#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 5.05 -0.21 3.15 1.01 -1.26 -4.41 120.40 123.73 2q4i s VAL 21 Ca 0.00 1.26 -0.07 0.00 0.00 0.00 0.00 61.98 63.17 2q4i s VAL 21 Cb 0.00 -3.97 -0.03 0.00 0.00 0.00 0.00 36.38 32.38 2q4i s VAL 21 CO 0.00 0.19 0.06 -1.10 0.00 0.00 0.00 175.10 174.24 2q4i s GLN 22 N 1.36 3.81 0.03 2.72 -0.21 0.15 -4.93 119.66 122.58 2q4i s GLN 22 Ca 0.32 -0.42 -0.22 0.00 0.02 0.00 0.00 55.36 55.06 2q4i s GLN 22 Cb -0.16 -3.23 -0.06 0.00 1.00 0.00 0.00 33.01 30.56 2q4i s GLN 22 CO 0.13 0.07 0.65 -2.00 -2.12 0.00 0.00 175.29 172.02 2q4i s GLU 23 N 0.91 4.37 -0.07 2.91 2.12 -1.26 -0.20 118.70 127.47 2q4i s GLU 23 Ca 0.03 0.85 -0.01 0.00 0.36 0.00 0.00 54.97 56.20 2q4i s GLU 23 Cb -0.14 -3.33 0.03 0.00 0.26 0.00 0.00 34.13 30.95 2q4i s GLU 23 CO 0.03 0.38 -0.00 -1.17 -0.54 0.00 0.00 175.26 173.95 2q4i s LEU 24 N -0.30 0.64 -0.04 2.70 2.96 0.40 -4.94 118.68 120.09 2q4i s LEU 24 Ca 0.33 -0.10 0.05 0.00 -0.22 0.00 0.00 54.13 54.19 2q4i s LEU 24 Cb -0.19 -0.47 -0.02 0.00 0.50 0.00 0.00 46.19 46.00 2q4i s LEU 24 CO 0.19 -0.19 -0.20 -0.44 -1.32 0.00 0.00 176.35 174.40 2q4i s SER 25 N 1.95 3.57 0.04 3.68 0.01 -1.26 0.31 113.70 122.00 2q4i s SER 25 Ca 0.05 -0.33 -0.01 0.00 1.31 0.00 0.00 55.95 56.97 2q4i s SER 25 Cb -0.12 -0.67 -0.03 0.00 0.21 0.00 0.00 66.02 65.41 2q4i s SER 25 CO -0.05 0.32 -0.01 0.68 0.41 0.00 0.00 173.24 174.58 2q4i s VAL 26 N -0.61 0.17 0.11 3.43 -7.23 -0.16 -1.95 120.40 114.15 2q4i s VAL 26 Ca 0.09 -1.38 0.03 0.00 -1.81 0.00 0.00 61.98 58.91 2q4i s VAL 26 Cb -0.11 -0.96 -0.04 0.00 0.56 0.00 0.00 36.38 35.83 2q4i s VAL 26 CO 0.00 -0.76 0.16 -0.31 -0.31 0.00 0.00 175.10 173.88 2q4i s TYR 27 N -2.83 3.31 -0.11 2.82 2.02 -0.07 -0.50 117.35 121.99 2q4i s TYR 27 Ca -0.03 0.10 0.00 0.00 -0.37 0.00 0.00 57.07 56.77 2q4i s TYR 27 Cb 0.00 -1.64 0.02 0.00 -0.40 0.00 0.00 41.96 39.95 2q4i s TYR 27 CO -0.06 0.54 -0.09 -2.00 -1.57 0.00 0.00 175.55 172.36 2q4i s GLU 28 N -2.71 1.66 0.04 -0.62 2.12 -0.88 -0.20 118.70 118.11 2q4i s GLU 28 Ca 0.32 -0.32 0.03 0.00 0.36 0.00 0.00 54.97 55.36 2q4i s GLU 28 Cb -0.12 -1.62 -0.02 0.00 0.26 0.00 0.00 34.13 32.63 2q4i s GLU 28 CO 0.25 -0.21 -0.10 0.42 -0.54 0.00 0.00 175.26 175.08 2q4i s ILE 29 N 1.49 0.73 -0.27 -3.70 1.01 -0.16 0.10 121.20 120.41 2q4i s ILE 29 Ca 0.01 -1.01 -0.10 0.00 0.00 0.00 0.00 60.65 59.56 2q4i s ILE 29 Cb -0.13 -0.73 -0.04 0.00 0.01 0.00 0.00 42.46 41.56 2q4i s ILE 29 CO -0.06 -0.23 0.15 0.21 0.00 0.00 0.00 174.94 175.01 2q4i s ASN 30 N -1.36 5.72 -0.13 3.58 3.84 -0.41 -1.54 114.94 124.64 2q4i s ASN 30 Ca -0.05 -0.08 0.18 0.00 0.21 0.00 0.00 52.86 53.11 2q4i s ASN 30 Cb -0.09 -2.05 0.72 0.00 -0.55 0.00 0.00 41.25 39.28 2q4i s ASN 30 CO 0.01 -0.05 1.63 -0.62 -2.79 0.00 0.00 177.10 175.28 2q4i n GLU 31 N 5.01 3.82 -3.63 0.43 1.02 -1.26 -4.87 120.64 121.17 2q4i n GLU 31 Ca -0.15 -2.90 -0.22 0.00 -0.02 0.00 0.00 57.16 53.86 2q4i n GLU 31 Cb 0.52 -1.92 0.06 0.00 -0.02 0.00 0.00 31.44 30.08 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 0.98 -3.38 -0.49 -4.62 4.77 -1.26 -4.90 117.00 108.10 2q4i n LEU 32 Ca 0.26 -0.66 0.00 0.00 -0.03 0.00 0.00 56.01 55.57 2q4i n LEU 32 Cb 0.92 -2.91 0.00 0.00 -2.33 0.00 0.00 43.42 39.10 2q4i n LEU 32 CO 0.24 0.49 0.25 -0.90 -1.33 0.00 0.00 177.39 176.14 2q4i n ASP 33 N -3.03 0.00 -0.06 -1.43 5.75 -1.26 -4.85 116.55 111.68 2q4i n ASP 33 Ca -0.14 -1.77 0.01 0.00 -0.01 0.00 0.00 54.79 52.89 2q4i n ASP 33 Cb 0.61 -0.15 0.02 0.00 -1.03 0.00 0.00 41.12 40.57 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 1.59 -1.84 0.11 1.74 -1.26 -5.00 116.66 112.00 2q4i n ARG 34 Ca 0.00 -1.32 -0.13 0.00 -0.77 0.00 0.00 57.85 55.63 2q4i n ARG 34 Cb 0.65 -0.88 -0.03 0.00 -1.02 0.00 0.00 32.46 31.19 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 -0.44 -0.33 -4.28 -1.55 8.25 -1.26 -5.01 115.22 110.60 2q4i n HIS 35 Ca 0.02 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.27 2q4i n HIS 35 Cb 0.42 -2.64 -0.12 0.00 1.12 0.00 0.00 29.99 28.77 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 -2.62 2.38 0.59 0.41 0.15 -1.26 -4.14 113.70 109.20 2q4i s SER 36 Ca 0.00 -0.77 -0.14 0.00 0.70 0.00 0.00 55.95 55.75 2q4i s SER 36 Cb 0.00 -0.12 -0.05 0.00 -1.71 0.00 0.00 66.02 64.14 2q4i s SER 36 CO 0.00 -0.03 1.02 -2.16 1.20 0.00 0.00 173.24 173.27 2q4i s PRO 37 N -2.38 3.60 -0.19 5.44 0.04 -1.26 -4.83 135.00 135.42 2q4i s PRO 37 Ca 0.09 0.91 -0.05 0.00 0.04 0.00 0.00 61.00 61.99 2q4i s PRO 37 Cb -0.07 -2.08 -0.03 0.00 0.04 0.00 0.00 34.50 32.36 2q4i s PRO 37 CO 0.05 -0.57 0.01 0.21 0.04 0.00 0.00 177.00 176.74 2q4i s LYS 38 N -4.62 3.69 -0.20 4.56 2.47 -0.84 -5.05 119.74 119.75 2q4i s LYS 38 Ca 0.58 -0.49 -0.10 0.00 -1.56 0.00 0.00 55.97 54.40 2q4i s LYS 38 Cb -0.12 -3.08 -0.05 0.00 -1.46 0.00 0.00 37.83 33.12 2q4i s LYS 38 CO 0.44 0.10 0.13 0.42 0.16 0.00 0.00 175.35 176.59 2q4i s ILE 39 N 0.78 5.34 -0.46 5.43 1.01 -1.26 -3.12 121.20 128.91 2q4i s ILE 39 Ca 0.01 0.16 0.04 0.00 0.00 0.00 0.00 60.65 60.86 2q4i s ILE 39 Cb -0.14 -3.44 0.12 0.00 0.01 0.00 0.00 42.46 39.01 2q4i s ILE 39 CO 0.02 0.43 0.20 -0.76 0.00 0.00 0.00 174.94 174.83 2q4i s LEU 40 N 0.48 4.17 -0.15 2.97 1.43 -0.24 -5.02 118.68 122.32 2q4i s LEU 40 Ca 0.07 -2.71 -0.23 0.00 -1.03 0.00 0.00 54.13 50.23 2q4i s LEU 40 Cb -0.12 -1.54 -0.02 0.00 0.03 0.00 0.00 46.19 44.54 2q4i s LEU 40 CO -0.01 -0.28 0.73 -0.75 0.23 0.00 0.00 176.35 176.27 2q4i s LYS 41 N 0.14 4.31 0.00 1.70 2.47 -1.26 -1.33 119.74 125.76 2q4i s LYS 41 Ca 0.15 0.84 0.00 0.00 -1.56 0.00 0.00 55.97 55.40 2q4i s LYS 41 Cb -0.24 -3.54 0.00 0.00 -1.46 0.00 0.00 37.83 32.59 2q4i s LYS 41 CO -0.03 -0.19 0.00 0.09 0.16 0.00 0.00 175.35 175.39 2q4i n ASN 42 N 4.76 1.04 -4.77 1.43 3.02 -1.25 -4.96 115.26 114.53 2q4i n ASN 42 Ca 0.01 -0.03 -0.35 0.00 -0.03 0.00 0.00 54.58 54.18 2q4i n ASN 42 Cb 0.50 0.26 0.01 0.00 -0.61 0.00 0.00 39.78 39.94 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 -0.47 2.66 -1.25 5.41 0.00 -1.26 -4.89 121.76 121.96 2q4i s ALA 43 Ca 0.00 0.78 -0.08 0.00 0.00 0.00 0.00 51.96 52.65 2q4i s ALA 43 Cb 0.00 -3.35 0.18 0.00 0.00 0.00 0.00 23.12 19.95 2q4i s ALA 43 CO 0.00 -0.84 1.87 1.19 0.00 0.00 0.00 175.76 177.97 2q4i n PHE 44 N -1.47 2.79 -3.56 0.00 3.72 -1.26 -4.88 117.46 112.80 2q4i n PHE 44 Ca 0.11 -2.75 -0.16 0.00 -0.05 0.00 0.00 57.45 54.60 2q4i n PHE 44 Cb 0.51 -1.83 -0.06 0.00 -0.94 0.00 0.00 39.48 37.15 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 0.42 -0.66 0.00 4.37 0.15 -1.26 -5.14 113.70 111.58 2q4i s SER 45 Ca 0.39 0.93 -0.01 0.00 0.70 0.00 0.00 55.95 57.96 2q4i s SER 45 Cb 0.10 0.82 -0.06 0.00 -1.71 0.00 0.00 66.02 65.17 2q4i s SER 45 CO 0.01 -0.46 2.09 0.18 1.20 0.00 0.00 173.24 176.25 2q4i n LEU 46 N 1.49 4.46 -4.92 3.45 4.77 -1.26 -4.96 117.00 120.03 2q4i n LEU 46 Ca -0.17 -2.23 -0.28 0.00 -0.03 0.00 0.00 56.01 53.31 2q4i n LEU 46 Cb 0.56 -1.02 -0.03 0.00 -2.33 0.00 0.00 43.42 40.61 2q4i n LEU 46 CO 0.16 0.99 0.10 -0.36 -1.33 0.00 0.00 177.39 176.94 2q4i s PHE 48 N 0.61 3.48 0.07 -1.77 0.08 -1.26 -5.24 117.98 113.94 2q4i s PHE 48 Ca 0.16 0.47 -0.21 0.00 0.12 0.00 0.00 56.93 57.47 2q4i s PHE 48 Cb 0.08 -1.96 0.07 0.00 -0.57 0.00 0.00 43.02 40.64 2q4i s PHE 48 CO 0.00 0.30 0.96 0.41 -0.10 0.00 0.00 175.22 176.79 2q4i n GLY 49 N -0.75 0.50 3.60 4.36 0.00 -1.26 -3.55 105.19 108.09 2q4i n GLY 49 Ca -0.03 -1.06 -0.42 0.00 0.00 0.00 0.00 46.02 44.50 2q4i n GLY 49 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2q4i n LEU 50 N 0.00 2.28 0.00 0.99 7.94 -1.18 -1.94 117.00 125.09 2q4i n LEU 50 Ca 0.01 1.07 0.00 0.00 -1.11 0.00 0.00 56.01 55.98 2q4i n LEU 50 Cb 0.48 -1.33 0.00 0.00 0.53 0.00 0.00 43.42 43.11 2q4i n LEU 50 CO 0.15 -1.49 0.00 0.61 -1.11 0.00 0.00 177.39 175.55 2q4i n GLY 51 N 1.21 2.67 3.71 -3.96 0.00 -1.26 -3.99 105.19 103.57 2q4i n GLY 51 Ca 0.09 -0.63 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 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 7.37 -0.05 1.61 1.01 -0.82 -3.78 116.67 122.08 2q4i s ASP 52 Ca 0.00 1.72 0.06 0.00 0.71 0.00 0.00 52.55 55.04 2q4i s ASP 52 Cb 0.00 -2.57 -0.01 0.00 1.01 0.00 0.00 42.92 41.34 2q4i s ASP 52 CO 0.00 -0.24 -0.25 -0.76 0.21 0.00 0.00 175.17 174.13 2q4i s LEU 53 N 0.81 2.05 -0.45 1.23 1.43 -0.44 -1.31 118.68 122.00 2q4i s LEU 53 Ca 0.52 -0.49 0.02 0.00 -1.03 0.00 0.00 54.13 53.15 2q4i s LEU 53 Cb -0.22 -1.33 0.14 0.00 0.03 0.00 0.00 46.19 44.81 2q4i s LEU 53 CO 0.29 0.25 0.27 -0.69 0.23 0.00 0.00 176.35 176.70 2q4i s VAL 54 N -0.25 1.26 0.51 -1.59 1.01 0.22 -1.08 120.40 120.50 2q4i s VAL 54 Ca -0.01 -2.64 -0.22 0.00 0.00 0.00 0.00 61.98 59.11 2q4i s VAL 54 Cb -0.13 -1.88 -0.06 0.00 0.00 0.00 0.00 36.38 34.32 2q4i s VAL 54 CO 0.03 -0.96 1.29 -2.16 0.00 0.00 0.00 175.10 173.30 2q4i s PRO 55 N 0.22 3.39 0.36 2.72 0.04 -1.18 -1.72 135.00 138.82 2q4i s PRO 55 Ca 0.20 2.09 -0.10 0.00 0.04 0.00 0.00 61.00 63.23 2q4i s PRO 55 Cb -0.18 -2.33 0.03 0.00 0.04 0.00 0.00 34.50 32.05 2q4i s PRO 55 CO -0.04 -0.95 0.64 -0.59 0.04 0.00 0.00 177.00 176.10 2q4i s PHE 56 N -1.38 0.54 -0.30 0.56 -0.12 -0.85 -1.98 117.98 114.45 2q4i s PHE 56 Ca 0.68 -1.00 -0.19 0.00 -0.05 0.00 0.00 56.93 56.37 2q4i s PHE 56 Cb -0.37 0.40 0.19 0.00 -0.63 0.00 0.00 43.02 42.61 2q4i s PHE 56 CO 0.44 -1.35 1.24 -0.08 -0.05 0.00 0.00 175.22 175.42 2q4i s THR 57 N -2.75 -0.13 0.16 -4.49 -1.32 -1.26 -2.24 115.64 103.60 2q4i s THR 57 Ca 0.22 0.00 0.10 0.00 -1.21 0.00 0.00 61.69 60.81 2q4i s THR 57 Cb -0.03 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.92 2q4i s THR 57 CO 0.15 0.00 -0.23 0.20 -2.21 0.00 0.00 174.62 172.53 2q4i s ASN 58 N 2.11 3.13 0.36 8.08 0.01 -1.05 -4.79 114.94 122.78 2q4i s ASN 58 Ca -0.00 -0.81 -0.28 0.00 -0.71 0.00 0.00 52.86 51.06 2q4i s ASN 58 Cb -0.02 -0.21 -0.12 0.00 0.41 0.00 0.00 41.25 41.32 2q4i s ASN 58 CO -0.16 0.10 1.43 0.29 -1.51 0.00 0.00 177.10 177.24 2q4i n LYS 59 N 0.57 2.48 -4.02 -0.60 5.02 -0.59 0.10 118.16 121.13 2q4i n LYS 59 Ca -0.15 0.87 -0.31 0.00 -2.02 0.00 0.00 58.31 56.70 2q4i n LYS 59 Cb 0.55 -2.55 -0.15 0.00 -0.02 0.00 0.00 35.03 32.85 2q4i n LYS 59 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2q4i s LEU 60 N -1.58 2.82 0.11 -0.35 2.96 -0.47 -0.98 118.68 121.18 2q4i s LEU 60 Ca 0.55 -1.16 0.02 0.00 -0.22 0.00 0.00 54.13 53.32 2q4i s LEU 60 Cb -0.51 -1.36 -0.04 0.00 0.50 0.00 0.00 46.19 44.78 2q4i s LEU 60 CO 0.62 -0.18 0.17 -0.31 -1.32 0.00 0.00 176.35 175.34 2q4i s TYR 61 N 1.27 3.34 0.70 5.38 2.02 0.72 -3.09 117.35 127.71 2q4i s TYR 61 Ca -0.05 0.12 -0.16 0.00 -0.37 0.00 0.00 57.07 56.60 2q4i s TYR 61 Cb -0.18 -1.65 -0.02 0.00 -0.40 0.00 0.00 41.96 39.70 2q4i s TYR 61 CO -0.07 0.54 0.73 0.25 -1.57 0.00 0.00 175.55 175.43 2q4i n THR 62 N 0.03 2.33 0.03 -0.71 -2.24 -0.70 -0.89 114.28 112.14 2q4i n THR 62 Ca -0.07 -0.40 0.10 0.00 -2.27 0.00 0.00 64.05 61.41 2q4i n THR 62 Cb 0.53 -0.90 0.54 0.00 -2.10 0.00 0.00 70.33 68.40 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 -0.24 0.35 -0.76 3.38 0.00 -1.71 0.21 103.07 104.30 2q4i h GLY 63 Ca -0.46 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 46.75 2q4i h GLY 63 CO 0.45 0.09 0.00 2.09 0.00 0.00 0.00 176.54 179.17 2q4i n ASP 64 N -4.47 1.07 -0.23 0.19 5.68 -1.26 -2.70 116.55 114.83 2q4i n ASP 64 Ca 0.05 -2.03 -0.02 0.00 -0.50 0.00 0.00 54.79 52.29 2q4i n ASP 64 Cb 0.26 -0.18 -0.01 0.00 -1.14 0.00 0.00 41.12 40.05 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 0.01 0.35 0.14 -2.12 4.77 0.74 -4.77 117.00 116.13 2q4i n LEU 65 Ca 0.06 0.05 0.12 0.00 -0.03 0.00 0.00 56.01 56.21 2q4i n LEU 65 Cb 0.19 -1.75 0.11 0.00 -2.33 0.00 0.00 43.42 39.64 2q4i n LEU 65 CO 0.04 -0.62 0.42 0.11 -1.33 0.00 0.00 177.39 176.02 2q4i h LYS 66 N 0.00 0.00 -4.23 3.23 1.57 -1.90 0.11 116.57 115.35 2q4i h LYS 66 Ca -0.04 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.40 2q4i h LYS 66 Cb 0.65 0.00 -0.29 0.00 0.08 0.00 0.00 32.23 32.66 2q4i h LYS 66 CO 0.06 0.00 -0.76 0.15 -0.57 0.00 0.00 179.45 178.34 2q4i s LYS 67 N -3.26 0.45 -0.09 3.15 1.02 -1.26 -4.28 119.74 115.46 2q4i s LYS 67 Ca 0.04 -0.16 -0.27 0.00 0.02 0.00 0.00 55.97 55.60 2q4i s LYS 67 Cb 0.08 -0.45 -0.02 0.00 -0.52 0.00 0.00 37.83 36.92 2q4i s LYS 67 CO 0.72 0.08 0.89 0.50 -0.92 0.00 0.00 175.35 176.62 2q4i s ARG 68 N 0.06 4.42 -0.10 1.68 6.06 0.26 -1.73 118.95 129.61 2q4i s ARG 68 Ca -0.00 1.19 0.07 0.00 -2.50 0.00 0.00 55.73 54.49 2q4i s ARG 68 Cb -0.04 -3.51 -0.11 0.00 0.06 0.00 0.00 34.95 31.34 2q4i s ARG 68 CO -0.00 -0.18 0.01 1.33 -2.50 0.00 0.00 175.30 173.95 2q4i n VAL 69 N 4.30 0.66 0.00 7.11 0.24 -1.20 -1.77 118.33 127.67 2q4i n VAL 69 Ca 0.05 -0.38 0.00 0.00 -2.04 0.00 0.00 64.34 61.97 2q4i n VAL 69 Cb 0.50 -0.78 0.00 0.00 -1.47 0.00 0.00 33.84 32.09 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 2.49 -0.63 0.60 7.63 0.00 -1.18 0.52 105.19 114.63 2q4i n GLY 70 Ca -0.17 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.26 2q4i n GLY 70 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2q4i n ILE 71 N 0.00 0.00 -4.14 -0.61 -6.64 -1.24 -1.37 119.36 105.35 2q4i n ILE 71 Ca 0.00 -0.04 -0.23 0.00 -1.77 0.00 0.00 62.75 60.71 2q4i n ILE 71 Cb 0.00 0.10 -0.06 0.00 -1.44 0.00 0.00 39.64 38.23 2q4i n ILE 71 CO 0.00 0.00 0.00 0.42 -1.77 0.00 0.00 176.55 175.20 2q4i s THR 72 N -2.25 3.24 -0.29 7.28 -4.23 0.28 -2.27 115.64 117.39 2q4i s THR 72 Ca 0.04 -1.72 -0.16 0.00 -1.18 0.00 0.00 61.69 58.67 2q4i s THR 72 Cb -0.00 -2.98 0.17 0.00 1.34 0.00 0.00 72.50 71.03 2q4i s THR 72 CO 0.00 -0.24 1.08 0.00 -0.54 0.00 0.00 174.62 174.92 2q4i s ALA 73 N -2.38 -2.54 0.00 3.99 0.00 -0.88 -2.54 121.76 117.42 2q4i s ALA 73 Ca 0.36 2.09 0.00 0.00 0.00 0.00 0.00 51.96 54.41 2q4i s ALA 73 Cb -0.04 -1.89 0.00 0.00 0.00 0.00 0.00 23.12 21.19 2q4i s ALA 73 CO 0.22 -0.50 0.00 0.41 0.00 0.00 0.00 175.76 175.89 2q4i n GLY 74 N 3.84 -0.33 3.56 0.00 0.00 -0.95 -1.50 105.19 109.80 2q4i n GLY 74 Ca -0.16 -1.04 -0.30 0.00 0.00 0.00 0.00 46.02 44.52 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 2.97 -0.21 0.99 2.96 0.14 -2.01 118.68 123.52 2q4i s LEU 75 Ca 0.00 -0.40 0.01 0.00 -0.22 0.00 0.00 54.13 53.52 2q4i s LEU 75 Cb 0.00 -1.77 0.05 0.00 0.50 0.00 0.00 46.19 44.96 2q4i s LEU 75 CO 0.00 0.19 -0.09 0.00 -1.32 0.00 0.00 176.35 175.12 2q4i s VAL 77 N 1.37 5.29 0.09 0.00 1.01 -0.42 0.73 120.40 128.48 2q4i s VAL 77 Ca -0.03 0.48 -0.30 0.00 0.00 0.00 0.00 61.98 62.14 2q4i s VAL 77 Cb -0.17 -3.62 -0.05 0.00 0.00 0.00 0.00 36.38 32.54 2q4i s VAL 77 CO -0.08 0.33 0.98 -0.69 0.00 0.00 0.00 175.10 175.65 2q4i s VAL 78 N 0.90 4.51 -0.24 2.92 1.01 -0.43 -0.79 120.40 128.29 2q4i s VAL 78 Ca 0.14 2.02 -0.14 0.00 0.00 0.00 0.00 61.98 64.00 2q4i s VAL 78 Cb -0.14 -4.29 -0.10 0.00 0.00 0.00 0.00 36.38 31.85 2q4i s VAL 78 CO 0.05 0.28 -0.34 -0.38 0.00 0.00 0.00 175.10 174.70 2q4i n ILE 79 N 3.02 1.46 -3.53 2.22 2.08 -0.36 -3.77 119.36 120.48 2q4i n ILE 79 Ca 0.03 -0.26 -0.14 0.00 0.56 0.00 0.00 62.75 62.95 2q4i n ILE 79 Cb 0.49 -1.96 -0.05 0.00 -0.75 0.00 0.00 39.64 37.37 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 -2.57 0.88 0.27 0.38 -1.05 -1.18 -3.11 118.70 112.33 2q4i s GLU 80 Ca -0.35 0.12 -0.17 0.00 -0.15 0.00 0.00 54.97 54.42 2q4i s GLU 80 Cb 0.12 0.41 -0.09 0.00 -0.44 0.00 0.00 34.13 34.14 2q4i s GLU 80 CO 0.45 -0.29 0.73 -1.58 0.95 0.00 0.00 175.26 175.52 2q4i s HIS 81 N -1.50 3.51 -0.52 4.83 5.65 -1.23 -1.95 115.29 124.07 2q4i s HIS 81 Ca -0.05 1.30 0.04 0.00 0.25 0.00 0.00 55.06 56.59 2q4i s HIS 81 Cb -0.00 -2.58 0.14 0.00 -1.18 0.00 0.00 32.58 28.96 2q4i s HIS 81 CO 0.04 0.21 0.31 0.08 -0.65 0.00 0.00 174.74 174.73 2q4i s VAL 82 N -1.76 2.08 0.38 0.89 1.01 -0.90 -4.96 120.40 117.13 2q4i s VAL 82 Ca 0.49 -3.20 0.10 0.00 0.00 0.00 0.00 61.98 59.36 2q4i s VAL 82 Cb -0.13 -2.42 0.32 0.00 0.00 0.00 0.00 36.38 34.14 2q4i s VAL 82 CO 0.19 -0.91 1.92 1.55 0.00 0.00 0.00 175.10 177.85 2q4i h PRO 83 N 6.29 0.60 0.00 2.72 0.13 -1.97 -1.21 132.00 138.56 2q4i h PRO 83 Ca 0.02 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 2q4i h PRO 83 Cb 0.88 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 31.87 2q4i h PRO 83 CO 0.60 0.40 0.00 1.05 -0.23 0.00 0.00 178.00 179.82 2q4i h GLU 84 N 0.62 0.00 -0.11 0.86 9.09 -1.95 -2.69 114.58 120.40 2q4i h GLU 84 Ca 0.37 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.78 2q4i h GLU 84 Cb 0.60 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.70 2q4i h GLU 84 CO -0.14 0.00 0.00 1.63 0.05 0.00 0.00 179.01 180.55 2q4i n LYS 85 N -2.78 2.47 -4.09 1.06 4.76 -0.49 -5.01 118.16 114.08 2q4i n LYS 85 Ca -0.01 -1.56 -0.39 0.00 -2.87 0.00 0.00 58.31 53.48 2q4i n LYS 85 Cb 0.14 -1.09 -0.01 0.00 -1.84 0.00 0.00 35.03 32.23 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 -0.09 -0.82 -1.45 1.97 4.76 -0.98 -4.80 118.16 116.75 2q4i n LYS 86 Ca 0.04 0.15 -0.01 0.00 -2.87 0.00 0.00 58.31 55.62 2q4i n LYS 86 Cb 0.28 -3.17 0.00 0.00 -1.84 0.00 0.00 35.03 30.30 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 -2.18 1.59 3.17 0.72 0.00 -1.22 -4.80 105.19 102.46 2q4i n GLY 87 Ca -0.19 -0.99 -0.18 0.00 0.00 0.00 0.00 46.02 44.66 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 -2.01 0.82 -0.20 1.61 0.41 -1.26 -2.13 118.70 115.94 2q4i s GLU 88 Ca 0.02 -0.94 -0.06 0.00 -0.41 0.00 0.00 54.97 53.57 2q4i s GLU 88 Cb -0.00 -0.83 -0.03 0.00 -1.78 0.00 0.00 34.13 31.49 2q4i s GLU 88 CO 0.01 0.18 0.04 0.50 -0.49 0.00 0.00 175.26 175.50 2q4i s ARG 89 N -1.71 3.77 0.06 1.61 3.52 -0.82 -1.21 118.95 124.18 2q4i s ARG 89 Ca -0.02 -0.44 0.09 0.00 -0.13 0.00 0.00 55.73 55.23 2q4i s ARG 89 Cb -0.10 -3.18 -0.03 0.00 -1.56 0.00 0.00 34.95 30.08 2q4i s ARG 89 CO 0.02 0.08 -0.25 -0.06 -0.81 0.00 0.00 175.30 174.29 2q4i s PHE 90 N 0.86 2.36 -0.24 5.12 0.08 -1.26 -1.22 117.98 123.68 2q4i s PHE 90 Ca 0.02 -0.38 -0.10 0.00 0.12 0.00 0.00 56.93 56.60 2q4i s PHE 90 Cb -0.14 -1.37 -0.05 0.00 -0.57 0.00 0.00 43.02 40.89 2q4i s PHE 90 CO 0.02 0.19 0.15 -2.00 -0.10 0.00 0.00 175.22 173.48 2q4i s GLU 91 N -1.46 4.02 0.03 0.44 2.56 0.03 -2.75 118.70 121.58 2q4i s GLU 91 Ca 0.13 -0.30 0.05 0.00 0.00 0.00 0.00 54.97 54.85 2q4i s GLU 91 Cb -0.10 -3.50 -0.03 0.00 2.00 0.00 0.00 34.13 32.50 2q4i s GLU 91 CO 0.04 0.05 -0.09 0.00 -0.56 0.00 0.00 175.26 174.70 2q4i s ALA 92 N 1.08 2.96 -0.04 6.30 0.00 0.70 -1.30 121.76 131.46 2q4i s ALA 92 Ca 0.07 -1.09 0.01 0.00 0.00 0.00 0.00 51.96 50.95 2q4i s ALA 92 Cb -0.14 -1.03 0.02 0.00 0.00 0.00 0.00 23.12 21.97 2q4i s ALA 92 CO 0.04 0.62 -0.03 0.99 0.00 0.00 0.00 175.76 177.38 2q4i s THR 93 N -1.04 0.44 0.00 0.00 2.01 -0.36 -2.16 115.64 114.52 2q4i s THR 93 Ca 0.18 -0.08 0.00 0.00 0.31 0.00 0.00 61.69 62.10 2q4i s THR 93 Cb -0.11 -0.47 0.00 0.00 0.01 0.00 0.00 72.50 71.93 2q4i s THR 93 CO 0.09 0.20 0.00 0.00 -0.69 0.00 0.00 174.62 174.22 2q4i n TYR 94 N 3.99 0.00 -4.32 4.92 0.18 -1.21 0.25 117.16 120.96 2q4i n TYR 94 Ca -0.25 0.00 -0.17 0.00 1.88 0.00 0.00 57.90 59.36 2q4i n TYR 94 Cb 0.51 0.00 -0.10 0.00 -0.38 0.00 0.00 39.34 39.37 2q4i n TYR 94 CO 0.00 0.00 0.00 -1.12 -2.08 0.00 0.00 176.86 173.66 2q4i s SER 95 N 0.00 1.67 -0.19 9.48 0.01 -0.56 -2.21 113.70 121.89 2q4i s SER 95 Ca 0.00 -1.23 0.01 0.00 1.31 0.00 0.00 55.95 56.04 2q4i s SER 95 Cb 0.00 0.04 0.03 0.00 0.21 0.00 0.00 66.02 66.30 2q4i s SER 95 CO 0.00 -0.55 -0.18 -0.36 0.41 0.00 0.00 173.24 172.56 2q4i s PHE 96 N -3.49 2.84 -0.16 2.43 0.08 0.19 -2.06 117.98 117.80 2q4i s PHE 96 Ca 0.29 -1.76 -0.06 0.00 0.12 0.00 0.00 56.93 55.52 2q4i s PHE 96 Cb 0.06 -1.90 -0.04 0.00 -0.57 0.00 0.00 43.02 40.57 2q4i s PHE 96 CO 0.09 -0.82 0.05 0.71 -0.10 0.00 0.00 175.22 175.15 2q4i s TYR 97 N 1.26 3.24 -0.58 0.36 2.02 -0.96 0.59 117.35 123.28 2q4i s TYR 97 Ca 0.02 0.08 0.05 0.00 -0.37 0.00 0.00 57.07 56.85 2q4i s TYR 97 Cb -0.14 -2.01 0.35 0.00 -0.40 0.00 0.00 41.96 39.76 2q4i s TYR 97 CO -0.11 0.22 1.03 1.19 -1.57 0.00 0.00 175.55 176.31 2q4i n PHE 98 N 3.21 3.90 -1.06 2.71 3.72 0.70 -3.68 117.46 126.96 2q4i n PHE 98 Ca -0.17 -3.78 0.00 0.00 -0.05 0.00 0.00 57.45 53.45 2q4i n PHE 98 Cb 0.53 -0.46 0.00 0.00 -0.94 0.00 0.00 39.48 38.60 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 -0.28 2.47 0.31 1.37 0.00 -1.13 -1.29 105.19 106.64 2q4i n GLY 99 Ca 0.33 -0.18 0.20 0.00 0.00 0.00 0.00 46.02 46.37 2q4i n GLY 99 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2q4i h ASP 100 N 2.11 0.00 0.17 1.61 3.32 -1.50 -2.93 116.42 119.21 2q4i h ASP 100 Ca 0.00 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.89 2q4i h ASP 100 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 2q4i h ASP 100 CO 0.00 0.01 -0.60 1.88 -1.72 0.00 0.00 179.24 178.81 2q4i h TYR 101 N 0.00 0.55 0.00 4.55 0.05 -1.48 -3.49 116.97 117.15 2q4i h TYR 101 Ca -0.00 -0.21 0.00 0.00 0.05 0.00 0.00 58.73 58.57 2q4i h TYR 101 Cb 0.21 -0.10 0.00 0.00 1.01 0.00 0.00 36.73 37.85 2q4i h TYR 101 CO 0.00 0.92 0.00 0.41 -1.05 0.00 0.00 178.16 178.44 2q4i n GLY 102 N 0.32 0.59 3.43 3.88 0.00 -1.11 -2.93 105.19 109.36 2q4i n GLY 102 Ca -0.03 -1.79 -0.10 0.00 0.00 0.00 0.00 46.02 44.11 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 -2.51 0.34 -0.03 1.61 -3.43 -1.25 0.25 115.29 110.26 2q4i s HIS 103 Ca 0.00 -0.69 0.06 0.00 -0.80 0.00 0.00 55.06 53.63 2q4i s HIS 103 Cb 0.00 0.06 -0.01 0.00 -1.43 0.00 0.00 32.58 31.19 2q4i s HIS 103 CO 0.00 -0.82 -0.22 -0.51 -2.00 0.00 0.00 174.74 171.19 2q4i s LEU 104 N -2.97 2.03 0.05 5.38 1.43 0.20 -3.34 118.68 121.45 2q4i s LEU 104 Ca 0.18 -0.42 0.06 0.00 -1.03 0.00 0.00 54.13 52.93 2q4i s LEU 104 Cb 0.02 -1.18 -0.03 0.00 0.03 0.00 0.00 46.19 45.03 2q4i s LEU 104 CO 0.02 0.25 -0.15 -0.44 0.23 0.00 0.00 176.35 176.27 2q4i s SER 105 N -0.38 4.03 0.23 2.29 0.01 -0.46 0.55 113.70 119.97 2q4i s SER 105 Ca 0.05 -0.38 -0.03 0.00 1.31 0.00 0.00 55.95 56.90 2q4i s SER 105 Cb -0.10 -0.72 -0.03 0.00 0.21 0.00 0.00 66.02 65.38 2q4i s SER 105 CO 0.00 0.25 0.24 0.68 0.41 0.00 0.00 173.24 174.82 2q4i s VAL 106 N -0.99 0.00 -0.20 3.43 -7.23 -0.94 -0.51 120.40 113.96 2q4i s VAL 106 Ca 0.16 -1.84 -0.18 0.00 -1.81 0.00 0.00 61.98 58.30 2q4i s VAL 106 Cb -0.11 -2.44 0.05 0.00 0.56 0.00 0.00 36.38 34.44 2q4i s VAL 106 CO 0.07 0.00 0.54 -1.58 -0.31 0.00 0.00 175.10 173.82 2q4i s GLN 107 N -3.99 0.62 0.00 4.82 0.74 -0.45 -3.36 119.66 118.04 2q4i s GLN 107 Ca 0.35 0.75 0.00 0.00 0.05 0.00 0.00 55.36 56.51 2q4i s GLN 107 Cb 0.04 0.30 0.00 0.00 1.10 0.00 0.00 33.01 34.45 2q4i s GLN 107 CO 0.13 -0.08 0.00 0.41 -0.55 0.00 0.00 175.29 175.21 2q4i n GLY 108 N 2.83 -0.27 3.94 2.59 0.00 -0.92 0.39 105.19 113.75 2q4i n GLY 108 Ca -0.14 -1.25 -0.25 0.00 0.00 0.00 0.00 46.02 44.38 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 2.34 -0.22 1.61 0.04 -1.26 -0.22 135.00 135.30 2q4i s PRO 109 Ca 0.00 -0.33 0.18 0.00 0.04 0.00 0.00 61.00 60.89 2q4i s PRO 109 Cb 0.00 -2.24 0.41 0.00 0.04 0.00 0.00 34.50 32.71 2q4i s PRO 109 CO 0.00 -1.08 1.24 0.98 0.04 0.00 0.00 177.00 178.18 2q4i n TYR 110 N -2.77 -0.07 -1.55 0.56 9.36 -1.11 -4.71 117.16 116.87 2q4i n TYR 110 Ca 0.08 -1.59 -0.63 0.00 3.32 0.00 0.00 57.90 59.08 2q4i n TYR 110 Cb 0.60 0.40 -0.10 0.00 -0.63 0.00 0.00 39.34 39.61 2q4i n TYR 110 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 2q4i n LEU 111 N -0.65 1.05 0.28 2.98 4.77 -1.26 -4.63 117.00 119.54 2q4i n LEU 111 Ca -0.04 1.02 0.16 0.00 -0.03 0.00 0.00 56.01 57.11 2q4i n LEU 111 Cb 0.87 -0.84 0.81 0.00 -2.33 0.00 0.00 43.42 41.93 2q4i n LEU 111 CO -0.04 -0.78 1.02 0.71 -1.33 0.00 0.00 177.39 176.97 2q4i h THR 112 N 5.21 0.32 -0.01 -5.08 1.35 -1.53 -2.89 112.91 110.26 2q4i h THR 112 Ca -0.34 -0.44 0.00 0.00 -0.55 0.00 0.00 66.41 65.08 2q4i h THR 112 Cb 1.31 1.33 0.00 0.00 -1.73 0.00 0.00 68.15 69.06 2q4i h THR 112 CO 0.96 0.07 -0.14 0.00 -0.25 0.00 0.00 175.52 176.16 2q4i n TYR 113 N -3.39 0.00 -3.59 4.73 0.18 -1.26 -4.90 117.16 108.93 2q4i n TYR 113 Ca -0.01 0.00 -0.11 0.00 1.88 0.00 0.00 57.90 59.65 2q4i n TYR 113 Cb 0.23 -0.06 -0.06 0.00 -0.38 0.00 0.00 39.34 39.06 2q4i n TYR 113 CO 0.00 0.00 0.00 -1.83 -2.08 0.00 0.00 176.86 172.95 2q4i s GLU 114 N -2.26 0.65 0.70 -3.48 -1.05 -1.09 -5.08 118.70 107.08 2q4i s GLU 114 Ca 0.31 0.33 -0.16 0.00 -0.15 0.00 0.00 54.97 55.29 2q4i s GLU 114 Cb 0.20 0.31 -0.04 0.00 -0.44 0.00 0.00 34.13 34.16 2q4i s GLU 114 CO 0.43 -0.17 0.57 -0.25 0.95 0.00 0.00 175.26 176.79 2q4i n ASP 115 N 1.27 -1.02 -4.03 0.83 8.00 -1.26 -4.33 116.55 116.00 2q4i n ASP 115 Ca -0.12 0.62 -0.10 0.00 0.71 0.00 0.00 54.79 55.90 2q4i n ASP 115 Cb 0.57 -1.23 -0.07 0.00 -0.02 0.00 0.00 41.12 40.37 2q4i n ASP 115 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2q4i s SER 116 N -1.44 0.05 -0.15 -2.24 1.04 -0.68 -4.92 113.70 105.36 2q4i s SER 116 Ca 0.67 -1.02 0.01 0.00 0.48 0.00 0.00 55.95 56.09 2q4i s SER 116 Cb -0.36 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.21 2q4i s SER 116 CO 0.57 -0.93 -0.19 -0.36 0.98 0.00 0.00 173.24 173.31 2q4i s PHE 117 N -4.02 2.72 0.30 5.02 0.08 -1.26 -1.54 117.98 119.28 2q4i s PHE 117 Ca 0.23 -1.19 0.05 0.00 0.12 0.00 0.00 56.93 56.14 2q4i s PHE 117 Cb 0.03 -1.85 0.05 0.00 -0.57 0.00 0.00 43.02 40.68 2q4i s PHE 117 CO 0.05 -0.54 0.40 1.28 -0.10 0.00 0.00 175.22 176.30 2q4i n LEU 118 N 4.06 0.00 -4.32 -0.37 4.32 -1.08 -4.32 117.00 115.29 2q4i n LEU 118 Ca -0.19 -1.35 -0.34 0.00 -0.02 0.00 0.00 56.01 54.10 2q4i n LEU 118 Cb 0.52 -0.20 -0.14 0.00 -1.62 0.00 0.00 43.42 41.98 2q4i n LEU 118 CO 0.28 -0.59 -0.41 0.00 -1.22 0.00 0.00 177.39 175.45 2q4i s ALA 119 N -2.37 2.73 -0.30 -1.18 0.00 0.16 -3.50 121.76 117.30 2q4i s ALA 119 Ca 0.30 -1.08 -0.29 0.00 0.00 0.00 0.00 51.96 50.90 2q4i s ALA 119 Cb -0.02 -1.51 -0.00 0.00 0.00 0.00 0.00 23.12 21.58 2q4i s ALA 119 CO 0.19 -0.20 1.35 0.42 0.00 0.00 0.00 175.76 177.52 2q4i s ILE 120 N 1.09 4.07 -0.65 0.00 1.01 -0.62 -1.34 121.20 124.76 2q4i s ILE 120 Ca 0.01 1.20 0.24 0.00 0.00 0.00 0.00 60.65 62.10 2q4i s ILE 120 Cb -0.15 -4.10 0.08 0.00 0.01 0.00 0.00 42.46 38.30 2q4i s ILE 120 CO -0.01 -0.47 1.37 0.35 0.00 0.00 0.00 174.94 176.18 2q4i n THR 121 N 6.29 0.39 0.00 2.92 -2.24 0.33 -3.94 114.28 118.02 2q4i n THR 121 Ca 0.15 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 2q4i n THR 121 Cb 0.46 -0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.51 2q4i n THR 121 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2q4i n GLY 122 N 1.33 0.84 3.53 3.38 0.00 -1.23 -5.01 105.19 108.03 2q4i n GLY 122 Ca 0.04 -1.31 -0.15 0.00 0.00 0.00 0.00 46.02 44.60 2q4i n GLY 122 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2q4i s GLY 123 N 0.00 1.46 0.16 -0.02 0.00 -1.20 -1.35 107.32 106.36 2q4i s GLY 123 Ca 0.00 -1.49 0.00 0.00 0.00 0.00 0.00 44.72 43.23 2q4i s GLY 123 CO 0.00 -0.94 0.05 0.00 0.00 0.00 0.00 173.10 172.20 2q4i s ALA 124 N -2.84 1.09 0.00 3.20 0.00 -1.21 -4.03 121.76 117.97 2q4i s ALA 124 Ca 0.29 -1.55 0.00 0.00 0.00 0.00 0.00 51.96 50.71 2q4i s ALA 124 Cb -0.01 0.81 0.00 0.00 0.00 0.00 0.00 23.12 23.91 2q4i s ALA 124 CO 0.21 -0.44 0.00 0.41 0.00 0.00 0.00 175.76 175.94 2q4i n GLY 125 N -0.17 2.00 0.19 0.00 0.00 -1.26 -1.70 105.19 104.24 2q4i n GLY 125 Ca -0.05 -0.49 0.14 0.00 0.00 0.00 0.00 46.02 45.63 2q4i n GLY 125 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 2q4i h ILE 126 N 0.00 0.00 -0.34 -0.61 3.07 -1.91 -0.51 117.51 117.21 2q4i h ILE 126 Ca 0.00 -0.27 0.00 0.00 1.55 0.00 0.00 64.86 66.14 2q4i h ILE 126 Cb 0.00 1.07 0.00 0.00 -0.27 0.00 0.00 36.82 37.62 2q4i h ILE 126 CO 0.00 0.00 0.00 0.49 -1.05 0.00 0.00 178.15 177.59 2q4i n PHE 127 N -2.54 0.44 -1.81 0.16 3.72 -0.69 -4.26 117.46 112.48 2q4i n PHE 127 Ca 0.01 -0.22 -0.42 0.00 -0.05 0.00 0.00 57.45 56.77 2q4i n PHE 127 Cb 0.22 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.73 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 -1.56 4.16 0.00 -1.08 -6.30 -0.20 -1.44 118.70 112.28 2q4i s GLU 128 Ca 0.35 2.50 0.00 0.00 -2.50 0.00 0.00 54.97 55.31 2q4i s GLU 128 Cb 0.19 -3.36 0.00 0.00 0.00 0.00 0.00 34.13 30.97 2q4i s GLU 128 CO 0.27 -0.74 0.00 0.41 0.02 0.00 0.00 175.26 175.22 2q4i n GLY 129 N 4.01 0.72 3.61 -1.50 0.00 -1.26 -4.51 105.19 106.27 2q4i n GLY 129 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 2q4i n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q4i n ALA 130 N -0.66 0.19 -3.49 4.61 0.00 -0.52 -4.52 120.51 116.12 2q4i n ALA 130 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2q4i n ALA 130 Cb 0.00 -2.10 -0.05 0.00 0.00 0.00 0.00 19.45 17.30 2q4i n ALA 130 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 2q4i s TYR 131 N -1.48 -0.68 -1.56 0.00 -0.85 -0.56 -4.09 117.35 108.13 2q4i s TYR 131 Ca 0.73 1.22 0.00 0.00 -0.52 0.00 0.00 57.07 58.50 2q4i s TYR 131 Cb -0.44 0.41 0.00 0.00 0.38 0.00 0.00 41.96 42.31 2q4i s TYR 131 CO 0.49 -0.34 0.00 0.41 -1.52 0.00 0.00 175.55 174.60 2q4i n GLY 132 N 4.60 -0.71 3.02 5.49 0.00 -1.25 -2.84 105.19 113.50 2q4i n GLY 132 Ca -0.12 -0.38 -0.14 0.00 0.00 0.00 0.00 46.02 45.37 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 -0.94 0.49 -0.10 1.61 -2.07 -1.26 -1.58 119.66 115.81 2q4i s GLN 133 Ca 0.00 -0.53 0.01 0.00 -1.82 0.00 0.00 55.36 53.02 2q4i s GLN 133 Cb 0.00 -0.35 -0.02 0.00 -1.09 0.00 0.00 33.01 31.55 2q4i s GLN 133 CO 0.00 0.08 -0.13 0.54 -1.32 0.00 0.00 175.29 174.45 2q4i s VAL 134 N -0.87 3.07 -0.56 3.63 0.11 -1.23 -2.99 120.40 121.56 2q4i s VAL 134 Ca -0.05 -0.68 -0.19 0.00 -2.93 0.00 0.00 61.98 58.13 2q4i s VAL 134 Cb -0.07 -2.26 0.09 0.00 -1.53 0.00 0.00 36.38 32.61 2q4i s VAL 134 CO 0.00 0.55 0.66 -0.75 -3.33 0.00 0.00 175.10 172.23 2q4i s LYS 135 N -0.04 3.07 -0.16 1.54 2.20 -1.26 -2.63 119.74 122.45 2q4i s LYS 135 Ca -0.03 -1.18 -0.29 0.00 -0.36 0.00 0.00 55.97 54.11 2q4i s LYS 135 Cb -0.14 -4.21 -0.00 0.00 -1.51 0.00 0.00 37.83 31.97 2q4i s LYS 135 CO 0.04 -1.41 0.99 -1.17 -0.36 0.00 0.00 175.35 173.44 2q4i s LEU 136 N 2.61 4.18 -0.24 5.43 0.20 -0.59 -3.38 118.68 126.89 2q4i s LEU 136 Ca 0.12 1.42 0.03 0.00 0.69 0.00 0.00 54.13 56.38 2q4i s LEU 136 Cb -0.23 -3.50 0.05 0.00 -0.43 0.00 0.00 46.19 42.09 2q4i s LEU 136 CO 0.08 -0.53 -0.13 -1.10 -0.29 0.00 0.00 176.35 174.39 2q4i s GLN 137 N 2.49 2.37 -0.67 1.98 -0.21 -0.66 -1.69 119.66 123.27 2q4i s GLN 137 Ca 0.45 -1.23 -0.27 0.00 0.02 0.00 0.00 55.36 54.33 2q4i s GLN 137 Cb -0.17 -2.81 0.03 0.00 1.00 0.00 0.00 33.01 31.06 2q4i s GLN 137 CO 0.12 -0.50 1.22 -1.14 -2.12 0.00 0.00 175.29 172.88 2q4i s GLN 138 N 1.15 3.30 0.00 2.91 0.74 -1.26 -1.68 119.66 124.82 2q4i s GLN 138 Ca -0.06 -0.10 0.00 0.00 0.05 0.00 0.00 55.36 55.25 2q4i s GLN 138 Cb -0.19 -4.12 0.00 0.00 1.10 0.00 0.00 33.01 29.80 2q4i s GLN 138 CO -0.07 -1.94 0.12 -0.11 -0.55 0.00 0.00 175.29 172.74 2q4i n LEU 139 N 8.89 0.12 -3.93 3.68 7.94 -0.60 -4.82 117.00 128.28 2q4i n LEU 139 Ca 0.04 0.54 -0.30 0.00 -1.11 0.00 0.00 56.01 55.18 2q4i n LEU 139 Cb 0.49 -0.48 -0.16 0.00 0.53 0.00 0.00 43.42 43.80 2q4i n LEU 139 CO 0.71 -0.48 -0.42 -0.69 -1.11 0.00 0.00 177.39 175.40 2q4i s VAL 140 N -1.19 1.46 0.10 1.96 1.01 0.15 -4.83 120.40 119.07 2q4i s VAL 140 Ca 0.00 -1.17 -0.30 0.00 0.00 0.00 0.00 61.98 60.51 2q4i s VAL 140 Cb 0.00 -1.74 -0.06 0.00 0.00 0.00 0.00 36.38 34.58 2q4i s VAL 140 CO 0.00 -0.10 1.04 -0.47 0.00 0.00 0.00 175.10 175.56 2q4i s TYR 141 N 1.43 3.67 -0.36 5.22 6.14 -1.26 -0.58 117.35 131.61 2q4i s TYR 141 Ca -0.05 1.66 0.06 0.00 0.64 0.00 0.00 57.07 59.37 2q4i s TYR 141 Cb -0.19 -3.18 0.45 0.00 0.42 0.00 0.00 41.96 39.46 2q4i s TYR 141 CO -0.06 -0.26 1.24 -0.35 0.64 0.00 0.00 175.55 176.76 2q4i n PRO 142 N 3.04 3.50 0.00 4.97 -0.04 -1.26 -4.94 135.00 140.27 2q4i n PRO 142 Ca 0.04 -4.18 0.00 0.00 -0.04 0.00 0.00 63.50 59.32 2q4i n PRO 142 Cb 0.48 -2.27 0.00 0.00 -0.04 0.00 0.00 33.50 31.67 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 -0.67 0.45 -3.53 0.52 -2.24 0.25 -4.79 114.28 104.27 2q4i n THR 143 Ca 0.44 -0.45 -0.21 0.00 -2.27 0.00 0.00 64.05 61.56 2q4i n THR 143 Cb 0.86 0.78 -0.14 0.00 -2.10 0.00 0.00 70.33 69.73 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 -0.45 0.15 0.52 -0.78 1.02 0.15 -1.29 119.74 119.06 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 -1.42 0.00 0.00 -0.52 0.00 0.00 37.83 35.89 2q4i s LYS 144 CO 0.00 -0.67 0.14 -0.51 -0.92 0.00 0.00 175.35 173.39 2q4i s LEU 145 N 2.26 2.45 -0.23 3.17 1.02 0.12 -0.68 118.68 126.79 2q4i s LEU 145 Ca 0.05 -1.50 -0.06 0.00 0.02 0.00 0.00 54.13 52.64 2q4i s LEU 145 Cb -0.16 -0.91 0.11 0.00 0.02 0.00 0.00 46.19 45.26 2q4i s LEU 145 CO -0.12 -0.93 0.46 0.12 0.02 0.00 0.00 176.35 175.91 2q4i s PHE 146 N -2.83 -0.95 0.29 0.29 5.36 -0.67 -2.07 117.98 117.39 2q4i s PHE 146 Ca 0.16 1.57 0.07 0.00 -0.96 0.00 0.00 56.93 57.78 2q4i s PHE 146 Cb 0.00 0.37 -0.03 0.00 -0.34 0.00 0.00 43.02 43.02 2q4i s PHE 146 CO 0.10 -0.58 0.22 0.71 -1.46 0.00 0.00 175.22 174.21 2q4i s TYR 147 N 2.67 2.97 -0.33 10.12 2.02 0.34 -1.65 117.35 133.50 2q4i s TYR 147 Ca 0.01 -0.21 0.17 0.00 -0.37 0.00 0.00 57.07 56.67 2q4i s TYR 147 Cb -0.13 -1.57 0.45 0.00 -0.40 0.00 0.00 41.96 40.31 2q4i s TYR 147 CO -0.15 0.38 1.00 2.41 -1.57 0.00 0.00 175.55 177.62 2q4i n THR 148 N -1.24 0.85 -0.50 -0.71 -1.04 -1.22 -0.99 114.28 109.44 2q4i n THR 148 Ca -0.05 -2.87 -0.19 0.00 -2.04 0.00 0.00 64.05 58.90 2q4i n THR 148 Cb 0.59 0.70 -0.02 0.00 -1.82 0.00 0.00 70.33 69.78 2q4i n THR 148 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 2q4i n PHE 149 N -0.12 0.06 -3.35 -1.42 3.72 0.92 -3.88 117.46 113.39 2q4i n PHE 149 Ca 0.08 0.35 -0.34 0.00 -0.05 0.00 0.00 57.45 57.49 2q4i n PHE 149 Cb 0.82 -0.70 -0.05 0.00 -0.94 0.00 0.00 39.48 38.61 2q4i n PHE 149 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2q4i n TYR 150 N 0.30 3.31 -2.57 1.38 4.01 -1.16 0.15 117.16 122.58 2q4i n TYR 150 Ca 0.07 -3.67 -0.43 0.00 -0.16 0.00 0.00 57.90 53.71 2q4i n TYR 150 Cb 0.05 -0.88 -0.02 0.00 -0.31 0.00 0.00 39.34 38.18 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 -2.36 4.18 0.31 7.72 1.43 0.72 -4.16 118.68 126.52 2q4i s LEU 151 Ca 0.35 1.56 0.08 0.00 -1.03 0.00 0.00 54.13 55.09 2q4i s LEU 151 Cb 0.07 -3.55 -0.04 0.00 0.03 0.00 0.00 46.19 42.71 2q4i s LEU 151 CO -0.00 -0.63 0.13 -0.54 0.23 0.00 0.00 176.35 175.54 2q4i s LYS 152 N 2.85 2.46 0.00 1.70 1.02 -1.13 -0.68 119.74 125.96 2q4i s LYS 152 Ca 0.50 -1.43 0.00 0.00 0.02 0.00 0.00 55.97 55.06 2q4i s LYS 152 Cb -0.19 -2.25 0.00 0.00 -0.52 0.00 0.00 37.83 34.87 2q4i s LYS 152 CO 0.13 0.21 0.00 0.41 -0.92 0.00 0.00 175.35 175.18 2q4i n GLY 153 N -1.11 0.73 3.76 -3.33 0.00 -1.26 -1.50 105.19 102.48 2q4i n GLY 153 Ca -0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 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 4.49 0.15 0.99 1.02 -1.26 -4.47 118.68 119.59 2q4i s LEU 154 Ca 0.00 2.42 -0.17 0.00 0.02 0.00 0.00 54.13 56.39 2q4i s LEU 154 Cb 0.00 -3.63 0.05 0.00 0.02 0.00 0.00 46.19 42.63 2q4i s LEU 154 CO 0.00 -0.34 1.72 0.00 0.02 0.00 0.00 176.35 177.75 2q4i h ALA 155 N 4.00 0.31 -2.19 4.21 0.00 -1.79 -3.45 119.26 120.34 2q4i h ALA 155 Ca -0.47 0.08 -0.42 0.00 0.00 0.00 0.00 54.91 54.10 2q4i h ALA 155 Cb 1.22 0.11 -0.14 0.00 0.00 0.00 0.00 17.79 18.98 2q4i h ALA 155 CO 0.68 -0.38 -0.58 -0.80 0.00 0.00 0.00 179.25 178.17 2q4i s ASN 156 N -5.28 1.74 0.54 0.00 -0.87 -1.26 -5.12 114.94 104.69 2q4i s ASN 156 Ca -0.13 -1.47 -0.22 0.00 -1.57 0.00 0.00 52.86 49.47 2q4i s ASN 156 Cb 0.12 0.23 -0.05 0.00 -0.02 0.00 0.00 41.25 41.53 2q4i s ASN 156 CO 0.70 -0.78 1.35 -1.81 -2.57 0.00 0.00 177.10 173.99 2q4i s ASP 157 N -3.40 5.32 0.69 -1.22 1.01 -1.26 -4.96 116.67 112.84 2q4i s ASP 157 Ca 0.35 2.74 -0.15 0.00 0.71 0.00 0.00 52.55 56.20 2q4i s ASP 157 Cb 0.06 -2.63 0.02 0.00 1.01 0.00 0.00 42.92 41.38 2q4i s ASP 157 CO 0.15 -1.53 1.15 -0.76 0.21 0.00 0.00 175.17 174.39 2q4i s LEU 158 N -3.49 3.36 0.33 1.23 1.43 -1.26 -4.94 118.68 115.35 2q4i s LEU 158 Ca 0.71 2.14 -0.29 0.00 -1.03 0.00 0.00 54.13 55.67 2q4i s LEU 158 Cb -0.40 -4.57 -0.11 0.00 0.03 0.00 0.00 46.19 41.15 2q4i s LEU 158 CO 0.47 -1.89 1.43 -2.16 0.23 0.00 0.00 176.35 174.43 2q4i s PRO 159 N -4.01 4.22 0.33 1.29 0.04 -1.26 -4.88 135.00 130.73 2q4i s PRO 159 Ca 0.70 2.41 0.11 0.00 0.04 0.00 0.00 61.00 64.26 2q4i s PRO 159 Cb -0.24 -3.03 0.91 0.00 0.04 0.00 0.00 34.50 32.18 2q4i s PRO 159 CO 0.43 -0.41 1.75 -0.07 0.04 0.00 0.00 177.00 178.74 2q4i h LEU 160 N 3.60 0.64 -2.51 -3.56 3.38 -1.97 0.89 115.31 115.78 2q4i h LEU 160 Ca -0.49 0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.59 2q4i h LEU 160 Cb 1.23 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.99 2q4i h LEU 160 CO 0.68 0.13 -0.01 1.05 0.09 0.00 0.00 178.44 180.38 2q4i h GLU 161 N 0.57 0.00 -0.37 1.13 4.11 -2.01 -0.87 114.58 117.14 2q4i h GLU 161 Ca 0.62 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.05 2q4i h GLU 161 Cb 1.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.48 2q4i h GLU 161 CO -0.42 0.01 0.00 1.28 0.07 0.00 0.00 179.01 179.95 2q4i n LEU 162 N -3.18 3.22 -0.11 3.06 4.77 0.30 -4.37 117.00 120.69 2q4i n LEU 162 Ca -0.02 -1.39 0.03 0.00 -0.03 0.00 0.00 56.01 54.60 2q4i n LEU 162 Cb 0.14 -0.24 0.04 0.00 -2.33 0.00 0.00 43.42 41.04 2q4i n LEU 162 CO 0.23 0.69 0.43 0.35 -1.33 0.00 0.00 177.39 177.76 2q4i n THR 163 N 1.34 0.89 -1.70 -5.08 -2.24 -0.34 -4.71 114.28 102.44 2q4i n THR 163 Ca 0.19 -1.00 -0.44 0.00 -2.27 0.00 0.00 64.05 60.53 2q4i n THR 163 Cb 0.57 0.37 -0.03 0.00 -2.10 0.00 0.00 70.33 69.15 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 -0.59 1.08 3.64 3.38 0.00 -1.15 -4.75 105.19 106.80 2q4i n GLY 164 Ca 0.05 0.53 -0.60 0.00 0.00 0.00 0.00 46.02 45.99 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 2.44 0.07 -1.51 2.61 -1.04 -1.26 -4.37 114.28 111.22 2q4i n THR 165 Ca 0.12 -0.01 -0.32 0.00 -2.04 0.00 0.00 64.05 61.80 2q4i n THR 165 Cb 0.33 -0.57 0.07 0.00 -1.82 0.00 0.00 70.33 68.34 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 1.83 2.49 0.21 -2.82 0.02 -1.26 -4.54 135.00 130.93 2q4i s PRO 166 Ca 0.96 1.33 -0.30 0.00 0.02 0.00 0.00 61.00 63.01 2q4i s PRO 166 Cb -1.25 -1.92 -0.08 0.00 0.02 0.00 0.00 34.50 31.27 2q4i s PRO 166 CO 0.65 -1.48 0.94 0.08 -0.33 0.00 0.00 177.00 176.86 2q4i s VAL 167 N -2.55 4.18 0.42 3.83 1.01 -1.10 -4.94 120.40 121.25 2q4i s VAL 167 Ca 0.65 2.06 -0.25 0.00 0.00 0.00 0.00 61.98 64.45 2q4i s VAL 167 Cb -0.20 -4.32 -0.08 0.00 0.00 0.00 0.00 36.38 31.78 2q4i s VAL 167 CO 0.48 0.46 1.20 -2.84 0.00 0.00 0.00 175.10 174.40 2q4i s PRO 168 N -0.92 3.93 0.17 2.72 0.02 -1.26 -4.93 135.00 134.73 2q4i s PRO 168 Ca 0.42 1.90 -0.31 0.00 0.02 0.00 0.00 61.00 63.03 2q4i s PRO 168 Cb -0.25 -2.61 -0.09 0.00 0.02 0.00 0.00 34.50 31.57 2q4i s PRO 168 CO 0.31 -0.45 1.42 -1.25 -0.33 0.00 0.00 177.00 176.70 2q4i s PRO 169 N -2.41 4.30 -0.04 5.54 0.04 -1.26 -5.01 135.00 136.17 2q4i s PRO 169 Ca 0.59 2.17 -0.12 0.00 0.04 0.00 0.00 61.00 63.69 2q4i s PRO 169 Cb -0.32 -3.19 0.02 0.00 0.04 0.00 0.00 34.50 31.05 2q4i s PRO 169 CO 0.40 -0.43 0.27 -1.54 0.04 0.00 0.00 177.00 175.74 2q4i s SER 170 N 0.79 -0.18 0.63 6.66 1.04 -1.26 -5.03 113.70 116.35 2q4i s SER 170 Ca 0.63 0.17 0.28 0.00 0.48 0.00 0.00 55.95 57.51 2q4i s SER 170 Cb -0.39 0.37 1.53 0.00 0.10 0.00 0.00 66.02 67.63 2q4i s SER 170 CO 0.35 -0.33 1.85 0.07 0.98 0.00 0.00 173.24 176.16 2q4i h LYS 171 N 4.48 0.00 -0.52 4.02 2.10 -1.96 -1.51 116.57 123.19 2q4i h LYS 171 Ca -0.29 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.36 2q4i h LYS 171 Cb 1.18 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.51 2q4i h LYS 171 CO 0.38 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.58 2q4i n ASP 172 N -2.79 2.78 -4.77 7.07 8.00 -1.26 -4.95 116.55 120.63 2q4i n ASP 172 Ca -0.02 -2.05 -0.35 0.00 0.71 0.00 0.00 54.79 53.07 2q4i n ASP 172 Cb 0.37 -0.36 0.01 0.00 -0.02 0.00 0.00 41.12 41.12 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 -1.41 3.03 -0.11 0.53 -5.25 -0.57 -5.04 121.20 112.37 2q4i s ILE 173 Ca 0.33 0.65 -0.11 0.00 -0.99 0.00 0.00 60.65 60.54 2q4i s ILE 173 Cb 0.18 -3.27 0.03 0.00 2.95 0.00 0.00 42.46 42.35 2q4i s ILE 173 CO 0.21 -0.12 0.30 -1.61 -1.79 0.00 0.00 174.94 171.93 2q4i s GLU 174 N -3.23 0.36 0.79 0.37 0.41 -1.26 -5.08 118.70 111.06 2q4i s GLU 174 Ca 0.73 0.40 -0.12 0.00 -0.41 0.00 0.00 54.97 55.57 2q4i s GLU 174 Cb -0.26 0.17 0.07 0.00 -1.78 0.00 0.00 34.13 32.34 2q4i s GLU 174 CO 0.29 -0.05 1.12 -1.25 -0.49 0.00 0.00 175.26 174.89 2q4i s PRO 175 N 0.12 1.94 0.67 0.39 0.04 -1.26 -4.95 135.00 131.95 2q4i s PRO 175 Ca -0.00 1.39 -0.17 0.00 0.04 0.00 0.00 61.00 62.25 2q4i s PRO 175 Cb -0.02 -1.85 -0.01 0.00 0.04 0.00 0.00 34.50 32.66 2q4i s PRO 175 CO 0.01 -1.91 1.14 0.00 0.04 0.00 0.00 177.00 176.27 2q4i n ALA 176 N -3.49 0.54 -0.31 8.56 0.00 0.38 -4.80 120.51 121.38 2q4i n ALA 176 Ca 0.11 -0.06 -0.02 0.00 0.00 0.00 0.00 53.44 53.47 2q4i n ALA 176 Cb 0.52 -2.22 0.11 0.00 0.00 0.00 0.00 19.45 17.86 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 0.23 1.05 -0.56 0.00 0.11 -1.92 -2.10 132.00 128.81 2q4i h PRO 177 Ca -0.49 -0.06 0.02 0.00 0.11 0.00 0.00 66.00 65.58 2q4i h PRO 177 Cb 1.34 -0.24 -0.03 0.00 0.11 0.00 0.00 31.00 32.19 2q4i h PRO 177 CO 0.51 0.70 0.37 0.93 -0.21 0.00 0.00 178.00 180.29 2q4i h GLU 178 N 1.08 0.67 -0.17 1.05 3.07 -1.91 -1.26 114.58 117.12 2q4i h GLU 178 Ca 0.34 -0.04 -0.15 0.00 -0.50 0.00 0.00 59.36 59.01 2q4i h GLU 178 Cb -0.00 -0.15 0.00 0.00 -0.84 0.00 0.00 28.75 27.76 2q4i h GLU 178 CO -0.11 0.45 -0.48 0.00 -1.40 0.00 0.00 179.01 177.46 2q4i h ALA 179 N 1.67 0.28 -0.70 3.43 0.00 -1.54 -2.41 119.26 119.99 2q4i h ALA 179 Ca 0.22 -0.49 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 2q4i h ALA 179 Cb 0.02 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2q4i h ALA 179 CO -0.05 0.44 0.25 -0.22 0.00 0.00 0.00 179.25 179.67 2q4i h LYS 180 N 0.29 1.05 -0.00 0.00 3.64 -1.06 -2.77 116.57 117.71 2q4i h LYS 180 Ca -0.01 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 2q4i h LYS 180 Cb 1.10 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.75 2q4i h LYS 180 CO 0.10 0.87 -0.05 0.00 -2.27 0.00 0.00 179.45 178.11 2q4i n ALA 181 N -2.45 2.63 -3.56 5.00 0.00 -0.51 -4.95 120.51 116.68 2q4i n ALA 181 Ca 0.06 -0.21 -0.22 0.00 0.00 0.00 0.00 53.44 53.07 2q4i n ALA 181 Cb 0.20 -1.42 0.08 0.00 0.00 0.00 0.00 19.45 18.30 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 -1.08 -3.57 -4.88 0.00 4.77 -1.02 -5.01 117.00 106.21 2q4i n LEU 182 Ca 0.16 -0.58 -0.30 0.00 -0.03 0.00 0.00 56.01 55.25 2q4i n LEU 182 Cb 0.24 -3.04 -0.02 0.00 -2.33 0.00 0.00 43.42 38.27 2q4i n LEU 182 CO 0.22 0.56 0.49 -1.61 -1.33 0.00 0.00 177.39 175.72 2q4i s GLU 183 N -6.02 3.75 0.38 3.23 2.02 -0.94 -4.96 118.70 116.17 2q4i s GLU 183 Ca 0.39 0.51 0.12 0.00 0.02 0.00 0.00 54.97 56.01 2q4i s GLU 183 Cb -0.17 -2.33 0.92 0.00 0.10 0.00 0.00 34.13 32.64 2q4i s GLU 183 CO 0.74 -0.13 1.88 -1.35 0.02 0.00 0.00 175.26 176.41 2q4i h PRO 184 N 0.94 0.56 0.00 0.39 0.11 -1.92 -0.90 132.00 131.17 2q4i h PRO 184 Ca -0.47 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 2q4i h PRO 184 Cb 1.19 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 2q4i h PRO 184 CO 0.63 0.37 -0.04 0.66 -0.21 0.00 0.00 178.00 179.41 2q4i h SER 185 N 0.57 0.00 -0.24 -2.05 4.64 -1.93 -2.93 113.55 111.61 2q4i h SER 185 Ca 0.44 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.75 2q4i h SER 185 Cb 0.84 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.93 2q4i h SER 185 CO -0.18 0.04 -0.00 0.61 -0.87 0.00 0.00 176.83 176.42 2q4i n GLY 186 N -0.95 4.12 3.12 -0.77 0.00 -0.35 -4.88 105.19 105.48 2q4i n GLY 186 Ca -0.02 -1.06 -0.08 0.00 0.00 0.00 0.00 46.02 44.86 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 -2.85 0.17 0.43 1.61 -7.23 -1.11 0.93 120.40 112.34 2q4i s VAL 187 Ca 0.42 -1.37 -0.01 0.00 -1.81 0.00 0.00 61.98 59.21 2q4i s VAL 187 Cb 0.34 -1.19 -0.02 0.00 0.56 0.00 0.00 36.38 36.07 2q4i s VAL 187 CO 0.08 -0.76 0.66 0.27 -0.31 0.00 0.00 175.10 175.05 2q4i s ILE 188 N -3.31 4.61 0.09 -0.62 -4.36 -0.73 -4.86 121.20 112.01 2q4i s ILE 188 Ca 0.01 -0.30 -0.31 0.00 -0.26 0.00 0.00 60.65 59.79 2q4i s ILE 188 Cb 0.03 -3.71 -0.09 0.00 1.25 0.00 0.00 42.46 39.94 2q4i s ILE 188 CO -0.08 -0.54 1.62 -0.44 0.24 0.00 0.00 174.94 175.73 2q4i s SER 189 N -4.13 6.62 -1.83 4.36 0.01 -1.26 -1.91 113.70 115.56 2q4i s SER 189 Ca 0.45 2.49 0.00 0.00 1.31 0.00 0.00 55.95 60.20 2q4i s SER 189 Cb -0.10 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.56 2q4i s SER 189 CO 0.39 -0.86 0.00 -3.20 0.41 0.00 0.00 173.24 169.98 2q4i n ASN 190 N 5.20 -5.59 -3.62 2.44 5.15 -1.26 -1.81 115.26 115.77 2q4i n ASN 190 Ca 0.15 0.14 -0.35 0.00 -0.60 0.00 0.00 54.58 53.93 2q4i n ASN 190 Cb 0.40 -4.69 0.03 0.00 -0.53 0.00 0.00 39.78 34.99 2q4i n ASN 190 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2q4i n TYR 191 N -3.51 -1.91 -3.56 1.20 0.18 -0.80 -4.03 117.16 104.73 2q4i n TYR 191 Ca -0.22 0.48 -0.37 0.00 1.88 0.00 0.00 57.90 59.66 2q4i n TYR 191 Cb 0.67 -1.26 -0.06 0.00 -0.38 0.00 0.00 39.34 38.31 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 -1.81 5.09 0.00 -3.48 2.01 0.19 -4.69 115.64 112.95 2q4i s THR 192 Ca 0.33 0.71 0.00 0.00 0.31 0.00 0.00 61.69 63.04 2q4i s THR 192 Cb 0.04 -3.67 0.00 0.00 0.01 0.00 0.00 72.50 68.89 2q4i s THR 192 CO 0.63 0.54 0.00 -3.20 -0.69 0.00 0.00 174.62 171.90