#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gg4 s SER 3 N 0.00 6.94 -0.02 7.28 0.15 -1.26 -4.42 113.70 122.38 1gg4 s SER 3 Ca 0.00 2.18 -0.11 0.00 0.70 0.00 0.00 55.95 58.73 1gg4 s SER 3 Cb 0.00 -2.58 0.01 0.00 -1.71 0.00 0.00 66.02 61.74 1gg4 s SER 3 CO 0.00 -0.57 0.22 0.54 1.20 0.00 0.00 173.24 174.64 1gg4 s VAL 4 N 1.08 0.06 0.03 4.45 0.11 0.01 -4.95 120.40 121.19 1gg4 s VAL 4 Ca 0.62 -0.51 -0.03 0.00 -2.93 0.00 0.00 61.98 59.13 1gg4 s VAL 4 Cb -0.33 -0.50 -0.04 0.00 -1.53 0.00 0.00 36.38 33.98 1gg4 s VAL 4 CO 0.30 -0.28 0.23 0.42 -3.33 0.00 0.00 175.10 172.43 1gg4 s THR 5 N -1.16 5.37 0.27 5.04 -4.23 -1.26 0.10 115.64 119.77 1gg4 s THR 5 Ca -0.12 -0.13 0.01 0.00 -1.18 0.00 0.00 61.69 60.26 1gg4 s THR 5 Cb -0.06 -3.58 0.26 0.00 1.34 0.00 0.00 72.50 70.46 1gg4 s THR 5 CO 0.02 0.25 1.77 -0.07 -0.54 0.00 0.00 174.62 176.06 1gg4 h LEU 6 N 3.55 0.61 -1.18 4.79 4.07 -1.61 0.89 115.31 126.43 1gg4 h LEU 6 Ca -0.48 0.09 -0.04 0.00 0.08 0.00 0.00 57.88 57.54 1gg4 h LEU 6 Cb 1.18 -0.01 -0.02 0.00 1.08 0.00 0.00 40.66 42.89 1gg4 h LEU 6 CO 0.71 0.25 0.17 0.77 -1.08 0.00 0.00 178.44 179.25 1gg4 h SER 7 N 0.67 0.68 -0.40 -0.43 4.64 -1.93 -1.58 113.55 115.20 1gg4 h SER 7 Ca 0.49 -0.09 -0.10 0.00 -0.47 0.00 0.00 61.79 61.62 1gg4 h SER 7 Cb 0.71 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 62.61 1gg4 h SER 7 CO -0.37 0.64 -0.12 1.56 -0.87 0.00 0.00 176.83 177.67 1gg4 h GLN 8 N 0.73 0.86 0.00 4.77 4.20 -1.25 -3.06 115.11 121.36 1gg4 h GLN 8 Ca 0.17 -0.30 -0.06 0.00 0.06 0.00 0.00 58.65 58.52 1gg4 h GLN 8 Cb 0.20 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 1gg4 h GLN 8 CO -0.01 0.94 -0.29 -0.07 -0.67 0.00 0.00 178.83 178.73 1gg4 h LEU 9 N 0.77 0.00 -0.74 1.46 4.07 -0.35 -2.44 115.31 118.08 1gg4 h LEU 9 Ca 0.12 0.00 0.07 0.00 0.08 0.00 0.00 57.88 58.15 1gg4 h LEU 9 Cb 0.63 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 42.31 1gg4 h LEU 9 CO 0.04 0.29 0.42 0.71 -1.08 0.00 0.00 178.44 178.82 1gg4 h THR 10 N 0.00 0.97 0.14 0.22 1.35 -1.28 0.30 112.91 114.61 1gg4 h THR 10 Ca -0.00 -0.26 -0.01 0.00 -0.55 0.00 0.00 66.41 65.59 1gg4 h THR 10 Cb 0.52 0.14 0.00 0.00 -1.73 0.00 0.00 68.15 67.08 1gg4 h THR 10 CO 0.04 0.14 -0.07 -0.78 -0.25 0.00 0.00 175.52 174.60 1gg4 h ASP 11 N 0.76 -0.16 -0.85 5.36 1.82 -1.62 0.47 116.42 122.19 1gg4 h ASP 11 Ca 0.33 0.01 0.15 0.00 -0.39 0.00 0.00 57.03 57.12 1gg4 h ASP 11 Cb 0.22 0.04 -0.15 0.00 0.68 0.00 0.00 39.33 40.12 1gg4 h ASP 11 CO -0.20 -0.08 -0.33 0.40 -1.61 0.00 0.00 179.24 177.42 1gg4 h ILE 12 N -0.25 0.08 -0.38 2.25 2.04 -1.31 0.64 117.51 120.58 1gg4 h ILE 12 Ca -0.02 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.84 1gg4 h ILE 12 Cb 0.14 0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.30 1gg4 h ILE 12 CO 0.03 0.00 0.00 0.18 0.00 0.00 0.00 178.15 178.36 1gg4 n LEU 13 N -5.48 2.66 -3.50 1.44 4.77 0.11 -4.95 117.00 112.05 1gg4 n LEU 13 Ca 0.09 -1.22 -0.16 0.00 -0.03 0.00 0.00 56.01 54.70 1gg4 n LEU 13 Cb 0.40 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 1gg4 n LEU 13 CO -0.08 0.61 0.00 -3.20 -1.33 0.00 0.00 177.39 173.39 1gg4 n ASN 14 N 0.96 -6.05 -3.92 -1.43 5.15 0.22 -4.86 115.26 105.33 1gg4 n ASN 14 Ca 0.18 -0.62 -0.09 0.00 -0.60 0.00 0.00 54.58 53.44 1gg4 n ASN 14 Cb 0.46 -3.25 -0.07 0.00 -0.53 0.00 0.00 39.78 36.39 1gg4 n ASN 14 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 1gg4 s GLY 15 N -3.04 0.34 -0.09 8.20 0.00 0.06 -4.52 107.32 108.27 1gg4 s GLY 15 Ca 0.05 -0.79 -0.16 0.00 0.00 0.00 0.00 44.72 43.81 1gg4 s GLY 15 CO 0.84 -0.83 0.41 1.85 0.00 0.00 0.00 173.10 175.37 1gg4 s GLU 16 N -3.93 4.19 -0.27 2.90 2.12 0.05 -4.37 118.70 119.38 1gg4 s GLU 16 Ca 0.13 0.35 -0.19 0.00 0.36 0.00 0.00 54.97 55.62 1gg4 s GLU 16 Cb 0.04 -3.37 -0.02 0.00 0.26 0.00 0.00 34.13 31.04 1gg4 s GLU 16 CO -0.04 0.34 0.58 -1.17 -0.54 0.00 0.00 175.26 174.43 1gg4 s LEU 17 N 0.07 4.09 -0.60 2.70 0.20 -1.26 -0.83 118.68 123.05 1gg4 s LEU 17 Ca 0.23 0.53 0.06 0.00 0.69 0.00 0.00 54.13 55.64 1gg4 s LEU 17 Cb -0.15 -2.77 0.30 0.00 -0.43 0.00 0.00 46.19 43.14 1gg4 s LEU 17 CO 0.10 -0.38 0.85 1.67 -0.29 0.00 0.00 176.35 178.30 1gg4 n GLN 18 N 5.70 2.82 -3.43 1.98 7.27 0.91 -5.00 117.38 127.63 1gg4 n GLN 18 Ca -0.02 -4.71 0.00 0.00 0.07 0.00 0.00 57.00 52.34 1gg4 n GLN 18 Cb 0.49 -2.21 0.00 0.00 2.41 0.00 0.00 30.24 30.93 1gg4 n GLN 18 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1gg4 n GLY 19 N 0.28 -1.38 3.73 1.69 0.00 -1.26 -3.06 105.19 105.19 1gg4 n GLY 19 Ca 0.30 -1.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.02 1gg4 n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gg4 s ALA 20 N -1.12 1.31 0.66 4.61 0.00 -1.26 -4.95 121.76 121.01 1gg4 s ALA 20 Ca 0.00 -0.71 -0.09 0.00 0.00 0.00 0.00 51.96 51.15 1gg4 s ALA 20 Cb 0.00 -2.97 0.01 0.00 0.00 0.00 0.00 23.12 20.16 1gg4 s ALA 20 CO 0.00 -2.82 1.02 0.34 0.00 0.00 0.00 175.76 174.30 1gg4 s ASP 21 N -3.99 5.54 0.04 0.00 2.15 -1.26 -4.90 116.67 114.26 1gg4 s ASP 21 Ca 0.68 1.00 -0.27 0.00 0.43 0.00 0.00 52.55 54.38 1gg4 s ASP 21 Cb -0.13 -1.88 0.07 0.00 -0.30 0.00 0.00 42.92 40.68 1gg4 s ASP 21 CO 0.55 -1.21 0.64 -0.63 -0.17 0.00 0.00 175.17 174.35 1gg4 s ILE 22 N -3.22 0.00 -0.14 4.11 1.01 -1.26 -4.97 121.20 116.73 1gg4 s ILE 22 Ca 0.56 -0.01 -0.06 0.00 0.00 0.00 0.00 60.65 61.14 1gg4 s ILE 22 Cb -0.11 -1.00 -0.04 0.00 0.01 0.00 0.00 42.46 41.32 1gg4 s ILE 22 CO 0.49 -0.01 0.07 -0.89 0.00 0.00 0.00 174.94 174.61 1gg4 s THR 23 N -2.28 4.87 0.18 2.92 2.01 -1.26 -1.41 115.64 120.67 1gg4 s THR 23 Ca -0.06 -0.02 0.08 0.00 0.31 0.00 0.00 61.69 62.01 1gg4 s THR 23 Cb -0.00 -3.14 -0.04 0.00 0.01 0.00 0.00 72.50 69.32 1gg4 s THR 23 CO 0.00 0.53 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.65 1gg4 s LEU 24 N -0.27 3.10 0.00 4.42 1.43 0.11 -4.94 118.68 122.52 1gg4 s LEU 24 Ca 0.08 -0.53 0.00 0.00 -1.03 0.00 0.00 54.13 52.66 1gg4 s LEU 24 Cb -0.12 -1.76 0.00 0.00 0.03 0.00 0.00 46.19 44.34 1gg4 s LEU 24 CO 0.01 0.09 0.00 -0.67 0.23 0.00 0.00 176.35 176.02 1gg4 n ASP 25 N -0.08 0.00 -3.65 2.29 4.64 -1.26 -0.81 116.55 117.68 1gg4 n ASP 25 Ca -0.10 -0.67 -0.14 0.00 -1.38 0.00 0.00 54.79 52.50 1gg4 n ASP 25 Cb 0.56 0.00 -0.08 0.00 -1.04 0.00 0.00 41.12 40.56 1gg4 n ASP 25 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1gg4 s ALA 26 N 0.00 -1.55 0.05 -1.67 0.00 -1.26 -4.42 121.76 112.91 1gg4 s ALA 26 Ca 0.00 1.70 0.03 0.00 0.00 0.00 0.00 51.96 53.69 1gg4 s ALA 26 Cb 0.00 -0.93 -0.03 0.00 0.00 0.00 0.00 23.12 22.16 1gg4 s ALA 26 CO 0.00 -0.30 -0.09 0.54 0.00 0.00 0.00 175.76 175.91 1gg4 s VAL 27 N 0.18 0.64 0.09 0.00 0.11 -1.26 -1.12 120.40 119.05 1gg4 s VAL 27 Ca -0.01 -1.19 -0.25 0.00 -2.93 0.00 0.00 61.98 57.60 1gg4 s VAL 27 Cb -0.04 -0.77 0.08 0.00 -1.53 0.00 0.00 36.38 34.12 1gg4 s VAL 27 CO 0.02 -0.40 0.68 0.28 -3.33 0.00 0.00 175.10 172.35 1gg4 s THR 28 N -1.56 0.00 -1.08 5.04 -1.32 -0.40 -4.92 115.64 111.41 1gg4 s THR 28 Ca -0.07 0.00 0.09 0.00 -1.21 0.00 0.00 61.69 60.50 1gg4 s THR 28 Cb -0.09 -1.00 0.07 0.00 -1.51 0.00 0.00 72.50 69.97 1gg4 s THR 28 CO 0.00 0.00 0.78 0.35 -2.21 0.00 0.00 174.62 173.54 1gg4 n THR 29 N -0.18 0.02 -4.49 5.08 -2.24 -1.26 -0.92 114.28 110.29 1gg4 n THR 29 Ca -0.15 -0.51 -0.33 0.00 -2.27 0.00 0.00 64.05 60.79 1gg4 n THR 29 Cb 0.63 1.17 -0.15 0.00 -2.10 0.00 0.00 70.33 69.88 1gg4 n THR 29 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1gg4 s ASP 30 N -0.73 3.62 0.45 3.42 2.15 -1.26 -4.91 116.67 119.41 1gg4 s ASP 30 Ca 0.10 -0.48 0.11 0.00 0.43 0.00 0.00 52.55 52.70 1gg4 s ASP 30 Cb 0.07 -1.56 0.99 0.00 -0.30 0.00 0.00 42.92 42.13 1gg4 s ASP 30 CO 0.11 0.08 2.07 0.71 -0.17 0.00 0.00 175.17 177.96 1gg4 h THR 31 N 5.69 1.08 0.00 1.71 1.35 -1.96 0.27 112.91 121.05 1gg4 h THR 31 Ca -0.34 -0.22 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 1gg4 h THR 31 Cb 1.19 0.80 0.00 0.00 -1.73 0.00 0.00 68.15 68.41 1gg4 h THR 31 CO 0.57 0.09 0.00 0.54 -0.25 0.00 0.00 175.52 176.47 1gg4 n ARG 32 N -4.46 0.87 -0.80 4.72 1.74 -1.26 -3.25 116.66 114.21 1gg4 n ARG 32 Ca 0.00 0.00 0.05 0.00 -0.77 0.00 0.00 57.85 57.14 1gg4 n ARG 32 Cb 0.11 -1.50 0.13 0.00 -1.02 0.00 0.00 32.46 30.18 1gg4 n ARG 32 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1gg4 n LYS 33 N -1.00 0.98 -2.48 5.56 4.76 0.93 -5.08 118.16 121.83 1gg4 n LYS 33 Ca 0.21 -2.69 -0.35 0.00 -2.87 0.00 0.00 58.31 52.61 1gg4 n LYS 33 Cb 0.10 -1.05 -0.03 0.00 -1.84 0.00 0.00 35.03 32.20 1gg4 n LYS 33 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1gg4 s LEU 34 N -2.03 3.88 0.09 -0.35 2.01 -1.20 -4.88 118.68 116.20 1gg4 s LEU 34 Ca 0.34 2.01 0.06 0.00 0.01 0.00 0.00 54.13 56.55 1gg4 s LEU 34 Cb 0.34 -4.49 -0.03 0.00 0.01 0.00 0.00 46.19 42.02 1gg4 s LEU 34 CO -0.08 -0.82 -0.16 -0.89 1.01 0.00 0.00 176.35 175.41 1gg4 s THR 35 N -1.87 1.30 -0.66 5.49 2.01 -1.26 -5.04 115.64 115.60 1gg4 s THR 35 Ca 0.67 -1.44 -0.30 0.00 0.31 0.00 0.00 61.69 60.92 1gg4 s THR 35 Cb -0.19 -1.27 -0.14 0.00 0.01 0.00 0.00 72.50 70.90 1gg4 s THR 35 CO 0.23 -0.22 2.47 -2.65 -0.69 0.00 0.00 174.62 173.76 1gg4 n PRO 36 N 1.09 0.60 -2.54 4.92 -0.02 -1.26 -1.99 135.00 135.80 1gg4 n PRO 36 Ca -0.20 0.06 -0.01 0.00 -2.02 0.00 0.00 63.50 61.33 1gg4 n PRO 36 Cb 0.54 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 1gg4 n PRO 36 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gg4 n GLY 37 N 6.37 0.88 4.00 -1.23 0.00 0.97 -4.89 105.19 111.28 1gg4 n GLY 37 Ca 0.50 -0.64 -0.21 0.00 0.00 0.00 0.00 46.02 45.67 1gg4 n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gg4 s LEU 39 N -4.84 3.88 -0.35 0.00 2.96 -0.27 0.12 118.68 120.17 1gg4 s LEU 39 Ca 0.62 -0.05 -0.16 0.00 -0.22 0.00 0.00 54.13 54.32 1gg4 s LEU 39 Cb -0.07 -2.07 -0.01 0.00 0.50 0.00 0.00 46.19 44.55 1gg4 s LEU 39 CO 0.40 -0.03 0.39 0.12 -1.32 0.00 0.00 176.35 175.91 1gg4 s PHE 40 N 1.65 3.20 -0.26 5.38 5.36 -0.69 -1.27 117.98 131.35 1gg4 s PHE 40 Ca 0.07 -0.04 -0.23 0.00 -0.96 0.00 0.00 56.93 55.77 1gg4 s PHE 40 Cb -0.16 -2.72 -0.01 0.00 -0.34 0.00 0.00 43.02 39.79 1gg4 s PHE 40 CO 0.09 -0.47 0.76 0.08 -1.46 0.00 0.00 175.22 174.21 1gg4 s VAL 41 N 2.07 4.87 -0.68 3.12 1.01 -0.09 -1.29 120.40 129.41 1gg4 s VAL 41 Ca 0.13 1.37 -0.19 0.00 0.00 0.00 0.00 61.98 63.28 1gg4 s VAL 41 Cb -0.16 -4.07 0.12 0.00 0.00 0.00 0.00 36.38 32.27 1gg4 s VAL 41 CO 0.12 -0.07 0.81 0.00 0.00 0.00 0.00 175.10 175.95 1gg4 s ALA 42 N 2.76 3.45 0.52 5.51 0.00 -0.37 -4.48 121.76 129.15 1gg4 s ALA 42 Ca 0.32 -2.40 -0.05 0.00 0.00 0.00 0.00 51.96 49.83 1gg4 s ALA 42 Cb -0.15 -3.65 -0.02 0.00 0.00 0.00 0.00 23.12 19.31 1gg4 s ALA 42 CO 0.09 -2.49 0.81 -0.51 0.00 0.00 0.00 175.76 173.66 1gg4 s LEU 43 N 2.55 3.49 -0.21 0.00 1.43 -1.26 -4.71 118.68 119.97 1gg4 s LEU 43 Ca 0.17 0.79 -0.01 0.00 -1.03 0.00 0.00 54.13 54.05 1gg4 s LEU 43 Cb -0.19 -3.70 0.06 0.00 0.03 0.00 0.00 46.19 42.40 1gg4 s LEU 43 CO 0.02 -0.76 -0.01 -1.59 0.23 0.00 0.00 176.35 174.25 1gg4 s LYS 44 N -4.81 1.10 0.00 1.70 -2.85 -1.26 -0.20 119.74 113.42 1gg4 s LYS 44 Ca 0.50 -0.67 0.00 0.00 -1.00 0.00 0.00 55.97 54.79 1gg4 s LYS 44 Cb -0.10 -2.32 0.00 0.00 -2.06 0.00 0.00 37.83 33.35 1gg4 s LYS 44 CO 0.44 -0.62 0.00 0.41 0.10 0.00 0.00 175.35 175.69 1gg4 n GLY 45 N 4.88 0.00 0.08 0.59 0.00 0.19 -4.97 105.19 105.96 1gg4 n GLY 45 Ca -0.10 -1.76 -0.16 0.00 0.00 0.00 0.00 46.02 44.00 1gg4 n GLY 45 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1gg4 h GLU 46 N 0.00 0.00 -1.02 1.61 4.57 -2.05 -3.36 114.58 114.34 1gg4 h GLU 46 Ca 0.00 0.00 -0.41 0.00 -1.18 0.00 0.00 59.36 57.77 1gg4 h GLU 46 Cb 0.00 0.00 -0.24 0.00 -0.16 0.00 0.00 28.75 28.35 1gg4 h GLU 46 CO 0.00 1.00 0.52 2.89 -1.18 0.00 0.00 179.01 182.24 1gg4 n ARG 47 N -4.57 1.99 -3.28 1.92 1.85 -1.26 -4.83 116.66 108.47 1gg4 n ARG 47 Ca -0.15 -2.34 0.03 0.00 -1.00 0.00 0.00 57.85 54.39 1gg4 n ARG 47 Cb 0.52 -1.92 -0.04 0.00 -1.05 0.00 0.00 32.46 29.98 1gg4 n ARG 47 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1gg4 s PHE 48 N -2.58 -0.43 -0.42 2.89 0.40 -1.26 -5.11 117.98 111.46 1gg4 s PHE 48 Ca 0.45 0.70 -0.05 0.00 -0.60 0.00 0.00 56.93 57.42 1gg4 s PHE 48 Cb 0.37 0.24 0.11 0.00 0.51 0.00 0.00 43.02 44.25 1gg4 s PHE 48 CO 0.08 -0.22 0.25 0.34 0.70 0.00 0.00 175.22 176.37 1gg4 s ASP 49 N 2.38 5.42 0.00 1.36 3.68 -1.26 0.57 116.67 128.81 1gg4 s ASP 49 Ca -0.01 -1.91 0.01 0.00 2.13 0.00 0.00 52.55 52.77 1gg4 s ASP 49 Cb -0.05 -1.90 0.08 0.00 -1.45 0.00 0.00 42.92 39.61 1gg4 s ASP 49 CO -0.16 -0.58 0.33 0.00 0.13 0.00 0.00 175.17 174.89 1gg4 n ALA 50 N 4.72 1.68 0.06 3.66 0.00 0.73 -1.70 120.51 129.66 1gg4 n ALA 50 Ca -0.05 -0.01 -0.15 0.00 0.00 0.00 0.00 53.44 53.23 1gg4 n ALA 50 Cb 0.41 -1.02 -0.06 0.00 0.00 0.00 0.00 19.45 18.78 1gg4 n ALA 50 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1gg4 h HIS 51 N 0.00 0.74 0.00 0.00 -0.00 -1.85 -2.93 115.15 111.10 1gg4 h HIS 51 Ca 0.00 -0.39 0.00 0.00 -0.00 0.00 0.00 60.37 59.98 1gg4 h HIS 51 Cb 0.00 -0.09 0.00 0.00 -0.00 0.00 0.00 27.41 27.32 1gg4 h HIS 51 CO 0.00 1.21 0.00 -0.25 -0.00 0.00 0.00 177.93 178.89 1gg4 n ASP 52 N -3.79 0.00 -1.26 2.45 10.43 -0.69 -0.89 116.55 122.81 1gg4 n ASP 52 Ca -0.08 0.49 0.10 0.00 2.57 0.00 0.00 54.79 57.87 1gg4 n ASP 52 Cb 0.84 -0.49 0.30 0.00 1.84 0.00 0.00 41.12 43.60 1gg4 n ASP 52 CO 0.00 0.00 0.00 0.49 -1.07 0.00 0.00 177.20 176.62 1gg4 n PHE 53 N -1.49 1.03 0.05 1.24 3.01 -1.11 -4.59 117.46 115.61 1gg4 n PHE 53 Ca 0.03 -0.55 -0.12 0.00 1.01 0.00 0.00 57.45 57.81 1gg4 n PHE 53 Cb 0.12 -0.10 -0.07 0.00 -0.01 0.00 0.00 39.48 39.42 1gg4 n PHE 53 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1gg4 h ALA 54 N 3.65 -0.05 -0.97 4.37 0.00 -1.08 -1.70 119.26 123.48 1gg4 h ALA 54 Ca 0.00 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.93 1gg4 h ALA 54 Cb 1.11 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.86 1gg4 h ALA 54 CO 0.08 -0.51 0.63 -0.44 0.00 0.00 0.00 179.25 179.01 1gg4 h ASP 55 N -0.09 1.03 -0.28 0.00 3.32 -1.81 -1.03 116.42 117.56 1gg4 h ASP 55 Ca -0.01 -0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 1gg4 h ASP 55 Cb 0.08 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 1gg4 h ASP 55 CO 0.01 0.69 0.07 -0.61 -1.72 0.00 0.00 179.24 177.68 1gg4 h GLN 56 N 1.19 0.45 -0.60 3.56 5.75 -1.83 -0.32 115.11 123.31 1gg4 h GLN 56 Ca 0.40 -0.11 0.04 0.00 -0.15 0.00 0.00 58.65 58.83 1gg4 h GLN 56 Cb 0.06 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 28.51 1gg4 h GLN 56 CO -0.14 0.53 0.40 0.00 -2.65 0.00 0.00 178.83 176.97 1gg4 h ALA 57 N 0.90 1.71 0.12 3.38 0.00 -0.61 0.12 119.26 124.88 1gg4 h ALA 57 Ca 0.09 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1gg4 h ALA 57 Cb 0.28 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1gg4 h ALA 57 CO 0.00 0.22 -0.06 -0.22 0.00 0.00 0.00 179.25 179.19 1gg4 h LYS 58 N 0.68 -0.16 -0.02 0.00 3.64 -0.81 0.72 116.57 120.62 1gg4 h LYS 58 Ca 0.24 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.64 1gg4 h LYS 58 Cb 0.12 0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 31.98 1gg4 h LYS 58 CO -0.07 0.14 0.04 0.00 -2.27 0.00 0.00 179.45 177.29 1gg4 h ALA 59 N 0.37 1.29 0.00 5.00 0.00 -0.21 0.66 119.26 126.38 1gg4 h ALA 59 Ca -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1gg4 h ALA 59 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1gg4 h ALA 59 CO 0.03 -0.05 -0.37 0.41 0.00 0.00 0.00 179.25 179.27 1gg4 n GLY 60 N -1.21 -1.37 0.00 0.00 0.00 0.34 -4.93 105.19 98.02 1gg4 n GLY 60 Ca -0.03 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.75 1gg4 n GLY 60 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gg4 n GLY 61 N 1.46 1.36 3.69 -0.02 0.00 0.22 -4.77 105.19 107.14 1gg4 n GLY 61 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1gg4 n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gg4 s ALA 62 N -2.00 3.61 0.21 4.61 0.00 0.22 -0.02 121.76 128.39 1gg4 s ALA 62 Ca 0.00 1.01 0.21 0.00 0.00 0.00 0.00 51.96 53.18 1gg4 s ALA 62 Cb 0.00 -3.61 0.86 0.00 0.00 0.00 0.00 23.12 20.37 1gg4 s ALA 62 CO 0.00 -0.91 1.82 0.78 0.00 0.00 0.00 175.76 177.45 1gg4 h GLY 63 N 8.10 0.00 -2.31 0.00 0.00 -0.49 -3.44 103.07 104.93 1gg4 h GLY 63 Ca -0.40 0.00 0.14 0.00 0.00 0.00 0.00 47.33 47.07 1gg4 h GLY 63 CO 0.90 0.00 0.40 0.00 0.00 0.00 0.00 176.54 177.84 1gg4 s ALA 64 N -3.75 -1.53 -0.06 3.60 0.00 -1.06 -4.36 121.76 114.61 1gg4 s ALA 64 Ca -0.00 0.05 0.03 0.00 0.00 0.00 0.00 51.96 52.03 1gg4 s ALA 64 Cb 0.11 0.70 0.01 0.00 0.00 0.00 0.00 23.12 23.94 1gg4 s ALA 64 CO 0.66 -1.02 -0.14 -0.51 0.00 0.00 0.00 175.76 174.76 1gg4 s LEU 65 N -2.91 1.74 -0.39 0.00 1.43 -0.37 -1.71 118.68 116.47 1gg4 s LEU 65 Ca 0.11 -0.31 -0.16 0.00 -1.03 0.00 0.00 54.13 52.74 1gg4 s LEU 65 Cb -0.03 -0.86 0.01 0.00 0.03 0.00 0.00 46.19 45.34 1gg4 s LEU 65 CO 0.03 0.07 0.38 -0.22 0.23 0.00 0.00 176.35 176.84 1gg4 s LEU 66 N 0.47 4.76 0.05 1.79 2.96 -0.41 -1.52 118.68 126.78 1gg4 s LEU 66 Ca -0.12 -0.57 -0.02 0.00 -0.22 0.00 0.00 54.13 53.20 1gg4 s LEU 66 Cb -0.14 -2.32 -0.03 0.00 0.50 0.00 0.00 46.19 44.19 1gg4 s LEU 66 CO 0.03 -0.47 0.01 0.54 -1.32 0.00 0.00 176.35 175.14 1gg4 s VAL 67 N 2.01 0.19 -1.24 1.68 0.11 -0.80 -1.23 120.40 121.11 1gg4 s VAL 67 Ca 0.11 -1.56 0.14 0.00 -2.93 0.00 0.00 61.98 57.73 1gg4 s VAL 67 Cb -0.17 -1.30 0.56 0.00 -1.53 0.00 0.00 36.38 33.94 1gg4 s VAL 67 CO 0.12 -0.86 1.43 -1.54 -3.33 0.00 0.00 175.10 170.92 1gg4 n SER 68 N 0.32 3.76 -3.55 3.54 3.41 -1.26 -1.69 113.62 118.15 1gg4 n SER 68 Ca -0.16 -2.34 -0.09 0.00 -0.26 0.00 0.00 58.87 56.03 1gg4 n SER 68 Cb 0.60 -0.50 -0.03 0.00 -0.26 0.00 0.00 64.21 64.02 1gg4 n SER 68 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gg4 s ARG 69 N -1.77 0.64 0.29 4.33 1.70 -1.26 -4.81 118.95 118.06 1gg4 s ARG 69 Ca 0.39 -0.08 -0.29 0.00 -0.47 0.00 0.00 55.73 55.28 1gg4 s ARG 69 Cb 0.25 0.30 -0.10 0.00 -0.57 0.00 0.00 34.95 34.83 1gg4 s ARG 69 CO 0.19 -0.25 1.27 -2.14 -1.08 0.00 0.00 175.30 173.29 1gg4 s PRO 70 N -2.15 4.42 0.06 3.89 0.02 -1.26 -4.94 135.00 135.04 1gg4 s PRO 70 Ca 0.03 2.10 0.06 0.00 0.02 0.00 0.00 61.00 63.21 1gg4 s PRO 70 Cb -0.01 -3.12 -0.03 0.00 0.02 0.00 0.00 34.50 31.36 1gg4 s PRO 70 CO -0.04 -0.13 -0.16 -0.51 -0.33 0.00 0.00 177.00 175.83 1gg4 s LEU 71 N -1.29 2.23 -1.46 -5.54 1.43 -1.26 -5.04 118.68 107.74 1gg4 s LEU 71 Ca 0.50 -0.56 -0.12 0.00 -1.03 0.00 0.00 54.13 52.92 1gg4 s LEU 71 Cb -0.38 -0.65 0.04 0.00 0.03 0.00 0.00 46.19 45.23 1gg4 s LEU 71 CO 0.47 0.01 2.34 0.47 0.23 0.00 0.00 176.35 179.86 1gg4 n ASP 72 N 1.52 5.25 -3.90 2.29 8.00 -1.26 -4.82 116.55 123.63 1gg4 n ASP 72 Ca -0.19 -2.84 -0.27 0.00 0.71 0.00 0.00 54.79 52.20 1gg4 n ASP 72 Cb 0.54 -1.60 -0.17 0.00 -0.02 0.00 0.00 41.12 39.87 1gg4 n ASP 72 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1gg4 s ILE 73 N 2.37 1.01 -0.54 0.53 -1.09 -1.26 -5.03 121.20 117.18 1gg4 s ILE 73 Ca 0.51 -0.28 -0.26 0.00 -2.23 0.00 0.00 60.65 58.39 1gg4 s ILE 73 Cb 0.14 -1.03 -0.24 0.00 -1.58 0.00 0.00 42.46 39.76 1gg4 s ILE 73 CO -0.07 0.36 1.81 -0.67 -1.23 0.00 0.00 174.94 175.15 1gg4 n ASP 74 N 4.92 1.94 -3.69 3.58 2.03 -1.26 -4.72 116.55 119.35 1gg4 n ASP 74 Ca -0.13 -2.61 -0.12 0.00 0.52 0.00 0.00 54.79 52.46 1gg4 n ASP 74 Cb 0.50 -0.97 -0.09 0.00 -0.72 0.00 0.00 41.12 39.84 1gg4 n ASP 74 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1gg4 s LEU 75 N 2.42 -0.10 0.10 -2.67 1.43 -1.26 -5.11 118.68 113.49 1gg4 s LEU 75 Ca 0.64 1.06 -0.35 0.00 -1.03 0.00 0.00 54.13 54.45 1gg4 s LEU 75 Cb 0.12 1.76 -0.15 0.00 0.03 0.00 0.00 46.19 47.96 1gg4 s LEU 75 CO 0.21 -0.19 1.54 -2.65 0.23 0.00 0.00 176.35 175.49 1gg4 n PRO 76 N 3.23 1.84 -4.59 1.29 -0.02 -1.26 -4.75 135.00 130.74 1gg4 n PRO 76 Ca -0.16 0.67 -0.30 0.00 -2.02 0.00 0.00 63.50 61.68 1gg4 n PRO 76 Cb 0.56 -2.40 -0.13 0.00 -0.02 0.00 0.00 33.50 31.51 1gg4 n PRO 76 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1gg4 s GLN 77 N 1.15 1.92 -0.40 -0.52 -0.21 -1.17 -1.24 119.66 119.19 1gg4 s GLN 77 Ca 0.82 -1.07 0.04 0.00 0.02 0.00 0.00 55.36 55.17 1gg4 s GLN 77 Cb -0.77 -2.12 0.11 0.00 1.00 0.00 0.00 33.01 31.23 1gg4 s GLN 77 CO 0.42 0.52 0.12 -1.17 -2.12 0.00 0.00 175.29 173.06 1gg4 s LEU 78 N -1.62 4.59 -0.37 2.90 0.20 -0.58 -0.06 118.68 123.73 1gg4 s LEU 78 Ca 0.15 -2.45 -0.26 0.00 0.69 0.00 0.00 54.13 52.25 1gg4 s LEU 78 Cb -0.10 -1.63 0.02 0.00 -0.43 0.00 0.00 46.19 44.05 1gg4 s LEU 78 CO 0.06 -0.33 0.94 -0.63 -0.29 0.00 0.00 176.35 176.10 1gg4 s ILE 79 N 0.49 4.57 0.27 6.68 1.09 -0.01 -1.90 121.20 132.38 1gg4 s ILE 79 Ca 0.13 1.23 0.11 0.00 -1.10 0.00 0.00 60.65 61.02 1gg4 s ILE 79 Cb -0.21 -4.35 -0.05 0.00 -1.06 0.00 0.00 42.46 36.79 1gg4 s ILE 79 CO -0.05 -0.55 -0.15 0.68 -0.10 0.00 0.00 174.94 174.76 1gg4 s VAL 80 N 3.52 2.73 0.18 2.92 -7.23 -0.68 -0.77 120.40 121.06 1gg4 s VAL 80 Ca 0.39 -2.24 -0.12 0.00 -1.81 0.00 0.00 61.98 58.21 1gg4 s VAL 80 Cb -0.12 -2.43 0.10 0.00 0.56 0.00 0.00 36.38 34.49 1gg4 s VAL 80 CO 0.19 -0.36 1.78 0.50 -0.31 0.00 0.00 175.10 176.90 1gg4 h LYS 81 N 2.27 0.90 -3.40 4.82 3.64 -1.89 -3.36 116.57 119.55 1gg4 h LYS 81 Ca -0.42 -0.12 -0.34 0.00 -1.27 0.00 0.00 60.65 58.50 1gg4 h LYS 81 Cb 1.25 -0.17 -0.37 0.00 -0.41 0.00 0.00 32.23 32.54 1gg4 h LYS 81 CO 0.59 0.71 -0.73 0.34 -2.27 0.00 0.00 179.45 178.08 1gg4 s ASP 82 N -6.00 0.64 0.15 4.20 3.68 -1.26 -4.91 116.67 113.17 1gg4 s ASP 82 Ca -0.13 0.07 0.06 0.00 2.13 0.00 0.00 52.55 54.68 1gg4 s ASP 82 Cb 0.13 -0.10 -0.08 0.00 -1.45 0.00 0.00 42.92 41.42 1gg4 s ASP 82 CO 0.79 -0.19 1.35 0.71 0.13 0.00 0.00 175.17 177.95 1gg4 h THR 83 N 6.37 1.62 -0.14 1.71 1.35 -1.89 -1.92 112.91 120.02 1gg4 h THR 83 Ca -0.28 -3.05 0.00 0.00 -0.55 0.00 0.00 66.41 62.54 1gg4 h THR 83 Cb 1.12 2.67 -0.01 0.00 -1.73 0.00 0.00 68.15 70.20 1gg4 h THR 83 CO 0.30 0.88 0.08 -0.09 -0.25 0.00 0.00 175.52 176.44 1gg4 h ARG 84 N 0.02 0.17 0.10 4.72 9.65 -1.95 -0.06 114.38 127.02 1gg4 h ARG 84 Ca -0.02 -0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 58.84 1gg4 h ARG 84 Cb 1.62 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 30.16 1gg4 h ARG 84 CO 0.13 0.11 -0.05 -0.07 2.80 0.00 0.00 179.97 182.89 1gg4 h LEU 85 N 0.17 -0.11 -1.36 3.80 -0.00 -1.96 -2.65 115.31 113.20 1gg4 h LEU 85 Ca 0.05 -0.24 0.08 0.00 -0.00 0.00 0.00 57.88 57.78 1gg4 h LEU 85 Cb -0.01 0.03 -0.05 0.00 -0.00 0.00 0.00 40.66 40.63 1gg4 h LEU 85 CO -0.02 0.18 0.50 0.00 -0.00 0.00 0.00 178.44 179.09 1gg4 h ALA 86 N 0.47 1.73 -0.10 1.53 0.00 -1.17 0.39 119.26 122.11 1gg4 h ALA 86 Ca -0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1gg4 h ALA 86 Cb 0.34 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1gg4 h ALA 86 CO 0.02 0.13 0.03 0.35 0.00 0.00 0.00 179.25 179.78 1gg4 h PHE 87 N 0.74 0.17 -0.41 0.00 3.57 -0.94 0.26 116.94 120.34 1gg4 h PHE 87 Ca 0.34 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.80 1gg4 h PHE 87 Cb 0.35 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.02 1gg4 h PHE 87 CO -0.00 0.33 0.19 0.78 -2.23 0.00 0.00 178.31 177.38 1gg4 h GLY 88 N -0.03 0.64 0.95 2.40 0.00 -0.86 -1.97 103.07 104.20 1gg4 h GLY 88 Ca 0.03 -0.32 0.02 0.00 0.00 0.00 0.00 47.33 47.06 1gg4 h GLY 88 CO 0.00 0.31 0.56 0.83 0.00 0.00 0.00 176.54 178.24 1gg4 h GLU 89 N 0.52 1.09 -0.63 4.80 5.08 0.02 0.50 114.58 125.97 1gg4 h GLU 89 Ca 0.14 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.41 1gg4 h GLU 89 Cb 0.14 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 29.11 1gg4 h GLU 89 CO -0.02 0.72 0.28 1.25 -1.00 0.00 0.00 179.01 180.25 1gg4 h LEU 90 N 1.12 0.81 -0.59 1.33 5.85 -0.20 -1.01 115.31 122.63 1gg4 h LEU 90 Ca 0.33 -0.09 -0.13 0.00 0.84 0.00 0.00 57.88 58.83 1gg4 h LEU 90 Cb -0.07 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.74 1gg4 h LEU 90 CO -0.09 0.70 -0.28 0.00 -0.34 0.00 0.00 178.44 178.44 1gg4 h ALA 91 N 1.42 0.77 0.30 1.25 0.00 -0.51 -0.78 119.26 121.71 1gg4 h ALA 91 Ca 0.22 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1gg4 h ALA 91 Cb 0.12 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1gg4 h ALA 91 CO -0.03 0.65 -0.15 0.00 0.00 0.00 0.00 179.25 179.73 1gg4 h ALA 92 N 0.97 -0.41 -0.11 0.00 0.00 -0.44 -1.12 119.26 118.16 1gg4 h ALA 92 Ca 0.08 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 54.94 1gg4 h ALA 92 Cb 0.82 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.73 1gg4 h ALA 92 CO 0.07 -0.73 -0.13 2.35 0.00 0.00 0.00 179.25 180.81 1gg4 h TRP 93 N -0.41 -0.33 -0.73 0.00 7.01 -1.03 -1.90 115.95 118.56 1gg4 h TRP 93 Ca -0.04 0.02 0.07 0.00 2.11 0.00 0.00 58.89 61.05 1gg4 h TRP 93 Cb 0.32 0.16 -0.06 0.00 -2.10 0.00 0.00 29.16 27.48 1gg4 h TRP 93 CO -0.06 -0.19 0.41 0.28 -2.79 0.00 0.00 178.44 176.09 1gg4 h VAL 94 N -0.17 0.94 -0.47 2.65 2.07 -0.99 -1.21 116.25 119.08 1gg4 h VAL 94 Ca 0.08 -0.25 0.01 0.00 0.82 0.00 0.00 66.70 67.36 1gg4 h VAL 94 Cb 0.29 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.18 1gg4 h VAL 94 CO -0.21 0.13 0.31 -0.09 0.02 0.00 0.00 177.57 177.73 1gg4 h ARG 95 N 0.73 0.60 0.00 1.57 1.12 -0.44 -1.02 114.38 116.94 1gg4 h ARG 95 Ca 0.34 -0.04 -0.06 0.00 -1.11 0.00 0.00 59.98 59.11 1gg4 h ARG 95 Cb 0.25 -0.14 -0.01 0.00 -0.01 0.00 0.00 29.97 30.07 1gg4 h ARG 95 CO -0.21 0.40 -0.29 1.96 -3.11 0.00 0.00 179.97 178.72 1gg4 h GLN 96 N 0.62 0.00 0.00 0.20 1.08 -0.64 -3.09 115.11 113.28 1gg4 h GLN 96 Ca 0.17 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.37 1gg4 h GLN 96 Cb -0.06 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.37 1gg4 h GLN 96 CO -0.04 0.29 0.00 1.96 -0.95 0.00 0.00 178.83 180.09 1gg4 h GLN 97 N 0.00 0.00 -6.16 1.46 1.08 -0.81 -3.46 115.11 107.21 1gg4 h GLN 97 Ca -0.00 0.00 -0.56 0.00 -1.45 0.00 0.00 58.65 56.64 1gg4 h GLN 97 Cb 0.74 0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 28.11 1gg4 h GLN 97 CO 0.04 0.00 -0.54 0.14 -0.95 0.00 0.00 178.83 177.52 1gg4 s VAL 98 N -3.18 4.68 -2.19 -0.54 -7.23 -1.17 -4.96 120.40 105.81 1gg4 s VAL 98 Ca 0.09 -1.01 0.23 0.00 -1.81 0.00 0.00 61.98 59.48 1gg4 s VAL 98 Cb 0.10 -3.41 0.56 0.00 0.56 0.00 0.00 36.38 34.19 1gg4 s VAL 98 CO 0.60 -0.12 1.74 -0.81 -0.31 0.00 0.00 175.10 176.19 1gg4 n PRO 99 N -0.46 1.39 -1.75 4.82 -0.04 -1.26 -4.98 135.00 132.71 1gg4 n PRO 99 Ca -0.08 -0.57 -0.42 0.00 -0.04 0.00 0.00 63.50 62.39 1gg4 n PRO 99 Cb 0.55 -1.39 -0.01 0.00 -0.04 0.00 0.00 33.50 32.60 1gg4 n PRO 99 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1gg4 n ALA 100 N -0.24 2.36 -2.40 0.55 0.00 -1.25 -4.92 120.51 114.60 1gg4 n ALA 100 Ca 0.17 0.36 -0.42 0.00 0.00 0.00 0.00 53.44 53.55 1gg4 n ALA 100 Cb 0.22 -2.43 -0.02 0.00 0.00 0.00 0.00 19.45 17.22 1gg4 n ALA 100 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1gg4 s ARG 101 N -1.28 3.47 -0.13 0.00 1.81 -0.05 -4.85 118.95 117.92 1gg4 s ARG 101 Ca 0.59 0.66 -0.13 0.00 -1.72 0.00 0.00 55.73 55.13 1gg4 s ARG 101 Cb -0.50 -4.06 -0.05 0.00 -0.45 0.00 0.00 34.95 29.90 1gg4 s ARG 101 CO 0.56 -1.71 0.30 0.08 -0.68 0.00 0.00 175.30 173.85 1gg4 s VAL 102 N 5.59 5.28 0.04 3.52 1.01 -1.26 -0.72 120.40 133.86 1gg4 s VAL 102 Ca 0.55 0.57 0.03 0.00 0.00 0.00 0.00 61.98 63.14 1gg4 s VAL 102 Cb -0.11 -3.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.62 1gg4 s VAL 102 CO 0.29 0.44 -0.10 0.54 0.00 0.00 0.00 175.10 176.27 1gg4 s VAL 103 N 0.11 0.76 0.17 2.92 0.11 0.02 -0.49 120.40 124.00 1gg4 s VAL 103 Ca 0.18 -0.98 0.03 0.00 -2.93 0.00 0.00 61.98 58.28 1gg4 s VAL 103 Cb -0.13 -0.75 -0.05 0.00 -1.53 0.00 0.00 36.38 33.92 1gg4 s VAL 103 CO 0.05 -0.19 -0.05 0.00 -3.33 0.00 0.00 175.10 171.59 1gg4 s ALA 104 N -1.06 1.44 0.02 1.54 0.00 -0.69 -0.44 121.76 122.56 1gg4 s ALA 104 Ca -0.04 -1.56 -0.20 0.00 0.00 0.00 0.00 51.96 50.16 1gg4 s ALA 104 Cb -0.08 0.30 0.04 0.00 0.00 0.00 0.00 23.12 23.38 1gg4 s ALA 104 CO 0.01 -0.21 0.46 -0.48 0.00 0.00 0.00 175.76 175.53 1gg4 s LEU 105 N -3.18 0.22 0.00 0.00 2.34 -0.88 -1.46 118.68 115.72 1gg4 s LEU 105 Ca 0.21 0.14 0.00 0.00 0.06 0.00 0.00 54.13 54.54 1gg4 s LEU 105 Cb 0.05 1.86 -0.00 0.00 -0.56 0.00 0.00 46.19 47.53 1gg4 s LEU 105 CO 0.03 -0.64 0.01 0.41 -1.06 0.00 0.00 176.35 175.10 1gg4 n THR 106 N 0.65 0.00 0.00 5.48 -1.04 0.10 -0.43 114.28 119.04 1gg4 n THR 106 Ca -0.19 -0.07 0.00 0.00 -2.04 0.00 0.00 64.05 61.75 1gg4 n THR 106 Cb 0.59 0.04 0.00 0.00 -1.82 0.00 0.00 70.33 69.14 1gg4 n THR 106 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1gg4 n GLY 107 N -0.02 0.62 0.10 3.41 0.00 -1.26 -1.27 105.19 106.76 1gg4 n GLY 107 Ca 0.00 -1.63 -0.10 0.00 0.00 0.00 0.00 46.02 44.29 1gg4 n GLY 107 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1gg4 n SER 108 N 0.00 0.48 -3.89 1.61 7.64 -0.78 -4.90 113.62 113.78 1gg4 n SER 108 Ca 0.00 0.15 -0.11 0.00 1.01 0.00 0.00 58.87 59.93 1gg4 n SER 108 Cb 0.00 0.49 -0.10 0.00 -1.01 0.00 0.00 64.21 63.59 1gg4 n SER 108 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1gg4 s SER 109 N -5.80 0.08 0.00 6.43 1.04 -1.26 -4.90 113.70 109.28 1gg4 s SER 109 Ca -0.10 -0.32 0.00 0.00 0.48 0.00 0.00 55.95 56.02 1gg4 s SER 109 Cb 0.07 0.20 0.00 0.00 0.10 0.00 0.00 66.02 66.39 1gg4 s SER 109 CO 0.82 -0.40 0.00 0.61 0.98 0.00 0.00 173.24 175.24 1gg4 n GLY 110 N 1.28 0.68 0.25 7.32 0.00 -1.26 -4.60 105.19 108.86 1gg4 n GLY 110 Ca -0.22 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.78 1gg4 n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gg4 h LYS 111 N 2.00 0.63 -0.50 1.61 1.57 -1.90 -0.78 116.57 119.19 1gg4 h LYS 111 Ca 0.00 -0.04 -0.11 0.00 -1.87 0.00 0.00 60.65 58.63 1gg4 h LYS 111 Cb 0.00 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.15 1gg4 h LYS 111 CO 0.00 0.41 -0.12 1.15 -0.57 0.00 0.00 179.45 180.33 1gg4 h THR 112 N 0.64 1.27 0.03 -0.16 2.02 -1.95 -1.09 112.91 113.67 1gg4 h THR 112 Ca 0.28 -1.24 -0.23 0.00 0.77 0.00 0.00 66.41 65.98 1gg4 h THR 112 Cb 0.17 1.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.58 1gg4 h THR 112 CO -0.17 0.43 -1.00 0.77 0.37 0.00 0.00 175.52 175.91 1gg4 h SER 113 N 0.84 0.48 -0.29 4.18 4.64 -1.90 -1.11 113.55 120.39 1gg4 h SER 113 Ca 0.13 -0.41 -0.14 0.00 -0.47 0.00 0.00 61.79 60.90 1gg4 h SER 113 Cb 0.65 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 1gg4 h SER 113 CO 0.05 1.23 -0.34 0.58 -0.87 0.00 0.00 176.83 177.48 1gg4 h VAL 114 N 0.18 1.28 0.47 0.95 2.07 -1.11 -3.14 116.25 116.95 1gg4 h VAL 114 Ca -0.09 -1.50 -0.02 0.00 0.82 0.00 0.00 66.70 65.91 1gg4 h VAL 114 Cb 1.66 1.36 -0.00 0.00 -1.52 0.00 0.00 31.29 32.79 1gg4 h VAL 114 CO 0.17 0.50 -0.26 0.50 0.02 0.00 0.00 177.57 178.50 1gg4 h LYS 115 N 0.68 -0.65 -0.96 1.57 3.64 -1.15 0.11 116.57 119.81 1gg4 h LYS 115 Ca 0.07 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 1gg4 h LYS 115 Cb 0.89 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.86 1gg4 h LYS 115 CO 0.08 -0.43 0.00 0.39 -2.27 0.00 0.00 179.45 177.22 1gg4 n GLU 116 N -5.39 0.07 0.00 1.90 1.02 -0.42 0.08 120.64 117.89 1gg4 n GLU 116 Ca -0.11 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.03 1gg4 n GLU 116 Cb 0.29 -1.24 0.00 0.00 -0.02 0.00 0.00 31.44 30.47 1gg4 n GLU 116 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1gg4 n THR 118 N 0.70 0.00 -0.28 2.62 -1.04 0.39 -1.03 114.28 115.65 1gg4 n THR 118 Ca 0.00 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 61.96 1gg4 n THR 118 Cb 0.03 0.00 0.06 0.00 -1.82 0.00 0.00 70.33 68.60 1gg4 n THR 118 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1gg4 h ALA 119 N 0.00 1.00 -0.82 2.41 0.00 -0.59 -1.25 119.26 120.00 1gg4 h ALA 119 Ca 0.00 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.77 1gg4 h ALA 119 Cb 0.00 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.44 1gg4 h ALA 119 CO 0.00 0.56 0.54 0.00 0.00 0.00 0.00 179.25 180.36 1gg4 h ALA 120 N 1.19 1.43 -0.00 0.00 0.00 -1.31 -1.56 119.26 119.00 1gg4 h ALA 120 Ca 0.27 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 1gg4 h ALA 120 Cb 0.12 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.58 1gg4 h ALA 120 CO -0.03 0.53 -0.01 0.82 0.00 0.00 0.00 179.25 180.55 1gg4 h ILE 121 N 1.10 1.62 0.00 0.00 2.04 -1.71 -3.28 117.51 117.28 1gg4 h ILE 121 Ca 0.30 -1.85 -0.01 0.00 1.00 0.00 0.00 64.86 64.31 1gg4 h ILE 121 Cb -0.11 2.87 -0.00 0.00 -0.74 0.00 0.00 36.82 38.84 1gg4 h ILE 121 CO -0.07 0.48 -0.06 -0.07 0.00 0.00 0.00 178.15 178.43 1gg4 h LEU 122 N -0.77 0.00 -2.20 1.44 3.38 -1.14 -0.99 115.31 115.03 1gg4 h LEU 122 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1gg4 h LEU 122 Cb 0.79 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.54 1gg4 h LEU 122 CO 0.00 0.06 -0.05 0.28 0.09 0.00 0.00 178.44 178.82 1gg4 h SER 123 N 0.00 0.00 1.87 -0.43 0.02 -1.34 0.35 113.55 114.02 1gg4 h SER 123 Ca -0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1gg4 h SER 123 Cb 0.19 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.73 1gg4 h SER 123 CO 0.01 0.05 -0.02 1.56 -1.14 0.00 0.00 176.83 177.29 1gg4 h GLN 124 N 0.00 0.00 0.09 3.45 1.08 -1.30 -3.32 115.11 115.11 1gg4 h GLN 124 Ca -0.00 0.00 -0.35 0.00 -1.45 0.00 0.00 58.65 56.85 1gg4 h GLN 124 Cb 0.23 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.63 1gg4 h GLN 124 CO 0.01 0.02 -1.98 0.00 -0.95 0.00 0.00 178.83 175.93 1gg4 n GLY 126 N 1.92 -1.19 3.60 0.00 0.00 -0.43 -5.11 105.19 103.97 1gg4 n GLY 126 Ca -0.30 -1.00 -0.44 0.00 0.00 0.00 0.00 46.02 44.28 1gg4 n GLY 126 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1gg4 n ASN 127 N 0.17 3.31 -4.30 1.61 2.85 -1.26 -4.13 115.26 113.51 1gg4 n ASN 127 Ca 0.00 0.39 -0.29 0.00 -0.11 0.00 0.00 54.58 54.58 1gg4 n ASN 127 Cb 0.00 -1.51 -0.15 0.00 1.24 0.00 0.00 39.78 39.36 1gg4 n ASN 127 CO 0.00 0.00 0.00 0.28 -2.11 0.00 0.00 177.26 175.43 1gg4 s THR 128 N 7.29 1.93 -0.09 -0.44 -1.32 -1.26 0.30 115.64 122.04 1gg4 s THR 128 Ca 0.99 -1.21 0.01 0.00 -1.21 0.00 0.00 61.69 60.27 1gg4 s THR 128 Cb -0.43 -1.64 -0.02 0.00 -1.51 0.00 0.00 72.50 68.90 1gg4 s THR 128 CO 0.39 0.38 -0.12 -0.22 -2.21 0.00 0.00 174.62 172.85 1gg4 s LEU 129 N -0.98 2.84 0.10 9.08 0.20 -0.88 -4.99 118.68 124.06 1gg4 s LEU 129 Ca 0.10 -0.21 0.02 0.00 0.69 0.00 0.00 54.13 54.73 1gg4 s LEU 129 Cb -0.09 -1.62 -0.04 0.00 -0.43 0.00 0.00 46.19 44.01 1gg4 s LEU 129 CO 0.01 0.27 -0.07 -0.72 -0.29 0.00 0.00 176.35 175.55 1gg4 s TYR 130 N -0.28 0.91 0.29 5.38 -0.85 -1.26 0.19 117.35 121.73 1gg4 s TYR 130 Ca 0.02 -0.90 -0.30 0.00 -0.52 0.00 0.00 57.07 55.38 1gg4 s TYR 130 Cb -0.13 -0.52 -0.13 0.00 0.38 0.00 0.00 41.96 41.56 1gg4 s TYR 130 CO 0.03 -0.13 1.37 2.41 -1.52 0.00 0.00 175.55 177.70 1gg4 n THR 131 N -0.02 1.46 -3.33 -3.49 -1.04 -0.82 -4.95 114.28 102.09 1gg4 n THR 131 Ca -0.12 -0.37 -0.38 0.00 -2.04 0.00 0.00 64.05 61.14 1gg4 n THR 131 Cb 0.61 -1.57 -0.06 0.00 -1.82 0.00 0.00 70.33 67.48 1gg4 n THR 131 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1gg4 s ALA 132 N -0.55 3.51 0.00 2.41 0.00 -1.26 -4.92 121.76 120.95 1gg4 s ALA 132 Ca 0.62 -0.31 0.00 0.00 0.00 0.00 0.00 51.96 52.27 1gg4 s ALA 132 Cb -0.59 -2.65 0.00 0.00 0.00 0.00 0.00 23.12 19.87 1gg4 s ALA 132 CO 0.56 -0.12 0.00 0.41 0.00 0.00 0.00 175.76 176.60 1gg4 n GLY 133 N 3.50 3.60 2.32 0.00 0.00 -1.26 -2.68 105.19 110.67 1gg4 n GLY 133 Ca -0.07 -0.09 -0.25 0.00 0.00 0.00 0.00 46.02 45.61 1gg4 n GLY 133 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1gg4 n ASN 134 N 4.97 4.68 -4.24 1.61 4.13 -1.26 -4.92 115.26 120.23 1gg4 n ASN 134 Ca 0.00 -3.69 -0.43 0.00 1.68 0.00 0.00 54.58 52.14 1gg4 n ASN 134 Cb 0.00 -0.42 0.00 0.00 -1.54 0.00 0.00 39.78 37.82 1gg4 n ASN 134 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1gg4 n LEU 135 N -0.56 5.76 -0.01 3.41 4.77 -1.09 -4.60 117.00 124.67 1gg4 n LEU 135 Ca 0.40 -4.52 0.01 0.00 -0.03 0.00 0.00 56.01 51.87 1gg4 n LEU 135 Cb 0.78 -1.57 0.01 0.00 -2.33 0.00 0.00 43.42 40.31 1gg4 n LEU 135 CO 0.35 0.96 0.47 -0.46 -1.33 0.00 0.00 177.39 177.38 1gg4 n ASN 136 N 5.02 1.74 -1.62 -1.43 0.23 -1.26 -3.52 115.26 114.42 1gg4 n ASN 136 Ca 0.38 -1.97 0.00 0.00 -0.53 0.00 0.00 54.58 52.46 1gg4 n ASN 136 Cb 0.40 -0.04 0.00 0.00 -2.08 0.00 0.00 39.78 38.06 1gg4 n ASN 136 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 1gg4 n ASN 137 N -0.51 0.00 0.19 0.53 2.04 -1.26 -0.98 115.26 115.27 1gg4 n ASN 137 Ca 0.01 -0.74 0.14 0.00 -0.44 0.00 0.00 54.58 53.55 1gg4 n ASN 137 Cb 0.32 0.00 0.66 0.00 -2.53 0.00 0.00 39.78 38.23 1gg4 n ASN 137 CO 0.00 0.00 0.00 -2.24 -0.44 0.00 0.00 177.26 174.58 1gg4 h ASP 138 N 0.00 0.00 0.00 0.53 3.04 -1.92 -0.67 116.42 117.41 1gg4 h ASP 138 Ca 0.00 0.00 -0.40 0.00 -3.24 0.00 0.00 57.03 53.39 1gg4 h ASP 138 Cb 0.00 0.00 -0.07 0.00 -1.04 0.00 0.00 39.33 38.22 1gg4 h ASP 138 CO 0.00 0.00 -2.43 -0.38 -2.04 0.00 0.00 179.24 174.39 1gg4 n ILE 139 N -2.45 1.43 -0.03 4.15 2.08 -1.26 -4.34 119.36 118.95 1gg4 n ILE 139 Ca -0.00 -0.49 -0.05 0.00 0.56 0.00 0.00 62.75 62.76 1gg4 n ILE 139 Cb 0.13 -1.53 0.15 0.00 -0.75 0.00 0.00 39.64 37.64 1gg4 n ILE 139 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 1gg4 h GLY 140 N 1.02 0.66 0.72 7.39 0.00 -1.76 -3.19 103.07 107.92 1gg4 h GLY 140 Ca -0.59 -0.55 -0.01 0.00 0.00 0.00 0.00 47.33 46.19 1gg4 h GLY 140 CO -0.19 0.50 -0.07 -2.08 0.00 0.00 0.00 176.54 174.71 1gg4 h VAL 141 N 0.54 0.99 0.00 4.60 2.07 -1.16 0.07 116.25 123.35 1gg4 h VAL 141 Ca 0.08 -0.58 0.00 0.00 0.82 0.00 0.00 66.70 67.01 1gg4 h VAL 141 Cb 0.69 1.35 0.00 0.00 -1.52 0.00 0.00 31.29 31.81 1gg4 h VAL 141 CO 0.05 0.14 0.00 -2.65 0.02 0.00 0.00 177.57 175.13 1gg4 n PRO 142 N -5.05 0.00 0.00 1.57 -0.02 -1.21 0.16 135.00 130.46 1gg4 n PRO 142 Ca -0.09 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.39 1gg4 n PRO 142 Cb 0.20 -1.07 0.00 0.00 -0.02 0.00 0.00 33.50 32.61 1gg4 n PRO 142 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1gg4 n THR 144 N 0.67 0.00 -0.31 3.45 -1.04 0.01 0.16 114.28 117.22 1gg4 n THR 144 Ca 0.00 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 61.96 1gg4 n THR 144 Cb 0.00 0.00 0.08 0.00 -1.82 0.00 0.00 70.33 68.59 1gg4 n THR 144 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1gg4 h LEU 145 N 0.00 1.11 -1.06 -4.42 3.38 -0.54 -2.38 115.31 111.41 1gg4 h LEU 145 Ca 0.00 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.83 1gg4 h LEU 145 Cb 0.00 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 40.46 1gg4 h LEU 145 CO 0.00 0.95 0.00 0.18 0.09 0.00 0.00 178.44 179.66 1gg4 n LEU 146 N -4.30 0.49 -0.16 1.67 4.32 0.12 -1.57 117.00 117.58 1gg4 n LEU 146 Ca 0.08 0.70 0.15 0.00 -0.02 0.00 0.00 56.01 56.92 1gg4 n LEU 146 Cb 0.15 -0.73 0.73 0.00 -1.62 0.00 0.00 43.42 41.95 1gg4 n LEU 146 CO 0.40 -0.79 0.97 0.54 -1.22 0.00 0.00 177.39 177.29 1gg4 n ARG 147 N -2.13 1.05 -2.23 3.23 1.74 -0.90 -4.75 116.66 112.68 1gg4 n ARG 147 Ca -0.00 -0.32 -0.35 0.00 -0.77 0.00 0.00 57.85 56.40 1gg4 n ARG 147 Cb 0.07 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.02 1gg4 n ARG 147 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1gg4 s LEU 148 N -2.16 3.77 0.13 0.55 1.43 -0.61 -5.06 118.68 116.72 1gg4 s LEU 148 Ca 0.39 2.22 -0.09 0.00 -1.03 0.00 0.00 54.13 55.62 1gg4 s LEU 148 Cb 0.21 -4.55 -0.01 0.00 0.03 0.00 0.00 46.19 41.88 1gg4 s LEU 148 CO 0.40 -1.23 0.23 0.42 0.23 0.00 0.00 176.35 176.39 1gg4 s THR 149 N -1.72 0.10 -0.05 5.49 -4.23 -1.26 -4.37 115.64 109.60 1gg4 s THR 149 Ca 0.72 -1.30 0.28 0.00 -1.18 0.00 0.00 61.69 60.22 1gg4 s THR 149 Cb -0.25 -1.60 0.29 0.00 1.34 0.00 0.00 72.50 72.28 1gg4 s THR 149 CO 0.29 -0.47 1.86 -0.65 -0.54 0.00 0.00 174.62 175.11 1gg4 h PRO 150 N 2.65 0.00 0.00 3.99 0.11 -1.97 -2.43 132.00 134.35 1gg4 h PRO 150 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1gg4 h PRO 150 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1gg4 h PRO 150 CO 0.52 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 179.24 1gg4 h GLU 151 N 0.00 0.00 -6.78 1.05 3.07 -1.99 -3.44 114.58 106.48 1gg4 h GLU 151 Ca 0.00 0.00 -0.49 0.00 -0.50 0.00 0.00 59.36 58.37 1gg4 h GLU 151 Cb 0.15 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.05 1gg4 h GLU 151 CO 0.00 0.00 0.39 0.71 -1.40 0.00 0.00 179.01 178.71 1gg4 s TYR 152 N -3.29 3.84 -0.22 4.33 2.02 -0.92 -4.74 117.35 118.37 1gg4 s TYR 152 Ca 0.06 1.84 0.12 0.00 -0.37 0.00 0.00 57.07 58.73 1gg4 s TYR 152 Cb 0.09 -3.07 -0.22 0.00 -0.40 0.00 0.00 41.96 38.36 1gg4 s TYR 152 CO 0.58 0.13 -0.03 -0.25 -1.57 0.00 0.00 175.55 174.41 1gg4 n ASP 153 N 1.31 0.72 -4.12 2.29 10.43 0.15 -3.95 116.55 123.37 1gg4 n ASP 153 Ca -0.01 -0.04 -0.08 0.00 2.57 0.00 0.00 54.79 57.22 1gg4 n ASP 153 Cb 0.47 0.48 -0.10 0.00 1.84 0.00 0.00 41.12 43.81 1gg4 n ASP 153 CO 0.00 0.00 0.00 -0.31 -1.07 0.00 0.00 177.20 175.82 1gg4 s TYR 154 N -2.50 0.67 -0.17 1.24 1.51 -0.87 -0.87 117.35 116.35 1gg4 s TYR 154 Ca -0.19 -1.09 -0.06 0.00 -1.01 0.00 0.00 57.07 54.72 1gg4 s TYR 154 Cb 0.07 -0.44 0.08 0.00 -0.11 0.00 0.00 41.96 41.56 1gg4 s TYR 154 CO 0.75 -0.38 0.37 0.00 -1.11 0.00 0.00 175.55 175.18 1gg4 s ALA 155 N -3.91 -0.95 -0.47 3.71 0.00 0.10 -2.07 121.76 118.17 1gg4 s ALA 155 Ca 0.12 1.33 -0.11 0.00 0.00 0.00 0.00 51.96 53.30 1gg4 s ALA 155 Cb 0.08 -1.17 0.10 0.00 0.00 0.00 0.00 23.12 22.13 1gg4 s ALA 155 CO -0.06 -0.65 0.35 0.08 0.00 0.00 0.00 175.76 175.48 1gg4 s VAL 156 N 2.38 4.51 -0.40 0.00 1.01 0.13 -0.80 120.40 127.23 1gg4 s VAL 156 Ca -0.02 -1.54 -0.17 0.00 0.00 0.00 0.00 61.98 60.25 1gg4 s VAL 156 Cb -0.12 -3.86 0.01 0.00 0.00 0.00 0.00 36.38 32.42 1gg4 s VAL 156 CO -0.11 -0.69 0.43 -0.63 0.00 0.00 0.00 175.10 174.09 1gg4 s ILE 157 N 1.45 5.10 -0.03 2.22 -1.09 0.41 -1.95 121.20 127.31 1gg4 s ILE 157 Ca 0.04 -0.19 -0.24 0.00 -2.23 0.00 0.00 60.65 58.03 1gg4 s ILE 157 Cb -0.26 -3.98 -0.04 0.00 -1.58 0.00 0.00 42.46 36.60 1gg4 s ILE 157 CO 0.02 -0.33 0.74 -0.70 -1.23 0.00 0.00 174.94 173.43 1gg4 s GLU 158 N 2.14 4.46 -0.11 2.79 2.12 -1.26 -2.08 118.70 126.77 1gg4 s GLU 158 Ca 0.13 0.97 0.03 0.00 0.36 0.00 0.00 54.97 56.46 1gg4 s GLU 158 Cb -0.17 -3.42 -0.01 0.00 0.26 0.00 0.00 34.13 30.79 1gg4 s GLU 158 CO 0.13 0.12 -0.20 -0.51 -0.54 0.00 0.00 175.26 174.26 1gg4 s LEU 159 N 0.56 2.31 0.37 2.70 1.43 0.43 -4.42 118.68 122.06 1gg4 s LEU 159 Ca 0.39 -0.47 0.08 0.00 -1.03 0.00 0.00 54.13 53.10 1gg4 s LEU 159 Cb -0.19 -1.48 -0.06 0.00 0.03 0.00 0.00 46.19 44.50 1gg4 s LEU 159 CO 0.20 0.17 0.06 -0.83 0.23 0.00 0.00 176.35 176.18 1gg4 s GLY 160 N 0.29 2.21 -0.11 -3.19 0.00 -0.15 -4.27 107.32 102.10 1gg4 s GLY 160 Ca -0.15 -2.06 -0.20 0.00 0.00 0.00 0.00 44.72 42.31 1gg4 s GLY 160 CO 0.07 -1.94 0.49 0.00 0.00 0.00 0.00 173.10 171.73 1gg4 s ALA 161 N -2.57 -1.24 0.00 3.20 0.00 -1.26 -4.51 121.76 115.37 1gg4 s ALA 161 Ca 0.36 1.10 0.00 0.00 0.00 0.00 0.00 51.96 53.43 1gg4 s ALA 161 Cb 0.03 -0.40 0.00 0.00 0.00 0.00 0.00 23.12 22.75 1gg4 s ALA 161 CO 0.20 -0.28 0.00 0.09 0.00 0.00 0.00 175.76 175.77 1gg4 n ASN 162 N 1.96 4.11 -4.19 0.00 3.02 -1.26 -5.07 115.26 113.83 1gg4 n ASN 162 Ca -0.17 0.00 -0.25 0.00 -0.03 0.00 0.00 54.58 54.13 1gg4 n ASN 162 Cb 0.56 0.19 -0.08 0.00 -0.61 0.00 0.00 39.78 39.84 1gg4 n ASN 162 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1gg4 s HIS 163 N -1.93 1.81 0.54 3.10 3.76 -1.26 -5.11 115.29 116.19 1gg4 s HIS 163 Ca 0.00 -1.23 -0.10 0.00 -0.15 0.00 0.00 55.06 53.58 1gg4 s HIS 163 Cb 0.00 -1.19 -0.05 0.00 1.11 0.00 0.00 32.58 32.45 1gg4 s HIS 163 CO 0.00 -0.24 0.92 -0.65 -0.85 0.00 0.00 174.74 173.93 1gg4 s GLN 164 N -3.74 3.66 0.00 1.40 -0.21 -1.26 -3.86 119.66 115.65 1gg4 s GLN 164 Ca 0.24 0.59 0.00 0.00 0.02 0.00 0.00 55.36 56.22 1gg4 s GLN 164 Cb 0.03 -2.21 0.00 0.00 1.00 0.00 0.00 33.01 31.83 1gg4 s GLN 164 CO 0.14 -0.35 0.00 0.41 -2.12 0.00 0.00 175.29 173.37 1gg4 n GLY 165 N -2.24 2.81 0.12 3.09 0.00 -1.26 -4.89 105.19 102.82 1gg4 n GLY 165 Ca 0.04 -0.01 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 1gg4 n GLY 165 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1gg4 h GLU 166 N 0.00 -0.22 -0.35 1.61 5.08 -1.95 -2.37 114.58 116.37 1gg4 h GLU 166 Ca 0.00 0.02 -0.10 0.00 -1.00 0.00 0.00 59.36 58.28 1gg4 h GLU 166 Cb 0.00 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 1gg4 h GLU 166 CO 0.00 -0.15 -0.19 0.82 -1.00 0.00 0.00 179.01 178.49 1gg4 h ILE 167 N -0.23 1.26 -0.74 3.13 2.04 -1.83 -2.76 117.51 118.38 1gg4 h ILE 167 Ca -0.02 -1.24 0.12 0.00 1.00 0.00 0.00 64.86 64.71 1gg4 h ILE 167 Cb 0.18 1.20 -0.08 0.00 -0.74 0.00 0.00 36.82 37.37 1gg4 h ILE 167 CO 0.04 0.41 0.35 0.00 0.00 0.00 0.00 178.15 178.95 1gg4 h ALA 168 N 1.20 1.05 0.52 1.87 0.00 -1.78 -0.59 119.26 121.52 1gg4 h ALA 168 Ca 0.09 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 1gg4 h ALA 168 Cb 0.65 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.45 1gg4 h ALA 168 CO 0.05 -0.11 -0.25 2.35 0.00 0.00 0.00 179.25 181.29 1gg4 h TRP 169 N 0.55 -0.65 -0.37 0.00 2.91 -1.19 -2.93 115.95 114.29 1gg4 h TRP 169 Ca 0.39 -0.02 -0.03 0.00 1.13 0.00 0.00 58.89 60.36 1gg4 h TRP 169 Cb 0.49 0.21 -0.02 0.00 -0.51 0.00 0.00 29.16 29.34 1gg4 h TRP 169 CO -0.12 -0.34 0.11 1.79 -1.03 0.00 0.00 178.44 178.85 1gg4 h THR 170 N -0.87 1.16 0.00 2.65 1.35 -1.17 -1.92 112.91 114.12 1gg4 h THR 170 Ca -0.07 -0.55 -0.09 0.00 -0.55 0.00 0.00 66.41 65.15 1gg4 h THR 170 Cb 0.60 0.77 -0.01 0.00 -1.73 0.00 0.00 68.15 67.77 1gg4 h THR 170 CO 0.12 0.20 -0.42 -0.37 -0.25 0.00 0.00 175.52 174.80 1gg4 h VAL 171 N 0.52 0.95 -0.33 6.82 -1.51 -1.19 -1.28 116.25 120.22 1gg4 h VAL 171 Ca 0.13 -1.67 -0.09 0.00 -1.23 0.00 0.00 66.70 63.84 1gg4 h VAL 171 Cb 0.17 2.00 -0.02 0.00 -2.13 0.00 0.00 31.29 31.32 1gg4 h VAL 171 CO -0.01 0.41 -0.15 0.77 -1.23 0.00 0.00 177.57 177.36 1gg4 h SER 172 N 0.00 0.58 -0.05 4.19 4.64 -1.15 0.25 113.55 122.01 1gg4 h SER 172 Ca -0.00 -0.17 -0.05 0.00 -0.47 0.00 0.00 61.79 61.09 1gg4 h SER 172 Cb 0.97 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 1gg4 h SER 172 CO 0.05 0.75 -0.17 -0.07 -0.87 0.00 0.00 176.83 176.53 1gg4 h LEU 173 N 0.53 0.24 -0.60 5.97 3.38 -1.23 -3.32 115.31 120.28 1gg4 h LEU 173 Ca 0.09 -0.62 -0.11 0.00 0.09 0.00 0.00 57.88 57.34 1gg4 h LEU 173 Cb 0.57 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 1gg4 h LEU 173 CO 0.04 0.82 -0.08 0.74 0.09 0.00 0.00 178.44 180.05 1gg4 h THR 174 N -0.32 1.27 -6.80 0.22 2.02 -1.12 -3.40 112.91 104.78 1gg4 h THR 174 Ca -0.01 -1.23 -0.55 0.00 0.77 0.00 0.00 66.41 65.39 1gg4 h THR 174 Cb 0.80 0.92 0.00 0.00 -1.74 0.00 0.00 68.15 68.13 1gg4 h THR 174 CO 0.04 0.44 -1.01 0.54 0.37 0.00 0.00 175.52 175.90 1gg4 n ARG 175 N -4.15 -0.57 -2.45 6.66 5.12 0.87 -4.90 116.66 117.24 1gg4 n ARG 175 Ca 0.02 0.24 -0.35 0.00 -1.93 0.00 0.00 57.85 55.83 1gg4 n ARG 175 Cb 0.39 -2.72 -0.03 0.00 -1.16 0.00 0.00 32.46 28.94 1gg4 n ARG 175 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1gg4 s PRO 176 N -6.82 3.81 0.41 5.56 0.04 -1.24 -4.91 135.00 131.84 1gg4 s PRO 176 Ca 0.41 1.51 0.22 0.00 0.04 0.00 0.00 61.00 63.18 1gg4 s PRO 176 Cb -0.22 -2.25 0.75 0.00 0.04 0.00 0.00 34.50 32.83 1gg4 s PRO 176 CO 0.95 -0.45 1.75 0.93 0.04 0.00 0.00 177.00 180.22 1gg4 h GLU 177 N 1.82 0.00 -3.23 4.56 5.08 -1.12 -3.36 114.58 118.33 1gg4 h GLU 177 Ca -0.49 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 57.70 1gg4 h GLU 177 Cb 1.23 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 30.23 1gg4 h GLU 177 CO 0.60 0.29 -0.45 0.00 -1.00 0.00 0.00 179.01 178.44 1gg4 s ALA 178 N -3.56 -0.53 0.01 3.43 0.00 -1.26 -1.97 121.76 117.89 1gg4 s ALA 178 Ca 0.01 0.51 0.04 0.00 0.00 0.00 0.00 51.96 52.51 1gg4 s ALA 178 Cb 0.10 -0.28 -0.01 0.00 0.00 0.00 0.00 23.12 22.93 1gg4 s ALA 178 CO 0.66 -0.13 -0.11 0.00 0.00 0.00 0.00 175.76 176.18 1gg4 s ALA 179 N -0.15 0.94 -0.02 0.00 0.00 -0.98 -1.71 121.76 119.85 1gg4 s ALA 179 Ca -0.03 -0.57 0.03 0.00 0.00 0.00 0.00 51.96 51.40 1gg4 s ALA 179 Cb -0.02 -0.20 -0.00 0.00 0.00 0.00 0.00 23.12 22.89 1gg4 s ALA 179 CO 0.01 0.21 -0.10 -1.17 0.00 0.00 0.00 175.76 174.70 1gg4 s LEU 180 N -0.54 1.94 -0.32 0.00 0.20 -0.53 -1.73 118.68 117.69 1gg4 s LEU 180 Ca 0.03 -0.20 -0.03 0.00 0.69 0.00 0.00 54.13 54.62 1gg4 s LEU 180 Cb -0.05 -0.57 0.05 0.00 -0.43 0.00 0.00 46.19 45.19 1gg4 s LEU 180 CO 0.00 0.11 0.04 -0.69 -0.29 0.00 0.00 176.35 175.52 1gg4 s VAL 181 N -0.09 3.20 0.23 1.68 1.01 -1.13 0.01 120.40 125.31 1gg4 s VAL 181 Ca 0.01 -1.36 -0.02 0.00 0.00 0.00 0.00 61.98 60.61 1gg4 s VAL 181 Cb -0.06 -2.85 0.05 0.00 0.00 0.00 0.00 36.38 33.51 1gg4 s VAL 181 CO -0.00 -0.16 1.66 -1.13 0.00 0.00 0.00 175.10 175.47 1gg4 h ASN 182 N 8.06 0.71 -5.92 3.32 -0.00 -1.51 -3.27 115.58 116.96 1gg4 h ASN 182 Ca -0.21 -0.25 0.39 0.00 -0.00 0.00 0.00 56.30 56.23 1gg4 h ASN 182 Cb 1.07 -0.19 -0.14 0.00 -0.00 0.00 0.00 38.32 39.05 1gg4 h ASN 182 CO 0.56 0.91 0.97 0.54 -0.00 0.00 0.00 177.43 180.41 1gg4 s ASN 183 N -6.76 -0.01 0.09 1.15 2.20 -1.26 -4.58 114.94 105.77 1gg4 s ASN 183 Ca -0.09 -0.02 0.08 0.00 -0.94 0.00 0.00 52.86 51.89 1gg4 s ASN 183 Cb 0.13 0.03 -0.03 0.00 -2.00 0.00 0.00 41.25 39.38 1gg4 s ASN 183 CO 0.82 -0.05 -0.20 -0.76 -2.94 0.00 0.00 177.10 173.97 1gg4 s LEU 184 N -2.98 2.28 -0.37 3.54 1.43 -1.26 -1.86 118.68 119.47 1gg4 s LEU 184 Ca 0.15 -0.66 0.06 0.00 -1.03 0.00 0.00 54.13 52.65 1gg4 s LEU 184 Cb 0.07 -0.85 0.25 0.00 0.03 0.00 0.00 46.19 45.70 1gg4 s LEU 184 CO -0.06 0.05 1.23 0.00 0.23 0.00 0.00 176.35 177.80 1gg4 n ALA 185 N 1.20 -0.37 -0.50 4.21 0.00 -1.26 -4.94 120.51 118.85 1gg4 n ALA 185 Ca -0.19 -0.93 -0.19 0.00 0.00 0.00 0.00 53.44 52.13 1gg4 n ALA 185 Cb 0.54 -1.06 0.16 0.00 0.00 0.00 0.00 19.45 19.08 1gg4 n ALA 185 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1gg4 n SER 194 N -0.51 -3.09 -0.33 0.00 7.64 -1.26 -4.98 113.62 111.08 1gg4 n SER 194 Ca -0.13 -0.43 0.19 0.00 1.01 0.00 0.00 58.87 59.52 1gg4 n SER 194 Cb 0.76 -0.78 0.38 0.00 -1.01 0.00 0.00 64.21 63.55 1gg4 n SER 194 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1gg4 h LEU 195 N -2.77 -0.12 -1.09 -3.43 5.85 -2.04 0.20 115.31 111.91 1gg4 h LEU 195 Ca -0.25 0.25 0.10 0.00 0.84 0.00 0.00 57.88 58.82 1gg4 h LEU 195 Cb 0.80 0.37 -0.07 0.00 0.37 0.00 0.00 40.66 42.12 1gg4 h LEU 195 CO 0.16 -0.32 0.61 0.00 -0.34 0.00 0.00 178.44 178.55 1gg4 h ALA 196 N 1.94 1.54 -0.47 1.25 0.00 -1.99 0.68 119.26 122.22 1gg4 h ALA 196 Ca 0.66 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.50 1gg4 h ALA 196 Cb 1.49 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 1gg4 h ALA 196 CO -0.81 0.26 0.02 0.78 0.00 0.00 0.00 179.25 179.50 1gg4 h GLY 197 N 0.99 0.81 1.46 0.00 0.00 -1.03 0.18 103.07 105.48 1gg4 h GLY 197 Ca 0.45 -0.52 -0.19 0.00 0.00 0.00 0.00 47.33 47.07 1gg4 h GLY 197 CO -0.20 0.48 -0.69 -0.39 0.00 0.00 0.00 176.54 175.74 1gg4 h VAL 198 N 0.71 1.34 -0.52 4.60 -1.51 -1.05 -2.01 116.25 117.80 1gg4 h VAL 198 Ca 0.14 -2.01 -0.03 0.00 -1.23 0.00 0.00 66.70 63.58 1gg4 h VAL 198 Cb 0.41 1.99 -0.02 0.00 -2.13 0.00 0.00 31.29 31.53 1gg4 h VAL 198 CO 0.01 0.62 0.22 0.00 -1.23 0.00 0.00 177.57 177.19 1gg4 h ALA 199 N 0.85 0.68 -0.21 5.19 0.00 -0.32 -0.64 119.26 124.82 1gg4 h ALA 199 Ca -0.03 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.75 1gg4 h ALA 199 Cb 1.27 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1gg4 h ALA 199 CO 0.13 0.28 0.07 -0.22 0.00 0.00 0.00 179.25 179.51 1gg4 h LYS 200 N 0.71 0.16 0.88 0.00 1.63 -0.58 0.31 116.57 119.68 1gg4 h LYS 200 Ca 0.18 -0.01 -0.04 0.00 -0.85 0.00 0.00 60.65 59.92 1gg4 h LYS 200 Cb 0.18 -0.04 0.01 0.00 -0.60 0.00 0.00 32.23 31.78 1gg4 h LYS 200 CO -0.02 0.11 -0.44 0.00 -3.45 0.00 0.00 179.45 175.65 1gg4 h ALA 201 N 1.13 -1.31 -0.44 5.00 0.00 -0.93 -2.71 119.26 120.00 1gg4 h ALA 201 Ca 0.09 -0.26 0.08 0.00 0.00 0.00 0.00 54.91 54.82 1gg4 h ALA 201 Cb 0.06 0.50 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1gg4 h ALA 201 CO -0.09 -1.23 0.30 0.87 0.00 0.00 0.00 179.25 179.10 1gg4 h LYS 202 N -1.21 0.24 0.00 0.00 1.79 -1.10 0.54 116.57 116.83 1gg4 h LYS 202 Ca -0.12 -0.01 -0.01 0.00 -2.18 0.00 0.00 60.65 58.33 1gg4 h LYS 202 Cb 0.93 -0.05 -0.00 0.00 -1.58 0.00 0.00 32.23 31.53 1gg4 h LYS 202 CO 0.18 0.16 -0.04 0.78 -1.08 0.00 0.00 179.45 179.44 1gg4 h GLY 203 N 0.24 0.00 1.72 3.86 0.00 -0.62 -1.96 103.07 106.32 1gg4 h GLY 203 Ca 0.20 0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.57 1gg4 h GLY 203 CO -0.04 0.00 0.10 0.83 0.00 0.00 0.00 176.54 177.43 1gg4 h GLU 204 N 0.00 0.00 -0.52 4.80 5.08 -0.64 -2.48 114.58 120.82 1gg4 h GLU 204 Ca -0.00 0.00 0.15 0.00 -1.00 0.00 0.00 59.36 58.51 1gg4 h GLU 204 Cb 0.16 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1gg4 h GLU 204 CO 0.01 0.00 0.38 0.97 -1.00 0.00 0.00 179.01 179.37 1gg4 h ILE 205 N 0.00 0.71 0.00 3.13 2.10 -1.51 -0.59 117.51 121.34 1gg4 h ILE 205 Ca 0.06 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.00 1gg4 h ILE 205 Cb 0.26 0.73 0.00 0.00 -1.09 0.00 0.00 36.82 36.72 1gg4 h ILE 205 CO -0.00 0.00 0.00 -0.26 -1.08 0.00 0.00 178.15 176.81 1gg4 h PHE 206 N 0.00 0.00 0.00 2.19 0.05 -1.67 -3.11 116.94 114.40 1gg4 h PHE 206 Ca 0.25 0.00 0.00 0.00 3.82 0.00 0.00 57.97 62.04 1gg4 h PHE 206 Cb 1.01 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.96 1gg4 h PHE 206 CO 0.00 0.00 0.00 -1.13 -0.18 0.00 0.00 178.31 177.00 1gg4 n SER 207 N -2.52 0.38 -0.97 2.17 3.41 -0.23 -2.84 113.62 113.02 1gg4 n SER 207 Ca 0.02 0.58 0.11 0.00 -0.26 0.00 0.00 58.87 59.32 1gg4 n SER 207 Cb 0.27 -0.67 0.26 0.00 -0.26 0.00 0.00 64.21 63.81 1gg4 n SER 207 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1gg4 n GLY 208 N 0.27 1.27 3.76 5.00 0.00 -1.17 -4.95 105.19 109.37 1gg4 n GLY 208 Ca 0.03 -0.64 -0.39 0.00 0.00 0.00 0.00 46.02 45.03 1gg4 n GLY 208 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gg4 s LEU 209 N -1.51 4.52 0.94 0.99 1.43 -1.13 -3.71 118.68 120.20 1gg4 s LEU 209 Ca 0.36 1.92 -0.14 0.00 -1.03 0.00 0.00 54.13 55.25 1gg4 s LEU 209 Cb 0.21 -3.78 0.16 0.00 0.03 0.00 0.00 46.19 42.81 1gg4 s LEU 209 CO 0.30 0.05 1.18 -2.16 0.23 0.00 0.00 176.35 175.94 1gg4 s PRO 210 N -1.55 0.86 0.64 1.29 0.04 -1.26 -4.84 135.00 130.18 1gg4 s PRO 210 Ca 0.45 0.09 0.40 0.00 0.04 0.00 0.00 61.00 61.98 1gg4 s PRO 210 Cb -0.23 -1.83 2.24 0.00 0.04 0.00 0.00 34.50 34.72 1gg4 s PRO 210 CO 0.29 -2.34 2.33 0.93 0.04 0.00 0.00 177.00 178.25 1gg4 h GLU 211 N -1.60 0.00 -0.60 4.56 5.08 -1.99 0.32 114.58 120.35 1gg4 h GLU 211 Ca -0.48 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 1gg4 h GLU 211 Cb 1.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.56 1gg4 h GLU 211 CO 0.54 0.00 0.00 0.27 -1.00 0.00 0.00 179.01 178.83 1gg4 n ASN 212 N -3.32 3.64 -4.78 1.42 0.23 -1.26 -4.81 115.26 106.39 1gg4 n ASN 212 Ca -0.03 -1.99 -0.31 0.00 -0.53 0.00 0.00 54.58 51.72 1gg4 n ASN 212 Cb 0.08 -0.40 0.08 0.00 -2.08 0.00 0.00 39.78 37.46 1gg4 n ASN 212 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 1gg4 s GLY 213 N -1.03 1.66 -0.19 4.83 0.00 0.11 -4.90 107.32 107.80 1gg4 s GLY 213 Ca 0.41 0.12 -0.02 0.00 0.00 0.00 0.00 44.72 45.24 1gg4 s GLY 213 CO 0.29 0.48 -0.10 -0.42 0.00 0.00 0.00 173.10 173.35 1gg4 s ILE 214 N -2.98 3.01 -0.17 0.90 1.01 -0.83 -3.28 121.20 118.87 1gg4 s ILE 214 Ca 0.60 -0.63 -0.16 0.00 0.00 0.00 0.00 60.65 60.46 1gg4 s ILE 214 Cb -0.16 -2.33 -0.04 0.00 0.01 0.00 0.00 42.46 39.94 1gg4 s ILE 214 CO 0.56 0.47 0.42 0.00 0.00 0.00 0.00 174.94 176.38 1gg4 s ALA 215 N 1.21 3.54 0.23 9.38 0.00 -0.65 -2.31 121.76 133.15 1gg4 s ALA 215 Ca 0.02 -0.40 0.11 0.00 0.00 0.00 0.00 51.96 51.69 1gg4 s ALA 215 Cb -0.14 -2.62 -0.05 0.00 0.00 0.00 0.00 23.12 20.31 1gg4 s ALA 215 CO -0.04 -0.17 -0.21 0.42 0.00 0.00 0.00 175.76 175.76 1gg4 s ILE 216 N 1.02 2.32 -0.23 0.00 1.01 -0.71 0.62 121.20 125.24 1gg4 s ILE 216 Ca 0.21 -2.19 -0.07 0.00 0.00 0.00 0.00 60.65 58.61 1gg4 s ILE 216 Cb -0.15 -2.17 -0.03 0.00 0.01 0.00 0.00 42.46 40.13 1gg4 s ILE 216 CO 0.08 -0.28 0.05 0.21 0.00 0.00 0.00 174.94 175.00 1gg4 s ASN 218 N -3.05 5.10 0.35 3.58 3.04 -1.24 -2.85 114.94 119.87 1gg4 s ASN 218 Ca 0.24 -0.17 0.02 0.00 0.04 0.00 0.00 52.86 53.00 1gg4 s ASN 218 Cb -0.06 -1.90 0.63 0.00 -1.54 0.00 0.00 41.25 38.38 1gg4 s ASN 218 CO 0.12 0.02 1.98 0.00 -3.04 0.00 0.00 177.10 176.18 1gg4 h ALA 219 N 7.81 1.51 -0.01 1.71 0.00 -1.45 -2.19 119.26 126.64 1gg4 h ALA 219 Ca -0.37 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1gg4 h ALA 219 Cb 1.18 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1gg4 h ALA 219 CO 0.60 0.42 -0.01 -0.25 0.00 0.00 0.00 179.25 180.01 1gg4 n ASP 220 N -4.41 1.00 -3.05 0.00 8.00 -1.26 -4.67 116.55 112.14 1gg4 n ASP 220 Ca 0.05 -1.30 0.03 0.00 0.71 0.00 0.00 54.79 54.28 1gg4 n ASP 220 Cb 0.08 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.18 1gg4 n ASP 220 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 1gg4 s ASN 221 N -2.03 -0.97 0.10 -2.24 3.84 -0.82 -5.10 114.94 107.72 1gg4 s ASN 221 Ca 0.40 -0.25 -0.03 0.00 0.21 0.00 0.00 52.86 53.19 1gg4 s ASN 221 Cb 0.21 1.38 0.01 0.00 -0.55 0.00 0.00 41.25 42.30 1gg4 s ASN 221 CO 0.36 -0.14 0.20 -0.46 -2.79 0.00 0.00 177.10 174.27 1gg4 n ASN 222 N 4.53 -0.58 -2.65 -4.21 0.23 -1.24 -4.15 115.26 107.20 1gg4 n ASN 222 Ca 0.08 -1.44 -0.10 0.00 -0.53 0.00 0.00 54.58 52.59 1gg4 n ASN 222 Cb 0.58 0.97 0.03 0.00 -2.08 0.00 0.00 39.78 39.28 1gg4 n ASN 222 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 1gg4 n ASP 223 N -1.27 1.70 -0.34 0.53 4.64 -1.26 -4.93 116.55 115.61 1gg4 n ASP 223 Ca -0.02 -2.77 0.19 0.00 -1.38 0.00 0.00 54.79 50.81 1gg4 n ASP 223 Cb 0.16 -0.52 0.41 0.00 -1.04 0.00 0.00 41.12 40.12 1gg4 n ASP 223 CO 0.00 0.00 0.00 -0.25 -0.82 0.00 0.00 177.20 176.13 1gg4 h TRP 224 N 2.95 0.98 -0.86 -0.67 2.91 -1.97 0.12 115.95 119.42 1gg4 h TRP 224 Ca -0.07 0.04 0.22 0.00 1.13 0.00 0.00 58.89 60.21 1gg4 h TRP 224 Cb 1.16 -0.28 -0.14 0.00 -0.51 0.00 0.00 29.16 29.40 1gg4 h TRP 224 CO 0.53 0.00 0.23 1.25 -1.03 0.00 0.00 178.44 179.41 1gg4 h LEU 225 N 0.51 0.00 0.02 0.65 5.85 -2.02 -0.24 115.31 120.09 1gg4 h LEU 225 Ca 0.67 0.19 -0.36 0.00 0.84 0.00 0.00 57.88 59.22 1gg4 h LEU 225 Cb 1.33 0.25 -0.06 0.00 0.37 0.00 0.00 40.66 42.56 1gg4 h LEU 225 CO -0.51 -0.13 -2.19 0.59 -0.34 0.00 0.00 178.44 175.85 1gg4 n ASN 226 N -5.21 1.07 0.27 1.25 3.02 -0.28 -4.33 115.26 111.05 1gg4 n ASN 226 Ca 0.20 0.09 0.11 0.00 -0.03 0.00 0.00 54.58 54.96 1gg4 n ASN 226 Cb 0.64 0.08 0.75 0.00 -0.61 0.00 0.00 39.78 40.64 1gg4 n ASN 226 CO 0.00 0.00 0.00 -0.50 -2.62 0.00 0.00 177.26 174.14 1gg4 h TRP 227 N 0.01 0.00 0.00 3.10 6.55 -0.30 -2.01 115.95 123.31 1gg4 h TRP 227 Ca -0.48 0.00 -0.01 0.00 0.95 0.00 0.00 58.89 59.36 1gg4 h TRP 227 Cb 2.07 0.00 -0.00 0.00 -0.86 0.00 0.00 29.16 30.37 1gg4 h TRP 227 CO 0.02 0.06 -0.03 -0.56 -1.05 0.00 0.00 178.44 176.87 1gg4 h GLN 228 N 0.00 0.00 0.00 0.49 3.07 -1.25 0.19 115.11 117.61 1gg4 h GLN 228 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1gg4 h GLN 228 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.69 1gg4 h GLN 228 CO 0.01 0.03 0.00 0.66 0.09 0.00 0.00 178.83 179.62 1gg4 h SER 229 N 0.00 0.00 0.00 0.06 4.64 -1.62 -1.67 113.55 114.96 1gg4 h SER 229 Ca -0.00 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.14 1gg4 h SER 229 Cb 0.11 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.16 1gg4 h SER 229 CO 0.00 0.00 -1.71 0.55 -0.87 0.00 0.00 176.83 174.81 1gg4 n VAL 230 N -2.50 0.68 0.17 0.95 3.14 -0.39 -4.46 118.33 115.92 1gg4 n VAL 230 Ca 0.04 -0.43 0.05 0.00 -2.96 0.00 0.00 64.34 61.04 1gg4 n VAL 230 Cb 0.40 -0.67 0.19 0.00 -1.06 0.00 0.00 33.84 32.70 1gg4 n VAL 230 CO 0.00 0.00 0.00 0.16 -6.46 0.00 0.00 176.83 170.53 1gg4 h ILE 231 N 0.00 0.77 0.00 1.55 -0.00 -0.76 -3.42 117.51 115.65 1gg4 h ILE 231 Ca -0.27 -1.80 0.00 0.00 -0.00 0.00 0.00 64.86 62.79 1gg4 h ILE 231 Cb 1.58 2.17 0.00 0.00 -0.00 0.00 0.00 36.82 40.57 1gg4 h ILE 231 CO 0.01 0.39 0.00 0.61 -0.00 0.00 0.00 178.15 179.17 1gg4 n GLY 232 N 0.79 3.02 1.46 0.16 0.00 -0.63 -2.39 105.19 107.60 1gg4 n GLY 232 Ca 0.01 -0.20 0.11 0.00 0.00 0.00 0.00 46.02 45.94 1gg4 n GLY 232 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1gg4 n SER 233 N 6.05 4.33 -4.67 1.61 7.64 -1.26 -4.92 113.62 122.40 1gg4 n SER 233 Ca 0.00 -2.20 -0.30 0.00 1.01 0.00 0.00 58.87 57.38 1gg4 n SER 233 Cb 0.00 -0.53 0.16 0.00 -1.01 0.00 0.00 64.21 62.83 1gg4 n SER 233 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1gg4 s ARG 234 N -1.38 0.95 0.64 1.43 0.52 -1.01 -4.95 118.95 115.14 1gg4 s ARG 234 Ca 0.50 1.17 -0.18 0.00 -0.52 0.00 0.00 55.73 56.70 1gg4 s ARG 234 Cb 0.29 -1.75 -0.01 0.00 0.52 0.00 0.00 34.95 34.00 1gg4 s ARG 234 CO 0.29 -2.56 1.24 0.15 0.02 0.00 0.00 175.30 174.45 1gg4 s LYS 235 N -4.73 2.67 -0.02 3.54 1.02 -1.20 -4.90 119.74 116.11 1gg4 s LYS 235 Ca 0.65 1.90 0.02 0.00 0.02 0.00 0.00 55.97 58.56 1gg4 s LYS 235 Cb -0.21 -1.88 0.00 0.00 -0.52 0.00 0.00 37.83 35.22 1gg4 s LYS 235 CO 0.59 -1.46 -0.06 0.08 -0.92 0.00 0.00 175.35 173.57 1gg4 s VAL 236 N -1.60 0.52 -0.00 3.17 1.01 -1.26 -1.63 120.40 120.60 1gg4 s VAL 236 Ca 0.79 -0.23 0.05 0.00 0.00 0.00 0.00 61.98 62.59 1gg4 s VAL 236 Cb -0.33 -0.47 -0.01 0.00 0.00 0.00 0.00 36.38 35.57 1gg4 s VAL 236 CO 0.38 0.17 -0.17 0.26 0.00 0.00 0.00 175.10 175.74 1gg4 s TRP 237 N 0.17 1.49 -0.01 5.22 0.51 0.20 -4.93 118.94 121.59 1gg4 s TRP 237 Ca -0.02 -0.30 0.05 0.00 -2.12 0.00 0.00 56.10 53.72 1gg4 s TRP 237 Cb -0.06 -0.95 -0.01 0.00 -0.81 0.00 0.00 33.47 31.64 1gg4 s TRP 237 CO -0.00 -0.01 -0.17 1.03 -0.51 0.00 0.00 176.95 177.29 1gg4 s ARG 238 N -0.55 1.41 0.15 4.98 0.52 -1.26 -3.95 118.95 120.25 1gg4 s ARG 238 Ca 0.06 -0.61 0.11 0.00 -0.52 0.00 0.00 55.73 54.76 1gg4 s ARG 238 Cb -0.07 -1.36 -0.04 0.00 0.52 0.00 0.00 34.95 34.00 1gg4 s ARG 238 CO -0.00 0.36 -0.25 -0.59 0.02 0.00 0.00 175.30 174.84 1gg4 s PHE 239 N -0.38 2.25 0.00 -0.53 -0.12 -1.26 0.03 117.98 117.97 1gg4 s PHE 239 Ca 0.06 -0.38 0.00 0.00 -0.05 0.00 0.00 56.93 56.56 1gg4 s PHE 239 Cb -0.07 -1.19 0.00 0.00 -0.63 0.00 0.00 43.02 41.14 1gg4 s PHE 239 CO -0.01 0.37 0.00 0.45 -0.05 0.00 0.00 175.22 175.99 1gg4 n SER 240 N 0.73 0.00 -0.27 1.98 2.88 -0.64 -1.06 113.62 117.24 1gg4 n SER 240 Ca -0.17 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.51 1gg4 n SER 240 Cb 0.54 0.00 0.40 0.00 -0.75 0.00 0.00 64.21 64.40 1gg4 n SER 240 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1gg4 h PRO 241 N 0.00 0.63 0.00 -1.46 0.11 -1.89 -3.33 132.00 126.05 1gg4 h PRO 241 Ca 0.00 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.07 1gg4 h PRO 241 Cb 0.00 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 30.97 1gg4 h PRO 241 CO 0.00 0.42 -0.02 0.27 -0.21 0.00 0.00 178.00 178.45 1gg4 n ASN 242 N -4.56 0.00 -4.69 -2.05 2.04 -1.26 -1.43 115.26 103.30 1gg4 n ASN 242 Ca 0.18 -1.05 -0.40 0.00 -0.44 0.00 0.00 54.58 52.87 1gg4 n ASN 242 Cb 0.51 -0.01 0.03 0.00 -2.53 0.00 0.00 39.78 37.78 1gg4 n ASN 242 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1gg4 n ALA 243 N 0.00 1.06 -0.20 -2.53 0.00 -1.26 -4.88 120.51 112.69 1gg4 n ALA 243 Ca 0.00 0.16 -0.02 0.00 0.00 0.00 0.00 53.44 53.58 1gg4 n ALA 243 Cb 0.51 -2.25 0.18 0.00 0.00 0.00 0.00 19.45 17.90 1gg4 n ALA 243 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1gg4 h ALA 244 N 1.50 1.27 -0.49 0.00 0.00 -1.99 -2.50 119.26 117.05 1gg4 h ALA 244 Ca -0.49 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1gg4 h ALA 244 Cb 1.32 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1gg4 h ALA 244 CO 0.57 0.56 0.00 0.27 0.00 0.00 0.00 179.25 180.64 1gg4 n ASN 245 N -4.33 4.87 -4.77 0.00 6.94 -1.26 -4.96 115.26 111.75 1gg4 n ASN 245 Ca 0.06 -2.73 -0.39 0.00 -0.02 0.00 0.00 54.58 51.50 1gg4 n ASN 245 Cb 0.14 -0.64 -0.06 0.00 -2.36 0.00 0.00 39.78 36.86 1gg4 n ASN 245 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 1gg4 s SER 246 N -0.67 7.46 -0.15 0.53 0.15 -0.94 -4.68 113.70 115.40 1gg4 s SER 246 Ca 0.45 1.74 0.17 0.00 0.70 0.00 0.00 55.95 59.01 1gg4 s SER 246 Cb 0.34 -2.53 -0.25 0.00 -1.71 0.00 0.00 66.02 61.87 1gg4 s SER 246 CO 0.14 0.18 0.25 0.47 1.20 0.00 0.00 173.24 175.48 1gg4 n ASP 247 N 1.51 0.23 -4.14 5.45 9.92 0.10 -4.77 116.55 124.85 1gg4 n ASP 247 Ca -0.04 0.11 -0.34 0.00 -0.53 0.00 0.00 54.79 53.98 1gg4 n ASP 247 Cb 0.48 0.77 -0.14 0.00 -0.64 0.00 0.00 41.12 41.59 1gg4 n ASP 247 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 1gg4 s PHE 248 N -2.57 3.37 0.30 1.24 0.40 -0.91 -3.78 117.98 116.02 1gg4 s PHE 248 Ca -0.08 -2.12 0.09 0.00 -0.60 0.00 0.00 56.93 54.21 1gg4 s PHE 248 Cb 0.07 -2.37 -0.04 0.00 0.51 0.00 0.00 43.02 41.19 1gg4 s PHE 248 CO 0.83 -0.86 0.07 0.99 0.70 0.00 0.00 175.22 176.96 1gg4 s THR 249 N 1.18 3.32 -0.12 0.64 2.01 -0.20 -1.62 115.64 120.85 1gg4 s THR 249 Ca -0.02 -1.78 -0.02 0.00 0.31 0.00 0.00 61.69 60.18 1gg4 s THR 249 Cb -0.20 -2.94 0.04 0.00 0.01 0.00 0.00 72.50 69.40 1gg4 s THR 249 CO -0.03 -0.28 0.00 0.00 -0.69 0.00 0.00 174.62 173.62 1gg4 s ALA 250 N -2.36 0.89 0.39 7.40 0.00 -0.52 -1.15 121.76 126.42 1gg4 s ALA 250 Ca 0.34 -0.38 0.04 0.00 0.00 0.00 0.00 51.96 51.97 1gg4 s ALA 250 Cb -0.05 -0.91 -0.05 0.00 0.00 0.00 0.00 23.12 22.11 1gg4 s ALA 250 CO 0.21 -0.69 0.05 0.95 0.00 0.00 0.00 175.76 176.28 1gg4 s THR 251 N 1.90 1.23 -1.52 0.00 -4.23 -0.50 -4.66 115.64 107.86 1gg4 s THR 251 Ca 0.03 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.43 1gg4 s THR 251 Cb -0.14 -2.63 0.08 0.00 1.34 0.00 0.00 72.50 71.15 1gg4 s THR 251 CO -0.07 0.00 0.81 0.59 -0.54 0.00 0.00 174.62 175.41 1gg4 n ASN 252 N -0.99 -3.18 -4.61 3.99 3.02 -1.26 0.07 115.26 112.30 1gg4 n ASN 252 Ca -0.07 -0.87 -0.43 0.00 -0.03 0.00 0.00 54.58 53.18 1gg4 n ASN 252 Cb 0.66 -3.53 -0.02 0.00 -0.61 0.00 0.00 39.78 36.28 1gg4 n ASN 252 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1gg4 s ILE 253 N -3.46 3.66 -0.22 2.41 1.01 -1.26 -4.12 121.20 119.23 1gg4 s ILE 253 Ca 0.47 0.70 0.01 0.00 0.00 0.00 0.00 60.65 61.82 1gg4 s ILE 253 Cb -0.24 -3.80 0.05 0.00 0.01 0.00 0.00 42.46 38.48 1gg4 s ILE 253 CO 0.86 -0.45 -0.07 -2.28 0.00 0.00 0.00 174.94 173.00 1gg4 s HIS 254 N 5.94 2.32 0.16 3.97 2.46 0.01 -4.99 115.29 125.15 1gg4 s HIS 254 Ca 0.73 -1.63 -0.30 0.00 0.47 0.00 0.00 55.06 54.33 1gg4 s HIS 254 Cb -0.21 -1.57 -0.07 0.00 -0.13 0.00 0.00 32.58 30.60 1gg4 s HIS 254 CO 0.32 -0.75 1.00 0.54 -2.47 0.00 0.00 174.74 173.38 1gg4 s VAL 255 N 1.42 4.21 0.32 0.89 0.11 -1.26 -0.72 120.40 125.37 1gg4 s VAL 255 Ca -0.04 1.94 0.05 0.00 -2.93 0.00 0.00 61.98 61.00 1gg4 s VAL 255 Cb -0.18 -4.24 -0.06 0.00 -1.53 0.00 0.00 36.38 30.37 1gg4 s VAL 255 CO -0.07 0.35 0.01 -0.89 -3.33 0.00 0.00 175.10 171.17 1gg4 s THR 256 N -0.36 1.51 0.67 5.04 2.01 0.31 -4.88 115.64 119.94 1gg4 s THR 256 Ca 0.46 -2.05 0.44 0.00 0.31 0.00 0.00 61.69 60.86 1gg4 s THR 256 Cb -0.26 -2.71 0.44 0.00 0.01 0.00 0.00 72.50 69.98 1gg4 s THR 256 CO 0.32 -0.11 2.36 0.77 -0.69 0.00 0.00 174.62 177.27 1gg4 h SER 257 N 2.11 0.00 0.00 3.53 4.64 -1.97 -3.16 113.55 118.70 1gg4 h SER 257 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 1gg4 h SER 257 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1gg4 h SER 257 CO 0.71 0.00 -0.18 0.45 -0.87 0.00 0.00 176.83 176.94 1gg4 h HIS 258 N 0.00 0.00 -0.54 4.77 3.86 -1.98 -3.48 115.15 117.79 1gg4 h HIS 258 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1gg4 h HIS 258 Cb 0.02 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.49 1gg4 h HIS 258 CO 0.00 0.00 0.00 0.41 0.86 0.00 0.00 177.93 179.20 1gg4 n GLY 259 N 1.71 3.16 3.63 2.45 0.00 -1.19 -4.61 105.19 110.34 1gg4 n GLY 259 Ca -0.02 -0.62 -0.38 0.00 0.00 0.00 0.00 46.02 45.00 1gg4 n GLY 259 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gg4 s THR 260 N -2.08 5.29 -0.03 2.61 2.01 -0.05 -0.53 115.64 122.86 1gg4 s THR 260 Ca 0.00 0.33 -0.13 0.00 0.31 0.00 0.00 61.69 62.20 1gg4 s THR 260 Cb 0.00 -3.58 -0.05 0.00 0.01 0.00 0.00 72.50 68.88 1gg4 s THR 260 CO 0.00 0.27 0.34 -1.61 -0.69 0.00 0.00 174.62 172.93 1gg4 s GLU 261 N 1.47 3.79 -0.02 4.92 2.02 0.10 -0.29 118.70 130.70 1gg4 s GLU 261 Ca 0.11 0.27 -0.29 0.00 0.02 0.00 0.00 54.97 55.07 1gg4 s GLU 261 Cb -0.15 -3.21 0.11 0.00 0.10 0.00 0.00 34.13 30.97 1gg4 s GLU 261 CO 0.08 0.71 0.91 -0.59 0.02 0.00 0.00 175.26 176.39 1gg4 s PHE 262 N -1.06 -0.34 -0.39 1.61 -0.12 -0.56 -0.81 117.98 116.31 1gg4 s PHE 262 Ca 0.21 0.23 -0.20 0.00 -0.05 0.00 0.00 56.93 57.12 1gg4 s PHE 262 Cb -0.15 0.53 0.01 0.00 -0.63 0.00 0.00 43.02 42.78 1gg4 s PHE 262 CO 0.11 -0.52 0.60 0.99 -0.05 0.00 0.00 175.22 176.35 1gg4 s THR 263 N -2.98 4.90 -0.34 -4.49 2.01 0.11 -0.16 115.64 114.69 1gg4 s THR 263 Ca 0.05 0.28 -0.23 0.00 0.31 0.00 0.00 61.69 62.10 1gg4 s THR 263 Cb -0.01 -4.10 0.00 0.00 0.01 0.00 0.00 72.50 68.40 1gg4 s THR 263 CO -0.08 -0.42 0.78 -0.22 -0.69 0.00 0.00 174.62 173.99 1gg4 s LEU 264 N 2.66 4.11 -0.36 4.42 2.96 0.14 -1.41 118.68 131.20 1gg4 s LEU 264 Ca 0.22 0.50 -0.08 0.00 -0.22 0.00 0.00 54.13 54.54 1gg4 s LEU 264 Cb -0.15 -3.05 0.04 0.00 0.50 0.00 0.00 46.19 43.54 1gg4 s LEU 264 CO 0.16 -0.67 0.16 -1.10 -1.32 0.00 0.00 176.35 173.57 1gg4 s GLN 265 N 3.03 2.65 0.36 1.98 -0.21 -0.30 -1.89 119.66 125.29 1gg4 s GLN 265 Ca 0.32 -1.21 0.08 0.00 0.02 0.00 0.00 55.36 54.56 1gg4 s GLN 265 Cb -0.14 -3.58 -0.03 0.00 1.00 0.00 0.00 33.01 30.26 1gg4 s GLN 265 CO 0.15 -0.73 0.24 0.95 -2.12 0.00 0.00 175.29 173.78 1gg4 s THR 266 N 1.44 3.05 -0.11 -0.19 -4.23 -0.54 -1.04 115.64 114.01 1gg4 s THR 266 Ca 0.00 -1.52 0.14 0.00 -1.18 0.00 0.00 61.69 59.13 1gg4 s THR 266 Cb -0.20 -3.05 0.14 0.00 1.34 0.00 0.00 72.50 70.73 1gg4 s THR 266 CO 0.04 -0.13 1.35 -2.65 -0.54 0.00 0.00 174.62 172.69 1gg4 n PRO 267 N -1.30 0.09 0.00 3.99 -0.02 -1.25 -1.67 135.00 134.84 1gg4 n PRO 267 Ca -0.01 0.57 0.07 0.00 -2.02 0.00 0.00 63.50 62.10 1gg4 n PRO 267 Cb 0.61 -2.01 -0.02 0.00 -0.02 0.00 0.00 33.50 32.06 1gg4 n PRO 267 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1gg4 n THR 268 N -2.04 0.00 -0.99 3.45 -2.24 -1.26 -5.09 114.28 106.10 1gg4 n THR 268 Ca -0.01 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 1gg4 n THR 268 Cb 0.22 1.12 0.00 0.00 -2.10 0.00 0.00 70.33 69.57 1gg4 n THR 268 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gg4 n GLY 269 N 1.13 0.33 3.34 3.38 0.00 -0.67 -5.12 105.19 107.57 1gg4 n GLY 269 Ca 0.05 -1.73 -0.21 0.00 0.00 0.00 0.00 46.02 44.12 1gg4 n GLY 269 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1gg4 s SER 270 N -3.70 2.67 -0.09 1.61 0.01 -1.26 -1.47 113.70 111.47 1gg4 s SER 270 Ca 0.00 -0.89 -0.05 0.00 1.31 0.00 0.00 55.95 56.32 1gg4 s SER 270 Cb 0.00 -0.16 0.04 0.00 0.21 0.00 0.00 66.02 66.11 1gg4 s SER 270 CO 0.00 -0.06 0.21 0.68 0.41 0.00 0.00 173.24 174.49 1gg4 s VAL 271 N -2.22 -0.03 -0.26 3.43 -7.23 -0.79 -4.97 120.40 108.33 1gg4 s VAL 271 Ca 0.17 0.11 -0.29 0.00 -1.81 0.00 0.00 61.98 60.16 1gg4 s VAL 271 Cb -0.05 -0.33 0.01 0.00 0.56 0.00 0.00 36.38 36.58 1gg4 s VAL 271 CO 0.07 0.05 1.06 -1.81 -0.31 0.00 0.00 175.10 174.15 1gg4 s ASP 272 N 0.91 7.04 0.39 4.85 1.01 -1.26 -0.68 116.67 128.93 1gg4 s ASP 272 Ca -0.07 1.28 0.08 0.00 0.71 0.00 0.00 52.55 54.55 1gg4 s ASP 272 Cb -0.08 -2.54 -0.06 0.00 1.01 0.00 0.00 42.92 41.25 1gg4 s ASP 272 CO -0.05 -0.74 0.11 0.68 0.21 0.00 0.00 175.17 175.38 1gg4 s VAL 273 N 3.35 2.35 -0.18 -1.27 -7.23 0.78 -4.95 120.40 113.26 1gg4 s VAL 273 Ca 0.45 -1.80 0.00 0.00 -1.81 0.00 0.00 61.98 58.82 1gg4 s VAL 273 Cb -0.14 -2.96 0.04 0.00 0.56 0.00 0.00 36.38 33.88 1gg4 s VAL 273 CO 0.09 -0.05 -0.10 -0.22 -0.31 0.00 0.00 175.10 174.52 1gg4 s LEU 274 N -3.83 1.96 -0.55 1.32 2.96 -1.26 -1.49 118.68 117.79 1gg4 s LEU 274 Ca 0.39 -0.73 -0.15 0.00 -0.22 0.00 0.00 54.13 53.41 1gg4 s LEU 274 Cb 0.04 -1.13 0.13 0.00 0.50 0.00 0.00 46.19 45.73 1gg4 s LEU 274 CO 0.21 -0.14 0.50 -0.22 -1.32 0.00 0.00 176.35 175.38 1gg4 s LEU 275 N 1.48 6.17 0.00 -0.68 2.96 0.61 -3.84 118.68 125.38 1gg4 s LEU 275 Ca 0.01 -1.85 0.00 0.00 -0.22 0.00 0.00 54.13 52.07 1gg4 s LEU 275 Cb -0.15 -2.19 0.00 0.00 0.50 0.00 0.00 46.19 44.35 1gg4 s LEU 275 CO -0.09 -0.83 1.09 -0.81 -1.32 0.00 0.00 176.35 174.39 1gg4 n PRO 276 N 5.15 0.58 -4.25 0.98 -0.04 -1.26 -0.87 135.00 135.30 1gg4 n PRO 276 Ca -0.12 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.10 1gg4 n PRO 276 Cb 0.40 -1.21 -0.17 0.00 -0.04 0.00 0.00 33.50 32.49 1gg4 n PRO 276 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1gg4 s LEU 277 N 0.00 1.37 0.62 1.53 1.43 -1.26 -4.81 118.68 117.56 1gg4 s LEU 277 Ca 0.00 -0.23 -0.18 0.00 -1.03 0.00 0.00 54.13 52.69 1gg4 s LEU 277 Cb 0.00 -0.69 -0.02 0.00 0.03 0.00 0.00 46.19 45.51 1gg4 s LEU 277 CO 0.00 -0.04 1.22 -2.84 0.23 0.00 0.00 176.35 174.91 1gg4 s PRO 278 N 1.07 2.78 0.00 1.29 0.02 -1.26 -4.53 135.00 134.37 1gg4 s PRO 278 Ca -0.08 1.83 0.00 0.00 0.02 0.00 0.00 61.00 62.77 1gg4 s PRO 278 Cb -0.14 -1.90 0.00 0.00 0.02 0.00 0.00 34.50 32.47 1gg4 s PRO 278 CO -0.01 -1.36 0.00 0.41 -0.33 0.00 0.00 177.00 175.71 1gg4 n GLY 279 N 0.50 2.39 0.21 0.52 0.00 -1.26 -4.81 105.19 102.74 1gg4 n GLY 279 Ca 0.14 -1.20 0.05 0.00 0.00 0.00 0.00 46.02 45.00 1gg4 n GLY 279 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1gg4 h ARG 280 N 0.00 0.00 -0.00 1.61 0.11 -1.97 -2.53 114.38 111.60 1gg4 h ARG 280 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1gg4 h ARG 280 Cb 0.00 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.08 1gg4 h ARG 280 CO 0.00 0.24 0.00 1.12 0.10 0.00 0.00 179.97 181.43 1gg4 h HIS 281 N 0.00 0.00 0.00 4.08 2.07 -1.97 0.10 115.15 119.44 1gg4 h HIS 281 Ca -0.00 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.50 1gg4 h HIS 281 Cb 0.43 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.41 1gg4 h HIS 281 CO 0.00 0.00 -0.08 -0.91 -3.07 0.00 0.00 177.93 173.87 1gg4 h ASN 282 N 0.00 0.00 -0.72 3.10 2.35 -1.76 -3.12 115.58 115.43 1gg4 h ASN 282 Ca 0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 1gg4 h ASN 282 Cb 0.00 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.34 1gg4 h ASN 282 CO -0.00 0.08 0.40 0.40 -1.65 0.00 0.00 177.43 176.66 1gg4 h ILE 283 N 0.00 1.22 -0.22 2.81 2.04 -0.94 -0.42 117.51 122.01 1gg4 h ILE 283 Ca -0.00 -0.55 -0.03 0.00 1.00 0.00 0.00 64.86 65.28 1gg4 h ILE 283 Cb 0.94 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 1gg4 h ILE 283 CO 0.01 0.24 0.02 0.00 0.00 0.00 0.00 178.15 178.42 1gg4 h ALA 284 N 1.20 0.29 -0.56 1.87 0.00 -1.65 -2.07 119.26 118.33 1gg4 h ALA 284 Ca 0.25 -0.19 0.08 0.00 0.00 0.00 0.00 54.91 55.05 1gg4 h ALA 284 Cb 0.04 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 17.68 1gg4 h ALA 284 CO -0.04 -0.01 0.20 -0.91 0.00 0.00 0.00 179.25 178.49 1gg4 h ASN 285 N 0.15 0.20 -0.03 0.00 2.35 -1.49 0.17 115.58 116.92 1gg4 h ASN 285 Ca 0.06 0.07 0.01 0.00 -0.55 0.00 0.00 56.30 55.90 1gg4 h ASN 285 Cb 0.36 0.06 -0.00 0.00 0.05 0.00 0.00 38.32 38.78 1gg4 h ASN 285 CO 0.01 0.13 0.02 0.00 -1.65 0.00 0.00 177.43 175.94 1gg4 h ALA 286 N 1.38 2.02 -0.04 -0.83 0.00 -0.76 0.11 119.26 121.15 1gg4 h ALA 286 Ca 0.28 -0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.98 1gg4 h ALA 286 Cb 0.33 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.13 1gg4 h ALA 286 CO -0.28 -0.04 -0.77 -0.07 0.00 0.00 0.00 179.25 178.09 1gg4 h LEU 287 N 0.00 0.74 0.04 0.00 3.38 -0.04 -0.73 115.31 118.70 1gg4 h LEU 287 Ca 0.02 -0.71 -0.00 0.00 0.09 0.00 0.00 57.88 57.27 1gg4 h LEU 287 Cb 0.07 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.59 1gg4 h LEU 287 CO -0.00 1.35 -0.02 0.00 0.09 0.00 0.00 178.44 179.86 1gg4 h ALA 288 N 0.41 -0.05 -0.85 1.53 0.00 -0.16 -0.42 119.26 119.72 1gg4 h ALA 288 Ca -0.08 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.82 1gg4 h ALA 288 Cb 1.44 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 19.20 1gg4 h ALA 288 CO 0.15 -0.51 0.56 0.00 0.00 0.00 0.00 179.25 179.45 1gg4 h ALA 289 N 0.87 1.44 -0.60 0.00 0.00 -0.83 0.13 119.26 120.26 1gg4 h ALA 289 Ca -0.01 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 1gg4 h ALA 289 Cb 0.07 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1gg4 h ALA 289 CO 0.01 0.50 -0.03 0.00 0.00 0.00 0.00 179.25 179.73 1gg4 h ALA 290 N 1.49 0.81 0.05 0.00 0.00 -0.72 -0.55 119.26 120.34 1gg4 h ALA 290 Ca 0.32 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1gg4 h ALA 290 Cb -0.05 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.52 1gg4 h ALA 290 CO -0.08 0.68 -0.02 0.00 0.00 0.00 0.00 179.25 179.82 1gg4 h ALA 291 N 0.98 -0.07 -0.25 0.00 0.00 -0.01 -3.14 119.26 116.78 1gg4 h ALA 291 Ca 0.17 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1gg4 h ALA 291 Cb 0.60 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1gg4 h ALA 291 CO 0.04 -0.43 0.12 -0.07 0.00 0.00 0.00 179.25 178.91 1gg4 h LEU 292 N -0.28 0.18 -1.09 0.00 3.38 -0.68 -1.30 115.31 115.52 1gg4 h LEU 292 Ca -0.01 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1gg4 h LEU 292 Cb 0.25 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1gg4 h LEU 292 CO 0.01 0.14 0.00 -1.20 0.09 0.00 0.00 178.44 177.48 1gg4 n SER 293 N -4.98 0.00 0.00 -0.43 7.64 -0.22 -3.60 113.62 112.02 1gg4 n SER 293 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.86 1gg4 n SER 293 Cb 0.06 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.26 1gg4 n SER 293 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1gg4 n SER 295 N 0.47 0.00 -1.40 6.43 3.41 -0.49 -1.56 113.62 120.48 1gg4 n SER 295 Ca 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.55 1gg4 n SER 295 Cb 0.00 0.00 0.22 0.00 -0.26 0.00 0.00 64.21 64.17 1gg4 n SER 295 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1gg4 n VAL 296 N 0.00 2.67 0.00 -3.33 0.24 -1.24 -4.98 118.33 111.69 1gg4 n VAL 296 Ca 0.00 -2.33 0.00 0.00 -2.04 0.00 0.00 64.34 59.97 1gg4 n VAL 296 Cb 0.00 -0.34 0.00 0.00 -1.47 0.00 0.00 33.84 32.03 1gg4 n VAL 296 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1gg4 n GLY 297 N -0.92 2.86 3.52 7.63 0.00 -1.17 -5.04 105.19 112.07 1gg4 n GLY 297 Ca 0.37 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.94 1gg4 n GLY 297 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gg4 n ALA 298 N -1.45 -1.11 -2.74 4.61 0.00 -0.60 -4.97 120.51 114.24 1gg4 n ALA 298 Ca 0.00 0.36 -0.22 0.00 0.00 0.00 0.00 53.44 53.58 1gg4 n ALA 298 Cb 0.00 -1.87 -0.01 0.00 0.00 0.00 0.00 19.45 17.56 1gg4 n ALA 298 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1gg4 s THR 299 N -1.11 4.96 0.22 0.00 -4.23 -1.26 -4.92 115.64 109.30 1gg4 s THR 299 Ca 0.61 -0.76 -0.07 0.00 -1.18 0.00 0.00 61.69 60.29 1gg4 s THR 299 Cb -0.74 -3.78 0.18 0.00 1.34 0.00 0.00 72.50 69.50 1gg4 s THR 299 CO 0.59 -0.40 1.73 -0.07 -0.54 0.00 0.00 174.62 175.93 1gg4 h LEU 300 N 0.92 0.22 -1.51 4.79 3.38 -1.98 0.17 115.31 121.30 1gg4 h LEU 300 Ca -0.50 0.10 0.05 0.00 0.09 0.00 0.00 57.88 57.62 1gg4 h LEU 300 Cb 1.23 0.08 -0.03 0.00 0.09 0.00 0.00 40.66 42.03 1gg4 h LEU 300 CO 0.60 0.11 0.40 0.44 0.09 0.00 0.00 178.44 180.07 1gg4 h ASP 301 N 0.41 0.53 -0.01 -0.43 5.19 -1.98 -0.17 116.42 119.95 1gg4 h ASP 301 Ca 0.36 -0.00 -0.17 0.00 -0.62 0.00 0.00 57.03 56.59 1gg4 h ASP 301 Cb 0.50 -0.12 -0.00 0.00 0.18 0.00 0.00 39.33 39.89 1gg4 h ASP 301 CO -0.36 0.35 -0.59 0.00 -3.12 0.00 0.00 179.24 175.52 1gg4 h ALA 302 N 1.67 0.62 -0.04 3.45 0.00 -1.10 -2.63 119.26 121.23 1gg4 h ALA 302 Ca 0.25 -0.53 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 1gg4 h ALA 302 Cb 0.23 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1gg4 h ALA 302 CO -0.07 0.70 -0.01 0.82 0.00 0.00 0.00 179.25 180.68 1gg4 h ILE 303 N 0.46 1.31 -0.35 0.00 2.04 0.46 -0.60 117.51 120.83 1gg4 h ILE 303 Ca 0.00 -0.94 0.05 0.00 1.00 0.00 0.00 64.86 64.97 1gg4 h ILE 303 Cb 1.15 1.87 -0.04 0.00 -0.74 0.00 0.00 36.82 39.06 1gg4 h ILE 303 CO 0.11 0.25 0.08 0.50 0.00 0.00 0.00 178.15 179.10 1gg4 h LYS 304 N -0.30 0.20 -0.05 2.37 3.64 -1.15 -1.06 116.57 120.22 1gg4 h LYS 304 Ca 0.01 -0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.27 1gg4 h LYS 304 Cb 0.41 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 1gg4 h LYS 304 CO 0.00 0.13 -0.46 0.00 -2.27 0.00 0.00 179.45 176.86 1gg4 h ALA 305 N 1.25 1.13 -0.13 5.00 0.00 -1.47 -2.09 119.26 122.96 1gg4 h ALA 305 Ca 0.17 -0.43 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 1gg4 h ALA 305 Cb 0.18 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1gg4 h ALA 305 CO -0.21 0.61 -0.08 0.78 0.00 0.00 0.00 179.25 180.35 1gg4 h GLY 306 N 1.34 0.31 0.95 0.00 0.00 -0.56 -3.27 103.07 101.84 1gg4 h GLY 306 Ca 0.01 -0.29 -0.04 0.00 0.00 0.00 0.00 47.33 47.01 1gg4 h GLY 306 CO 0.07 0.26 0.13 1.41 0.00 0.00 0.00 176.54 178.41 1gg4 h LEU 307 N -0.07 0.63 -1.22 3.11 4.07 -1.19 -3.22 115.31 117.42 1gg4 h LEU 307 Ca 0.03 -0.21 0.00 0.00 0.08 0.00 0.00 57.88 57.78 1gg4 h LEU 307 Cb 0.57 -0.17 0.00 0.00 1.08 0.00 0.00 40.66 42.14 1gg4 h LEU 307 CO 0.02 0.67 0.39 0.00 -1.08 0.00 0.00 178.44 178.45 1gg4 h ALA 308 N 0.98 1.33 -0.08 1.53 0.00 -1.42 -1.82 119.26 119.79 1gg4 h ALA 308 Ca 0.14 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1gg4 h ALA 308 Cb 0.27 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1gg4 h ALA 308 CO -0.00 -0.33 -0.23 0.27 0.00 0.00 0.00 179.25 178.96 1gg4 n ASN 309 N -2.42 2.23 -4.79 0.00 0.23 -1.21 -4.83 115.26 104.46 1gg4 n ASN 309 Ca -0.01 -3.55 -0.35 0.00 -0.53 0.00 0.00 54.58 50.14 1gg4 n ASN 309 Cb 0.42 -0.52 -0.03 0.00 -2.08 0.00 0.00 39.78 37.57 1gg4 n ASN 309 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 1gg4 s LEU 310 N -3.09 3.91 -0.04 -4.53 1.43 -0.68 -5.05 118.68 110.63 1gg4 s LEU 310 Ca 0.38 1.99 0.04 0.00 -1.03 0.00 0.00 54.13 55.50 1gg4 s LEU 310 Cb 0.35 -4.46 -0.00 0.00 0.03 0.00 0.00 46.19 42.10 1gg4 s LEU 310 CO -0.01 -0.76 -0.15 -0.54 0.23 0.00 0.00 176.35 175.12 1gg4 s LYS 311 N -3.04 1.58 0.72 1.70 -0.14 -1.26 -4.87 119.74 114.42 1gg4 s LYS 311 Ca 0.65 -0.52 -0.11 0.00 -1.36 0.00 0.00 55.97 54.63 1gg4 s LYS 311 Cb -0.19 -1.38 0.02 0.00 -1.68 0.00 0.00 37.83 34.60 1gg4 s LYS 311 CO 0.23 0.19 1.09 0.00 -0.76 0.00 0.00 175.35 176.10 1gg4 s ALA 312 N 0.13 2.73 -0.23 5.17 0.00 -1.26 -5.03 121.76 123.27 1gg4 s ALA 312 Ca -0.05 -0.25 -0.21 0.00 0.00 0.00 0.00 51.96 51.46 1gg4 s ALA 312 Cb -0.11 -3.06 -0.02 0.00 0.00 0.00 0.00 23.12 19.92 1gg4 s ALA 312 CO 0.02 -1.25 0.64 0.08 0.00 0.00 0.00 175.76 175.25 1gg4 s VAL 313 N -3.27 4.99 0.12 0.00 1.01 -1.26 -4.99 120.40 117.00 1gg4 s VAL 313 Ca 0.58 1.18 -0.35 0.00 0.00 0.00 0.00 61.98 63.40 1gg4 s VAL 313 Cb -0.12 -3.95 -0.17 0.00 0.00 0.00 0.00 36.38 32.14 1gg4 s VAL 313 CO 0.53 0.05 1.21 -2.65 0.00 0.00 0.00 175.10 174.24 1gg4 n PRO 314 N 5.49 1.01 -0.60 2.72 -0.02 -1.26 -1.30 135.00 141.03 1gg4 n PRO 314 Ca -0.00 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 1gg4 n PRO 314 Cb 0.49 -1.91 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 1gg4 n PRO 314 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gg4 n GLY 315 N 2.19 0.80 2.65 -1.23 0.00 -1.26 -4.90 105.19 103.43 1gg4 n GLY 315 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 1gg4 n GLY 315 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gg4 s ARG 316 N -0.40 0.96 -1.63 1.61 1.81 -0.42 -1.44 118.95 119.44 1gg4 s ARG 316 Ca 0.00 -1.62 -0.11 0.00 -1.72 0.00 0.00 55.73 52.28 1gg4 s ARG 316 Cb 0.00 -1.97 0.10 0.00 -0.45 0.00 0.00 34.95 32.63 1gg4 s ARG 316 CO 0.00 -1.14 0.48 1.28 -0.68 0.00 0.00 175.30 175.25 1gg4 n LEU 317 N 3.95 -1.51 -4.53 2.53 4.77 -0.43 -4.31 117.00 117.48 1gg4 n LEU 317 Ca 0.07 -1.11 -0.43 0.00 -0.03 0.00 0.00 56.01 54.51 1gg4 n LEU 317 Cb 0.37 -1.92 -0.05 0.00 -2.33 0.00 0.00 43.42 39.49 1gg4 n LEU 317 CO 0.19 0.33 0.65 0.12 -1.33 0.00 0.00 177.39 177.35 1gg4 s PHE 318 N -3.70 2.91 0.22 -1.77 5.36 0.14 -4.34 117.98 116.81 1gg4 s PHE 318 Ca 0.41 0.09 -0.30 0.00 -0.96 0.00 0.00 56.93 56.17 1gg4 s PHE 318 Cb -0.23 -3.86 -0.09 0.00 -0.34 0.00 0.00 43.02 38.51 1gg4 s PHE 318 CO 0.95 -1.14 1.22 -1.25 -1.46 0.00 0.00 175.22 173.54 1gg4 s PRO 319 N 3.57 4.48 -0.16 10.12 0.04 -1.26 -0.57 135.00 151.20 1gg4 s PRO 319 Ca 0.30 1.95 -0.02 0.00 0.04 0.00 0.00 61.00 63.27 1gg4 s PRO 319 Cb -0.12 -3.20 0.05 0.00 0.04 0.00 0.00 34.50 31.27 1gg4 s PRO 319 CO 0.21 -0.09 0.02 0.42 0.04 0.00 0.00 177.00 177.61 1gg4 s ILE 320 N -0.34 0.53 -0.45 0.56 1.01 0.11 -4.94 121.20 117.68 1gg4 s ILE 320 Ca 0.52 -0.41 -0.29 0.00 0.00 0.00 0.00 60.65 60.47 1gg4 s ILE 320 Cb -0.34 -0.94 0.01 0.00 0.01 0.00 0.00 42.46 41.20 1gg4 s ILE 320 CO 0.40 -0.08 1.36 -1.58 0.00 0.00 0.00 174.94 175.04 1gg4 s GLN 321 N 1.87 3.55 -0.04 2.79 2.00 -1.26 -0.45 119.66 128.11 1gg4 s GLN 321 Ca 0.01 0.77 -0.21 0.00 -2.00 0.00 0.00 55.36 53.93 1gg4 s GLN 321 Cb -0.16 -4.02 -0.15 0.00 0.80 0.00 0.00 33.01 29.48 1gg4 s GLN 321 CO -0.07 -1.60 0.89 -0.07 -0.50 0.00 0.00 175.29 173.93 1gg4 h LEU 322 N 12.19 -0.24 0.00 3.68 3.38 -0.43 -3.49 115.31 130.40 1gg4 h LEU 322 Ca -0.26 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.42 1gg4 h LEU 322 Cb 1.09 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1gg4 h LEU 322 CO 1.11 0.28 0.00 0.00 0.09 0.00 0.00 178.44 179.92 1gg4 n ALA 323 N -2.58 0.00 -1.87 1.53 0.00 -1.22 -5.02 120.51 111.35 1gg4 n ALA 323 Ca -0.08 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.95 1gg4 n ALA 323 Cb 0.26 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.68 1gg4 n ALA 323 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1gg4 s GLU 324 N -0.91 4.29 -0.41 0.00 8.01 -1.26 -2.48 118.70 125.93 1gg4 s GLU 324 Ca 0.00 2.27 0.00 0.00 0.01 0.00 0.00 54.97 57.25 1gg4 s GLU 324 Cb 0.00 -3.11 0.00 0.00 -4.31 0.00 0.00 34.13 26.71 1gg4 s GLU 324 CO 0.00 -0.37 0.00 0.09 0.01 0.00 0.00 175.26 174.99 1gg4 n ASN 325 N 2.10 -5.07 -4.08 -0.19 3.02 -1.26 -4.87 115.26 104.91 1gg4 n ASN 325 Ca 0.06 0.10 -0.35 0.00 -0.03 0.00 0.00 54.58 54.35 1gg4 n ASN 325 Cb 0.41 -3.33 -0.11 0.00 -0.61 0.00 0.00 39.78 36.14 1gg4 n ASN 325 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1gg4 s GLN 326 N -2.11 2.38 -0.18 3.52 -0.21 -1.03 -2.69 119.66 119.34 1gg4 s GLN 326 Ca 0.00 -2.43 -0.09 0.00 0.02 0.00 0.00 55.36 52.86 1gg4 s GLN 326 Cb 0.00 -3.64 -0.05 0.00 1.00 0.00 0.00 33.01 30.32 1gg4 s GLN 326 CO 0.00 -1.15 0.12 -1.17 -2.12 0.00 0.00 175.29 170.97 1gg4 s LEU 327 N 0.09 4.18 -0.10 2.90 2.96 -0.73 0.38 118.68 128.36 1gg4 s LEU 327 Ca 0.16 0.25 -0.00 0.00 -0.22 0.00 0.00 54.13 54.32 1gg4 s LEU 327 Cb -0.21 -2.06 -0.03 0.00 0.50 0.00 0.00 46.19 44.39 1gg4 s LEU 327 CO -0.03 0.23 -0.07 -0.22 -1.32 0.00 0.00 176.35 174.94 1gg4 s LEU 328 N 0.07 3.13 -0.40 -0.68 2.96 0.40 -0.30 118.68 123.85 1gg4 s LEU 328 Ca 0.09 -0.09 0.03 0.00 -0.22 0.00 0.00 54.13 53.94 1gg4 s LEU 328 Cb -0.11 -1.70 0.11 0.00 0.50 0.00 0.00 46.19 44.98 1gg4 s LEU 328 CO -0.00 0.29 0.13 -0.76 -1.32 0.00 0.00 176.35 174.69 1gg4 s LEU 329 N -0.36 4.71 -0.36 -0.68 1.43 0.30 0.08 118.68 123.81 1gg4 s LEU 329 Ca 0.05 -2.40 -0.29 0.00 -1.03 0.00 0.00 54.13 50.47 1gg4 s LEU 329 Cb -0.12 -1.66 0.00 0.00 0.03 0.00 0.00 46.19 44.44 1gg4 s LEU 329 CO 0.02 -0.35 1.47 -0.62 0.23 0.00 0.00 176.35 177.10 1gg4 s ASP 330 N 0.66 6.35 -0.13 2.29 2.15 0.26 -2.15 116.67 126.10 1gg4 s ASP 330 Ca 0.13 1.06 0.22 0.00 0.43 0.00 0.00 52.55 54.39 1gg4 s ASP 330 Cb -0.21 -2.54 0.46 0.00 -0.30 0.00 0.00 42.92 40.33 1gg4 s ASP 330 CO -0.05 -1.38 1.16 -0.67 -0.17 0.00 0.00 175.17 174.05 1gg4 n ASP 331 N 8.74 1.53 0.00 -0.34 2.03 -0.53 0.27 116.55 128.26 1gg4 n ASP 331 Ca 0.17 -2.32 0.08 0.00 0.52 0.00 0.00 54.79 53.24 1gg4 n ASP 331 Cb 0.47 -0.39 0.46 0.00 -0.72 0.00 0.00 41.12 40.95 1gg4 n ASP 331 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 1gg4 n SER 332 N -0.12 0.00 0.27 1.67 3.41 -1.03 -4.21 113.62 113.61 1gg4 n SER 332 Ca 0.10 -1.37 -0.16 0.00 -0.26 0.00 0.00 58.87 57.19 1gg4 n SER 332 Cb 0.97 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.84 1gg4 n SER 332 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 1gg4 h TYR 333 N 0.00 -0.61 -3.47 7.33 3.20 -1.49 -3.41 116.97 118.52 1gg4 h TYR 333 Ca 0.00 -0.01 -0.16 0.00 3.14 0.00 0.00 58.73 61.69 1gg4 h TYR 333 Cb 0.00 0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.44 1gg4 h TYR 333 CO 0.00 -0.32 0.03 -1.71 -1.64 0.00 0.00 178.16 174.52 1gg4 n ASN 334 N -5.32 -1.63 -3.65 -2.11 2.85 -1.23 -3.71 115.26 100.47 1gg4 n ASN 334 Ca -0.11 -2.64 -0.01 0.00 -0.11 0.00 0.00 54.58 51.71 1gg4 n ASN 334 Cb 0.30 2.87 -0.06 0.00 1.24 0.00 0.00 39.78 44.12 1gg4 n ASN 334 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1gg4 s ALA 335 N -2.40 -2.43 0.22 5.20 0.00 -1.18 -4.30 121.76 116.87 1gg4 s ALA 335 Ca 0.22 2.08 0.00 0.00 0.00 0.00 0.00 51.96 54.26 1gg4 s ALA 335 Cb -0.02 -1.82 -0.04 0.00 0.00 0.00 0.00 23.12 21.23 1gg4 s ALA 335 CO 0.16 -0.32 0.15 0.54 0.00 0.00 0.00 175.76 176.29 1gg4 s ASN 336 N 1.12 0.40 0.20 0.00 2.20 -1.26 -1.69 114.94 115.92 1gg4 s ASN 336 Ca -0.08 -1.45 -0.15 0.00 -0.94 0.00 0.00 52.86 50.24 1gg4 s ASN 336 Cb -0.03 0.41 0.21 0.00 -2.00 0.00 0.00 41.25 39.83 1gg4 s ASN 336 CO -0.12 -0.88 1.62 0.58 -2.94 0.00 0.00 177.10 175.36 1gg4 h VAL 337 N 2.54 0.33 0.49 3.54 2.07 -1.97 -2.83 116.25 120.42 1gg4 h VAL 337 Ca -0.34 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.17 1gg4 h VAL 337 Cb 1.25 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 1gg4 h VAL 337 CO 0.50 0.00 -0.49 1.23 0.02 0.00 0.00 177.57 178.83 1gg4 h GLY 338 N -0.05 -1.21 -1.65 2.17 0.00 -1.99 0.42 103.07 100.77 1gg4 h GLY 338 Ca 0.28 0.57 0.00 0.00 0.00 0.00 0.00 47.33 48.18 1gg4 h GLY 338 CO -0.65 -0.37 0.00 -1.14 0.00 0.00 0.00 176.54 174.39 1gg4 n SER 339 N -5.56 0.46 0.00 0.19 3.41 -1.07 -1.15 113.62 109.90 1gg4 n SER 339 Ca -0.12 -0.40 0.00 0.00 -0.26 0.00 0.00 58.87 58.09 1gg4 n SER 339 Cb 0.46 -0.10 0.00 0.00 -0.26 0.00 0.00 64.21 64.31 1gg4 n SER 339 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1gg4 n THR 341 N 0.72 0.00 -0.07 6.66 -1.04 0.15 -1.13 114.28 119.56 1gg4 n THR 341 Ca 0.00 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 61.87 1gg4 n THR 341 Cb 0.08 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 68.57 1gg4 n THR 341 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1gg4 h ALA 342 N 0.00 0.51 -0.70 2.41 0.00 -1.34 -3.11 119.26 117.02 1gg4 h ALA 342 Ca 0.00 -0.51 0.10 0.00 0.00 0.00 0.00 54.91 54.50 1gg4 h ALA 342 Cb 0.00 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 17.63 1gg4 h ALA 342 CO 0.00 0.68 0.34 0.00 0.00 0.00 0.00 179.25 180.27 1gg4 h ALA 343 N 0.74 0.97 -0.59 0.00 0.00 -1.38 -1.34 119.26 117.66 1gg4 h ALA 343 Ca 0.02 0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.05 1gg4 h ALA 343 Cb 1.13 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.84 1gg4 h ALA 343 CO 0.12 -0.07 0.30 0.28 0.00 0.00 0.00 179.25 179.88 1gg4 h VAL 344 N 0.57 0.93 -0.84 0.00 2.07 -1.83 -1.08 116.25 116.07 1gg4 h VAL 344 Ca 0.35 -0.20 -0.00 0.00 0.82 0.00 0.00 66.70 67.67 1gg4 h VAL 344 Cb 0.39 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 30.43 1gg4 h VAL 344 CO -0.28 0.10 0.51 -0.61 0.02 0.00 0.00 177.57 177.31 1gg4 h GLN 345 N 0.57 1.13 0.06 1.57 -0.00 -1.21 0.12 115.11 117.35 1gg4 h GLN 345 Ca 0.27 -0.09 -0.00 0.00 -0.00 0.00 0.00 58.65 58.82 1gg4 h GLN 345 Cb 0.20 -0.24 0.00 0.00 0.00 0.00 0.00 27.48 27.43 1gg4 h GLN 345 CO -0.19 0.78 -0.03 0.28 0.00 0.00 0.00 178.83 179.67 1gg4 h VAL 346 N 1.15 1.10 -0.18 2.39 2.07 -0.69 -3.16 116.25 118.94 1gg4 h VAL 346 Ca 0.30 -0.55 0.02 0.00 0.82 0.00 0.00 66.70 67.30 1gg4 h VAL 346 Cb -0.06 1.46 -0.02 0.00 -1.52 0.00 0.00 31.29 31.15 1gg4 h VAL 346 CO -0.06 0.14 0.03 0.25 0.02 0.00 0.00 177.57 177.95 1gg4 h LEU 347 N -0.32 -0.01 -1.51 2.57 6.46 -0.92 -2.90 115.31 118.69 1gg4 h LEU 347 Ca -0.01 0.03 0.34 0.00 -0.12 0.00 0.00 57.88 58.13 1gg4 h LEU 347 Cb 0.28 0.04 -0.10 0.00 -0.73 0.00 0.00 40.66 40.16 1gg4 h LEU 347 CO 0.01 0.02 0.78 0.00 -0.62 0.00 0.00 178.44 178.64 1gg4 h ALA 348 N 1.13 2.60 -0.53 1.25 0.00 -0.73 -3.44 119.26 119.55 1gg4 h ALA 348 Ca 0.08 0.06 -0.73 0.00 0.00 0.00 0.00 54.91 54.32 1gg4 h ALA 348 Cb 0.08 0.10 -0.09 0.00 0.00 0.00 0.00 17.79 17.87 1gg4 h ALA 348 CO -0.11 -1.07 2.67 0.39 0.00 0.00 0.00 179.25 181.13 1gg4 n GLU 349 N -4.55 4.13 -4.25 0.00 1.02 -1.10 -5.02 120.64 110.88 1gg4 n GLU 349 Ca 0.30 -3.18 -0.30 0.00 -0.02 0.00 0.00 57.16 53.96 1gg4 n GLU 349 Cb 1.16 -2.76 -0.10 0.00 -0.02 0.00 0.00 31.44 29.72 1gg4 n GLU 349 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1gg4 s PRO 351 N 0.05 2.30 2.31 3.49 0.04 -1.26 -4.88 135.00 137.06 1gg4 s PRO 351 Ca 0.54 -0.92 0.00 0.00 0.04 0.00 0.00 61.00 60.66 1gg4 s PRO 351 Cb 0.16 -2.40 0.00 0.00 0.04 0.00 0.00 34.50 32.31 1gg4 s PRO 351 CO -0.07 0.53 0.00 0.41 0.04 0.00 0.00 177.00 177.92 1gg4 n GLY 352 N 0.84 -0.87 3.68 0.56 0.00 -1.26 -3.98 105.19 104.16 1gg4 n GLY 352 Ca -0.13 -1.18 -0.42 0.00 0.00 0.00 0.00 46.02 44.28 1gg4 n GLY 352 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1gg4 s TYR 353 N 0.00 3.19 -0.19 1.61 5.04 0.32 -4.85 117.35 122.46 1gg4 s TYR 353 Ca 0.00 1.25 -0.06 0.00 -2.44 0.00 0.00 57.07 55.82 1gg4 s TYR 353 Cb 0.00 -3.39 -0.03 0.00 0.35 0.00 0.00 41.96 38.89 1gg4 s TYR 353 CO 0.00 -1.18 0.02 1.03 -1.34 0.00 0.00 175.55 174.09 1gg4 s ARG 354 N 2.43 3.75 -0.21 4.97 0.52 -1.26 -1.55 118.95 127.60 1gg4 s ARG 354 Ca 0.54 -0.46 -0.01 0.00 -0.52 0.00 0.00 55.73 55.28 1gg4 s ARG 354 Cb -0.23 -3.12 0.01 0.00 0.52 0.00 0.00 34.95 32.13 1gg4 s ARG 354 CO 0.19 0.12 -0.12 0.08 0.02 0.00 0.00 175.30 175.60 1gg4 s VAL 355 N 0.74 2.66 -0.46 3.52 1.01 -0.26 -1.81 120.40 125.80 1gg4 s VAL 355 Ca 0.01 -0.85 -0.18 0.00 0.00 0.00 0.00 61.98 60.96 1gg4 s VAL 355 Cb -0.14 -2.23 0.04 0.00 0.00 0.00 0.00 36.38 34.06 1gg4 s VAL 355 CO 0.02 0.40 0.53 -0.22 0.00 0.00 0.00 175.10 175.83 1gg4 s LEU 356 N 1.35 4.93 -0.28 3.92 2.96 0.04 -1.52 118.68 130.07 1gg4 s LEU 356 Ca 0.04 -0.78 -0.14 0.00 -0.22 0.00 0.00 54.13 53.03 1gg4 s LEU 356 Cb -0.15 -2.43 -0.04 0.00 0.50 0.00 0.00 46.19 44.07 1gg4 s LEU 356 CO -0.08 -0.72 0.32 -0.69 -1.32 0.00 0.00 176.35 173.86 1gg4 s VAL 357 N 2.35 5.21 0.22 1.68 1.01 0.62 -2.12 120.40 129.38 1gg4 s VAL 357 Ca 0.14 0.40 0.03 0.00 0.00 0.00 0.00 61.98 62.55 1gg4 s VAL 357 Cb -0.18 -3.67 -0.05 0.00 0.00 0.00 0.00 36.38 32.48 1gg4 s VAL 357 CO 0.13 0.15 0.00 0.68 0.00 0.00 0.00 175.10 176.06 1gg4 s VAL 358 N 1.98 0.96 0.25 2.92 -7.23 -0.62 -1.44 120.40 117.22 1gg4 s VAL 358 Ca 0.12 -2.02 0.01 0.00 -1.81 0.00 0.00 61.98 58.28 1gg4 s VAL 358 Cb -0.16 -2.32 -0.05 0.00 0.56 0.00 0.00 36.38 34.41 1gg4 s VAL 358 CO 0.10 -0.34 0.11 -0.83 -0.31 0.00 0.00 175.10 173.84 1gg4 s GLY 359 N -3.29 1.72 0.00 2.32 0.00 -0.93 -2.02 107.32 105.12 1gg4 s GLY 359 Ca 0.28 -1.82 0.00 0.00 0.00 0.00 0.00 44.72 43.18 1gg4 s GLY 359 CO 0.08 -1.55 0.00 1.22 0.00 0.00 0.00 173.10 172.85 1gg4 n ASP 360 N -0.48 -0.12 -2.16 1.64 8.00 -1.24 -4.46 116.55 117.74 1gg4 n ASP 360 Ca 0.01 0.00 -0.23 0.00 0.71 0.00 0.00 54.79 55.28 1gg4 n ASP 360 Cb 0.66 0.00 0.02 0.00 -0.02 0.00 0.00 41.12 41.78 1gg4 n ASP 360 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gg4 n ALA 362 N -2.88 4.84 -1.69 2.24 0.00 -0.68 -1.12 120.51 121.21 1gg4 n ALA 362 Ca 0.00 -3.80 -0.31 0.00 0.00 0.00 0.00 53.44 49.34 1gg4 n ALA 362 Cb 0.00 -0.40 0.04 0.00 0.00 0.00 0.00 19.45 19.09 1gg4 n ALA 362 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1gg4 s GLU 363 N -3.60 2.98 0.05 0.00 0.41 -1.26 -4.98 118.70 112.29 1gg4 s GLU 363 Ca 0.49 0.78 0.09 0.00 -0.41 0.00 0.00 54.97 55.92 1gg4 s GLU 363 Cb 0.40 -2.01 -0.03 0.00 -1.78 0.00 0.00 34.13 30.72 1gg4 s GLU 363 CO -0.00 -1.02 -0.25 -0.51 -0.49 0.00 0.00 175.26 172.98 1gg4 s LEU 364 N -5.46 2.25 0.00 1.80 1.02 -1.26 -4.93 118.68 112.11 1gg4 s LEU 364 Ca 0.58 -0.57 0.00 0.00 0.02 0.00 0.00 54.13 54.16 1gg4 s LEU 364 Cb -0.13 -1.32 0.00 0.00 0.02 0.00 0.00 46.19 44.76 1gg4 s LEU 364 CO 0.54 0.26 0.00 0.61 0.02 0.00 0.00 176.35 177.78 1gg4 n GLY 365 N 1.71 0.61 0.20 -3.19 0.00 -1.26 -3.78 105.19 99.47 1gg4 n GLY 365 Ca -0.17 -0.81 0.14 0.00 0.00 0.00 0.00 46.02 45.18 1gg4 n GLY 365 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gg4 h ALA 366 N -0.80 1.00 0.00 4.61 0.00 -2.05 -2.37 119.26 119.65 1gg4 h ALA 366 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1gg4 h ALA 366 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1gg4 h ALA 366 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 179.25 177.34 1gg4 n GLU 367 N -2.60 0.00 0.16 0.00 4.07 -1.25 -3.94 120.64 117.08 1gg4 n GLU 367 Ca 0.01 0.02 -0.14 0.00 -0.06 0.00 0.00 57.16 56.99 1gg4 n GLU 367 Cb 0.24 -1.50 -0.07 0.00 -0.06 0.00 0.00 31.44 30.05 1gg4 n GLU 367 CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 1gg4 h SER 368 N 0.00 -0.54 -0.38 4.31 0.87 -1.52 0.96 113.55 117.26 1gg4 h SER 368 Ca 0.00 0.05 0.08 0.00 -1.23 0.00 0.00 61.79 60.69 1gg4 h SER 368 Cb 0.49 0.18 -0.09 0.00 -0.44 0.00 0.00 62.40 62.54 1gg4 h SER 368 CO 0.00 -0.31 -0.22 -0.08 -0.53 0.00 0.00 176.83 175.69 1gg4 h GLU 369 N -0.46 -0.16 -0.57 2.24 4.81 -1.80 -1.34 114.58 117.31 1gg4 h GLU 369 Ca -0.01 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.26 1gg4 h GLU 369 Cb 0.42 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.79 1gg4 h GLU 369 CO -0.03 -0.10 0.34 0.00 -0.73 0.00 0.00 179.01 178.49 1gg4 h ALA 370 N 1.04 0.73 -0.48 2.92 0.00 -1.68 -1.55 119.26 120.25 1gg4 h ALA 370 Ca 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1gg4 h ALA 370 Cb 0.45 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1gg4 h ALA 370 CO -0.48 0.06 0.31 0.00 0.00 0.00 0.00 179.25 179.14 1gg4 h HIS 372 N 0.65 0.78 -0.20 0.00 -0.00 -0.77 -2.97 115.15 112.65 1gg4 h HIS 372 Ca 0.17 -0.40 0.02 0.00 -0.00 0.00 0.00 60.37 60.17 1gg4 h HIS 372 Cb -0.06 -0.10 -0.02 0.00 -0.00 0.00 0.00 27.41 27.23 1gg4 h HIS 372 CO 0.00 1.21 0.06 0.28 -0.00 0.00 0.00 177.93 179.48 1gg4 h VAL 373 N 0.33 0.94 -0.40 2.45 2.07 -0.34 -1.05 116.25 120.24 1gg4 h VAL 373 Ca -0.08 -0.05 0.07 0.00 0.82 0.00 0.00 66.70 67.46 1gg4 h VAL 373 Cb 1.53 0.78 -0.06 0.00 -1.52 0.00 0.00 31.29 32.02 1gg4 h VAL 373 CO 0.17 0.03 0.00 1.56 0.02 0.00 0.00 177.57 179.35 1gg4 h GLN 374 N 0.15 0.11 -0.81 1.57 4.20 -1.08 0.26 115.11 119.51 1gg4 h GLN 374 Ca 0.09 -0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.76 1gg4 h GLN 374 Cb 0.06 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 27.78 1gg4 h GLN 374 CO -0.10 0.07 0.40 0.28 -0.67 0.00 0.00 178.83 178.81 1gg4 h VAL 375 N 0.11 1.25 -0.01 -0.54 2.07 -1.32 0.20 116.25 118.02 1gg4 h VAL 375 Ca 0.20 -0.69 -0.00 0.00 0.82 0.00 0.00 66.70 67.03 1gg4 h VAL 375 Cb 0.28 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 30.26 1gg4 h VAL 375 CO -0.33 0.30 0.01 1.23 0.02 0.00 0.00 177.57 178.79 1gg4 h GLY 376 N 1.14 0.01 1.67 2.17 0.00 0.21 -1.56 103.07 106.72 1gg4 h GLY 376 Ca 0.28 -0.01 0.02 0.00 0.00 0.00 0.00 47.33 47.62 1gg4 h GLY 376 CO -0.04 0.01 0.18 0.83 0.00 0.00 0.00 176.54 177.52 1gg4 h GLU 377 N -0.02 0.27 -0.36 4.80 5.08 -0.14 -0.46 114.58 123.76 1gg4 h GLU 377 Ca 0.00 -0.02 -0.13 0.00 -1.00 0.00 0.00 59.36 58.22 1gg4 h GLU 377 Cb 0.03 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1gg4 h GLU 377 CO -0.00 0.18 -0.27 0.00 -1.00 0.00 0.00 179.01 177.92 1gg4 h ALA 378 N 1.85 0.51 -0.22 3.43 0.00 -0.04 -0.17 119.26 124.62 1gg4 h ALA 378 Ca 0.11 -0.40 -0.12 0.00 0.00 0.00 0.00 54.91 54.50 1gg4 h ALA 378 Cb 0.09 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1gg4 h ALA 378 CO -0.02 0.52 -0.37 0.00 0.00 0.00 0.00 179.25 179.38 1gg4 h ALA 379 N 0.77 0.94 0.59 0.00 0.00 -0.77 0.29 119.26 121.09 1gg4 h ALA 379 Ca 0.07 -0.42 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 1gg4 h ALA 379 Cb 0.84 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.52 1gg4 h ALA 379 CO 0.07 0.62 -0.28 -0.22 0.00 0.00 0.00 179.25 179.44 1gg4 h LYS 380 N 0.42 -0.76 0.00 0.00 1.63 -0.88 -1.42 116.57 115.56 1gg4 h LYS 380 Ca 0.04 0.05 -0.04 0.00 -0.85 0.00 0.00 60.65 59.86 1gg4 h LYS 380 Cb 0.84 0.17 -0.01 0.00 -0.60 0.00 0.00 32.23 32.64 1gg4 h LYS 380 CO 0.07 -0.50 -0.18 0.00 -3.45 0.00 0.00 179.45 175.39 1gg4 h ALA 381 N -0.40 1.32 0.00 5.00 0.00 -0.93 -2.49 119.26 121.75 1gg4 h ALA 381 Ca -0.08 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1gg4 h ALA 381 Cb 0.62 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1gg4 h ALA 381 CO 0.13 0.23 0.00 0.00 0.00 0.00 0.00 179.25 179.61 1gg4 h ALA 382 N 1.82 1.00 0.00 0.00 0.00 -0.64 -3.47 119.26 117.97 1gg4 h ALA 382 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1gg4 h ALA 382 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1gg4 h ALA 382 CO 0.02 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.68 1gg4 n GLY 383 N 0.93 0.50 3.74 0.00 0.00 -0.87 -4.89 105.19 104.60 1gg4 n GLY 383 Ca 0.04 -0.88 -0.42 0.00 0.00 0.00 0.00 46.02 44.77 1gg4 n GLY 383 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gg4 s ILE 384 N -2.00 2.26 0.26 -0.61 -1.09 -0.59 -4.90 121.20 114.52 1gg4 s ILE 384 Ca 0.00 0.20 0.23 0.00 -2.23 0.00 0.00 60.65 58.85 1gg4 s ILE 384 Cb 0.00 -3.13 0.22 0.00 -1.58 0.00 0.00 42.46 37.97 1gg4 s ILE 384 CO 0.00 0.03 1.88 0.44 -1.23 0.00 0.00 174.94 176.06 1gg4 h ASP 385 N 5.56 0.00 -3.20 3.58 3.32 -1.79 -3.47 116.42 120.42 1gg4 h ASP 385 Ca -0.45 0.00 0.14 0.00 0.02 0.00 0.00 57.03 56.74 1gg4 h ASP 385 Cb 1.21 0.00 -0.27 0.00 0.22 0.00 0.00 39.33 40.49 1gg4 h ASP 385 CO 0.84 0.24 0.70 -0.60 -1.72 0.00 0.00 179.24 178.70 1gg4 s ARG 386 N -3.86 0.32 -0.29 3.56 3.52 -0.75 -4.77 118.95 116.68 1gg4 s ARG 386 Ca -0.01 0.21 -0.01 0.00 -0.13 0.00 0.00 55.73 55.79 1gg4 s ARG 386 Cb 0.12 0.15 0.09 0.00 -1.56 0.00 0.00 34.95 33.75 1gg4 s ARG 386 CO 0.64 -0.07 0.08 0.08 -0.81 0.00 0.00 175.30 175.21 1gg4 s VAL 387 N -0.50 0.90 -0.13 7.11 1.01 -1.26 -0.78 120.40 126.75 1gg4 s VAL 387 Ca 0.04 -1.30 -0.19 0.00 0.00 0.00 0.00 61.98 60.53 1gg4 s VAL 387 Cb -0.03 -1.62 -0.04 0.00 0.00 0.00 0.00 36.38 34.70 1gg4 s VAL 387 CO -0.07 -0.58 0.51 -0.76 0.00 0.00 0.00 175.10 174.21 1gg4 s LEU 388 N 1.62 4.26 0.12 3.92 1.43 -0.90 -1.51 118.68 127.61 1gg4 s LEU 388 Ca 0.07 0.84 0.05 0.00 -1.03 0.00 0.00 54.13 54.06 1gg4 s LEU 388 Cb -0.17 -2.75 -0.04 0.00 0.03 0.00 0.00 46.19 43.26 1gg4 s LEU 388 CO -0.22 -0.05 -0.11 -0.94 0.23 0.00 0.00 176.35 175.26 1gg4 s SER 389 N 0.74 1.71 0.00 2.29 1.04 -0.01 -1.59 113.70 117.88 1gg4 s SER 389 Ca 0.27 -0.87 0.00 0.00 0.48 0.00 0.00 55.95 55.84 1gg4 s SER 389 Cb -0.15 -0.02 -0.00 0.00 0.10 0.00 0.00 66.02 65.94 1gg4 s SER 389 CO 0.11 -0.25 -0.01 -0.69 0.98 0.00 0.00 173.24 173.39 1gg4 s VAL 390 N -2.59 0.06 0.00 5.02 1.01 -0.86 -0.40 120.40 122.64 1gg4 s VAL 390 Ca 0.10 -0.13 0.00 0.00 0.00 0.00 0.00 61.98 61.94 1gg4 s VAL 390 Cb -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 36.38 36.28 1gg4 s VAL 390 CO 0.01 -0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.67 1gg4 n GLY 391 N 2.89 2.72 1.22 4.51 0.00 -1.25 -3.61 105.19 111.67 1gg4 n GLY 391 Ca -0.13 -1.85 0.12 0.00 0.00 0.00 0.00 46.02 44.15 1gg4 n GLY 391 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1gg4 n LYS 392 N -1.80 2.56 0.00 1.61 5.02 -1.26 -4.33 118.16 119.96 1gg4 n LYS 392 Ca 0.00 -2.40 0.00 0.00 -2.02 0.00 0.00 58.31 53.89 1gg4 n LYS 392 Cb 0.00 -1.53 0.00 0.00 -0.02 0.00 0.00 35.03 33.48 1gg4 n LYS 392 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1gg4 n GLN 393 N 1.51 0.61 0.00 1.97 1.13 -1.26 -4.84 117.38 116.50 1gg4 n GLN 393 Ca 0.22 0.00 0.04 0.00 -1.94 0.00 0.00 57.00 55.32 1gg4 n GLN 393 Cb 0.60 -0.64 0.21 0.00 0.11 0.00 0.00 30.24 30.51 1gg4 n GLN 393 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 1gg4 n SER 394 N -1.33 0.00 0.15 1.08 3.41 -1.26 -2.04 113.62 113.62 1gg4 n SER 394 Ca 0.00 0.27 0.02 0.00 -0.26 0.00 0.00 58.87 58.90 1gg4 n SER 394 Cb 0.14 -0.35 0.37 0.00 -0.26 0.00 0.00 64.21 64.11 1gg4 n SER 394 CO 0.00 0.00 0.00 1.12 -0.16 0.00 0.00 175.04 176.00 1gg4 h HIS 395 N 0.00 0.15 -0.80 7.33 2.07 -1.88 -2.60 115.15 119.42 1gg4 h HIS 395 Ca 0.00 -0.02 0.12 0.00 -2.85 0.00 0.00 60.37 57.61 1gg4 h HIS 395 Cb 0.10 -0.04 -0.06 0.00 2.57 0.00 0.00 27.41 29.99 1gg4 h HIS 395 CO 0.00 0.38 0.52 0.00 -3.07 0.00 0.00 177.93 175.76 1gg4 h ALA 396 N 1.63 1.85 0.41 6.11 0.00 -1.76 0.80 119.26 128.30 1gg4 h ALA 396 Ca 0.02 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1gg4 h ALA 396 Cb 0.51 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1gg4 h ALA 396 CO 0.04 -0.04 -0.19 0.82 0.00 0.00 0.00 179.25 179.87 1gg4 h ILE 397 N 0.65 0.00 -0.76 0.00 2.04 -1.54 -1.46 117.51 116.43 1gg4 h ILE 397 Ca 0.38 -0.27 0.12 0.00 1.00 0.00 0.00 64.86 66.09 1gg4 h ILE 397 Cb 0.58 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 36.61 1gg4 h ILE 397 CO -0.15 0.00 0.50 0.77 0.00 0.00 0.00 178.15 179.28 1gg4 h SER 398 N -0.81 0.53 0.74 1.72 4.64 -1.49 0.84 113.55 119.72 1gg4 h SER 398 Ca -0.06 0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 61.25 1gg4 h SER 398 Cb 0.42 -0.09 0.01 0.00 -0.31 0.00 0.00 62.40 62.43 1gg4 h SER 398 CO 0.09 0.30 -0.35 0.74 -0.87 0.00 0.00 176.83 176.74 1gg4 h THR 399 N 0.58 0.16 0.00 2.95 2.02 -0.88 -3.05 112.91 114.69 1gg4 h THR 399 Ca 0.36 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 67.35 1gg4 h THR 399 Cb 0.62 0.20 -0.00 0.00 -1.74 0.00 0.00 68.15 67.23 1gg4 h THR 399 CO -0.13 0.01 -0.04 0.00 0.37 0.00 0.00 175.52 175.73 1gg4 h ALA 400 N -1.00 1.41 0.00 6.16 0.00 -0.59 -2.04 119.26 123.20 1gg4 h ALA 400 Ca -0.10 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1gg4 h ALA 400 Cb 0.78 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1gg4 h ALA 400 CO 0.17 0.05 0.00 -1.13 0.00 0.00 0.00 179.25 178.34 1gg4 n SER 401 N -3.73 0.00 -1.45 0.00 3.41 0.23 -4.04 113.62 108.04 1gg4 n SER 401 Ca -0.03 0.42 -0.17 0.00 -0.26 0.00 0.00 58.87 58.84 1gg4 n SER 401 Cb 0.14 -0.46 -0.06 0.00 -0.26 0.00 0.00 64.21 63.56 1gg4 n SER 401 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1gg4 n GLY 402 N 0.30 1.24 3.78 5.00 0.00 -0.77 -4.27 105.19 110.47 1gg4 n GLY 402 Ca 0.05 -0.20 -0.03 0.00 0.00 0.00 0.00 46.02 45.83 1gg4 n GLY 402 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gg4 s VAL 403 N -2.68 0.00 0.00 1.61 0.11 -1.25 -5.13 120.40 113.07 1gg4 s VAL 403 Ca 0.00 -0.67 0.00 0.00 -2.93 0.00 0.00 61.98 58.38 1gg4 s VAL 403 Cb 0.00 -2.16 0.00 0.00 -1.53 0.00 0.00 36.38 32.69 1gg4 s VAL 403 CO 0.00 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.38 1gg4 n GLY 404 N -0.51 -1.39 3.17 6.54 0.00 -1.26 -4.36 105.19 107.39 1gg4 n GLY 404 Ca -0.06 -1.58 -0.08 0.00 0.00 0.00 0.00 46.02 44.30 1gg4 n GLY 404 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1gg4 s GLU 405 N -2.01 0.79 0.14 1.61 -1.05 -0.57 -4.85 118.70 112.76 1gg4 s GLU 405 Ca 0.00 -1.09 0.08 0.00 -0.15 0.00 0.00 54.97 53.81 1gg4 s GLU 405 Cb 0.00 0.29 -0.04 0.00 -0.44 0.00 0.00 34.13 33.94 1gg4 s GLU 405 CO 0.00 -0.22 -0.10 -1.58 0.95 0.00 0.00 175.26 174.31 1gg4 s HIS 406 N -3.90 2.68 0.11 4.83 2.46 -1.26 -0.83 115.29 119.38 1gg4 s HIS 406 Ca 0.08 -0.19 0.05 0.00 0.47 0.00 0.00 55.06 55.47 1gg4 s HIS 406 Cb 0.06 -1.36 -0.04 0.00 -0.13 0.00 0.00 32.58 31.11 1gg4 s HIS 406 CO -0.09 0.46 -0.13 -0.06 -2.47 0.00 0.00 174.74 172.45 1gg4 s PHE 407 N -1.43 1.31 -0.80 3.88 0.40 0.46 -4.92 117.98 116.87 1gg4 s PHE 407 Ca 0.23 -0.56 0.26 0.00 -0.60 0.00 0.00 56.93 56.26 1gg4 s PHE 407 Cb -0.10 -0.70 0.66 0.00 0.51 0.00 0.00 43.02 43.39 1gg4 s PHE 407 CO 0.14 0.10 1.57 0.00 0.70 0.00 0.00 175.22 177.73 1gg4 n ALA 408 N 0.65 2.78 -3.14 5.36 0.00 -1.26 -3.90 120.51 121.00 1gg4 n ALA 408 Ca -0.16 -0.19 -0.10 0.00 0.00 0.00 0.00 53.44 52.99 1gg4 n ALA 408 Cb 0.57 -1.29 -0.04 0.00 0.00 0.00 0.00 19.45 18.68 1gg4 n ALA 408 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1gg4 s ASP 409 N -3.82 -0.23 0.38 0.00 -4.77 -1.26 -4.88 116.67 102.09 1gg4 s ASP 409 Ca 0.10 -0.45 0.17 0.00 -3.30 0.00 0.00 52.55 49.07 1gg4 s ASP 409 Cb 0.15 0.53 0.74 0.00 -1.09 0.00 0.00 42.92 43.25 1gg4 s ASP 409 CO 0.65 -0.96 1.78 0.11 0.70 0.00 0.00 175.17 177.45 1gg4 h LYS 410 N 2.29 0.00 -0.44 2.11 1.57 -1.98 -3.21 116.57 116.92 1gg4 h LYS 410 Ca -0.31 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.39 1gg4 h LYS 410 Cb 1.26 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.55 1gg4 h LYS 410 CO 0.42 0.37 -0.06 1.15 -0.57 0.00 0.00 179.45 180.76 1gg4 h THR 411 N 0.00 1.25 -0.07 -0.16 2.02 -1.99 0.29 112.91 114.25 1gg4 h THR 411 Ca -0.00 -1.07 -0.15 0.00 0.77 0.00 0.00 66.41 65.96 1gg4 h THR 411 Cb 0.80 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 68.17 1gg4 h THR 411 CO 0.05 0.37 -0.61 0.00 0.37 0.00 0.00 175.52 175.69 1gg4 h ALA 412 N 1.25 0.84 0.16 6.16 0.00 -1.99 -2.45 119.26 123.24 1gg4 h ALA 412 Ca 0.13 -0.55 -0.01 0.00 0.00 0.00 0.00 54.91 54.48 1gg4 h ALA 412 Cb 0.51 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1gg4 h ALA 412 CO 0.03 0.74 -0.08 1.25 0.00 0.00 0.00 179.25 181.18 1gg4 h LEU 413 N 0.17 -0.19 -0.68 0.00 6.46 -1.39 -2.40 115.31 117.29 1gg4 h LEU 413 Ca -0.01 -0.24 0.10 0.00 -0.12 0.00 0.00 57.88 57.62 1gg4 h LEU 413 Cb 1.12 0.05 -0.08 0.00 -0.73 0.00 0.00 40.66 41.02 1gg4 h LEU 413 CO 0.09 0.15 0.29 0.40 -0.62 0.00 0.00 178.44 178.76 1gg4 h ILE 414 N -0.54 0.78 0.22 4.05 2.04 -0.90 0.43 117.51 123.60 1gg4 h ILE 414 Ca -0.02 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.66 1gg4 h ILE 414 Cb 0.41 0.24 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 1gg4 h ILE 414 CO 0.04 0.09 -0.12 0.74 0.00 0.00 0.00 178.15 178.90 1gg4 h THR 415 N 0.49 0.76 -0.03 -0.27 2.02 -1.41 0.28 112.91 114.76 1gg4 h THR 415 Ca 0.35 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.46 1gg4 h THR 415 Cb 0.43 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 67.59 1gg4 h THR 415 CO -0.31 0.00 -0.28 -0.09 0.37 0.00 0.00 175.52 175.21 1gg4 h ARG 416 N -0.31 0.05 0.13 6.66 1.12 -0.85 -2.24 114.38 118.94 1gg4 h ARG 416 Ca -0.03 -0.01 -0.01 0.00 -1.11 0.00 0.00 59.98 58.82 1gg4 h ARG 416 Cb 0.25 -0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.20 1gg4 h ARG 416 CO 0.04 0.32 -0.06 1.25 -3.11 0.00 0.00 179.97 178.41 1gg4 h LEU 417 N 0.04 -0.15 -0.87 3.80 6.46 0.20 -2.18 115.31 122.62 1gg4 h LEU 417 Ca 0.01 -0.34 0.15 0.00 -0.12 0.00 0.00 57.88 57.58 1gg4 h LEU 417 Cb 0.51 0.04 -0.10 0.00 -0.73 0.00 0.00 40.66 40.38 1gg4 h LEU 417 CO 0.04 0.29 0.46 0.11 -0.62 0.00 0.00 178.44 178.72 1gg4 h LYS 418 N -0.62 0.63 0.01 1.25 1.57 -0.15 -0.21 116.57 119.05 1gg4 h LYS 418 Ca -0.02 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1gg4 h LYS 418 Cb 0.48 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.65 1gg4 h LYS 418 CO 0.03 0.42 -0.01 -0.07 -0.57 0.00 0.00 179.45 179.25 1gg4 h LEU 419 N 0.65 -0.01 -1.08 2.94 3.38 -1.36 -1.11 115.31 118.72 1gg4 h LEU 419 Ca 0.48 -0.06 0.12 0.00 0.09 0.00 0.00 57.88 58.51 1gg4 h LEU 419 Cb 0.68 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.36 1gg4 h LEU 419 CO -0.36 0.05 0.62 0.25 0.09 0.00 0.00 178.44 179.08 1gg4 h LEU 420 N -0.07 0.88 -0.45 1.67 6.46 -0.54 0.60 115.31 123.86 1gg4 h LEU 420 Ca -0.00 0.04 -0.04 0.00 -0.12 0.00 0.00 57.88 57.76 1gg4 h LEU 420 Cb 0.07 -0.14 -0.02 0.00 -0.73 0.00 0.00 40.66 39.84 1gg4 h LEU 420 CO 0.00 0.48 0.12 0.40 -0.62 0.00 0.00 178.44 178.82 1gg4 h ILE 421 N 0.95 1.23 0.00 4.05 2.04 -0.59 0.24 117.51 125.43 1gg4 h ILE 421 Ca 0.48 -0.80 -0.14 0.00 1.00 0.00 0.00 64.86 65.40 1gg4 h ILE 421 Cb 0.49 0.90 -0.02 0.00 -0.74 0.00 0.00 36.82 37.45 1gg4 h ILE 421 CO -0.24 0.29 -0.65 0.00 0.00 0.00 0.00 178.15 177.55 1gg4 h ALA 422 N 0.98 0.91 -0.04 1.87 0.00 0.06 -3.22 119.26 119.81 1gg4 h ALA 422 Ca 0.14 -0.59 -0.25 0.00 0.00 0.00 0.00 54.91 54.21 1gg4 h ALA 422 Cb 0.31 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 18.02 1gg4 h ALA 422 CO 0.00 0.81 -0.97 1.49 0.00 0.00 0.00 179.25 180.58 1gg4 h GLU 423 N 0.00 0.69 -4.68 0.00 4.81 0.40 -3.42 114.58 112.38 1gg4 h GLU 423 Ca -0.01 -0.70 -0.69 0.00 -0.13 0.00 0.00 59.36 57.83 1gg4 h GLU 423 Cb 1.16 0.19 -0.25 0.00 0.63 0.00 0.00 28.75 30.48 1gg4 h GLU 423 CO 0.08 1.29 -0.56 -0.65 -0.73 0.00 0.00 179.01 178.44 1gg4 s GLN 424 N -3.42 2.93 0.50 1.92 -1.52 0.82 -4.96 119.66 115.93 1gg4 s GLN 424 Ca -0.09 -0.99 0.29 0.00 -1.95 0.00 0.00 55.36 52.61 1gg4 s GLN 424 Cb 0.08 -3.59 1.18 0.00 -0.22 0.00 0.00 33.01 30.46 1gg4 s GLN 424 CO 0.91 -0.60 1.93 -0.56 -0.25 0.00 0.00 175.29 176.72 1gg4 h GLN 425 N 8.35 0.00 -3.20 2.91 3.07 -1.83 -3.36 115.11 121.05 1gg4 h GLN 425 Ca -0.27 0.00 -0.63 0.00 0.09 0.00 0.00 58.65 57.84 1gg4 h GLN 425 Cb 1.11 0.00 -0.41 0.00 0.08 0.00 0.00 27.48 28.26 1gg4 h GLN 425 CO 0.63 0.12 -0.66 0.08 0.09 0.00 0.00 178.83 179.09 1gg4 s VAL 426 N -3.72 2.24 0.03 1.86 1.01 -1.26 -4.42 120.40 116.13 1gg4 s VAL 426 Ca 0.00 -3.23 0.05 0.00 0.00 0.00 0.00 61.98 58.80 1gg4 s VAL 426 Cb 0.10 -2.54 -0.02 0.00 0.00 0.00 0.00 36.38 33.92 1gg4 s VAL 426 CO 0.59 -0.87 -0.14 0.27 0.00 0.00 0.00 175.10 174.94 1gg4 s ILE 427 N -0.28 1.14 -0.15 2.22 -5.25 -1.09 -0.52 121.20 117.26 1gg4 s ILE 427 Ca 0.19 -0.94 0.02 0.00 -0.99 0.00 0.00 60.65 58.93 1gg4 s ILE 427 Cb -0.21 -1.01 0.01 0.00 2.95 0.00 0.00 42.46 44.19 1gg4 s ILE 427 CO -0.03 0.06 -0.21 -0.89 -1.79 0.00 0.00 174.94 172.09 1gg4 s THR 428 N -0.76 2.18 -0.06 8.37 2.01 -0.60 -1.78 115.64 124.99 1gg4 s THR 428 Ca 0.02 -0.94 0.03 0.00 0.31 0.00 0.00 61.69 61.12 1gg4 s THR 428 Cb -0.07 -1.88 -0.02 0.00 0.01 0.00 0.00 72.50 70.53 1gg4 s THR 428 CO 0.01 0.54 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.70 1gg4 s ILE 429 N 0.85 2.96 -0.22 1.82 1.01 0.58 -1.10 121.20 127.10 1gg4 s ILE 429 Ca -0.06 -0.75 0.00 0.00 0.00 0.00 0.00 60.65 59.84 1gg4 s ILE 429 Cb -0.15 -2.16 0.06 0.00 0.01 0.00 0.00 42.46 40.21 1gg4 s ILE 429 CO -0.02 0.58 -0.04 -0.22 0.00 0.00 0.00 174.94 175.23 1gg4 s LEU 430 N -0.50 2.33 -0.19 2.97 0.20 -0.58 0.11 118.68 123.02 1gg4 s LEU 430 Ca 0.07 -1.10 -0.12 0.00 0.69 0.00 0.00 54.13 53.67 1gg4 s LEU 430 Cb -0.12 -1.09 -0.05 0.00 -0.43 0.00 0.00 46.19 44.51 1gg4 s LEU 430 CO 0.01 -0.24 0.20 -0.69 -0.29 0.00 0.00 176.35 175.35 1gg4 s VAL 431 N 1.47 5.36 -0.24 1.68 1.01 -0.91 -0.27 120.40 128.49 1gg4 s VAL 431 Ca -0.05 0.33 -0.25 0.00 0.00 0.00 0.00 61.98 62.02 1gg4 s VAL 431 Cb -0.18 -3.54 0.07 0.00 0.00 0.00 0.00 36.38 32.72 1gg4 s VAL 431 CO -0.07 0.40 0.70 -0.75 0.00 0.00 0.00 175.10 175.38 1gg4 s LYS 432 N 0.54 0.84 0.18 2.72 2.20 -0.52 -1.46 119.74 124.24 1gg4 s LYS 432 Ca 0.11 0.90 -0.23 0.00 -0.36 0.00 0.00 55.97 56.39 1gg4 s LYS 432 Cb -0.12 0.41 0.08 0.00 -1.51 0.00 0.00 37.83 36.68 1gg4 s LYS 432 CO 0.01 -0.12 1.03 0.20 -0.36 0.00 0.00 175.35 176.11 1gg4 s GLY 433 N 0.21 0.05 0.85 5.54 0.00 -1.26 -2.19 107.32 110.51 1gg4 s GLY 433 Ca -0.01 -0.24 -0.12 0.00 0.00 0.00 0.00 44.72 44.35 1gg4 s GLY 433 CO 0.02 1.95 1.10 -1.35 0.00 0.00 0.00 173.10 174.82 1gg4 s SER 434 N -3.32 3.99 0.13 1.64 1.04 -0.28 -3.10 113.70 113.80 1gg4 s SER 434 Ca 0.20 1.32 -0.21 0.00 0.48 0.00 0.00 55.95 57.74 1gg4 s SER 434 Cb -0.02 -2.01 -0.03 0.00 0.10 0.00 0.00 66.02 64.06 1gg4 s SER 434 CO 0.05 -2.29 1.69 0.03 0.98 0.00 0.00 173.24 173.70 1gg4 h ARG 435 N -1.31 -0.06 -0.02 4.02 2.47 -1.85 -0.61 114.38 117.01 1gg4 h ARG 435 Ca -0.48 0.00 0.01 0.00 -1.26 0.00 0.00 59.98 58.25 1gg4 h ARG 435 Cb 1.28 0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 29.62 1gg4 h ARG 435 CO 0.58 -0.04 0.02 0.66 0.56 0.00 0.00 179.97 181.75 1gg4 h SER 436 N -0.07 0.00 0.68 7.04 4.64 -1.92 -0.93 113.55 122.99 1gg4 h SER 436 Ca 0.09 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.34 1gg4 h SER 436 Cb 0.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 1gg4 h SER 436 CO -0.21 0.00 -0.36 0.00 -0.87 0.00 0.00 176.83 175.39 1gg4 h ALA 437 N 1.97 1.10 -4.23 5.18 0.00 -1.38 -3.52 119.26 118.38 1gg4 h ALA 437 Ca 0.01 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1gg4 h ALA 437 Cb 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1gg4 h ALA 437 CO -0.00 0.45 -0.87 0.00 0.00 0.00 0.00 179.25 178.82 1gg4 n ALA 438 N -2.33 -1.87 0.00 0.00 0.00 -0.36 -4.99 120.51 110.96 1gg4 n ALA 438 Ca -0.01 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.87 1gg4 n ALA 438 Cb 0.46 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.54 1gg4 n ALA 438 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1gg4 n GLU 440 N 1.38 0.00 -0.24 0.00 0.00 -1.26 -4.50 120.64 116.02 1gg4 n GLU 440 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 57.16 57.28 1gg4 n GLU 440 Cb 0.00 -1.34 0.40 0.00 0.00 0.00 0.00 31.44 30.49 1gg4 n GLU 440 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 1gg4 h GLU 441 N 0.00 0.63 -0.29 3.44 5.08 -1.98 0.86 114.58 122.32 1gg4 h GLU 441 Ca 0.00 -0.04 -0.16 0.00 -1.00 0.00 0.00 59.36 58.16 1gg4 h GLU 441 Cb 0.00 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 1gg4 h GLU 441 CO 0.00 0.42 -0.46 0.28 -1.00 0.00 0.00 179.01 178.25 1gg4 h VAL 442 N 0.65 1.29 -0.27 3.13 2.07 -1.96 -0.56 116.25 120.61 1gg4 h VAL 442 Ca 0.41 -1.65 -0.08 0.00 0.82 0.00 0.00 66.70 66.20 1gg4 h VAL 442 Cb 0.67 1.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.98 1gg4 h VAL 442 CO -0.17 0.53 -0.15 0.58 0.02 0.00 0.00 177.57 178.39 1gg4 h VAL 443 N 0.61 1.30 0.41 2.57 2.07 -0.73 -2.00 116.25 120.48 1gg4 h VAL 443 Ca 0.04 -1.25 -0.02 0.00 0.82 0.00 0.00 66.70 66.29 1gg4 h VAL 443 Cb 1.03 1.54 0.00 0.00 -1.52 0.00 0.00 31.29 32.34 1gg4 h VAL 443 CO 0.10 0.39 -0.20 0.03 0.02 0.00 0.00 177.57 177.92 1gg4 h ARG 444 N 0.30 -0.53 -1.00 1.57 2.47 0.55 -2.84 114.38 114.89 1gg4 h ARG 444 Ca 0.06 0.04 0.19 0.00 -1.26 0.00 0.00 59.98 59.00 1gg4 h ARG 444 Cb 0.66 0.12 -0.10 0.00 -1.65 0.00 0.00 29.97 29.00 1gg4 h ARG 444 CO 0.04 -0.32 0.61 0.00 0.56 0.00 0.00 179.97 180.86 1gg4 h ALA 445 N -0.02 1.71 0.00 0.04 0.00 -1.10 -0.22 119.26 119.68 1gg4 h ALA 445 Ca -0.06 0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1gg4 h ALA 445 Cb 0.45 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1gg4 h ALA 445 CO 0.09 -0.08 -0.35 -0.07 0.00 0.00 0.00 179.25 178.85 1gg4 h LEU 446 N 0.75 0.00 -1.45 0.00 3.38 -1.13 -3.51 115.31 113.34 1gg4 h LEU 446 Ca 0.57 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.54 1gg4 h LEU 446 Cb 0.91 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.66 1gg4 h LEU 446 CO -0.36 0.35 0.00 0.00 0.09 0.00 0.00 178.44 178.51