#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 5.00 -0.22 3.15 1.01 -1.26 -4.46 120.40 123.62 2q4i s VAL 21 Ca 0.00 1.23 -0.02 0.00 0.00 0.00 0.00 61.98 63.19 2q4i s VAL 21 Cb 0.00 -3.93 0.01 0.00 0.00 0.00 0.00 36.38 32.46 2q4i s VAL 21 CO 0.00 0.36 -0.09 -1.10 0.00 0.00 0.00 175.10 174.27 2q4i s GLN 22 N 0.21 3.09 0.33 2.72 -0.21 0.13 -4.91 119.66 121.01 2q4i s GLN 22 Ca 0.31 -0.80 -0.26 0.00 0.02 0.00 0.00 55.36 54.63 2q4i s GLN 22 Cb -0.17 -2.89 -0.10 0.00 1.00 0.00 0.00 33.01 30.85 2q4i s GLN 22 CO 0.16 -0.27 0.97 -1.21 -2.12 0.00 0.00 175.29 172.81 2q4i s GLU 23 N 1.38 4.55 -0.23 2.91 2.02 -1.26 -1.40 118.70 126.67 2q4i s GLU 23 Ca 0.04 1.39 -0.03 0.00 0.02 0.00 0.00 54.97 56.38 2q4i s GLU 23 Cb -0.15 -2.82 0.12 0.00 0.10 0.00 0.00 34.13 31.38 2q4i s GLU 23 CO -0.06 0.24 0.30 -1.17 0.02 0.00 0.00 175.26 174.58 2q4i s LEU 24 N -2.05 -0.36 0.25 1.80 2.96 -0.82 -4.96 118.68 115.49 2q4i s LEU 24 Ca 0.50 -0.09 0.04 0.00 -0.22 0.00 0.00 54.13 54.36 2q4i s LEU 24 Cb -0.20 0.72 -0.03 0.00 0.50 0.00 0.00 46.19 47.18 2q4i s LEU 24 CO 0.26 -0.32 0.38 -0.44 -1.32 0.00 0.00 176.35 174.91 2q4i s SER 25 N 2.43 6.32 0.05 3.68 0.01 -1.26 -1.18 113.70 123.75 2q4i s SER 25 Ca 0.10 0.14 -0.23 0.00 1.31 0.00 0.00 55.95 57.26 2q4i s SER 25 Cb -0.15 -1.89 0.06 0.00 0.21 0.00 0.00 66.02 64.24 2q4i s SER 25 CO -0.16 -0.09 0.55 0.68 0.41 0.00 0.00 173.24 174.62 2q4i s VAL 26 N -2.01 0.02 -0.15 3.43 -7.23 -0.96 -1.73 120.40 111.77 2q4i s VAL 26 Ca 0.35 -0.19 -0.02 0.00 -1.81 0.00 0.00 61.98 60.31 2q4i s VAL 26 Cb -0.09 -0.98 -0.02 0.00 0.56 0.00 0.00 36.38 35.85 2q4i s VAL 26 CO 0.30 -0.10 -0.07 -0.31 -0.31 0.00 0.00 175.10 174.60 2q4i s TYR 27 N -2.44 2.93 -0.25 2.82 2.02 0.22 -1.57 117.35 121.08 2q4i s TYR 27 Ca -0.05 -0.51 -0.06 0.00 -0.37 0.00 0.00 57.07 56.07 2q4i s TYR 27 Cb -0.01 -1.93 -0.01 0.00 -0.40 0.00 0.00 41.96 39.61 2q4i s TYR 27 CO -0.02 -0.17 0.04 -2.00 -1.57 0.00 0.00 175.55 171.84 2q4i s GLU 28 N 0.50 3.46 -0.06 -0.62 2.12 -0.70 0.41 118.70 123.80 2q4i s GLU 28 Ca -0.06 -0.60 0.06 0.00 0.36 0.00 0.00 54.97 54.73 2q4i s GLU 28 Cb -0.15 -3.26 -0.01 0.00 0.26 0.00 0.00 34.13 30.98 2q4i s GLU 28 CO 0.03 -0.25 -0.25 0.42 -0.54 0.00 0.00 175.26 174.68 2q4i s ILE 29 N 1.56 2.04 -0.49 -3.70 1.01 0.13 -1.41 121.20 120.34 2q4i s ILE 29 Ca 0.05 -1.05 -0.18 0.00 0.00 0.00 0.00 60.65 59.47 2q4i s ILE 29 Cb -0.15 -1.73 0.06 0.00 0.01 0.00 0.00 42.46 40.65 2q4i s ILE 29 CO 0.02 0.56 0.54 0.21 0.00 0.00 0.00 174.94 176.27 2q4i s ASN 30 N -0.08 6.20 -0.00 3.58 3.84 0.14 -1.16 114.94 127.46 2q4i s ASN 30 Ca -0.06 -0.99 0.15 0.00 0.21 0.00 0.00 52.86 52.17 2q4i s ASN 30 Cb -0.14 -2.25 0.43 0.00 -0.55 0.00 0.00 41.25 38.74 2q4i s ASN 30 CO 0.04 -0.79 1.36 -0.62 -2.79 0.00 0.00 177.10 174.31 2q4i n GLU 31 N 5.84 2.14 -1.24 0.43 1.02 -1.26 -4.74 120.64 122.84 2q4i n GLU 31 Ca -0.08 -1.76 -0.08 0.00 -0.02 0.00 0.00 57.16 55.21 2q4i n GLU 31 Cb 0.45 -1.38 -0.04 0.00 -0.02 0.00 0.00 31.44 30.45 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 0.93 -0.28 -0.53 -4.62 4.77 -1.26 -4.87 117.00 111.14 2q4i n LEU 32 Ca 0.16 0.20 0.09 0.00 -0.03 0.00 0.00 56.01 56.44 2q4i n LEU 32 Cb 0.42 -2.06 0.21 0.00 -2.33 0.00 0.00 43.42 39.65 2q4i n LEU 32 CO 0.11 -0.75 0.65 -0.90 -1.33 0.00 0.00 177.39 175.17 2q4i n ASP 33 N -0.54 3.21 -0.80 -1.43 5.75 -1.26 -4.53 116.55 116.95 2q4i n ASP 33 Ca -0.08 -3.05 0.05 0.00 -0.01 0.00 0.00 54.79 51.71 2q4i n ASP 33 Cb 0.43 -0.49 0.13 0.00 -1.03 0.00 0.00 41.12 40.16 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 -0.92 0.99 -1.60 0.11 1.74 -1.26 -4.97 116.66 110.75 2q4i n ARG 34 Ca 0.19 -2.70 -0.16 0.00 -0.77 0.00 0.00 57.85 54.41 2q4i n ARG 34 Cb 0.78 -1.06 -0.06 0.00 -1.02 0.00 0.00 32.46 31.10 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 -0.61 -0.39 -4.53 -1.55 8.25 -1.26 -4.83 115.22 110.29 2q4i n HIS 35 Ca 0.14 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.27 2q4i n HIS 35 Cb 0.82 -2.94 -0.11 0.00 1.12 0.00 0.00 29.99 28.88 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 -2.30 4.57 0.73 0.41 0.15 -1.26 -4.10 113.70 111.90 2q4i s SER 36 Ca 0.00 -0.12 -0.10 0.00 0.70 0.00 0.00 55.95 56.42 2q4i s SER 36 Cb 0.00 -1.07 0.04 0.00 -1.71 0.00 0.00 66.02 63.28 2q4i s SER 36 CO 0.00 0.31 1.09 -2.16 1.20 0.00 0.00 173.24 173.68 2q4i s PRO 37 N -1.22 2.44 -0.28 5.44 0.04 -1.26 -4.82 135.00 135.34 2q4i s PRO 37 Ca 0.15 0.17 0.02 0.00 0.04 0.00 0.00 61.00 61.38 2q4i s PRO 37 Cb -0.11 -2.05 0.07 0.00 0.04 0.00 0.00 34.50 32.45 2q4i s PRO 37 CO 0.05 -1.23 -0.06 0.21 0.04 0.00 0.00 177.00 176.02 2q4i s LYS 38 N -5.38 2.16 -0.04 4.56 2.47 -0.91 -5.05 119.74 117.55 2q4i s LYS 38 Ca 0.59 -1.42 -0.23 0.00 -1.56 0.00 0.00 55.97 53.36 2q4i s LYS 38 Cb -0.11 -3.01 -0.04 0.00 -1.46 0.00 0.00 37.83 33.21 2q4i s LYS 38 CO 0.49 -0.65 0.67 0.42 0.16 0.00 0.00 175.35 176.44 2q4i s ILE 39 N 1.10 4.99 -0.37 5.43 1.01 -1.26 -3.32 121.20 128.78 2q4i s ILE 39 Ca -0.05 1.39 -0.04 0.00 0.00 0.00 0.00 60.65 61.95 2q4i s ILE 39 Cb -0.20 -4.01 0.08 0.00 0.01 0.00 0.00 42.46 38.33 2q4i s ILE 39 CO -0.05 0.30 0.14 -0.76 0.00 0.00 0.00 174.94 174.58 2q4i s LEU 40 N 0.49 4.71 -0.21 2.97 1.43 -0.57 -5.02 118.68 122.48 2q4i s LEU 40 Ca 0.36 -1.57 -0.20 0.00 -1.03 0.00 0.00 54.13 51.69 2q4i s LEU 40 Cb -0.18 -1.84 -0.03 0.00 0.03 0.00 0.00 46.19 44.18 2q4i s LEU 40 CO 0.18 -0.43 0.60 -0.75 0.23 0.00 0.00 176.35 176.18 2q4i s LYS 41 N 1.27 4.18 0.00 1.70 2.47 -1.26 -2.11 119.74 125.99 2q4i s LYS 41 Ca 0.02 0.54 0.00 0.00 -1.56 0.00 0.00 55.97 54.97 2q4i s LYS 41 Cb -0.21 -3.59 0.00 0.00 -1.46 0.00 0.00 37.83 32.56 2q4i s LYS 41 CO -0.01 -0.26 0.00 0.09 0.16 0.00 0.00 175.35 175.34 2q4i n ASN 42 N 5.14 0.92 -4.77 1.43 3.02 -1.25 -4.98 115.26 114.76 2q4i n ASN 42 Ca -0.02 -0.08 -0.39 0.00 -0.03 0.00 0.00 54.58 54.06 2q4i n ASN 42 Cb 0.50 0.34 -0.03 0.00 -0.61 0.00 0.00 39.78 39.97 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 -0.52 3.29 -1.25 5.41 0.00 -1.26 -4.86 121.76 122.56 2q4i s ALA 43 Ca 0.00 0.91 -0.10 0.00 0.00 0.00 0.00 51.96 52.77 2q4i s ALA 43 Cb 0.00 -3.34 0.18 0.00 0.00 0.00 0.00 23.12 19.96 2q4i s ALA 43 CO 0.00 -0.31 1.77 1.19 0.00 0.00 0.00 175.76 178.41 2q4i n PHE 44 N 0.61 3.26 -3.51 0.00 3.72 -1.26 -4.85 117.46 115.43 2q4i n PHE 44 Ca 0.02 -2.88 -0.17 0.00 -0.05 0.00 0.00 57.45 54.36 2q4i n PHE 44 Cb 0.46 -1.94 -0.06 0.00 -0.94 0.00 0.00 39.48 37.00 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 1.02 -0.63 0.00 4.37 0.15 -1.26 -5.13 113.70 112.22 2q4i s SER 45 Ca 0.39 0.62 0.00 0.00 0.70 0.00 0.00 55.95 57.67 2q4i s SER 45 Cb 0.07 0.53 0.00 0.00 -1.71 0.00 0.00 66.02 64.91 2q4i s SER 45 CO 0.01 -0.63 0.75 0.18 1.20 0.00 0.00 173.24 174.75 2q4i n LEU 46 N 0.76 2.24 -4.85 3.45 4.77 -1.26 -4.93 117.00 117.18 2q4i n LEU 46 Ca -0.18 -1.12 -0.35 0.00 -0.03 0.00 0.00 56.01 54.33 2q4i n LEU 46 Cb 0.58 -0.37 -0.06 0.00 -2.33 0.00 0.00 43.42 41.24 2q4i n LEU 46 CO 0.22 0.37 0.20 -0.36 -1.33 0.00 0.00 177.39 176.49 2q4i s PHE 48 N 0.26 3.57 0.27 -1.77 0.08 -1.26 -5.21 117.98 113.92 2q4i s PHE 48 Ca 0.00 0.97 -0.15 0.00 0.12 0.00 0.00 56.93 57.88 2q4i s PHE 48 Cb 0.00 -2.31 0.00 0.00 -0.57 0.00 0.00 43.02 40.15 2q4i s PHE 48 CO 0.00 0.42 0.55 0.20 -0.10 0.00 0.00 175.22 176.30 2q4i s GLY 49 N -1.83 0.41 0.23 4.36 0.00 -1.26 -3.88 107.32 105.34 2q4i s GLY 49 Ca 0.38 -0.75 -0.31 0.00 0.00 0.00 0.00 44.72 44.04 2q4i s GLY 49 CO 0.19 -0.49 1.32 -0.10 0.00 0.00 0.00 173.10 174.02 2q4i n LEU 50 N -0.42 2.67 0.00 0.66 7.94 -1.26 -1.18 117.00 125.41 2q4i n LEU 50 Ca -0.02 1.15 0.00 0.00 -1.11 0.00 0.00 56.01 56.02 2q4i n LEU 50 Cb 0.61 -1.37 0.00 0.00 0.53 0.00 0.00 43.42 43.19 2q4i n LEU 50 CO 0.21 -0.74 0.00 0.61 -1.11 0.00 0.00 177.39 176.36 2q4i n GLY 51 N 2.01 1.60 3.73 -3.96 0.00 -1.26 -4.09 105.19 103.21 2q4i n GLY 51 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.35 7.48 0.03 1.61 1.01 -0.33 -3.84 116.67 122.29 2q4i s ASP 52 Ca 0.00 1.78 0.08 0.00 0.71 0.00 0.00 52.55 55.13 2q4i s ASP 52 Cb 0.00 -2.59 -0.03 0.00 1.01 0.00 0.00 42.92 41.32 2q4i s ASP 52 CO 0.00 -0.09 -0.25 -0.76 0.21 0.00 0.00 175.17 174.28 2q4i s LEU 53 N 0.12 2.14 -0.43 1.23 1.43 -0.90 -1.39 118.68 120.88 2q4i s LEU 53 Ca 0.48 -0.54 0.02 0.00 -1.03 0.00 0.00 54.13 53.05 2q4i s LEU 53 Cb -0.23 -1.22 0.14 0.00 0.03 0.00 0.00 46.19 44.91 2q4i s LEU 53 CO 0.30 0.25 0.26 -0.69 0.23 0.00 0.00 176.35 176.69 2q4i s VAL 54 N -0.75 1.05 0.53 -1.59 1.01 0.39 -1.51 120.40 119.53 2q4i s VAL 54 Ca 0.10 -2.45 -0.20 0.00 0.00 0.00 0.00 61.98 59.44 2q4i s VAL 54 Cb -0.10 -1.74 -0.06 0.00 0.00 0.00 0.00 36.38 34.49 2q4i s VAL 54 CO 0.01 -0.96 1.12 -2.84 0.00 0.00 0.00 175.10 172.43 2q4i s PRO 55 N 0.40 3.43 0.28 2.72 0.02 -1.21 0.79 135.00 141.44 2q4i s PRO 55 Ca 0.20 1.60 -0.17 0.00 0.02 0.00 0.00 61.00 62.65 2q4i s PRO 55 Cb -0.20 -2.04 0.01 0.00 0.02 0.00 0.00 34.50 32.29 2q4i s PRO 55 CO -0.03 -0.78 0.63 -0.59 -0.33 0.00 0.00 177.00 175.90 2q4i s PHE 56 N -1.78 0.10 -0.30 6.54 -0.12 -0.82 -2.14 117.98 119.46 2q4i s PHE 56 Ca 0.72 -0.53 -0.11 0.00 -0.05 0.00 0.00 56.93 56.95 2q4i s PHE 56 Cb -0.23 0.50 0.16 0.00 -0.63 0.00 0.00 43.02 42.81 2q4i s PHE 56 CO 0.27 -1.18 0.82 -0.08 -0.05 0.00 0.00 175.22 175.00 2q4i s THR 57 N -3.76 -0.73 0.48 -4.49 -1.32 -1.26 -2.49 115.64 102.07 2q4i s THR 57 Ca 0.17 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 60.67 2q4i s THR 57 Cb -0.04 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 69.98 2q4i s THR 57 CO 0.09 0.00 0.19 0.59 -2.21 0.00 0.00 174.62 173.27 2q4i n ASN 58 N 5.25 2.95 -4.90 8.08 3.02 -1.18 -4.71 115.26 123.78 2q4i n ASN 58 Ca -0.09 -2.89 -0.32 0.00 -0.03 0.00 0.00 54.58 51.26 2q4i n ASN 58 Cb 0.51 0.15 -0.05 0.00 -0.61 0.00 0.00 39.78 39.78 2q4i n ASN 58 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2q4i s LYS 59 N -3.87 3.62 -0.04 3.52 1.02 -0.31 -1.07 119.74 122.61 2q4i s LYS 59 Ca 0.14 -0.09 0.04 0.00 0.02 0.00 0.00 55.97 56.09 2q4i s LYS 59 Cb -0.01 -2.86 -0.00 0.00 -0.52 0.00 0.00 37.83 34.43 2q4i s LYS 59 CO 0.09 0.48 -0.17 -1.17 -0.92 0.00 0.00 175.35 173.66 2q4i s LEU 60 N -2.60 1.91 0.15 3.17 2.96 -1.01 0.22 118.68 123.48 2q4i s LEU 60 Ca 0.40 -0.34 0.06 0.00 -0.22 0.00 0.00 54.13 54.03 2q4i s LEU 60 Cb -0.12 -0.94 -0.04 0.00 0.50 0.00 0.00 46.19 45.58 2q4i s LEU 60 CO 0.24 0.15 -0.13 -0.31 -1.32 0.00 0.00 176.35 174.98 2q4i s TYR 61 N 0.05 1.45 1.07 5.38 2.02 0.17 0.82 117.35 128.30 2q4i s TYR 61 Ca -0.04 -0.61 -0.12 0.00 -0.37 0.00 0.00 57.07 55.92 2q4i s TYR 61 Cb -0.11 -0.73 0.23 0.00 -0.40 0.00 0.00 41.96 40.95 2q4i s TYR 61 CO 0.02 0.18 1.06 0.95 -1.57 0.00 0.00 175.55 176.20 2q4i s THR 62 N -2.66 2.10 0.39 -0.71 -4.23 -0.82 -0.61 115.64 109.10 2q4i s THR 62 Ca 0.14 0.03 0.09 0.00 -1.18 0.00 0.00 61.69 60.78 2q4i s THR 62 Cb -0.02 -2.30 0.31 0.00 1.34 0.00 0.00 72.50 71.84 2q4i s THR 62 CO 0.03 -0.04 1.95 1.23 -0.54 0.00 0.00 174.62 177.25 2q4i h GLY 63 N -2.22 0.87 -0.02 3.99 0.00 -1.57 -1.68 103.07 102.44 2q4i h GLY 63 Ca -0.57 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 46.50 2q4i h GLY 63 CO 0.53 0.16 -0.00 2.09 0.00 0.00 0.00 176.54 179.32 2q4i n ASP 64 N -4.49 1.05 -0.08 0.19 5.68 -1.25 -0.81 116.55 116.85 2q4i n ASP 64 Ca 0.12 -1.35 -0.01 0.00 -0.50 0.00 0.00 54.79 53.05 2q4i n ASP 64 Cb 0.33 0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 40.31 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 -0.18 0.52 0.11 -2.12 4.77 -0.63 -4.66 117.00 114.81 2q4i n LEU 65 Ca 0.20 0.02 -0.02 0.00 -0.03 0.00 0.00 56.01 56.19 2q4i n LEU 65 Cb 0.28 -1.80 -0.03 0.00 -2.33 0.00 0.00 43.42 39.54 2q4i n LEU 65 CO 0.17 -0.65 0.33 0.11 -1.33 0.00 0.00 177.39 176.03 2q4i h LYS 66 N 0.33 0.00 -4.56 3.23 1.57 -1.92 -2.29 116.57 112.93 2q4i h LYS 66 Ca -0.02 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.42 2q4i h LYS 66 Cb 0.66 0.00 -0.27 0.00 0.08 0.00 0.00 32.23 32.70 2q4i h LYS 66 CO 0.03 0.72 -0.76 0.15 -0.57 0.00 0.00 179.45 179.02 2q4i s LYS 67 N -2.88 0.57 0.19 3.15 1.02 -1.25 -4.06 119.74 116.47 2q4i s LYS 67 Ca 0.02 -0.38 -0.30 0.00 0.02 0.00 0.00 55.97 55.33 2q4i s LYS 67 Cb 0.09 -0.51 -0.08 0.00 -0.52 0.00 0.00 37.83 36.80 2q4i s LYS 67 CO 0.78 0.13 1.24 0.50 -0.92 0.00 0.00 175.35 177.08 2q4i s ARG 68 N -0.52 4.45 -0.04 1.68 6.06 0.88 -1.94 118.95 129.52 2q4i s ARG 68 Ca 0.00 1.94 0.15 0.00 -2.50 0.00 0.00 55.73 55.32 2q4i s ARG 68 Cb -0.04 -3.23 -0.24 0.00 0.06 0.00 0.00 34.95 31.50 2q4i s ARG 68 CO 0.00 -0.16 0.30 1.33 -2.50 0.00 0.00 175.30 174.28 2q4i n VAL 69 N 2.60 0.15 0.00 7.11 0.24 0.24 -3.17 118.33 125.50 2q4i n VAL 69 Ca 0.05 -0.40 0.00 0.00 -2.04 0.00 0.00 64.34 61.95 2q4i n VAL 69 Cb 0.44 0.03 0.00 0.00 -1.47 0.00 0.00 33.84 32.84 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 1.68 -0.30 3.56 7.63 0.00 -0.99 -2.32 105.19 114.45 2q4i n GLY 70 Ca -0.06 -0.09 -0.09 0.00 0.00 0.00 0.00 46.02 45.78 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 0.00 0.01 0.30 -0.61 -4.36 -1.19 -2.41 121.20 112.94 2q4i s ILE 71 Ca 0.00 -1.26 0.07 0.00 -0.26 0.00 0.00 60.65 59.20 2q4i s ILE 71 Cb 0.00 -2.02 -0.03 0.00 1.25 0.00 0.00 42.46 41.66 2q4i s ILE 71 CO 0.00 -0.06 0.26 0.42 0.24 0.00 0.00 174.94 175.80 2q4i s THR 72 N -3.98 4.02 -0.27 8.37 -4.23 -0.23 -0.63 115.64 118.69 2q4i s THR 72 Ca 0.18 -1.35 -0.14 0.00 -1.18 0.00 0.00 61.69 59.20 2q4i s THR 72 Cb -0.01 -3.31 0.08 0.00 1.34 0.00 0.00 72.50 70.60 2q4i s THR 72 CO 0.05 -0.26 0.65 0.00 -0.54 0.00 0.00 174.62 174.53 2q4i s ALA 73 N -2.21 -1.79 0.00 3.99 0.00 -0.08 -3.10 121.76 118.57 2q4i s ALA 73 Ca 0.37 2.30 0.00 0.00 0.00 0.00 0.00 51.96 54.63 2q4i s ALA 73 Cb -0.07 -1.41 0.00 0.00 0.00 0.00 0.00 23.12 21.64 2q4i s ALA 73 CO 0.26 -0.44 0.00 0.41 0.00 0.00 0.00 175.76 175.99 2q4i n GLY 74 N 4.47 -0.58 2.88 0.00 0.00 -1.04 0.07 105.19 110.99 2q4i n GLY 74 Ca -0.19 -0.66 -0.17 0.00 0.00 0.00 0.00 46.02 45.00 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 1.51 -0.22 0.99 2.96 -0.55 -1.95 118.68 121.43 2q4i s LEU 75 Ca 0.00 -0.07 -0.07 0.00 -0.22 0.00 0.00 54.13 53.76 2q4i s LEU 75 Cb 0.00 -0.29 -0.04 0.00 0.50 0.00 0.00 46.19 46.37 2q4i s LEU 75 CO 0.00 -0.03 0.07 0.00 -1.32 0.00 0.00 176.35 175.07 2q4i s VAL 77 N 1.09 4.63 0.15 0.00 1.01 -0.09 0.15 120.40 127.34 2q4i s VAL 77 Ca 0.04 -0.08 -0.30 0.00 0.00 0.00 0.00 61.98 61.64 2q4i s VAL 77 Cb -0.14 -3.19 -0.08 0.00 0.00 0.00 0.00 36.38 32.97 2q4i s VAL 77 CO 0.03 0.30 1.30 -0.69 0.00 0.00 0.00 175.10 176.04 2q4i s VAL 78 N 1.66 3.40 -0.23 2.92 1.01 -0.48 -1.08 120.40 127.61 2q4i s VAL 78 Ca 0.06 1.09 -0.01 0.00 0.00 0.00 0.00 61.98 63.12 2q4i s VAL 78 Cb -0.15 -3.70 -0.14 0.00 0.00 0.00 0.00 36.38 32.39 2q4i s VAL 78 CO 0.06 0.13 -0.22 -0.38 0.00 0.00 0.00 175.10 174.69 2q4i n ILE 79 N 3.16 1.28 -3.56 2.22 2.08 -0.14 -4.18 119.36 120.23 2q4i n ILE 79 Ca 0.08 -0.45 -0.07 0.00 0.56 0.00 0.00 62.75 62.86 2q4i n ILE 79 Cb 0.43 -1.40 -0.03 0.00 -0.75 0.00 0.00 39.64 37.89 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 -2.44 0.56 0.32 0.38 -1.05 -1.21 -4.13 118.70 111.12 2q4i s GLU 80 Ca -0.31 -0.12 -0.18 0.00 -0.15 0.00 0.00 54.97 54.21 2q4i s GLU 80 Cb 0.09 0.26 -0.09 0.00 -0.44 0.00 0.00 34.13 33.94 2q4i s GLU 80 CO 0.49 -0.23 0.79 -1.58 0.95 0.00 0.00 175.26 175.69 2q4i s HIS 81 N -2.32 3.44 -0.63 4.83 5.65 -1.25 -1.77 115.29 123.24 2q4i s HIS 81 Ca 0.05 1.37 0.05 0.00 0.25 0.00 0.00 55.06 56.78 2q4i s HIS 81 Cb -0.01 -2.64 0.16 0.00 -1.18 0.00 0.00 32.58 28.91 2q4i s HIS 81 CO -0.05 0.12 0.43 0.08 -0.65 0.00 0.00 174.74 174.67 2q4i s VAL 82 N -1.89 2.36 0.36 0.89 1.01 0.16 -4.91 120.40 118.38 2q4i s VAL 82 Ca 0.53 -3.83 0.03 0.00 0.00 0.00 0.00 61.98 58.71 2q4i s VAL 82 Cb -0.12 -2.57 0.25 0.00 0.00 0.00 0.00 36.38 33.94 2q4i s VAL 82 CO 0.18 -1.02 2.00 1.55 0.00 0.00 0.00 175.10 177.81 2q4i h PRO 83 N 5.61 0.74 0.00 2.72 0.13 -1.96 0.46 132.00 139.69 2q4i h PRO 83 Ca 0.14 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 2q4i h PRO 83 Cb 0.80 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 31.77 2q4i h PRO 83 CO 0.65 0.51 0.00 1.05 -0.23 0.00 0.00 178.00 179.98 2q4i h GLU 84 N 0.75 0.00 -0.21 0.86 9.09 -1.94 -2.08 114.58 121.06 2q4i h GLU 84 Ca 0.20 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.61 2q4i h GLU 84 Cb -0.04 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.06 2q4i h GLU 84 CO -0.04 0.00 0.00 1.63 0.05 0.00 0.00 179.01 180.65 2q4i n LYS 85 N -3.06 1.87 -4.02 1.06 4.76 -0.14 -5.01 118.16 113.62 2q4i n LYS 85 Ca -0.00 -1.68 -0.37 0.00 -2.87 0.00 0.00 58.31 53.39 2q4i n LYS 85 Cb 0.23 -1.25 -0.00 0.00 -1.84 0.00 0.00 35.03 32.17 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 0.59 -1.08 -3.58 1.97 4.76 -0.03 -4.84 118.16 115.95 2q4i n LYS 86 Ca 0.10 0.21 -0.03 0.00 -2.87 0.00 0.00 58.31 55.72 2q4i n LYS 86 Cb 0.37 -3.40 0.02 0.00 -1.84 0.00 0.00 35.03 30.17 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 -2.08 0.68 3.59 0.72 0.00 -1.00 -4.84 105.19 102.25 2q4i n GLY 87 Ca -0.18 -1.12 -0.24 0.00 0.00 0.00 0.00 46.02 44.48 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 2.04 -0.15 1.61 0.41 -1.26 0.37 118.70 119.67 2q4i s GLU 88 Ca 0.20 -1.64 -0.03 0.00 -0.41 0.00 0.00 54.97 53.10 2q4i s GLU 88 Cb -0.02 -1.96 -0.02 0.00 -1.78 0.00 0.00 34.13 30.34 2q4i s GLU 88 CO 0.05 0.27 -0.06 0.50 -0.49 0.00 0.00 175.26 175.53 2q4i s ARG 89 N -3.64 3.60 0.22 1.61 3.52 -0.73 -1.76 118.95 121.77 2q4i s ARG 89 Ca 0.32 -0.56 0.11 0.00 -0.13 0.00 0.00 55.73 55.47 2q4i s ARG 89 Cb -0.04 -2.85 -0.05 0.00 -1.56 0.00 0.00 34.95 30.46 2q4i s ARG 89 CO 0.18 0.23 -0.22 -0.06 -0.81 0.00 0.00 175.30 174.62 2q4i s PHE 90 N 0.38 2.24 -0.27 5.12 0.08 0.86 -0.96 117.98 125.43 2q4i s PHE 90 Ca -0.06 -0.36 -0.04 0.00 0.12 0.00 0.00 56.93 56.59 2q4i s PHE 90 Cb -0.15 -1.06 0.01 0.00 -0.57 0.00 0.00 43.02 41.26 2q4i s PHE 90 CO 0.04 0.56 0.01 -2.00 -0.10 0.00 0.00 175.22 173.72 2q4i s GLU 91 N -3.01 3.03 -0.10 0.44 2.56 -0.24 -1.66 118.70 119.72 2q4i s GLU 91 Ca 0.24 -0.87 0.03 0.00 0.00 0.00 0.00 54.97 54.36 2q4i s GLU 91 Cb -0.06 -3.17 -0.01 0.00 2.00 0.00 0.00 34.13 32.89 2q4i s GLU 91 CO 0.11 -0.39 -0.20 0.00 -0.56 0.00 0.00 175.26 174.22 2q4i s ALA 92 N 1.43 2.33 -0.16 6.30 0.00 0.57 -0.92 121.76 131.31 2q4i s ALA 92 Ca 0.02 -0.96 -0.01 0.00 0.00 0.00 0.00 51.96 51.01 2q4i s ALA 92 Cb -0.17 -0.92 0.04 0.00 0.00 0.00 0.00 23.12 22.08 2q4i s ALA 92 CO -0.01 0.31 -0.05 0.99 0.00 0.00 0.00 175.76 177.00 2q4i s THR 93 N 0.20 1.07 0.20 0.00 2.01 -0.86 -1.17 115.64 117.09 2q4i s THR 93 Ca -0.12 -0.58 -0.23 0.00 0.31 0.00 0.00 61.69 61.07 2q4i s THR 93 Cb -0.16 -1.24 0.05 0.00 0.01 0.00 0.00 72.50 71.16 2q4i s THR 93 CO 0.07 0.15 0.90 -0.72 -0.69 0.00 0.00 174.62 174.32 2q4i s TYR 94 N 1.65 -0.11 0.29 4.92 -0.85 -0.96 -1.47 117.35 120.82 2q4i s TYR 94 Ca 0.01 -0.27 0.09 0.00 -0.52 0.00 0.00 57.07 56.38 2q4i s TYR 94 Cb -0.15 0.68 -0.06 0.00 0.38 0.00 0.00 41.96 42.81 2q4i s TYR 94 CO -0.08 -0.99 -0.11 -1.12 -1.52 0.00 0.00 175.55 171.73 2q4i s SER 95 N -2.99 3.23 -0.17 -0.18 0.01 0.11 -0.95 113.70 112.76 2q4i s SER 95 Ca 0.13 -1.14 0.01 0.00 1.31 0.00 0.00 55.95 56.25 2q4i s SER 95 Cb -0.03 -0.25 0.02 0.00 0.21 0.00 0.00 66.02 65.97 2q4i s SER 95 CO 0.04 -0.20 -0.18 -0.36 0.41 0.00 0.00 173.24 172.95 2q4i s PHE 96 N -2.78 2.58 -0.14 2.43 0.08 0.19 -0.90 117.98 119.44 2q4i s PHE 96 Ca 0.30 -1.52 -0.04 0.00 0.12 0.00 0.00 56.93 55.79 2q4i s PHE 96 Cb 0.01 -1.81 -0.03 0.00 -0.57 0.00 0.00 43.02 40.62 2q4i s PHE 96 CO 0.13 -0.76 0.00 0.71 -0.10 0.00 0.00 175.22 175.21 2q4i s TYR 97 N 1.35 3.14 -0.56 0.36 2.02 0.20 -0.13 117.35 123.73 2q4i s TYR 97 Ca 0.05 -0.03 0.05 0.00 -0.37 0.00 0.00 57.07 56.77 2q4i s TYR 97 Cb -0.13 -1.94 0.35 0.00 -0.40 0.00 0.00 41.96 39.84 2q4i s TYR 97 CO -0.12 0.18 0.96 1.19 -1.57 0.00 0.00 175.55 176.19 2q4i n PHE 98 N 3.10 3.86 -0.45 2.71 3.72 0.59 -3.17 117.46 127.82 2q4i n PHE 98 Ca -0.18 -3.89 0.00 0.00 -0.05 0.00 0.00 57.45 53.34 2q4i n PHE 98 Cb 0.53 -0.44 0.00 0.00 -0.94 0.00 0.00 39.48 38.63 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 -0.26 2.65 0.29 1.37 0.00 -0.98 -1.16 105.19 107.10 2q4i n GLY 99 Ca 0.32 -0.10 0.18 0.00 0.00 0.00 0.00 46.02 46.42 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 0.89 0.00 0.80 1.61 3.32 -1.54 -3.00 116.42 118.50 2q4i h ASP 100 Ca 0.00 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 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 0.04 -0.24 1.88 -1.72 0.00 0.00 179.24 179.20 2q4i h TYR 101 N 0.00 0.00 0.00 4.55 0.05 -1.44 -3.47 116.97 116.66 2q4i h TYR 101 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2q4i h TYR 101 Cb 0.29 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.03 2q4i h TYR 101 CO 0.00 0.24 0.00 0.41 -1.05 0.00 0.00 178.16 177.76 2q4i n GLY 102 N 0.01 0.16 3.65 3.88 0.00 -1.14 -0.03 105.19 111.72 2q4i n GLY 102 Ca -0.00 -1.85 -0.09 0.00 0.00 0.00 0.00 46.02 44.08 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 -0.54 -0.10 0.07 1.61 -3.43 -0.70 -0.30 115.29 111.90 2q4i s HIS 103 Ca 0.00 -0.28 0.10 0.00 -0.80 0.00 0.00 55.06 54.08 2q4i s HIS 103 Cb 0.00 0.49 -0.03 0.00 -1.43 0.00 0.00 32.58 31.61 2q4i s HIS 103 CO 0.00 -1.04 -0.26 -0.51 -2.00 0.00 0.00 174.74 170.93 2q4i s LEU 104 N -2.90 2.25 0.09 5.38 1.43 0.81 -1.82 118.68 123.92 2q4i s LEU 104 Ca 0.11 -0.63 0.09 0.00 -1.03 0.00 0.00 54.13 52.68 2q4i s LEU 104 Cb -0.03 -1.29 -0.03 0.00 0.03 0.00 0.00 46.19 44.87 2q4i s LEU 104 CO 0.02 0.23 -0.24 -0.44 0.23 0.00 0.00 176.35 176.15 2q4i s SER 105 N -1.53 2.96 0.17 2.29 0.01 -0.84 0.54 113.70 117.30 2q4i s SER 105 Ca 0.13 -0.66 -0.04 0.00 1.31 0.00 0.00 55.95 56.69 2q4i s SER 105 Cb -0.10 -0.22 -0.03 0.00 0.21 0.00 0.00 66.02 65.88 2q4i s SER 105 CO 0.04 0.17 0.17 0.68 0.41 0.00 0.00 173.24 174.70 2q4i s VAL 106 N -0.97 0.06 -0.23 3.43 -7.23 -0.12 -1.92 120.40 113.42 2q4i s VAL 106 Ca 0.11 -1.77 -0.18 0.00 -1.81 0.00 0.00 61.98 58.33 2q4i s VAL 106 Cb -0.10 -2.14 0.06 0.00 0.56 0.00 0.00 36.38 34.76 2q4i s VAL 106 CO 0.04 -0.25 0.59 -1.58 -0.31 0.00 0.00 175.10 173.58 2q4i s GLN 107 N -4.06 0.66 0.00 4.82 0.74 -0.89 -2.27 119.66 118.66 2q4i s GLN 107 Ca 0.27 0.89 0.00 0.00 0.05 0.00 0.00 55.36 56.56 2q4i s GLN 107 Cb 0.06 0.26 0.00 0.00 1.10 0.00 0.00 33.01 34.42 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 3.22 0.01 3.73 2.59 0.00 -0.32 -1.86 105.19 112.56 2q4i n GLY 108 Ca -0.16 -1.36 -0.40 0.00 0.00 0.00 0.00 46.02 44.10 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 4.47 -0.24 1.61 0.04 -1.26 -0.31 135.00 137.30 2q4i s PRO 109 Ca 0.00 1.00 0.02 0.00 0.04 0.00 0.00 61.00 62.07 2q4i s PRO 109 Cb 0.00 -3.40 0.05 0.00 0.04 0.00 0.00 34.50 31.19 2q4i s PRO 109 CO 0.00 0.18 -0.13 -0.47 0.04 0.00 0.00 177.00 176.63 2q4i s TYR 110 N 0.32 3.13 -0.37 0.56 5.04 -0.66 -4.76 117.35 120.61 2q4i s TYR 110 Ca 0.39 -2.15 -0.04 0.00 -2.44 0.00 0.00 57.07 52.82 2q4i s TYR 110 Cb -0.19 -1.91 0.08 0.00 0.35 0.00 0.00 41.96 40.28 2q4i s TYR 110 CO 0.21 -0.86 0.14 -0.51 -1.34 0.00 0.00 175.55 173.20 2q4i s LEU 111 N 1.15 4.71 0.63 6.97 1.43 -1.26 -0.10 118.68 132.22 2q4i s LEU 111 Ca -0.06 -1.58 0.21 0.00 -1.03 0.00 0.00 54.13 51.67 2q4i s LEU 111 Cb -0.18 -1.83 1.12 0.00 0.03 0.00 0.00 46.19 45.32 2q4i s LEU 111 CO -0.07 -0.43 1.62 0.71 0.23 0.00 0.00 176.35 178.41 2q4i h THR 112 N 6.31 0.00 -0.01 5.49 1.35 -1.72 -1.69 112.91 122.63 2q4i h THR 112 Ca -0.19 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.67 2q4i h THR 112 Cb 1.06 0.46 0.00 0.00 -1.73 0.00 0.00 68.15 67.94 2q4i h THR 112 CO 0.65 0.00 -0.53 0.00 -0.25 0.00 0.00 175.52 175.38 2q4i n TYR 113 N -2.71 0.00 -3.60 4.73 0.18 -1.26 -4.94 117.16 109.56 2q4i n TYR 113 Ca -0.01 0.00 -0.08 0.00 1.88 0.00 0.00 57.90 59.68 2q4i n TYR 113 Cb 0.54 -0.02 -0.02 0.00 -0.38 0.00 0.00 39.34 39.46 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 -2.58 1.27 1.00 -3.48 -1.05 -0.64 -5.07 118.70 108.15 2q4i s GLU 114 Ca 0.17 -0.58 -0.12 0.00 -0.15 0.00 0.00 54.97 54.29 2q4i s GLU 114 Cb 0.18 0.51 0.19 0.00 -0.44 0.00 0.00 34.13 34.57 2q4i s GLU 114 CO 0.62 -0.57 1.08 -0.51 0.95 0.00 0.00 175.26 176.83 2q4i s ASP 115 N -2.76 2.51 0.10 0.83 1.01 -1.26 -4.33 116.67 112.77 2q4i s ASP 115 Ca 0.06 1.38 -0.26 0.00 0.71 0.00 0.00 52.55 54.45 2q4i s ASP 115 Cb -0.02 -2.07 0.09 0.00 1.01 0.00 0.00 42.92 41.93 2q4i s ASP 115 CO -0.05 -3.23 1.11 -0.55 0.21 0.00 0.00 175.17 172.67 2q4i s SER 116 N -3.22 -0.06 -0.02 0.27 0.15 -0.69 -4.91 113.70 105.23 2q4i s SER 116 Ca 0.65 -0.41 0.05 0.00 0.70 0.00 0.00 55.95 56.95 2q4i s SER 116 Cb -0.20 0.37 -0.03 0.00 -1.71 0.00 0.00 66.02 64.45 2q4i s SER 116 CO 0.59 -0.71 -0.18 -0.36 1.20 0.00 0.00 173.24 173.79 2q4i s PHE 117 N -2.51 2.59 0.13 3.44 0.08 -1.26 -0.37 117.98 120.08 2q4i s PHE 117 Ca 0.18 -0.24 0.07 0.00 0.12 0.00 0.00 56.93 57.07 2q4i s PHE 117 Cb -0.00 -1.56 -0.04 0.00 -0.57 0.00 0.00 43.02 40.85 2q4i s PHE 117 CO 0.01 0.16 -0.05 -0.51 -0.10 0.00 0.00 175.22 174.74 2q4i s LEU 118 N -0.92 3.21 0.22 -0.37 1.02 0.43 -4.49 118.68 117.77 2q4i s LEU 118 Ca 0.12 -0.37 -0.30 0.00 0.02 0.00 0.00 54.13 53.60 2q4i s LEU 118 Cb -0.10 -1.93 -0.08 0.00 0.02 0.00 0.00 46.19 44.09 2q4i s LEU 118 CO 0.02 0.14 1.06 0.00 0.02 0.00 0.00 176.35 177.58 2q4i s ALA 119 N -1.46 3.37 -0.36 4.21 0.00 -0.78 0.16 121.76 126.90 2q4i s ALA 119 Ca 0.25 0.78 -0.21 0.00 0.00 0.00 0.00 51.96 52.77 2q4i s ALA 119 Cb -0.10 -3.31 0.01 0.00 0.00 0.00 0.00 23.12 19.71 2q4i s ALA 119 CO 0.16 -0.09 0.69 0.42 0.00 0.00 0.00 175.76 176.94 2q4i s ILE 120 N -0.71 4.83 -0.30 0.00 1.01 0.77 -2.10 121.20 124.71 2q4i s ILE 120 Ca 0.46 0.66 0.21 0.00 0.00 0.00 0.00 60.65 61.98 2q4i s ILE 120 Cb -0.29 -4.13 0.13 0.00 0.01 0.00 0.00 42.46 38.18 2q4i s ILE 120 CO 0.36 -0.37 1.28 0.71 0.00 0.00 0.00 174.94 176.92 2q4i h THR 121 N 5.71 0.13 0.00 2.92 1.35 -1.68 -3.36 112.91 117.98 2q4i h THR 121 Ca -0.26 -1.20 0.00 0.00 -0.55 0.00 0.00 66.41 64.40 2q4i h THR 121 Cb 1.10 1.83 0.00 0.00 -1.73 0.00 0.00 68.15 69.35 2q4i h THR 121 CO 0.86 0.07 0.00 0.61 -0.25 0.00 0.00 175.52 176.82 2q4i n GLY 122 N 1.17 -2.23 3.70 5.82 0.00 -1.25 -4.99 105.19 107.42 2q4i n GLY 122 Ca 0.01 -1.24 -0.11 0.00 0.00 0.00 0.00 46.02 44.68 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 0.77 -0.03 -0.02 0.00 -1.23 -1.99 107.32 104.81 2q4i s GLY 123 Ca 0.00 -1.03 -0.19 0.00 0.00 0.00 0.00 44.72 43.50 2q4i s GLY 123 CO 0.00 -0.54 0.42 0.00 0.00 0.00 0.00 173.10 172.98 2q4i s ALA 124 N -2.47 -1.08 0.00 3.20 0.00 -0.75 -4.11 121.76 116.55 2q4i s ALA 124 Ca 0.21 0.65 0.00 0.00 0.00 0.00 0.00 51.96 52.82 2q4i s ALA 124 Cb -0.04 0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.10 2q4i s ALA 124 CO 0.15 -0.29 0.00 0.41 0.00 0.00 0.00 175.76 176.03 2q4i n GLY 125 N 1.24 0.33 0.00 0.00 0.00 -1.26 -1.72 105.19 103.78 2q4i n GLY 125 Ca -0.20 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.56 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 1.21 -0.36 -0.61 -5.35 0.95 -1.45 119.36 113.75 2q4i n ILE 126 Ca 0.00 0.32 0.09 0.00 -0.27 0.00 0.00 62.75 62.89 2q4i n ILE 126 Cb 0.00 -1.32 0.25 0.00 -1.74 0.00 0.00 39.64 36.83 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 -1.29 0.83 -1.77 4.28 3.72 -1.21 -4.79 117.46 117.22 2q4i n PHE 127 Ca 0.00 -0.54 -0.41 0.00 -0.05 0.00 0.00 57.45 56.45 2q4i n PHE 127 Cb 0.02 -0.07 -0.01 0.00 -0.94 0.00 0.00 39.48 38.48 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 -1.23 4.11 0.00 -1.08 -6.30 -0.53 -1.89 118.70 111.78 2q4i s GLU 128 Ca 0.38 2.59 0.00 0.00 -2.50 0.00 0.00 54.97 55.44 2q4i s GLU 128 Cb 0.21 -3.01 0.00 0.00 0.00 0.00 0.00 34.13 31.33 2q4i s GLU 128 CO 0.23 -0.63 0.00 0.41 0.02 0.00 0.00 175.26 175.29 2q4i n GLY 129 N 1.94 0.79 3.76 -1.50 0.00 -1.26 -4.47 105.19 104.44 2q4i n GLY 129 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 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 -3.00 3.61 0.32 4.61 0.00 -0.80 -4.25 121.76 122.26 2q4i s ALA 130 Ca 0.00 1.43 -0.06 0.00 0.00 0.00 0.00 51.96 53.33 2q4i s ALA 130 Cb 0.00 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.55 2q4i s ALA 130 CO 0.00 -0.86 0.48 1.52 0.00 0.00 0.00 175.76 176.90 2q4i s TYR 131 N -0.54 0.83 0.00 0.00 -0.85 -0.33 -3.78 117.35 112.68 2q4i s TYR 131 Ca 0.56 -1.13 0.00 0.00 -0.52 0.00 0.00 57.07 55.99 2q4i s TYR 131 Cb -0.44 0.03 0.00 0.00 0.38 0.00 0.00 41.96 41.93 2q4i s TYR 131 CO 0.52 -1.11 0.00 0.41 -1.52 0.00 0.00 175.55 173.85 2q4i n GLY 132 N -0.50 0.27 3.35 5.49 0.00 -1.26 -1.47 105.19 111.07 2q4i n GLY 132 Ca -0.00 -2.21 -0.18 0.00 0.00 0.00 0.00 46.02 43.62 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 0.00 1.36 -0.03 1.61 -2.07 -1.26 -0.16 119.66 119.11 2q4i s GLN 133 Ca 0.00 -1.64 0.03 0.00 -1.82 0.00 0.00 55.36 51.93 2q4i s GLN 133 Cb 0.00 -1.00 -0.00 0.00 -1.09 0.00 0.00 33.01 30.92 2q4i s GLN 133 CO 0.00 0.09 -0.13 0.54 -1.32 0.00 0.00 175.29 174.48 2q4i s VAL 134 N -3.09 1.04 -0.26 3.63 0.11 0.12 -1.85 120.40 120.12 2q4i s VAL 134 Ca 0.25 -0.52 -0.17 0.00 -2.93 0.00 0.00 61.98 58.61 2q4i s VAL 134 Cb 0.02 -0.90 -0.03 0.00 -1.53 0.00 0.00 36.38 33.93 2q4i s VAL 134 CO 0.08 0.31 0.47 -0.75 -3.33 0.00 0.00 175.10 171.87 2q4i s LYS 135 N 0.03 4.07 -0.26 1.54 2.20 -0.08 0.16 119.74 127.40 2q4i s LYS 135 Ca -0.01 0.24 -0.14 0.00 -0.36 0.00 0.00 55.97 55.70 2q4i s LYS 135 Cb -0.09 -3.64 -0.04 0.00 -1.51 0.00 0.00 37.83 32.55 2q4i s LYS 135 CO 0.01 -0.30 0.33 -1.17 -0.36 0.00 0.00 175.35 173.85 2q4i s LEU 136 N 2.14 4.06 -0.24 5.43 0.20 0.50 -0.42 118.68 130.34 2q4i s LEU 136 Ca 0.19 0.25 -0.03 0.00 0.69 0.00 0.00 54.13 55.24 2q4i s LEU 136 Cb -0.16 -2.36 0.01 0.00 -0.43 0.00 0.00 46.19 43.26 2q4i s LEU 136 CO 0.09 -0.12 -0.05 -1.10 -0.29 0.00 0.00 176.35 174.88 2q4i s GLN 137 N 1.82 3.01 -0.53 1.98 -0.21 0.28 -1.71 119.66 124.30 2q4i s GLN 137 Ca 0.13 -0.86 -0.25 0.00 0.02 0.00 0.00 55.36 54.41 2q4i s GLN 137 Cb -0.15 -3.01 0.04 0.00 1.00 0.00 0.00 33.01 30.89 2q4i s GLN 137 CO 0.09 -0.34 0.95 -1.14 -2.12 0.00 0.00 175.29 172.73 2q4i s GLN 138 N 1.38 3.38 -0.17 2.91 0.74 -1.26 -1.37 119.66 125.27 2q4i s GLN 138 Ca 0.02 -0.16 -0.21 0.00 0.05 0.00 0.00 55.36 55.06 2q4i s GLN 138 Cb -0.16 -4.03 -0.18 0.00 1.10 0.00 0.00 33.01 29.74 2q4i s GLN 138 CO -0.04 -1.44 0.37 1.25 -0.55 0.00 0.00 175.29 174.87 2q4i h LEU 139 N 10.93 0.00 -7.17 3.68 5.85 -1.88 -3.46 115.31 123.26 2q4i h LEU 139 Ca -0.26 -0.60 -0.36 0.00 0.84 0.00 0.00 57.88 57.51 2q4i h LEU 139 Cb 1.07 0.00 -0.38 0.00 0.37 0.00 0.00 40.66 41.72 2q4i h LEU 139 CO 1.08 1.14 -0.69 -0.69 -0.34 0.00 0.00 178.44 178.94 2q4i s VAL 140 N -2.22 -0.19 -0.02 1.05 1.01 -0.62 -4.70 120.40 114.72 2q4i s VAL 140 Ca -0.21 0.20 -0.30 0.00 0.00 0.00 0.00 61.98 61.67 2q4i s VAL 140 Cb 0.02 -0.36 -0.04 0.00 0.00 0.00 0.00 36.38 35.99 2q4i s VAL 140 CO 0.54 0.02 1.19 -0.47 0.00 0.00 0.00 175.10 176.38 2q4i s TYR 141 N 2.23 3.27 -0.38 5.22 6.14 -1.26 -1.21 117.35 131.36 2q4i s TYR 141 Ca 0.04 1.25 0.17 0.00 0.64 0.00 0.00 57.07 59.17 2q4i s TYR 141 Cb -0.13 -3.41 -0.23 0.00 0.42 0.00 0.00 41.96 38.60 2q4i s TYR 141 CO -0.06 -1.27 0.54 -0.35 0.64 0.00 0.00 175.55 175.04 2q4i n PRO 142 N 4.79 0.94 0.19 4.97 -0.04 -1.26 -4.91 135.00 139.68 2q4i n PRO 142 Ca 0.10 -0.09 0.14 0.00 -0.04 0.00 0.00 63.50 63.61 2q4i n PRO 142 Cb 0.46 -1.36 0.69 0.00 -0.04 0.00 0.00 33.50 33.25 2q4i n PRO 142 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 2q4i h THR 143 N 0.00 0.00 -3.32 0.52 1.35 -1.81 -3.43 112.91 106.22 2q4i h THR 143 Ca 0.00 -0.07 -0.37 0.00 -0.55 0.00 0.00 66.41 65.42 2q4i h THR 143 Cb 0.61 0.70 -0.39 0.00 -1.73 0.00 0.00 68.15 67.35 2q4i h THR 143 CO 0.00 0.00 -0.74 -0.54 -0.25 0.00 0.00 175.52 173.99 2q4i s LYS 144 N -3.62 -0.03 0.14 4.72 1.02 -0.35 0.25 119.74 121.88 2q4i s LYS 144 Ca -0.02 0.35 0.07 0.00 0.02 0.00 0.00 55.97 56.39 2q4i s LYS 144 Cb 0.08 -0.53 -0.04 0.00 -0.52 0.00 0.00 37.83 36.82 2q4i s LYS 144 CO 0.28 -0.32 -0.15 -0.51 -0.92 0.00 0.00 175.35 173.73 2q4i s LEU 145 N 2.10 2.44 -0.07 3.17 1.02 -0.50 -1.58 118.68 125.26 2q4i s LEU 145 Ca 0.04 -0.86 0.01 0.00 0.02 0.00 0.00 54.13 53.34 2q4i s LEU 145 Cb -0.12 -0.62 0.02 0.00 0.02 0.00 0.00 46.19 45.49 2q4i s LEU 145 CO -0.03 -0.13 -0.08 0.12 0.02 0.00 0.00 176.35 176.25 2q4i s PHE 146 N -2.30 1.14 0.16 0.29 5.36 -0.47 -1.72 117.98 120.45 2q4i s PHE 146 Ca 0.13 -0.43 0.11 0.00 -0.96 0.00 0.00 56.93 55.78 2q4i s PHE 146 Cb -0.04 -0.93 -0.04 0.00 -0.34 0.00 0.00 43.02 41.66 2q4i s PHE 146 CO 0.04 -0.30 -0.24 0.71 -1.46 0.00 0.00 175.22 173.97 2q4i s TYR 147 N 1.06 2.33 -0.24 10.12 2.02 -0.61 -0.56 117.35 131.47 2q4i s TYR 147 Ca -0.08 -0.36 -0.00 0.00 -0.37 0.00 0.00 57.07 56.26 2q4i s TYR 147 Cb -0.14 -1.20 0.07 0.00 -0.40 0.00 0.00 41.96 40.28 2q4i s TYR 147 CO -0.01 0.43 0.01 0.99 -1.57 0.00 0.00 175.55 175.40 2q4i s THR 148 N -1.39 1.19 0.02 -0.71 2.01 0.44 -2.25 115.64 114.95 2q4i s THR 148 Ca 0.18 -1.15 -0.29 0.00 0.31 0.00 0.00 61.69 60.74 2q4i s THR 148 Cb -0.09 -1.63 -0.04 0.00 0.01 0.00 0.00 72.50 70.76 2q4i s THR 148 CO 0.08 -0.27 0.93 -0.36 -0.69 0.00 0.00 174.62 174.31 2q4i s PHE 149 N 1.53 3.69 -1.00 4.92 0.08 -0.32 -0.90 117.98 125.97 2q4i s PHE 149 Ca -0.01 1.65 -0.07 0.00 0.12 0.00 0.00 56.93 58.63 2q4i s PHE 149 Cb -0.18 -3.04 0.25 0.00 -0.57 0.00 0.00 43.02 39.48 2q4i s PHE 149 CO -0.10 0.07 0.95 0.71 -0.10 0.00 0.00 175.22 176.75 2q4i s TYR 150 N 0.67 4.09 -0.16 0.36 2.02 -0.77 -1.95 117.35 121.60 2q4i s TYR 150 Ca 0.48 -2.78 -0.29 0.00 -0.37 0.00 0.00 57.07 54.11 2q4i s TYR 150 Cb -0.21 -3.61 -0.00 0.00 -0.40 0.00 0.00 41.96 37.74 2q4i s TYR 150 CO 0.27 -0.87 1.04 -0.51 -1.57 0.00 0.00 175.55 173.90 2q4i s LEU 151 N -1.18 4.18 0.40 -1.29 1.43 -0.49 -4.15 118.68 117.58 2q4i s LEU 151 Ca 0.28 1.48 0.08 0.00 -1.03 0.00 0.00 54.13 54.94 2q4i s LEU 151 Cb -0.09 -3.55 -0.06 0.00 0.03 0.00 0.00 46.19 42.52 2q4i s LEU 151 CO -0.10 -0.55 0.09 -0.54 0.23 0.00 0.00 176.35 175.48 2q4i s LYS 152 N 2.56 2.11 0.00 1.70 1.02 -0.54 -0.70 119.74 125.89 2q4i s LYS 152 Ca 0.47 -1.91 0.00 0.00 0.02 0.00 0.00 55.97 54.55 2q4i s LYS 152 Cb -0.17 -1.86 0.00 0.00 -0.52 0.00 0.00 37.83 35.28 2q4i s LYS 152 CO 0.13 -0.04 0.00 0.41 -0.92 0.00 0.00 175.35 174.93 2q4i n GLY 153 N -1.09 2.52 3.77 -3.33 0.00 -1.26 -1.19 105.19 104.60 2q4i n GLY 153 Ca -0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 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 4.43 0.15 0.99 1.02 -1.26 -4.45 118.68 119.56 2q4i s LEU 154 Ca 0.00 2.44 -0.16 0.00 0.02 0.00 0.00 54.13 56.43 2q4i s LEU 154 Cb 0.00 -3.71 0.01 0.00 0.02 0.00 0.00 46.19 42.50 2q4i s LEU 154 CO 0.00 -0.40 1.81 0.00 0.02 0.00 0.00 176.35 177.78 2q4i h ALA 155 N 3.41 0.49 -1.43 4.21 0.00 -1.87 -3.46 119.26 120.61 2q4i h ALA 155 Ca -0.48 -0.03 -0.57 0.00 0.00 0.00 0.00 54.91 53.83 2q4i h ALA 155 Cb 1.22 -0.16 -0.13 0.00 0.00 0.00 0.00 17.79 18.72 2q4i h ALA 155 CO 0.65 -0.04 -0.54 -0.80 0.00 0.00 0.00 179.25 178.52 2q4i s ASN 156 N -5.56 3.07 0.83 0.00 -0.87 -1.26 -5.14 114.94 106.01 2q4i s ASN 156 Ca -0.13 -1.59 -0.11 0.00 -1.57 0.00 0.00 52.86 49.46 2q4i s ASN 156 Cb 0.11 0.32 0.09 0.00 -0.02 0.00 0.00 41.25 41.75 2q4i s ASN 156 CO 0.72 -0.81 1.09 -1.81 -2.57 0.00 0.00 177.10 173.72 2q4i s ASP 157 N -3.65 4.08 0.61 -1.22 1.01 -1.26 -5.03 116.67 111.21 2q4i s ASP 157 Ca 0.23 1.49 -0.11 0.00 0.71 0.00 0.00 52.55 54.87 2q4i s ASP 157 Cb 0.04 -2.20 -0.04 0.00 1.01 0.00 0.00 42.92 41.73 2q4i s ASP 157 CO 0.12 -2.25 1.01 -0.76 0.21 0.00 0.00 175.17 173.50 2q4i s LEU 158 N -5.99 3.27 0.61 1.23 1.43 -1.26 -5.03 118.68 112.94 2q4i s LEU 158 Ca 0.62 1.39 -0.17 0.00 -1.03 0.00 0.00 54.13 54.93 2q4i s LEU 158 Cb -0.16 -4.43 -0.02 0.00 0.03 0.00 0.00 46.19 41.60 2q4i s LEU 158 CO 0.56 -0.84 1.16 -2.16 0.23 0.00 0.00 176.35 175.29 2q4i s PRO 159 N -5.13 2.93 0.41 1.29 0.04 -1.26 -4.93 135.00 128.35 2q4i s PRO 159 Ca 0.55 1.65 0.15 0.00 0.04 0.00 0.00 61.00 63.38 2q4i s PRO 159 Cb -0.11 -1.94 0.87 0.00 0.04 0.00 0.00 34.50 33.36 2q4i s PRO 159 CO 0.53 -1.20 1.89 -0.07 0.04 0.00 0.00 177.00 178.19 2q4i h LEU 160 N 0.60 0.00 -0.64 -3.56 3.38 -1.96 -2.51 115.31 110.62 2q4i h LEU 160 Ca -0.49 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.48 2q4i h LEU 160 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 2q4i h LEU 160 CO 0.55 0.29 0.00 -1.84 0.09 0.00 0.00 178.44 177.53 2q4i n GLU 161 N -4.10 0.17 0.02 1.13 0.28 -1.26 -1.27 120.64 115.62 2q4i n GLU 161 Ca -0.02 0.41 0.11 0.00 -0.16 0.00 0.00 57.16 57.50 2q4i n GLU 161 Cb 0.35 -1.84 0.05 0.00 1.43 0.00 0.00 31.44 31.43 2q4i n GLU 161 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 2q4i n LEU 162 N -2.17 0.64 -2.34 -1.84 4.77 -0.96 -4.51 117.00 110.60 2q4i n LEU 162 Ca 0.02 -0.07 -0.24 0.00 -0.03 0.00 0.00 56.01 55.69 2q4i n LEU 162 Cb 0.22 -0.11 0.01 0.00 -2.33 0.00 0.00 43.42 41.21 2q4i n LEU 162 CO 0.19 0.08 0.16 0.35 -1.33 0.00 0.00 177.39 176.84 2q4i n THR 163 N -1.83 2.30 -2.21 -5.08 -2.24 -0.39 -4.54 114.28 100.29 2q4i n THR 163 Ca 0.03 -4.49 -0.34 0.00 -2.27 0.00 0.00 64.05 56.98 2q4i n THR 163 Cb 0.41 -1.01 -0.00 0.00 -2.10 0.00 0.00 70.33 67.63 2q4i n THR 163 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2q4i s GLY 164 N -3.55 2.36 -0.25 3.38 0.00 -1.23 -4.90 107.32 103.13 2q4i s GLY 164 Ca 0.47 0.58 -0.43 0.00 0.00 0.00 0.00 44.72 45.34 2q4i s GLY 164 CO -0.09 0.91 1.46 2.41 0.00 0.00 0.00 173.10 177.79 2q4i n THR 165 N -1.59 0.06 -2.01 0.90 -1.04 -1.26 -3.88 114.28 105.47 2q4i n THR 165 Ca 0.10 -0.01 -0.37 0.00 -2.04 0.00 0.00 64.05 61.72 2q4i n THR 165 Cb 0.52 -0.56 0.02 0.00 -1.82 0.00 0.00 70.33 68.49 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 2.04 3.30 -0.26 -2.82 0.02 -1.26 -3.80 135.00 132.22 2q4i s PRO 166 Ca 0.98 1.96 -0.28 0.00 0.02 0.00 0.00 61.00 63.67 2q4i s PRO 166 Cb -1.28 -2.21 0.01 0.00 0.02 0.00 0.00 34.50 31.04 2q4i s PRO 166 CO 0.68 -0.98 1.01 0.08 -0.33 0.00 0.00 177.00 177.46 2q4i s VAL 167 N -1.47 4.66 0.21 3.83 1.01 0.01 -4.86 120.40 123.79 2q4i s VAL 167 Ca 0.71 1.85 -0.32 0.00 0.00 0.00 0.00 61.98 64.22 2q4i s VAL 167 Cb -0.33 -4.31 -0.15 0.00 0.00 0.00 0.00 36.38 31.59 2q4i s VAL 167 CO 0.39 -0.25 1.22 -2.65 0.00 0.00 0.00 175.10 173.81 2q4i n PRO 168 N 6.42 1.47 -2.10 2.72 -0.02 -1.26 -4.84 135.00 137.39 2q4i n PRO 168 Ca 0.11 0.52 -0.41 0.00 -2.02 0.00 0.00 63.50 61.69 2q4i n PRO 168 Cb 0.47 -2.05 -0.03 0.00 -0.02 0.00 0.00 33.50 31.87 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 -0.56 4.32 -0.04 0.52 0.04 -1.26 -4.99 135.00 133.03 2q4i s PRO 169 Ca 0.69 2.19 -0.16 0.00 0.04 0.00 0.00 61.00 63.76 2q4i s PRO 169 Cb -0.77 -3.15 0.03 0.00 0.04 0.00 0.00 34.50 30.65 2q4i s PRO 169 CO 0.53 -0.36 0.37 -1.54 0.04 0.00 0.00 177.00 176.03 2q4i s SER 170 N 0.44 -0.29 0.60 6.66 1.04 -1.26 -5.02 113.70 115.87 2q4i s SER 170 Ca 0.59 0.29 0.30 0.00 0.48 0.00 0.00 55.95 57.62 2q4i s SER 170 Cb -0.39 0.43 1.63 0.00 0.10 0.00 0.00 66.02 67.79 2q4i s SER 170 CO 0.40 -0.41 1.91 0.07 0.98 0.00 0.00 173.24 176.19 2q4i h LYS 171 N 4.08 0.00 -0.21 4.02 2.10 -1.95 -1.29 116.57 123.32 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 1.17 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.50 2q4i h LYS 171 CO 0.37 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.57 2q4i n ASP 172 N -2.78 1.56 -4.78 7.07 8.00 -1.26 -4.94 116.55 119.42 2q4i n ASP 172 Ca -0.02 -1.78 -0.35 0.00 0.71 0.00 0.00 54.79 53.34 2q4i n ASP 172 Cb 0.30 -0.13 -0.00 0.00 -0.02 0.00 0.00 41.12 41.26 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 -1.73 3.22 0.13 0.53 -5.25 -0.49 -5.04 121.20 112.57 2q4i s ILE 173 Ca 0.28 0.77 -0.09 0.00 -0.99 0.00 0.00 60.65 60.62 2q4i s ILE 173 Cb 0.15 -3.32 -0.00 0.00 2.95 0.00 0.00 42.46 42.24 2q4i s ILE 173 CO 0.22 -0.15 0.25 -1.61 -1.79 0.00 0.00 174.94 171.85 2q4i s GLU 174 N -3.24 1.02 0.43 0.37 0.41 -1.26 -5.07 118.70 111.37 2q4i s GLU 174 Ca 0.72 -1.06 -0.07 0.00 -0.41 0.00 0.00 54.97 54.14 2q4i s GLU 174 Cb -0.24 0.37 -0.05 0.00 -1.78 0.00 0.00 34.13 32.43 2q4i s GLU 174 CO 0.27 -0.36 0.76 -1.25 -0.49 0.00 0.00 175.26 174.19 2q4i s PRO 175 N -3.92 3.64 0.46 0.39 0.04 -1.26 -4.96 135.00 129.38 2q4i s PRO 175 Ca 0.11 0.27 -0.25 0.00 0.04 0.00 0.00 61.00 61.18 2q4i s PRO 175 Cb 0.04 -2.41 -0.08 0.00 0.04 0.00 0.00 34.50 32.09 2q4i s PRO 175 CO -0.05 -0.10 1.40 0.00 0.04 0.00 0.00 177.00 178.28 2q4i n ALA 176 N -1.78 1.86 -0.00 8.56 0.00 -0.86 -4.70 120.51 123.58 2q4i n ALA 176 Ca 0.01 0.24 0.09 0.00 0.00 0.00 0.00 53.44 53.77 2q4i n ALA 176 Cb 0.55 -2.37 0.50 0.00 0.00 0.00 0.00 19.45 18.13 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 2.16 0.38 -0.50 0.00 0.11 -1.93 0.49 132.00 132.72 2q4i h PRO 177 Ca -0.50 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.56 2q4i h PRO 177 Cb 1.28 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 2q4i h PRO 177 CO 0.60 0.25 0.19 0.93 -0.21 0.00 0.00 178.00 179.77 2q4i h GLU 178 N 0.39 0.71 0.11 1.05 3.07 -1.90 0.13 114.58 118.16 2q4i h GLU 178 Ca 0.19 -0.10 -0.29 0.00 -0.50 0.00 0.00 59.36 58.65 2q4i h GLU 178 Cb 0.26 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.03 2q4i h GLU 178 CO -0.05 0.59 -1.53 0.00 -1.40 0.00 0.00 179.01 176.62 2q4i h ALA 179 N 1.51 0.23 -0.68 3.43 0.00 -1.26 0.40 119.26 122.88 2q4i h ALA 179 Ca 0.17 -1.16 0.05 0.00 0.00 0.00 0.00 54.91 53.97 2q4i h ALA 179 Cb 0.15 0.54 -0.05 0.00 0.00 0.00 0.00 17.79 18.43 2q4i h ALA 179 CO -0.02 0.92 0.40 -0.22 0.00 0.00 0.00 179.25 180.33 2q4i h LYS 180 N -0.26 0.73 -0.01 0.00 3.64 -0.04 -2.31 116.57 118.33 2q4i h LYS 180 Ca -0.33 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.00 2q4i h LYS 180 Cb 1.80 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 33.45 2q4i h LYS 180 CO 0.05 0.49 -0.01 0.00 -2.27 0.00 0.00 179.45 177.71 2q4i n ALA 181 N -2.33 2.65 -3.05 5.00 0.00 0.46 -4.95 120.51 118.29 2q4i n ALA 181 Ca 0.08 -0.32 -0.15 0.00 0.00 0.00 0.00 53.44 53.05 2q4i n ALA 181 Cb 0.14 -1.34 0.04 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 -0.47 -2.69 -4.80 0.00 4.77 -0.87 -5.03 117.00 107.90 2q4i n LEU 182 Ca 0.21 -0.29 -0.36 0.00 -0.03 0.00 0.00 56.01 55.53 2q4i n LEU 182 Cb 0.24 -2.10 -0.06 0.00 -2.33 0.00 0.00 43.42 39.16 2q4i n LEU 182 CO 0.18 0.33 0.51 -1.61 -1.33 0.00 0.00 177.39 175.47 2q4i s GLU 183 N -5.65 4.37 0.25 3.23 2.02 0.14 -4.96 118.70 118.10 2q4i s GLU 183 Ca 0.31 1.03 -0.06 0.00 0.02 0.00 0.00 54.97 56.28 2q4i s GLU 183 Cb -0.14 -2.83 0.47 0.00 0.10 0.00 0.00 34.13 31.74 2q4i s GLU 183 CO 0.39 0.34 1.62 -1.35 0.02 0.00 0.00 175.26 176.28 2q4i h PRO 184 N 3.28 0.08 -0.09 0.39 0.11 -1.91 0.20 132.00 134.06 2q4i h PRO 184 Ca -0.47 -0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.66 2q4i h PRO 184 Cb 1.19 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 2q4i h PRO 184 CO 0.65 0.05 0.08 0.66 -0.21 0.00 0.00 178.00 179.23 2q4i h SER 185 N 0.08 0.00 -0.48 -2.05 4.64 -1.94 -1.37 113.55 112.44 2q4i h SER 185 Ca 0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.76 2q4i h SER 185 Cb 0.78 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 2q4i h SER 185 CO -0.72 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 175.85 2q4i n GLY 186 N -1.45 1.73 3.06 -0.77 0.00 0.69 -4.81 105.19 103.65 2q4i n GLY 186 Ca -0.01 -0.58 -0.08 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.59 0.18 0.39 1.61 -7.23 -0.52 -0.09 120.40 113.16 2q4i s VAL 187 Ca 0.35 -1.46 -0.05 0.00 -1.81 0.00 0.00 61.98 59.01 2q4i s VAL 187 Cb 0.21 -1.07 -0.05 0.00 0.56 0.00 0.00 36.38 36.04 2q4i s VAL 187 CO 0.19 -0.81 0.68 0.27 -0.31 0.00 0.00 175.10 175.13 2q4i s ILE 188 N -3.04 4.95 0.44 -0.62 -4.36 -1.19 -4.92 121.20 112.46 2q4i s ILE 188 Ca -0.01 0.13 -0.25 0.00 -0.26 0.00 0.00 60.65 60.26 2q4i s ILE 188 Cb 0.02 -3.80 -0.09 0.00 1.25 0.00 0.00 42.46 39.83 2q4i s ILE 188 CO -0.07 -0.60 1.28 -1.20 0.24 0.00 0.00 174.94 174.59 2q4i n SER 189 N -1.65 2.57 -4.30 4.36 7.64 -1.26 -1.91 113.62 119.06 2q4i n SER 189 Ca -0.01 1.09 -0.38 0.00 1.01 0.00 0.00 58.87 60.59 2q4i n SER 189 Cb 0.55 -1.51 -0.04 0.00 -1.01 0.00 0.00 64.21 62.19 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 0.05 -2.68 -4.61 6.43 3.02 -1.26 -2.08 115.26 114.13 2q4i n ASN 190 Ca 0.07 -1.08 -0.43 0.00 -0.03 0.00 0.00 54.58 53.10 2q4i n ASN 190 Cb 0.40 -2.43 -0.01 0.00 -0.61 0.00 0.00 39.78 37.14 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 -4.31 1.41 -2.35 3.10 0.18 -0.80 -3.94 117.16 110.45 2q4i n TYR 191 Ca 0.06 0.64 -0.41 0.00 1.88 0.00 0.00 57.90 60.07 2q4i n TYR 191 Cb 0.49 -2.27 -0.03 0.00 -0.38 0.00 0.00 39.34 37.15 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 -1.13 3.39 0.00 -3.48 2.01 -1.23 -4.82 115.64 110.39 2q4i s THR 192 Ca 0.59 1.25 0.00 0.00 0.31 0.00 0.00 61.69 63.84 2q4i s THR 192 Cb -0.64 -3.80 0.00 0.00 0.01 0.00 0.00 72.50 68.08 2q4i s THR 192 CO 0.60 0.24 0.00 -3.20 -0.69 0.00 0.00 174.62 171.56