#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q4g s SER 3 N 0.00 5.65 0.38 4.31 1.04 -1.26 -4.86 113.70 118.96 2q4g s SER 3 Ca 0.00 1.13 0.27 0.00 0.48 0.00 0.00 55.95 57.83 2q4g s SER 3 Cb 0.00 -2.01 1.32 0.00 0.10 0.00 0.00 66.02 65.43 2q4g s SER 3 CO 0.00 -1.19 1.83 0.03 0.98 0.00 0.00 173.24 174.89 2q4g h ARG 4 N -0.50 0.00 0.09 4.02 2.47 -1.96 0.61 114.38 119.11 2q4g h ARG 4 Ca -0.45 0.00 -0.27 0.00 -1.26 0.00 0.00 59.98 58.00 2q4g h ARG 4 Cb 1.24 0.00 0.02 0.00 -1.65 0.00 0.00 29.97 29.58 2q4g h ARG 4 CO 0.63 0.00 -1.17 0.00 0.56 0.00 0.00 179.97 179.99 2q4g h ALA 5 N 2.09 0.12 -0.05 0.04 0.00 -1.87 -1.97 119.26 117.61 2q4g h ALA 5 Ca 0.00 -0.79 -0.23 0.00 0.00 0.00 0.00 54.91 53.90 2q4g h ALA 5 Cb 0.20 0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.05 2q4g h ALA 5 CO 0.00 0.80 -0.88 0.87 0.00 0.00 0.00 179.25 180.04 2q4g h LYS 6 N 0.21 0.57 -0.28 0.00 1.79 -1.50 -2.85 116.57 114.51 2q4g h LYS 6 Ca -0.15 -0.54 -0.00 0.00 -2.18 0.00 0.00 60.65 57.78 2q4g h LYS 6 Cb 1.84 0.14 -0.01 0.00 -1.58 0.00 0.00 32.23 32.61 2q4g h LYS 6 CO 0.21 1.16 0.16 -0.22 -1.08 0.00 0.00 179.45 179.68 2q4g h LYS 7 N 0.35 0.38 -0.20 3.15 3.64 -0.96 0.04 116.57 122.98 2q4g h LYS 7 Ca -0.07 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.22 2q4g h LYS 7 Cb 1.50 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 33.24 2q4g h LYS 7 CO 0.16 0.28 -0.12 0.35 -2.27 0.00 0.00 179.45 177.86 2q4g h PHE 8 N 0.39 0.49 -0.45 1.91 3.57 -1.21 -1.10 116.94 120.54 2q4g h PHE 8 Ca 0.10 -0.13 -0.06 0.00 3.53 0.00 0.00 57.97 61.42 2q4g h PHE 8 Cb 0.01 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.62 2q4g h PHE 8 CO 0.00 0.73 0.05 1.96 -2.23 0.00 0.00 178.31 178.82 2q4g h GLN 9 N 0.11 0.70 -0.22 1.11 4.20 -1.16 0.49 115.11 120.34 2q4g h GLN 9 Ca 0.04 -0.16 -0.04 0.00 0.06 0.00 0.00 58.65 58.55 2q4g h GLN 9 Cb 0.62 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.29 2q4g h GLN 9 CO 0.03 0.68 -0.02 -0.09 -0.67 0.00 0.00 178.83 178.76 2q4g h ARG 10 N 0.67 0.41 0.00 1.46 2.43 -0.85 -2.02 114.38 116.47 2q4g h ARG 10 Ca 0.14 -0.14 -0.05 0.00 -0.81 0.00 0.00 59.98 59.12 2q4g h ARG 10 Cb 0.35 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.86 2q4g h ARG 10 CO 0.01 0.62 -0.94 1.96 -1.51 0.00 0.00 179.97 180.11 2q4g h GLN 11 N 0.16 0.00 0.00 0.20 4.20 -1.10 -3.41 115.11 115.16 2q4g h GLN 11 Ca 0.06 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.77 2q4g h GLN 11 Cb 0.45 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.23 2q4g h GLN 11 CO 0.02 0.12 0.00 0.72 -0.67 0.00 0.00 178.83 179.01 2q4g n HIS 12 N -2.83 0.00 -4.12 2.96 8.25 0.15 -4.62 115.22 115.01 2q4g n HIS 12 Ca -0.02 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.10 2q4g n HIS 12 Cb 0.64 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.65 2q4g n HIS 12 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 2q4g s MET 13 N -0.56 3.86 -0.43 -0.41 -1.94 -0.76 0.82 119.30 119.88 2q4g s MET 13 Ca 0.00 -0.39 0.08 0.00 -1.71 0.00 0.00 55.69 53.67 2q4g s MET 13 Cb 0.00 -3.12 0.31 0.00 2.01 0.00 0.00 34.83 34.03 2q4g s MET 13 CO 0.00 0.29 0.89 -3.47 -0.01 0.00 0.00 175.02 172.72 2q4g n ASP 14 N 3.45 -1.17 0.29 3.03 2.03 -0.92 -4.82 116.55 118.44 2q4g n ASP 14 Ca -0.17 -3.31 0.14 0.00 0.52 0.00 0.00 54.79 51.98 2q4g n ASP 14 Cb 0.52 0.83 0.86 0.00 -0.72 0.00 0.00 41.12 42.61 2q4g n ASP 14 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 2q4g h SER 15 N 3.29 0.00 1.34 1.67 0.02 -1.75 -3.12 113.55 115.00 2q4g h SER 15 Ca -0.03 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 2q4g h SER 15 Cb 1.02 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.56 2q4g h SER 15 CO 0.32 0.03 -0.58 0.44 -1.14 0.00 0.00 176.83 175.90 2q4g h ASP 16 N 0.00 0.00 -4.10 3.07 3.32 -1.91 -3.41 116.42 113.38 2q4g h ASP 16 Ca -0.00 -0.02 -0.45 0.00 0.02 0.00 0.00 57.03 56.58 2q4g h ASP 16 Cb 0.09 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 2q4g h ASP 16 CO 0.00 0.01 0.35 -0.44 -1.72 0.00 0.00 179.24 177.45 2q4g s SER 17 N -5.49 6.84 0.62 6.45 0.01 -1.18 -5.04 113.70 115.91 2q4g s SER 17 Ca 0.03 1.65 -0.18 0.00 1.31 0.00 0.00 55.95 58.77 2q4g s SER 17 Cb 0.09 -2.53 -0.02 0.00 0.21 0.00 0.00 66.02 63.76 2q4g s SER 17 CO 0.73 -0.43 1.17 -0.55 0.41 0.00 0.00 173.24 174.58 2q4g s SER 18 N -2.45 5.14 0.39 2.44 0.15 -1.26 -4.91 113.70 113.20 2q4g s SER 18 Ca 0.61 2.26 0.08 0.00 0.70 0.00 0.00 55.95 59.60 2q4g s SER 18 Cb -0.09 -2.58 0.81 0.00 -1.71 0.00 0.00 66.02 62.44 2q4g s SER 18 CO 0.19 -1.62 1.97 -0.65 1.20 0.00 0.00 173.24 174.33 2q4g h PRO 19 N 0.61 0.37 -4.55 5.44 0.11 -1.94 -3.35 132.00 128.70 2q4g h PRO 19 Ca -0.49 -0.06 -0.71 0.00 0.11 0.00 0.00 66.00 64.85 2q4g h PRO 19 Cb 1.28 -0.07 -0.07 0.00 0.11 0.00 0.00 31.00 32.25 2q4g h PRO 19 CO 0.54 0.38 2.61 0.43 -0.21 0.00 0.00 178.00 181.76 2q4g n SER 20 N -4.36 4.42 -4.75 -2.05 7.64 -1.26 -4.68 113.62 108.58 2q4g n SER 20 Ca 0.01 -2.91 -0.41 0.00 1.01 0.00 0.00 58.87 56.57 2q4g n SER 20 Cb 0.18 -1.66 -0.02 0.00 -1.01 0.00 0.00 64.21 61.70 2q4g n SER 20 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2q4g s SER 21 N 3.20 6.62 0.69 6.43 0.01 -1.26 -5.00 113.70 124.40 2q4g s SER 21 Ca 0.48 2.71 -0.11 0.00 1.31 0.00 0.00 55.95 60.34 2q4g s SER 21 Cb 0.09 -2.63 0.01 0.00 0.21 0.00 0.00 66.02 63.70 2q4g s SER 21 CO -0.02 -0.71 1.08 -0.94 0.41 0.00 0.00 173.24 173.06 2q4g s SER 22 N 0.28 5.53 0.15 2.44 1.04 -1.26 -4.73 113.70 117.15 2q4g s SER 22 Ca 0.58 1.22 0.09 0.00 0.48 0.00 0.00 55.95 58.33 2q4g s SER 22 Cb -0.42 -2.07 0.49 0.00 0.10 0.00 0.00 66.02 64.12 2q4g s SER 22 CO 0.45 -1.30 1.23 -1.54 0.98 0.00 0.00 173.24 173.07 2q4g n SER 23 N -2.99 0.23 -0.68 7.02 3.41 -1.26 -1.04 113.62 118.31 2q4g n SER 23 Ca 0.07 0.56 0.07 0.00 -0.26 0.00 0.00 58.87 59.31 2q4g n SER 23 Cb 0.56 -0.58 0.14 0.00 -0.26 0.00 0.00 64.21 64.07 2q4g n SER 23 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2q4g n THR 24 N -1.80 0.66 0.36 6.66 -2.24 -1.26 -4.30 114.28 112.36 2q4g n THR 24 Ca -0.01 -0.83 -0.18 0.00 -2.27 0.00 0.00 64.05 60.77 2q4g n THR 24 Cb 0.09 0.76 -0.09 0.00 -2.10 0.00 0.00 70.33 68.99 2q4g n THR 24 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 2q4g h TYR 25 N 2.45 -0.86 -1.00 4.78 3.20 -1.45 -2.80 116.97 121.29 2q4g h TYR 25 Ca 0.00 -0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.90 2q4g h TYR 25 Cb 0.70 0.29 -0.06 0.00 1.54 0.00 0.00 36.73 39.19 2q4g h TYR 25 CO 0.18 -0.53 0.65 0.00 -1.64 0.00 0.00 178.16 176.83 2q4g h ASN 27 N 1.24 0.95 0.51 0.00 2.35 -1.80 -0.18 115.58 118.64 2q4g h ASN 27 Ca 0.41 -0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 56.12 2q4g h ASN 27 Cb 0.05 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.20 2q4g h ASN 27 CO -0.14 0.66 -0.24 -0.61 -1.65 0.00 0.00 177.43 175.45 2q4g h GLN 28 N 1.10 -0.65 -0.40 0.81 4.15 -0.98 -3.27 115.11 115.87 2q4g h GLN 28 Ca 0.33 0.04 -0.11 0.00 0.77 0.00 0.00 58.65 59.69 2q4g h GLN 28 Cb -0.02 0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.80 2q4g h GLN 28 CO -0.09 -0.36 -0.21 0.52 -1.93 0.00 0.00 178.83 176.76 2q4g h MET 29 N -1.07 0.78 -0.25 1.69 2.86 -0.94 -1.95 114.93 116.04 2q4g h MET 29 Ca -0.07 -0.31 -0.00 0.00 -2.06 0.00 0.00 59.70 57.26 2q4g h MET 29 Cb 0.59 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.20 2q4g h MET 29 CO 0.11 0.92 0.15 0.52 1.06 0.00 0.00 176.91 179.67 2q4g h MET 30 N 0.69 0.34 0.01 1.72 2.86 -1.17 0.11 114.93 119.48 2q4g h MET 30 Ca 0.10 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.67 2q4g h MET 30 Cb 0.72 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.31 2q4g h MET 30 CO 0.06 0.24 -0.18 0.00 1.06 0.00 0.00 176.91 178.09 2q4g h ARG 31 N 0.35 0.11 -0.71 1.72 3.08 -1.56 -2.21 114.38 115.15 2q4g h ARG 31 Ca 0.09 -0.12 0.03 0.00 0.07 0.00 0.00 59.98 60.05 2q4g h ARG 31 Cb -0.00 0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.05 2q4g h ARG 31 CO -0.02 0.90 0.47 0.00 -1.07 0.00 0.00 179.97 180.26 2q4g h ARG 32 N -0.63 0.84 -0.80 0.04 3.08 -0.98 -2.51 114.38 113.41 2q4g h ARG 32 Ca -0.02 -0.05 -0.09 0.00 0.07 0.00 0.00 59.98 59.88 2q4g h ARG 32 Cb 0.97 -0.19 -0.06 0.00 0.08 0.00 0.00 29.97 30.77 2q4g h ARG 32 CO 0.03 0.56 0.12 0.54 -1.07 0.00 0.00 179.97 180.15 2q4g n ARG 33 N -4.45 3.09 -3.83 0.04 5.12 0.35 -4.94 116.66 112.04 2q4g n ARG 33 Ca 0.09 -2.04 -0.24 0.00 -1.93 0.00 0.00 57.85 53.73 2q4g n ARG 33 Cb 0.12 -1.94 0.01 0.00 -1.16 0.00 0.00 32.46 29.49 2q4g n ARG 33 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 2q4g n ASN 34 N 0.14 -0.93 -0.42 0.55 3.02 -0.95 -4.76 115.26 111.91 2q4g n ASN 34 Ca 0.24 -0.90 0.04 0.00 -0.03 0.00 0.00 54.58 53.92 2q4g n ASN 34 Cb 0.98 -3.60 0.10 0.00 -0.61 0.00 0.00 39.78 36.66 2q4g n ASN 34 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 2q4g n MET 35 N -4.34 2.81 -0.41 3.52 2.81 -0.83 -4.50 117.12 116.17 2q4g n MET 35 Ca -0.29 -1.83 0.07 0.00 -1.81 0.00 0.00 57.70 53.84 2q4g n MET 35 Cb 0.67 -1.18 0.14 0.00 -0.71 0.00 0.00 33.22 32.15 2q4g n MET 35 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 2q4g n THR 36 N 0.18 1.66 -3.29 2.03 -2.24 -1.24 -1.30 114.28 110.07 2q4g n THR 36 Ca 0.08 -2.28 -0.39 0.00 -2.27 0.00 0.00 64.05 59.19 2q4g n THR 36 Cb 0.36 -0.06 -0.07 0.00 -2.10 0.00 0.00 70.33 68.45 2q4g n THR 36 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2q4g s GLN 37 N -2.48 4.15 0.00 -0.78 -0.21 -1.26 -4.43 119.66 114.65 2q4g s GLN 37 Ca 0.31 0.31 0.00 0.00 0.02 0.00 0.00 55.36 56.00 2q4g s GLN 37 Cb 0.29 -3.58 0.00 0.00 1.00 0.00 0.00 33.01 30.72 2q4g s GLN 37 CO -0.02 -0.17 0.00 0.41 -2.12 0.00 0.00 175.29 173.39 2q4g n GLY 38 N 4.05 1.94 3.02 3.09 0.00 -1.26 -4.81 105.19 111.21 2q4g n GLY 38 Ca -0.06 -0.18 -0.12 0.00 0.00 0.00 0.00 46.02 45.66 2q4g n GLY 38 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2q4g s ARG 39 N 0.00 0.42 -0.29 1.61 1.81 -1.26 -5.00 118.95 116.24 2q4g s ARG 39 Ca 0.00 -0.62 -0.29 0.00 -1.72 0.00 0.00 55.73 53.10 2q4g s ARG 39 Cb 0.00 -0.15 0.00 0.00 -0.45 0.00 0.00 34.95 34.35 2q4g s ARG 39 CO 0.00 0.02 1.25 0.00 -0.68 0.00 0.00 175.30 175.89 2q4g s LYS 41 N 3.99 3.81 0.61 0.00 2.20 -0.42 -4.86 119.74 125.08 2q4g s LYS 41 Ca 0.54 2.16 0.38 0.00 -0.36 0.00 0.00 55.97 58.68 2q4g s LYS 41 Cb -0.16 -4.15 2.01 0.00 -1.51 0.00 0.00 37.83 34.01 2q4g s LYS 41 CO 0.21 -1.31 2.24 -1.00 -0.36 0.00 0.00 175.35 175.13 2q4g h PRO 42 N 11.56 0.00 -2.84 4.03 0.13 -1.93 -3.43 132.00 139.52 2q4g h PRO 42 Ca -0.42 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.60 2q4g h PRO 42 Cb 1.21 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.13 2q4g h PRO 42 CO 0.96 0.02 -0.20 0.54 -0.23 0.00 0.00 178.00 179.09 2q4g s VAL 43 N -4.15 0.04 -0.21 1.56 0.11 -1.26 -1.84 120.40 114.65 2q4g s VAL 43 Ca -0.04 -0.34 -0.29 0.00 -2.93 0.00 0.00 61.98 58.38 2q4g s VAL 43 Cb 0.13 -0.67 0.15 0.00 -1.53 0.00 0.00 36.38 34.46 2q4g s VAL 43 CO 0.48 -0.19 1.11 0.21 -3.33 0.00 0.00 175.10 173.39 2q4g s ASN 44 N -1.11 -0.29 -0.06 3.54 2.47 0.22 -4.99 114.94 114.72 2q4g s ASN 44 Ca -0.11 0.37 0.03 0.00 0.42 0.00 0.00 52.86 53.56 2q4g s ASN 44 Cb -0.04 0.31 0.01 0.00 -1.45 0.00 0.00 41.25 40.08 2q4g s ASN 44 CO 0.05 -0.22 -0.15 -0.89 -3.72 0.00 0.00 177.10 172.17 2q4g s THR 45 N -0.81 1.30 -0.10 -5.21 2.01 -1.26 0.03 115.64 111.59 2q4g s THR 45 Ca 0.02 -0.59 -0.03 0.00 0.31 0.00 0.00 61.69 61.39 2q4g s THR 45 Cb -0.02 -1.16 -0.04 0.00 0.01 0.00 0.00 72.50 71.30 2q4g s THR 45 CO -0.03 0.39 0.04 -0.36 -0.69 0.00 0.00 174.62 173.97 2q4g s PHE 46 N 0.46 3.27 -0.19 4.92 0.08 -0.68 -4.33 117.98 121.51 2q4g s PHE 46 Ca -0.12 0.27 -0.06 0.00 0.12 0.00 0.00 56.93 57.14 2q4g s PHE 46 Cb -0.15 -1.84 -0.03 0.00 -0.57 0.00 0.00 43.02 40.43 2q4g s PHE 46 CO 0.04 0.52 0.02 0.08 -0.10 0.00 0.00 175.22 175.78 2q4g s VAL 47 N -0.86 4.23 -1.05 -0.44 1.01 0.24 -1.31 120.40 122.22 2q4g s VAL 47 Ca 0.13 -0.22 -0.03 0.00 0.00 0.00 0.00 61.98 61.86 2q4g s VAL 47 Cb -0.12 -2.91 0.31 0.00 0.00 0.00 0.00 36.38 33.66 2q4g s VAL 47 CO 0.03 0.44 1.45 1.41 0.00 0.00 0.00 175.10 178.42 2q4g n HIS 48 N 3.98 2.34 -3.80 5.22 -0.00 0.05 -2.16 115.22 120.84 2q4g n HIS 48 Ca -0.17 -2.68 -0.09 0.00 -0.00 0.00 0.00 57.72 54.78 2q4g n HIS 48 Cb 0.52 -1.20 -0.07 0.00 -0.00 0.00 0.00 29.99 29.25 2q4g n HIS 48 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 2q4g s GLU 49 N -2.85 0.89 0.45 -0.41 0.41 -1.26 -4.53 118.70 111.41 2q4g s GLU 49 Ca 0.32 -0.89 -0.25 0.00 -0.41 0.00 0.00 54.97 53.74 2q4g s GLU 49 Cb 0.06 0.37 -0.08 0.00 -1.78 0.00 0.00 34.13 32.70 2q4g s GLU 49 CO 0.09 -0.30 1.39 -2.30 -0.49 0.00 0.00 175.26 173.65 2q4g n PRO 50 N -0.08 2.13 -0.31 0.39 -0.02 -1.26 -4.33 135.00 131.52 2q4g n PRO 50 Ca -0.15 0.76 0.05 0.00 -2.02 0.00 0.00 63.50 62.14 2q4g n PRO 50 Cb 0.63 -2.57 0.20 0.00 -0.02 0.00 0.00 33.50 31.74 2q4g n PRO 50 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2q4g h LEU 51 N 2.17 0.68 -1.69 2.45 5.85 -1.97 -0.43 115.31 122.37 2q4g h LEU 51 Ca -0.50 0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.25 2q4g h LEU 51 Cb 1.28 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.24 2q4g h LEU 51 CO 0.60 0.36 -0.15 1.62 -0.34 0.00 0.00 178.44 180.52 2q4g h VAL 52 N 0.78 0.58 -0.22 1.05 3.04 -1.98 0.94 116.25 120.43 2q4g h VAL 52 Ca 0.44 -0.71 -0.18 0.00 -1.01 0.00 0.00 66.70 65.24 2q4g h VAL 52 Cb 0.48 1.46 -0.00 0.00 -2.01 0.00 0.00 31.29 31.22 2q4g h VAL 52 CO -0.29 0.15 -0.58 0.44 -1.01 0.00 0.00 177.57 176.29 2q4g h ASP 53 N 0.00 0.79 0.66 3.17 5.19 -1.44 -0.80 116.42 123.99 2q4g h ASP 53 Ca -0.00 -0.44 -0.20 0.00 -0.62 0.00 0.00 57.03 55.78 2q4g h ASP 53 Cb 0.45 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 39.72 2q4g h ASP 53 CO 0.02 1.19 -0.89 0.58 -3.12 0.00 0.00 179.24 177.02 2q4g h VAL 54 N 0.53 1.53 -0.05 -1.35 2.07 -1.01 -3.19 116.25 114.77 2q4g h VAL 54 Ca 0.00 -2.73 -0.11 0.00 0.82 0.00 0.00 66.70 64.68 2q4g h VAL 54 Cb 1.16 2.52 -0.01 0.00 -1.52 0.00 0.00 31.29 33.44 2q4g h VAL 54 CO 0.12 0.79 -0.48 1.56 0.02 0.00 0.00 177.57 179.58 2q4g h GLN 55 N 0.08 0.14 0.00 1.57 4.20 -0.67 -2.91 115.11 117.52 2q4g h GLN 55 Ca -0.04 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.56 2q4g h GLN 55 Cb 1.53 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.31 2q4g h GLN 55 CO 0.13 0.59 -0.16 -0.91 -0.67 0.00 0.00 178.83 177.82 2q4g h ASN 56 N 0.11 0.00 -0.22 1.46 2.35 -1.13 -2.51 115.58 115.63 2q4g h ASN 56 Ca 0.00 0.00 0.06 0.00 -0.55 0.00 0.00 56.30 55.82 2q4g h ASN 56 Cb 0.90 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.26 2q4g h ASN 56 CO 0.07 0.16 0.22 0.58 -1.65 0.00 0.00 177.43 176.81 2q4g h VAL 57 N 0.00 0.52 0.00 2.81 2.07 -1.55 0.41 116.25 120.51 2q4g h VAL 57 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2q4g h VAL 57 Cb 0.57 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 2q4g h VAL 57 CO 0.02 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.61 2q4g n PHE 59 N -1.77 0.15 -1.35 0.00 3.72 0.14 -5.02 117.46 113.34 2q4g n PHE 59 Ca 0.00 -1.06 0.00 0.00 -0.05 0.00 0.00 57.45 56.34 2q4g n PHE 59 Cb 0.06 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 38.41 2q4g n PHE 59 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 2q4g n GLN 60 N -1.27 3.90 -1.75 -1.08 6.02 -0.06 -5.03 117.38 118.10 2q4g n GLN 60 Ca 0.18 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.74 2q4g n GLN 60 Cb 0.69 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 31.92 2q4g n GLN 60 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 2q4g s GLU 61 N 3.20 3.73 0.13 -1.09 2.12 -1.23 -4.85 118.70 120.71 2q4g s GLU 61 Ca 0.00 2.21 -0.30 0.00 0.36 0.00 0.00 54.97 57.24 2q4g s GLU 61 Cb 0.00 -4.20 -0.07 0.00 0.26 0.00 0.00 34.13 30.12 2q4g s GLU 61 CO 0.00 -1.41 1.11 0.21 -0.54 0.00 0.00 175.26 174.62 2q4g s LYS 62 N 5.14 4.55 0.22 4.30 2.20 -1.26 -0.52 119.74 134.38 2q4g s LYS 62 Ca 0.89 1.69 0.00 0.00 -0.36 0.00 0.00 55.97 58.19 2q4g s LYS 62 Cb -0.35 -3.32 -0.04 0.00 -1.51 0.00 0.00 37.83 32.61 2q4g s LYS 62 CO 0.36 -0.01 0.15 0.14 -0.36 0.00 0.00 175.35 175.63 2q4g s VAL 63 N 0.22 0.05 0.02 4.02 -7.23 0.18 -4.91 120.40 112.75 2q4g s VAL 63 Ca 0.52 -2.00 -0.24 0.00 -1.81 0.00 0.00 61.98 58.45 2q4g s VAL 63 Cb -0.28 -2.51 -0.05 0.00 0.56 0.00 0.00 36.38 34.10 2q4g s VAL 63 CO 0.33 0.00 0.73 -0.89 -0.31 0.00 0.00 175.10 174.96 2q4g s THR 64 N -4.03 4.80 0.55 5.32 2.01 -1.26 -2.87 115.64 120.15 2q4g s THR 64 Ca 0.39 1.55 -0.17 0.00 0.31 0.00 0.00 61.69 63.77 2q4g s THR 64 Cb 0.06 -4.08 -0.06 0.00 0.01 0.00 0.00 72.50 68.44 2q4g s THR 64 CO 0.14 0.36 1.05 0.00 -0.69 0.00 0.00 174.62 175.48 2q4g h LYS 66 N 0.87 0.00 -0.65 0.00 3.64 -1.91 0.18 116.57 118.69 2q4g h LYS 66 Ca -0.48 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 2q4g h LYS 66 Cb 1.22 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 2q4g h LYS 66 CO 0.58 0.00 0.00 0.27 -2.27 0.00 0.00 179.45 178.03 2q4g n ASN 67 N -3.82 3.08 0.00 4.20 6.94 -1.26 -4.91 115.26 119.49 2q4g n ASN 67 Ca 0.10 -2.33 0.00 0.00 -0.02 0.00 0.00 54.58 52.33 2q4g n ASN 67 Cb 0.73 -0.49 0.00 0.00 -2.36 0.00 0.00 39.78 37.66 2q4g n ASN 67 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2q4g n GLY 68 N 0.60 3.06 3.77 4.83 0.00 0.62 -5.02 105.19 113.05 2q4g n GLY 68 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 2q4g n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2q4g s GLN 69 N -0.22 3.70 0.03 1.61 -1.52 -1.26 -4.71 119.66 117.29 2q4g s GLN 69 Ca 0.00 1.79 0.25 0.00 -1.95 0.00 0.00 55.36 55.45 2q4g s GLN 69 Cb 0.00 -2.38 0.50 0.00 -0.22 0.00 0.00 33.01 30.91 2q4g s GLN 69 CO 0.00 -0.60 1.41 0.41 -0.25 0.00 0.00 175.29 176.26 2q4g n GLY 70 N 0.45 -1.30 1.83 3.09 0.00 -1.26 0.26 105.19 108.25 2q4g n GLY 70 Ca 0.08 -0.31 -0.05 0.00 0.00 0.00 0.00 46.02 45.74 2q4g n GLY 70 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2q4g n ASN 71 N -1.66 4.35 -4.65 1.61 6.94 -1.26 -4.22 115.26 116.37 2q4g n ASN 71 Ca 0.05 -2.23 -0.23 0.00 -0.02 0.00 0.00 54.58 52.15 2q4g n ASN 71 Cb 0.36 -1.04 -0.07 0.00 -2.36 0.00 0.00 39.78 36.67 2q4g n ASN 71 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2q4g s TYR 73 N -2.37 -0.04 -0.13 0.00 2.02 0.93 -0.65 117.35 117.12 2q4g s TYR 73 Ca 0.33 0.10 -0.05 0.00 -0.37 0.00 0.00 57.07 57.07 2q4g s TYR 73 Cb -0.05 -0.00 -0.04 0.00 -0.40 0.00 0.00 41.96 41.47 2q4g s TYR 73 CO 0.20 -0.08 0.05 0.21 -1.57 0.00 0.00 175.55 174.36 2q4g s LYS 74 N -0.27 3.43 0.62 -0.62 2.20 0.33 -1.41 119.74 124.01 2q4g s LYS 74 Ca -0.03 -0.33 -0.17 0.00 -0.36 0.00 0.00 55.97 55.08 2q4g s LYS 74 Cb -0.02 -3.02 -0.02 0.00 -1.51 0.00 0.00 37.83 33.26 2q4g s LYS 74 CO 0.00 0.57 1.12 -1.54 -0.36 0.00 0.00 175.35 175.14 2q4g s SER 75 N -0.47 5.29 0.19 1.43 1.04 -0.25 -3.47 113.70 117.46 2q4g s SER 75 Ca 0.10 2.08 -0.04 0.00 0.48 0.00 0.00 55.95 58.57 2q4g s SER 75 Cb -0.12 -2.56 0.12 0.00 0.10 0.00 0.00 66.02 63.55 2q4g s SER 75 CO 0.02 -1.51 1.53 0.78 0.98 0.00 0.00 173.24 175.03 2q4g h ASN 76 N 0.44 0.68 -2.85 7.02 2.35 -1.96 -3.44 115.58 117.81 2q4g h ASN 76 Ca -0.48 -0.34 -0.62 0.00 -0.55 0.00 0.00 56.30 54.31 2q4g h ASN 76 Cb 1.25 -0.19 -0.15 0.00 0.05 0.00 0.00 38.32 39.28 2q4g h ASN 76 CO 0.55 1.05 -0.75 -0.55 -1.65 0.00 0.00 177.43 176.08 2q4g s SER 77 N -6.89 3.97 -0.36 5.81 0.15 -1.26 -5.07 113.70 110.05 2q4g s SER 77 Ca -0.08 -0.73 -0.29 0.00 0.70 0.00 0.00 55.95 55.55 2q4g s SER 77 Cb 0.12 -0.55 0.01 0.00 -1.71 0.00 0.00 66.02 63.89 2q4g s SER 77 CO 0.84 0.09 1.23 -0.94 1.20 0.00 0.00 173.24 175.66 2q4g s SER 78 N -2.98 6.68 0.53 5.45 1.04 -1.26 -4.45 113.70 118.72 2q4g s SER 78 Ca 0.25 0.96 -0.09 0.00 0.48 0.00 0.00 55.95 57.55 2q4g s SER 78 Cb -0.08 -2.54 -0.04 0.00 0.10 0.00 0.00 66.02 63.46 2q4g s SER 78 CO 0.14 -1.12 0.90 -0.04 0.98 0.00 0.00 173.24 174.10 2q4g s MET 79 N 4.21 3.63 -0.60 4.02 -1.94 0.27 -4.47 119.30 124.42 2q4g s MET 79 Ca 0.53 0.51 -0.27 0.00 -1.71 0.00 0.00 55.69 54.75 2q4g s MET 79 Cb -0.13 -2.24 0.03 0.00 2.01 0.00 0.00 34.83 34.50 2q4g s MET 79 CO 0.24 -0.34 1.14 -1.01 -0.01 0.00 0.00 175.02 175.05 2q4g s HIS 80 N -2.86 2.60 0.45 -0.03 3.76 -1.26 -0.65 115.29 117.30 2q4g s HIS 80 Ca 0.52 0.21 0.05 0.00 -0.15 0.00 0.00 55.06 55.69 2q4g s HIS 80 Cb -0.11 -4.42 -0.05 0.00 1.11 0.00 0.00 32.58 29.11 2q4g s HIS 80 CO 0.46 -1.61 0.02 0.96 -0.85 0.00 0.00 174.74 173.72 2q4g s ILE 81 N 4.81 1.71 -0.06 0.60 -4.36 0.98 -0.77 121.20 124.11 2q4g s ILE 81 Ca 0.38 -1.97 -0.01 0.00 -0.26 0.00 0.00 60.65 58.79 2q4g s ILE 81 Cb -0.09 -2.69 0.03 0.00 1.25 0.00 0.00 42.46 40.96 2q4g s ILE 81 CO 0.22 0.00 -0.00 -0.89 0.24 0.00 0.00 174.94 174.50 2q4g s THR 82 N -2.76 0.37 0.45 8.37 2.01 -0.43 -0.30 115.64 123.34 2q4g s THR 82 Ca 0.25 0.08 -0.15 0.00 0.31 0.00 0.00 61.69 62.19 2q4g s THR 82 Cb 0.06 -0.50 -0.08 0.00 0.01 0.00 0.00 72.50 72.00 2q4g s THR 82 CO 0.13 0.24 0.88 -1.81 -0.69 0.00 0.00 174.62 173.37 2q4g s ASP 83 N 1.68 6.63 -0.06 3.53 1.01 0.21 -1.69 116.67 127.99 2q4g s ASP 83 Ca 0.00 1.40 -0.01 0.00 0.71 0.00 0.00 52.55 54.65 2q4g s ASP 83 Cb -0.13 -2.43 0.03 0.00 1.01 0.00 0.00 42.92 41.40 2q4g s ASP 83 CO -0.04 -0.46 0.02 0.00 0.21 0.00 0.00 175.17 174.90 2q4g s ARG 85 N 1.92 -0.01 0.50 0.00 3.52 -1.21 -0.61 118.95 123.06 2q4g s ARG 85 Ca 0.03 0.37 -0.23 0.00 -0.13 0.00 0.00 55.73 55.77 2q4g s ARG 85 Cb -0.12 -0.32 -0.06 0.00 -1.56 0.00 0.00 34.95 32.88 2q4g s ARG 85 CO -0.04 -0.25 1.39 -1.17 -0.81 0.00 0.00 175.30 174.41 2q4g s LEU 86 N 1.72 3.97 0.83 -0.88 2.96 -0.76 -1.58 118.68 124.94 2q4g s LEU 86 Ca -0.02 2.83 -0.12 0.00 -0.22 0.00 0.00 54.13 56.60 2q4g s LEU 86 Cb -0.12 -4.12 0.09 0.00 0.50 0.00 0.00 46.19 42.54 2q4g s LEU 86 CO -0.04 -1.38 1.11 0.42 -1.32 0.00 0.00 176.35 175.13 2q4g s THR 87 N -1.26 2.77 -2.00 3.68 -4.23 -0.55 -4.87 115.64 109.18 2q4g s THR 87 Ca 0.67 0.25 0.25 0.00 -1.18 0.00 0.00 61.69 61.68 2q4g s THR 87 Cb -0.42 -2.99 0.72 0.00 1.34 0.00 0.00 72.50 71.16 2q4g s THR 87 CO 0.51 -0.33 1.97 0.59 -0.54 0.00 0.00 174.62 176.83 2q4g n ASN 88 N -3.54 0.00 -0.00 3.99 3.02 -1.26 -3.20 115.26 114.27 2q4g n ASN 88 Ca 0.07 -1.19 0.06 0.00 -0.03 0.00 0.00 54.58 53.48 2q4g n ASN 88 Cb 0.57 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.67 2q4g n ASN 88 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2q4g n GLY 89 N 0.89 -0.23 3.77 7.41 0.00 -1.26 -5.03 105.19 110.73 2q4g n GLY 89 Ca 0.19 -0.32 -0.40 0.00 0.00 0.00 0.00 46.02 45.49 2q4g n GLY 89 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2q4g s SER 90 N -2.46 5.95 -0.11 1.61 0.01 -1.20 -5.03 113.70 112.47 2q4g s SER 90 Ca 0.02 2.98 -0.04 0.00 1.31 0.00 0.00 55.95 60.22 2q4g s SER 90 Cb 0.09 -2.66 0.06 0.00 0.21 0.00 0.00 66.02 63.71 2q4g s SER 90 CO 0.49 -1.13 0.20 -0.60 0.41 0.00 0.00 173.24 172.61 2q4g s ARG 91 N -2.38 0.09 0.28 12.44 3.52 -1.21 -5.02 118.95 126.66 2q4g s ARG 91 Ca 0.59 0.57 -0.27 0.00 -0.13 0.00 0.00 55.73 56.50 2q4g s ARG 91 Cb -0.45 -0.33 -0.15 0.00 -1.56 0.00 0.00 34.95 32.47 2q4g s ARG 91 CO 0.59 -0.35 0.76 0.98 -0.81 0.00 0.00 175.30 176.47 2q4g n TYR 92 N 5.33 0.36 1.34 5.12 9.36 -1.26 -1.25 117.16 136.16 2q4g n TYR 92 Ca -0.05 0.79 0.06 0.00 3.32 0.00 0.00 57.90 62.01 2q4g n TYR 92 Cb 0.50 -2.11 0.20 0.00 -0.63 0.00 0.00 39.34 37.30 2q4g n TYR 92 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 2q4g n PRO 93 N 0.81 1.51 -2.97 2.98 -0.04 -1.26 -5.02 135.00 131.01 2q4g n PRO 93 Ca 0.13 -0.79 -0.44 0.00 -0.04 0.00 0.00 63.50 62.36 2q4g n PRO 93 Cb 0.31 -1.23 -0.01 0.00 -0.04 0.00 0.00 33.50 32.53 2q4g n PRO 93 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2q4g s ASN 94 N -1.16 6.96 -0.70 3.54 0.01 -0.38 -4.97 114.94 118.24 2q4g s ASN 94 Ca 0.20 -2.77 -0.23 0.00 -0.71 0.00 0.00 52.86 49.34 2q4g s ASN 94 Cb 0.10 -2.39 0.06 0.00 0.41 0.00 0.00 41.25 39.44 2q4g s ASN 94 CO 0.14 -0.80 1.06 0.00 -1.51 0.00 0.00 177.10 175.99 2q4g s ALA 96 N 4.42 3.77 0.12 0.00 0.00 -1.26 -4.89 121.76 123.91 2q4g s ALA 96 Ca 0.26 -0.60 0.08 0.00 0.00 0.00 0.00 51.96 51.71 2q4g s ALA 96 Cb -0.14 -2.12 -0.04 0.00 0.00 0.00 0.00 23.12 20.82 2q4g s ALA 96 CO 0.10 0.40 -0.21 0.71 0.00 0.00 0.00 175.76 176.76 2q4g s TYR 97 N -0.41 1.82 -0.36 0.00 1.51 -1.26 -1.49 117.35 117.15 2q4g s TYR 97 Ca 0.14 -0.43 -0.13 0.00 -1.01 0.00 0.00 57.07 55.64 2q4g s TYR 97 Cb -0.12 -0.97 0.00 0.00 -0.11 0.00 0.00 41.96 40.75 2q4g s TYR 97 CO 0.03 0.24 0.24 0.50 -1.11 0.00 0.00 175.55 175.46 2q4g s ARG 98 N -2.14 3.23 -0.09 -0.62 3.52 -0.61 -4.62 118.95 117.61 2q4g s ARG 98 Ca 0.09 -0.82 -0.30 0.00 -0.13 0.00 0.00 55.73 54.57 2q4g s ARG 98 Cb -0.09 -3.82 -0.01 0.00 -1.56 0.00 0.00 34.95 29.46 2q4g s ARG 98 CO 0.05 -0.57 1.01 0.99 -0.81 0.00 0.00 175.30 175.97 2q4g s THR 99 N 1.68 4.77 -0.41 4.11 2.01 -1.26 -3.34 115.64 123.20 2q4g s THR 99 Ca 0.05 2.03 0.02 0.00 0.31 0.00 0.00 61.69 64.10 2q4g s THR 99 Cb -0.18 -4.31 0.13 0.00 0.01 0.00 0.00 72.50 68.15 2q4g s THR 99 CO 0.09 0.02 0.20 -0.44 -0.69 0.00 0.00 174.62 173.80 2q4g s SER 100 N 1.10 3.82 0.30 3.53 0.01 -0.37 -4.85 113.70 117.23 2q4g s SER 100 Ca 0.49 -2.39 -0.27 0.00 1.31 0.00 0.00 55.95 55.09 2q4g s SER 100 Cb -0.19 -1.05 -0.10 0.00 0.21 0.00 0.00 66.02 64.90 2q4g s SER 100 CO 0.19 -0.31 0.93 -2.16 0.41 0.00 0.00 173.24 172.31 2q4g s PRO 101 N 0.65 4.64 0.17 12.44 0.04 -1.26 0.65 135.00 152.32 2q4g s PRO 101 Ca 0.15 1.35 -0.23 0.00 0.04 0.00 0.00 61.00 62.31 2q4g s PRO 101 Cb -0.23 -2.93 0.07 0.00 0.04 0.00 0.00 34.50 31.46 2q4g s PRO 101 CO -0.06 0.35 1.02 -1.59 0.04 0.00 0.00 177.00 176.76 2q4g s LYS 102 N -1.82 1.24 -0.23 4.56 -2.85 0.59 -4.94 119.74 116.29 2q4g s LYS 102 Ca 0.47 -0.75 -0.01 0.00 -1.00 0.00 0.00 55.97 54.68 2q4g s LYS 102 Cb -0.20 0.37 0.02 0.00 -2.06 0.00 0.00 37.83 35.96 2q4g s LYS 102 CO 0.26 -0.57 -0.10 -1.21 0.10 0.00 0.00 175.35 173.82 2q4g s GLU 103 N -2.59 2.87 0.10 1.78 2.02 -1.26 -0.01 118.70 121.60 2q4g s GLU 103 Ca 0.18 -0.94 -0.11 0.00 0.02 0.00 0.00 54.97 54.12 2q4g s GLU 103 Cb -0.02 -2.87 0.01 0.00 0.10 0.00 0.00 34.13 31.35 2q4g s GLU 103 CO 0.04 -0.35 0.26 1.03 0.02 0.00 0.00 175.26 176.26 2q4g s ARG 104 N 1.31 0.90 0.57 1.61 1.81 0.18 -4.86 118.95 120.47 2q4g s ARG 104 Ca 0.01 -0.86 -0.15 0.00 -1.72 0.00 0.00 55.73 53.01 2q4g s ARG 104 Cb -0.16 0.38 -0.05 0.00 -0.45 0.00 0.00 34.95 34.67 2q4g s ARG 104 CO -0.07 -0.31 1.02 -1.01 -0.68 0.00 0.00 175.30 174.26 2q4g s HIS 105 N -3.77 3.28 0.20 -0.53 3.76 0.05 0.96 115.29 119.24 2q4g s HIS 105 Ca 0.04 1.46 0.10 0.00 -0.15 0.00 0.00 55.06 56.51 2q4g s HIS 105 Cb 0.04 -2.87 -0.04 0.00 1.11 0.00 0.00 32.58 30.82 2q4g s HIS 105 CO -0.11 -0.74 -0.16 0.96 -0.85 0.00 0.00 174.74 173.85 2q4g s ILE 106 N -2.66 2.82 -0.22 0.60 -4.36 -1.26 0.05 121.20 116.17 2q4g s ILE 106 Ca 0.60 -1.88 -0.00 0.00 -0.26 0.00 0.00 60.65 59.11 2q4g s ILE 106 Cb -0.13 -2.39 0.06 0.00 1.25 0.00 0.00 42.46 41.25 2q4g s ILE 106 CO 0.38 -0.15 -0.04 -0.63 0.24 0.00 0.00 174.94 174.74 2q4g s ILE 107 N -1.79 1.30 0.30 8.37 1.01 0.11 -1.09 121.20 129.41 2q4g s ILE 107 Ca 0.24 -1.01 0.10 0.00 0.00 0.00 0.00 60.65 59.98 2q4g s ILE 107 Cb -0.08 -1.59 -0.05 0.00 0.01 0.00 0.00 42.46 40.76 2q4g s ILE 107 CO 0.13 -0.07 -0.02 0.68 0.00 0.00 0.00 174.94 175.66 2q4g s VAL 108 N 1.51 2.94 -0.06 2.92 -7.23 -0.50 0.05 120.40 120.02 2q4g s VAL 108 Ca -0.04 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.13 2q4g s VAL 108 Cb -0.18 -2.74 -0.03 0.00 0.56 0.00 0.00 36.38 33.99 2q4g s VAL 108 CO -0.07 -0.30 -0.04 0.00 -0.31 0.00 0.00 175.10 174.38 2q4g s ALA 109 N -2.44 3.09 0.12 1.32 0.00 -0.10 -0.05 121.76 123.70 2q4g s ALA 109 Ca 0.33 -0.88 0.08 0.00 0.00 0.00 0.00 51.96 51.49 2q4g s ALA 109 Cb -0.03 -1.30 -0.04 0.00 0.00 0.00 0.00 23.12 21.75 2q4g s ALA 109 CO 0.19 0.58 -0.20 0.00 0.00 0.00 0.00 175.76 176.33 2q4g s GLU 111 N -2.14 1.67 0.45 0.00 2.12 -0.72 -4.89 118.70 115.18 2q4g s GLU 111 Ca 0.09 -0.91 0.00 0.00 0.36 0.00 0.00 54.97 54.51 2q4g s GLU 111 Cb -0.09 0.58 0.00 0.00 0.26 0.00 0.00 34.13 34.88 2q4g s GLU 111 CO 0.05 -0.76 0.00 0.41 -0.54 0.00 0.00 175.26 174.42 2q4g n GLY 112 N -0.46 -2.32 2.63 -1.50 0.00 -1.26 -2.15 105.19 100.13 2q4g n GLY 112 Ca -0.05 -1.62 -0.25 0.00 0.00 0.00 0.00 46.02 44.10 2q4g n GLY 112 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2q4g s SER 113 N -2.98 2.23 0.79 1.61 0.15 -1.26 -2.81 113.70 111.42 2q4g s SER 113 Ca 0.00 -0.58 -0.12 0.00 0.70 0.00 0.00 55.95 55.95 2q4g s SER 113 Cb 0.00 -0.13 0.07 0.00 -1.71 0.00 0.00 66.02 64.25 2q4g s SER 113 CO 0.00 -0.35 1.15 -2.16 1.20 0.00 0.00 173.24 173.08 2q4g s PRO 114 N 2.17 1.92 -0.40 5.44 0.04 -1.26 -5.08 135.00 137.83 2q4g s PRO 114 Ca 0.03 1.50 -0.29 0.00 0.04 0.00 0.00 61.00 62.28 2q4g s PRO 114 Cb -0.16 -1.83 0.01 0.00 0.04 0.00 0.00 34.50 32.56 2q4g s PRO 114 CO -0.11 -1.95 1.41 -0.47 0.04 0.00 0.00 177.00 175.92 2q4g s TYR 115 N -2.46 2.42 0.16 0.56 6.04 -1.12 -4.88 117.35 118.06 2q4g s TYR 115 Ca 0.68 0.69 0.00 0.00 0.04 0.00 0.00 57.07 58.48 2q4g s TYR 115 Cb -0.23 -4.27 -0.04 0.00 -1.04 0.00 0.00 41.96 36.37 2q4g s TYR 115 CO 0.51 -1.98 0.04 0.14 -1.54 0.00 0.00 175.55 172.73 2q4g s VAL 116 N 5.35 0.38 0.20 3.14 -7.23 -0.91 -4.87 120.40 116.46 2q4g s VAL 116 Ca 0.61 -1.95 -0.30 0.00 -1.81 0.00 0.00 61.98 58.52 2q4g s VAL 116 Cb -0.14 -2.15 -0.09 0.00 0.56 0.00 0.00 36.38 34.55 2q4g s VAL 116 CO 0.32 -0.40 1.40 -2.84 -0.31 0.00 0.00 175.10 173.26 2q4g s PRO 117 N -4.00 4.31 0.00 4.82 0.02 -1.26 -1.76 135.00 137.13 2q4g s PRO 117 Ca 0.26 2.18 0.00 0.00 0.02 0.00 0.00 61.00 63.46 2q4g s PRO 117 Cb 0.07 -3.17 0.00 0.00 0.02 0.00 0.00 34.50 31.42 2q4g s PRO 117 CO 0.04 -0.38 0.51 1.33 -0.33 0.00 0.00 177.00 178.18 2q4g n VAL 118 N 2.84 0.20 -3.64 3.83 0.24 -0.36 -4.47 118.33 116.97 2q4g n VAL 118 Ca 0.08 -0.23 -0.09 0.00 -2.04 0.00 0.00 64.34 62.05 2q4g n VAL 118 Cb 0.41 1.07 -0.07 0.00 -1.47 0.00 0.00 33.84 33.79 2q4g n VAL 118 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 2q4g s HIS 119 N -0.20 -0.50 -0.32 6.34 5.65 -1.19 -4.80 115.29 120.27 2q4g s HIS 119 Ca 0.00 1.21 -0.09 0.00 0.25 0.00 0.00 55.06 56.43 2q4g s HIS 119 Cb 0.00 0.36 0.01 0.00 -1.18 0.00 0.00 32.58 31.76 2q4g s HIS 119 CO 0.00 -0.24 0.15 0.12 -0.65 0.00 0.00 174.74 174.12 2q4g s PHE 120 N 0.26 3.19 -0.12 3.88 5.36 -1.26 -0.92 117.98 128.36 2q4g s PHE 120 Ca 0.03 -0.77 -0.08 0.00 -0.96 0.00 0.00 56.93 55.14 2q4g s PHE 120 Cb -0.05 -2.35 -0.26 0.00 -0.34 0.00 0.00 43.02 40.02 2q4g s PHE 120 CO -0.06 -0.53 0.38 0.22 -1.46 0.00 0.00 175.22 173.77 2q4g h ASP 121 N 8.34 0.41 -5.65 6.13 1.82 -0.72 -3.49 116.42 123.26 2q4g h ASP 121 Ca -0.30 -0.93 0.33 0.00 -0.39 0.00 0.00 57.03 55.74 2q4g h ASP 121 Cb 1.13 -0.13 -0.13 0.00 0.68 0.00 0.00 39.33 40.88 2q4g h ASP 121 CO 0.62 1.83 0.86 0.00 -1.61 0.00 0.00 179.24 180.95 2q4g s ALA 122 N -2.55 -2.28 0.03 -0.78 0.00 -0.94 -4.92 121.76 110.32 2q4g s ALA 122 Ca -0.22 0.85 0.07 0.00 0.00 0.00 0.00 51.96 52.66 2q4g s ALA 122 Cb 0.06 0.28 -0.02 0.00 0.00 0.00 0.00 23.12 23.44 2q4g s ALA 122 CO 0.77 -1.01 -0.21 -1.54 0.00 0.00 0.00 175.76 173.77 2q4g s SER 123 N -2.90 2.52 -0.04 0.00 1.04 -1.26 0.04 113.70 113.10 2q4g s SER 123 Ca 0.14 -0.49 0.07 0.00 0.48 0.00 0.00 55.95 56.15 2q4g s SER 123 Cb 0.05 -0.23 -0.01 0.00 0.10 0.00 0.00 66.02 65.92 2q4g s SER 123 CO -0.04 0.19 -0.25 -0.69 0.98 0.00 0.00 173.24 173.43 2q4g s VAL 124 N -0.72 2.00 -0.42 5.02 1.01 0.11 -4.93 120.40 122.47 2q4g s VAL 124 Ca 0.08 -1.06 -0.08 0.00 0.00 0.00 0.00 61.98 60.92 2q4g s VAL 124 Cb -0.09 -1.67 0.09 0.00 0.00 0.00 0.00 36.38 34.71 2q4g s VAL 124 CO 0.01 0.56 0.26 -0.70 0.00 0.00 0.00 175.10 175.23 2q4g s GLU 125 N -0.38 2.46 -0.02 2.72 2.12 -1.26 -0.77 118.70 123.58 2q4g s GLU 125 Ca 0.03 -1.58 0.03 0.00 0.36 0.00 0.00 54.97 53.81 2q4g s GLU 125 Cb -0.12 -3.75 0.04 0.00 0.26 0.00 0.00 34.13 30.57 2q4g s GLU 125 CO 0.01 -1.01 0.97 -0.40 -0.54 0.00 0.00 175.26 174.28 2q4g n ASP 126 N 4.84 1.78 0.00 -1.70 3.85 -1.26 -5.08 116.55 118.98 2q4g n ASP 126 Ca -0.08 -2.04 0.00 0.00 -0.71 0.00 0.00 54.79 51.95 2q4g n ASP 126 Cb 0.42 -0.07 0.00 0.00 -1.35 0.00 0.00 41.12 40.13 2q4g n ASP 126 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.20 174.65