#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g4i s ASP 2 N 0.00 5.10 -0.21 0.00 1.01 -1.26 -5.07 116.67 116.24 2g4i s ASP 2 Ca 0.00 1.18 -0.06 0.00 0.71 0.00 0.00 52.55 54.38 2g4i s ASP 2 Cb 0.00 -1.95 -0.03 0.00 1.01 0.00 0.00 42.92 41.96 2g4i s ASP 2 CO 0.00 -1.57 0.03 -0.89 0.21 0.00 0.00 175.17 172.95 2g4i s THR 3 N -3.30 4.21 -0.06 -1.27 2.01 -1.26 -5.06 115.64 110.91 2g4i s THR 3 Ca 0.59 -0.22 0.03 0.00 0.31 0.00 0.00 61.69 62.40 2g4i s THR 3 Cb -0.12 -2.92 0.01 0.00 0.01 0.00 0.00 72.50 69.48 2g4i s THR 3 CO 0.52 0.41 -0.14 -0.63 -0.69 0.00 0.00 174.62 174.10 2g4i s ILE 4 N 1.02 1.24 -0.20 1.82 -1.09 -1.26 -3.49 121.20 119.24 2g4i s ILE 4 Ca 0.03 -0.55 0.01 0.00 -2.23 0.00 0.00 60.65 57.90 2g4i s ILE 4 Cb -0.14 -1.11 0.03 0.00 -1.58 0.00 0.00 42.46 39.65 2g4i s ILE 4 CO 0.02 0.38 -0.17 -0.69 -1.23 0.00 0.00 174.94 173.24 2g4i s VAL 5 N 0.52 2.14 0.07 2.92 1.01 -0.47 -0.58 120.40 126.02 2g4i s VAL 5 Ca -0.13 -1.06 0.05 0.00 0.00 0.00 0.00 61.98 60.85 2g4i s VAL 5 Cb -0.15 -1.98 -0.03 0.00 0.00 0.00 0.00 36.38 34.23 2g4i s VAL 5 CO 0.04 0.42 -0.15 0.00 0.00 0.00 0.00 175.10 175.42 2g4i s ALA 6 N 1.26 1.20 -0.27 5.51 0.00 0.17 -0.19 121.76 129.46 2g4i s ALA 6 Ca 0.02 -1.01 -0.09 0.00 0.00 0.00 0.00 51.96 50.88 2g4i s ALA 6 Cb -0.14 -0.11 -0.04 0.00 0.00 0.00 0.00 23.12 22.83 2g4i s ALA 6 CO -0.11 0.18 0.13 0.08 0.00 0.00 0.00 175.76 176.04 2g4i s VAL 7 N -1.26 4.79 -0.15 0.00 1.01 -0.08 -0.12 120.40 124.59 2g4i s VAL 7 Ca -0.02 -0.02 -0.09 0.00 0.00 0.00 0.00 61.98 61.85 2g4i s VAL 7 Cb -0.10 -3.27 -0.05 0.00 0.00 0.00 0.00 36.38 32.97 2g4i s VAL 7 CO 0.02 0.29 0.16 -1.83 0.00 0.00 0.00 175.10 173.74 2g4i s GLU 8 N 1.68 3.81 -0.65 2.72 -1.05 -0.14 -1.76 118.70 123.30 2g4i s GLU 8 Ca 0.07 -0.12 -0.11 0.00 -0.15 0.00 0.00 54.97 54.66 2g4i s GLU 8 Cb -0.16 -3.29 0.17 0.00 -0.44 0.00 0.00 34.13 30.41 2g4i s GLU 8 CO 0.07 0.56 0.55 -0.51 0.95 0.00 0.00 175.26 176.88 2g4i s LEU 9 N -0.40 6.11 -0.32 1.83 1.43 0.12 -1.06 118.68 126.39 2g4i s LEU 9 Ca 0.13 -2.38 -0.10 0.00 -1.03 0.00 0.00 54.13 50.75 2g4i s LEU 9 Cb -0.12 -2.09 -0.00 0.00 0.03 0.00 0.00 46.19 44.00 2g4i s LEU 9 CO 0.02 -0.61 0.16 -0.62 0.23 0.00 0.00 176.35 175.53 2g4i s ASP 10 N 2.25 5.59 0.17 2.29 -1.08 -0.31 -1.70 116.67 123.87 2g4i s ASP 10 Ca 0.12 -0.57 0.21 0.00 -0.52 0.00 0.00 52.55 51.79 2g4i s ASP 10 Cb -0.20 -2.01 -0.03 0.00 -1.46 0.00 0.00 42.92 39.23 2g4i s ASP 10 CO -0.04 -0.21 1.00 0.71 0.52 0.00 0.00 175.17 177.15 2g4i h THR 11 N 5.67 0.17 -3.28 1.71 1.35 -1.46 -2.05 112.91 115.02 2g4i h THR 11 Ca -0.31 -1.33 -0.66 0.00 -0.55 0.00 0.00 66.41 63.55 2g4i h THR 11 Cb 1.14 1.70 -0.30 0.00 -1.73 0.00 0.00 68.15 68.96 2g4i h THR 11 CO 0.62 0.10 -0.77 -0.47 -0.25 0.00 0.00 175.52 174.75 2g4i s TYR 12 N -3.22 2.89 -0.41 4.73 6.14 -1.22 -4.47 117.35 121.79 2g4i s TYR 12 Ca -0.01 -1.17 -0.29 0.00 0.64 0.00 0.00 57.07 56.24 2g4i s TYR 12 Cb 0.09 -2.03 0.02 0.00 0.42 0.00 0.00 41.96 40.46 2g4i s TYR 12 CO 0.79 -0.63 1.27 -1.25 0.64 0.00 0.00 175.55 176.37 2g4i s PRO 13 N 1.37 3.72 -0.95 4.97 0.04 -1.26 -4.96 135.00 137.93 2g4i s PRO 13 Ca 0.05 0.86 -0.08 0.00 0.04 0.00 0.00 61.00 61.87 2g4i s PRO 13 Cb -0.14 -3.94 0.24 0.00 0.04 0.00 0.00 34.50 30.71 2g4i s PRO 13 CO -0.06 -1.38 0.90 -0.80 0.04 0.00 0.00 177.00 175.70 2g4i s ASN 14 N 3.02 6.70 0.56 6.66 -0.87 -1.26 -4.92 114.94 124.83 2g4i s ASN 14 Ca 0.54 -3.36 0.34 0.00 -1.57 0.00 0.00 52.86 48.82 2g4i s ASN 14 Cb -0.12 -2.11 1.44 0.00 -0.02 0.00 0.00 41.25 40.45 2g4i s ASN 14 CO 0.29 -0.33 2.01 0.71 -2.57 0.00 0.00 177.10 177.21 2g4i h THR 15 N 4.16 0.02 0.00 1.60 1.35 -1.84 -1.66 112.91 116.54 2g4i h THR 15 Ca 0.14 -0.49 -0.00 0.00 -0.55 0.00 0.00 66.41 65.51 2g4i h THR 15 Cb 0.90 1.48 -0.00 0.00 -1.73 0.00 0.00 68.15 68.80 2g4i h THR 15 CO 0.89 0.01 -0.02 -2.24 -0.25 0.00 0.00 175.52 173.91 2g4i h ASP 16 N 0.00 0.00 -0.43 5.36 2.03 -1.91 -2.89 116.42 118.58 2g4i h ASP 16 Ca -0.00 0.00 -0.17 0.00 -0.73 0.00 0.00 57.03 56.13 2g4i h ASP 16 Cb 0.48 0.00 -0.10 0.00 -0.83 0.00 0.00 39.33 38.88 2g4i h ASP 16 CO 0.00 0.02 0.06 2.30 -1.03 0.00 0.00 179.24 180.59 2g4i n ILE 17 N -4.42 2.58 -0.51 4.15 -5.35 -0.66 -4.97 119.36 110.19 2g4i n ILE 17 Ca -0.03 -2.31 0.00 0.00 -0.27 0.00 0.00 62.75 60.14 2g4i n ILE 17 Cb 0.10 -0.32 0.00 0.00 -1.74 0.00 0.00 39.64 37.68 2g4i n ILE 17 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2g4i n GLY 18 N -0.87 0.98 3.71 3.28 0.00 -1.09 -4.59 105.19 106.60 2g4i n GLY 18 Ca 0.33 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.95 2g4i n GLY 18 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2g4i n ASP 19 N 0.00 2.65 -4.54 1.61 8.00 -1.00 -4.95 116.55 118.32 2g4i n ASP 19 Ca 0.00 1.12 -0.28 0.00 0.71 0.00 0.00 54.79 56.33 2g4i n ASP 19 Cb 0.00 -1.51 0.22 0.00 -0.02 0.00 0.00 41.12 39.81 2g4i n ASP 19 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 2g4i s PRO 20 N -2.21 -0.40 -0.15 -0.24 0.04 -1.26 -4.03 135.00 126.75 2g4i s PRO 20 Ca 0.61 0.58 0.00 0.00 0.04 0.00 0.00 61.00 62.23 2g4i s PRO 20 Cb -0.50 -1.63 0.15 0.00 0.04 0.00 0.00 34.50 32.55 2g4i s PRO 20 CO 0.58 -3.31 1.68 -1.13 0.04 0.00 0.00 177.00 174.87 2g4i n SER 21 N -4.59 4.78 -3.84 6.66 3.41 -1.26 -4.62 113.62 114.17 2g4i n SER 21 Ca 0.04 -2.63 -0.10 0.00 -0.26 0.00 0.00 58.87 55.93 2g4i n SER 21 Cb 0.56 -0.87 -0.05 0.00 -0.26 0.00 0.00 64.21 63.58 2g4i n SER 21 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 2g4i s TYR 22 N -0.97 0.12 0.43 7.33 -0.85 -1.26 -4.99 117.35 117.17 2g4i s TYR 22 Ca 0.16 -0.47 -0.25 0.00 -0.52 0.00 0.00 57.07 56.00 2g4i s TYR 22 Cb 0.13 0.17 -0.10 0.00 0.38 0.00 0.00 41.96 42.54 2g4i s TYR 22 CO 0.01 -0.80 1.20 -2.30 -1.52 0.00 0.00 175.55 172.14 2g4i n PRO 23 N -0.26 1.73 -3.63 -3.49 -0.02 -1.26 -4.51 135.00 123.56 2g4i n PRO 23 Ca -0.09 0.62 -0.14 0.00 -2.02 0.00 0.00 63.50 61.86 2g4i n PRO 23 Cb 0.63 -2.30 -0.06 0.00 -0.02 0.00 0.00 33.50 31.75 2g4i n PRO 23 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 2g4i s HIS 24 N -1.23 -0.37 -0.08 6.00 -3.43 -0.77 -0.92 115.29 114.49 2g4i s HIS 24 Ca 0.63 0.46 -0.10 0.00 -0.80 0.00 0.00 55.06 55.25 2g4i s HIS 24 Cb -0.51 0.27 -0.05 0.00 -1.43 0.00 0.00 32.58 30.86 2g4i s HIS 24 CO 0.57 -0.57 0.23 0.96 -2.00 0.00 0.00 174.74 173.93 2g4i s ILE 25 N -2.05 5.35 0.11 -5.38 -4.36 -0.13 -1.16 121.20 113.58 2g4i s ILE 25 Ca -0.08 0.42 0.03 0.00 -0.26 0.00 0.00 60.65 60.77 2g4i s ILE 25 Cb -0.01 -3.51 -0.04 0.00 1.25 0.00 0.00 42.46 40.15 2g4i s ILE 25 CO 0.01 0.60 -0.09 -0.83 0.24 0.00 0.00 174.94 174.87 2g4i s GLY 26 N -0.96 0.88 -0.21 6.27 0.00 -0.22 -1.15 107.32 111.91 2g4i s GLY 26 Ca 0.18 -1.35 -0.02 0.00 0.00 0.00 0.00 44.72 43.53 2g4i s GLY 26 CO 0.07 -1.45 -0.09 -0.42 0.00 0.00 0.00 173.10 171.21 2g4i s ILE 27 N -3.23 2.87 -0.32 0.90 1.01 -0.72 -0.97 121.20 120.75 2g4i s ILE 27 Ca 0.12 -0.74 -0.04 0.00 0.00 0.00 0.00 60.65 59.99 2g4i s ILE 27 Cb 0.02 -2.31 0.04 0.00 0.01 0.00 0.00 42.46 40.22 2g4i s ILE 27 CO -0.02 0.41 0.05 -1.81 0.00 0.00 0.00 174.94 173.58 2g4i s ASP 28 N 1.39 5.11 -0.48 3.58 1.01 0.83 -0.94 116.67 127.17 2g4i s ASP 28 Ca 0.04 -1.20 -0.09 0.00 0.71 0.00 0.00 52.55 52.02 2g4i s ASP 28 Cb -0.14 -1.79 0.12 0.00 1.01 0.00 0.00 42.92 42.12 2g4i s ASP 28 CO -0.07 -0.29 0.35 -0.63 0.21 0.00 0.00 175.17 174.75 2g4i s ILE 29 N 1.33 4.20 -1.47 0.77 -1.09 -1.26 -0.65 121.20 123.03 2g4i s ILE 29 Ca -0.03 -1.84 0.00 0.00 -2.23 0.00 0.00 60.65 56.55 2g4i s ILE 29 Cb -0.20 -3.77 0.00 0.00 -1.58 0.00 0.00 42.46 36.92 2g4i s ILE 29 CO 0.01 -0.78 0.00 0.29 -1.23 0.00 0.00 174.94 173.23 2g4i n LYS 30 N 4.85 -1.59 -3.62 2.79 5.02 0.26 -4.94 118.16 120.93 2g4i n LYS 30 Ca -0.07 0.95 -0.15 0.00 -2.02 0.00 0.00 58.31 57.02 2g4i n LYS 30 Cb 0.41 -5.31 -0.07 0.00 -0.02 0.00 0.00 35.03 30.04 2g4i n LYS 30 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2g4i s SER 31 N -2.42 -0.60 0.28 4.39 0.15 -1.26 -4.95 113.70 109.29 2g4i s SER 31 Ca 0.00 0.93 0.24 0.00 0.70 0.00 0.00 55.95 57.82 2g4i s SER 31 Cb 0.00 0.90 1.02 0.00 -1.71 0.00 0.00 66.02 66.23 2g4i s SER 31 CO 0.00 -0.38 1.73 1.62 1.20 0.00 0.00 173.24 177.40 2g4i h VAL 32 N 3.71 0.00 -1.06 4.45 3.04 -1.84 -3.38 116.25 121.18 2g4i h VAL 32 Ca -0.28 -0.24 -0.65 0.00 -1.01 0.00 0.00 66.70 64.52 2g4i h VAL 32 Cb 1.16 0.98 -0.09 0.00 -2.01 0.00 0.00 31.29 31.32 2g4i h VAL 32 CO 0.24 0.00 1.84 -0.13 -1.01 0.00 0.00 177.57 178.51 2g4i s ARG 33 N -3.35 3.81 0.13 4.17 0.52 -1.26 -4.98 118.95 117.98 2g4i s ARG 33 Ca 0.04 -1.64 -0.27 0.00 -0.52 0.00 0.00 55.73 53.33 2g4i s ARG 33 Cb 0.09 -5.43 -0.16 0.00 0.52 0.00 0.00 34.95 29.98 2g4i s ARG 33 CO 0.39 -2.21 0.59 0.43 0.02 0.00 0.00 175.30 174.52 2g4i n SER 34 N 8.46 -0.78 0.21 0.23 7.64 -1.26 -4.85 113.62 123.26 2g4i n SER 34 Ca 0.41 0.99 0.11 0.00 1.01 0.00 0.00 58.87 61.39 2g4i n SER 34 Cb 0.48 -0.82 0.27 0.00 -1.01 0.00 0.00 64.21 63.13 2g4i n SER 34 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2g4i h LYS 35 N 1.36 0.00 -2.39 1.43 1.79 -1.36 -3.45 116.57 113.94 2g4i h LYS 35 Ca -0.30 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.09 2g4i h LYS 35 Cb 1.25 0.00 -0.20 0.00 -1.58 0.00 0.00 32.23 31.71 2g4i h LYS 35 CO 0.52 0.14 0.01 0.21 -1.08 0.00 0.00 179.45 179.25 2g4i s LYS 36 N -3.30 0.89 0.08 3.15 2.47 -1.25 -5.02 119.74 116.77 2g4i s LYS 36 Ca 0.04 0.14 -0.02 0.00 -1.56 0.00 0.00 55.97 54.58 2g4i s LYS 36 Cb 0.07 0.42 -0.04 0.00 -1.46 0.00 0.00 37.83 36.82 2g4i s LYS 36 CO 0.66 -0.26 0.02 0.95 0.16 0.00 0.00 175.35 176.88 2g4i s THR 37 N -1.13 0.17 0.01 3.43 -4.23 -1.26 -1.75 115.64 110.88 2g4i s THR 37 Ca -0.11 -1.81 0.01 0.00 -1.18 0.00 0.00 61.69 58.60 2g4i s THR 37 Cb -0.02 -1.70 -0.01 0.00 1.34 0.00 0.00 72.50 72.11 2g4i s THR 37 CO 0.07 -0.79 -0.04 0.00 -0.54 0.00 0.00 174.62 173.33 2g4i s ALA 38 N -3.96 0.29 0.23 3.99 0.00 -0.30 -4.97 121.76 117.04 2g4i s ALA 38 Ca 0.13 -0.29 -0.31 0.00 0.00 0.00 0.00 51.96 51.49 2g4i s ALA 38 Cb 0.08 -0.02 -0.14 0.00 0.00 0.00 0.00 23.12 23.04 2g4i s ALA 38 CO -0.06 0.02 1.38 1.17 0.00 0.00 0.00 175.76 178.28 2g4i n LYS 39 N 2.58 1.94 -4.47 0.00 4.81 -1.26 -0.96 118.16 120.81 2g4i n LYS 39 Ca -0.16 0.69 -0.30 0.00 -0.87 0.00 0.00 58.31 57.68 2g4i n LYS 39 Cb 0.58 -2.33 -0.17 0.00 0.02 0.00 0.00 35.03 33.13 2g4i n LYS 39 CO 0.00 0.00 0.00 -0.46 1.17 0.00 0.00 177.40 178.11 2g4i s TRP 40 N -0.06 2.23 -1.20 5.64 -0.00 -0.09 -4.75 118.94 120.70 2g4i s TRP 40 Ca 0.69 -1.10 -0.09 0.00 -0.00 0.00 0.00 56.10 55.60 2g4i s TRP 40 Cb -0.67 -1.57 0.22 0.00 -0.00 0.00 0.00 33.47 31.44 2g4i s TRP 40 CO 0.50 -0.55 1.62 0.09 -0.00 0.00 0.00 176.95 178.61 2g4i n ASN 41 N 4.23 5.52 -4.61 5.86 4.13 -1.26 -4.34 115.26 124.79 2g4i n ASN 41 Ca -0.19 -3.16 -0.50 0.00 1.68 0.00 0.00 54.58 52.41 2g4i n ASN 41 Cb 0.51 -1.43 -0.05 0.00 -1.54 0.00 0.00 39.78 37.27 2g4i n ASN 41 CO 0.00 0.00 0.00 0.80 0.28 0.00 0.00 177.26 178.34 2g4i n MET 42 N 3.38 1.39 -3.94 3.52 1.56 -1.26 -5.00 117.12 116.76 2g4i n MET 42 Ca 0.34 0.50 -0.35 0.00 -0.27 0.00 0.00 57.70 57.92 2g4i n MET 42 Cb 0.37 -2.14 -0.14 0.00 2.15 0.00 0.00 33.22 33.45 2g4i n MET 42 CO 0.00 0.00 0.00 -0.65 -0.73 0.00 0.00 175.97 174.59 2g4i s GLN 43 N 0.36 3.02 -0.01 2.12 -0.21 -1.26 -5.09 119.66 118.58 2g4i s GLN 43 Ca 0.80 -0.86 -0.30 0.00 0.02 0.00 0.00 55.36 55.02 2g4i s GLN 43 Cb -0.87 -2.99 -0.06 0.00 1.00 0.00 0.00 33.01 30.09 2g4i s GLN 43 CO 0.46 -0.33 1.53 1.21 -2.12 0.00 0.00 175.29 176.04 2g4i s ASN 44 N 1.38 6.74 0.00 5.90 3.84 -1.26 -3.07 114.94 128.47 2g4i s ASN 44 Ca 0.02 2.21 0.00 0.00 0.21 0.00 0.00 52.86 55.30 2g4i s ASN 44 Cb -0.16 -2.55 0.00 0.00 -0.55 0.00 0.00 41.25 37.99 2g4i s ASN 44 CO -0.04 -0.82 0.00 0.61 -2.79 0.00 0.00 177.10 174.05 2g4i n GLY 45 N 3.87 0.34 3.90 1.21 0.00 -0.31 -4.97 105.19 109.23 2g4i n GLY 45 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 2g4i n GLY 45 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2g4i s LYS 46 N -0.67 3.43 -0.10 1.61 2.20 -1.17 -4.96 119.74 120.08 2g4i s LYS 46 Ca 0.00 -0.28 -0.30 0.00 -0.36 0.00 0.00 55.97 55.03 2g4i s LYS 46 Cb 0.00 -3.11 -0.02 0.00 -1.51 0.00 0.00 37.83 33.19 2g4i s LYS 46 CO 0.00 0.70 1.14 0.08 -0.36 0.00 0.00 175.35 176.91 2g4i s VAL 47 N -1.26 4.45 0.44 4.02 1.01 -1.26 -4.28 120.40 123.52 2g4i s VAL 47 Ca 0.25 1.75 0.07 0.00 0.00 0.00 0.00 61.98 64.04 2g4i s VAL 47 Cb -0.12 -4.13 -0.04 0.00 0.00 0.00 0.00 36.38 32.09 2g4i s VAL 47 CO 0.16 -0.04 0.19 -0.83 0.00 0.00 0.00 175.10 174.57 2g4i s GLY 48 N 1.41 2.41 -0.04 4.51 0.00 0.38 -4.56 107.32 111.43 2g4i s GLY 48 Ca 0.52 -1.86 -0.01 0.00 0.00 0.00 0.00 44.72 43.38 2g4i s GLY 48 CO 0.18 -1.95 0.03 -1.59 0.00 0.00 0.00 173.10 169.77 2g4i s THR 49 N -2.65 0.03 -0.06 0.90 2.01 0.64 -1.40 115.64 115.11 2g4i s THR 49 Ca 0.37 0.27 -0.03 0.00 0.31 0.00 0.00 61.69 62.61 2g4i s THR 49 Cb 0.03 -0.22 -0.04 0.00 0.01 0.00 0.00 72.50 72.29 2g4i s THR 49 CO 0.20 0.17 0.07 0.00 -0.69 0.00 0.00 174.62 174.37 2g4i s ALA 50 N 1.69 3.57 -0.06 7.40 0.00 -0.32 -1.16 121.76 132.88 2g4i s ALA 50 Ca -0.01 -0.78 0.02 0.00 0.00 0.00 0.00 51.96 51.18 2g4i s ALA 50 Cb -0.13 -1.66 0.02 0.00 0.00 0.00 0.00 23.12 21.36 2g4i s ALA 50 CO -0.03 0.64 -0.08 -1.01 0.00 0.00 0.00 175.76 175.27 2g4i s HIS 51 N -1.05 1.13 -0.04 0.00 3.76 -0.21 -1.69 115.29 117.19 2g4i s HIS 51 Ca 0.18 -0.39 0.07 0.00 -0.15 0.00 0.00 55.06 54.76 2g4i s HIS 51 Cb -0.12 -0.89 -0.01 0.00 1.11 0.00 0.00 32.58 32.67 2g4i s HIS 51 CO 0.07 -0.25 -0.24 0.42 -0.85 0.00 0.00 174.74 173.89 2g4i s ILE 52 N 0.84 1.93 0.02 0.60 1.09 0.74 -0.87 121.20 125.56 2g4i s ILE 52 Ca -0.12 -1.02 -0.01 0.00 -1.10 0.00 0.00 60.65 58.40 2g4i s ILE 52 Cb -0.15 -1.62 -0.02 0.00 -1.06 0.00 0.00 42.46 39.61 2g4i s ILE 52 CO 0.01 0.54 -0.02 0.27 -0.10 0.00 0.00 174.94 175.65 2g4i s ILE 53 N -0.36 0.12 -0.10 2.92 -4.36 -0.26 -1.51 121.20 117.64 2g4i s ILE 53 Ca 0.03 -0.96 -0.30 0.00 -0.26 0.00 0.00 60.65 59.17 2g4i s ILE 53 Cb -0.11 -0.36 0.08 0.00 1.25 0.00 0.00 42.46 43.32 2g4i s ILE 53 CO 0.01 -0.53 0.73 -0.47 0.24 0.00 0.00 174.94 174.92 2g4i s TYR 54 N -1.63 -0.64 0.08 1.37 5.04 -1.00 -1.17 117.35 119.40 2g4i s TYR 54 Ca -0.14 1.20 -0.10 0.00 -2.44 0.00 0.00 57.07 55.59 2g4i s TYR 54 Cb -0.09 0.39 0.00 0.00 0.35 0.00 0.00 41.96 42.62 2g4i s TYR 54 CO -0.01 -0.54 0.21 0.54 -1.34 0.00 0.00 175.55 174.41 2g4i s ASN 55 N -0.90 0.07 0.09 4.32 2.20 -1.26 -1.07 114.94 118.40 2g4i s ASN 55 Ca -0.08 -0.57 0.27 0.00 -0.94 0.00 0.00 52.86 51.54 2g4i s ASN 55 Cb -0.01 0.34 0.85 0.00 -2.00 0.00 0.00 41.25 40.44 2g4i s ASN 55 CO 0.07 -0.71 1.71 -1.54 -2.94 0.00 0.00 177.10 173.70 2g4i n SER 56 N 0.06 0.46 0.19 3.54 3.41 0.51 -0.32 113.62 121.47 2g4i n SER 56 Ca -0.16 0.37 -0.10 0.00 -0.26 0.00 0.00 58.87 58.72 2g4i n SER 56 Cb 0.62 -0.40 -0.06 0.00 -0.26 0.00 0.00 64.21 64.11 2g4i n SER 56 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2g4i h VAL 57 N 0.00 0.24 0.00 -3.33 2.07 -1.88 -3.36 116.25 109.98 2g4i h VAL 57 Ca 0.00 -0.65 -0.17 0.00 0.82 0.00 0.00 66.70 66.71 2g4i h VAL 57 Cb 0.62 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 2g4i h VAL 57 CO 0.00 0.05 -0.79 0.44 0.02 0.00 0.00 177.57 177.30 2g4i h ASP 58 N -1.07 0.00 -6.01 0.57 3.32 -1.97 -3.48 116.42 107.78 2g4i h ASP 58 Ca -0.05 0.00 -0.39 0.00 0.02 0.00 0.00 57.03 56.61 2g4i h ASP 58 Cb 0.50 0.00 0.11 0.00 0.22 0.00 0.00 39.33 40.16 2g4i h ASP 58 CO 0.09 0.79 -0.90 0.29 -1.72 0.00 0.00 179.24 177.79 2g4i n LYS 59 N -3.30 -2.21 -3.72 3.56 5.02 0.56 -4.89 118.16 113.17 2g4i n LYS 59 Ca 0.01 0.59 -0.25 0.00 -2.02 0.00 0.00 58.31 56.64 2g4i n LYS 59 Cb 0.85 -4.76 -0.17 0.00 -0.02 0.00 0.00 35.03 30.93 2g4i n LYS 59 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2g4i s ARG 60 N -5.59 0.47 -0.43 1.97 3.52 -1.25 -1.49 118.95 116.16 2g4i s ARG 60 Ca 0.37 -0.07 -0.25 0.00 -0.13 0.00 0.00 55.73 55.65 2g4i s ARG 60 Cb -0.11 -1.45 0.02 0.00 -1.56 0.00 0.00 34.95 31.86 2g4i s ARG 60 CO 0.82 -0.48 0.88 -1.17 -0.81 0.00 0.00 175.30 174.55 2g4i s LEU 61 N 1.98 4.06 0.23 -0.88 2.96 -0.87 -4.12 118.68 122.04 2g4i s LEU 61 Ca 0.03 0.21 0.10 0.00 -0.22 0.00 0.00 54.13 54.25 2g4i s LEU 61 Cb -0.14 -3.14 -0.04 0.00 0.50 0.00 0.00 46.19 43.36 2g4i s LEU 61 CO -0.07 -0.94 -0.10 -0.44 -1.32 0.00 0.00 176.35 173.49 2g4i s SER 62 N 2.10 4.15 -0.01 3.68 0.01 -0.32 -0.88 113.70 122.43 2g4i s SER 62 Ca 0.35 -0.72 -0.08 0.00 1.31 0.00 0.00 55.95 56.81 2g4i s SER 62 Cb -0.11 -0.64 0.00 0.00 0.21 0.00 0.00 66.02 65.48 2g4i s SER 62 CO 0.23 0.05 0.16 0.00 0.41 0.00 0.00 173.24 174.09 2g4i s ALA 63 N -2.10 -0.38 0.01 1.44 0.00 0.09 -1.10 121.76 119.72 2g4i s ALA 63 Ca 0.28 -0.03 0.04 0.00 0.00 0.00 0.00 51.96 52.24 2g4i s ALA 63 Cb -0.07 0.07 -0.01 0.00 0.00 0.00 0.00 23.12 23.11 2g4i s ALA 63 CO 0.16 -0.20 -0.12 0.08 0.00 0.00 0.00 175.76 175.68 2g4i s VAL 64 N -1.25 0.95 -0.03 0.00 1.01 -0.04 -1.42 120.40 119.62 2g4i s VAL 64 Ca -0.13 -0.67 0.03 0.00 0.00 0.00 0.00 61.98 61.21 2g4i s VAL 64 Cb -0.07 -0.83 0.00 0.00 0.00 0.00 0.00 36.38 35.49 2g4i s VAL 64 CO 0.02 0.15 -0.12 0.54 0.00 0.00 0.00 175.10 175.69 2g4i s VAL 65 N -0.49 1.00 0.06 2.92 0.11 0.20 -1.05 120.40 123.14 2g4i s VAL 65 Ca 0.03 -0.48 -0.09 0.00 -2.93 0.00 0.00 61.98 58.50 2g4i s VAL 65 Cb -0.06 -0.87 0.00 0.00 -1.53 0.00 0.00 36.38 33.92 2g4i s VAL 65 CO 0.00 0.30 0.20 -0.94 -3.33 0.00 0.00 175.10 171.33 2g4i s SER 66 N 0.10 0.06 0.15 3.54 1.04 -0.31 -1.43 113.70 116.86 2g4i s SER 66 Ca -0.03 -0.48 0.11 0.00 0.48 0.00 0.00 55.95 56.03 2g4i s SER 66 Cb -0.09 0.31 -0.04 0.00 0.10 0.00 0.00 66.02 66.30 2g4i s SER 66 CO 0.01 -0.64 -0.24 -0.31 0.98 0.00 0.00 173.24 173.05 2g4i s TYR 67 N -3.13 2.36 0.64 5.02 2.02 -1.26 -0.26 117.35 122.74 2g4i s TYR 67 Ca -0.01 -0.35 -0.18 0.00 -0.37 0.00 0.00 57.07 56.17 2g4i s TYR 67 Cb 0.02 -1.23 -0.02 0.00 -0.40 0.00 0.00 41.96 40.33 2g4i s TYR 67 CO -0.07 0.41 1.22 -2.30 -1.57 0.00 0.00 175.55 173.24 2g4i n PRO 68 N 0.62 1.04 -1.11 -1.71 -0.02 -1.26 -2.77 135.00 129.79 2g4i n PRO 68 Ca -0.15 0.41 -0.04 0.00 -2.02 0.00 0.00 63.50 61.70 2g4i n PRO 68 Cb 0.54 -2.45 -0.02 0.00 -0.02 0.00 0.00 33.50 31.55 2g4i n PRO 68 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2g4i n ASN 69 N -1.69 -5.04 -4.07 2.55 3.02 -1.26 -4.97 115.26 103.79 2g4i n ASN 69 Ca 0.16 0.09 -0.18 0.00 -0.03 0.00 0.00 54.58 54.62 2g4i n ASN 69 Cb 0.48 -2.87 -0.13 0.00 -0.61 0.00 0.00 39.78 36.65 2g4i n ASN 69 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2g4i s ALA 70 N -1.60 0.86 0.70 5.41 0.00 -1.12 -5.15 121.76 120.87 2g4i s ALA 70 Ca 0.00 -0.63 -0.15 0.00 0.00 0.00 0.00 51.96 51.18 2g4i s ALA 70 Cb 0.00 -0.14 0.02 0.00 0.00 0.00 0.00 23.12 23.01 2g4i s ALA 70 CO 0.00 0.15 1.17 -0.51 0.00 0.00 0.00 175.76 176.57 2g4i s ASP 71 N -0.85 4.55 0.38 0.00 1.01 -1.26 -4.57 116.67 115.93 2g4i s ASP 71 Ca -0.00 2.21 -0.06 0.00 0.71 0.00 0.00 52.55 55.41 2g4i s ASP 71 Cb -0.06 -2.57 -0.05 0.00 1.01 0.00 0.00 42.92 41.24 2g4i s ASP 71 CO 0.00 -2.02 0.68 -0.44 0.21 0.00 0.00 175.17 173.61 2g4i s SER 72 N -2.25 6.39 -0.05 0.27 0.01 -1.26 -4.70 113.70 112.11 2g4i s SER 72 Ca 0.71 0.86 0.00 0.00 1.31 0.00 0.00 55.95 58.84 2g4i s SER 72 Cb -0.26 -2.21 -0.03 0.00 0.21 0.00 0.00 66.02 63.73 2g4i s SER 72 CO 0.44 -0.38 -0.03 0.00 0.41 0.00 0.00 173.24 173.68 2g4i s ALA 73 N -2.38 3.16 0.10 1.44 0.00 -0.51 -4.96 121.76 118.60 2g4i s ALA 73 Ca 0.46 -0.89 0.05 0.00 0.00 0.00 0.00 51.96 51.58 2g4i s ALA 73 Cb -0.10 -1.33 -0.03 0.00 0.00 0.00 0.00 23.12 21.65 2g4i s ALA 73 CO 0.35 0.60 -0.13 -0.08 0.00 0.00 0.00 175.76 176.51 2g4i s THR 74 N -0.93 1.12 -0.14 0.00 -1.32 -1.26 -0.63 115.64 112.48 2g4i s THR 74 Ca 0.15 -1.57 -0.19 0.00 -1.21 0.00 0.00 61.69 58.87 2g4i s THR 74 Cb -0.11 -1.33 0.05 0.00 -1.51 0.00 0.00 72.50 69.60 2g4i s THR 74 CO 0.05 -0.41 0.50 0.54 -2.21 0.00 0.00 174.62 173.08 2g4i s VAL 75 N -1.99 0.01 -0.01 5.08 0.11 -0.51 -4.50 120.40 118.59 2g4i s VAL 75 Ca 0.04 -0.08 -0.01 0.00 -2.93 0.00 0.00 61.98 59.01 2g4i s VAL 75 Cb -0.06 -0.73 0.00 0.00 -1.53 0.00 0.00 36.38 34.06 2g4i s VAL 75 CO 0.02 -0.04 0.02 -0.44 -3.33 0.00 0.00 175.10 171.33 2g4i s SER 76 N -0.18 -0.01 -0.05 3.54 0.01 -1.26 -0.73 113.70 115.02 2g4i s SER 76 Ca -0.04 0.01 0.01 0.00 1.31 0.00 0.00 55.95 57.25 2g4i s SER 76 Cb -0.03 0.05 0.02 0.00 0.21 0.00 0.00 66.02 66.27 2g4i s SER 76 CO 0.02 -0.03 -0.05 -0.47 0.41 0.00 0.00 173.24 173.13 2g4i s TYR 77 N -0.08 0.82 -0.12 2.43 5.04 -0.06 -4.93 117.35 120.45 2g4i s TYR 77 Ca -0.01 -0.25 -0.29 0.00 -2.44 0.00 0.00 57.07 54.08 2g4i s TYR 77 Cb -0.01 -0.72 -0.05 0.00 0.35 0.00 0.00 41.96 41.54 2g4i s TYR 77 CO -0.00 -0.21 1.67 -0.51 -1.34 0.00 0.00 175.55 175.15 2g4i s ASP 78 N 0.98 6.52 -0.29 4.32 1.01 -1.26 -2.05 116.67 125.90 2g4i s ASP 78 Ca -0.10 2.02 -0.14 0.00 0.71 0.00 0.00 52.55 55.03 2g4i s ASP 78 Cb -0.14 -2.53 0.12 0.00 1.01 0.00 0.00 42.92 41.37 2g4i s ASP 78 CO -0.00 -1.08 0.78 0.54 0.21 0.00 0.00 175.17 175.61 2g4i s VAL 79 N 4.62 -0.29 -0.60 -1.27 0.11 -0.55 -5.00 120.40 117.41 2g4i s VAL 79 Ca 0.74 0.00 -0.26 0.00 -2.93 0.00 0.00 61.98 59.53 2g4i s VAL 79 Cb -0.30 -1.00 0.04 0.00 -1.53 0.00 0.00 36.38 33.58 2g4i s VAL 79 CO 0.30 0.00 1.10 -0.62 -3.33 0.00 0.00 175.10 172.55 2g4i s ASP 80 N 1.96 6.34 0.57 3.54 -1.08 -1.26 -4.13 116.67 122.60 2g4i s ASP 80 Ca -0.08 -0.25 0.35 0.00 -0.52 0.00 0.00 52.55 52.05 2g4i s ASP 80 Cb -0.06 -2.50 1.62 0.00 -1.46 0.00 0.00 42.92 40.51 2g4i s ASP 80 CO -0.18 -1.45 2.09 -0.07 0.52 0.00 0.00 175.17 176.07 2g4i h LEU 81 N 11.74 0.00 -1.60 -1.34 3.38 -1.95 -1.57 115.31 123.97 2g4i h LEU 81 Ca -0.26 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 2g4i h LEU 81 Cb 1.06 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.81 2g4i h LEU 81 CO 1.17 0.03 -0.10 0.44 0.09 0.00 0.00 178.44 180.07 2g4i h ASP 82 N 0.00 0.00 0.41 -0.43 3.32 -1.91 -0.10 116.42 117.71 2g4i h ASP 82 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2g4i h ASP 82 Cb 0.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.93 2g4i h ASP 82 CO 0.00 0.10 -0.21 0.59 -1.72 0.00 0.00 179.24 178.00 2g4i n ASN 83 N -3.30 0.59 -0.04 6.45 3.02 -0.59 -4.51 115.26 116.88 2g4i n ASN 83 Ca -0.00 -0.51 -0.08 0.00 -0.03 0.00 0.00 54.58 53.96 2g4i n ASN 83 Cb 0.31 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.45 2g4i n ASN 83 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2g4i n VAL 84 N -1.01 0.63 -3.69 2.41 0.31 -0.87 -5.07 118.33 111.03 2g4i n VAL 84 Ca 0.11 -0.05 -0.26 0.00 -0.01 0.00 0.00 64.34 64.14 2g4i n VAL 84 Cb 0.31 -1.66 -0.03 0.00 -0.91 0.00 0.00 33.84 31.56 2g4i n VAL 84 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2g4i s LEU 85 N -6.61 4.21 0.97 7.52 1.43 -0.10 -4.97 118.68 121.12 2g4i s LEU 85 Ca -0.12 0.37 -0.12 0.00 -1.03 0.00 0.00 54.13 53.23 2g4i s LEU 85 Cb 0.04 -3.15 0.17 0.00 0.03 0.00 0.00 46.19 43.28 2g4i s LEU 85 CO 0.15 -0.07 1.10 -2.16 0.23 0.00 0.00 176.35 175.60 2g4i s PRO 86 N -3.51 0.67 0.35 1.29 0.04 -1.26 -4.71 135.00 127.86 2g4i s PRO 86 Ca 0.38 0.49 0.16 0.00 0.04 0.00 0.00 61.00 62.06 2g4i s PRO 86 Cb -0.11 -1.77 0.63 0.00 0.04 0.00 0.00 34.50 33.30 2g4i s PRO 86 CO 0.30 -2.56 1.73 1.05 0.04 0.00 0.00 177.00 177.56 2g4i h GLU 87 N -1.77 0.00 -5.31 4.56 4.11 -1.93 -3.40 114.58 110.84 2g4i h GLU 87 Ca -0.53 0.00 -0.63 0.00 0.07 0.00 0.00 59.36 58.26 2g4i h GLU 87 Cb 1.33 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 30.37 2g4i h GLU 87 CO 0.58 0.43 -0.65 -1.58 0.07 0.00 0.00 179.01 177.86 2g4i s TRP 88 N -3.74 3.05 0.28 2.06 0.52 -1.26 -1.34 118.94 118.50 2g4i s TRP 88 Ca -0.01 -0.25 0.02 0.00 0.02 0.00 0.00 56.10 55.88 2g4i s TRP 88 Cb 0.12 -1.97 -0.05 0.00 -1.15 0.00 0.00 33.47 30.42 2g4i s TRP 88 CO 0.71 -0.01 0.09 0.14 0.02 0.00 0.00 176.95 177.91 2g4i s VAL 89 N 0.34 0.65 0.08 4.03 -7.23 -0.37 -4.39 120.40 113.51 2g4i s VAL 89 Ca -0.03 -2.00 0.10 0.00 -1.81 0.00 0.00 61.98 58.24 2g4i s VAL 89 Cb -0.14 -2.65 -0.03 0.00 0.56 0.00 0.00 36.38 34.12 2g4i s VAL 89 CO 0.03 0.00 -0.27 -0.13 -0.31 0.00 0.00 175.10 174.42 2g4i s ARG 90 N -3.99 1.65 0.16 4.82 0.52 -0.18 -0.60 118.95 121.33 2g4i s ARG 90 Ca 0.37 -1.20 0.08 0.00 -0.52 0.00 0.00 55.73 54.46 2g4i s ARG 90 Cb 0.08 -1.95 -0.04 0.00 0.52 0.00 0.00 34.95 33.56 2g4i s ARG 90 CO 0.14 0.49 -0.06 0.14 0.02 0.00 0.00 175.30 176.03 2g4i s VAL 91 N -0.90 3.44 0.16 3.52 -7.23 -1.26 -0.90 120.40 117.22 2g4i s VAL 91 Ca 0.13 -1.49 -0.24 0.00 -1.81 0.00 0.00 61.98 58.56 2g4i s VAL 91 Cb -0.10 -2.70 0.07 0.00 0.56 0.00 0.00 36.38 34.22 2g4i s VAL 91 CO 0.03 -0.07 1.02 -0.83 -0.31 0.00 0.00 175.10 174.95 2g4i s GLY 92 N -2.76 -0.08 -0.02 2.32 0.00 0.39 -1.85 107.32 105.32 2g4i s GLY 92 Ca 0.25 -0.05 0.07 0.00 0.00 0.00 0.00 44.72 44.99 2g4i s GLY 92 CO 0.16 1.09 -0.23 1.08 0.00 0.00 0.00 173.10 175.20 2g4i s LEU 93 N -3.16 2.25 0.09 0.66 1.43 0.20 -0.05 118.68 120.11 2g4i s LEU 93 Ca 0.17 -0.42 0.04 0.00 -1.03 0.00 0.00 54.13 52.89 2g4i s LEU 93 Cb -0.01 -1.39 -0.03 0.00 0.03 0.00 0.00 46.19 44.78 2g4i s LEU 93 CO 0.03 0.32 -0.12 -0.55 0.23 0.00 0.00 176.35 176.26 2g4i s SER 94 N -0.75 1.57 0.20 2.29 0.15 -0.57 -0.93 113.70 115.66 2g4i s SER 94 Ca 0.11 -0.74 -0.18 0.00 0.70 0.00 0.00 55.95 55.84 2g4i s SER 94 Cb -0.10 -0.02 0.03 0.00 -1.71 0.00 0.00 66.02 64.22 2g4i s SER 94 CO 0.00 -0.19 0.53 0.00 1.20 0.00 0.00 173.24 174.79 2g4i s ALA 95 N -2.00 -0.95 0.13 5.45 0.00 -0.45 -1.26 121.76 122.68 2g4i s ALA 95 Ca 0.03 -0.23 -0.19 0.00 0.00 0.00 0.00 51.96 51.57 2g4i s ALA 95 Cb -0.06 0.86 0.05 0.00 0.00 0.00 0.00 23.12 23.97 2g4i s ALA 95 CO 0.01 -0.82 0.47 -1.54 0.00 0.00 0.00 175.76 173.89 2g4i s SER 96 N -2.88 -0.36 0.35 0.00 1.04 -1.08 -1.72 113.70 109.06 2g4i s SER 96 Ca 0.09 -0.17 0.04 0.00 0.48 0.00 0.00 55.95 56.39 2g4i s SER 96 Cb -0.01 0.51 -0.06 0.00 0.10 0.00 0.00 66.02 66.57 2g4i s SER 96 CO -0.02 -0.87 0.07 0.42 0.98 0.00 0.00 173.24 173.81 2g4i s THR 97 N -3.64 1.11 0.00 2.02 -4.23 0.38 -0.05 115.64 111.23 2g4i s THR 97 Ca 0.01 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.52 2g4i s THR 97 Cb 0.01 -2.70 0.00 0.00 1.34 0.00 0.00 72.50 71.15 2g4i s THR 97 CO -0.11 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.58 2g4i n GLY 98 N -0.76 4.90 0.25 3.99 0.00 -1.26 -0.96 105.19 111.35 2g4i n GLY 98 Ca -0.04 -0.64 0.11 0.00 0.00 0.00 0.00 46.02 45.45 2g4i n GLY 98 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2g4i h LEU 99 N 0.00 0.00-10.09 0.99 3.38 -1.99 -1.72 115.31 105.88 2g4i h LEU 99 Ca 0.00 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.49 2g4i h LEU 99 Cb 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2g4i h LEU 99 CO 0.00 0.15 -0.46 -0.31 0.09 0.00 0.00 178.44 177.90 2g4i s TYR 100 N -4.23 3.34 0.22 1.13 1.51 -1.26 -4.99 117.35 113.08 2g4i s TYR 100 Ca -0.03 -0.04 -0.12 0.00 -1.01 0.00 0.00 57.07 55.87 2g4i s TYR 100 Cb 0.13 -1.52 -0.00 0.00 -0.11 0.00 0.00 41.96 40.46 2g4i s TYR 100 CO 0.61 0.47 0.44 -1.59 -1.11 0.00 0.00 175.55 174.36 2g4i s LYS 101 N -3.88 1.44 -0.12 -0.62 0.00 -1.25 -4.41 119.74 110.89 2g4i s LYS 101 Ca 0.34 -1.19 -0.33 0.00 0.00 0.00 0.00 55.97 54.79 2g4i s LYS 101 Cb -0.09 0.45 0.13 0.00 0.00 0.00 0.00 37.83 38.32 2g4i s LYS 101 CO 0.28 -0.58 1.11 -1.83 0.00 0.00 0.00 175.35 174.32 2g4i s GLU 102 N -3.99 0.48 0.22 1.78 -1.05 -1.12 -3.22 118.70 111.80 2g4i s GLU 102 Ca 0.20 -0.19 -0.30 0.00 -0.15 0.00 0.00 54.97 54.54 2g4i s GLU 102 Cb 0.00 0.22 -0.09 0.00 -0.44 0.00 0.00 34.13 33.83 2g4i s GLU 102 CO 0.06 -0.21 1.13 0.95 0.95 0.00 0.00 175.26 178.14 2g4i s THR 103 N -2.65 3.61 -0.61 1.83 -4.23 0.09 -4.70 115.64 108.98 2g4i s THR 103 Ca 0.08 1.46 0.06 0.00 -1.18 0.00 0.00 61.69 62.12 2g4i s THR 103 Cb -0.01 -3.93 0.28 0.00 1.34 0.00 0.00 72.50 70.18 2g4i s THR 103 CO -0.06 0.29 0.80 0.59 -0.54 0.00 0.00 174.62 175.70 2g4i n ASN 104 N 1.91 3.82 -4.64 3.99 3.02 -1.26 -3.76 115.26 118.34 2g4i n ASN 104 Ca 0.02 -3.49 -0.38 0.00 -0.03 0.00 0.00 54.58 50.70 2g4i n ASN 104 Cb 0.45 -0.63 -0.09 0.00 -0.61 0.00 0.00 39.78 38.90 2g4i n ASN 104 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2g4i s THR 105 N -3.07 5.23 -0.29 3.41 2.01 -1.05 -2.18 115.64 119.70 2g4i s THR 105 Ca 0.43 0.49 -0.16 0.00 0.31 0.00 0.00 61.69 62.76 2g4i s THR 105 Cb 0.20 -3.65 -0.03 0.00 0.01 0.00 0.00 72.50 69.03 2g4i s THR 105 CO -0.06 0.23 0.41 -0.63 -0.69 0.00 0.00 174.62 173.88 2g4i s ILE 106 N 1.60 5.14 -0.21 1.82 -1.09 0.52 -0.41 121.20 128.57 2g4i s ILE 106 Ca 0.14 0.46 0.21 0.00 -2.23 0.00 0.00 60.65 59.23 2g4i s ILE 106 Cb -0.15 -3.77 -0.01 0.00 -1.58 0.00 0.00 42.46 36.94 2g4i s ILE 106 CO 0.08 0.05 1.03 -0.07 -1.23 0.00 0.00 174.94 174.80 2g4i h LEU 107 N 8.72 0.00 -7.00 2.97 3.38 -1.22 -1.93 115.31 120.23 2g4i h LEU 107 Ca -0.30 0.00 0.12 0.00 0.09 0.00 0.00 57.88 57.78 2g4i h LEU 107 Cb 1.15 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.73 2g4i h LEU 107 CO 0.68 0.17 0.54 -0.94 0.09 0.00 0.00 178.44 178.98 2g4i s SER 108 N -5.57 -0.34 -0.30 -0.43 1.04 -1.22 -4.48 113.70 102.40 2g4i s SER 108 Ca -0.01 0.09 -0.13 0.00 0.48 0.00 0.00 55.95 56.38 2g4i s SER 108 Cb 0.09 0.34 0.13 0.00 0.10 0.00 0.00 66.02 66.69 2g4i s SER 108 CO 0.79 -0.52 0.79 0.86 0.98 0.00 0.00 173.24 176.14 2g4i s TRP 109 N -2.63 -1.02 0.03 5.02 -0.00 0.31 -1.59 118.94 119.05 2g4i s TRP 109 Ca 0.04 1.83 0.00 0.00 -0.00 0.00 0.00 56.10 57.98 2g4i s TRP 109 Cb -0.01 0.61 -0.03 0.00 -0.00 0.00 0.00 33.47 34.05 2g4i s TRP 109 CO -0.06 -0.51 -0.04 -1.54 -0.00 0.00 0.00 176.95 174.80 2g4i s SER 110 N 2.42 0.44 -0.10 5.86 1.04 0.22 -0.24 113.70 123.34 2g4i s SER 110 Ca -0.06 -0.61 -0.08 0.00 0.48 0.00 0.00 55.95 55.68 2g4i s SER 110 Cb -0.08 0.10 0.03 0.00 0.10 0.00 0.00 66.02 66.17 2g4i s SER 110 CO -0.18 -0.34 0.26 0.12 0.98 0.00 0.00 173.24 174.08 2g4i s PHE 111 N -1.94 -0.31 -0.05 5.02 5.36 -0.59 -0.88 117.98 124.59 2g4i s PHE 111 Ca -0.10 0.75 0.01 0.00 -0.96 0.00 0.00 56.93 56.63 2g4i s PHE 111 Cb -0.06 0.08 0.02 0.00 -0.34 0.00 0.00 43.02 42.72 2g4i s PHE 111 CO -0.02 -0.18 -0.06 0.99 -1.46 0.00 0.00 175.22 174.49 2g4i s THR 112 N 0.60 0.66 -0.01 0.12 2.01 0.04 -1.22 115.64 117.84 2g4i s THR 112 Ca -0.04 -0.19 0.06 0.00 0.31 0.00 0.00 61.69 61.83 2g4i s THR 112 Cb -0.05 -0.67 -0.01 0.00 0.01 0.00 0.00 72.50 71.77 2g4i s THR 112 CO -0.03 0.26 -0.19 -0.94 -0.69 0.00 0.00 174.62 173.03 2g4i s SER 113 N 0.95 2.19 -0.05 3.53 1.04 -0.13 -0.06 113.70 121.16 2g4i s SER 113 Ca -0.10 -0.34 0.05 0.00 0.48 0.00 0.00 55.95 56.03 2g4i s SER 113 Cb -0.14 -0.24 -0.01 0.00 0.10 0.00 0.00 66.02 65.73 2g4i s SER 113 CO 0.00 0.23 -0.20 -0.54 0.98 0.00 0.00 173.24 173.71 2g4i s LYS 114 N -0.47 2.04 -0.24 4.02 1.02 0.16 -1.49 119.74 124.79 2g4i s LYS 114 Ca 0.07 -0.72 0.00 0.00 0.02 0.00 0.00 55.97 55.34 2g4i s LYS 114 Cb -0.07 -1.77 0.03 0.00 -0.52 0.00 0.00 37.83 35.50 2g4i s LYS 114 CO -0.01 0.30 -0.11 -0.51 -0.92 0.00 0.00 175.35 174.11 2g4i s LEU 115 N -0.06 3.01 -0.25 3.17 1.43 0.93 -1.42 118.68 125.49 2g4i s LEU 115 Ca -0.03 -0.95 -0.08 0.00 -1.03 0.00 0.00 54.13 52.04 2g4i s LEU 115 Cb -0.12 -1.59 -0.04 0.00 0.03 0.00 0.00 46.19 44.47 2g4i s LEU 115 CO 0.03 -0.11 0.09 -0.54 0.23 0.00 0.00 176.35 176.05 2g4i s LYS 116 N 1.26 3.77 0.73 1.70 1.02 0.72 -0.13 119.74 128.80 2g4i s LYS 116 Ca -0.01 -0.42 -0.04 0.00 0.02 0.00 0.00 55.97 55.52 2g4i s LYS 116 Cb -0.17 -3.38 0.11 0.00 -0.52 0.00 0.00 37.83 33.87 2g4i s LYS 116 CO -0.07 -0.11 1.01 -1.54 -0.92 0.00 0.00 175.35 173.72 2g4i s SER 117 N 1.45 4.41 0.00 2.83 1.04 -1.09 0.71 113.70 123.05 2g4i s SER 117 Ca 0.06 -0.03 0.27 0.00 0.48 0.00 0.00 55.95 56.73 2g4i s SER 117 Cb -0.15 -0.44 0.89 0.00 0.10 0.00 0.00 66.02 66.43 2g4i s SER 117 CO 0.05 -1.82 1.68 -0.46 0.98 0.00 0.00 173.24 173.67 2g4i n ASN 118 N -2.92 0.30 -4.78 7.02 6.94 -0.89 -4.60 115.26 116.34 2g4i n ASN 118 Ca 0.12 0.01 -0.35 0.00 -0.02 0.00 0.00 54.58 54.35 2g4i n ASN 118 Cb 0.60 -0.10 0.00 0.00 -2.36 0.00 0.00 39.78 37.93 2g4i n ASN 118 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 2g4i s SER 119 N -2.93 5.71 0.17 0.53 1.04 -1.26 -4.97 113.70 111.99 2g4i s SER 119 Ca 0.14 2.13 -0.12 0.00 0.48 0.00 0.00 55.95 58.59 2g4i s SER 119 Cb 0.18 -2.58 0.07 0.00 0.10 0.00 0.00 66.02 63.80 2g4i s SER 119 CO 0.60 -1.22 1.71 0.71 0.98 0.00 0.00 173.24 176.02 2g4i h THR 120 N 1.09 1.24 -0.87 2.02 1.35 -2.05 -3.31 112.91 112.39 2g4i h THR 120 Ca -0.50 -0.79 -0.37 0.00 -0.55 0.00 0.00 66.41 64.21 2g4i h THR 120 Cb 1.26 0.63 -0.06 0.00 -1.73 0.00 0.00 68.15 68.25 2g4i h THR 120 CO 0.57 0.30 0.93 -1.00 -0.25 0.00 0.00 175.52 176.06 2g4i s HIS 121 N -5.45 1.96 -0.20 4.73 3.76 -1.26 -4.88 115.29 113.95 2g4i s HIS 121 Ca -0.13 0.31 -0.17 0.00 -0.15 0.00 0.00 55.06 54.93 2g4i s HIS 121 Cb 0.13 -4.19 -0.12 0.00 1.11 0.00 0.00 32.58 29.50 2g4i s HIS 121 CO 0.80 -1.81 -0.03 -0.85 -0.85 0.00 0.00 174.74 172.00 2g4i n GLU 122 N 8.88 0.53 -2.87 1.40 0.00 -1.25 -4.90 120.64 122.44 2g4i n GLU 122 Ca 0.37 0.49 -0.40 0.00 0.00 0.00 0.00 57.16 57.62 2g4i n GLU 122 Cb 0.48 -1.67 -0.05 0.00 0.00 0.00 0.00 31.44 30.20 2g4i n GLU 122 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 2g4i s THR 123 N -2.39 4.64 -0.23 3.84 2.01 -1.26 -2.67 115.64 119.58 2g4i s THR 123 Ca -0.26 1.83 -0.07 0.00 0.31 0.00 0.00 61.69 63.50 2g4i s THR 123 Cb 0.06 -4.21 -0.03 0.00 0.01 0.00 0.00 72.50 68.33 2g4i s THR 123 CO 0.46 0.33 0.05 0.20 -0.69 0.00 0.00 174.62 174.98 2g4i s ASN 124 N 0.02 5.10 0.01 3.53 -0.87 0.81 -4.98 114.94 118.57 2g4i s ASN 124 Ca 0.43 -0.18 0.04 0.00 -1.57 0.00 0.00 52.86 51.58 2g4i s ASN 124 Cb -0.22 -1.90 -0.02 0.00 -0.02 0.00 0.00 41.25 39.09 2g4i s ASN 124 CO 0.26 0.01 -0.14 0.00 -2.57 0.00 0.00 177.10 174.66 2g4i s ALA 125 N 1.37 1.15 -0.04 0.60 0.00 -1.26 -0.05 121.76 123.52 2g4i s ALA 125 Ca 0.05 -0.69 0.02 0.00 0.00 0.00 0.00 51.96 51.33 2g4i s ALA 125 Cb -0.15 -0.24 0.01 0.00 0.00 0.00 0.00 23.12 22.75 2g4i s ALA 125 CO 0.03 0.25 -0.08 -1.17 0.00 0.00 0.00 175.76 174.79 2g4i s LEU 126 N -0.69 1.58 -0.02 0.00 2.96 -0.56 -5.01 118.68 116.94 2g4i s LEU 126 Ca 0.04 -0.19 -0.00 0.00 -0.22 0.00 0.00 54.13 53.75 2g4i s LEU 126 Cb -0.06 -0.57 0.03 0.00 0.50 0.00 0.00 46.19 46.08 2g4i s LEU 126 CO 0.00 0.01 0.03 -2.28 -1.32 0.00 0.00 176.35 172.79 2g4i s HIS 127 N 0.58 0.04 0.14 5.38 5.65 -1.26 -0.96 115.29 124.87 2g4i s HIS 127 Ca -0.09 0.13 0.08 0.00 0.25 0.00 0.00 55.06 55.42 2g4i s HIS 127 Cb -0.13 -0.26 -0.04 0.00 -1.18 0.00 0.00 32.58 30.98 2g4i s HIS 127 CO 0.01 -0.10 -0.17 -0.59 -0.65 0.00 0.00 174.74 173.24 2g4i s PHE 128 N 1.13 1.69 -0.05 3.88 -0.12 -0.36 -5.00 117.98 119.15 2g4i s PHE 128 Ca -0.08 -0.49 -0.02 0.00 -0.05 0.00 0.00 56.93 56.29 2g4i s PHE 128 Cb -0.13 -0.86 0.04 0.00 -0.63 0.00 0.00 43.02 41.43 2g4i s PHE 128 CO -0.03 0.26 0.10 1.41 -0.05 0.00 0.00 175.22 176.91 2g4i s MET 129 N -2.63 -0.00 -0.23 1.99 1.75 -1.26 -1.54 119.30 117.37 2g4i s MET 129 Ca 0.12 0.39 -0.02 0.00 -1.25 0.00 0.00 55.69 54.94 2g4i s MET 129 Cb -0.06 -0.32 0.02 0.00 2.84 0.00 0.00 34.83 37.31 2g4i s MET 129 CO 0.05 -0.25 -0.08 -0.06 -0.65 0.00 0.00 175.02 174.03 2g4i s PHE 130 N 1.76 3.00 -0.56 4.11 0.40 0.67 -4.90 117.98 122.46 2g4i s PHE 130 Ca -0.02 -1.45 0.15 0.00 -0.60 0.00 0.00 56.93 55.01 2g4i s PHE 130 Cb -0.12 -2.05 -0.17 0.00 0.51 0.00 0.00 43.02 41.19 2g4i s PHE 130 CO -0.04 -0.71 0.56 0.09 0.70 0.00 0.00 175.22 175.82 2g4i n ASN 131 N 4.69 0.86 -3.64 1.36 3.02 -1.26 -0.53 115.26 119.75 2g4i n ASN 131 Ca -0.17 -0.68 -0.20 0.00 -0.03 0.00 0.00 54.58 53.50 2g4i n ASN 131 Cb 0.48 1.14 -0.16 0.00 -0.61 0.00 0.00 39.78 40.62 2g4i n ASN 131 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 2g4i s GLN 132 N -2.51 0.02 0.10 3.52 2.00 -1.26 -4.70 119.66 116.82 2g4i s GLN 132 Ca 0.03 0.32 -0.06 0.00 -2.00 0.00 0.00 55.36 53.64 2g4i s GLN 132 Cb 0.11 -0.81 -0.05 0.00 0.80 0.00 0.00 33.01 33.05 2g4i s GLN 132 CO 0.61 -0.43 0.36 -0.06 -0.50 0.00 0.00 175.29 175.26 2g4i s PHE 133 N 2.22 3.52 0.02 1.67 0.40 0.44 -5.01 117.98 121.24 2g4i s PHE 133 Ca 0.04 0.62 0.05 0.00 -0.60 0.00 0.00 56.93 57.04 2g4i s PHE 133 Cb -0.13 -2.04 -0.02 0.00 0.51 0.00 0.00 43.02 41.34 2g4i s PHE 133 CO -0.06 0.49 -0.16 0.45 0.70 0.00 0.00 175.22 176.64 2g4i s SER 134 N -2.12 1.91 0.22 1.36 0.15 -1.26 -4.01 113.70 109.95 2g4i s SER 134 Ca 0.36 -0.39 -0.16 0.00 0.70 0.00 0.00 55.95 56.46 2g4i s SER 134 Cb -0.13 -0.17 0.24 0.00 -1.71 0.00 0.00 66.02 64.25 2g4i s SER 134 CO 0.21 0.13 1.45 1.17 1.20 0.00 0.00 173.24 177.41 2g4i n LYS 135 N 2.25 -0.21 -3.78 5.44 4.81 -1.26 -3.08 118.16 122.33 2g4i n LYS 135 Ca -0.16 1.44 -0.32 0.00 -0.87 0.00 0.00 58.31 58.40 2g4i n LYS 135 Cb 0.54 -2.14 -0.10 0.00 0.02 0.00 0.00 35.03 33.36 2g4i n LYS 135 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 2g4i s ASP 136 N -5.33 5.33 -0.90 3.14 2.15 -1.26 -4.64 116.67 115.16 2g4i s ASP 136 Ca -0.13 -3.71 -0.21 0.00 0.43 0.00 0.00 52.55 48.94 2g4i s ASP 136 Cb 0.19 -1.77 0.10 0.00 -0.30 0.00 0.00 42.92 41.15 2g4i s ASP 136 CO 0.67 -0.15 1.17 -1.58 -0.17 0.00 0.00 175.17 175.12 2g4i s GLN 137 N -1.29 3.51 0.45 4.34 2.00 -1.18 -4.90 119.66 122.59 2g4i s GLN 137 Ca 0.25 -1.43 0.23 0.00 -2.00 0.00 0.00 55.36 52.41 2g4i s GLN 137 Cb -0.08 -4.88 1.03 0.00 0.80 0.00 0.00 33.01 29.89 2g4i s GLN 137 CO -0.13 -1.89 1.89 0.87 -0.50 0.00 0.00 175.29 175.53 2g4i h LYS 138 N 9.20 0.00 -0.11 1.67 1.57 -1.96 -2.57 116.57 124.37 2g4i h LYS 138 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2g4i h LYS 138 Cb 1.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.34 2g4i h LYS 138 CO 1.19 0.23 0.00 -0.40 -0.57 0.00 0.00 179.45 179.91 2g4i n ASP 139 N -3.57 0.95 -4.36 0.86 5.75 -1.26 -4.76 116.55 110.17 2g4i n ASP 139 Ca -0.01 -1.65 -0.32 0.00 -0.01 0.00 0.00 54.79 52.80 2g4i n ASP 139 Cb 0.38 -0.07 -0.15 0.00 -1.03 0.00 0.00 41.12 40.25 2g4i n ASP 139 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2g4i s LEU 140 N -1.48 2.45 -0.41 -2.12 1.43 -0.97 -0.75 118.68 116.83 2g4i s LEU 140 Ca 0.28 -0.36 -0.21 0.00 -1.03 0.00 0.00 54.13 52.80 2g4i s LEU 140 Cb 0.14 -1.49 0.02 0.00 0.03 0.00 0.00 46.19 44.88 2g4i s LEU 140 CO 0.22 0.25 0.65 -0.63 0.23 0.00 0.00 176.35 177.07 2g4i s ILE 141 N -0.19 4.83 -0.06 -0.59 1.01 0.63 -4.90 121.20 121.93 2g4i s ILE 141 Ca -0.01 0.28 -0.15 0.00 0.00 0.00 0.00 60.65 60.76 2g4i s ILE 141 Cb -0.13 -4.18 -0.05 0.00 0.01 0.00 0.00 42.46 38.11 2g4i s ILE 141 CO 0.03 -0.52 0.40 -0.76 0.00 0.00 0.00 174.94 174.10 2g4i s LEU 142 N 2.82 4.38 0.09 2.97 1.43 -1.26 -0.78 118.68 128.32 2g4i s LEU 142 Ca 0.24 0.84 0.06 0.00 -1.03 0.00 0.00 54.13 54.23 2g4i s LEU 142 Cb -0.14 -2.57 -0.03 0.00 0.03 0.00 0.00 46.19 43.47 2g4i s LEU 142 CO 0.18 0.19 -0.15 -1.10 0.23 0.00 0.00 176.35 175.70 2g4i s GLN 143 N -0.32 0.92 7.99 1.70 -0.21 0.16 -4.98 119.66 124.91 2g4i s GLN 143 Ca 0.23 -1.05 0.00 0.00 0.02 0.00 0.00 55.36 54.56 2g4i s GLN 143 Cb -0.16 -0.94 0.00 0.00 1.00 0.00 0.00 33.01 32.91 2g4i s GLN 143 CO 0.11 0.21 0.00 0.41 -2.12 0.00 0.00 175.29 173.89 2g4i n GLY 144 N 1.09 4.01 0.81 3.09 0.00 -1.26 -1.31 105.19 111.62 2g4i n GLY 144 Ca -0.20 0.03 0.11 0.00 0.00 0.00 0.00 46.02 45.96 2g4i n GLY 144 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2g4i n ASP 145 N 7.06 2.44 -4.72 1.61 8.00 0.13 -4.96 116.55 126.11 2g4i n ASP 145 Ca 0.00 -1.84 -0.42 0.00 0.71 0.00 0.00 54.79 53.24 2g4i n ASP 145 Cb 0.00 -0.16 -0.03 0.00 -0.02 0.00 0.00 41.12 40.91 2g4i n ASP 145 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2g4i s ALA 146 N -1.67 3.83 0.22 2.24 0.00 -1.16 -4.37 121.76 120.84 2g4i s ALA 146 Ca 0.35 1.46 0.04 0.00 0.00 0.00 0.00 51.96 53.81 2g4i s ALA 146 Cb 0.20 -3.65 -0.05 0.00 0.00 0.00 0.00 23.12 19.62 2g4i s ALA 146 CO 0.28 -0.84 -0.04 0.95 0.00 0.00 0.00 175.76 176.12 2g4i s THR 147 N 1.05 1.20 0.08 0.00 -4.23 0.34 -4.71 115.64 109.38 2g4i s THR 147 Ca 0.71 -2.06 0.05 0.00 -1.18 0.00 0.00 61.69 59.21 2g4i s THR 147 Cb -0.46 -2.27 -0.03 0.00 1.34 0.00 0.00 72.50 71.08 2g4i s THR 147 CO 0.33 -0.40 -0.14 0.42 -0.54 0.00 0.00 174.62 174.28 2g4i s THR 148 N -3.31 1.17 0.00 3.99 -4.23 -1.26 -0.59 115.64 111.41 2g4i s THR 148 Ca 0.26 -1.43 0.00 0.00 -1.18 0.00 0.00 61.69 59.35 2g4i s THR 148 Cb 0.04 -1.21 0.00 0.00 1.34 0.00 0.00 72.50 72.68 2g4i s THR 148 CO 0.08 -0.28 0.00 0.61 -0.54 0.00 0.00 174.62 174.48 2g4i n GLY 149 N 1.06 0.67 3.58 3.99 0.00 -0.72 -4.10 105.19 109.68 2g4i n GLY 149 Ca -0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 2g4i n GLY 149 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2g4i s THR 150 N -2.01 3.70 -1.49 2.61 2.01 -1.25 -3.36 115.64 115.85 2g4i s THR 150 Ca 0.00 0.63 0.00 0.00 0.31 0.00 0.00 61.69 62.63 2g4i s THR 150 Cb 0.00 -4.20 0.00 0.00 0.01 0.00 0.00 72.50 68.31 2g4i s THR 150 CO 0.00 -0.93 0.00 0.47 -0.69 0.00 0.00 174.62 173.47 2g4i n ASP 151 N 9.96 -4.74 -0.91 3.53 8.00 -1.26 -1.71 116.55 129.43 2g4i n ASP 151 Ca 0.16 0.21 -0.11 0.00 0.71 0.00 0.00 54.79 55.76 2g4i n ASP 151 Cb 0.49 -3.72 -0.04 0.00 -0.02 0.00 0.00 41.12 37.84 2g4i n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2g4i n GLY 152 N -1.06 0.97 3.45 0.44 0.00 -1.21 -4.98 105.19 102.80 2g4i n GLY 152 Ca -0.17 -0.51 -0.26 0.00 0.00 0.00 0.00 46.02 45.08 2g4i n GLY 152 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2g4i s ASN 153 N -2.82 3.58 -0.38 1.61 0.01 -0.69 -0.42 114.94 115.82 2g4i s ASN 153 Ca 0.00 -0.86 -0.21 0.00 -0.71 0.00 0.00 52.86 51.09 2g4i s ASN 153 Cb 0.00 -0.33 0.01 0.00 0.41 0.00 0.00 41.25 41.34 2g4i s ASN 153 CO 0.00 0.10 0.64 -0.22 -1.51 0.00 0.00 177.10 176.12 2g4i s LEU 154 N -2.85 4.32 -0.55 0.60 2.96 -0.73 -1.76 118.68 120.68 2g4i s LEU 154 Ca 0.23 -0.00 -0.18 0.00 -0.22 0.00 0.00 54.13 53.96 2g4i s LEU 154 Cb -0.07 -2.78 0.10 0.00 0.50 0.00 0.00 46.19 43.94 2g4i s LEU 154 CO 0.11 -0.66 0.60 -1.61 -1.32 0.00 0.00 176.35 173.47 2g4i s GLU 155 N 2.77 3.04 0.23 1.98 0.41 0.24 -0.35 118.70 127.02 2g4i s GLU 155 Ca 0.24 -1.35 0.00 0.00 -0.41 0.00 0.00 54.97 53.46 2g4i s GLU 155 Cb -0.14 -4.23 0.24 0.00 -1.78 0.00 0.00 34.13 28.22 2g4i s GLU 155 CO 0.16 -1.37 1.59 -0.07 -0.49 0.00 0.00 175.26 175.09 2g4i h LEU 156 N 9.50 0.50 -9.57 1.80 3.38 -1.69 0.99 115.31 120.21 2g4i h LEU 156 Ca -0.29 -0.23 -0.59 0.00 0.09 0.00 0.00 57.88 56.85 2g4i h LEU 156 Cb 1.09 -0.14 -0.11 0.00 0.09 0.00 0.00 40.66 41.59 2g4i h LEU 156 CO 1.03 0.88 -0.63 0.42 0.09 0.00 0.00 178.44 180.24 2g4i s THR 157 N -4.12 2.50 0.22 0.22 -4.23 -1.26 -2.61 115.64 106.37 2g4i s THR 157 Ca -0.06 -2.02 -0.30 0.00 -1.18 0.00 0.00 61.69 58.13 2g4i s THR 157 Cb 0.12 -2.78 -0.10 0.00 1.34 0.00 0.00 72.50 71.09 2g4i s THR 157 CO 0.81 -0.19 1.40 -0.60 -0.54 0.00 0.00 174.62 175.51 2g4i s ARG 158 N -3.70 4.30 -0.04 3.99 6.06 -1.26 -4.76 118.95 123.55 2g4i s ARG 158 Ca 0.34 2.22 -0.01 0.00 -2.50 0.00 0.00 55.73 55.78 2g4i s ARG 158 Cb 0.01 -3.14 0.03 0.00 0.06 0.00 0.00 34.95 31.91 2g4i s ARG 158 CO 0.19 -0.38 0.07 0.08 -2.50 0.00 0.00 175.30 172.76 2g4i s VAL 159 N 0.13 -0.09 0.85 7.11 1.01 -1.26 -1.67 120.40 126.48 2g4i s VAL 159 Ca 0.59 0.29 -0.10 0.00 0.00 0.00 0.00 61.98 62.75 2g4i s VAL 159 Cb -0.40 -0.15 0.11 0.00 0.00 0.00 0.00 36.38 35.94 2g4i s VAL 159 CO 0.41 0.12 1.13 -0.94 0.00 0.00 0.00 175.10 175.81 2g4i s SER 160 N 1.52 3.54 0.45 3.32 1.04 -0.25 -4.89 113.70 118.44 2g4i s SER 160 Ca -0.04 2.07 0.21 0.00 0.48 0.00 0.00 55.95 58.67 2g4i s SER 160 Cb -0.12 -2.55 1.20 0.00 0.10 0.00 0.00 66.02 64.64 2g4i s SER 160 CO -0.04 -2.69 1.88 0.77 0.98 0.00 0.00 173.24 174.15 2g4i h SER 161 N -1.53 0.28 0.00 7.02 4.64 -2.02 -1.16 113.55 120.79 2g4i h SER 161 Ca -0.43 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 2g4i h SER 161 Cb 1.26 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2g4i h SER 161 CO 0.45 0.12 0.00 -0.46 -0.87 0.00 0.00 176.83 176.07 2g4i n ASN 162 N -4.45 0.00 0.00 4.97 0.23 -1.26 -4.88 115.26 109.87 2g4i n ASN 162 Ca 0.18 -0.75 0.00 0.00 -0.53 0.00 0.00 54.58 53.48 2g4i n ASN 162 Cb 0.74 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.44 2g4i n ASN 162 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2g4i n GLY 163 N 0.18 1.70 3.69 4.83 0.00 -0.44 -5.06 105.19 110.10 2g4i n GLY 163 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 2g4i n GLY 163 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2g4i s SER 164 N -2.01 6.97 0.30 1.61 0.15 -1.25 -4.74 113.70 114.73 2g4i s SER 164 Ca 0.00 1.18 -0.29 0.00 0.70 0.00 0.00 55.95 57.54 2g4i s SER 164 Cb 0.00 -2.43 -0.10 0.00 -1.71 0.00 0.00 66.02 61.78 2g4i s SER 164 CO 0.00 -0.24 1.21 -2.16 1.20 0.00 0.00 173.24 173.25 2g4i s PRO 165 N 1.41 4.49 0.05 5.44 0.04 -1.26 -1.09 135.00 144.08 2g4i s PRO 165 Ca 0.38 2.02 -0.04 0.00 0.04 0.00 0.00 61.00 63.40 2g4i s PRO 165 Cb -0.17 -3.13 -0.05 0.00 0.04 0.00 0.00 34.50 31.19 2g4i s PRO 165 CO 0.16 -0.01 0.28 -0.65 0.04 0.00 0.00 177.00 176.82 2g4i s GLN 166 N -1.57 3.55 0.70 4.56 -1.52 -0.67 -4.81 119.66 119.90 2g4i s GLN 166 Ca 0.47 -0.17 -0.06 0.00 -1.95 0.00 0.00 55.36 53.65 2g4i s GLN 166 Cb -0.36 -3.01 0.06 0.00 -0.22 0.00 0.00 33.01 29.48 2g4i s GLN 166 CO 0.47 0.60 1.00 0.20 -0.25 0.00 0.00 175.29 177.30 2g4i s GLY 167 N -2.07 1.70 -1.47 3.09 0.00 -1.26 -4.49 107.32 102.82 2g4i s GLY 167 Ca 0.32 -0.98 -0.11 0.00 0.00 0.00 0.00 44.72 43.96 2g4i s GLY 167 CO 0.21 -0.58 0.95 1.44 0.00 0.00 0.00 173.10 175.12 2g4i n SER 168 N -2.88 -4.22 -4.37 1.64 7.64 -0.65 -4.86 113.62 105.92 2g4i n SER 168 Ca 0.08 -0.76 -0.31 0.00 1.01 0.00 0.00 58.87 58.89 2g4i n SER 168 Cb 0.60 -4.03 -0.15 0.00 -1.01 0.00 0.00 64.21 59.63 2g4i n SER 168 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2g4i s SER 169 N -3.53 3.35 -0.02 6.43 0.15 -1.21 -4.97 113.70 113.90 2g4i s SER 169 Ca 0.52 -0.48 -0.00 0.00 0.70 0.00 0.00 55.95 56.69 2g4i s SER 169 Cb -0.26 -0.43 0.02 0.00 -1.71 0.00 0.00 66.02 63.64 2g4i s SER 169 CO 0.82 0.29 0.03 0.54 1.20 0.00 0.00 173.24 176.11 2g4i s VAL 170 N -0.76 -0.04 0.05 4.45 0.11 -1.26 -0.47 120.40 122.48 2g4i s VAL 170 Ca 0.12 0.15 -0.10 0.00 -2.93 0.00 0.00 61.98 59.22 2g4i s VAL 170 Cb -0.10 -0.07 0.00 0.00 -1.53 0.00 0.00 36.38 34.69 2g4i s VAL 170 CO 0.02 0.06 0.20 -0.83 -3.33 0.00 0.00 175.10 171.22 2g4i s GLY 171 N 0.74 0.03 -0.02 6.54 0.00 -0.70 -0.69 107.32 113.22 2g4i s GLY 171 Ca -0.06 -0.31 -0.04 0.00 0.00 0.00 0.00 44.72 44.31 2g4i s GLY 171 CO -0.02 -0.49 0.09 0.50 0.00 0.00 0.00 173.10 173.18 2g4i s ARG 172 N -2.77 0.25 -0.15 2.90 0.52 -0.42 -1.34 118.95 117.94 2g4i s ARG 172 Ca -0.03 -0.14 0.01 0.00 -0.52 0.00 0.00 55.73 55.05 2g4i s ARG 172 Cb -0.00 0.11 0.01 0.00 0.52 0.00 0.00 34.95 35.58 2g4i s ARG 172 CO -0.05 -0.05 -0.18 0.00 0.02 0.00 0.00 175.30 175.04 2g4i s ALA 173 N -0.60 2.39 -0.07 2.13 0.00 -0.11 0.39 121.76 125.89 2g4i s ALA 173 Ca -0.07 -1.09 0.04 0.00 0.00 0.00 0.00 51.96 50.84 2g4i s ALA 173 Cb -0.04 -1.14 -0.01 0.00 0.00 0.00 0.00 23.12 21.92 2g4i s ALA 173 CO 0.00 -0.08 -0.21 -0.51 0.00 0.00 0.00 175.76 174.97 2g4i s LEU 174 N 0.89 2.32 0.43 0.00 1.02 0.04 -0.62 118.68 122.76 2g4i s LEU 174 Ca -0.04 -0.42 -0.26 0.00 0.02 0.00 0.00 54.13 53.43 2g4i s LEU 174 Cb -0.15 -1.46 -0.09 0.00 0.02 0.00 0.00 46.19 44.51 2g4i s LEU 174 CO -0.02 0.24 1.46 0.12 0.02 0.00 0.00 176.35 178.17 2g4i s PHE 175 N -0.15 2.47 0.13 0.29 5.36 -0.77 -0.27 117.98 125.04 2g4i s PHE 175 Ca -0.03 1.21 -0.15 0.00 -0.96 0.00 0.00 56.93 57.00 2g4i s PHE 175 Cb -0.14 -3.99 -0.01 0.00 -0.34 0.00 0.00 43.02 38.55 2g4i s PHE 175 CO 0.04 -3.05 1.63 -0.92 -1.46 0.00 0.00 175.22 171.46 2g4i h TYR 176 N 2.55 0.70 -3.53 10.12 3.20 -1.28 -3.44 116.97 125.29 2g4i h TYR 176 Ca -0.51 -0.09 -0.52 0.00 3.14 0.00 0.00 58.73 60.75 2g4i h TYR 176 Cb 1.26 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 39.31 2g4i h TYR 176 CO 0.51 0.67 0.38 0.00 -1.64 0.00 0.00 178.16 178.08 2g4i s ALA 177 N -5.28 3.25 0.63 1.82 0.00 -1.26 -5.03 121.76 115.88 2g4i s ALA 177 Ca -0.13 0.61 -0.18 0.00 0.00 0.00 0.00 51.96 52.25 2g4i s ALA 177 Cb 0.10 -3.30 -0.02 0.00 0.00 0.00 0.00 23.12 19.90 2g4i s ALA 177 CO 0.77 -0.09 1.28 -2.14 0.00 0.00 0.00 175.76 175.58 2g4i s PRO 178 N 0.17 2.70 -0.08 0.00 0.02 -1.26 -4.81 135.00 131.74 2g4i s PRO 178 Ca 0.48 2.02 0.01 0.00 0.02 0.00 0.00 61.00 63.53 2g4i s PRO 178 Cb -0.24 -1.90 -0.03 0.00 0.02 0.00 0.00 34.50 32.36 2g4i s PRO 178 CO 0.30 -1.47 -0.09 0.08 -0.33 0.00 0.00 177.00 175.49 2g4i s VAL 179 N -1.43 3.49 -0.32 3.83 1.01 0.23 -4.96 120.40 122.25 2g4i s VAL 179 Ca 0.81 -0.54 -0.12 0.00 0.00 0.00 0.00 61.98 62.12 2g4i s VAL 179 Cb -0.36 -2.44 -0.03 0.00 0.00 0.00 0.00 36.38 33.55 2g4i s VAL 179 CO 0.39 0.57 0.24 -2.28 0.00 0.00 0.00 175.10 174.02 2g4i s HIS 180 N -0.47 3.22 -0.60 5.22 2.46 -1.26 -1.24 115.29 122.62 2g4i s HIS 180 Ca 0.07 -0.05 0.12 0.00 0.47 0.00 0.00 55.06 55.67 2g4i s HIS 180 Cb -0.12 -2.46 -0.13 0.00 -0.13 0.00 0.00 32.58 29.74 2g4i s HIS 180 CO 0.02 -0.29 0.53 0.44 -2.47 0.00 0.00 174.74 172.98 2g4i n ILE 181 N 5.10 0.00 -3.91 0.89 -5.35 -0.45 -4.83 119.36 110.81 2g4i n ILE 181 Ca -0.13 -0.21 -0.10 0.00 -0.27 0.00 0.00 62.75 62.04 2g4i n ILE 181 Cb 0.51 1.00 -0.10 0.00 -1.74 0.00 0.00 39.64 39.31 2g4i n ILE 181 CO 0.00 0.00 0.00 0.86 -1.76 0.00 0.00 176.55 175.65 2g4i s TRP 182 N -2.16 0.12 -0.01 4.28 -0.00 -1.25 -4.90 118.94 115.03 2g4i s TRP 182 Ca 0.05 -0.28 -0.11 0.00 -0.00 0.00 0.00 56.10 55.76 2g4i s TRP 182 Cb 0.09 -0.10 0.01 0.00 -0.00 0.00 0.00 33.47 33.47 2g4i s TRP 182 CO 0.51 -0.25 0.22 -2.00 -0.00 0.00 0.00 176.95 175.43 2g4i s GLU 183 N -1.40 0.56 0.18 5.86 2.12 -1.26 -4.92 118.70 119.84 2g4i s GLU 183 Ca -0.15 -0.28 -0.21 0.00 0.36 0.00 0.00 54.97 54.69 2g4i s GLU 183 Cb -0.08 0.24 0.12 0.00 0.26 0.00 0.00 34.13 34.66 2g4i s GLU 183 CO 0.01 -0.14 1.59 1.03 -0.54 0.00 0.00 175.26 177.21 2g4i h SER 184 N 4.16 -1.08 -0.52 -1.70 0.87 -2.02 -2.84 113.55 110.42 2g4i h SER 184 Ca -0.30 0.21 0.00 0.00 -1.23 0.00 0.00 61.79 60.47 2g4i h SER 184 Cb 1.19 0.54 0.00 0.00 -0.44 0.00 0.00 62.40 63.68 2g4i h SER 184 CO 0.40 -0.30 0.00 -1.54 -0.53 0.00 0.00 176.83 174.86 2g4i n SER 185 N -5.43 2.81 -4.70 6.23 3.41 -1.26 -4.95 113.62 109.74 2g4i n SER 185 Ca 0.04 -2.02 -0.42 0.00 -0.26 0.00 0.00 58.87 56.21 2g4i n SER 185 Cb 0.35 -0.35 -0.03 0.00 -0.26 0.00 0.00 64.21 63.91 2g4i n SER 185 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2g4i s ALA 186 N -1.33 3.77 -0.24 7.33 0.00 -1.08 -2.09 121.76 128.12 2g4i s ALA 186 Ca 0.35 1.40 0.03 0.00 0.00 0.00 0.00 51.96 53.74 2g4i s ALA 186 Cb 0.18 -3.73 -0.18 0.00 0.00 0.00 0.00 23.12 19.39 2g4i s ALA 186 CO 0.23 -1.12 -0.15 1.33 0.00 0.00 0.00 175.76 176.05 2g4i n VAL 187 N 4.58 1.50 -4.10 0.00 0.24 0.22 -4.91 118.33 115.86 2g4i n VAL 187 Ca 0.17 -0.61 -0.16 0.00 -2.04 0.00 0.00 64.34 61.70 2g4i n VAL 187 Cb 0.38 -1.34 -0.15 0.00 -1.47 0.00 0.00 33.84 31.26 2g4i n VAL 187 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2g4i s VAL 188 N -2.52 0.36 -0.08 3.34 1.01 -1.16 -4.84 120.40 116.52 2g4i s VAL 188 Ca -0.31 -0.14 0.03 0.00 0.00 0.00 0.00 61.98 61.55 2g4i s VAL 188 Cb 0.09 -0.35 0.01 0.00 0.00 0.00 0.00 36.38 36.13 2g4i s VAL 188 CO 0.64 0.13 -0.16 0.00 0.00 0.00 0.00 175.10 175.71 2g4i s ALA 189 N 0.24 1.53 0.04 5.51 0.00 -1.26 -0.20 121.76 127.63 2g4i s ALA 189 Ca -0.02 -0.58 -0.00 0.00 0.00 0.00 0.00 51.96 51.35 2g4i s ALA 189 Cb -0.06 -0.65 -0.03 0.00 0.00 0.00 0.00 23.12 22.38 2g4i s ALA 189 CO -0.00 0.14 -0.04 -1.54 0.00 0.00 0.00 175.76 174.32 2g4i s SER 190 N 0.61 0.48 0.15 0.00 1.04 -0.51 -0.36 113.70 115.11 2g4i s SER 190 Ca -0.15 -0.78 -0.07 0.00 0.48 0.00 0.00 55.95 55.43 2g4i s SER 190 Cb -0.16 0.14 -0.02 0.00 0.10 0.00 0.00 66.02 66.08 2g4i s SER 190 CO 0.05 -0.45 0.21 0.72 0.98 0.00 0.00 173.24 174.75 2g4i s PHE 191 N -2.78 0.49 -0.03 5.02 -0.12 -0.23 -0.67 117.98 119.67 2g4i s PHE 191 Ca -0.03 -0.87 -0.15 0.00 -0.05 0.00 0.00 56.93 55.84 2g4i s PHE 191 Cb -0.00 -0.17 0.03 0.00 -0.63 0.00 0.00 43.02 42.24 2g4i s PHE 191 CO -0.05 -0.65 0.33 -1.83 -0.05 0.00 0.00 175.22 172.97 2g4i s GLU 192 N -3.98 0.64 -0.01 1.99 -1.05 0.91 -2.38 118.70 114.82 2g4i s GLU 192 Ca 0.17 -0.08 0.01 0.00 -0.15 0.00 0.00 54.97 54.92 2g4i s GLU 192 Cb 0.05 0.29 0.01 0.00 -0.44 0.00 0.00 34.13 34.03 2g4i s GLU 192 CO -0.01 -0.17 -0.01 0.00 0.95 0.00 0.00 175.26 176.02 2g4i s ALA 193 N -1.10 0.20 -0.05 -0.84 0.00 -0.57 -0.78 121.76 118.61 2g4i s ALA 193 Ca -0.12 0.01 0.02 0.00 0.00 0.00 0.00 51.96 51.87 2g4i s ALA 193 Cb -0.05 -0.13 0.01 0.00 0.00 0.00 0.00 23.12 22.96 2g4i s ALA 193 CO 0.04 0.00 -0.10 0.99 0.00 0.00 0.00 175.76 176.69 2g4i s THR 194 N 0.31 0.92 0.05 0.00 2.01 -0.05 -0.19 115.64 118.69 2g4i s THR 194 Ca -0.03 -0.36 0.04 0.00 0.31 0.00 0.00 61.69 61.65 2g4i s THR 194 Cb -0.05 -0.86 -0.02 0.00 0.01 0.00 0.00 72.50 71.57 2g4i s THR 194 CO -0.01 0.31 -0.12 0.72 -0.69 0.00 0.00 174.62 174.83 2g4i s PHE 195 N 0.69 1.03 -0.01 4.92 -0.71 -0.68 -0.61 117.98 122.62 2g4i s PHE 195 Ca -0.13 -0.40 0.02 0.00 -1.04 0.00 0.00 56.93 55.39 2g4i s PHE 195 Cb -0.15 -0.61 -0.03 0.00 -1.21 0.00 0.00 43.02 41.02 2g4i s PHE 195 CO 0.02 0.01 -0.03 0.95 -1.34 0.00 0.00 175.22 174.83 2g4i s THR 196 N -1.03 3.90 -0.03 -4.49 -4.23 -0.62 -1.18 115.64 107.95 2g4i s THR 196 Ca -0.02 -0.67 -0.09 0.00 -1.18 0.00 0.00 61.69 59.73 2g4i s THR 196 Cb -0.08 -2.71 0.01 0.00 1.34 0.00 0.00 72.50 71.06 2g4i s THR 196 CO 0.01 0.40 0.21 0.72 -0.54 0.00 0.00 174.62 175.42 2g4i s PHE 197 N -1.02 -0.11 -0.26 3.99 -0.71 -0.49 -0.71 117.98 118.67 2g4i s PHE 197 Ca 0.18 0.22 0.02 0.00 -1.04 0.00 0.00 56.93 56.30 2g4i s PHE 197 Cb -0.11 0.03 0.07 0.00 -1.21 0.00 0.00 43.02 41.79 2g4i s PHE 197 CO 0.08 -0.25 -0.05 -1.17 -1.34 0.00 0.00 175.22 172.49 2g4i s LEU 198 N -0.83 3.00 -0.35 -1.99 2.96 0.46 -0.47 118.68 121.46 2g4i s LEU 198 Ca -0.09 -1.36 -0.07 0.00 -0.22 0.00 0.00 54.13 52.39 2g4i s LEU 198 Cb -0.05 -1.30 0.04 0.00 0.50 0.00 0.00 46.19 45.38 2g4i s LEU 198 CO 0.02 -0.25 0.12 -0.63 -1.32 0.00 0.00 176.35 174.29 2g4i s ILE 199 N 1.28 3.92 0.06 6.68 1.01 -1.26 -2.52 121.20 130.37 2g4i s ILE 199 Ca -0.04 -1.09 0.06 0.00 0.00 0.00 0.00 60.65 59.58 2g4i s ILE 199 Cb -0.19 -3.22 -0.03 0.00 0.01 0.00 0.00 42.46 39.03 2g4i s ILE 199 CO -0.07 -0.19 -0.18 -1.59 0.00 0.00 0.00 174.94 172.91 2g4i s LYS 200 N 1.43 1.12 -0.01 2.79 -2.85 -1.25 -1.16 119.74 119.81 2g4i s LYS 200 Ca -0.01 -0.92 -0.01 0.00 -1.00 0.00 0.00 55.97 54.03 2g4i s LYS 200 Cb -0.19 -1.22 0.00 0.00 -2.06 0.00 0.00 37.83 34.36 2g4i s LYS 200 CO 0.03 0.30 0.02 0.45 0.10 0.00 0.00 175.35 176.26 2g4i s SER 201 N -1.35 -0.01 0.00 0.03 0.15 -1.26 -0.73 113.70 110.53 2g4i s SER 201 Ca 0.04 0.01 0.08 0.00 0.70 0.00 0.00 55.95 56.79 2g4i s SER 201 Cb -0.09 0.06 0.38 0.00 -1.71 0.00 0.00 66.02 64.66 2g4i s SER 201 CO 0.02 -0.04 1.23 -0.81 1.20 0.00 0.00 173.24 174.84 2g4i n PRO 202 N 2.93 0.04 -3.89 5.44 -0.04 -1.26 -4.81 135.00 133.41 2g4i n PRO 202 Ca -0.13 0.31 -0.35 0.00 -0.04 0.00 0.00 63.50 63.29 2g4i n PRO 202 Cb 0.59 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.50 2g4i n PRO 202 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2g4i s ASP 203 N -2.86 6.38 0.54 3.54 1.01 -1.26 -5.01 116.67 119.01 2g4i s ASP 203 Ca 0.05 0.40 0.33 0.00 0.71 0.00 0.00 52.55 54.05 2g4i s ASP 203 Cb 0.06 -2.03 1.33 0.00 1.01 0.00 0.00 42.92 43.28 2g4i s ASP 203 CO 0.14 0.32 1.97 0.28 0.21 0.00 0.00 175.17 178.09 2g4i h SER 204 N 4.28 0.00 -4.34 0.27 0.02 -1.98 -3.34 113.55 108.46 2g4i h SER 204 Ca -0.51 0.00 -0.64 0.00 -0.84 0.00 0.00 61.79 59.79 2g4i h SER 204 Cb 1.20 0.00 -0.41 0.00 0.14 0.00 0.00 62.40 63.34 2g4i h SER 204 CO 0.65 0.00 -0.63 -1.00 -1.14 0.00 0.00 176.83 174.71 2g4i s HIS 205 N -3.65 3.22 0.63 3.45 3.76 -1.26 -5.12 115.29 116.32 2g4i s HIS 205 Ca 0.01 -3.16 -0.11 0.00 -0.15 0.00 0.00 55.06 51.66 2g4i s HIS 205 Cb 0.09 -2.84 -0.03 0.00 1.11 0.00 0.00 32.58 30.91 2g4i s HIS 205 CO 0.55 -0.75 1.04 -1.25 -0.85 0.00 0.00 174.74 173.47 2g4i s PRO 206 N -0.23 3.48 0.03 8.40 0.04 -1.26 -4.45 135.00 141.02 2g4i s PRO 206 Ca 0.17 0.77 -0.14 0.00 0.04 0.00 0.00 61.00 61.84 2g4i s PRO 206 Cb -0.25 -2.06 0.02 0.00 0.04 0.00 0.00 34.50 32.24 2g4i s PRO 206 CO -0.00 -0.66 0.31 0.00 0.04 0.00 0.00 177.00 176.68 2g4i s ALA 207 N -3.16 -0.70 -0.01 8.56 0.00 -1.20 -3.78 121.76 121.47 2g4i s ALA 207 Ca 0.56 0.06 0.01 0.00 0.00 0.00 0.00 51.96 52.59 2g4i s ALA 207 Cb -0.11 0.28 -0.01 0.00 0.00 0.00 0.00 23.12 23.27 2g4i s ALA 207 CO 0.54 -0.39 0.00 -0.25 0.00 0.00 0.00 175.76 175.67 2g4i n ASP 208 N 0.70 4.70 0.00 0.00 8.00 0.93 -2.80 116.55 128.07 2g4i n ASP 208 Ca -0.19 -0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.31 2g4i n ASP 208 Cb 0.59 0.47 0.00 0.00 -0.02 0.00 0.00 41.12 42.16 2g4i n ASP 208 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2g4i n GLY 209 N 2.99 0.29 3.43 0.44 0.00 -1.20 -1.26 105.19 109.89 2g4i n GLY 209 Ca -0.01 -1.36 -0.32 0.00 0.00 0.00 0.00 46.02 44.33 2g4i n GLY 209 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2g4i s ILE 210 N -1.89 2.77 -0.04 -0.61 1.01 -0.69 -2.63 121.20 119.12 2g4i s ILE 210 Ca 0.00 -0.88 0.05 0.00 0.00 0.00 0.00 60.65 59.82 2g4i s ILE 210 Cb 0.00 -2.07 -0.01 0.00 0.01 0.00 0.00 42.46 40.40 2g4i s ILE 210 CO 0.00 0.56 -0.19 0.00 0.00 0.00 0.00 174.94 175.31 2g4i s ALA 211 N -0.72 1.63 -0.02 9.38 0.00 -0.39 0.13 121.76 131.78 2g4i s ALA 211 Ca 0.11 -0.77 -0.24 0.00 0.00 0.00 0.00 51.96 51.06 2g4i s ALA 211 Cb -0.10 -0.51 -0.04 0.00 0.00 0.00 0.00 23.12 22.46 2g4i s ALA 211 CO 0.01 0.32 0.73 0.12 0.00 0.00 0.00 175.76 176.94 2g4i s PHE 212 N -0.09 3.65 0.08 0.00 5.36 -0.72 -1.51 117.98 124.75 2g4i s PHE 212 Ca -0.01 1.35 0.00 0.00 -0.96 0.00 0.00 56.93 57.31 2g4i s PHE 212 Cb -0.11 -2.81 -0.04 0.00 -0.34 0.00 0.00 43.02 39.72 2g4i s PHE 212 CO 0.02 0.17 -0.04 -0.59 -1.46 0.00 0.00 175.22 173.33 2g4i s PHE 213 N 0.41 0.74 -0.06 10.12 -0.71 0.93 -0.90 117.98 128.51 2g4i s PHE 213 Ca 0.38 -1.02 0.03 0.00 -1.04 0.00 0.00 56.93 55.29 2g4i s PHE 213 Cb -0.19 -0.47 0.00 0.00 -1.21 0.00 0.00 43.02 41.16 2g4i s PHE 213 CO 0.20 -0.29 -0.16 0.42 -1.34 0.00 0.00 175.22 174.06 2g4i s ILE 214 N -3.79 1.38 0.31 -4.49 1.01 0.74 -0.46 121.20 115.89 2g4i s ILE 214 Ca 0.11 -0.65 0.05 0.00 0.00 0.00 0.00 60.65 60.16 2g4i s ILE 214 Cb 0.07 -1.21 -0.03 0.00 0.01 0.00 0.00 42.46 41.30 2g4i s ILE 214 CO -0.06 0.40 0.23 -0.94 0.00 0.00 0.00 174.94 174.57 2g4i s SER 215 N 0.32 1.47 0.99 3.58 1.04 -0.08 -1.37 113.70 119.64 2g4i s SER 215 Ca -0.10 -1.66 -0.11 0.00 0.48 0.00 0.00 55.95 54.56 2g4i s SER 215 Cb -0.14 0.50 0.18 0.00 0.10 0.00 0.00 66.02 66.67 2g4i s SER 215 CO 0.04 -0.99 1.09 0.54 0.98 0.00 0.00 173.24 174.90 2g4i s ASN 216 N -3.35 2.48 0.29 7.02 4.22 -1.23 -1.01 114.94 123.36 2g4i s ASN 216 Ca 0.38 1.80 0.12 0.00 -2.14 0.00 0.00 52.86 53.03 2g4i s ASN 216 Cb 0.04 -2.40 0.42 0.00 1.28 0.00 0.00 41.25 40.59 2g4i s ASN 216 CO 0.23 -3.31 1.63 0.16 -2.04 0.00 0.00 177.10 173.77 2g4i h ILE 217 N -2.01 1.33 -0.58 0.54 3.07 -1.85 -3.04 117.51 114.96 2g4i h ILE 217 Ca -0.51 -2.00 0.00 0.00 1.55 0.00 0.00 64.86 63.90 2g4i h ILE 217 Cb 1.29 2.10 0.00 0.00 -0.27 0.00 0.00 36.82 39.94 2g4i h ILE 217 CO 0.48 0.56 0.00 -0.90 -1.05 0.00 0.00 178.15 177.24 2g4i n ASP 218 N -3.75 5.76 -4.73 2.16 5.75 -1.26 -4.84 116.55 115.64 2g4i n ASP 218 Ca -0.01 -2.93 -0.42 0.00 -0.01 0.00 0.00 54.79 51.42 2g4i n ASP 218 Cb 0.60 -0.69 -0.02 0.00 -1.03 0.00 0.00 41.12 39.98 2g4i n ASP 218 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 2g4i n SER 219 N 0.63 3.63 -4.23 -1.12 2.88 -1.15 -5.02 113.62 109.23 2g4i n SER 219 Ca 0.28 1.16 -0.13 0.00 -1.33 0.00 0.00 58.87 58.84 2g4i n SER 219 Cb 1.20 -1.56 -0.10 0.00 -0.75 0.00 0.00 64.21 63.00 2g4i n SER 219 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2g4i s SER 220 N 0.37 1.29 0.04 -3.46 1.04 -1.26 -5.08 113.70 106.65 2g4i s SER 220 Ca 0.63 -1.13 -0.31 0.00 0.48 0.00 0.00 55.95 55.63 2g4i s SER 220 Cb -0.52 0.10 -0.10 0.00 0.10 0.00 0.00 66.02 65.60 2g4i s SER 220 CO 0.51 -0.52 1.94 -0.38 0.98 0.00 0.00 173.24 175.76 2g4i n ILE 221 N -0.21 0.67 -2.17 -1.02 5.41 -1.26 -4.94 119.36 115.84 2g4i n ILE 221 Ca -0.08 -0.12 -0.40 0.00 1.00 0.00 0.00 62.75 63.15 2g4i n ILE 221 Cb 0.62 -2.23 -0.02 0.00 -0.71 0.00 0.00 39.64 37.31 2g4i n ILE 221 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 2g4i s PRO 222 N 4.06 4.23 0.23 0.38 0.02 -1.26 -4.98 135.00 137.69 2g4i s PRO 222 Ca 0.88 2.09 -0.30 0.00 0.02 0.00 0.00 61.00 63.69 2g4i s PRO 222 Cb -0.47 -2.93 -0.15 0.00 0.02 0.00 0.00 34.50 30.97 2g4i s PRO 222 CO 0.42 -0.25 1.13 0.45 -0.33 0.00 0.00 177.00 178.43 2g4i n SER 223 N 0.54 1.54 -3.07 2.53 2.88 -1.26 -2.56 113.62 114.21 2g4i n SER 223 Ca 0.02 1.16 -0.21 0.00 -1.33 0.00 0.00 58.87 58.50 2g4i n SER 223 Cb 0.43 -1.28 0.01 0.00 -0.75 0.00 0.00 64.21 62.62 2g4i n SER 223 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2g4i n GLY 224 N 1.69 -0.50 1.91 0.46 0.00 -1.26 -4.75 105.19 102.74 2g4i n GLY 224 Ca 0.12 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.23 2g4i n GLY 224 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2g4i n SER 225 N -2.27 5.12 -4.66 1.61 3.41 -1.06 -4.90 113.62 110.86 2g4i n SER 225 Ca -0.08 -3.03 -0.29 0.00 -0.26 0.00 0.00 58.87 55.22 2g4i n SER 225 Cb 0.58 -0.71 0.18 0.00 -0.26 0.00 0.00 64.21 64.00 2g4i n SER 225 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2g4i s THR 226 N -2.78 2.24 0.00 6.66 -4.23 -1.26 0.15 115.64 116.42 2g4i s THR 226 Ca 0.52 0.08 0.00 0.00 -1.18 0.00 0.00 61.69 61.11 2g4i s THR 226 Cb 0.41 -2.50 0.00 0.00 1.34 0.00 0.00 72.50 71.75 2g4i s THR 226 CO 0.14 -0.10 0.00 0.61 -0.54 0.00 0.00 174.62 174.73 2g4i n GLY 227 N -0.81 3.01 0.25 3.99 0.00 -0.13 -3.23 105.19 108.26 2g4i n GLY 227 Ca 0.06 -0.20 0.17 0.00 0.00 0.00 0.00 46.02 46.05 2g4i n GLY 227 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2g4i h ARG 228 N 0.00 0.00 -0.00 1.61 0.11 -1.89 -2.47 114.38 111.74 2g4i h ARG 228 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2g4i h ARG 228 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 2g4i h ARG 228 CO 0.00 0.00 -0.27 1.28 0.10 0.00 0.00 179.97 181.08 2g4i n LEU 229 N -2.79 0.48 -0.75 0.08 4.77 -1.20 -4.94 117.00 112.65 2g4i n LEU 229 Ca -0.00 0.06 -0.10 0.00 -0.03 0.00 0.00 56.01 55.94 2g4i n LEU 229 Cb 0.19 -0.26 -0.04 0.00 -2.33 0.00 0.00 43.42 40.97 2g4i n LEU 229 CO 0.21 0.10 -0.09 0.18 -1.33 0.00 0.00 177.39 176.46 2g4i n LEU 230 N -1.24 -0.56 -0.39 2.23 4.77 -0.93 -1.51 117.00 119.36 2g4i n LEU 230 Ca 0.09 0.24 -0.05 0.00 -0.03 0.00 0.00 56.01 56.26 2g4i n LEU 230 Cb 0.32 -1.91 -0.02 0.00 -2.33 0.00 0.00 43.42 39.49 2g4i n LEU 230 CO 0.29 -0.66 -0.05 0.61 -1.33 0.00 0.00 177.39 176.25 2g4i n GLY 231 N -1.19 0.67 0.09 -0.72 0.00 0.12 -3.83 105.19 100.34 2g4i n GLY 231 Ca -0.10 -0.18 -0.12 0.00 0.00 0.00 0.00 46.02 45.62 2g4i n GLY 231 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2g4i n LEU 232 N -0.58 2.58 -4.26 0.99 4.77 -0.57 -4.46 117.00 115.46 2g4i n LEU 232 Ca -0.05 -0.09 -0.21 0.00 -0.03 0.00 0.00 56.01 55.63 2g4i n LEU 232 Cb 0.35 -0.53 -0.12 0.00 -2.33 0.00 0.00 43.42 40.79 2g4i n LEU 232 CO 0.08 0.76 -0.48 -0.36 -1.33 0.00 0.00 177.39 176.06 2g4i s PHE 233 N -2.38 1.58 -0.48 -1.77 0.08 -1.18 -4.81 117.98 109.02 2g4i s PHE 233 Ca -0.23 -0.48 0.24 0.00 0.12 0.00 0.00 56.93 56.57 2g4i s PHE 233 Cb 0.06 -0.83 0.34 0.00 -0.57 0.00 0.00 43.02 42.02 2g4i s PHE 233 CO 0.46 0.19 1.45 -1.00 -0.10 0.00 0.00 175.22 176.22 2g4i h PRO 234 N 3.72 0.00 -3.67 0.24 0.13 -1.90 -3.41 132.00 127.11 2g4i h PRO 234 Ca -0.42 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.60 2g4i h PRO 234 Cb 1.19 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.25 2g4i h PRO 234 CO 0.46 0.00 -0.07 0.16 -0.23 0.00 0.00 178.00 178.32 2g4i s ASP 235 N -5.33 0.22 -0.10 1.44 1.47 -1.26 -4.88 116.67 108.22 2g4i s ASP 235 Ca 0.06 -1.12 0.08 0.00 1.18 0.00 0.00 52.55 52.75 2g4i s ASP 235 Cb 0.09 0.66 0.43 0.00 -0.34 0.00 0.00 42.92 43.75 2g4i s ASP 235 CO 0.70 -1.28 1.19 0.00 0.68 0.00 0.00 175.17 176.46 2g4i n ALA 236 N -0.46 3.10 0.58 2.11 0.00 -1.26 -4.69 120.51 119.90 2g4i n ALA 236 Ca -0.02 -0.97 0.05 0.00 0.00 0.00 0.00 53.44 52.50 2g4i n ALA 236 Cb 0.61 -1.05 0.28 0.00 0.00 0.00 0.00 19.45 19.29 2g4i n ALA 236 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59