122 N 1.17 -2.45 3.10 5.82 0.00 -1.25 -5.00 105.19 106.58 2q4i n GLY 122 Ca 0.03 -1.37 -0.09 0.00 0.00 0.00 0.00 46.02 44.59 2q4i n GLY 122 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2q4i n GLY 123 N -0.94 1.54 3.16 -0.02 0.00 -1.19 -1.67 105.19 106.06 2q4i n GLY 123 Ca 0.00 -1.35 -0.10 0.00 0.00 0.00 0.00 46.02 44.57 2q4i n GLY 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q4i s ALA 124 N -2.18 -0.25 0.00 4.61 0.00 -1.03 -4.01 121.76 118.91 2q4i s ALA 124 Ca 0.18 -0.41 0.00 0.00 0.00 0.00 0.00 51.96 51.73 2q4i s ALA 124 Cb -0.03 0.29 0.00 0.00 0.00 0.00 0.00 23.12 23.38 2q4i s ALA 124 CO 0.13 -0.37 0.00 0.41 0.00 0.00 0.00 175.76 175.93 2q4i n GLY 125 N 0.62 0.51 0.00 0.00 0.00 -1.26 -2.13 105.19 102.92 2q4i n GLY 125 Ca -0.18 -1.04 0.07 0.00 0.00 0.00 0.00 46.02 44.87 2q4i n GLY 125 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2q4i n ILE 126 N 0.00 0.27 -0.31 -0.61 -5.35 0.90 -1.97 119.36 112.29 2q4i n ILE 126 Ca 0.00 0.07 0.07 0.00 -0.27 0.00 0.00 62.75 62.62 2q4i n ILE 126 Cb 0.00 -0.84 0.21 0.00 -1.74 0.00 0.00 39.64 37.27 2q4i n ILE 126 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 2q4i n PHE 127 N -1.13 0.67 -1.87 4.28 3.72 -1.11 -4.70 117.46 117.32 2q4i n PHE 127 Ca 0.09 -0.54 -0.42 0.00 -0.05 0.00 0.00 57.45 56.53 2q4i n PHE 127 Cb 0.08 -0.06 -0.03 0.00 -0.94 0.00 0.00 39.48 38.53 2q4i n PHE 127 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 2q4i s GLU 128 N -1.22 4.18 0.00 -1.08 -6.30 -0.83 -2.06 118.70 111.39 2q4i s GLU 128 Ca 0.32 2.40 0.00 0.00 -2.50 0.00 0.00 54.97 55.19 2q4i s GLU 128 Cb 0.18 -3.57 0.00 0.00 0.00 0.00 0.00 34.13 30.74 2q4i s GLU 128 CO 0.19 -0.75 0.00 0.41 0.02 0.00 0.00 175.26 175.13 2q4i n GLY 129 N 4.04 0.69 3.77 -1.50 0.00 -1.26 -4.59 105.19 106.34 2q4i n GLY 129 Ca 0.16 -0.05 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 2q4i n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q4i s ALA 130 N -2.00 3.44 0.33 4.61 0.00 -0.87 -4.29 121.76 122.98 2q4i s ALA 130 Ca 0.00 1.16 -0.05 0.00 0.00 0.00 0.00 51.96 53.07 2q4i s ALA 130 Cb 0.00 -3.44 0.01 0.00 0.00 0.00 0.00 23.12 19.69 2q4i s ALA 130 CO 0.00 -0.53 0.50 1.52 0.00 0.00 0.00 175.76 177.25 2q4i s TYR 131 N -1.17 0.88 -0.69 0.00 -0.85 0.08 -3.76 117.35 111.85 2q4i s TYR 131 Ca 0.49 -1.17 0.00 0.00 -0.52 0.00 0.00 57.07 55.87 2q4i s TYR 131 Cb -0.37 0.03 0.00 0.00 0.38 0.00 0.00 41.96 42.00 2q4i s TYR 131 CO 0.49 -1.15 0.00 0.41 -1.52 0.00 0.00 175.55 173.78 2q4i n GLY 132 N -0.53 0.52 3.48 5.49 0.00 -1.26 -0.54 105.19 112.35 2q4i n GLY 132 Ca -0.00 -2.24 -0.23 0.00 0.00 0.00 0.00 46.02 43.54 2q4i n GLY 132 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2q4i s GLN 133 N -0.27 1.67 -0.03 1.61 -2.07 -1.25 -1.23 119.66 118.09 2q4i s GLN 133 Ca 0.00 -1.86 0.01 0.00 -1.82 0.00 0.00 55.36 51.69 2q4i s GLN 133 Cb 0.00 -1.37 0.01 0.00 -1.09 0.00 0.00 33.01 30.56 2q4i s GLN 133 CO 0.00 0.07 -0.05 0.54 -1.32 0.00 0.00 175.29 174.53 2q4i s VAL 134 N -2.86 0.53 0.21 3.63 0.11 -0.56 -0.62 120.40 120.85 2q4i s VAL 134 Ca 0.31 -0.17 -0.29 0.00 -2.93 0.00 0.00 61.98 58.90 2q4i s VAL 134 Cb 0.04 -0.53 -0.09 0.00 -1.53 0.00 0.00 36.38 34.28 2q4i s VAL 134 CO 0.14 0.20 0.91 -0.75 -3.33 0.00 0.00 175.10 172.27 2q4i s LYS 135 N 0.58 4.79 -0.28 1.54 2.20 0.55 -1.84 119.74 127.28 2q4i s LYS 135 Ca -0.08 1.43 0.03 0.00 -0.36 0.00 0.00 55.97 56.99 2q4i s LYS 135 Cb -0.11 -3.29 0.07 0.00 -1.51 0.00 0.00 37.83 32.99 2q4i s LYS 135 CO 0.00 0.50 -0.07 -1.17 -0.36 0.00 0.00 175.35 174.25 2q4i s LEU 136 N -1.06 3.74 -0.21 5.43 0.20 0.74 -0.51 118.68 127.01 2q4i s LEU 136 Ca 0.41 -1.53 -0.05 0.00 0.69 0.00 0.00 54.13 53.65 2q4i s LEU 136 Cb -0.25 -1.58 -0.02 0.00 -0.43 0.00 0.00 46.19 43.91 2q4i s LEU 136 CO 0.31 -0.23 -0.01 -1.10 -0.29 0.00 0.00 176.35 175.02 2q4i s GLN 137 N 1.08 3.52 0.63 1.98 -0.21 0.19 -0.99 119.66 125.86 2q4i s GLN 137 Ca -0.05 -0.56 -0.09 0.00 0.02 0.00 0.00 55.36 54.68 2q4i s GLN 137 Cb -0.20 -3.07 -0.00 0.00 1.00 0.00 0.00 33.01 30.73 2q4i s GLN 137 CO -0.05 -0.10 0.99 -0.65 -2.12 0.00 0.00 175.29 173.36 2q4i s GLN 138 N 1.27 3.10 0.02 2.91 -0.21 -1.26 0.21 119.66 125.69 2q4i s GLN 138 Ca 0.04 0.35 0.00 0.00 0.02 0.00 0.00 55.36 55.76 2q4i s GLN 138 Cb -0.15 -2.15 0.00 0.00 1.00 0.00 0.00 33.01 31.72 2q4i s GLN 138 CO 0.00 -0.75 0.00 1.28 -2.12 0.00 0.00 175.29 173.70 2q4i n LEU 139 N -2.75 -0.00 -3.73 2.90 4.32 -0.36 -4.75 117.00 112.63 2q4i n LEU 139 Ca 0.05 0.03 -0.16 0.00 -0.02 0.00 0.00 56.01 55.91 2q4i n LEU 139 Cb 0.56 0.02 -0.16 0.00 -1.62 0.00 0.00 43.42 42.22 2q4i n LEU 139 CO 0.56 -0.46 -0.31 -0.69 -1.22 0.00 0.00 177.39 175.27 2q4i s VAL 140 N -2.00 -0.09 -0.14 4.08 1.01 -0.96 -4.61 120.40 117.69 2q4i s VAL 140 Ca 0.00 0.28 -0.15 0.00 0.00 0.00 0.00 61.98 62.11 2q4i s VAL 140 Cb 0.00 -0.15 -0.05 0.00 0.00 0.00 0.00 36.38 36.18 2q4i s VAL 140 CO 0.00 0.12 0.35 -0.47 0.00 0.00 0.00 175.10 175.10 2q4i s TYR 141 N 1.52 3.50 -0.69 5.22 6.14 -1.26 -0.19 117.35 131.58 2q4i s TYR 141 Ca -0.04 0.71 0.02 0.00 0.64 0.00 0.00 57.07 58.40 2q4i s TYR 141 Cb -0.12 -2.39 0.36 0.00 0.42 0.00 0.00 41.96 40.23 2q4i s TYR 141 CO -0.04 0.25 1.46 -0.35 0.64 0.00 0.00 175.55 177.51 2q4i n PRO 142 N 3.46 3.59 0.00 4.97 -0.04 -1.26 -4.97 135.00 140.75 2q4i n PRO 142 Ca -0.11 -4.35 0.00 0.00 -0.04 0.00 0.00 63.50 59.00 2q4i n PRO 142 Cb 0.52 -2.29 0.00 0.00 -0.04 0.00 0.00 33.50 31.68 2q4i n PRO 142 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2q4i n THR 143 N -0.37 0.00 -3.90 0.52 -2.24 0.73 -4.69 114.28 104.34 2q4i n THR 143 Ca 0.43 -0.02 -0.19 0.00 -2.27 0.00 0.00 64.05 61.99 2q4i n THR 143 Cb 0.41 0.41 -0.17 0.00 -2.10 0.00 0.00 70.33 68.88 2q4i n THR 143 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2q4i s LYS 144 N -1.43 0.42 -0.01 -0.78 1.02 -0.06 -2.55 119.74 116.36 2q4i s LYS 144 Ca 0.00 0.09 0.03 0.00 0.02 0.00 0.00 55.97 56.11 2q4i s LYS 144 Cb 0.00 -0.67 -0.00 0.00 -0.52 0.00 0.00 37.83 36.64 2q4i s LYS 144 CO 0.00 -0.19 -0.09 -0.51 -0.92 0.00 0.00 175.35 173.64 2q4i s LEU 145 N 1.38 1.91 -0.09 3.17 1.02 -0.99 -1.23 118.68 123.86 2q4i s LEU 145 Ca -0.04 -0.17 0.00 0.00 0.02 0.00 0.00 54.13 53.94 2q4i s LEU 145 Cb -0.13 -0.49 -0.03 0.00 0.02 0.00 0.00 46.19 45.57 2q4i s LEU 145 CO -0.02 0.09 -0.09 0.12 0.02 0.00 0.00 176.35 176.46 2q4i s PHE 146 N -0.03 2.88 0.03 0.29 5.36 0.13 -2.52 117.98 124.12 2q4i s PHE 146 Ca 0.01 -0.22 0.08 0.00 -0.96 0.00 0.00 56.93 55.84 2q4i s PHE 146 Cb -0.06 -1.77 -0.02 0.00 -0.34 0.00 0.00 43.02 40.83 2q4i s PHE 146 CO -0.00 0.11 -0.23 0.71 -1.46 0.00 0.00 175.22 174.35 2q4i s TYR 147 N -0.32 2.06 -0.29 10.12 2.02 -1.20 0.57 117.35 130.31 2q4i s TYR 147 Ca 0.04 -0.39 0.02 0.00 -0.37 0.00 0.00 57.07 56.37 2q4i s TYR 147 Cb -0.13 -1.26 0.08 0.00 -0.40 0.00 0.00 41.96 40.26 2q4i s TYR 147 CO 0.02 0.07 -0.01 0.99 -1.57 0.00 0.00 175.55 175.06 2q4i s THR 148 N -0.73 1.88 -0.34 -0.71 2.01 0.33 -3.43 115.64 114.65 2q4i s THR 148 Ca 0.09 -1.76 -0.27 0.00 0.31 0.00 0.00 61.69 60.07 2q4i s THR 148 Cb -0.09 -2.23 0.01 0.00 0.01 0.00 0.00 72.50 70.20 2q4i s THR 148 CO 0.01 -0.34 0.96 -0.36 -0.69 0.00 0.00 174.62 174.20 2q4i s PHE 149 N 1.17 3.12 -1.17 4.92 0.08 -0.20 0.21 117.98 126.10 2q4i s PHE 149 Ca 0.01 0.93 -0.11 0.00 0.12 0.00 0.00 56.93 57.89 2q4i s PHE 149 Cb -0.19 -3.60 0.22 0.00 -0.57 0.00 0.00 43.02 38.88 2q4i s PHE 149 CO -0.09 -0.77 1.35 0.66 -0.10 0.00 0.00 175.22 176.28 2q4i n TYR 150 N 6.72 4.79 -2.90 0.36 4.01 0.21 -1.89 117.16 128.47 2q4i n TYR 150 Ca 0.08 -3.49 -0.42 0.00 -0.16 0.00 0.00 57.90 53.92 2q4i n TYR 150 Cb 0.48 -1.93 -0.04 0.00 -0.31 0.00 0.00 39.34 37.53 2q4i n TYR 150 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2q4i s LEU 151 N 0.08 4.07 0.43 7.72 1.43 -0.75 -3.76 118.68 127.90 2q4i s LEU 151 Ca 0.37 0.71 0.07 0.00 -1.03 0.00 0.00 54.13 54.25 2q4i s LEU 151 Cb -0.04 -3.15 -0.03 0.00 0.03 0.00 0.00 46.19 43.00 2q4i s LEU 151 CO -0.02 -0.66 0.25 -0.54 0.23 0.00 0.00 176.35 175.61 2q4i s LYS 152 N 3.07 2.30 0.00 1.70 1.02 0.30 -1.63 119.74 126.49 2q4i s LYS 152 Ca 0.34 -1.81 0.00 0.00 0.02 0.00 0.00 55.97 54.52 2q4i s LYS 152 Cb -0.14 -2.07 0.00 0.00 -0.52 0.00 0.00 37.83 35.10 2q4i s LYS 152 CO 0.13 -0.20 0.00 0.41 -0.92 0.00 0.00 175.35 174.77 2q4i n GLY 153 N -1.38 1.94 3.79 -3.33 0.00 -1.26 -0.74 105.19 104.22 2q4i n GLY 153 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2q4i n GLY 153 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2q4i s LEU 154 N 0.00 3.85 0.00 0.99 1.02 -1.26 -4.48 118.68 118.80 2q4i s LEU 154 Ca 0.00 2.02 0.28 0.00 0.02 0.00 0.00 54.13 56.45 2q4i s LEU 154 Cb 0.00 -4.52 1.02 0.00 0.02 0.00 0.00 46.19 42.71 2q4i s LEU 154 CO 0.00 -0.88 1.74 0.00 0.02 0.00 0.00 176.35 177.24 2q4i n ALA 155 N -0.95 2.89 -2.72 4.21 0.00 -1.26 -4.94 120.51 117.73 2q4i n ALA 155 Ca 0.09 -0.27 -0.10 0.00 0.00 0.00 0.00 53.44 53.17 2q4i n ALA 155 Cb 0.52 -1.29 -0.09 0.00 0.00 0.00 0.00 19.45 18.59 2q4i n ALA 155 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2q4i s ASN 156 N -2.71 0.13 0.38 0.00 0.02 -1.26 -5.13 114.94 106.37 2q4i s ASN 156 Ca 0.21 -0.51 -0.27 0.00 -1.02 0.00 0.00 52.86 51.27 2q4i s ASN 156 Cb 0.19 0.27 -0.10 0.00 0.02 0.00 0.00 41.25 41.63 2q4i s ASN 156 CO 0.54 -0.57 1.36 -1.81 0.02 0.00 0.00 177.10 176.64 2q4i s ASP 157 N -2.26 6.42 0.84 -1.22 1.01 -1.26 -4.97 116.67 115.22 2q4i s ASP 157 Ca -0.03 2.78 -0.11 0.00 0.71 0.00 0.00 52.55 55.90 2q4i s ASP 157 Cb 0.00 -2.65 0.10 0.00 1.01 0.00 0.00 42.92 41.38 2q4i s ASP 157 CO -0.06 -0.79 1.15 -0.76 0.21 0.00 0.00 175.17 174.92 2q4i s LEU 158 N -2.19 3.00 0.26 1.23 1.43 -1.26 -4.96 118.68 116.19 2q4i s LEU 158 Ca 0.54 2.14 -0.31 0.00 -1.03 0.00 0.00 54.13 55.47 2q4i s LEU 158 Cb -0.41 -4.56 -0.11 0.00 0.03 0.00 0.00 46.19 41.14 2q4i s LEU 158 CO 0.54 -2.65 1.62 -2.84 0.23 0.00 0.00 176.35 173.25 2q4i s PRO 159 N -4.54 4.14 0.29 1.29 0.02 -1.26 -4.91 135.00 130.02 2q4i s PRO 159 Ca 0.67 2.56 0.03 0.00 0.02 0.00 0.00 61.00 64.28 2q4i s PRO 159 Cb -0.23 -3.05 0.64 0.00 0.02 0.00 0.00 34.50 31.88 2q4i s PRO 159 CO 0.54 -0.66 1.80 -0.07 -0.33 0.00 0.00 177.00 178.29 2q4i h LEU 160 N 5.57 0.83 -1.35 -5.54 3.38 -1.98 0.55 115.31 116.78 2q4i h LEU 160 Ca -0.45 0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.59 2q4i h LEU 160 Cb 1.21 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.88 2q4i h LEU 160 CO 0.85 0.37 0.00 1.05 0.09 0.00 0.00 178.44 180.80 2q4i h GLU 161 N 0.86 0.00 0.00 1.13 4.11 -2.03 -2.17 114.58 116.48 2q4i h GLU 161 Ca 0.53 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.96 2q4i h GLU 161 Cb 0.70 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.95 2q4i h GLU 161 CO -0.33 0.00 -0.80 1.28 0.07 0.00 0.00 179.01 179.23 2q4i n LEU 162 N -2.56 0.68 -1.07 3.06 4.77 0.16 -4.40 117.00 117.63 2q4i n LEU 162 Ca 0.00 -0.15 0.08 0.00 -0.03 0.00 0.00 56.01 55.91 2q4i n LEU 162 Cb 0.19 -0.13 0.27 0.00 -2.33 0.00 0.00 43.42 41.41 2q4i n LEU 162 CO 0.19 0.14 0.73 0.35 -1.33 0.00 0.00 177.39 177.47 2q4i n THR 163 N -1.64 1.92 -1.58 -5.08 -2.24 -0.81 -4.67 114.28 100.17 2q4i n THR 163 Ca 0.04 -1.47 -0.42 0.00 -2.27 0.00 0.00 64.05 59.93 2q4i n THR 163 Cb 0.36 0.01 0.01 0.00 -2.10 0.00 0.00 70.33 68.61 2q4i n THR 163 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2q4i n GLY 164 N 0.19 -0.41 3.63 3.38 0.00 -1.24 -4.78 105.19 105.96 2q4i n GLY 164 Ca 0.20 0.16 -0.58 0.00 0.00 0.00 0.00 46.02 45.80 2q4i n GLY 164 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2q4i n THR 165 N -0.41 0.08 -1.35 2.61 -1.04 -1.26 -4.17 114.28 108.73 2q4i n THR 165 Ca 0.10 -0.01 -0.33 0.00 -2.04 0.00 0.00 64.05 61.76 2q4i n THR 165 Cb 0.38 -0.65 0.10 0.00 -1.82 0.00 0.00 70.33 68.33 2q4i n THR 165 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 2q4i s PRO 166 N 1.63 2.06 -0.14 -2.82 0.02 -1.26 -4.18 135.00 130.32 2q4i s PRO 166 Ca 0.94 1.64 -0.20 0.00 0.02 0.00 0.00 61.00 63.40 2q4i s PRO 166 Cb -1.17 -1.84 -0.04 0.00 0.02 0.00 0.00 34.50 31.48 2q4i s PRO 166 CO 0.61 -1.87 0.55 0.08 -0.33 0.00 0.00 177.00 176.04 2q4i s VAL 167 N -2.20 5.12 0.08 3.83 1.01 -1.02 -4.91 120.40 122.31 2q4i s VAL 167 Ca 0.71 1.09 -0.35 0.00 0.00 0.00 0.00 61.98 63.43 2q4i s VAL 167 Cb -0.26 -3.89 -0.14 0.00 0.00 0.00 0.00 36.38 32.09 2q4i s VAL 167 CO 0.47 0.25 1.59 -2.65 0.00 0.00 0.00 175.10 174.76 2q4i n PRO 168 N 4.11 1.88 -2.10 2.72 -0.02 -1.26 -4.90 135.00 135.43 2q4i n PRO 168 Ca -0.05 0.68 -0.37 0.00 -2.02 0.00 0.00 63.50 61.75 2q4i n PRO 168 Cb 0.51 -2.43 0.01 0.00 -0.02 0.00 0.00 33.50 31.57 2q4i n PRO 168 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2q4i s PRO 169 N 1.52 3.34 0.16 0.52 0.04 -1.26 -4.97 135.00 134.35 2q4i s PRO 169 Ca 0.84 1.85 -0.25 0.00 0.04 0.00 0.00 61.00 63.48 2q4i s PRO 169 Cb -0.76 -2.17 0.07 0.00 0.04 0.00 0.00 34.50 31.67 2q4i s PRO 169 CO 0.44 -0.92 0.98 -1.54 0.04 0.00 0.00 177.00 176.01 2q4i s SER 170 N -1.42 -0.14 0.47 6.66 1.04 -1.26 -5.04 113.70 114.01 2q4i s SER 170 Ca 0.71 -0.45 0.26 0.00 0.48 0.00 0.00 55.95 56.94 2q4i s SER 170 Cb -0.31 0.48 1.06 0.00 0.10 0.00 0.00 66.02 67.36 2q4i s SER 170 CO 0.35 -0.91 1.88 0.07 0.98 0.00 0.00 173.24 175.62 2q4i h LYS 171 N 2.00 0.00 -0.61 4.02 2.10 -1.96 -3.22 116.57 118.90 2q4i h LYS 171 Ca -0.25 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.40 2q4i h LYS 171 Cb 1.23 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 2q4i h LYS 171 CO 0.27 0.18 0.00 -0.25 -2.00 0.00 0.00 179.45 177.66 2q4i n ASP 172 N -3.38 5.15 -4.74 7.07 8.00 -1.26 -4.91 116.55 122.48 2q4i n ASP 172 Ca -0.00 -2.65 -0.35 0.00 0.71 0.00 0.00 54.79 52.50 2q4i n ASP 172 Cb 0.39 -0.62 0.06 0.00 -0.02 0.00 0.00 41.12 40.93 2q4i n ASP 172 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 2q4i s ILE 173 N -2.23 2.49 -0.11 0.53 -5.25 -1.22 -5.04 121.20 110.37 2q4i s ILE 173 Ca 0.53 0.27 -0.08 0.00 -0.99 0.00 0.00 60.65 60.37 2q4i s ILE 173 Cb 0.37 -2.95 0.04 0.00 2.95 0.00 0.00 42.46 42.87 2q4i s ILE 173 CO 0.21 -0.10 0.28 -1.61 -1.79 0.00 0.00 174.94 171.93 2q4i s GLU 174 N -3.67 0.29 0.89 0.37 0.41 -1.26 -5.08 118.70 110.66 2q4i s GLU 174 Ca 0.76 0.46 -0.11 0.00 -0.41 0.00 0.00 54.97 55.66 2q4i s GLU 174 Cb -0.30 0.06 0.12 0.00 -1.78 0.00 0.00 34.13 32.23 2q4i s GLU 174 CO 0.40 -0.09 1.07 -0.35 -0.49 0.00 0.00 175.26 175.81 2q4i n PRO 175 N 3.43 -0.26 -1.74 0.39 -0.04 -1.26 -4.90 135.00 130.62 2q4i n PRO 175 Ca -0.17 -0.01 -0.39 0.00 -0.04 0.00 0.00 63.50 62.89 2q4i n PRO 175 Cb 0.56 -2.33 0.03 0.00 -0.04 0.00 0.00 33.50 31.73 2q4i n PRO 175 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2q4i n ALA 176 N -3.91 1.61 -0.28 0.55 0.00 0.27 -4.79 120.51 113.97 2q4i n ALA 176 Ca 0.12 0.18 0.13 0.00 0.00 0.00 0.00 53.44 53.87 2q4i n ALA 176 Cb 0.52 -2.34 0.39 0.00 0.00 0.00 0.00 19.45 18.02 2q4i n ALA 176 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2q4i h PRO 177 N 1.73 0.64 -0.66 0.00 0.11 -1.90 -1.64 132.00 130.27 2q4i h PRO 177 Ca -0.50 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.51 2q4i h PRO 177 Cb 1.30 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.23 2q4i h PRO 177 CO 0.58 0.42 0.18 0.93 -0.21 0.00 0.00 178.00 179.90 2q4i h GLU 178 N 0.66 1.03 -0.18 1.05 3.07 -1.91 -1.19 114.58 117.11 2q4i h GLU 178 Ca 0.47 -0.22 -0.05 0.00 -0.50 0.00 0.00 59.36 59.06 2q4i h GLU 178 Cb 0.82 -0.15 -0.00 0.00 -0.84 0.00 0.00 28.75 28.58 2q4i h GLU 178 CO -0.22 0.90 -0.09 0.00 -1.40 0.00 0.00 179.01 178.19 2q4i h ALA 179 N 1.21 0.25 0.00 3.43 0.00 -1.49 0.91 119.26 123.56 2q4i h ALA 179 Ca 0.21 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2q4i h ALA 179 Cb 0.32 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2q4i h ALA 179 CO -0.00 0.07 -0.03 0.87 0.00 0.00 0.00 179.25 180.15 2q4i h LYS 180 N 0.05 0.00 -0.01 0.00 1.57 -1.35 -1.40 116.57 115.43 2q4i h LYS 180 Ca 0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 2q4i h LYS 180 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.88 2q4i h LYS 180 CO 0.03 0.03 -0.08 0.00 -0.57 0.00 0.00 179.45 178.85 2q4i n ALA 181 N -2.53 2.75 -1.83 3.86 0.00 -0.46 -4.93 120.51 117.36 2q4i n ALA 181 Ca -0.03 -0.38 -0.19 0.00 0.00 0.00 0.00 53.44 52.84 2q4i n ALA 181 Cb 0.12 -1.22 -0.06 0.00 0.00 0.00 0.00 19.45 18.29 2q4i n ALA 181 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2q4i n LEU 182 N -0.34 -1.57 -4.77 0.00 4.77 0.11 -4.95 117.00 110.25 2q4i n LEU 182 Ca 0.17 0.31 -0.38 0.00 -0.03 0.00 0.00 56.01 56.08 2q4i n LEU 182 Cb 0.32 -2.72 -0.02 0.00 -2.33 0.00 0.00 43.42 38.67 2q4i n LEU 182 CO 0.20 -0.74 0.85 -1.61 -1.33 0.00 0.00 177.39 174.76 2q4i s GLU 183 N -4.09 4.01 0.29 3.23 2.02 -0.03 -4.88 118.70 119.24 2q4i s GLU 183 Ca 0.00 1.85 0.03 0.00 0.02 0.00 0.00 54.97 56.87 2q4i s GLU 183 Cb 0.00 -2.64 0.72 0.00 0.10 0.00 0.00 34.13 32.30 2q4i s GLU 183 CO 0.00 -0.37 1.66 -1.35 0.02 0.00 0.00 175.26 175.22 2q4i h PRO 184 N 2.56 0.24 -0.08 0.39 0.11 -1.92 0.25 132.00 133.55 2q4i h PRO 184 Ca -0.49 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 65.63 2q4i h PRO 184 Cb 1.24 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 2q4i h PRO 184 CO 0.62 0.16 0.08 0.66 -0.21 0.00 0.00 178.00 179.31 2q4i h SER 185 N 0.25 0.00 -0.69 -2.05 4.64 -1.92 -1.77 113.55 112.01 2q4i h SER 185 Ca 0.55 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.87 2q4i h SER 185 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 2q4i h SER 185 CO -0.62 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 175.95 2q4i n GLY 186 N -1.42 2.69 3.14 -0.77 0.00 0.85 -4.86 105.19 104.82 2q4i n GLY 186 Ca -0.01 -0.85 -0.09 0.00 0.00 0.00 0.00 46.02 45.06 2q4i n GLY 186 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2q4i s VAL 187 N -1.67 0.54 0.35 1.61 -7.23 -0.67 0.12 120.40 113.45 2q4i s VAL 187 Ca 0.52 -1.89 -0.01 0.00 -1.81 0.00 0.00 61.98 58.79 2q4i s VAL 187 Cb 0.32 -1.62 -0.04 0.00 0.56 0.00 0.00 36.38 35.60 2q4i s VAL 187 CO 0.27 -0.91 0.57 0.27 -0.31 0.00 0.00 175.10 174.99 2q4i s ILE 188 N -3.71 5.08 0.36 -0.62 -4.36 -0.74 -4.88 121.20 112.33 2q4i s ILE 188 Ca 0.10 -0.34 -0.27 0.00 -0.26 0.00 0.00 60.65 59.87 2q4i s ILE 188 Cb 0.06 -3.85 -0.12 0.00 1.25 0.00 0.00 42.46 39.81 2q4i s ILE 188 CO -0.06 -0.55 1.29 -1.20 0.24 0.00 0.00 174.94 174.65 2q4i n SER 189 N -1.71 2.73 -4.26 4.36 7.64 -1.26 -1.88 113.62 119.23 2q4i n SER 189 Ca -0.04 1.18 -0.36 0.00 1.01 0.00 0.00 58.87 60.66 2q4i n SER 189 Cb 0.56 -1.49 -0.04 0.00 -1.01 0.00 0.00 64.21 62.23 2q4i n SER 189 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2q4i n ASN 190 N 0.61 -2.54 -4.61 6.43 3.02 -1.26 -3.18 115.26 113.74 2q4i n ASN 190 Ca 0.05 -1.07 -0.42 0.00 -0.03 0.00 0.00 54.58 53.11 2q4i n ASN 190 Cb 0.37 -2.52 0.00 0.00 -0.61 0.00 0.00 39.78 37.03 2q4i n ASN 190 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2q4i n TYR 191 N -4.34 1.21 -2.75 3.10 0.18 -0.79 -4.25 117.16 109.52 2q4i n TYR 191 Ca 0.03 0.59 -0.40 0.00 1.88 0.00 0.00 57.90 59.99 2q4i n TYR 191 Cb 0.51 -2.24 -0.05 0.00 -0.38 0.00 0.00 39.34 37.18 2q4i n TYR 191 CO 0.00 0.00 0.00 0.99 -2.08 0.00 0.00 176.86 175.77 2q4i s THR 192 N -1.23 4.25 0.00 -3.48 2.01 -1.06 -4.88 115.64 111.26 2q4i s THR 192 Ca 0.62 2.07 0.00 0.00 0.31 0.00 0.00 61.69 64.68 2q4i s THR 192 Cb -0.59 -4.32 0.00 0.00 0.01 0.00 0.00 72.50 67.60 2q4i s THR 192 CO 0.58 0.43 0.00 -3.20 -0.69 0.00 0.00 174.62 171.74