#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c4g h LEU -2 N 0.00 0.00 -0.58 1.53 3.38 -2.00 -3.07 115.31 114.57 2c4g h LEU -2 Ca 0.00 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.81 2c4g h LEU -2 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2c4g h LEU -2 CO 0.00 0.14 -0.65 0.58 0.09 0.00 0.00 178.44 178.60 2c4g h VAL -1 N 0.00 1.40 -0.12 1.22 2.07 -2.05 -2.56 116.25 116.22 2c4g h VAL -1 Ca -0.01 -2.09 -0.16 0.00 0.82 0.00 0.00 66.70 65.25 2c4g h VAL -1 Cb 1.12 2.08 0.01 0.00 -1.52 0.00 0.00 31.29 32.98 2c4g h VAL -1 CO 0.02 0.62 -0.57 0.44 0.02 0.00 0.00 177.57 178.10 2c4g h ASP 0 N 0.17 0.70 0.25 0.57 5.19 -1.99 -3.13 116.42 118.18 2c4g h ASP 0 Ca -0.01 -0.64 -0.05 0.00 -0.62 0.00 0.00 57.03 55.71 2c4g h ASP 0 Cb 1.18 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 40.47 2c4g h ASP 0 CO 0.10 1.23 -0.24 0.24 -3.12 0.00 0.00 179.24 177.45 2c4g h MET 1 N 0.23 0.00 0.00 3.56 2.86 -1.53 -1.66 114.93 118.39 2c4g h MET 1 Ca -0.04 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.55 2c4g h MET 1 Cb 1.21 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.86 2c4g h MET 1 CO 0.12 0.24 -0.24 1.49 1.06 0.00 0.00 176.91 179.57 2c4g h GLU 2 N 0.00 0.00 -0.02 1.72 4.57 -1.40 -2.31 114.58 117.14 2c4g h GLU 2 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2c4g h GLU 2 Cb 0.43 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.02 2c4g h GLU 2 CO 0.03 0.24 0.00 0.09 -1.18 0.00 0.00 179.01 178.19 2c4g n ASN 3 N -4.21 0.21 -4.60 1.04 3.02 -0.63 -4.79 115.26 105.31 2c4g n ASN 3 Ca -0.02 -1.38 -0.34 0.00 -0.03 0.00 0.00 54.58 52.81 2c4g n ASN 3 Cb 0.30 -0.01 -0.11 0.00 -0.61 0.00 0.00 39.78 39.35 2c4g n ASN 3 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2c4g s PHE 4 N -1.98 3.09 -0.19 3.10 0.08 -0.87 0.11 117.98 121.32 2c4g s PHE 4 Ca 0.32 -0.01 -0.01 0.00 0.12 0.00 0.00 56.93 57.34 2c4g s PHE 4 Cb 0.15 -1.87 0.00 0.00 -0.57 0.00 0.00 43.02 40.74 2c4g s PHE 4 CO 0.25 0.24 -0.11 -1.14 -0.10 0.00 0.00 175.22 174.36 2c4g s GLN 5 N -0.31 3.24 0.60 0.44 2.00 0.59 -4.92 119.66 121.29 2c4g s GLN 5 Ca 0.06 -0.71 -0.18 0.00 -2.00 0.00 0.00 55.36 52.52 2c4g s GLN 5 Cb -0.12 -2.79 -0.03 0.00 0.80 0.00 0.00 33.01 30.87 2c4g s GLN 5 CO 0.02 -0.13 1.19 0.15 -0.50 0.00 0.00 175.29 176.02 2c4g s LYS 6 N 1.23 2.97 0.00 1.67 1.02 -1.26 -0.46 119.74 124.91 2c4g s LYS 6 Ca 0.02 1.77 0.00 0.00 0.02 0.00 0.00 55.97 57.79 2c4g s LYS 6 Cb -0.14 -1.94 0.00 0.00 -0.52 0.00 0.00 37.83 35.23 2c4g s LYS 6 CO -0.05 -1.19 0.00 0.28 -0.92 0.00 0.00 175.35 173.47 2c4g n VAL 7 N -1.65 0.00 -3.65 3.17 0.31 0.14 -4.82 118.33 111.84 2c4g n VAL 7 Ca 0.13 0.00 -0.02 0.00 -0.01 0.00 0.00 64.34 64.44 2c4g n VAL 7 Cb 0.50 -0.82 -0.07 0.00 -0.91 0.00 0.00 33.84 32.55 2c4g n VAL 7 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 2c4g s GLU 8 N -1.86 0.26 -1.11 5.55 -1.05 -1.12 -4.95 118.70 114.42 2c4g s GLU 8 Ca 0.00 0.40 -0.24 0.00 -0.15 0.00 0.00 54.97 54.98 2c4g s GLU 8 Cb 0.00 0.08 -0.13 0.00 -0.44 0.00 0.00 34.13 33.64 2c4g s GLU 8 CO 0.00 -0.05 2.01 0.21 0.95 0.00 0.00 175.26 178.39 2c4g s LYS 9 N 0.85 2.06 0.30 -4.83 2.20 -1.26 -0.53 119.74 118.53 2c4g s LYS 9 Ca -0.04 -0.78 0.04 0.00 -0.36 0.00 0.00 55.97 54.83 2c4g s LYS 9 Cb -0.04 -5.12 0.80 0.00 -1.51 0.00 0.00 37.83 31.96 2c4g s LYS 9 CO -0.12 -4.40 1.49 -0.89 -0.36 0.00 0.00 175.35 171.07 2c4g n ILE 10 N 8.23 -0.40 -3.26 5.43 5.41 0.57 -4.85 119.36 130.49 2c4g n ILE 10 Ca 0.43 2.07 0.00 0.00 1.00 0.00 0.00 62.75 66.26 2c4g n ILE 10 Cb 0.46 -3.07 0.00 0.00 -0.71 0.00 0.00 39.64 36.32 2c4g n ILE 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2c4g n GLY 11 N -1.45 0.89 0.00 7.39 0.00 -0.67 -5.01 105.19 106.34 2c4g n GLY 11 Ca 0.24 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.56 2c4g n GLY 11 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2c4g n GLU 12 N 0.00 0.00 0.00 1.61 0.28 -1.26 -1.06 120.64 120.21 2c4g n GLU 12 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2c4g n GLU 12 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 2c4g n GLU 12 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2c4g n GLY 13 N 0.00 0.37 0.10 -1.84 0.00 -0.84 -4.86 105.19 98.13 2c4g n GLY 13 Ca 0.00 -1.11 -0.19 0.00 0.00 0.00 0.00 46.02 44.72 2c4g n GLY 13 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2c4g h THR 14 N 0.00 1.32 -0.25 2.61 2.02 -2.02 -3.37 112.91 113.23 2c4g h THR 14 Ca 0.00 -2.35 0.03 0.00 0.77 0.00 0.00 66.41 64.86 2c4g h THR 14 Cb 0.00 2.88 -0.05 0.00 -1.74 0.00 0.00 68.15 69.25 2c4g h THR 14 CO 0.00 0.58 -0.33 1.88 0.37 0.00 0.00 175.52 178.02 2c4g h TYR 15 N -0.72 -1.01 0.00 3.16 -1.99 -1.95 -3.48 116.97 110.98 2c4g h TYR 15 Ca -0.19 0.05 0.00 0.00 2.00 0.00 0.00 58.73 60.59 2c4g h TYR 15 Cb 1.38 0.47 0.00 0.00 2.00 0.00 0.00 36.73 40.58 2c4g h TYR 15 CO 0.18 -0.29 0.00 0.41 -0.00 0.00 0.00 178.16 178.46 2c4g n GLY 16 N -1.22 -0.15 3.08 3.88 0.00 -1.25 -4.38 105.19 105.14 2c4g n GLY 16 Ca -0.02 0.56 -0.10 0.00 0.00 0.00 0.00 46.02 46.46 2c4g n GLY 16 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c4g s VAL 17 N 2.87 0.43 -0.33 1.61 1.01 0.48 -1.98 120.40 124.48 2c4g s VAL 17 Ca 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 61.98 60.58 2c4g s VAL 17 Cb 0.00 -0.99 0.11 0.00 0.00 0.00 0.00 36.38 35.50 2c4g s VAL 17 CO 0.00 -0.65 0.11 -0.69 0.00 0.00 0.00 175.10 173.87 2c4g s VAL 18 N -2.46 1.12 0.41 2.92 1.01 -0.22 0.18 120.40 123.36 2c4g s VAL 18 Ca -0.02 -1.70 -0.00 0.00 0.00 0.00 0.00 61.98 60.25 2c4g s VAL 18 Cb -0.03 -1.84 -0.02 0.00 0.00 0.00 0.00 36.38 34.49 2c4g s VAL 18 CO -0.03 -0.70 0.63 -0.31 0.00 0.00 0.00 175.10 174.69 2c4g s TYR 19 N 1.33 3.39 -0.21 5.22 1.51 0.13 -0.32 117.35 128.40 2c4g s TYR 19 Ca 0.11 0.36 -0.12 0.00 -1.01 0.00 0.00 57.07 56.41 2c4g s TYR 19 Cb -0.19 -2.13 -0.05 0.00 -0.11 0.00 0.00 41.96 39.49 2c4g s TYR 19 CO -0.19 -0.14 0.20 0.21 -1.11 0.00 0.00 175.55 174.53 2c4g s LYS 20 N -4.48 4.14 0.20 -0.62 2.20 0.31 0.05 119.74 121.54 2c4g s LYS 20 Ca 0.44 -0.14 0.03 0.00 -0.36 0.00 0.00 55.97 55.94 2c4g s LYS 20 Cb -0.10 -3.49 -0.05 0.00 -1.51 0.00 0.00 37.83 32.68 2c4g s LYS 20 CO 0.38 0.14 -0.02 0.00 -0.36 0.00 0.00 175.35 175.49 2c4g s ALA 21 N 0.81 1.59 -0.03 3.13 0.00 -0.06 0.28 121.76 127.48 2c4g s ALA 21 Ca 0.10 -1.66 0.06 0.00 0.00 0.00 0.00 51.96 50.47 2c4g s ALA 21 Cb -0.13 0.43 -0.01 0.00 0.00 0.00 0.00 23.12 23.41 2c4g s ALA 21 CO 0.03 -0.25 -0.21 0.50 0.00 0.00 0.00 175.76 175.83 2c4g s ARG 22 N -3.86 1.91 -0.19 0.00 3.52 0.39 -0.68 118.95 120.03 2c4g s ARG 22 Ca 0.25 -0.77 -0.29 0.00 -0.13 0.00 0.00 55.73 54.79 2c4g s ARG 22 Cb 0.05 -1.76 0.00 0.00 -1.56 0.00 0.00 34.95 31.69 2c4g s ARG 22 CO 0.06 0.41 1.06 1.21 -0.81 0.00 0.00 175.30 177.22 2c4g s ASN 23 N -0.34 7.12 0.42 -2.12 3.84 0.14 -0.30 114.94 123.69 2c4g s ASN 23 Ca 0.04 1.46 0.16 0.00 0.21 0.00 0.00 52.86 54.72 2c4g s ASN 23 Cb -0.10 -2.54 0.90 0.00 -0.55 0.00 0.00 41.25 38.96 2c4g s ASN 23 CO 0.01 -0.62 1.91 0.11 -2.79 0.00 0.00 177.10 175.71 2c4g h LYS 24 N 7.44 0.00 0.14 0.43 1.57 0.49 0.67 116.57 127.31 2c4g h LYS 24 Ca -0.23 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.20 2c4g h LYS 24 Cb 1.09 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.39 2c4g h LYS 24 CO 0.95 0.28 -1.84 -0.07 -0.57 0.00 0.00 179.45 178.20 2c4g h LEU 25 N 0.00 0.48 0.00 2.94 3.38 -1.92 -3.40 115.31 116.79 2c4g h LEU 25 Ca -0.00 -0.93 0.00 0.00 0.09 0.00 0.00 57.88 57.04 2c4g h LEU 25 Cb 0.52 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.12 2c4g h LEU 25 CO 0.04 1.81 -1.61 0.35 0.09 0.00 0.00 178.44 179.11 2c4g n THR 26 N -3.59 0.00 0.00 0.22 -2.24 -1.24 -4.98 114.28 102.46 2c4g n THR 26 Ca -0.29 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 2c4g n THR 26 Cb 1.04 0.37 0.00 0.00 -2.10 0.00 0.00 70.33 69.64 2c4g n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2c4g n GLY 27 N 1.36 2.24 3.68 3.38 0.00 0.23 -5.00 105.19 111.08 2c4g n GLY 27 Ca -0.01 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.56 2c4g n GLY 27 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2c4g n GLU 28 N -2.00 2.24 -3.54 1.61 2.13 -1.25 -4.47 120.64 115.36 2c4g n GLU 28 Ca 0.00 0.80 -0.36 0.00 0.66 0.00 0.00 57.16 58.26 2c4g n GLU 28 Cb 0.00 -2.54 -0.07 0.00 0.27 0.00 0.00 31.44 29.10 2c4g n GLU 28 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2c4g s VAL 29 N 0.44 5.31 0.28 6.31 1.01 -1.26 0.24 120.40 132.73 2c4g s VAL 29 Ca 0.72 0.54 0.03 0.00 0.00 0.00 0.00 61.98 63.26 2c4g s VAL 29 Cb -0.63 -3.63 -0.06 0.00 0.00 0.00 0.00 36.38 32.07 2c4g s VAL 29 CO 0.43 0.39 0.07 0.68 0.00 0.00 0.00 175.10 176.67 2c4g s VAL 30 N 0.47 0.87 -0.31 2.92 -7.23 0.14 -3.66 120.40 113.60 2c4g s VAL 30 Ca 0.16 -2.00 -0.07 0.00 -1.81 0.00 0.00 61.98 58.26 2c4g s VAL 30 Cb -0.13 -2.64 0.02 0.00 0.56 0.00 0.00 36.38 34.19 2c4g s VAL 30 CO 0.04 -0.06 0.09 0.00 -0.31 0.00 0.00 175.10 174.86 2c4g s ALA 31 N -3.53 3.07 -0.29 1.32 0.00 0.06 -0.88 121.76 121.50 2c4g s ALA 31 Ca 0.36 -1.56 -0.13 0.00 0.00 0.00 0.00 51.96 50.62 2c4g s ALA 31 Cb 0.08 -2.21 -0.04 0.00 0.00 0.00 0.00 23.12 20.95 2c4g s ALA 31 CO 0.13 -1.08 0.28 -0.51 0.00 0.00 0.00 175.76 174.58 2c4g s LEU 32 N 1.47 4.12 -0.46 0.00 1.43 0.11 -1.18 118.68 124.17 2c4g s LEU 32 Ca 0.01 0.04 -0.11 0.00 -1.03 0.00 0.00 54.13 53.04 2c4g s LEU 32 Cb -0.18 -2.26 0.09 0.00 0.03 0.00 0.00 46.19 43.87 2c4g s LEU 32 CO 0.03 -0.15 0.34 -0.75 0.23 0.00 0.00 176.35 176.04 2c4g s LYS 33 N 1.91 2.69 -0.03 1.70 2.20 -0.15 0.22 119.74 128.29 2c4g s LYS 33 Ca 0.10 -1.55 -0.25 0.00 -0.36 0.00 0.00 55.97 53.92 2c4g s LYS 33 Cb -0.16 -3.95 -0.04 0.00 -1.51 0.00 0.00 37.83 32.17 2c4g s LYS 33 CO 0.11 -1.08 0.76 0.21 -0.36 0.00 0.00 175.35 174.99 2c4g s LYS 34 N 1.47 4.47 -0.20 4.03 2.20 0.13 -1.80 119.74 130.03 2c4g s LYS 34 Ca 0.04 1.02 0.01 0.00 -0.36 0.00 0.00 55.97 56.68 2c4g s LYS 34 Cb -0.25 -3.43 0.04 0.00 -1.51 0.00 0.00 37.83 32.68 2c4g s LYS 34 CO 0.02 0.11 -0.12 0.42 -0.36 0.00 0.00 175.35 175.42 2c4g s ILE 35 N 0.60 1.78 -0.04 5.43 1.01 -0.54 -0.39 121.20 129.06 2c4g s ILE 35 Ca 0.40 -1.06 -0.30 0.00 0.00 0.00 0.00 60.65 59.69 2c4g s ILE 35 Cb -0.19 -1.80 -0.03 0.00 0.01 0.00 0.00 42.46 40.45 2c4g s ILE 35 CO 0.21 0.22 1.05 -0.13 0.00 0.00 0.00 174.94 176.29 2c4g s ARG 36 N 1.34 4.46 0.00 2.79 0.52 -1.26 -1.52 118.95 125.29 2c4g s ARG 36 Ca -0.01 1.49 0.25 0.00 -0.52 0.00 0.00 55.73 56.94 2c4g s ARG 36 Cb -0.16 -3.49 0.58 0.00 0.52 0.00 0.00 34.95 32.40 2c4g s ARG 36 CO -0.09 -0.23 1.48 1.28 0.02 0.00 0.00 175.30 177.76 2c4g n LEU 37 N 4.50 2.36 -0.52 2.53 4.77 -0.17 -4.18 117.00 126.30 2c4g n LEU 37 Ca 0.08 -0.83 0.12 0.00 -0.03 0.00 0.00 56.01 55.35 2c4g n LEU 37 Cb 0.49 -0.03 0.13 0.00 -2.33 0.00 0.00 43.42 41.68 2c4g n LEU 37 CO 0.53 0.42 0.47 0.47 -1.33 0.00 0.00 177.39 177.95 2c4g n ASP 38 N 0.83 1.94 -1.18 -1.43 8.00 -1.26 -3.33 116.55 120.13 2c4g n ASP 38 Ca 0.17 -1.46 0.00 0.00 0.71 0.00 0.00 54.79 54.20 2c4g n ASP 38 Cb 0.49 0.29 0.00 0.00 -0.02 0.00 0.00 41.12 41.88 2c4g n ASP 38 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 2c4g n THR 39 N 0.08 1.20 0.00 -3.53 -1.04 -1.26 -3.76 114.28 105.97 2c4g n THR 39 Ca 0.11 -0.15 0.00 0.00 -2.04 0.00 0.00 64.05 61.98 2c4g n THR 39 Cb 0.46 -1.11 0.00 0.00 -1.82 0.00 0.00 70.33 67.85 2c4g n THR 39 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 2c4g n GLU 40 N 0.87 0.00 -4.08 -2.82 0.28 -1.26 -5.00 120.64 108.63 2c4g n GLU 40 Ca 0.00 0.00 -0.37 0.00 -0.16 0.00 0.00 57.16 56.63 2c4g n GLU 40 Cb 0.45 0.00 -0.02 0.00 1.43 0.00 0.00 31.44 33.30 2c4g n GLU 40 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 2c4g n THR 41 N 0.00 -2.65 -0.29 3.84 -2.24 -1.21 -4.80 114.28 106.93 2c4g n THR 41 Ca 0.00 -0.61 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 2c4g n THR 41 Cb 0.00 -2.22 0.00 0.00 -2.10 0.00 0.00 70.33 66.01 2c4g n THR 41 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2c4g n GLU 42 N -4.72 1.93 0.00 -0.78 4.07 -1.26 -5.10 120.64 114.78 2c4g n GLU 42 Ca -0.20 -1.15 0.00 0.00 -0.06 0.00 0.00 57.16 55.75 2c4g n GLU 42 Cb 0.63 -0.85 0.00 0.00 -0.06 0.00 0.00 31.44 31.15 2c4g n GLU 42 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2c4g n GLY 43 N -0.33 0.24 3.73 8.31 0.00 -1.26 -4.90 105.19 110.98 2c4g n GLY 43 Ca 0.00 -1.61 -0.40 0.00 0.00 0.00 0.00 46.02 44.01 2c4g n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c4g s VAL 44 N 0.00 4.96 0.61 1.61 1.01 -1.26 -4.94 120.40 122.39 2c4g s VAL 44 Ca 0.00 1.49 -0.18 0.00 0.00 0.00 0.00 61.98 63.29 2c4g s VAL 44 Cb 0.00 -4.06 -0.06 0.00 0.00 0.00 0.00 36.38 32.27 2c4g s VAL 44 CO 0.00 0.29 0.75 -2.65 0.00 0.00 0.00 175.10 173.49 2c4g n PRO 45 N 3.47 0.66 0.06 2.72 -0.02 -1.26 -4.79 135.00 135.83 2c4g n PRO 45 Ca -0.02 0.26 -0.02 0.00 -2.02 0.00 0.00 63.50 61.71 2c4g n PRO 45 Cb 0.51 -1.95 0.25 0.00 -0.02 0.00 0.00 33.50 32.28 2c4g n PRO 45 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 2c4g h SER 46 N 0.26 0.37 0.09 2.55 0.02 -1.98 -1.78 113.55 113.08 2c4g h SER 46 Ca -0.47 -0.12 -0.06 0.00 -0.84 0.00 0.00 61.79 60.29 2c4g h SER 46 Cb 1.38 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.81 2c4g h SER 46 CO 0.48 0.63 -0.21 0.71 -1.14 0.00 0.00 176.83 177.30 2c4g h THR 47 N 0.33 1.22 -0.08 -2.27 1.35 -1.91 -0.60 112.91 110.94 2c4g h THR 47 Ca 0.05 -0.99 -0.07 0.00 -0.55 0.00 0.00 66.41 64.85 2c4g h THR 47 Cb 0.64 1.35 0.00 0.00 -1.73 0.00 0.00 68.15 68.41 2c4g h THR 47 CO 0.05 0.30 -0.22 0.00 -0.25 0.00 0.00 175.52 175.40 2c4g h ALA 48 N 1.58 0.14 -0.57 6.62 0.00 -1.79 0.11 119.26 125.35 2c4g h ALA 48 Ca 0.04 -0.39 0.10 0.00 0.00 0.00 0.00 54.91 54.66 2c4g h ALA 48 Cb 0.50 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.19 2c4g h ALA 48 CO 0.03 0.11 0.16 0.82 0.00 0.00 0.00 179.25 180.37 2c4g h ILE 49 N -0.18 0.72 -0.03 0.00 1.08 -1.00 -0.58 117.51 117.53 2c4g h ILE 49 Ca -0.00 -0.11 -0.11 0.00 -0.39 0.00 0.00 64.86 64.25 2c4g h ILE 49 Cb 0.83 0.38 0.01 0.00 -3.07 0.00 0.00 36.82 34.97 2c4g h ILE 49 CO 0.05 0.06 -0.41 0.03 -0.69 0.00 0.00 178.15 177.19 2c4g h ARG 50 N 0.31 0.32 -0.56 2.37 3.08 -1.09 -2.76 114.38 116.05 2c4g h ARG 50 Ca 0.29 -0.31 0.01 0.00 0.07 0.00 0.00 59.98 60.03 2c4g h ARG 50 Cb 0.39 0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.49 2c4g h ARG 50 CO -0.34 0.99 0.37 1.49 -1.07 0.00 0.00 179.97 181.41 2c4g h GLU 51 N -0.22 0.74 0.50 0.04 4.81 -0.83 -1.63 114.58 117.99 2c4g h GLU 51 Ca -0.04 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.12 2c4g h GLU 51 Cb 1.11 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.33 2c4g h GLU 51 CO 0.08 0.49 -0.24 0.82 -0.73 0.00 0.00 179.01 179.43 2c4g h ILE 52 N 0.76 0.00 -0.70 2.32 2.04 -1.19 0.27 117.51 121.02 2c4g h ILE 52 Ca 0.21 -0.11 0.11 0.00 1.00 0.00 0.00 64.86 66.06 2c4g h ILE 52 Cb -0.09 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 35.95 2c4g h ILE 52 CO -0.04 0.00 0.46 0.77 0.00 0.00 0.00 178.15 179.34 2c4g h SER 53 N -0.78 0.47 0.27 1.72 4.64 -1.54 0.52 113.55 118.85 2c4g h SER 53 Ca -0.07 0.01 -0.34 0.00 -0.47 0.00 0.00 61.79 60.93 2c4g h SER 53 Cb 0.51 -0.08 0.03 0.00 -0.31 0.00 0.00 62.40 62.55 2c4g h SER 53 CO 0.11 0.27 -1.52 -0.07 -0.87 0.00 0.00 176.83 174.75 2c4g h LEU 54 N 0.52 0.79 -0.38 5.97 3.38 -1.31 -3.33 115.31 120.95 2c4g h LEU 54 Ca 0.33 -0.89 -0.06 0.00 0.09 0.00 0.00 57.88 57.35 2c4g h LEU 54 Cb 0.58 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 2c4g h LEU 54 CO -0.11 1.71 0.00 0.25 0.09 0.00 0.00 178.44 180.38 2c4g h LEU 55 N 0.14 0.66 -1.70 1.67 5.85 0.05 -2.50 115.31 119.48 2c4g h LEU 55 Ca -0.27 -0.31 0.00 0.00 0.84 0.00 0.00 57.88 58.15 2c4g h LEU 55 Cb 2.15 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 43.01 2c4g h LEU 55 CO 0.26 0.80 0.00 2.29 -0.34 0.00 0.00 178.44 181.45 2c4g n LYS 56 N -4.47 0.91 0.00 1.25 2.85 0.13 -1.30 118.16 117.53 2c4g n LYS 56 Ca -0.01 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.25 2c4g n LYS 56 Cb 0.28 -1.17 0.00 0.00 -0.65 0.00 0.00 35.03 33.49 2c4g n LYS 56 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 2c4g n GLU 57 N 0.40 0.15 -3.70 -1.58 2.13 -0.95 -4.95 120.64 112.13 2c4g n GLU 57 Ca 0.00 -0.43 -0.28 0.00 0.66 0.00 0.00 57.16 57.11 2c4g n GLU 57 Cb 0.38 -0.54 -0.12 0.00 0.27 0.00 0.00 31.44 31.44 2c4g n GLU 57 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2c4g s LEU 58 N -0.06 3.22 -0.46 4.31 1.43 -0.42 -5.07 118.68 121.64 2c4g s LEU 58 Ca 0.00 -3.26 -0.18 0.00 -1.03 0.00 0.00 54.13 49.66 2c4g s LEU 58 Cb 0.00 -1.12 0.04 0.00 0.03 0.00 0.00 46.19 45.14 2c4g s LEU 58 CO 0.00 -0.16 0.51 0.21 0.23 0.00 0.00 176.35 177.13 2c4g s ASN 59 N -0.48 6.21 -0.07 2.29 3.04 -1.26 -4.92 114.94 119.74 2c4g s ASN 59 Ca 0.25 -0.83 -0.20 0.00 0.04 0.00 0.00 52.86 52.12 2c4g s ASN 59 Cb -0.08 -2.25 0.04 0.00 -1.54 0.00 0.00 41.25 37.43 2c4g s ASN 59 CO -0.12 -0.71 0.47 -2.28 -3.04 0.00 0.00 177.10 171.42 2c4g s HIS 60 N 2.27 -0.42 0.56 0.43 2.46 -1.26 -5.04 115.29 114.29 2c4g s HIS 60 Ca 0.13 0.80 0.24 0.00 0.47 0.00 0.00 55.06 56.70 2c4g s HIS 60 Cb -0.19 0.22 1.50 0.00 -0.13 0.00 0.00 32.58 33.98 2c4g s HIS 60 CO 0.12 -0.43 2.10 -1.35 -2.47 0.00 0.00 174.74 172.72 2c4g h PRO 61 N 3.96 0.00 -0.76 2.88 0.11 -1.99 -2.43 132.00 133.77 2c4g h PRO 61 Ca -0.28 0.00 -0.40 0.00 0.11 0.00 0.00 66.00 65.42 2c4g h PRO 61 Cb 1.16 0.00 -0.24 0.00 0.11 0.00 0.00 31.00 32.04 2c4g h PRO 61 CO 0.35 0.00 0.38 0.09 -0.21 0.00 0.00 178.00 178.60 2c4g n ASN 62 N -4.16 3.41 -3.74 -2.05 4.13 -1.26 -4.84 115.26 106.75 2c4g n ASN 62 Ca 0.02 -3.69 -0.18 0.00 1.68 0.00 0.00 54.58 52.41 2c4g n ASN 62 Cb 0.31 -0.77 -0.17 0.00 -1.54 0.00 0.00 39.78 37.62 2c4g n ASN 62 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2c4g s ILE 63 N -3.35 0.03 0.42 2.41 1.01 -0.92 -1.53 121.20 119.27 2c4g s ILE 63 Ca 0.53 0.26 -0.23 0.00 0.00 0.00 0.00 60.65 61.21 2c4g s ILE 63 Cb 0.45 -0.21 -0.12 0.00 0.01 0.00 0.00 42.46 42.60 2c4g s ILE 63 CO 0.06 0.16 0.63 0.55 0.00 0.00 0.00 174.94 176.34 2c4g n VAL 64 N 4.75 1.92 -3.69 2.92 3.14 -0.29 -4.64 118.33 122.44 2c4g n VAL 64 Ca -0.15 -0.50 -0.37 0.00 -2.96 0.00 0.00 64.34 60.36 2c4g n VAL 64 Cb 0.50 -0.64 -0.10 0.00 -1.06 0.00 0.00 33.84 32.54 2c4g n VAL 64 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 2c4g s LYS 65 N -1.66 3.99 -0.39 1.45 2.20 -1.26 -4.98 119.74 119.10 2c4g s LYS 65 Ca 0.63 -0.31 -0.23 0.00 -0.36 0.00 0.00 55.97 55.71 2c4g s LYS 65 Cb -0.60 -3.51 0.01 0.00 -1.51 0.00 0.00 37.83 32.23 2c4g s LYS 65 CO 0.58 0.01 0.75 -1.17 -0.36 0.00 0.00 175.35 175.16 2c4g s LEU 66 N 1.18 4.19 -0.03 5.43 2.96 -1.26 -0.99 118.68 130.17 2c4g s LEU 66 Ca 0.07 0.18 -0.16 0.00 -0.22 0.00 0.00 54.13 54.00 2c4g s LEU 66 Cb -0.14 -2.96 -0.32 0.00 0.50 0.00 0.00 46.19 43.27 2c4g s LEU 66 CO 0.05 -0.75 0.83 -0.07 -1.32 0.00 0.00 176.35 175.09 2c4g h LEU 67 N 9.77 0.65 -8.10 -0.68 3.38 0.06 -3.48 115.31 116.91 2c4g h LEU 67 Ca -0.25 -0.92 0.00 0.00 0.09 0.00 0.00 57.88 56.80 2c4g h LEU 67 Cb 1.09 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 41.56 2c4g h LEU 67 CO 0.91 1.66 0.04 -0.62 0.09 0.00 0.00 178.44 180.52 2c4g s ASP 68 N -7.31 -0.18 -0.09 -0.43 -1.08 -0.97 -5.00 116.67 101.60 2c4g s ASP 68 Ca -0.13 -0.76 -0.03 0.00 -0.52 0.00 0.00 52.55 51.10 2c4g s ASP 68 Cb 0.04 0.65 0.05 0.00 -1.46 0.00 0.00 42.92 42.19 2c4g s ASP 68 CO 0.87 -1.23 0.11 -0.69 0.52 0.00 0.00 175.17 174.76 2c4g s VAL 69 N -3.97 -0.17 -0.24 1.11 1.01 -1.26 -1.05 120.40 115.84 2c4g s VAL 69 Ca 0.17 0.24 -0.05 0.00 0.00 0.00 0.00 61.98 62.34 2c4g s VAL 69 Cb -0.03 -0.33 -0.01 0.00 0.00 0.00 0.00 36.38 36.01 2c4g s VAL 69 CO 0.07 0.04 -0.01 -0.63 0.00 0.00 0.00 175.10 174.58 2c4g s ILE 70 N 2.22 3.58 -0.41 2.22 1.09 -0.17 -4.96 121.20 124.77 2c4g s ILE 70 Ca 0.04 -0.48 -0.07 0.00 -1.10 0.00 0.00 60.65 59.03 2c4g s ILE 70 Cb -0.13 -2.67 0.08 0.00 -1.06 0.00 0.00 42.46 38.68 2c4g s ILE 70 CO -0.06 0.36 0.22 -2.28 -0.10 0.00 0.00 174.94 173.08 2c4g s HIS 71 N 1.50 3.38 0.00 3.97 2.46 -1.26 0.11 115.29 125.44 2c4g s HIS 71 Ca 0.05 -1.75 0.00 0.00 0.47 0.00 0.00 55.06 53.84 2c4g s HIS 71 Cb -0.15 -2.93 0.00 0.00 -0.13 0.00 0.00 32.58 29.37 2c4g s HIS 71 CO -0.01 -0.87 0.00 0.25 -2.47 0.00 0.00 174.74 171.63 2c4g n THR 72 N 4.82 0.00 0.11 0.89 -2.24 -0.02 -5.02 114.28 112.82 2c4g n THR 72 Ca -0.09 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.68 2c4g n THR 72 Cb 0.43 -1.13 -0.03 0.00 -2.10 0.00 0.00 70.33 67.49 2c4g n THR 72 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2c4g h GLU 73 N 0.00 0.00 0.00 -0.78 5.08 -2.02 -3.38 114.58 113.48 2c4g h GLU 73 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2c4g h GLU 73 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2c4g h GLU 73 CO 0.00 0.71 0.00 0.09 -1.00 0.00 0.00 179.01 178.81 2c4g n ASN 74 N -3.29 0.02 -4.17 1.42 3.02 -1.26 -4.99 115.26 106.01 2c4g n ASN 74 Ca 0.01 -0.40 -0.13 0.00 -0.03 0.00 0.00 54.58 54.02 2c4g n ASN 74 Cb 0.82 0.76 -0.11 0.00 -0.61 0.00 0.00 39.78 40.64 2c4g n ASN 74 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2c4g s LYS 75 N -0.76 0.84 -0.09 3.52 1.02 -1.26 -1.00 119.74 122.01 2c4g s LYS 75 Ca 0.00 -1.19 -0.01 0.00 0.02 0.00 0.00 55.97 54.79 2c4g s LYS 75 Cb 0.00 -0.46 0.03 0.00 -0.52 0.00 0.00 37.83 36.88 2c4g s LYS 75 CO 0.00 0.06 -0.04 -1.17 -0.92 0.00 0.00 175.35 173.28 2c4g s LEU 76 N -2.57 0.93 -0.14 3.17 2.96 -0.57 -0.84 118.68 121.62 2c4g s LEU 76 Ca 0.07 -0.19 -0.03 0.00 -0.22 0.00 0.00 54.13 53.75 2c4g s LEU 76 Cb -0.01 -0.64 -0.03 0.00 0.50 0.00 0.00 46.19 46.01 2c4g s LEU 76 CO -0.01 -0.15 -0.03 -0.31 -1.32 0.00 0.00 176.35 174.54 2c4g s TYR 77 N 1.76 3.06 -0.22 5.38 1.51 0.12 -1.46 117.35 127.49 2c4g s TYR 77 Ca 0.04 -0.15 -0.06 0.00 -1.01 0.00 0.00 57.07 55.89 2c4g s TYR 77 Cb -0.13 -1.92 -0.03 0.00 -0.11 0.00 0.00 41.96 39.78 2c4g s TYR 77 CO -0.06 0.10 0.03 -0.51 -1.11 0.00 0.00 175.55 174.00 2c4g s LEU 78 N 0.04 3.33 -0.36 -1.29 2.01 -0.75 -1.00 118.68 120.65 2c4g s LEU 78 Ca 0.01 -0.21 -0.10 0.00 0.01 0.00 0.00 54.13 53.84 2c4g s LEU 78 Cb -0.13 -1.87 0.02 0.00 0.01 0.00 0.00 46.19 44.23 2c4g s LEU 78 CO 0.02 0.01 0.18 -0.69 1.01 0.00 0.00 176.35 176.89 2c4g s VAL 79 N 1.31 4.45 0.23 -1.59 1.01 -0.21 -0.97 120.40 124.62 2c4g s VAL 79 Ca 0.04 -0.85 0.07 0.00 0.00 0.00 0.00 61.98 61.25 2c4g s VAL 79 Cb -0.15 -3.46 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 2c4g s VAL 79 CO 0.02 -0.19 0.13 -0.36 0.00 0.00 0.00 175.10 174.70 2c4g s PHE 80 N 1.54 3.02 0.47 5.22 0.40 -0.32 0.79 117.98 129.09 2c4g s PHE 80 Ca 0.02 -0.11 -0.23 0.00 -0.60 0.00 0.00 56.93 56.00 2c4g s PHE 80 Cb -0.19 -1.38 -0.07 0.00 0.51 0.00 0.00 43.02 41.89 2c4g s PHE 80 CO 0.06 0.54 1.22 -1.83 0.70 0.00 0.00 175.22 175.91 2c4g s GLU 81 N -3.57 3.68 -0.10 0.44 -1.05 -0.16 -0.76 118.70 117.17 2c4g s GLU 81 Ca 0.32 1.93 -0.15 0.00 -0.15 0.00 0.00 54.97 56.91 2c4g s GLU 81 Cb -0.08 -2.44 -0.05 0.00 -0.44 0.00 0.00 34.13 31.12 2c4g s GLU 81 CO 0.23 -0.66 0.38 0.12 0.95 0.00 0.00 175.26 176.28 2c4g s PHE 82 N -1.45 3.56 -0.02 4.83 2.19 -1.24 -4.39 117.98 121.47 2c4g s PHE 82 Ca 0.64 0.81 0.08 0.00 0.33 0.00 0.00 56.93 58.78 2c4g s PHE 82 Cb -0.32 -2.38 -0.02 0.00 -1.31 0.00 0.00 43.02 38.99 2c4g s PHE 82 CO 0.40 0.35 -0.25 -0.51 1.83 0.00 0.00 175.22 177.04 2c4g s LEU 83 N 0.01 2.05 0.50 6.12 1.02 -1.26 -4.99 118.68 122.13 2c4g s LEU 83 Ca 0.22 -0.46 0.16 0.00 0.02 0.00 0.00 54.13 54.07 2c4g s LEU 83 Cb -0.15 -1.29 1.21 0.00 0.02 0.00 0.00 46.19 45.98 2c4g s LEU 83 CO 0.09 0.31 2.09 0.45 0.02 0.00 0.00 176.35 179.31 2c4g h HIS 84 N 5.50 0.12 -2.57 0.29 3.86 -1.93 -3.47 115.15 116.95 2c4g h HIS 84 Ca -0.42 0.00 0.06 0.00 -1.16 0.00 0.00 60.37 58.85 2c4g h HIS 84 Cb 1.12 -0.04 -0.14 0.00 1.06 0.00 0.00 27.41 29.42 2c4g h HIS 84 CO 0.39 0.07 0.38 -1.14 0.86 0.00 0.00 177.93 178.49 2c4g s GLN 85 N -5.15 1.02 0.24 2.45 0.74 -1.07 -5.05 119.66 112.85 2c4g s GLN 85 Ca -0.06 -0.38 0.04 0.00 0.05 0.00 0.00 55.36 55.01 2c4g s GLN 85 Cb 0.18 0.46 -0.03 0.00 1.10 0.00 0.00 33.01 34.72 2c4g s GLN 85 CO 0.70 -0.45 0.38 0.16 -0.55 0.00 0.00 175.29 175.53 2c4g s ASP 86 N -2.60 6.32 0.51 6.67 1.47 -1.26 -0.18 116.67 127.60 2c4g s ASP 86 Ca 0.04 0.13 0.17 0.00 1.18 0.00 0.00 52.55 54.06 2c4g s ASP 86 Cb -0.01 -1.89 1.27 0.00 -0.34 0.00 0.00 42.92 41.95 2c4g s ASP 86 CO -0.10 -0.09 2.13 0.25 0.68 0.00 0.00 175.17 178.05 2c4g h LEU 87 N 1.21 0.00 0.39 2.11 5.85 -0.19 -2.20 115.31 122.48 2c4g h LEU 87 Ca -0.51 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.19 2c4g h LEU 87 Cb 1.23 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.26 2c4g h LEU 87 CO 0.62 0.03 -0.19 0.50 -0.34 0.00 0.00 178.44 179.06 2c4g h LYS 88 N 0.00 -0.50 -0.65 1.25 3.64 -1.74 -0.42 116.57 118.15 2c4g h LYS 88 Ca -0.00 0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.43 2c4g h LYS 88 Cb 0.06 0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 2c4g h LYS 88 CO 0.00 -0.22 0.43 0.87 -2.27 0.00 0.00 179.45 178.26 2c4g h LYS 89 N -0.74 0.82 -0.44 1.90 1.57 -1.85 -2.22 116.57 115.61 2c4g h LYS 89 Ca -0.05 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.64 2c4g h LYS 89 Cb 0.51 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 2c4g h LYS 89 CO 0.09 0.55 0.11 0.35 -0.57 0.00 0.00 179.45 179.98 2c4g h PHE 90 N 0.85 0.73 -0.91 -1.35 3.57 -1.25 -2.11 116.94 116.47 2c4g h PHE 90 Ca 0.24 -0.08 0.00 0.00 3.53 0.00 0.00 57.97 61.66 2c4g h PHE 90 Cb -0.05 -0.21 -0.04 0.00 2.79 0.00 0.00 35.95 38.44 2c4g h PHE 90 CO -0.00 0.67 0.57 0.52 -2.23 0.00 0.00 178.31 177.85 2c4g h MET 91 N 0.57 1.21 -0.14 1.11 2.86 -0.53 -1.43 114.93 118.58 2c4g h MET 91 Ca 0.14 -0.09 0.01 0.00 -2.06 0.00 0.00 59.70 57.69 2c4g h MET 91 Cb 0.31 -0.26 -0.01 0.00 0.06 0.00 0.00 31.60 31.69 2c4g h MET 91 CO 0.00 0.83 0.07 -0.44 1.06 0.00 0.00 176.91 178.43 2c4g h ASP 92 N 1.24 0.11 0.09 1.22 3.32 -1.11 -2.10 116.42 119.20 2c4g h ASP 92 Ca 0.33 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.37 2c4g h ASP 92 Cb -0.10 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 39.43 2c4g h ASP 92 CO -0.07 0.09 -0.06 0.00 -1.72 0.00 0.00 179.24 177.48 2c4g h ALA 93 N 1.07 1.68 -0.53 3.45 0.00 -0.97 -1.72 119.26 122.24 2c4g h ALA 93 Ca 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2c4g h ALA 93 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2c4g h ALA 93 CO -0.03 0.08 0.00 0.43 0.00 0.00 0.00 179.25 179.72 2c4g n SER 94 N -4.15 3.00 -0.27 0.00 7.64 -0.58 -4.48 113.62 114.78 2c4g n SER 94 Ca -0.03 -2.06 0.00 0.00 1.01 0.00 0.00 58.87 57.80 2c4g n SER 94 Cb 0.14 -0.38 0.13 0.00 -1.01 0.00 0.00 64.21 63.09 2c4g n SER 94 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2c4g h ALA 95 N 3.93 1.06 0.08 -0.43 0.00 -0.78 1.47 119.26 124.60 2c4g h ALA 95 Ca 0.00 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2c4g h ALA 95 Cb 0.79 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2c4g h ALA 95 CO 0.03 0.15 -0.04 1.25 0.00 0.00 0.00 179.25 180.64 2c4g h LEU 96 N 0.82 -0.09 0.02 0.00 5.85 -1.82 -3.37 115.31 116.73 2c4g h LEU 96 Ca 0.35 -0.51 -0.25 0.00 0.84 0.00 0.00 57.88 58.30 2c4g h LEU 96 Cb 0.21 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.23 2c4g h LEU 96 CO -0.19 0.53 -1.33 0.71 -0.34 0.00 0.00 178.44 177.82 2c4g h THR 97 N -0.79 1.32 0.00 1.05 1.35 -1.85 -3.51 112.91 110.49 2c4g h THR 97 Ca -0.01 -3.07 0.00 0.00 -0.55 0.00 0.00 66.41 62.78 2c4g h THR 97 Cb 0.60 2.69 0.00 0.00 -1.73 0.00 0.00 68.15 69.70 2c4g h THR 97 CO 0.02 0.78 0.00 0.61 -0.25 0.00 0.00 175.52 176.68 2c4g n GLY 98 N 1.47 -0.58 3.67 5.82 0.00 0.50 -4.91 105.19 111.17 2c4g n GLY 98 Ca -0.09 -1.61 -0.39 0.00 0.00 0.00 0.00 46.02 43.93 2c4g n GLY 98 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2c4g s ILE 99 N -3.03 5.09 0.20 -0.61 1.01 -1.26 -4.92 121.20 117.68 2c4g s ILE 99 Ca 0.00 1.03 -0.32 0.00 0.00 0.00 0.00 60.65 61.35 2c4g s ILE 99 Cb 0.00 -3.87 -0.15 0.00 0.01 0.00 0.00 42.46 38.45 2c4g s ILE 99 CO 0.00 0.18 1.23 -2.65 0.00 0.00 0.00 174.94 173.70 2c4g n PRO 100 N 4.69 1.44 -0.32 2.79 -0.02 -1.26 -4.74 135.00 137.57 2c4g n PRO 100 Ca -0.04 0.51 0.10 0.00 -2.02 0.00 0.00 63.50 62.05 2c4g n PRO 100 Cb 0.50 -2.05 0.31 0.00 -0.02 0.00 0.00 33.50 32.24 2c4g n PRO 100 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2c4g h LEU 101 N 3.59 0.80 -1.45 2.45 3.38 -1.98 -0.20 115.31 121.89 2c4g h LEU 101 Ca -0.44 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.57 2c4g h LEU 101 Cb 1.32 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.95 2c4g h LEU 101 CO 0.72 0.40 0.18 -0.65 0.09 0.00 0.00 178.44 179.17 2c4g h PRO 102 N 0.84 0.54 0.01 1.13 0.11 -1.99 0.11 132.00 132.76 2c4g h PRO 102 Ca 0.49 -0.06 -0.22 0.00 0.11 0.00 0.00 66.00 66.32 2c4g h PRO 102 Cb 0.64 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 31.64 2c4g h PRO 102 CO -0.26 0.44 -0.94 1.25 -0.21 0.00 0.00 178.00 178.29 2c4g h LEU 103 N 0.55 0.38 -0.42 2.35 5.85 -1.45 -1.29 115.31 121.27 2c4g h LEU 103 Ca 0.14 -0.31 -0.04 0.00 0.84 0.00 0.00 57.88 58.50 2c4g h LEU 103 Cb 0.08 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 2c4g h LEU 103 CO -0.02 1.13 0.09 0.40 -0.34 0.00 0.00 178.44 179.70 2c4g h ILE 104 N 0.15 1.24 -0.45 4.05 2.04 -0.33 0.02 117.51 124.23 2c4g h ILE 104 Ca -0.07 -0.83 -0.10 0.00 1.00 0.00 0.00 64.86 64.86 2c4g h ILE 104 Cb 1.58 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 38.61 2c4g h ILE 104 CO 0.15 0.29 -0.13 0.50 0.00 0.00 0.00 178.15 178.97 2c4g h LYS 105 N 0.54 0.82 -0.43 2.37 3.64 -0.78 -0.71 116.57 122.02 2c4g h LYS 105 Ca 0.13 -0.29 -0.03 0.00 -1.27 0.00 0.00 60.65 59.19 2c4g h LYS 105 Cb 0.34 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.08 2c4g h LYS 105 CO 0.00 0.90 0.15 1.03 -2.27 0.00 0.00 179.45 179.26 2c4g h SER 106 N 0.73 0.62 -0.36 4.20 0.87 -0.94 -1.16 113.55 117.51 2c4g h SER 106 Ca 0.12 -0.20 -0.09 0.00 -1.23 0.00 0.00 61.79 60.39 2c4g h SER 106 Cb 0.63 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.41 2c4g h SER 106 CO 0.04 0.65 -0.13 1.88 -0.53 0.00 0.00 176.83 178.74 2c4g h TYR 107 N 0.56 0.83 -0.61 2.24 0.05 -0.79 -2.00 116.97 117.25 2c4g h TYR 107 Ca 0.14 -0.19 -0.07 0.00 0.05 0.00 0.00 58.73 58.66 2c4g h TYR 107 Cb 0.24 -0.20 -0.02 0.00 1.01 0.00 0.00 36.73 37.76 2c4g h TYR 107 CO 0.01 0.90 0.09 1.25 -1.05 0.00 0.00 178.16 179.36 2c4g h LEU 108 N 0.52 0.97 -0.46 3.88 5.85 -1.07 -0.70 115.31 124.30 2c4g h LEU 108 Ca 0.09 -0.26 0.03 0.00 0.84 0.00 0.00 57.88 58.57 2c4g h LEU 108 Cb 0.66 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 2c4g h LEU 108 CO 0.04 0.99 0.25 0.15 -0.34 0.00 0.00 178.44 179.54 2c4g h PHE 109 N 0.91 0.47 -0.33 1.25 3.57 -1.14 0.01 116.94 121.69 2c4g h PHE 109 Ca 0.18 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.61 2c4g h PHE 109 Cb 0.44 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.02 2c4g h PHE 109 CO 0.03 0.26 -0.13 1.96 -2.23 0.00 0.00 178.31 178.20 2c4g h GLN 110 N 0.51 0.67 -0.86 1.11 4.20 -1.12 -2.51 115.11 117.11 2c4g h GLN 110 Ca 0.19 -0.28 -0.01 0.00 0.06 0.00 0.00 58.65 58.60 2c4g h GLN 110 Cb 0.05 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 27.76 2c4g h GLN 110 CO -0.10 0.87 0.48 -0.07 -0.67 0.00 0.00 178.83 179.33 2c4g h LEU 111 N 0.44 1.06 -1.50 1.46 3.38 -0.88 -1.42 115.31 117.85 2c4g h LEU 111 Ca 0.08 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 2c4g h LEU 111 Cb 0.65 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 2c4g h LEU 111 CO 0.04 0.84 -0.25 -0.07 0.09 0.00 0.00 178.44 179.09 2c4g h LEU 112 N 1.19 0.00 -0.02 1.67 3.38 -0.87 -1.19 115.31 119.47 2c4g h LEU 112 Ca 0.30 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 58.02 2c4g h LEU 112 Cb 0.01 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.78 2c4g h LEU 112 CO -0.05 0.25 -0.97 1.56 0.09 0.00 0.00 178.44 179.32 2c4g h GLN 113 N 0.00 0.70 -0.05 1.13 4.20 -0.84 -0.60 115.11 119.65 2c4g h GLN 113 Ca -0.00 -0.72 -0.13 0.00 0.06 0.00 0.00 58.65 57.85 2c4g h GLN 113 Cb 0.45 0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.41 2c4g h GLN 113 CO 0.03 1.30 -0.57 0.78 -0.67 0.00 0.00 178.83 179.70 2c4g h GLY 114 N 0.38 0.16 1.03 3.46 0.00 -1.19 -2.02 103.07 104.89 2c4g h GLY 114 Ca -0.12 -0.19 -0.19 0.00 0.00 0.00 0.00 47.33 46.83 2c4g h GLY 114 CO 0.19 0.17 -0.65 -2.00 0.00 0.00 0.00 176.54 174.25 2c4g h LEU 115 N 0.11 0.79 -1.31 3.11 5.85 -1.23 -1.96 115.31 120.67 2c4g h LEU 115 Ca -0.00 -0.64 -0.05 0.00 0.84 0.00 0.00 57.88 58.03 2c4g h LEU 115 Cb 1.04 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.82 2c4g h LEU 115 CO 0.08 1.30 -0.05 0.00 -0.34 0.00 0.00 178.44 179.44 2c4g h ALA 116 N 0.50 1.43 -0.38 1.25 0.00 -1.03 -1.18 119.26 119.85 2c4g h ALA 116 Ca -0.05 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.53 2c4g h ALA 116 Cb 1.29 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 2c4g h ALA 116 CO 0.14 0.40 -0.29 0.35 0.00 0.00 0.00 179.25 179.84 2c4g h PHE 117 N 0.39 0.95 0.16 0.00 3.57 -1.25 -1.75 116.94 119.01 2c4g h PHE 117 Ca 0.08 -0.24 -0.01 0.00 3.53 0.00 0.00 57.97 61.33 2c4g h PHE 117 Cb 0.34 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 38.86 2c4g h PHE 117 CO 0.01 1.01 -0.08 0.00 -2.23 0.00 0.00 178.31 177.02 2c4g h HIS 119 N -0.42 0.34 0.00 0.00 3.86 -1.24 0.51 115.15 118.21 2c4g h HIS 119 Ca -0.02 -0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.16 2c4g h HIS 119 Cb 0.33 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 28.70 2c4g h HIS 119 CO -0.00 0.41 0.00 -1.13 0.86 0.00 0.00 177.93 178.06 2c4g n SER 120 N -4.29 0.00 -0.68 2.45 3.41 -0.66 -1.99 113.62 111.85 2c4g n SER 120 Ca 0.00 -0.10 0.04 0.00 -0.26 0.00 0.00 58.87 58.56 2c4g n SER 120 Cb 0.25 -0.28 0.20 0.00 -0.26 0.00 0.00 64.21 64.11 2c4g n SER 120 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2c4g n HIS 121 N -1.28 0.34 -4.08 7.33 8.25 -0.45 -4.98 115.22 120.34 2c4g n HIS 121 Ca 0.12 -1.41 -0.28 0.00 -0.26 0.00 0.00 57.72 55.89 2c4g n HIS 121 Cb 0.21 -0.30 -0.04 0.00 1.12 0.00 0.00 29.99 30.97 2c4g n HIS 121 CO 0.00 0.00 0.00 2.89 0.64 0.00 0.00 176.34 179.87 2c4g n ARG 122 N -1.14 -2.68 -4.87 -0.41 -4.01 -0.84 -4.92 116.66 97.79 2c4g n ARG 122 Ca 0.22 0.32 -0.27 0.00 -1.04 0.00 0.00 57.85 57.08 2c4g n ARG 122 Cb 0.79 -4.38 -0.17 0.00 -3.04 0.00 0.00 32.46 25.66 2c4g n ARG 122 CO 0.00 0.00 0.00 0.08 -3.04 0.00 0.00 177.63 174.67 2c4g s VAL 123 N -3.97 1.52 -0.15 8.89 1.01 0.05 -0.70 120.40 127.05 2c4g s VAL 123 Ca 0.11 -0.73 -0.04 0.00 0.00 0.00 0.00 61.98 61.32 2c4g s VAL 123 Cb -0.06 -1.33 -0.03 0.00 0.00 0.00 0.00 36.38 34.96 2c4g s VAL 123 CO 0.92 0.44 -0.01 -0.76 0.00 0.00 0.00 175.10 175.69 2c4g s LEU 124 N 0.35 3.44 -0.08 3.92 1.43 0.70 -3.47 118.68 124.98 2c4g s LEU 124 Ca -0.12 -0.03 -0.27 0.00 -1.03 0.00 0.00 54.13 52.68 2c4g s LEU 124 Cb -0.15 -1.83 -0.23 0.00 0.03 0.00 0.00 46.19 44.00 2c4g s LEU 124 CO 0.05 0.20 1.01 -0.74 0.23 0.00 0.00 176.35 177.10 2c4g h HIS 125 N 6.45 0.06 0.00 0.29 -0.00 -1.89 -0.82 115.15 119.24 2c4g h HIS 125 Ca -0.36 -0.03 0.00 0.00 -0.00 0.00 0.00 60.37 59.98 2c4g h HIS 125 Cb 1.18 -0.01 0.00 0.00 -0.00 0.00 0.00 27.41 28.59 2c4g h HIS 125 CO 0.55 0.80 0.00 0.54 -0.00 0.00 0.00 177.93 179.82 2c4g n ARG 126 N -4.67 -1.15 -2.58 5.26 1.74 -1.26 -3.26 116.66 110.74 2c4g n ARG 126 Ca -0.09 0.29 -0.01 0.00 -0.77 0.00 0.00 57.85 57.26 2c4g n ARG 126 Cb 0.40 -4.31 0.08 0.00 -1.02 0.00 0.00 32.46 27.62 2c4g n ARG 126 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2c4g n ASP 127 N -0.57 -0.07 -4.58 0.55 2.03 -1.26 -3.34 116.55 109.31 2c4g n ASP 127 Ca 0.00 -2.11 -0.42 0.00 0.52 0.00 0.00 54.79 52.78 2c4g n ASP 127 Cb 0.29 0.14 -0.03 0.00 -0.72 0.00 0.00 41.12 40.80 2c4g n ASP 127 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2c4g s LEU 128 N -3.55 3.46 0.03 -2.67 1.43 -1.26 -4.84 118.68 111.27 2c4g s LEU 128 Ca 0.17 0.61 -0.09 0.00 -1.03 0.00 0.00 54.13 53.79 2c4g s LEU 128 Cb 0.37 -3.21 0.00 0.00 0.03 0.00 0.00 46.19 43.38 2c4g s LEU 128 CO -0.09 -1.71 0.19 -1.59 0.23 0.00 0.00 176.35 173.39 2c4g s LYS 129 N 5.55 0.65 0.27 1.70 -2.85 -1.26 -4.73 119.74 119.07 2c4g s LYS 129 Ca 0.61 -0.56 0.04 0.00 -1.00 0.00 0.00 55.97 55.06 2c4g s LYS 129 Cb -0.14 0.27 0.71 0.00 -2.06 0.00 0.00 37.83 36.62 2c4g s LYS 129 CO 0.28 -0.18 1.31 -2.30 0.10 0.00 0.00 175.35 174.56 2c4g n PRO 130 N 0.86 -0.06 0.18 1.78 -0.02 -1.26 -0.68 135.00 135.80 2c4g n PRO 130 Ca -0.20 1.24 0.14 0.00 -2.02 0.00 0.00 63.50 62.66 2c4g n PRO 130 Cb 0.58 -2.01 0.48 0.00 -0.02 0.00 0.00 33.50 32.53 2c4g n PRO 130 CO 0.00 0.00 0.00 -0.56 1.98 0.00 0.00 175.50 176.92 2c4g h GLN 131 N 0.00 0.00 -0.13 -0.52 3.07 -1.93 -2.55 115.11 113.04 2c4g h GLN 131 Ca 0.54 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.28 2c4g h GLN 131 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.73 2c4g h GLN 131 CO -0.77 0.00 0.00 0.09 0.09 0.00 0.00 178.83 178.24 2c4g n ASN 132 N -2.65 1.87 -4.48 0.06 3.02 0.14 -4.76 115.26 108.47 2c4g n ASN 132 Ca 0.03 -1.69 -0.36 0.00 -0.03 0.00 0.00 54.58 52.53 2c4g n ASN 132 Cb 0.35 -0.08 -0.12 0.00 -0.61 0.00 0.00 39.78 39.31 2c4g n ASN 132 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2c4g s LEU 133 N -1.71 3.44 -0.05 3.41 1.43 -1.03 -1.42 118.68 122.74 2c4g s LEU 133 Ca 0.34 -0.16 -0.01 0.00 -1.03 0.00 0.00 54.13 53.27 2c4g s LEU 133 Cb 0.19 -1.90 -0.04 0.00 0.03 0.00 0.00 46.19 44.48 2c4g s LEU 133 CO 0.29 0.03 0.03 -0.76 0.23 0.00 0.00 176.35 176.17 2c4g s LEU 134 N 1.22 3.71 0.16 1.79 1.43 -0.34 -0.14 118.68 126.52 2c4g s LEU 134 Ca 0.04 0.15 0.09 0.00 -1.03 0.00 0.00 54.13 53.37 2c4g s LEU 134 Cb -0.14 -1.98 -0.04 0.00 0.03 0.00 0.00 46.19 44.05 2c4g s LEU 134 CO 0.03 0.34 -0.19 0.27 0.23 0.00 0.00 176.35 177.02 2c4g s ILE 135 N -1.01 1.87 0.49 -0.59 -4.36 0.75 0.44 121.20 118.81 2c4g s ILE 135 Ca 0.17 -1.89 0.02 0.00 -0.26 0.00 0.00 60.65 58.68 2c4g s ILE 135 Cb -0.12 -1.85 -0.02 0.00 1.25 0.00 0.00 42.46 41.73 2c4g s ILE 135 CO 0.07 -0.26 0.01 0.54 0.24 0.00 0.00 174.94 175.54 2c4g s ASN 136 N -2.58 3.99 0.07 4.36 2.20 -0.82 -2.59 114.94 119.56 2c4g s ASN 136 Ca 0.15 -1.64 0.19 0.00 -0.94 0.00 0.00 52.86 50.62 2c4g s ASN 136 Cb -0.06 0.46 0.79 0.00 -2.00 0.00 0.00 41.25 40.44 2c4g s ASN 136 CO 0.07 -0.84 1.60 0.35 -2.94 0.00 0.00 177.10 175.34 2c4g n THR 137 N -1.21 0.81 1.55 0.54 -2.24 -1.26 -3.00 114.28 109.47 2c4g n THR 137 Ca -0.17 0.19 0.13 0.00 -2.27 0.00 0.00 64.05 61.93 2c4g n THR 137 Cb 0.67 -0.95 0.56 0.00 -2.10 0.00 0.00 70.33 68.52 2c4g n THR 137 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2c4g n GLU 138 N -1.69 1.53 -0.59 -0.78 4.71 -1.26 -4.46 120.64 118.08 2c4g n GLU 138 Ca 0.04 -0.77 0.00 0.00 -0.01 0.00 0.00 57.16 56.42 2c4g n GLU 138 Cb 0.22 -1.45 0.00 0.00 -1.01 0.00 0.00 31.44 29.20 2c4g n GLU 138 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2c4g n GLY 139 N 1.11 0.66 3.92 0.62 0.00 -1.16 -4.67 105.19 105.67 2c4g n GLY 139 Ca 0.19 -0.36 -0.31 0.00 0.00 0.00 0.00 46.02 45.53 2c4g n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c4g s ALA 140 N -2.00 4.00 0.01 4.61 0.00 -1.26 -4.81 121.76 122.30 2c4g s ALA 140 Ca 0.00 -0.83 0.04 0.00 0.00 0.00 0.00 51.96 51.17 2c4g s ALA 140 Cb 0.00 -1.84 -0.01 0.00 0.00 0.00 0.00 23.12 21.27 2c4g s ALA 140 CO 0.00 0.81 -0.12 -1.50 0.00 0.00 0.00 175.76 174.95 2c4g s ILE 141 N -1.47 0.96 0.01 0.00 2.07 -1.26 -1.94 121.20 119.57 2c4g s ILE 141 Ca 0.33 -0.69 0.02 0.00 -1.41 0.00 0.00 60.65 58.90 2c4g s ILE 141 Cb -0.13 -0.84 -0.01 0.00 0.13 0.00 0.00 42.46 41.61 2c4g s ILE 141 CO 0.26 0.14 -0.07 -0.54 -1.91 0.00 0.00 174.94 172.83 2c4g s LYS 142 N -0.62 0.51 0.15 3.50 1.02 0.17 -4.62 119.74 119.84 2c4g s LYS 142 Ca 0.03 -0.35 -0.30 0.00 0.02 0.00 0.00 55.97 55.36 2c4g s LYS 142 Cb -0.06 -0.45 -0.08 0.00 -0.52 0.00 0.00 37.83 36.73 2c4g s LYS 142 CO 0.00 0.12 1.29 -0.51 -0.92 0.00 0.00 175.35 175.33 2c4g s LEU 143 N -0.50 4.40 0.00 3.17 1.43 -0.58 -1.20 118.68 125.40 2c4g s LEU 143 Ca -0.00 2.28 0.07 0.00 -1.03 0.00 0.00 54.13 55.44 2c4g s LEU 143 Cb -0.04 -3.60 -0.02 0.00 0.03 0.00 0.00 46.19 42.56 2c4g s LEU 143 CO -0.00 -0.52 0.24 0.00 0.23 0.00 0.00 176.35 176.30 2c4g n ALA 144 N 3.23 0.66 -2.93 4.21 0.00 -0.51 -1.13 120.51 124.03 2c4g n ALA 144 Ca 0.08 -1.88 -0.11 0.00 0.00 0.00 0.00 53.44 51.53 2c4g n ALA 144 Cb 0.44 1.46 0.01 0.00 0.00 0.00 0.00 19.45 21.36 2c4g n ALA 144 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2c4g n ASP 145 N -1.71 -7.61 -2.03 0.00 -0.08 -1.26 -4.79 116.55 99.07 2c4g n ASP 145 Ca 0.05 0.56 -0.06 0.00 -1.51 0.00 0.00 54.79 53.82 2c4g n ASP 145 Cb 0.58 -4.79 0.31 0.00 2.34 0.00 0.00 41.12 39.56 2c4g n ASP 145 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 2c4g n PHE 146 N -0.12 2.50 0.04 -0.67 3.01 -1.26 -4.62 117.46 116.34 2c4g n PHE 146 Ca 0.07 -1.21 0.16 0.00 1.01 0.00 0.00 57.45 57.49 2c4g n PHE 146 Cb 0.43 -0.70 0.65 0.00 -0.01 0.00 0.00 39.48 39.86 2c4g n PHE 146 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2c4g h GLY 147 N 2.72 0.09 -1.97 1.37 0.00 -1.91 -1.44 103.07 101.92 2c4g h GLY 147 Ca 0.27 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.57 2c4g h GLY 147 CO 0.75 0.01 0.00 1.04 0.00 0.00 0.00 176.54 178.35 2c4g n LEU 148 N -4.43 3.58 -4.77 3.11 4.77 -1.26 -4.51 117.00 113.49 2c4g n LEU 148 Ca 0.07 -2.15 -0.36 0.00 -0.03 0.00 0.00 56.01 53.54 2c4g n LEU 148 Cb 0.47 -0.38 -0.01 0.00 -2.33 0.00 0.00 43.42 41.17 2c4g n LEU 148 CO 0.36 0.81 0.81 0.00 -1.33 0.00 0.00 177.39 178.04 2c4g s ALA 149 N -1.28 2.88 0.01 -1.18 0.00 -0.54 -4.64 121.76 117.00 2c4g s ALA 149 Ca 0.36 0.88 0.02 0.00 0.00 0.00 0.00 51.96 53.23 2c4g s ALA 149 Cb 0.21 -3.37 -0.01 0.00 0.00 0.00 0.00 23.12 19.95 2c4g s ALA 149 CO 0.22 -0.68 -0.08 1.03 0.00 0.00 0.00 175.76 176.25 2c4g s ARG 150 N -2.91 0.60 -0.00 0.00 1.81 -0.31 -4.87 118.95 113.26 2c4g s ARG 150 Ca 0.67 -0.37 -0.21 0.00 -1.72 0.00 0.00 55.73 54.09 2c4g s ARG 150 Cb -0.26 -0.55 -0.05 0.00 -0.45 0.00 0.00 34.95 33.63 2c4g s ARG 150 CO 0.31 0.14 0.61 0.00 -0.68 0.00 0.00 175.30 175.69 2c4g s ALA 151 N -0.41 3.47 -0.50 2.13 0.00 -1.26 -0.22 121.76 124.98 2c4g s ALA 151 Ca 0.01 0.05 0.04 0.00 0.00 0.00 0.00 51.96 52.05 2c4g s ALA 151 Cb -0.04 -2.77 0.42 0.00 0.00 0.00 0.00 23.12 20.73 2c4g s ALA 151 CO -0.00 0.15 1.36 1.97 0.00 0.00 0.00 175.76 179.23 2c4g n PHE 152 N 2.78 3.18 0.26 0.00 -1.74 0.12 -4.57 117.46 117.49 2c4g n PHE 152 Ca -0.06 -2.78 0.13 0.00 -0.56 0.00 0.00 57.45 54.18 2c4g n PHE 152 Cb 0.51 -0.43 0.68 0.00 1.52 0.00 0.00 39.48 41.76 2c4g n PHE 152 CO 0.00 0.00 0.00 0.78 -0.56 0.00 0.00 176.76 176.98 2c4g h GLY 153 N 2.53 0.00 -5.39 4.97 0.00 -1.94 -3.39 103.07 99.84 2c4g h GLY 153 Ca 0.38 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 47.21 2c4g h GLY 153 CO 0.99 0.00 -0.82 0.14 0.00 0.00 0.00 176.54 176.85 2c4g s VAL 154 N -4.00 1.16 0.10 4.60 1.01 -1.26 -5.11 120.40 116.90 2c4g s VAL 154 Ca -0.02 -0.56 -0.35 0.00 0.00 0.00 0.00 61.98 61.05 2c4g s VAL 154 Cb 0.12 -1.00 -0.18 0.00 0.00 0.00 0.00 36.38 35.32 2c4g s VAL 154 CO 0.59 0.34 1.04 -2.65 0.00 0.00 0.00 175.10 174.42 2c4g n PRO 155 N 3.21 0.51 -3.28 2.72 -0.02 -1.26 -4.94 135.00 131.94 2c4g n PRO 155 Ca -0.18 0.18 -0.40 0.00 -2.02 0.00 0.00 63.50 61.08 2c4g n PRO 155 Cb 0.53 -1.61 -0.08 0.00 -0.02 0.00 0.00 33.50 32.32 2c4g n PRO 155 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2c4g s VAL 156 N -0.17 5.08 0.48 -1.45 1.01 -1.26 -5.03 120.40 119.06 2c4g s VAL 156 Ca 0.80 0.65 -0.20 0.00 0.00 0.00 0.00 61.98 63.23 2c4g s VAL 156 Cb -1.04 -3.83 -0.09 0.00 0.00 0.00 0.00 36.38 31.43 2c4g s VAL 156 CO 0.54 0.03 1.03 -0.60 0.00 0.00 0.00 175.10 176.10 2c4g s ARG 157 N 2.27 3.85 -0.00 2.72 3.52 -1.26 -1.14 118.95 128.90 2c4g s ARG 157 Ca 0.19 1.35 -0.30 0.00 -0.13 0.00 0.00 55.73 56.84 2c4g s ARG 157 Cb -0.16 -2.12 -0.06 0.00 -1.56 0.00 0.00 34.95 31.06 2c4g s ARG 157 CO 0.10 -0.39 1.44 0.99 -0.81 0.00 0.00 175.30 176.64 2c4g s THR 158 N -1.98 3.65 -0.07 4.11 2.01 -0.41 -4.76 115.64 118.18 2c4g s THR 158 Ca 0.66 1.01 0.04 0.00 0.31 0.00 0.00 61.69 63.72 2c4g s THR 158 Cb -0.16 -3.65 0.00 0.00 0.01 0.00 0.00 72.50 68.70 2c4g s THR 158 CO 0.20 -0.01 -0.20 -0.47 -0.69 0.00 0.00 174.62 173.44 2c4g s TYR 159 N 2.62 2.08 0.27 4.92 5.04 -1.26 -5.02 117.35 125.99 2c4g s TYR 159 Ca 0.65 -0.74 -0.01 0.00 -2.44 0.00 0.00 57.07 54.54 2c4g s TYR 159 Cb -0.32 -1.41 0.36 0.00 0.35 0.00 0.00 41.96 40.94 2c4g s TYR 159 CO 0.27 -0.29 1.74 1.15 -1.34 0.00 0.00 175.55 177.08 2c4g h THR 160 N 5.53 1.25 -0.23 4.34 2.02 -2.02 -3.20 112.91 120.59 2c4g h THR 160 Ca -0.27 -1.11 0.00 0.00 0.77 0.00 0.00 66.41 65.80 2c4g h THR 160 Cb 1.20 1.07 0.00 0.00 -1.74 0.00 0.00 68.15 68.68 2c4g h THR 160 CO 0.47 0.37 0.00 1.41 0.37 0.00 0.00 175.52 178.15 2c4g n HIS 161 N -4.18 0.29 -3.32 3.16 8.25 -1.26 -4.48 115.22 113.68 2c4g n HIS 161 Ca 0.01 -0.14 -0.25 0.00 -0.26 0.00 0.00 57.72 57.07 2c4g n HIS 161 Cb 0.34 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.38 2c4g n HIS 161 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2c4g n GLU 162 N 0.84 1.34 -4.19 -0.41 1.02 -1.21 -5.09 120.64 112.94 2c4g n GLU 162 Ca 0.17 -3.78 -0.11 0.00 -0.02 0.00 0.00 57.16 53.42 2c4g n GLU 162 Cb 0.46 -1.66 -0.10 0.00 -0.02 0.00 0.00 31.44 30.11 2c4g n GLU 162 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2c4g s VAL 163 N -1.53 0.75 0.63 2.62 -7.23 -1.26 -4.72 120.40 109.65 2c4g s VAL 163 Ca 0.36 -1.96 -0.19 0.00 -1.81 0.00 0.00 61.98 58.39 2c4g s VAL 163 Cb 0.14 -1.76 -0.02 0.00 0.56 0.00 0.00 36.38 35.30 2c4g s VAL 163 CO -0.09 -0.81 1.27 0.52 -0.31 0.00 0.00 175.10 175.68 2c4g n VAL 164 N -0.09 4.65 -1.75 1.32 0.31 -1.21 -4.88 118.33 116.68 2c4g n VAL 164 Ca -0.11 -0.50 -0.41 0.00 -0.01 0.00 0.00 64.34 63.31 2c4g n VAL 164 Cb 0.61 -1.48 0.00 0.00 -0.91 0.00 0.00 33.84 32.06 2c4g n VAL 164 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 2c4g n THR 165 N -1.75 2.13 -0.21 2.52 5.66 -1.26 -4.65 114.28 116.72 2c4g n THR 165 Ca 0.15 -0.50 -0.02 0.00 -3.05 0.00 0.00 64.05 60.63 2c4g n THR 165 Cb 0.47 -1.84 0.00 0.00 -1.55 0.00 0.00 70.33 67.41 2c4g n THR 165 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 2c4g n LEU 166 N 0.43 -0.42 0.21 1.09 7.94 -1.26 -1.42 117.00 123.57 2c4g n LEU 166 Ca 0.03 0.95 0.18 0.00 -1.11 0.00 0.00 56.01 56.06 2c4g n LEU 166 Cb 0.39 -0.19 0.82 0.00 0.53 0.00 0.00 43.42 44.96 2c4g n LEU 166 CO 0.63 -0.83 1.16 -0.50 -1.11 0.00 0.00 177.39 176.73 2c4g h TRP 167 N 0.00 0.00 -0.14 1.96 4.06 -1.88 -1.37 115.95 118.58 2c4g h TRP 167 Ca 0.16 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.11 2c4g h TRP 167 Cb 0.29 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.45 2c4g h TRP 167 CO -0.50 0.00 0.00 0.66 -3.56 0.00 0.00 178.44 175.04 2c4g n TYR 168 N -3.44 0.18 -2.34 0.49 4.01 -0.51 -4.56 117.16 110.99 2c4g n TYR 168 Ca 0.02 -0.21 -0.42 0.00 -0.16 0.00 0.00 57.90 57.13 2c4g n TYR 168 Cb 0.44 -0.01 -0.03 0.00 -0.31 0.00 0.00 39.34 39.43 2c4g n TYR 168 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 2c4g s ARG 169 N -0.91 4.40 0.52 -0.72 3.52 -0.52 -4.12 118.95 121.12 2c4g s ARG 169 Ca 0.16 1.88 -0.21 0.00 -0.13 0.00 0.00 55.73 57.43 2c4g s ARG 169 Cb 0.09 -3.30 -0.06 0.00 -1.56 0.00 0.00 34.95 30.12 2c4g s ARG 169 CO 0.13 -0.30 1.16 0.00 -0.81 0.00 0.00 175.30 175.48 2c4g s ALA 170 N 0.97 2.79 0.43 6.12 0.00 -1.26 -4.90 121.76 125.91 2c4g s ALA 170 Ca 0.60 0.90 0.12 0.00 0.00 0.00 0.00 51.96 53.58 2c4g s ALA 170 Cb -0.32 -3.38 0.99 0.00 0.00 0.00 0.00 23.12 20.40 2c4g s ALA 170 CO 0.30 -0.78 2.01 -1.00 0.00 0.00 0.00 175.76 176.29 2c4g h PRO 171 N 1.51 0.42 -0.96 0.00 0.13 -1.94 -2.02 132.00 129.14 2c4g h PRO 171 Ca -0.50 -0.03 0.02 0.00 -0.87 0.00 0.00 66.00 64.62 2c4g h PRO 171 Cb 1.26 -0.10 -0.05 0.00 0.13 0.00 0.00 31.00 32.25 2c4g h PRO 171 CO 0.58 0.28 0.64 0.93 -0.23 0.00 0.00 178.00 180.20 2c4g h GLU 172 N 0.44 1.24 -0.46 0.86 3.07 -1.92 0.26 114.58 118.07 2c4g h GLU 172 Ca 0.22 -0.07 -0.14 0.00 -0.50 0.00 0.00 59.36 58.87 2c4g h GLU 172 Cb 0.32 -0.28 -0.01 0.00 -0.84 0.00 0.00 28.75 27.94 2c4g h GLU 172 CO -0.06 0.82 -0.26 0.82 -1.40 0.00 0.00 179.01 178.94 2c4g h ILE 173 N 1.28 1.27 -0.51 3.13 2.04 -1.74 -0.98 117.51 122.00 2c4g h ILE 173 Ca 0.36 -1.43 -0.11 0.00 1.00 0.00 0.00 64.86 64.68 2c4g h ILE 173 Cb -0.11 1.18 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 2c4g h ILE 173 CO -0.09 0.49 -0.13 -0.07 0.00 0.00 0.00 178.15 178.35 2c4g h LEU 174 N 0.84 0.98 0.00 1.44 3.38 -0.95 -2.51 115.31 118.49 2c4g h LEU 174 Ca 0.10 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.74 2c4g h LEU 174 Cb 0.84 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.33 2c4g h LEU 174 CO 0.07 1.10 0.00 0.18 0.09 0.00 0.00 178.44 179.89 2c4g n LEU 175 N -4.14 0.00 -1.98 1.67 4.77 0.84 -4.80 117.00 113.36 2c4g n LEU 175 Ca 0.01 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.93 2c4g n LEU 175 Cb 0.41 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.53 2c4g n LEU 175 CO 0.45 0.00 0.03 0.61 -1.33 0.00 0.00 177.39 177.16 2c4g n GLY 176 N 0.52 0.13 3.83 -0.72 0.00 -0.94 -1.56 105.19 106.45 2c4g n GLY 176 Ca 0.07 -0.18 -0.31 0.00 0.00 0.00 0.00 46.02 45.60 2c4g n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c4g h LYS 178 N -0.41 0.03 -5.03 0.00 3.64 -1.97 -3.43 116.57 109.40 2c4g h LYS 178 Ca -0.44 -0.04 -0.32 0.00 -1.27 0.00 0.00 60.65 58.57 2c4g h LYS 178 Cb 1.21 0.01 -0.16 0.00 -0.41 0.00 0.00 32.23 32.88 2c4g h LYS 178 CO 0.58 0.99 -0.72 0.71 -2.27 0.00 0.00 179.45 178.74 2c4g s TYR 179 N -2.78 1.19 0.55 1.91 2.02 -1.26 -1.29 117.35 117.68 2c4g s TYR 179 Ca 0.00 -0.72 -0.03 0.00 -0.37 0.00 0.00 57.07 55.95 2c4g s TYR 179 Cb 0.10 -0.62 0.01 0.00 -0.40 0.00 0.00 41.96 41.05 2c4g s TYR 179 CO 0.82 0.05 0.82 0.71 -1.57 0.00 0.00 175.55 176.38 2c4g s TYR 180 N -2.99 3.15 0.24 2.71 1.51 -0.29 -4.84 117.35 116.85 2c4g s TYR 180 Ca 0.12 0.39 -0.13 0.00 -1.01 0.00 0.00 57.07 56.44 2c4g s TYR 180 Cb 0.01 -2.65 -0.00 0.00 -0.11 0.00 0.00 41.96 39.20 2c4g s TYR 180 CO 0.00 -0.74 0.48 -1.54 -1.11 0.00 0.00 175.55 172.63 2c4g s SER 181 N -4.32 -0.09 0.62 2.29 1.04 -1.26 -4.62 113.70 107.35 2c4g s SER 181 Ca 0.53 -0.91 0.33 0.00 0.48 0.00 0.00 55.95 56.38 2c4g s SER 181 Cb -0.10 0.58 1.90 0.00 0.10 0.00 0.00 66.02 68.50 2c4g s SER 181 CO 0.42 -1.13 2.20 0.71 0.98 0.00 0.00 173.24 176.42 2c4g h THR 182 N 2.26 0.33 -0.00 2.02 1.35 -1.97 -2.46 112.91 114.44 2c4g h THR 182 Ca -0.26 0.00 -0.03 0.00 -0.55 0.00 0.00 66.41 65.57 2c4g h THR 182 Cb 1.25 0.91 -0.00 0.00 -1.73 0.00 0.00 68.15 68.58 2c4g h THR 182 CO 0.36 0.00 -0.13 0.00 -0.25 0.00 0.00 175.52 175.50 2c4g h ALA 183 N 1.86 1.78 -0.35 6.62 0.00 -1.93 -2.02 119.26 125.22 2c4g h ALA 183 Ca 0.03 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2c4g h ALA 183 Cb 0.23 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2c4g h ALA 183 CO -0.00 0.17 0.22 -0.39 0.00 0.00 0.00 179.25 179.24 2c4g h VAL 184 N 0.00 1.10 -0.17 0.00 -1.51 -1.84 -1.73 116.25 112.10 2c4g h VAL 184 Ca -0.00 -0.20 -0.17 0.00 -1.23 0.00 0.00 66.70 65.10 2c4g h VAL 184 Cb 0.23 0.59 0.01 0.00 -2.13 0.00 0.00 31.29 29.99 2c4g h VAL 184 CO 0.02 0.10 -0.54 0.44 -1.23 0.00 0.00 177.57 176.35 2c4g h ASP 185 N 0.48 0.77 -0.71 4.19 3.32 -1.56 -2.88 116.42 120.03 2c4g h ASP 185 Ca 0.13 -0.60 -0.01 0.00 0.02 0.00 0.00 57.03 56.57 2c4g h ASP 185 Cb -0.03 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.26 2c4g h ASP 185 CO -0.03 1.24 0.41 0.40 -1.72 0.00 0.00 179.24 179.54 2c4g h ILE 186 N 0.36 1.21 -0.76 0.35 1.08 -1.37 -1.94 117.51 116.43 2c4g h ILE 186 Ca -0.02 -0.50 -0.02 0.00 -0.39 0.00 0.00 64.86 63.93 2c4g h ILE 186 Cb 1.17 0.21 -0.04 0.00 -3.07 0.00 0.00 36.82 35.10 2c4g h ILE 186 CO 0.12 0.23 0.40 -0.25 -0.69 0.00 0.00 178.15 177.95 2c4g h TRP 187 N 1.00 1.07 -0.48 1.37 2.91 -1.30 0.33 115.95 120.85 2c4g h TRP 187 Ca 0.26 -0.04 -0.03 0.00 1.13 0.00 0.00 58.89 60.22 2c4g h TRP 187 Cb -0.00 -0.34 -0.02 0.00 -0.51 0.00 0.00 29.16 28.29 2c4g h TRP 187 CO 0.01 0.76 0.20 0.77 -1.03 0.00 0.00 178.44 179.14 2c4g h SER 188 N 1.06 0.65 -0.55 2.65 0.02 -1.17 -1.93 113.55 114.28 2c4g h SER 188 Ca 0.27 -0.16 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 2c4g h SER 188 Cb 0.06 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.41 2c4g h SER 188 CO -0.04 0.63 0.34 -0.07 -1.14 0.00 0.00 176.83 176.56 2c4g h LEU 189 N 0.63 0.65 -0.85 5.07 4.07 -0.96 -1.67 115.31 122.24 2c4g h LEU 189 Ca 0.16 -0.04 0.08 0.00 0.08 0.00 0.00 57.88 58.15 2c4g h LEU 189 Cb 0.18 -0.16 -0.07 0.00 1.08 0.00 0.00 40.66 41.69 2c4g h LEU 189 CO -0.01 0.50 0.52 1.23 -1.08 0.00 0.00 178.44 179.59 2c4g h GLY 190 N 0.74 1.31 1.48 0.83 0.00 -0.62 0.45 103.07 107.25 2c4g h GLY 190 Ca 0.20 -0.36 -0.10 0.00 0.00 0.00 0.00 47.33 47.07 2c4g h GLY 190 CO -0.04 0.21 -0.22 0.00 0.00 0.00 0.00 176.54 176.50 2c4g h ILE 192 N 0.53 1.40 0.45 0.00 2.04 -0.38 -1.02 117.51 120.53 2c4g h ILE 192 Ca 0.08 -2.16 -0.02 0.00 1.00 0.00 0.00 64.86 63.76 2c4g h ILE 192 Cb 0.66 2.12 0.00 0.00 -0.74 0.00 0.00 36.82 38.87 2c4g h ILE 192 CO 0.05 0.64 -0.21 0.15 0.00 0.00 0.00 178.15 178.78 2c4g h PHE 193 N 0.22 -0.56 -0.82 1.37 3.57 0.17 -1.19 116.94 119.71 2c4g h PHE 193 Ca -0.02 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.44 2c4g h PHE 193 Cb 1.27 0.18 -0.04 0.00 2.79 0.00 0.00 35.95 40.15 2c4g h PHE 193 CO 0.03 -0.34 0.42 0.00 -2.23 0.00 0.00 178.31 176.19 2c4g h ALA 194 N -0.05 1.20 -0.37 2.41 0.00 -1.37 -2.32 119.26 118.75 2c4g h ALA 194 Ca -0.06 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 2c4g h ALA 194 Cb 0.47 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2c4g h ALA 194 CO 0.10 0.63 0.12 1.49 0.00 0.00 0.00 179.25 181.59 2c4g h GLU 195 N 1.15 0.53 -0.22 0.00 4.81 -0.93 -1.11 114.58 118.82 2c4g h GLU 195 Ca 0.28 -0.07 -0.19 0.00 -0.13 0.00 0.00 59.36 59.25 2c4g h GLU 195 Cb 0.07 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.36 2c4g h GLU 195 CO -0.04 0.46 -0.59 0.52 -0.73 0.00 0.00 179.01 178.63 2c4g h MET 196 N 0.52 0.79 -0.60 1.92 2.86 -0.71 -0.95 114.93 118.76 2c4g h MET 196 Ca 0.13 -0.55 -0.09 0.00 -2.06 0.00 0.00 59.70 57.12 2c4g h MET 196 Cb 0.16 0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.88 2c4g h MET 196 CO -0.01 1.18 0.02 0.28 1.06 0.00 0.00 176.91 179.44 2c4g h VAL 197 N 0.53 1.26 0.00 -2.22 2.07 -1.00 -3.30 116.25 113.59 2c4g h VAL 197 Ca -0.01 -1.11 0.00 0.00 0.82 0.00 0.00 66.70 66.39 2c4g h VAL 197 Cb 1.21 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 2c4g h VAL 197 CO 0.13 0.41 -1.09 0.35 0.02 0.00 0.00 177.57 177.38 2c4g n THR 198 N -4.19 0.00 -1.01 2.57 -2.24 -0.46 -4.82 114.28 104.13 2c4g n THR 198 Ca 0.03 -0.08 -0.00 0.00 -2.27 0.00 0.00 64.05 61.73 2c4g n THR 198 Cb 0.33 0.87 -0.00 0.00 -2.10 0.00 0.00 70.33 69.43 2c4g n THR 198 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2c4g n ARG 199 N -1.58 -0.64 -3.83 -0.78 1.74 -0.37 -5.00 116.66 106.22 2c4g n ARG 199 Ca 0.03 0.20 -0.12 0.00 -0.77 0.00 0.00 57.85 57.19 2c4g n ARG 199 Cb 0.35 -3.71 -0.11 0.00 -1.02 0.00 0.00 32.46 27.96 2c4g n ARG 199 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 2c4g s ARG 200 N -0.78 0.31 0.27 5.56 1.70 -1.18 -5.03 118.95 119.80 2c4g s ARG 200 Ca 0.00 0.05 -0.30 0.00 -0.47 0.00 0.00 55.73 55.01 2c4g s ARG 200 Cb 0.00 0.14 -0.13 0.00 -0.57 0.00 0.00 34.95 34.39 2c4g s ARG 200 CO 0.00 -0.06 1.31 0.00 -1.08 0.00 0.00 175.30 175.48 2c4g n ALA 201 N 2.49 0.89 0.03 7.88 0.00 -1.26 -4.25 120.51 126.29 2c4g n ALA 201 Ca -0.16 0.40 -0.13 0.00 0.00 0.00 0.00 53.44 53.55 2c4g n ALA 201 Cb 0.58 -2.22 -0.09 0.00 0.00 0.00 0.00 19.45 17.71 2c4g n ALA 201 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2c4g h LEU 202 N 3.45 -0.06 -6.64 0.00 6.46 -1.91 -3.40 115.31 113.21 2c4g h LEU 202 Ca -0.45 -0.32 -0.60 0.00 -0.12 0.00 0.00 57.88 56.39 2c4g h LEU 202 Cb 1.29 0.02 -0.40 0.00 -0.73 0.00 0.00 40.66 40.84 2c4g h LEU 202 CO 0.70 0.30 -0.81 0.49 -0.62 0.00 0.00 178.44 178.50 2c4g n PHE 203 N -4.95 0.85 -1.74 1.25 3.72 -1.26 -4.99 117.46 110.33 2c4g n PHE 203 Ca -0.08 -3.73 -0.42 0.00 -0.05 0.00 0.00 57.45 53.17 2c4g n PHE 203 Cb 0.20 -0.12 -0.00 0.00 -0.94 0.00 0.00 39.48 38.62 2c4g n PHE 203 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 2c4g n PRO 204 N 2.41 2.93 -1.79 -1.08 -0.04 -1.26 -4.43 135.00 131.73 2c4g n PRO 204 Ca 0.26 -2.62 -0.34 0.00 -0.04 0.00 0.00 63.50 60.76 2c4g n PRO 204 Cb 0.43 -3.25 0.05 0.00 -0.04 0.00 0.00 33.50 30.69 2c4g n PRO 204 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2c4g s GLY 205 N 3.04 2.30 -0.04 0.55 0.00 -1.26 -4.97 107.32 106.94 2c4g s GLY 205 Ca 0.48 0.68 0.18 0.00 0.00 0.00 0.00 44.72 46.05 2c4g s GLY 205 CO -0.08 1.04 0.35 1.22 0.00 0.00 0.00 173.10 175.63 2c4g n ASP 206 N -2.25 0.90 -4.02 1.64 8.00 -1.26 -4.82 116.55 114.74 2c4g n ASP 206 Ca 0.11 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.52 2c4g n ASP 206 Cb 0.51 1.71 -0.06 0.00 -0.02 0.00 0.00 41.12 43.27 2c4g n ASP 206 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2c4g s SER 207 N -4.18 -0.06 0.25 -2.24 1.04 -1.26 -5.00 113.70 102.25 2c4g s SER 207 Ca -0.07 -0.97 -0.04 0.00 0.48 0.00 0.00 55.95 55.35 2c4g s SER 207 Cb 0.11 0.56 0.34 0.00 0.10 0.00 0.00 66.02 67.12 2c4g s SER 207 CO 0.74 -1.09 1.89 -0.33 0.98 0.00 0.00 173.24 175.43 2c4g h GLU 208 N 2.31 1.16 -0.04 4.02 5.08 -1.99 0.17 114.58 125.29 2c4g h GLU 208 Ca -0.27 -0.07 -0.24 0.00 -1.00 0.00 0.00 59.36 57.78 2c4g h GLU 208 Cb 1.25 -0.26 0.02 0.00 0.50 0.00 0.00 28.75 30.26 2c4g h GLU 208 CO 0.38 0.76 -0.91 0.97 -1.00 0.00 0.00 179.01 179.22 2c4g h ILE 209 N 1.19 1.30 -0.42 3.13 6.09 -1.97 -1.99 117.51 124.84 2c4g h ILE 209 Ca 0.40 -2.14 -0.03 0.00 -1.37 0.00 0.00 64.86 61.71 2c4g h ILE 209 Cb 0.05 2.31 -0.02 0.00 0.47 0.00 0.00 36.82 39.64 2c4g h ILE 209 CO -0.14 0.66 0.12 -0.78 -3.07 0.00 0.00 178.15 174.94 2c4g h ASP 210 N 0.35 0.56 0.26 2.19 3.58 -1.85 -0.40 116.42 121.11 2c4g h ASP 210 Ca -0.10 -0.08 -0.01 0.00 0.42 0.00 0.00 57.03 57.26 2c4g h ASP 210 Cb 1.56 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 42.47 2c4g h ASP 210 CO 0.18 0.55 -0.13 -0.61 -2.88 0.00 0.00 179.24 176.35 2c4g h GLN 211 N 0.60 -0.34 -0.39 0.28 5.75 -0.59 -1.21 115.11 119.21 2c4g h GLN 211 Ca 0.14 0.02 0.07 0.00 -0.15 0.00 0.00 58.65 58.74 2c4g h GLN 211 Cb 0.21 0.08 -0.07 0.00 1.07 0.00 0.00 27.48 28.77 2c4g h GLN 211 CO -0.01 -0.15 -0.04 -0.07 -2.65 0.00 0.00 178.83 175.91 2c4g h LEU 212 N -0.46 -0.24 -0.51 -2.39 3.38 -0.91 -2.55 115.31 111.62 2c4g h LEU 212 Ca -0.04 0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2c4g h LEU 212 Cb 0.35 0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 2c4g h LEU 212 CO 0.06 -0.08 0.29 -0.26 0.09 0.00 0.00 178.44 178.54 2c4g h PHE 213 N 0.06 0.69 -0.50 1.13 -1.00 -0.96 0.14 116.94 116.50 2c4g h PHE 213 Ca 0.19 -0.01 0.05 0.00 2.81 0.00 0.00 57.97 61.01 2c4g h PHE 213 Cb 0.28 -0.22 -0.03 0.00 3.61 0.00 0.00 35.95 39.59 2c4g h PHE 213 CO -0.30 0.50 0.33 0.00 -1.61 0.00 0.00 178.31 177.24 2c4g h ARG 214 N 0.68 0.46 -0.07 1.51 3.08 -0.92 0.42 114.38 119.54 2c4g h ARG 214 Ca 0.18 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 60.15 2c4g h ARG 214 Cb 0.03 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 29.97 2c4g h ARG 214 CO -0.03 0.30 -0.15 0.82 -1.07 0.00 0.00 179.97 179.84 2c4g h ILE 215 N 0.47 1.41 -0.87 2.04 2.04 -0.98 -2.73 117.51 118.89 2c4g h ILE 215 Ca 0.21 -1.45 0.01 0.00 1.00 0.00 0.00 64.86 64.63 2c4g h ILE 215 Cb 0.25 2.19 -0.04 0.00 -0.74 0.00 0.00 36.82 38.47 2c4g h ILE 215 CO -0.06 0.41 0.57 -0.26 0.00 0.00 0.00 178.15 178.81 2c4g h PHE 216 N -0.25 1.10 0.00 1.37 0.04 -0.16 0.17 116.94 119.21 2c4g h PHE 216 Ca 0.00 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.79 2c4g h PHE 216 Cb 0.73 -0.37 -0.00 0.00 2.20 0.00 0.00 35.95 38.51 2c4g h PHE 216 CO 0.11 0.70 -0.03 -0.09 -0.60 0.00 0.00 178.31 178.41 2c4g h ARG 217 N 1.18 0.00 0.00 1.51 2.43 -0.16 0.80 114.38 120.14 2c4g h ARG 217 Ca 0.32 0.00 -0.38 0.00 -0.81 0.00 0.00 59.98 59.10 2c4g h ARG 217 Cb -0.12 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.36 2c4g h ARG 217 CO -0.07 0.03 -2.38 2.41 -1.51 0.00 0.00 179.97 178.45 2c4g n THR 218 N -4.09 1.38 0.70 0.20 -1.04 -0.73 -4.55 114.28 106.14 2c4g n THR 218 Ca -0.03 -0.46 0.11 0.00 -2.04 0.00 0.00 64.05 61.63 2c4g n THR 218 Cb 0.11 -1.52 0.03 0.00 -1.82 0.00 0.00 70.33 67.13 2c4g n THR 218 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2c4g n LEU 219 N -3.53 0.64 0.00 -4.42 4.77 0.52 -1.24 117.00 113.74 2c4g n LEU 219 Ca -0.45 -0.10 0.00 0.00 -0.03 0.00 0.00 56.01 55.43 2c4g n LEU 219 Cb 0.92 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.90 2c4g n LEU 219 CO 0.16 0.09 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 2c4g n GLY 220 N 1.41 1.89 3.66 -0.72 0.00 0.28 -4.27 105.19 107.43 2c4g n GLY 220 Ca 0.03 -1.76 -0.43 0.00 0.00 0.00 0.00 46.02 43.86 2c4g n GLY 220 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2c4g s THR 221 N -2.38 4.40 0.46 2.61 2.01 -1.04 -4.46 115.64 117.24 2c4g s THR 221 Ca 0.00 1.68 -0.24 0.00 0.31 0.00 0.00 61.69 63.44 2c4g s THR 221 Cb 0.00 -4.12 -0.07 0.00 0.01 0.00 0.00 72.50 68.31 2c4g s THR 221 CO 0.00 -0.19 1.31 -2.16 -0.69 0.00 0.00 174.62 172.88 2c4g s PRO 222 N 3.47 3.69 0.22 4.92 0.04 -1.26 -4.81 135.00 141.28 2c4g s PRO 222 Ca 0.51 2.14 0.04 0.00 0.04 0.00 0.00 61.00 63.73 2c4g s PRO 222 Cb -0.19 -2.55 -0.05 0.00 0.04 0.00 0.00 34.50 31.75 2c4g s PRO 222 CO 0.13 -0.72 -0.01 0.16 0.04 0.00 0.00 177.00 176.60 2c4g s ASP 223 N -0.88 1.82 0.57 6.66 1.47 -1.26 -4.92 116.67 120.12 2c4g s ASP 223 Ca 0.62 -1.21 0.34 0.00 1.18 0.00 0.00 52.55 53.49 2c4g s ASP 223 Cb -0.38 0.01 1.44 0.00 -0.34 0.00 0.00 42.92 43.66 2c4g s ASP 223 CO 0.47 -0.50 1.72 -0.33 0.68 0.00 0.00 175.17 177.20 2c4g h GLU 224 N 2.49 0.00 -0.07 2.11 4.39 -1.98 0.24 114.58 121.77 2c4g h GLU 224 Ca -0.38 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.15 2c4g h GLU 224 Cb 1.22 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.88 2c4g h GLU 224 CO 0.64 0.00 -0.63 0.28 -1.16 0.00 0.00 179.01 178.15 2c4g h VAL 225 N 0.00 1.36 -0.02 3.13 2.07 -1.99 -2.60 116.25 118.21 2c4g h VAL 225 Ca 0.50 -1.96 -0.21 0.00 0.82 0.00 0.00 66.70 65.85 2c4g h VAL 225 Cb 2.26 2.29 -0.00 0.00 -1.52 0.00 0.00 31.29 34.32 2c4g h VAL 225 CO -0.01 0.59 -0.88 0.58 0.02 0.00 0.00 177.57 177.88 2c4g h VAL 226 N 0.15 1.42 -2.25 2.57 2.07 -1.45 -3.40 116.25 115.36 2c4g h VAL 226 Ca -0.06 -2.41 -0.54 0.00 0.82 0.00 0.00 66.70 64.51 2c4g h VAL 226 Cb 1.29 2.36 -0.36 0.00 -1.52 0.00 0.00 31.29 33.06 2c4g h VAL 226 CO 0.13 0.72 -0.91 0.86 0.02 0.00 0.00 177.57 178.39 2c4g s TRP 227 N -3.33 0.73 -0.42 1.57 -0.11 -0.12 -4.44 118.94 112.82 2c4g s TRP 227 Ca -0.05 -2.02 -0.41 0.00 1.22 0.00 0.00 56.10 54.84 2c4g s TRP 227 Cb 0.09 -0.78 -0.17 0.00 -1.50 0.00 0.00 33.47 31.12 2c4g s TRP 227 CO 0.85 -0.88 2.00 -2.30 -4.62 0.00 0.00 176.95 172.00 2c4g n PRO 228 N 3.06 0.50 0.00 5.86 -0.02 -0.98 -1.27 135.00 142.15 2c4g n PRO 228 Ca 0.26 0.15 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 2c4g n PRO 228 Cb 0.47 -1.86 0.00 0.00 -0.02 0.00 0.00 33.50 32.09 2c4g n PRO 228 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2c4g n GLY 229 N 6.09 0.72 0.42 -1.23 0.00 -1.26 -5.01 105.19 104.92 2c4g n GLY 229 Ca 0.42 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.31 2c4g n GLY 229 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2c4g h VAL 230 N 0.00 0.00 -0.20 1.61 2.07 -1.52 -1.40 116.25 116.80 2c4g h VAL 230 Ca 0.00 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.58 2c4g h VAL 230 Cb 0.00 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.76 2c4g h VAL 230 CO 0.00 0.00 0.68 0.71 0.02 0.00 0.00 177.57 178.98 2c4g h THR 231 N -0.57 0.06 -0.67 2.57 1.35 -1.91 0.32 112.91 114.06 2c4g h THR 231 Ca 0.02 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.88 2c4g h THR 231 Cb 0.62 0.36 0.00 0.00 -1.73 0.00 0.00 68.15 67.40 2c4g h THR 231 CO -0.33 0.00 0.00 -1.20 -0.25 0.00 0.00 175.52 173.74 2c4g n SER 232 N -2.94 3.89 -4.84 5.36 7.64 -0.53 -4.86 113.62 117.33 2c4g n SER 232 Ca 0.04 -2.10 -0.34 0.00 1.01 0.00 0.00 58.87 57.48 2c4g n SER 232 Cb 0.77 -0.49 -0.06 0.00 -1.01 0.00 0.00 64.21 63.42 2c4g n SER 232 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 2c4g s MET 233 N -1.26 4.08 0.30 1.43 -1.94 0.11 -4.98 119.30 117.04 2c4g s MET 233 Ca 0.47 0.74 0.01 0.00 -1.71 0.00 0.00 55.69 55.20 2c4g s MET 233 Cb 0.26 -2.56 0.73 0.00 2.01 0.00 0.00 34.83 35.26 2c4g s MET 233 CO 0.29 0.22 1.53 -2.30 -0.01 0.00 0.00 175.02 174.76 2c4g n PRO 234 N -0.04 -0.08 -0.35 2.03 -0.02 -1.22 -1.46 135.00 133.85 2c4g n PRO 234 Ca 0.02 1.47 0.07 0.00 -2.02 0.00 0.00 63.50 63.04 2c4g n PRO 234 Cb 0.53 -2.32 0.23 0.00 -0.02 0.00 0.00 33.50 31.91 2c4g n PRO 234 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2c4g n ASP 235 N -5.47 3.61 -4.65 2.55 8.00 -0.60 -4.94 116.55 115.04 2c4g n ASP 235 Ca 0.22 -2.47 -0.42 0.00 0.71 0.00 0.00 54.79 52.84 2c4g n ASP 235 Cb 0.73 -0.41 -0.04 0.00 -0.02 0.00 0.00 41.12 41.39 2c4g n ASP 235 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2c4g s TYR 236 N -1.84 3.35 -0.14 1.24 6.14 -0.54 -4.91 117.35 120.65 2c4g s TYR 236 Ca 0.35 1.23 -0.03 0.00 0.64 0.00 0.00 57.07 59.26 2c4g s TYR 236 Cb 0.24 -3.08 -0.03 0.00 0.42 0.00 0.00 41.96 39.51 2c4g s TYR 236 CO 0.15 -0.37 -0.02 0.15 0.64 0.00 0.00 175.55 176.10 2c4g s LYS 237 N 2.71 3.50 0.61 4.97 1.02 -1.26 -4.81 119.74 126.47 2c4g s LYS 237 Ca 0.37 -0.47 0.39 0.00 0.02 0.00 0.00 55.97 56.29 2c4g s LYS 237 Cb -0.16 -2.91 1.93 0.00 -0.52 0.00 0.00 37.83 36.18 2c4g s LYS 237 CO 0.09 0.38 2.19 -1.00 -0.92 0.00 0.00 175.35 176.09 2c4g h PRO 238 N 6.24 0.00 0.00 -1.68 0.13 -1.95 -2.09 132.00 132.65 2c4g h PRO 238 Ca -0.38 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 2c4g h PRO 238 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2c4g h PRO 238 CO 0.61 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.25 2c4g n SER 239 N -3.07 0.00 -4.71 1.44 3.41 -1.26 -4.84 113.62 104.59 2c4g n SER 239 Ca -0.01 -1.56 -0.42 0.00 -0.26 0.00 0.00 58.87 56.61 2c4g n SER 239 Cb 0.18 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.10 2c4g n SER 239 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2c4g s PHE 240 N -2.00 3.30 0.02 7.33 0.08 -0.79 -4.93 117.98 121.00 2c4g s PHE 240 Ca 0.02 1.08 -0.34 0.00 0.12 0.00 0.00 56.93 57.81 2c4g s PHE 240 Cb 0.01 -3.58 -0.12 0.00 -0.57 0.00 0.00 43.02 38.75 2c4g s PHE 240 CO 0.01 -1.97 1.77 -2.30 -0.10 0.00 0.00 175.22 172.64 2c4g n PRO 241 N 4.02 2.23 -2.78 0.24 -0.02 -1.26 -4.90 135.00 132.54 2c4g n PRO 241 Ca 0.11 0.81 -0.43 0.00 -2.02 0.00 0.00 63.50 61.97 2c4g n PRO 241 Cb 0.44 -2.64 -0.04 0.00 -0.02 0.00 0.00 33.50 31.24 2c4g n PRO 241 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2c4g s LYS 242 N 2.83 3.48 0.28 -0.52 1.02 -1.26 -4.79 119.74 120.77 2c4g s LYS 242 Ca 0.87 0.07 0.06 0.00 0.02 0.00 0.00 55.97 56.99 2c4g s LYS 242 Cb -0.66 -3.98 -0.02 0.00 -0.52 0.00 0.00 37.83 32.65 2c4g s LYS 242 CO 0.45 -1.38 0.39 -1.58 -0.92 0.00 0.00 175.35 172.32 2c4g s TRP 243 N 4.03 3.31 0.15 3.18 0.51 -1.26 -4.95 118.94 123.91 2c4g s TRP 243 Ca 0.37 -0.10 0.04 0.00 -2.12 0.00 0.00 56.10 54.29 2c4g s TRP 243 Cb -0.10 -1.72 -0.04 0.00 -0.81 0.00 0.00 33.47 30.80 2c4g s TRP 243 CO 0.25 0.27 0.19 0.00 -0.51 0.00 0.00 176.95 177.15 2c4g s ALA 244 N -2.06 3.73 -0.36 0.98 0.00 -1.26 -2.50 121.76 120.28 2c4g s ALA 244 Ca 0.38 -1.13 -0.28 0.00 0.00 0.00 0.00 51.96 50.93 2c4g s ALA 244 Cb -0.09 -1.53 -0.02 0.00 0.00 0.00 0.00 23.12 21.48 2c4g s ALA 244 CO 0.30 0.54 1.76 0.50 0.00 0.00 0.00 175.76 178.85 2c4g s ARG 245 N -3.10 3.30 0.93 0.00 3.52 -1.26 -4.08 118.95 118.26 2c4g s ARG 245 Ca 0.32 1.30 -0.12 0.00 -0.13 0.00 0.00 55.73 57.10 2c4g s ARG 245 Cb -0.11 -4.19 0.06 0.00 -1.56 0.00 0.00 34.95 29.15 2c4g s ARG 245 CO 0.25 -1.90 0.58 1.04 -0.81 0.00 0.00 175.30 174.47 2c4g n GLN 246 N 8.45 -0.29 -2.92 5.12 1.13 -0.37 -4.91 117.38 123.58 2c4g n GLN 246 Ca 0.22 -0.04 -0.42 0.00 -1.94 0.00 0.00 57.00 54.82 2c4g n GLN 246 Cb 0.47 -1.98 -0.05 0.00 0.11 0.00 0.00 30.24 28.80 2c4g n GLN 246 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 2c4g s ASP 247 N -2.12 6.69 0.43 1.08 2.15 -1.26 -4.92 116.67 118.71 2c4g s ASP 247 Ca 0.60 0.70 0.21 0.00 0.43 0.00 0.00 52.55 54.50 2c4g s ASP 247 Cb -0.22 -2.42 1.18 0.00 -0.30 0.00 0.00 42.92 41.16 2c4g s ASP 247 CO 0.65 -0.63 1.79 -0.26 -0.17 0.00 0.00 175.17 176.54 2c4g h PHE 248 N 8.10 0.53 0.00 -5.34 -1.00 -1.94 0.72 116.94 118.01 2c4g h PHE 248 Ca -0.24 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.56 2c4g h PHE 248 Cb 1.09 -0.15 0.00 0.00 3.61 0.00 0.00 35.95 40.50 2c4g h PHE 248 CO 0.78 0.05 0.00 0.66 -1.61 0.00 0.00 178.31 178.19 2c4g h SER 249 N 0.32 0.00 0.00 2.17 4.64 -1.92 0.33 113.55 119.10 2c4g h SER 249 Ca 0.58 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.90 2c4g h SER 249 Cb 1.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.69 2c4g h SER 249 CO -0.24 0.00 -1.63 0.29 -0.87 0.00 0.00 176.83 174.38 2c4g n LYS 250 N -2.92 0.48 -0.09 4.77 5.02 0.25 -3.35 118.16 122.32 2c4g n LYS 250 Ca -0.03 -0.13 -0.18 0.00 -2.02 0.00 0.00 58.31 55.96 2c4g n LYS 250 Cb 0.08 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.47 2c4g n LYS 250 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2c4g h VAL 251 N 0.00 1.23 -2.41 -0.18 2.07 -0.68 -3.40 116.25 112.89 2c4g h VAL 251 Ca 0.00 -2.19 -0.60 0.00 0.82 0.00 0.00 66.70 64.73 2c4g h VAL 251 Cb 0.81 2.60 -0.42 0.00 -1.52 0.00 0.00 31.29 32.76 2c4g h VAL 251 CO 0.00 0.42 -0.64 1.33 0.02 0.00 0.00 177.57 178.69 2c4g n VAL 252 N -4.52 1.80 -0.11 2.57 0.24 -0.08 -4.97 118.33 113.27 2c4g n VAL 252 Ca -0.22 -4.97 -0.07 0.00 -2.04 0.00 0.00 64.34 57.05 2c4g n VAL 252 Cb 0.57 -2.09 -0.00 0.00 -1.47 0.00 0.00 33.84 30.85 2c4g n VAL 252 CO 0.00 0.00 0.00 -0.65 -2.14 0.00 0.00 176.83 174.04 2c4g h PRO 253 N 4.51 -0.19 -0.44 7.34 0.11 -1.73 -2.63 132.00 138.97 2c4g h PRO 253 Ca 0.18 0.01 0.13 0.00 0.11 0.00 0.00 66.00 66.43 2c4g h PRO 253 Cb 0.71 0.04 -0.02 0.00 0.11 0.00 0.00 31.00 31.85 2c4g h PRO 253 CO 0.76 -0.13 0.54 -1.35 -0.21 0.00 0.00 178.00 177.61 2c4g h PRO 254 N -0.20 0.00 -6.85 1.05 0.11 -1.87 -3.43 132.00 120.80 2c4g h PRO 254 Ca 0.18 0.00 -0.49 0.00 0.11 0.00 0.00 66.00 65.80 2c4g h PRO 254 Cb 0.48 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.60 2c4g h PRO 254 CO -0.49 0.00 0.41 -0.51 -0.21 0.00 0.00 178.00 177.20 2c4g s LEU 255 N -7.08 4.42 0.00 2.35 1.02 -0.99 -5.07 118.68 113.32 2c4g s LEU 255 Ca -0.04 2.06 0.00 0.00 0.02 0.00 0.00 54.13 56.17 2c4g s LEU 255 Cb 0.14 -3.85 0.00 0.00 0.02 0.00 0.00 46.19 42.50 2c4g s LEU 255 CO 0.50 -0.17 0.00 -0.90 0.02 0.00 0.00 176.35 175.80 2c4g n ASP 256 N 0.78 -0.01 -0.00 2.29 5.75 -1.26 -4.77 116.55 119.32 2c4g n ASP 256 Ca 0.01 -0.23 -0.13 0.00 -0.01 0.00 0.00 54.79 54.43 2c4g n ASP 256 Cb 0.48 0.00 -0.10 0.00 -1.03 0.00 0.00 41.12 40.47 2c4g n ASP 256 CO 0.00 0.00 0.00 -0.08 -0.11 0.00 0.00 177.20 177.01 2c4g h GLU 257 N 0.00 -0.02 -0.24 0.11 4.81 -1.99 -2.73 114.58 114.52 2c4g h GLU 257 Ca 0.00 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2c4g h GLU 257 Cb 0.00 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 2c4g h GLU 257 CO 0.00 0.41 0.15 -0.44 -0.73 0.00 0.00 179.01 178.40 2c4g h ASP 258 N -0.46 0.28 -0.63 1.04 3.32 -1.97 -0.73 116.42 117.27 2c4g h ASP 258 Ca -0.00 -0.04 0.12 0.00 0.02 0.00 0.00 57.03 57.13 2c4g h ASP 258 Cb 0.44 -0.07 -0.09 0.00 0.22 0.00 0.00 39.33 39.83 2c4g h ASP 258 CO 0.00 0.24 0.14 1.23 -1.72 0.00 0.00 179.24 179.13 2c4g h GLY 259 N 0.30 0.82 1.40 2.75 0.00 -1.92 -0.21 103.07 106.21 2c4g h GLY 259 Ca 0.09 -0.03 -0.10 0.00 0.00 0.00 0.00 47.33 47.28 2c4g h GLY 259 CO -0.02 -0.13 -0.17 3.21 0.00 0.00 0.00 176.54 179.44 2c4g h ARG 260 N 0.27 0.71 -0.20 4.80 3.08 -1.15 -2.12 114.38 119.77 2c4g h ARG 260 Ca 0.33 -0.25 -0.00 0.00 0.07 0.00 0.00 59.98 60.13 2c4g h ARG 260 Cb 0.51 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 2c4g h ARG 260 CO -0.42 0.84 0.12 1.03 -1.07 0.00 0.00 179.97 180.47 2c4g h SER 261 N 0.63 0.23 0.20 7.04 0.87 0.40 -1.77 113.55 121.15 2c4g h SER 261 Ca 0.10 -0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 60.61 2c4g h SER 261 Cb 0.64 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.55 2c4g h SER 261 CO 0.05 0.20 -0.09 0.25 -0.53 0.00 0.00 176.83 176.70 2c4g h LEU 262 N 0.24 -0.22 -0.81 2.23 5.85 -1.00 -2.54 115.31 119.06 2c4g h LEU 262 Ca 0.07 -0.13 0.11 0.00 0.84 0.00 0.00 57.88 58.77 2c4g h LEU 262 Cb 0.01 0.06 -0.08 0.00 0.37 0.00 0.00 40.66 41.01 2c4g h LEU 262 CO -0.01 0.00 0.43 0.25 -0.34 0.00 0.00 178.44 178.77 2c4g h LEU 263 N -0.45 0.56 -1.39 2.25 5.85 -1.35 0.60 115.31 121.39 2c4g h LEU 263 Ca -0.03 0.07 -0.06 0.00 0.84 0.00 0.00 57.88 58.70 2c4g h LEU 263 Cb 0.34 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 2c4g h LEU 263 CO 0.04 0.29 -0.29 0.77 -0.34 0.00 0.00 178.44 178.92 2c4g h SER 264 N 0.68 0.00 1.40 1.25 4.64 -1.24 -0.92 113.55 119.35 2c4g h SER 264 Ca 0.41 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.63 2c4g h SER 264 Cb 0.48 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.55 2c4g h SER 264 CO -0.30 0.29 -0.50 1.56 -0.87 0.00 0.00 176.83 177.01 2c4g h GLN 265 N 0.00 0.00 0.00 4.77 4.20 -0.52 -2.51 115.11 121.05 2c4g h GLN 265 Ca -0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 2c4g h GLN 265 Cb 0.60 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.38 2c4g h GLN 265 CO 0.04 0.50 -0.25 0.52 -0.67 0.00 0.00 178.83 178.96 2c4g h MET 266 N 0.00 0.00 -0.35 1.46 2.86 -0.43 -2.25 114.93 116.22 2c4g h MET 266 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2c4g h MET 266 Cb 1.33 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.99 2c4g h MET 266 CO 0.06 0.04 0.00 1.28 1.06 0.00 0.00 176.91 179.35 2c4g n LEU 267 N -3.02 4.01 -4.77 1.22 4.77 -0.41 -3.98 117.00 114.83 2c4g n LEU 267 Ca 0.03 -2.76 -0.41 0.00 -0.03 0.00 0.00 56.01 52.84 2c4g n LEU 267 Cb 0.55 -0.51 -0.00 0.00 -2.33 0.00 0.00 43.42 41.13 2c4g n LEU 267 CO 0.36 0.69 1.16 1.57 -1.33 0.00 0.00 177.39 179.84 2c4g n HIS 268 N -0.02 2.94 0.23 -1.77 -0.00 -0.95 -4.95 115.22 110.69 2c4g n HIS 268 Ca 0.21 0.40 -0.14 0.00 0.46 0.00 0.00 57.72 58.65 2c4g n HIS 268 Cb 0.84 -2.55 -0.08 0.00 -0.12 0.00 0.00 29.99 28.09 2c4g n HIS 268 CO 0.00 0.00 0.00 1.88 0.46 0.00 0.00 176.34 178.68 2c4g h TYR 269 N 3.40 -0.55 -2.47 1.57 0.05 -1.90 -3.42 116.97 113.65 2c4g h TYR 269 Ca -0.50 -0.01 -0.58 0.00 0.05 0.00 0.00 58.73 57.69 2c4g h TYR 269 Cb 1.24 0.18 -0.02 0.00 1.01 0.00 0.00 36.73 39.14 2c4g h TYR 269 CO 0.54 -0.23 1.33 0.34 -1.05 0.00 0.00 178.16 179.09 2c4g s ASP 270 N -4.83 5.80 0.64 3.88 -1.08 -1.26 -4.84 116.67 114.98 2c4g s ASP 270 Ca -0.15 1.53 0.34 0.00 -0.52 0.00 0.00 52.55 53.75 2c4g s ASP 270 Cb 0.02 -2.52 1.85 0.00 -1.46 0.00 0.00 42.92 40.81 2c4g s ASP 270 CO 0.54 -1.74 2.09 1.55 0.52 0.00 0.00 175.17 178.13 2c4g h PRO 271 N 13.34 0.00 0.00 4.34 0.13 -1.96 0.18 132.00 148.03 2c4g h PRO 271 Ca -0.36 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.70 2c4g h PRO 271 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 2c4g h PRO 271 CO 1.00 0.00 -0.34 -0.91 -0.23 0.00 0.00 178.00 177.53 2c4g h ASN 272 N 0.00 0.00 0.10 1.44 2.35 -1.95 -3.20 115.58 114.31 2c4g h ASN 272 Ca 0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 2c4g h ASN 272 Cb 0.47 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.84 2c4g h ASN 272 CO -0.00 0.34 -1.00 0.29 -1.65 0.00 0.00 177.43 175.40 2c4g n LYS 273 N -3.23 0.06 -2.10 0.81 4.76 0.54 -4.96 118.16 114.04 2c4g n LYS 273 Ca 0.02 -0.01 -0.42 0.00 -2.87 0.00 0.00 58.31 55.03 2c4g n LYS 273 Cb 0.63 -1.51 -0.03 0.00 -1.84 0.00 0.00 35.03 32.28 2c4g n LYS 273 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 2c4g s ARG 274 N -3.05 4.31 0.47 1.97 3.52 -0.61 -4.95 118.95 120.61 2c4g s ARG 274 Ca 0.07 2.18 -0.22 0.00 -0.13 0.00 0.00 55.73 57.62 2c4g s ARG 274 Cb 0.16 -3.18 -0.09 0.00 -1.56 0.00 0.00 34.95 30.28 2c4g s ARG 274 CO 0.85 -0.41 0.91 1.51 -0.81 0.00 0.00 175.30 177.35 2c4g n ILE 275 N 3.13 2.59 -3.21 4.11 3.06 -0.85 -5.00 119.36 123.20 2c4g n ILE 275 Ca 0.09 -0.50 -0.26 0.00 -2.50 0.00 0.00 62.75 59.58 2c4g n ILE 275 Cb 0.41 -1.05 -0.02 0.00 0.54 0.00 0.00 39.64 39.52 2c4g n ILE 275 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 2c4g s SER 276 N -0.89 6.34 0.26 9.51 1.04 -1.26 -4.91 113.70 123.80 2c4g s SER 276 Ca 0.66 0.65 -0.05 0.00 0.48 0.00 0.00 55.95 57.69 2c4g s SER 276 Cb -0.53 -2.12 0.31 0.00 0.10 0.00 0.00 66.02 63.79 2c4g s SER 276 CO 0.55 -0.32 1.94 0.00 0.98 0.00 0.00 173.24 176.39 2c4g h ALA 277 N 0.98 1.32 0.57 5.32 0.00 -1.94 0.23 119.26 125.74 2c4g h ALA 277 Ca -0.48 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.34 2c4g h ALA 277 Cb 1.21 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 2c4g h ALA 277 CO 0.63 0.63 -0.36 -0.22 0.00 0.00 0.00 179.25 179.93 2c4g h LYS 278 N 1.30 -0.86 -0.92 0.00 3.64 -1.92 -2.15 116.57 115.66 2c4g h LYS 278 Ca 0.36 0.06 0.03 0.00 -1.27 0.00 0.00 60.65 59.83 2c4g h LYS 278 Cb -0.13 0.19 -0.05 0.00 -0.41 0.00 0.00 32.23 31.83 2c4g h LYS 278 CO -0.08 -0.57 0.60 0.00 -2.27 0.00 0.00 179.45 177.13 2c4g h ALA 279 N -0.54 1.21 -0.90 5.00 0.00 -1.87 -2.54 119.26 119.62 2c4g h ALA 279 Ca -0.07 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 54.86 2c4g h ALA 279 Cb 0.73 -0.33 -0.06 0.00 0.00 0.00 0.00 17.79 18.12 2c4g h ALA 279 CO 0.06 0.48 0.57 0.00 0.00 0.00 0.00 179.25 180.36 2c4g h ALA 280 N 1.37 1.23 0.00 0.00 0.00 -0.33 -0.54 119.26 121.00 2c4g h ALA 280 Ca 0.36 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.26 2c4g h ALA 280 Cb -0.02 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.51 2c4g h ALA 280 CO -0.11 0.34 0.00 1.28 0.00 0.00 0.00 179.25 180.75 2c4g n LEU 281 N -4.58 0.46 -0.83 0.00 4.77 -0.83 -0.93 117.00 115.07 2c4g n LEU 281 Ca 0.13 0.70 0.12 0.00 -0.03 0.00 0.00 56.01 56.93 2c4g n LEU 281 Cb 0.17 -0.74 0.09 0.00 -2.33 0.00 0.00 43.42 40.61 2c4g n LEU 281 CO 0.32 -0.81 0.56 0.00 -1.33 0.00 0.00 177.39 176.13 2c4g n ALA 282 N -1.72 2.73 -1.83 -1.18 0.00 -0.22 -4.89 120.51 113.41 2c4g n ALA 282 Ca -0.01 -0.67 -0.41 0.00 0.00 0.00 0.00 53.44 52.36 2c4g n ALA 282 Cb 0.05 -0.82 -0.02 0.00 0.00 0.00 0.00 19.45 18.66 2c4g n ALA 282 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2c4g s HIS 283 N -2.12 3.08 0.60 0.00 5.04 -0.10 -4.86 115.29 116.93 2c4g s HIS 283 Ca 0.26 1.31 0.21 0.00 -1.54 0.00 0.00 55.06 55.30 2c4g s HIS 283 Cb 0.20 -3.69 1.15 0.00 0.04 0.00 0.00 32.58 30.28 2c4g s HIS 283 CO 0.37 -2.01 1.64 -1.00 -2.34 0.00 0.00 174.74 171.40 2c4g h PRO 284 N 4.04 0.00 0.00 2.88 0.13 -1.93 -0.70 132.00 136.43 2c4g h PRO 284 Ca -0.48 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.64 2c4g h PRO 284 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 2c4g h PRO 284 CO 0.70 0.00 -0.04 0.35 -0.23 0.00 0.00 178.00 178.77 2c4g h PHE 285 N 0.00 0.00 -0.55 1.56 3.57 -1.89 -0.79 116.94 118.84 2c4g h PHE 285 Ca 0.00 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 2c4g h PHE 285 Cb 0.97 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.70 2c4g h PHE 285 CO 0.00 0.04 0.02 1.19 -2.23 0.00 0.00 178.31 177.34 2c4g n PHE 286 N -4.39 2.00 -0.22 0.41 3.72 -0.27 -4.49 117.46 114.23 2c4g n PHE 286 Ca -0.03 -0.72 -0.03 0.00 -0.05 0.00 0.00 57.45 56.63 2c4g n PHE 286 Cb 0.13 -0.51 0.08 0.00 -0.94 0.00 0.00 39.48 38.24 2c4g n PHE 286 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 2c4g h GLN 287 N 3.64 0.64 -0.57 -1.08 5.75 -1.28 -3.12 115.11 119.10 2c4g h GLN 287 Ca 0.02 -0.04 -0.39 0.00 -0.15 0.00 0.00 58.65 58.09 2c4g h GLN 287 Cb 1.93 -0.15 -0.27 0.00 1.07 0.00 0.00 27.48 30.06 2c4g h GLN 287 CO 0.49 0.43 -0.43 -0.40 -2.65 0.00 0.00 178.83 176.27 2c4g n ASP 288 N -4.79 4.18 -4.76 -0.69 5.68 -1.26 -5.07 116.55 109.83 2c4g n ASP 288 Ca 0.07 -3.79 -0.39 0.00 -0.50 0.00 0.00 54.79 50.18 2c4g n ASP 288 Cb 0.15 -0.50 0.01 0.00 -1.14 0.00 0.00 41.12 39.63 2c4g n ASP 288 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2c4g s VAL 289 N -4.12 2.49 0.36 2.12 0.11 -1.18 -5.04 120.40 115.14 2c4g s VAL 289 Ca 0.49 0.41 0.04 0.00 -2.93 0.00 0.00 61.98 59.99 2c4g s VAL 289 Cb 0.41 -3.23 -0.03 0.00 -1.53 0.00 0.00 36.38 32.01 2c4g s VAL 289 CO 0.01 0.03 0.17 0.42 -3.33 0.00 0.00 175.10 172.40 2c4g s THR 290 N -1.32 0.39 -0.64 5.04 -4.23 -1.26 -5.09 115.64 108.53 2c4g s THR 290 Ca 0.62 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 59.19 2c4g s THR 290 Cb -0.38 -2.44 0.21 0.00 1.34 0.00 0.00 72.50 71.24 2c4g s THR 290 CO 0.47 0.00 0.62 1.17 -0.54 0.00 0.00 174.62 176.34 2c4g n LYS 291 N -0.74 2.05 -1.14 3.99 4.81 -1.26 -4.39 118.16 121.48 2c4g n LYS 291 Ca -0.01 -4.45 -0.31 0.00 -0.87 0.00 0.00 58.31 52.66 2c4g n LYS 291 Cb 0.64 -2.18 0.11 0.00 0.02 0.00 0.00 35.03 33.62 2c4g n LYS 291 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 2c4g s PRO 292 N -1.89 1.90 -0.07 1.64 0.02 -1.26 -4.89 135.00 130.44 2c4g s PRO 292 Ca 0.33 1.36 -0.06 0.00 0.02 0.00 0.00 61.00 62.66 2c4g s PRO 292 Cb 0.07 -1.84 -0.04 0.00 0.02 0.00 0.00 34.50 32.71 2c4g s PRO 292 CO -0.09 -1.94 0.17 0.14 -0.33 0.00 0.00 177.00 174.95 2c4g s VAL 293 N -2.69 5.46 1.02 3.83 -7.23 -1.26 -4.26 120.40 115.26 2c4g s VAL 293 Ca 0.65 0.10 -0.14 0.00 -1.81 0.00 0.00 61.98 60.77 2c4g s VAL 293 Cb -0.20 -3.47 0.20 0.00 0.56 0.00 0.00 36.38 33.47 2c4g s VAL 293 CO 0.54 0.50 1.13 -2.16 -0.31 0.00 0.00 175.10 174.81 2c4g s PRO 294 N -1.39 0.25 -0.81 4.82 0.04 -1.26 -4.93 135.00 131.72 2c4g s PRO 294 Ca 0.20 0.21 0.02 0.00 0.04 0.00 0.00 61.00 61.47 2c4g s PRO 294 Cb -0.12 -1.74 0.32 0.00 0.04 0.00 0.00 34.50 32.99 2c4g s PRO 294 CO 0.10 -2.78 1.31 1.58 0.04 0.00 0.00 177.00 177.25 2c4g n HIS 295 N -4.16 3.35 -1.66 0.56 -0.00 -1.26 -4.97 115.22 107.09 2c4g n HIS 295 Ca 0.08 -3.33 -0.41 0.00 0.46 0.00 0.00 57.72 54.52 2c4g n HIS 295 Cb 0.59 -0.84 0.01 0.00 -0.12 0.00 0.00 29.99 29.63 2c4g n HIS 295 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 2c4g n LEU 296 N 0.10 3.37 -0.88 0.27 4.77 -1.26 -5.08 117.00 118.29 2c4g n LEU 296 Ca 0.36 1.06 0.11 0.00 -0.03 0.00 0.00 56.01 57.52 2c4g n LEU 296 Cb 0.34 -1.43 0.09 0.00 -2.33 0.00 0.00 43.42 40.09 2c4g n LEU 296 CO 0.46 -1.08 0.60 0.54 -1.33 0.00 0.00 177.39 176.58