#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oi4 s PRO 33 N 0.00 -2.20 -0.14 5.31 0.02 -1.26 -5.05 135.00 131.68 2oi4 s PRO 33 Ca 0.00 0.29 0.08 0.00 0.02 0.00 0.00 61.00 61.39 2oi4 s PRO 33 Cb 0.00 -1.45 -0.14 0.00 0.02 0.00 0.00 34.50 32.93 2oi4 s PRO 33 CO 0.00 -4.43 -0.02 1.47 -0.33 0.00 0.00 177.00 173.69 2oi4 n LEU 34 N -5.34 0.97 0.00 -5.54 -0.00 -1.26 -4.48 117.00 101.35 2oi4 n LEU 34 Ca 0.10 -0.03 0.13 0.00 -0.00 0.00 0.00 56.01 56.21 2oi4 n LEU 34 Cb 0.58 0.03 0.69 0.00 -0.00 0.00 0.00 43.42 44.72 2oi4 n LEU 34 CO 0.47 0.47 0.95 -0.62 -0.00 0.00 0.00 177.39 178.66 2oi4 n GLU 35 N -2.64 0.46 0.01 1.47 1.02 -1.26 -1.90 120.64 117.80 2oi4 n GLU 35 Ca -0.24 0.03 -0.22 0.00 -0.02 0.00 0.00 57.16 56.72 2oi4 n GLU 35 Cb 0.88 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 30.66 2oi4 n GLU 35 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2oi4 h SER 36 N 0.00 0.41 0.48 1.62 4.64 -1.99 -3.39 113.55 115.32 2oi4 h SER 36 Ca 0.00 -0.87 -0.10 0.00 -0.47 0.00 0.00 61.79 60.36 2oi4 h SER 36 Cb 0.21 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 2oi4 h SER 36 CO 0.00 1.67 -0.47 1.56 -0.87 0.00 0.00 176.83 178.72 2oi4 h GLN 37 N -0.22 0.00 -5.21 4.77 4.20 -1.63 -3.45 115.11 113.56 2oi4 h GLN 37 Ca -0.33 0.00 -0.62 0.00 0.06 0.00 0.00 58.65 57.77 2oi4 h GLN 37 Cb 1.83 0.00 -0.33 0.00 0.30 0.00 0.00 27.48 29.29 2oi4 h GLN 37 CO 0.07 0.47 -0.86 0.71 -0.67 0.00 0.00 178.83 178.55 2oi4 s TYR 38 N -3.95 2.09 -0.57 2.96 1.51 -0.80 -0.44 117.35 118.16 2oi4 s TYR 38 Ca -0.02 -0.77 -0.20 0.00 -1.01 0.00 0.00 57.07 55.07 2oi4 s TYR 38 Cb 0.14 -1.42 0.07 0.00 -0.11 0.00 0.00 41.96 40.63 2oi4 s TYR 38 CO 0.74 -0.31 0.76 -1.14 -1.11 0.00 0.00 175.55 174.49 2oi4 s GLN 39 N 0.30 3.13 0.37 -0.62 0.74 -0.54 -4.64 119.66 118.40 2oi4 s GLN 39 Ca -0.13 -0.90 -0.28 0.00 0.05 0.00 0.00 55.36 54.10 2oi4 s GLN 39 Cb -0.16 -4.16 -0.11 0.00 1.10 0.00 0.00 33.01 29.68 2oi4 s GLN 39 CO 0.06 -1.47 1.47 0.08 -0.55 0.00 0.00 175.29 174.88 2oi4 s VAL 40 N 3.13 2.10 0.00 1.34 1.01 -1.26 -2.32 120.40 124.40 2oi4 s VAL 40 Ca 0.18 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.26 2oi4 s VAL 40 Cb -0.19 -3.07 0.00 0.00 0.00 0.00 0.00 36.38 33.12 2oi4 s VAL 40 CO 0.11 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.85 2oi4 n GLY 41 N 0.50 5.98 3.80 4.51 0.00 0.45 -4.93 105.19 115.51 2oi4 n GLY 41 Ca 0.01 -1.83 -0.32 0.00 0.00 0.00 0.00 46.02 43.88 2oi4 n GLY 41 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2oi4 s PRO 42 N 1.65 3.02 0.10 1.61 0.04 -1.26 -4.53 135.00 135.63 2oi4 s PRO 42 Ca 0.00 1.11 -0.33 0.00 0.04 0.00 0.00 61.00 61.82 2oi4 s PRO 42 Cb 0.00 -2.00 -0.12 0.00 0.04 0.00 0.00 34.50 32.42 2oi4 s PRO 42 CO 0.00 -1.04 1.73 -0.11 0.04 0.00 0.00 177.00 177.62 2oi4 n LEU 43 N -2.67 3.53 0.02 -3.56 7.94 -1.26 -0.73 117.00 120.26 2oi4 n LEU 43 Ca 0.08 1.03 -0.13 0.00 -1.11 0.00 0.00 56.01 55.89 2oi4 n LEU 43 Cb 0.53 -1.46 -0.14 0.00 0.53 0.00 0.00 43.42 42.88 2oi4 n LEU 43 CO 0.51 -0.06 -0.41 -0.07 -1.11 0.00 0.00 177.39 176.26 2oi4 h LEU 44 N 7.44 0.17 0.00 -1.96 3.38 -0.74 -3.47 115.31 120.13 2oi4 h LEU 44 Ca -0.46 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.22 2oi4 h LEU 44 Cb 1.24 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.94 2oi4 h LEU 44 CO 0.92 1.25 0.00 0.61 0.09 0.00 0.00 178.44 181.32 2oi4 n GLY 45 N 1.62 -0.82 3.45 0.83 0.00 -1.17 -5.02 105.19 104.08 2oi4 n GLY 45 Ca -0.16 -1.17 -0.15 0.00 0.00 0.00 0.00 46.02 44.54 2oi4 n GLY 45 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2oi4 s SER 46 N 0.00 -0.57 0.00 1.61 1.04 -1.26 -1.13 113.70 113.39 2oi4 s SER 46 Ca 0.00 0.32 0.00 0.00 0.48 0.00 0.00 55.95 56.75 2oi4 s SER 46 Cb 0.00 0.55 0.00 0.00 0.10 0.00 0.00 66.02 66.67 2oi4 s SER 46 CO 0.00 -0.76 0.00 0.61 0.98 0.00 0.00 173.24 174.07 2oi4 n GLY 47 N 0.33 0.93 0.28 7.32 0.00 -0.42 -4.99 105.19 108.64 2oi4 n GLY 47 Ca -0.18 0.14 0.18 0.00 0.00 0.00 0.00 46.02 46.15 2oi4 n GLY 47 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2oi4 h GLY 48 N 0.00 0.00 1.98 -0.02 0.00 -2.03 -2.07 103.07 100.94 2oi4 h GLY 48 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2oi4 h GLY 48 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 176.54 178.51 2oi4 n PHE 49 N -3.09 0.00 0.00 5.60 -1.74 -1.26 -5.05 117.46 111.91 2oi4 n PHE 49 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.89 2oi4 n PHE 49 Cb 0.30 -0.49 0.00 0.00 1.52 0.00 0.00 39.48 40.80 2oi4 n PHE 49 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 2oi4 n GLY 50 N 0.78 -0.05 3.12 4.97 0.00 -0.78 -4.79 105.19 108.44 2oi4 n GLY 50 Ca 0.06 -2.03 -0.28 0.00 0.00 0.00 0.00 46.02 43.76 2oi4 n GLY 50 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2oi4 s SER 51 N -4.00 2.43 -0.16 1.61 0.01 0.46 -1.30 113.70 112.75 2oi4 s SER 51 Ca 0.00 -0.43 -0.01 0.00 1.31 0.00 0.00 55.95 56.82 2oi4 s SER 51 Cb 0.00 -1.12 -0.01 0.00 0.21 0.00 0.00 66.02 65.10 2oi4 s SER 51 CO 0.00 0.09 -0.10 -0.69 0.41 0.00 0.00 173.24 172.95 2oi4 s VAL 52 N 0.54 3.17 0.15 3.43 1.01 -0.29 -1.40 120.40 127.00 2oi4 s VAL 52 Ca -0.16 -0.60 0.10 0.00 0.00 0.00 0.00 61.98 61.31 2oi4 s VAL 52 Cb -0.17 -2.36 -0.04 0.00 0.00 0.00 0.00 36.38 33.81 2oi4 s VAL 52 CO 0.06 0.50 -0.18 -0.31 0.00 0.00 0.00 175.10 175.17 2oi4 s TYR 53 N 0.68 2.50 0.22 5.22 2.02 0.13 0.01 117.35 128.13 2oi4 s TYR 53 Ca -0.05 -0.28 -0.30 0.00 -0.37 0.00 0.00 57.07 56.07 2oi4 s TYR 53 Cb -0.15 -1.29 -0.08 0.00 -0.40 0.00 0.00 41.96 40.04 2oi4 s TYR 53 CO 0.02 0.44 1.03 0.45 -1.57 0.00 0.00 175.55 175.91 2oi4 s SER 54 N -2.40 7.43 0.28 2.29 0.15 0.09 -0.44 113.70 121.10 2oi4 s SER 54 Ca 0.20 2.06 -0.02 0.00 0.70 0.00 0.00 55.95 58.88 2oi4 s SER 54 Cb -0.10 -2.61 0.01 0.00 -1.71 0.00 0.00 66.02 61.61 2oi4 s SER 54 CO 0.11 -0.05 0.41 0.61 1.20 0.00 0.00 173.24 175.52 2oi4 n GLY 55 N 1.64 2.24 2.86 9.45 0.00 -0.26 0.17 105.19 121.28 2oi4 n GLY 55 Ca -0.00 -1.55 -0.16 0.00 0.00 0.00 0.00 46.02 44.31 2oi4 n GLY 55 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2oi4 s ILE 56 N -2.71 0.22 0.03 -0.61 1.01 -0.98 -1.10 121.20 117.06 2oi4 s ILE 56 Ca 0.23 0.01 -0.30 0.00 0.00 0.00 0.00 60.65 60.58 2oi4 s ILE 56 Cb -0.01 -0.27 -0.06 0.00 0.01 0.00 0.00 42.46 42.13 2oi4 s ILE 56 CO 0.16 0.13 1.35 -0.60 0.00 0.00 0.00 174.94 175.98 2oi4 s ARG 57 N 0.68 4.32 0.25 2.79 3.52 0.18 -1.47 118.95 129.21 2oi4 s ARG 57 Ca -0.07 1.94 -0.01 0.00 -0.13 0.00 0.00 55.73 57.46 2oi4 s ARG 57 Cb -0.10 -3.46 0.29 0.00 -1.56 0.00 0.00 34.95 30.12 2oi4 s ARG 57 CO -0.01 -0.48 1.67 0.28 -0.81 0.00 0.00 175.30 175.94 2oi4 h VAL 58 N 4.71 1.27 -0.16 7.11 2.07 -1.07 0.72 116.25 130.90 2oi4 h VAL 58 Ca -0.39 -1.34 0.03 0.00 0.82 0.00 0.00 66.70 65.82 2oi4 h VAL 58 Cb 1.19 1.32 -0.05 0.00 -1.52 0.00 0.00 31.29 32.23 2oi4 h VAL 58 CO 0.88 0.43 -0.41 -1.28 0.02 0.00 0.00 177.57 177.21 2oi4 h SER 59 N 0.53 -1.33 0.00 0.57 0.87 -1.91 -3.33 113.55 108.95 2oi4 h SER 59 Ca 0.07 0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.79 2oi4 h SER 59 Cb 0.73 0.53 0.00 0.00 -0.44 0.00 0.00 62.40 63.21 2oi4 h SER 59 CO 0.06 -0.35 -0.04 -0.90 -0.53 0.00 0.00 176.83 175.07 2oi4 n ASP 60 N -4.71 1.56 0.00 6.23 3.85 -1.19 -4.99 116.55 117.30 2oi4 n ASP 60 Ca -0.04 -2.09 0.00 0.00 -0.71 0.00 0.00 54.79 51.95 2oi4 n ASP 60 Cb 0.28 -0.12 0.00 0.00 -1.35 0.00 0.00 41.12 39.92 2oi4 n ASP 60 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 2oi4 n ASN 61 N -0.60 -3.63 -4.71 -1.12 3.02 0.24 -4.97 115.26 103.50 2oi4 n ASN 61 Ca 0.04 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.17 2oi4 n ASN 61 Cb 0.43 -1.47 -0.03 0.00 -0.61 0.00 0.00 39.78 38.10 2oi4 n ASN 61 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2oi4 s LEU 62 N 0.00 4.38 0.14 3.41 2.96 -1.21 -4.65 118.68 123.70 2oi4 s LEU 62 Ca 0.00 2.70 -0.31 0.00 -0.22 0.00 0.00 54.13 56.29 2oi4 s LEU 62 Cb 0.00 -3.58 -0.10 0.00 0.50 0.00 0.00 46.19 43.01 2oi4 s LEU 62 CO 0.00 -0.92 1.63 -2.16 -1.32 0.00 0.00 176.35 173.58 2oi4 s PRO 63 N 1.87 4.19 0.27 0.98 0.04 -1.26 0.49 135.00 141.58 2oi4 s PRO 63 Ca 0.75 2.39 0.04 0.00 0.04 0.00 0.00 61.00 64.22 2oi4 s PRO 63 Cb -0.45 -3.32 -0.06 0.00 0.04 0.00 0.00 34.50 30.71 2oi4 s PRO 63 CO 0.33 -0.68 0.01 0.14 0.04 0.00 0.00 177.00 176.84 2oi4 s VAL 64 N 1.75 1.14 -0.04 -0.36 -7.23 -0.26 -3.05 120.40 112.36 2oi4 s VAL 64 Ca 0.73 -2.04 0.06 0.00 -1.81 0.00 0.00 61.98 58.92 2oi4 s VAL 64 Cb -0.43 -2.50 -0.02 0.00 0.56 0.00 0.00 36.38 33.99 2oi4 s VAL 64 CO 0.32 -0.21 -0.23 0.00 -0.31 0.00 0.00 175.10 174.66 2oi4 s ALA 65 N -3.34 2.26 -0.22 1.32 0.00 0.13 -1.10 121.76 120.80 2oi4 s ALA 65 Ca 0.31 -1.07 0.01 0.00 0.00 0.00 0.00 51.96 51.21 2oi4 s ALA 65 Cb 0.06 -0.68 0.06 0.00 0.00 0.00 0.00 23.12 22.56 2oi4 s ALA 65 CO 0.11 0.49 -0.06 0.42 0.00 0.00 0.00 175.76 176.72 2oi4 s ILE 66 N -0.46 1.49 -0.14 0.00 1.01 0.41 -1.10 121.20 122.42 2oi4 s ILE 66 Ca 0.05 -1.13 0.02 0.00 0.00 0.00 0.00 60.65 59.59 2oi4 s ILE 66 Cb -0.11 -1.73 0.01 0.00 0.01 0.00 0.00 42.46 40.64 2oi4 s ILE 66 CO 0.01 -0.05 -0.20 -0.75 0.00 0.00 0.00 174.94 173.95 2oi4 s LYS 67 N 1.42 2.87 -0.02 2.79 2.20 -0.53 0.17 119.74 128.64 2oi4 s LYS 67 Ca -0.05 -0.79 0.03 0.00 -0.36 0.00 0.00 55.97 54.80 2oi4 s LYS 67 Cb -0.18 -2.37 -0.03 0.00 -1.51 0.00 0.00 37.83 33.74 2oi4 s LYS 67 CO -0.07 -0.07 -0.08 -1.01 -0.36 0.00 0.00 175.35 173.76 2oi4 s HIS 68 N 0.96 2.87 -0.06 4.03 3.76 -0.49 -1.03 115.29 125.33 2oi4 s HIS 68 Ca -0.04 -0.04 -0.02 0.00 -0.15 0.00 0.00 55.06 54.80 2oi4 s HIS 68 Cb -0.15 -1.63 0.04 0.00 1.11 0.00 0.00 32.58 31.95 2oi4 s HIS 68 CO -0.04 0.34 0.12 0.54 -0.85 0.00 0.00 174.74 174.85 2oi4 s VAL 69 N -0.92 -0.08 0.29 -0.90 0.11 -0.78 -0.40 120.40 117.72 2oi4 s VAL 69 Ca 0.15 0.21 -0.30 0.00 -2.93 0.00 0.00 61.98 59.12 2oi4 s VAL 69 Cb -0.11 -0.21 -0.11 0.00 -1.53 0.00 0.00 36.38 34.42 2oi4 s VAL 69 CO 0.05 0.09 1.49 -1.61 -3.33 0.00 0.00 175.10 171.79 2oi4 s GLU 70 N 1.30 4.20 0.16 1.54 2.02 -1.26 -1.80 118.70 124.86 2oi4 s GLU 70 Ca -0.07 2.44 -0.16 0.00 0.02 0.00 0.00 54.97 57.20 2oi4 s GLU 70 Cb -0.12 -3.05 0.10 0.00 0.10 0.00 0.00 34.13 31.16 2oi4 s GLU 70 CO -0.05 -0.50 1.70 0.87 0.02 0.00 0.00 175.26 177.30 2oi4 h LYS 71 N 4.51 0.12 -1.17 1.61 1.57 -1.38 -1.55 116.57 120.28 2oi4 h LYS 71 Ca -0.47 -0.01 0.34 0.00 -1.87 0.00 0.00 60.65 58.64 2oi4 h LYS 71 Cb 1.22 -0.03 -0.05 0.00 0.08 0.00 0.00 32.23 33.46 2oi4 h LYS 71 CO 0.75 0.08 0.86 -0.44 -0.57 0.00 0.00 179.45 180.13 2oi4 h ASP 72 N 0.12 0.00 -0.56 0.86 3.45 -1.91 0.99 116.42 119.38 2oi4 h ASP 72 Ca 0.19 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.65 2oi4 h ASP 72 Cb 0.26 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.03 2oi4 h ASP 72 CO -0.31 0.00 0.00 0.54 -1.57 0.00 0.00 179.24 177.90 2oi4 n ARG 73 N -4.12 2.38 -3.30 3.56 1.74 -0.59 -4.87 116.66 111.46 2oi4 n ARG 73 Ca 0.25 -2.03 -0.43 0.00 -0.77 0.00 0.00 57.85 54.87 2oi4 n ARG 73 Cb 1.25 -1.47 -0.08 0.00 -1.02 0.00 0.00 32.46 31.14 2oi4 n ARG 73 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2oi4 s ILE 74 N -1.31 5.07 0.12 0.55 1.01 0.34 -4.94 121.20 122.05 2oi4 s ILE 74 Ca 0.38 -0.46 -0.06 0.00 0.00 0.00 0.00 60.65 60.52 2oi4 s ILE 74 Cb 0.20 -4.09 -0.18 0.00 0.01 0.00 0.00 42.46 38.40 2oi4 s ILE 74 CO 0.25 -0.50 1.30 0.77 0.00 0.00 0.00 174.94 176.76 2oi4 h SER 75 N 8.77 0.59 -3.12 3.58 4.64 -1.89 -3.46 113.55 122.66 2oi4 h SER 75 Ca -0.27 -0.46 -0.65 0.00 -0.47 0.00 0.00 61.79 59.94 2oi4 h SER 75 Cb 1.11 -0.18 -0.35 0.00 -0.31 0.00 0.00 62.40 62.67 2oi4 h SER 75 CO 0.83 1.26 -0.85 -1.81 -0.87 0.00 0.00 176.83 175.38 2oi4 s ASP 76 N -7.10 2.96 0.09 4.97 -0.00 -1.26 -5.13 116.67 111.21 2oi4 s ASP 76 Ca -0.06 -0.58 0.09 0.00 -0.00 0.00 0.00 52.55 52.00 2oi4 s ASP 76 Cb 0.09 -1.37 -0.03 0.00 -0.00 0.00 0.00 42.92 41.60 2oi4 s ASP 76 CO 0.87 0.01 -0.24 0.26 -0.00 0.00 0.00 175.17 176.07 2oi4 s TRP 77 N 1.21 2.10 0.11 4.23 0.52 -1.26 -1.80 118.94 124.04 2oi4 s TRP 77 Ca 0.01 -0.40 0.02 0.00 0.02 0.00 0.00 56.10 55.76 2oi4 s TRP 77 Cb -0.14 -1.18 -0.01 0.00 -1.15 0.00 0.00 33.47 31.00 2oi4 s TRP 77 CO -0.09 0.22 0.06 0.41 0.02 0.00 0.00 176.95 177.57 2oi4 n GLY 78 N 1.28 3.80 3.39 0.98 0.00 0.45 -4.47 105.19 110.63 2oi4 n GLY 78 Ca -0.18 -1.90 -0.10 0.00 0.00 0.00 0.00 46.02 43.84 2oi4 n GLY 78 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2oi4 s GLU 79 N -2.44 0.52 -0.07 1.61 -1.05 -1.26 -2.65 118.70 113.36 2oi4 s GLU 79 Ca 0.08 0.88 0.02 0.00 -0.15 0.00 0.00 54.97 55.79 2oi4 s GLU 79 Cb 0.00 0.09 -0.03 0.00 -0.44 0.00 0.00 34.13 33.76 2oi4 s GLU 79 CO 0.06 -0.14 -0.11 -1.17 0.95 0.00 0.00 175.26 174.85 2oi4 s LEU 80 N 1.19 2.88 0.00 1.83 2.96 -1.26 -4.92 118.68 121.36 2oi4 s LEU 80 Ca -0.07 -0.16 0.00 0.00 -0.22 0.00 0.00 54.13 53.67 2oi4 s LEU 80 Cb -0.06 -1.61 0.00 0.00 0.50 0.00 0.00 46.19 45.01 2oi4 s LEU 80 CO -0.11 0.31 0.00 -2.65 -1.32 0.00 0.00 176.35 172.58 2oi4 n PRO 81 N 2.55 0.00 0.00 0.98 -0.02 -1.26 -1.52 135.00 135.73 2oi4 n PRO 81 Ca -0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.30 2oi4 n PRO 81 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.00 2oi4 n PRO 81 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2oi4 n ASN 82 N -1.91 0.00 0.00 2.55 5.15 -1.26 -5.04 115.26 114.74 2oi4 n ASN 82 Ca 0.00 0.82 0.00 0.00 -0.60 0.00 0.00 54.58 54.80 2oi4 n ASN 82 Cb 0.00 -0.32 0.00 0.00 -0.53 0.00 0.00 39.78 38.93 2oi4 n ASN 82 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2oi4 n GLY 83 N -0.88 0.40 0.00 8.20 0.00 -0.58 -5.19 105.19 107.15 2oi4 n GLY 83 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.52 2oi4 n GLY 83 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2oi4 n THR 84 N 0.00 0.00 -3.41 2.61 -2.24 -1.26 -5.01 114.28 104.97 2oi4 n THR 84 Ca 0.00 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.37 2oi4 n THR 84 Cb 0.00 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.14 2oi4 n THR 84 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2oi4 s ARG 85 N -1.02 3.45 0.21 -0.78 3.52 -1.26 -4.14 118.95 118.92 2oi4 s ARG 85 Ca 0.00 -0.53 0.07 0.00 -0.13 0.00 0.00 55.73 55.14 2oi4 s ARG 85 Cb 0.00 -3.84 -0.05 0.00 -1.56 0.00 0.00 34.95 29.50 2oi4 s ARG 85 CO 0.00 -0.58 -0.13 0.14 -0.81 0.00 0.00 175.30 173.92 2oi4 s VAL 86 N 1.98 1.68 0.32 7.11 -7.23 -1.08 -5.02 120.40 118.16 2oi4 s VAL 86 Ca 0.11 -2.20 -0.29 0.00 -1.81 0.00 0.00 61.98 57.79 2oi4 s VAL 86 Cb -0.17 -2.06 -0.12 0.00 0.56 0.00 0.00 36.38 34.59 2oi4 s VAL 86 CO 0.12 -0.59 1.34 -2.65 -0.31 0.00 0.00 175.10 173.01 2oi4 n PRO 87 N -0.38 2.17 -0.43 4.82 -0.02 -1.26 -0.41 135.00 139.49 2oi4 n PRO 87 Ca -0.08 0.76 0.37 0.00 -2.02 0.00 0.00 63.50 62.54 2oi4 n PRO 87 Cb 0.61 -2.38 0.65 0.00 -0.02 0.00 0.00 33.50 32.36 2oi4 n PRO 87 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 2oi4 h MET 88 N 3.06 0.02 -0.80 -0.52 1.85 -1.58 -1.04 114.93 115.92 2oi4 h MET 88 Ca -0.46 -0.00 0.07 0.00 -0.61 0.00 0.00 59.70 58.69 2oi4 h MET 88 Cb 1.28 -0.00 -0.06 0.00 0.43 0.00 0.00 31.60 33.24 2oi4 h MET 88 CO 0.66 0.01 0.47 1.49 -0.40 0.00 0.00 176.91 179.15 2oi4 h GLU 89 N 0.02 0.83 -0.73 0.39 4.81 -1.85 0.13 114.58 118.19 2oi4 h GLU 89 Ca 0.87 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 60.01 2oi4 h GLU 89 Cb 2.64 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 31.80 2oi4 h GLU 89 CO -0.55 0.55 0.29 0.28 -0.73 0.00 0.00 179.01 178.85 2oi4 h VAL 90 N 0.86 1.25 -0.48 0.32 2.07 -1.56 -1.20 116.25 117.51 2oi4 h VAL 90 Ca 0.36 -0.79 -0.01 0.00 0.82 0.00 0.00 66.70 67.08 2oi4 h VAL 90 Cb 0.21 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 2oi4 h VAL 90 CO -0.19 0.32 0.26 0.58 0.02 0.00 0.00 177.57 178.56 2oi4 h VAL 91 N 1.04 1.17 0.11 2.57 2.07 -0.91 -0.49 116.25 121.80 2oi4 h VAL 91 Ca 0.24 -0.42 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 2oi4 h VAL 91 Cb 0.21 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 30.56 2oi4 h VAL 91 CO -0.02 0.18 -0.05 -0.07 0.02 0.00 0.00 177.57 177.62 2oi4 h LEU 92 N 0.63 -0.13 -0.84 2.57 3.38 -0.78 -2.57 115.31 117.58 2oi4 h LEU 92 Ca 0.17 -0.14 0.10 0.00 0.09 0.00 0.00 57.88 58.10 2oi4 h LEU 92 Cb 0.05 0.03 -0.07 0.00 0.09 0.00 0.00 40.66 40.76 2oi4 h LEU 92 CO -0.03 0.06 0.48 -0.07 0.09 0.00 0.00 178.44 178.98 2oi4 h LEU 93 N -0.31 0.69 -1.43 1.67 3.38 -1.18 -1.16 115.31 116.98 2oi4 h LEU 93 Ca -0.02 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 2oi4 h LEU 93 Cb 0.25 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 2oi4 h LEU 93 CO 0.02 0.39 0.02 0.11 0.09 0.00 0.00 178.44 179.07 2oi4 h LYS 94 N 0.81 0.39 0.00 1.13 1.57 -0.98 -1.74 116.57 117.75 2oi4 h LYS 94 Ca 0.40 -0.07 -0.10 0.00 -1.87 0.00 0.00 60.65 59.02 2oi4 h LYS 94 Cb 0.37 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 2oi4 h LYS 94 CO -0.25 0.41 -0.49 0.87 -0.57 0.00 0.00 179.45 179.42 2oi4 h LYS 95 N 0.38 0.00 -0.01 3.15 1.57 -0.80 -3.26 116.57 117.59 2oi4 h LYS 95 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 2oi4 h LYS 95 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.54 2oi4 h LYS 95 CO 0.00 0.49 -0.61 1.33 -0.57 0.00 0.00 179.45 180.10 2oi4 n VAL 96 N -3.58 0.00 0.69 0.50 0.24 -1.00 -4.52 118.33 110.66 2oi4 n VAL 96 Ca -0.00 -0.19 0.08 0.00 -2.04 0.00 0.00 64.34 62.19 2oi4 n VAL 96 Cb 0.58 1.16 0.24 0.00 -1.47 0.00 0.00 33.84 34.35 2oi4 n VAL 96 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2oi4 n SER 97 N -0.42 2.33 -4.75 -1.34 7.64 -0.69 -4.87 113.62 111.52 2oi4 n SER 97 Ca 0.08 -1.94 -0.37 0.00 1.01 0.00 0.00 58.87 57.65 2oi4 n SER 97 Cb 0.43 -0.25 -0.07 0.00 -1.01 0.00 0.00 64.21 63.31 2oi4 n SER 97 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2oi4 s SER 98 N -1.16 6.57 0.38 6.43 0.01 -1.26 -4.86 113.70 119.81 2oi4 s SER 98 Ca 0.31 0.67 0.00 0.00 1.31 0.00 0.00 55.95 58.24 2oi4 s SER 98 Cb 0.17 -2.22 0.00 0.00 0.21 0.00 0.00 66.02 64.18 2oi4 s SER 98 CO 0.23 0.12 0.00 0.61 0.41 0.00 0.00 173.24 174.60 2oi4 n GLY 99 N 3.05 -1.12 3.77 3.44 0.00 -1.26 -4.83 105.19 108.23 2oi4 n GLY 99 Ca -0.11 -0.77 -0.38 0.00 0.00 0.00 0.00 46.02 44.76 2oi4 n GLY 99 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2oi4 s PHE 100 N -1.30 2.94 0.13 1.61 0.08 -1.26 -5.04 117.98 115.14 2oi4 s PHE 100 Ca 0.00 1.53 -0.25 0.00 0.12 0.00 0.00 56.93 58.34 2oi4 s PHE 100 Cb 0.00 -3.40 0.08 0.00 -0.57 0.00 0.00 43.02 39.13 2oi4 s PHE 100 CO 0.00 -1.47 1.06 -1.54 -0.10 0.00 0.00 175.22 173.16 2oi4 s SER 101 N -1.25 -0.07 -0.14 1.36 1.04 -1.26 -5.01 113.70 108.37 2oi4 s SER 101 Ca 0.61 -0.47 0.01 0.00 0.48 0.00 0.00 55.95 56.58 2oi4 s SER 101 Cb -0.30 0.43 0.18 0.00 0.10 0.00 0.00 66.02 66.43 2oi4 s SER 101 CO 0.37 -0.82 1.40 0.61 0.98 0.00 0.00 173.24 175.77 2oi4 n GLY 102 N -0.59 2.86 3.57 7.32 0.00 -1.26 -4.85 105.19 112.24 2oi4 n GLY 102 Ca -0.05 -0.38 -0.33 0.00 0.00 0.00 0.00 46.02 45.26 2oi4 n GLY 102 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2oi4 s VAL 103 N -1.04 3.57 0.10 1.61 -7.23 -1.26 -0.78 120.40 115.38 2oi4 s VAL 103 Ca 0.17 -0.61 -0.31 0.00 -1.81 0.00 0.00 61.98 59.43 2oi4 s VAL 103 Cb 0.14 -2.48 -0.10 0.00 0.56 0.00 0.00 36.38 34.51 2oi4 s VAL 103 CO 0.03 0.54 1.80 -0.63 -0.31 0.00 0.00 175.10 176.52 2oi4 s ILE 104 N -0.85 2.69 0.19 -0.62 -1.09 -0.21 -4.79 121.20 116.53 2oi4 s ILE 104 Ca 0.13 0.16 -0.26 0.00 -2.23 0.00 0.00 60.65 58.45 2oi4 s ILE 104 Cb -0.11 -3.10 -0.08 0.00 -1.58 0.00 0.00 42.46 37.59 2oi4 s ILE 104 CO 0.03 -0.00 0.82 -0.13 -1.23 0.00 0.00 174.94 174.43 2oi4 s ARG 105 N 2.84 4.62 -0.16 2.79 0.52 -1.26 -4.89 118.95 123.42 2oi4 s ARG 105 Ca 0.80 1.23 -0.29 0.00 -0.52 0.00 0.00 55.73 56.94 2oi4 s ARG 105 Cb -0.44 -3.23 -0.02 0.00 0.52 0.00 0.00 34.95 31.78 2oi4 s ARG 105 CO 0.36 0.54 1.27 -1.17 0.02 0.00 0.00 175.30 176.32 2oi4 s LEU 106 N -1.23 4.19 -0.07 2.53 2.96 -1.26 -2.08 118.68 123.72 2oi4 s LEU 106 Ca 0.38 1.71 0.17 0.00 -0.22 0.00 0.00 54.13 56.17 2oi4 s LEU 106 Cb -0.23 -3.54 -0.22 0.00 0.50 0.00 0.00 46.19 42.70 2oi4 s LEU 106 CO 0.27 -0.76 0.47 0.18 -1.32 0.00 0.00 176.35 175.19 2oi4 n LEU 107 N 6.56 0.45 -3.62 -0.68 4.77 0.70 -4.99 117.00 120.20 2oi4 n LEU 107 Ca 0.14 0.21 -0.00 0.00 -0.03 0.00 0.00 56.01 56.32 2oi4 n LEU 107 Cb 0.45 0.25 -0.01 0.00 -2.33 0.00 0.00 43.42 41.78 2oi4 n LEU 107 CO 0.56 0.32 1.03 -0.62 -1.33 0.00 0.00 177.39 177.35 2oi4 s ASP 108 N -5.61 -0.09 0.05 -1.43 2.15 -1.10 -4.99 116.67 105.66 2oi4 s ASP 108 Ca -0.06 -0.11 -0.27 0.00 0.43 0.00 0.00 52.55 52.53 2oi4 s ASP 108 Cb 0.08 0.18 0.07 0.00 -0.30 0.00 0.00 42.92 42.95 2oi4 s ASP 108 CO 0.83 -0.32 0.63 -1.66 -0.17 0.00 0.00 175.17 174.49 2oi4 s TRP 109 N -2.47 -0.59 -0.02 -5.34 1.48 -1.26 -0.43 118.94 110.31 2oi4 s TRP 109 Ca 0.13 0.74 0.01 0.00 -1.06 0.00 0.00 56.10 55.92 2oi4 s TRP 109 Cb 0.03 0.47 0.01 0.00 -1.16 0.00 0.00 33.47 32.83 2oi4 s TRP 109 CO -0.04 -0.72 -0.03 -0.06 -4.06 0.00 0.00 176.95 172.04 2oi4 s PHE 110 N -2.39 0.51 -0.18 1.66 0.40 0.14 -4.99 117.98 113.12 2oi4 s PHE 110 Ca -0.05 -0.10 -0.13 0.00 -0.60 0.00 0.00 56.93 56.05 2oi4 s PHE 110 Cb -0.00 -0.44 -0.05 0.00 0.51 0.00 0.00 43.02 43.04 2oi4 s PHE 110 CO -0.01 -0.10 0.27 -2.00 0.70 0.00 0.00 175.22 174.08 2oi4 s GLU 111 N 0.51 4.23 0.34 0.44 2.12 -1.26 -1.25 118.70 123.83 2oi4 s GLU 111 Ca -0.06 0.03 0.08 0.00 0.36 0.00 0.00 54.97 55.39 2oi4 s GLU 111 Cb -0.09 -3.45 -0.04 0.00 0.26 0.00 0.00 34.13 30.81 2oi4 s GLU 111 CO -0.00 0.20 0.16 1.03 -0.54 0.00 0.00 175.26 176.11 2oi4 s ARG 112 N 0.59 2.43 0.23 4.30 0.52 -0.20 -5.01 118.95 121.81 2oi4 s ARG 112 Ca 0.15 -1.50 -0.09 0.00 -0.52 0.00 0.00 55.73 53.77 2oi4 s ARG 112 Cb -0.13 -2.22 0.38 0.00 0.52 0.00 0.00 34.95 33.49 2oi4 s ARG 112 CO 0.03 0.11 1.64 -1.35 0.02 0.00 0.00 175.30 175.76 2oi4 h PRO 113 N 1.51 0.09 -0.14 3.54 0.11 -2.04 -3.24 132.00 131.83 2oi4 h PRO 113 Ca -0.44 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2oi4 h PRO 113 Cb 1.25 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2oi4 h PRO 113 CO 0.62 0.06 0.00 -0.25 -0.21 0.00 0.00 178.00 178.22 2oi4 n ASP 114 N -5.34 2.59 -3.83 -2.05 10.43 -1.26 -4.99 116.55 112.11 2oi4 n ASP 114 Ca 0.12 -2.29 -0.07 0.00 2.57 0.00 0.00 54.79 55.11 2oi4 n ASP 114 Cb 0.43 -0.21 -0.02 0.00 1.84 0.00 0.00 41.12 43.16 2oi4 n ASP 114 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 2oi4 s SER 115 N -1.40 -0.25 -0.03 -2.24 1.04 -1.22 -0.98 113.70 108.61 2oi4 s SER 115 Ca 0.18 -0.61 0.04 0.00 0.48 0.00 0.00 55.95 56.03 2oi4 s SER 115 Cb 0.12 0.72 -0.03 0.00 0.10 0.00 0.00 66.02 66.94 2oi4 s SER 115 CO 0.07 -1.34 -0.15 -0.36 0.98 0.00 0.00 173.24 172.44 2oi4 s PHE 116 N -3.84 2.67 -0.16 5.02 0.08 -0.74 -1.04 117.98 119.97 2oi4 s PHE 116 Ca 0.11 -0.18 0.00 0.00 0.12 0.00 0.00 56.93 56.99 2oi4 s PHE 116 Cb -0.06 -1.60 0.00 0.00 -0.57 0.00 0.00 43.02 40.80 2oi4 s PHE 116 CO 0.07 0.19 -0.16 0.08 -0.10 0.00 0.00 175.22 175.30 2oi4 s VAL 117 N -0.77 2.51 -0.13 -0.44 1.01 -0.38 -1.87 120.40 120.33 2oi4 s VAL 117 Ca 0.12 -0.82 -0.04 0.00 0.00 0.00 0.00 61.98 61.25 2oi4 s VAL 117 Cb -0.11 -2.06 -0.03 0.00 0.00 0.00 0.00 36.38 34.19 2oi4 s VAL 117 CO 0.01 0.52 -0.00 -0.76 0.00 0.00 0.00 175.10 174.87 2oi4 s LEU 118 N 0.94 3.49 -0.22 3.92 1.02 -0.20 0.26 118.68 127.89 2oi4 s LEU 118 Ca -0.03 0.02 -0.10 0.00 0.02 0.00 0.00 54.13 54.04 2oi4 s LEU 118 Cb -0.15 -1.83 -0.05 0.00 0.02 0.00 0.00 46.19 44.18 2oi4 s LEU 118 CO -0.03 0.26 0.14 -0.63 0.02 0.00 0.00 176.35 176.11 2oi4 s ILE 119 N -0.15 5.32 0.04 -0.59 -1.09 0.43 -1.46 121.20 123.71 2oi4 s ILE 119 Ca 0.04 0.16 0.03 0.00 -2.23 0.00 0.00 60.65 58.65 2oi4 s ILE 119 Cb -0.13 -3.45 -0.02 0.00 -1.58 0.00 0.00 42.46 37.28 2oi4 s ILE 119 CO 0.02 0.40 -0.09 -0.76 -1.23 0.00 0.00 174.94 173.28 2oi4 s LEU 120 N 0.68 2.25 0.52 2.97 1.43 -0.26 -0.22 118.68 126.06 2oi4 s LEU 120 Ca 0.07 -0.54 -0.21 0.00 -1.03 0.00 0.00 54.13 52.42 2oi4 s LEU 120 Cb -0.12 -0.22 -0.08 0.00 0.03 0.00 0.00 46.19 45.79 2oi4 s LEU 120 CO 0.01 -0.17 0.87 -0.62 0.23 0.00 0.00 176.35 176.66 2oi4 n GLU 121 N 1.49 0.96 -3.84 1.70 1.02 -0.88 -0.69 120.64 120.40 2oi4 n GLU 121 Ca -0.22 0.36 -0.28 0.00 -0.02 0.00 0.00 57.16 57.00 2oi4 n GLU 121 Cb 0.55 -1.99 -0.16 0.00 -0.02 0.00 0.00 31.44 29.81 2oi4 n GLU 121 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 2oi4 s ARG 122 N -2.28 1.14 0.72 3.49 3.52 -1.17 -4.24 118.95 120.12 2oi4 s ARG 122 Ca 0.69 -0.57 -0.14 0.00 -0.13 0.00 0.00 55.73 55.58 2oi4 s ARG 122 Cb -0.48 -2.14 0.03 0.00 -1.56 0.00 0.00 34.95 30.80 2oi4 s ARG 122 CO 0.53 -0.55 1.14 -2.14 -0.81 0.00 0.00 175.30 173.46 2oi4 s PRO 123 N 1.68 2.37 -0.20 5.12 0.02 -1.26 -4.69 135.00 138.03 2oi4 s PRO 123 Ca -0.01 1.46 -0.09 0.00 0.02 0.00 0.00 61.00 62.38 2oi4 s PRO 123 Cb -0.17 -1.89 0.08 0.00 0.02 0.00 0.00 34.50 32.54 2oi4 s PRO 123 CO -0.07 -1.60 0.47 -2.00 -0.33 0.00 0.00 177.00 173.46 2oi4 s GLU 124 N -4.24 0.42 0.57 5.54 2.12 -1.26 -4.08 118.70 117.77 2oi4 s GLU 124 Ca 0.68 0.99 -0.19 0.00 0.36 0.00 0.00 54.97 56.81 2oi4 s GLU 124 Cb -0.22 0.20 -0.05 0.00 0.26 0.00 0.00 34.13 34.32 2oi4 s GLU 124 CO 0.46 -0.20 1.13 -1.25 -0.54 0.00 0.00 175.26 174.87 2oi4 s PRO 125 N 2.00 3.23 0.03 4.30 0.04 -1.26 -4.91 135.00 138.42 2oi4 s PRO 125 Ca -0.06 1.59 0.04 0.00 0.04 0.00 0.00 61.00 62.61 2oi4 s PRO 125 Cb -0.10 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.44 2oi4 s PRO 125 CO -0.14 -0.95 -0.11 0.54 0.04 0.00 0.00 177.00 176.38 2oi4 s VAL 126 N -1.85 0.88 -0.02 -0.36 0.11 -1.26 -2.67 120.40 115.23 2oi4 s VAL 126 Ca 0.72 -0.85 0.02 0.00 -2.93 0.00 0.00 61.98 58.94 2oi4 s VAL 126 Cb -0.24 -0.81 0.01 0.00 -1.53 0.00 0.00 36.38 33.81 2oi4 s VAL 126 CO 0.30 -0.03 -0.06 -1.58 -3.33 0.00 0.00 175.10 170.40 2oi4 s GLN 127 N -0.99 0.65 0.67 1.54 0.74 -0.87 -4.98 119.66 116.42 2oi4 s GLN 127 Ca -0.00 -0.18 -0.14 0.00 0.05 0.00 0.00 55.36 55.09 2oi4 s GLN 127 Cb -0.07 -0.65 0.00 0.00 1.10 0.00 0.00 33.01 33.39 2oi4 s GLN 127 CO 0.01 0.05 1.09 0.16 -0.55 0.00 0.00 175.29 176.05 2oi4 s ASP 128 N 0.28 5.17 0.33 6.67 3.84 -1.26 -0.14 116.67 131.56 2oi4 s ASP 128 Ca -0.03 1.88 0.15 0.00 -0.00 0.00 0.00 52.55 54.54 2oi4 s ASP 128 Cb -0.08 -2.53 0.52 0.00 -1.38 0.00 0.00 42.92 39.45 2oi4 s ASP 128 CO -0.00 -1.59 1.68 0.25 -0.00 0.00 0.00 175.17 175.51 2oi4 h LEU 129 N -0.19 0.00 0.15 2.11 5.85 -0.01 -0.74 115.31 122.47 2oi4 h LEU 129 Ca -0.46 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.26 2oi4 h LEU 129 Cb 1.23 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.26 2oi4 h LEU 129 CO 0.55 0.49 -0.07 0.15 -0.34 0.00 0.00 178.44 179.22 2oi4 h PHE 130 N 0.00 -0.18 -0.60 1.25 3.57 -1.81 -0.15 116.94 119.01 2oi4 h PHE 130 Ca -0.00 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.56 2oi4 h PHE 130 Cb 0.98 0.06 -0.06 0.00 2.79 0.00 0.00 35.95 39.72 2oi4 h PHE 130 CO 0.00 -0.10 0.28 0.22 -2.23 0.00 0.00 178.31 176.48 2oi4 h ASP 131 N -0.22 0.36 -0.03 0.41 3.58 -1.83 -0.13 116.42 118.57 2oi4 h ASP 131 Ca -0.02 0.05 -0.00 0.00 0.42 0.00 0.00 57.03 57.48 2oi4 h ASP 131 Cb 0.17 -0.01 -0.00 0.00 1.72 0.00 0.00 39.33 41.21 2oi4 h ASP 131 CO 0.03 0.23 -0.00 0.15 -2.88 0.00 0.00 179.24 176.77 2oi4 h PHE 132 N 0.51 0.05 -0.57 0.28 3.57 -0.95 -1.39 116.94 118.45 2oi4 h PHE 132 Ca 0.29 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.73 2oi4 h PHE 132 Cb 0.27 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.97 2oi4 h PHE 132 CO -0.12 0.34 0.16 0.82 -2.23 0.00 0.00 178.31 177.28 2oi4 h ILE 133 N -0.25 1.24 -0.56 1.41 2.04 -0.92 -0.37 117.51 120.11 2oi4 h ILE 133 Ca 0.01 -0.85 0.11 0.00 1.00 0.00 0.00 64.86 65.13 2oi4 h ILE 133 Cb 0.32 0.70 -0.09 0.00 -0.74 0.00 0.00 36.82 37.02 2oi4 h ILE 133 CO 0.00 0.32 0.05 0.74 0.00 0.00 0.00 178.15 179.26 2oi4 h THR 134 N 0.82 0.60 -0.02 -0.27 2.02 -0.92 0.45 112.91 115.58 2oi4 h THR 134 Ca 0.18 -0.06 -0.26 0.00 0.77 0.00 0.00 66.41 67.05 2oi4 h THR 134 Cb 0.31 0.42 0.02 0.00 -1.74 0.00 0.00 68.15 67.16 2oi4 h THR 134 CO -0.00 0.03 -0.99 -0.08 0.37 0.00 0.00 175.52 174.85 2oi4 h GLU 135 N 0.17 0.70 -0.00 6.66 4.81 -1.14 -3.35 114.58 122.43 2oi4 h GLU 135 Ca 0.29 -0.73 0.00 0.00 -0.13 0.00 0.00 59.36 58.79 2oi4 h GLU 135 Cb 0.44 0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.02 2oi4 h GLU 135 CO -0.43 1.31 -0.70 0.54 -0.73 0.00 0.00 179.01 179.00 2oi4 n ARG 136 N -3.89 0.41 0.00 1.92 1.74 -0.16 -5.09 116.66 111.59 2oi4 n ARG 136 Ca -0.11 -0.31 0.00 0.00 -0.77 0.00 0.00 57.85 56.66 2oi4 n ARG 136 Cb 0.86 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.80 2oi4 n ARG 136 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2oi4 n GLY 137 N 1.46 -0.92 3.60 -0.13 0.00 0.14 -4.88 105.19 104.46 2oi4 n GLY 137 Ca 0.07 -1.14 -0.47 0.00 0.00 0.00 0.00 46.02 44.47 2oi4 n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oi4 n ALA 138 N 0.90 -0.31 -2.11 4.61 0.00 -1.26 -4.66 120.51 117.67 2oi4 n ALA 138 Ca 0.00 0.44 -0.40 0.00 0.00 0.00 0.00 53.44 53.48 2oi4 n ALA 138 Cb 0.00 -2.08 -0.05 0.00 0.00 0.00 0.00 19.45 17.32 2oi4 n ALA 138 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2oi4 s LEU 139 N 0.51 4.54 0.37 0.00 1.43 0.14 -4.95 118.68 120.73 2oi4 s LEU 139 Ca 0.70 1.73 -0.26 0.00 -1.03 0.00 0.00 54.13 55.27 2oi4 s LEU 139 Cb -0.79 -3.46 -0.12 0.00 0.03 0.00 0.00 46.19 41.86 2oi4 s LEU 139 CO 0.53 0.06 1.05 0.00 0.23 0.00 0.00 176.35 178.22 2oi4 n GLN 140 N 2.23 1.46 -0.32 1.70 6.02 -1.26 -4.53 117.38 122.68 2oi4 n GLN 140 Ca -0.01 0.52 0.08 0.00 -0.01 0.00 0.00 57.00 57.58 2oi4 n GLN 140 Cb 0.49 -2.03 0.29 0.00 1.02 0.00 0.00 30.24 30.01 2oi4 n GLN 140 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 2oi4 h GLU 141 N 1.81 0.87 -0.67 -1.09 5.08 -1.96 -0.88 114.58 117.74 2oi4 h GLU 141 Ca -0.43 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 57.88 2oi4 h GLU 141 Cb 1.33 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 30.35 2oi4 h GLU 141 CO 0.59 0.58 0.44 1.49 -1.00 0.00 0.00 179.01 181.11 2oi4 h GLU 142 N 0.90 0.89 0.14 2.33 4.81 -1.99 -0.59 114.58 121.07 2oi4 h GLU 142 Ca 0.47 -0.06 -0.22 0.00 -0.13 0.00 0.00 59.36 59.42 2oi4 h GLU 142 Cb 0.52 -0.20 0.02 0.00 0.63 0.00 0.00 28.75 29.73 2oi4 h GLU 142 CO -0.23 0.59 -0.93 1.25 -0.73 0.00 0.00 179.01 178.96 2oi4 h LEU 143 N 0.91 0.58 -1.01 1.64 5.85 -1.56 -3.01 115.31 118.70 2oi4 h LEU 143 Ca 0.25 -0.91 0.14 0.00 0.84 0.00 0.00 57.88 58.20 2oi4 h LEU 143 Cb -0.10 -0.19 -0.09 0.00 0.37 0.00 0.00 40.66 40.66 2oi4 h LEU 143 CO -0.05 1.44 0.63 0.00 -0.34 0.00 0.00 178.44 180.12 2oi4 h ALA 144 N 0.14 1.58 -0.38 1.25 0.00 -1.17 -1.31 119.26 119.36 2oi4 h ALA 144 Ca -0.16 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 2oi4 h ALA 144 Cb 1.71 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 2oi4 h ALA 144 CO 0.18 0.13 0.04 -0.09 0.00 0.00 0.00 179.25 179.51 2oi4 h ARG 145 N 0.92 0.65 -0.29 0.00 2.43 -1.14 0.43 114.38 117.38 2oi4 h ARG 145 Ca 0.53 -0.18 -0.11 0.00 -0.81 0.00 0.00 59.98 59.41 2oi4 h ARG 145 Cb 0.63 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.11 2oi4 h ARG 145 CO -0.30 0.72 -0.24 1.03 -1.51 0.00 0.00 179.97 179.66 2oi4 h SER 146 N 0.48 0.71 0.48 -3.80 0.87 -1.32 -0.88 113.55 110.09 2oi4 h SER 146 Ca 0.11 -0.45 -0.02 0.00 -1.23 0.00 0.00 61.79 60.20 2oi4 h SER 146 Cb 0.39 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.16 2oi4 h SER 146 CO 0.01 1.01 -0.23 -0.26 -0.53 0.00 0.00 176.83 176.83 2oi4 h PHE 147 N 0.41 -0.60 -0.66 2.24 0.05 -1.23 -1.91 116.94 115.24 2oi4 h PHE 147 Ca 0.05 -0.01 0.05 0.00 3.82 0.00 0.00 57.97 61.88 2oi4 h PHE 147 Cb 0.79 0.20 -0.05 0.00 2.00 0.00 0.00 35.95 38.89 2oi4 h PHE 147 CO 0.07 -0.33 0.38 0.35 -0.18 0.00 0.00 178.31 178.60 2oi4 h PHE 148 N -0.74 0.69 -0.01 -0.55 3.57 -0.16 -0.95 116.94 118.79 2oi4 h PHE 148 Ca -0.07 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.48 2oi4 h PHE 148 Cb 0.54 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 39.03 2oi4 h PHE 148 CO -0.02 0.35 -0.17 2.35 -2.23 0.00 0.00 178.31 178.59 2oi4 h TRP 149 N 0.71 -0.44 -0.68 0.41 2.91 -1.16 -0.42 115.95 117.28 2oi4 h TRP 149 Ca 0.29 0.02 0.01 0.00 1.13 0.00 0.00 58.89 60.33 2oi4 h TRP 149 Cb 0.14 0.20 -0.03 0.00 -0.51 0.00 0.00 29.16 28.96 2oi4 h TRP 149 CO -0.07 -0.25 0.45 1.96 -1.03 0.00 0.00 178.44 179.50 2oi4 h GLN 150 N -0.27 0.88 -0.81 2.65 4.20 -1.04 -1.10 115.11 119.61 2oi4 h GLN 150 Ca 0.06 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.70 2oi4 h GLN 150 Cb 0.35 -0.20 -0.04 0.00 0.30 0.00 0.00 27.48 27.89 2oi4 h GLN 150 CO -0.17 0.58 0.44 0.28 -0.67 0.00 0.00 178.83 179.30 2oi4 h VAL 151 N 0.90 1.24 -0.40 -0.54 2.07 -0.82 -1.78 116.25 116.92 2oi4 h VAL 151 Ca 0.25 -0.60 -0.03 0.00 0.82 0.00 0.00 66.70 67.14 2oi4 h VAL 151 Cb -0.09 0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 29.82 2oi4 h VAL 151 CO -0.06 0.27 0.12 -0.07 0.02 0.00 0.00 177.57 177.85 2oi4 h LEU 152 N 1.13 0.59 -0.76 2.57 3.38 -0.40 -0.35 115.31 121.46 2oi4 h LEU 152 Ca 0.29 -0.21 0.04 0.00 0.09 0.00 0.00 57.88 58.09 2oi4 h LEU 152 Cb 0.03 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.57 2oi4 h LEU 152 CO -0.05 0.65 0.47 -0.33 0.09 0.00 0.00 178.44 179.27 2oi4 h GLU 153 N 0.50 0.87 -0.76 1.13 4.39 -1.16 -1.06 114.58 118.48 2oi4 h GLU 153 Ca 0.13 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.77 2oi4 h GLU 153 Cb 0.27 -0.20 -0.04 0.00 -0.10 0.00 0.00 28.75 28.69 2oi4 h GLU 153 CO -0.00 0.57 0.45 0.00 -1.16 0.00 0.00 179.01 178.87 2oi4 h ALA 154 N 1.35 0.97 -0.20 3.43 0.00 -0.84 -0.16 119.26 123.80 2oi4 h ALA 154 Ca 0.32 -0.09 -0.20 0.00 0.00 0.00 0.00 54.91 54.94 2oi4 h ALA 154 Cb 0.09 -0.31 0.01 0.00 0.00 0.00 0.00 17.79 17.58 2oi4 h ALA 154 CO -0.14 0.44 -0.64 0.28 0.00 0.00 0.00 179.25 179.19 2oi4 h VAL 155 N 1.04 1.29 -0.62 0.00 2.07 -1.00 -1.93 116.25 117.09 2oi4 h VAL 155 Ca 0.27 -1.84 0.01 0.00 0.82 0.00 0.00 66.70 65.95 2oi4 h VAL 155 Cb -0.03 1.86 -0.03 0.00 -1.52 0.00 0.00 31.29 31.58 2oi4 h VAL 155 CO -0.05 0.59 0.41 0.03 0.02 0.00 0.00 177.57 178.57 2oi4 h ARG 156 N 0.53 0.82 -0.25 1.57 3.08 -1.13 -0.10 114.38 118.90 2oi4 h ARG 156 Ca -0.02 -0.05 0.06 0.00 0.07 0.00 0.00 59.98 60.04 2oi4 h ARG 156 Cb 1.27 -0.18 -0.07 0.00 0.08 0.00 0.00 29.97 31.06 2oi4 h ARG 156 CO 0.14 0.54 -0.28 1.25 -1.07 0.00 0.00 179.97 180.55 2oi4 h HIS 157 N 0.84 -0.77 -0.59 3.04 2.76 -0.93 -1.83 115.15 117.67 2oi4 h HIS 157 Ca 0.23 0.04 0.07 0.00 -2.20 0.00 0.00 60.37 58.51 2oi4 h HIS 157 Cb -0.09 0.38 -0.06 0.00 1.55 0.00 0.00 27.41 29.18 2oi4 h HIS 157 CO -0.03 -0.36 0.28 0.00 -1.30 0.00 0.00 177.93 176.52 2oi4 h HIS 159 N 0.51 1.10 -0.32 0.00 -0.00 -0.75 -0.23 115.15 115.46 2oi4 h HIS 159 Ca 0.28 0.00 -0.04 0.00 -0.00 0.00 0.00 60.37 60.62 2oi4 h HIS 159 Cb 0.26 -0.36 -0.02 0.00 -0.00 0.00 0.00 27.41 27.29 2oi4 h HIS 159 CO -0.12 0.72 0.05 -0.91 -0.00 0.00 0.00 177.93 177.67 2oi4 h ASN 160 N 1.15 0.43 0.00 2.45 -0.26 -1.16 -2.05 115.58 116.14 2oi4 h ASN 160 Ca 0.30 -0.06 0.00 0.00 -0.56 0.00 0.00 56.30 55.98 2oi4 h ASN 160 Cb -0.06 -0.11 0.00 0.00 -1.06 0.00 0.00 38.32 37.09 2oi4 h ASN 160 CO -0.06 0.47 0.00 0.00 -1.06 0.00 0.00 177.43 176.78 2oi4 n GLY 162 N 0.97 0.50 3.30 0.00 0.00 -0.77 -4.85 105.19 104.34 2oi4 n GLY 162 Ca 0.23 -0.78 -0.33 0.00 0.00 0.00 0.00 46.02 45.14 2oi4 n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oi4 s VAL 163 N -2.00 2.90 -0.29 1.61 1.01 -0.17 0.20 120.40 123.66 2oi4 s VAL 163 Ca 0.00 -0.69 -0.10 0.00 0.00 0.00 0.00 61.98 61.19 2oi4 s VAL 163 Cb 0.00 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 2oi4 s VAL 163 CO 0.00 0.50 0.17 -0.22 0.00 0.00 0.00 175.10 175.56 2oi4 s LEU 164 N 0.79 3.99 0.09 3.92 2.96 -0.32 -3.29 118.68 126.83 2oi4 s LEU 164 Ca -0.05 -0.15 -0.19 0.00 -0.22 0.00 0.00 54.13 53.53 2oi4 s LEU 164 Cb -0.15 -2.08 -0.07 0.00 0.50 0.00 0.00 46.19 44.39 2oi4 s LEU 164 CO 0.01 -0.08 1.57 -0.74 -1.32 0.00 0.00 176.35 175.79 2oi4 h HIS 165 N 8.36 0.45 0.00 5.38 -0.00 -1.94 0.16 115.15 127.57 2oi4 h HIS 165 Ca -0.35 -0.06 0.00 0.00 -0.00 0.00 0.00 60.37 59.96 2oi4 h HIS 165 Cb 1.18 -0.12 0.00 0.00 -0.00 0.00 0.00 27.41 28.46 2oi4 h HIS 165 CO 0.72 0.53 0.00 0.54 -0.00 0.00 0.00 177.93 179.72 2oi4 n ARG 166 N -4.69 -0.60 -2.71 5.26 1.74 -1.26 -2.89 116.66 111.51 2oi4 n ARG 166 Ca -0.03 0.15 -0.05 0.00 -0.77 0.00 0.00 57.85 57.15 2oi4 n ARG 166 Cb 0.19 -3.98 0.08 0.00 -1.02 0.00 0.00 32.46 27.73 2oi4 n ARG 166 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2oi4 n ASP 167 N -0.30 -0.04 -4.67 0.55 4.64 -1.26 -4.35 116.55 111.11 2oi4 n ASP 167 Ca 0.00 -2.41 -0.42 0.00 -1.38 0.00 0.00 54.79 50.58 2oi4 n ASP 167 Cb 0.15 0.16 -0.03 0.00 -1.04 0.00 0.00 41.12 40.36 2oi4 n ASP 167 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 2oi4 s ILE 168 N -1.70 3.26 0.07 5.18 1.01 -1.26 -4.79 121.20 122.98 2oi4 s ILE 168 Ca 0.22 0.45 -0.27 0.00 0.00 0.00 0.00 60.65 61.06 2oi4 s ILE 168 Cb 0.41 -3.29 0.08 0.00 0.01 0.00 0.00 42.46 39.67 2oi4 s ILE 168 CO -0.05 -0.03 0.92 -1.59 0.00 0.00 0.00 174.94 174.20 2oi4 s LYS 169 N 3.73 0.99 0.20 2.79 -2.85 -1.26 -4.85 119.74 118.48 2oi4 s LYS 169 Ca 0.78 -0.47 -0.13 0.00 -1.00 0.00 0.00 55.97 55.15 2oi4 s LYS 169 Cb -0.38 0.39 0.22 0.00 -2.06 0.00 0.00 37.83 36.00 2oi4 s LYS 169 CO 0.34 -0.45 1.67 0.38 0.10 0.00 0.00 175.35 177.39 2oi4 h ASP 170 N 2.00 -0.30 0.38 0.03 3.04 -1.94 -2.03 116.42 117.60 2oi4 h ASP 170 Ca -0.23 0.14 -0.02 0.00 -3.24 0.00 0.00 57.03 53.68 2oi4 h ASP 170 Cb 1.24 0.26 -0.00 0.00 -1.04 0.00 0.00 39.33 39.78 2oi4 h ASP 170 CO 0.28 -0.11 -0.08 -0.08 -2.04 0.00 0.00 179.24 177.21 2oi4 h GLU 171 N 0.08 0.00 -0.61 4.15 4.81 -1.94 -1.25 114.58 119.82 2oi4 h GLU 171 Ca 0.27 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 2oi4 h GLU 171 Cb 0.42 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.80 2oi4 h GLU 171 CO -0.48 0.08 0.00 0.09 -0.73 0.00 0.00 179.01 177.97 2oi4 n ASN 172 N -3.51 2.52 -3.97 1.04 3.02 -0.76 -4.69 115.26 108.90 2oi4 n ASN 172 Ca -0.02 -2.23 -0.30 0.00 -0.03 0.00 0.00 54.58 52.00 2oi4 n ASN 172 Cb 0.22 -0.43 -0.16 0.00 -0.61 0.00 0.00 39.78 38.80 2oi4 n ASN 172 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2oi4 s ILE 173 N -1.69 1.49 -0.16 2.41 1.01 -0.48 -1.71 121.20 122.07 2oi4 s ILE 173 Ca 0.23 -0.87 -0.13 0.00 0.00 0.00 0.00 60.65 59.89 2oi4 s ILE 173 Cb 0.15 -1.58 -0.05 0.00 0.01 0.00 0.00 42.46 41.00 2oi4 s ILE 173 CO 0.10 0.19 0.25 -0.76 0.00 0.00 0.00 174.94 174.73 2oi4 s LEU 174 N 1.47 4.25 -0.31 2.97 1.43 -0.20 0.33 118.68 128.61 2oi4 s LEU 174 Ca -0.00 0.46 -0.12 0.00 -1.03 0.00 0.00 54.13 53.44 2oi4 s LEU 174 Cb -0.16 -2.30 -0.03 0.00 0.03 0.00 0.00 46.19 43.73 2oi4 s LEU 174 CO -0.08 0.14 0.21 -0.63 0.23 0.00 0.00 176.35 176.22 2oi4 s ILE 175 N 0.30 5.26 -0.50 -0.59 1.01 0.80 0.07 121.20 127.54 2oi4 s ILE 175 Ca 0.15 -0.06 -0.29 0.00 0.00 0.00 0.00 60.65 60.45 2oi4 s ILE 175 Cb -0.13 -3.62 0.02 0.00 0.01 0.00 0.00 42.46 38.75 2oi4 s ILE 175 CO 0.03 0.11 1.23 -0.62 0.00 0.00 0.00 174.94 175.69 2oi4 s ASP 176 N 1.73 6.47 0.35 3.58 3.68 0.63 -2.05 116.67 131.07 2oi4 s ASP 176 Ca 0.06 0.41 0.11 0.00 2.13 0.00 0.00 52.55 55.27 2oi4 s ASP 176 Cb -0.17 -2.55 0.66 0.00 -1.45 0.00 0.00 42.92 39.42 2oi4 s ASP 176 CO 0.10 -1.40 1.80 -0.07 0.13 0.00 0.00 175.17 175.74 2oi4 h LEU 177 N 11.80 0.07 0.17 -1.34 3.38 -1.81 0.00 115.31 127.59 2oi4 h LEU 177 Ca -0.25 -0.03 -0.31 0.00 0.09 0.00 0.00 57.88 57.39 2oi4 h LEU 177 Cb 1.07 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 41.81 2oi4 h LEU 177 CO 1.14 0.43 -1.51 0.78 0.09 0.00 0.00 178.44 179.37 2oi4 h ASN 178 N 0.06 0.58 0.89 -0.43 2.35 -1.91 -3.38 115.58 113.74 2oi4 h ASN 178 Ca 0.01 -0.91 0.00 0.00 -0.55 0.00 0.00 56.30 54.84 2oi4 h ASN 178 Cb 0.67 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.86 2oi4 h ASN 178 CO 0.05 1.69 -0.51 0.54 -1.65 0.00 0.00 177.43 177.55 2oi4 n ARG 179 N -3.77 0.24 -1.26 0.81 1.74 -1.20 -4.88 116.66 108.33 2oi4 n ARG 179 Ca -0.22 0.09 -0.09 0.00 -0.77 0.00 0.00 57.85 56.85 2oi4 n ARG 179 Cb 1.00 -1.67 -0.04 0.00 -1.02 0.00 0.00 32.46 30.74 2oi4 n ARG 179 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2oi4 n GLY 180 N 1.36 1.04 3.77 -0.13 0.00 -0.02 -3.54 105.19 107.66 2oi4 n GLY 180 Ca 0.04 -0.40 -0.36 0.00 0.00 0.00 0.00 46.02 45.30 2oi4 n GLY 180 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2oi4 s GLU 181 N -2.56 3.78 0.02 1.61 2.02 -1.17 -4.59 118.70 117.80 2oi4 s GLU 181 Ca 0.00 -0.22 -0.13 0.00 0.02 0.00 0.00 54.97 54.64 2oi4 s GLU 181 Cb 0.00 -3.25 -0.06 0.00 0.10 0.00 0.00 34.13 30.93 2oi4 s GLU 181 CO 0.00 0.51 0.39 -0.51 0.02 0.00 0.00 175.26 175.67 2oi4 s LEU 182 N -0.26 4.43 -0.04 1.80 1.02 -1.26 -0.27 118.68 124.10 2oi4 s LEU 182 Ca 0.10 0.88 0.01 0.00 0.02 0.00 0.00 54.13 55.14 2oi4 s LEU 182 Cb -0.12 -2.69 0.02 0.00 0.02 0.00 0.00 46.19 43.42 2oi4 s LEU 182 CO 0.01 0.28 -0.04 -0.54 0.02 0.00 0.00 176.35 176.08 2oi4 s LYS 183 N -1.35 0.73 0.16 1.70 -0.14 0.11 -4.62 119.74 116.33 2oi4 s LYS 183 Ca 0.26 -0.10 -0.30 0.00 -1.36 0.00 0.00 55.97 54.48 2oi4 s LYS 183 Cb -0.15 -0.75 -0.07 0.00 -1.68 0.00 0.00 37.83 35.17 2oi4 s LYS 183 CO 0.14 -0.06 1.13 -0.51 -0.76 0.00 0.00 175.35 175.29 2oi4 s LEU 184 N 0.81 4.46 0.20 3.17 1.43 0.04 -1.04 118.68 127.75 2oi4 s LEU 184 Ca -0.10 2.09 0.07 0.00 -1.03 0.00 0.00 54.13 55.15 2oi4 s LEU 184 Cb -0.13 -3.60 -0.05 0.00 0.03 0.00 0.00 46.19 42.44 2oi4 s LEU 184 CO 0.00 -0.28 -0.12 0.27 0.23 0.00 0.00 176.35 176.45 2oi4 s ILE 185 N 0.02 1.55 -0.23 -0.59 -4.36 -0.69 -1.04 121.20 115.86 2oi4 s ILE 185 Ca 0.51 -2.16 -0.01 0.00 -0.26 0.00 0.00 60.65 58.74 2oi4 s ILE 185 Cb -0.30 -2.05 0.00 0.00 1.25 0.00 0.00 42.46 41.36 2oi4 s ILE 185 CO 0.34 -0.59 0.23 -0.67 0.24 0.00 0.00 174.94 174.49 2oi4 n ASP 186 N -0.36 -3.94 -0.52 4.36 2.03 -1.26 -4.85 116.55 112.01 2oi4 n ASP 186 Ca -0.08 0.01 0.03 0.00 0.52 0.00 0.00 54.79 55.28 2oi4 n ASP 186 Cb 0.61 -2.44 0.11 0.00 -0.72 0.00 0.00 41.12 38.67 2oi4 n ASP 186 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 2oi4 n PHE 187 N -1.11 0.37 0.77 -0.67 3.72 -1.26 -4.52 117.46 114.76 2oi4 n PHE 187 Ca 0.01 -0.17 0.12 0.00 -0.05 0.00 0.00 57.45 57.36 2oi4 n PHE 187 Cb 0.44 -0.04 0.50 0.00 -0.94 0.00 0.00 39.48 39.43 2oi4 n PHE 187 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2oi4 n GLY 188 N 0.73 -1.39 0.85 1.37 0.00 -1.26 -1.29 105.19 104.21 2oi4 n GLY 188 Ca 0.08 -0.06 0.08 0.00 0.00 0.00 0.00 46.02 46.12 2oi4 n GLY 188 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2oi4 n SER 189 N -1.67 3.78 -2.73 1.61 7.64 -1.26 -4.83 113.62 116.16 2oi4 n SER 189 Ca 0.06 -2.95 -0.11 0.00 1.01 0.00 0.00 58.87 56.88 2oi4 n SER 189 Cb 0.30 -0.52 0.08 0.00 -1.01 0.00 0.00 64.21 63.06 2oi4 n SER 189 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2oi4 n GLY 190 N -0.46 -1.40 3.56 0.23 0.00 -0.41 -4.66 105.19 102.06 2oi4 n GLY 190 Ca 0.20 -1.66 -0.09 0.00 0.00 0.00 0.00 46.02 44.47 2oi4 n GLY 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oi4 s ALA 191 N -3.89 -0.73 0.38 4.61 0.00 0.57 -4.98 121.76 117.72 2oi4 s ALA 191 Ca 0.28 -0.44 -0.28 0.00 0.00 0.00 0.00 51.96 51.52 2oi4 s ALA 191 Cb -0.01 0.90 -0.10 0.00 0.00 0.00 0.00 23.12 23.91 2oi4 s ALA 191 CO 0.20 -0.83 1.44 -0.51 0.00 0.00 0.00 175.76 176.06 2oi4 s LEU 192 N -2.92 4.30 0.22 0.00 1.43 -1.26 -1.17 118.68 119.27 2oi4 s LEU 192 Ca 0.13 2.96 -0.30 0.00 -1.03 0.00 0.00 54.13 55.89 2oi4 s LEU 192 Cb -0.01 -3.72 -0.09 0.00 0.03 0.00 0.00 46.19 42.40 2oi4 s LEU 192 CO 0.01 -0.87 1.25 -0.22 0.23 0.00 0.00 176.35 176.75 2oi4 s LEU 193 N -2.17 4.44 0.20 1.79 2.96 0.13 -4.62 118.68 121.41 2oi4 s LEU 193 Ca 0.54 2.36 -0.01 0.00 -0.22 0.00 0.00 54.13 56.80 2oi4 s LEU 193 Cb -0.45 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.59 2oi4 s LEU 193 CO 0.60 -0.44 0.12 -1.59 -1.32 0.00 0.00 176.35 173.72 2oi4 s LYS 194 N -0.46 1.21 0.00 1.98 -2.85 -1.26 -4.90 119.74 113.46 2oi4 s LYS 194 Ca 0.53 -1.64 0.24 0.00 -1.00 0.00 0.00 55.97 54.10 2oi4 s LYS 194 Cb -0.35 0.22 0.20 0.00 -2.06 0.00 0.00 37.83 35.84 2oi4 s LYS 194 CO 0.40 -0.38 1.22 -0.25 0.10 0.00 0.00 175.35 176.44 2oi4 n ASP 195 N -0.28 1.82 -4.89 0.03 10.43 -1.26 -4.49 116.55 117.91 2oi4 n ASP 195 Ca 0.02 -1.39 -0.21 0.00 2.57 0.00 0.00 54.79 55.78 2oi4 n ASP 195 Cb 0.66 0.37 0.07 0.00 1.84 0.00 0.00 41.12 44.06 2oi4 n ASP 195 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 2oi4 s THR 196 N -2.46 2.38 0.37 -3.53 -4.23 -1.26 -5.00 115.64 101.92 2oi4 s THR 196 Ca 0.21 -0.77 -0.25 0.00 -1.18 0.00 0.00 61.69 59.69 2oi4 s THR 196 Cb 0.18 -2.61 -0.09 0.00 1.34 0.00 0.00 72.50 71.32 2oi4 s THR 196 CO 0.55 0.00 1.05 0.54 -0.54 0.00 0.00 174.62 176.21 2oi4 s VAL 197 N -2.82 3.73 -0.10 2.29 0.11 -1.26 -4.71 120.40 117.65 2oi4 s VAL 197 Ca 0.61 1.40 -0.06 0.00 -2.93 0.00 0.00 61.98 61.00 2oi4 s VAL 197 Cb -0.07 -3.76 -0.04 0.00 -1.53 0.00 0.00 36.38 30.98 2oi4 s VAL 197 CO 0.40 0.08 0.15 -0.31 -3.33 0.00 0.00 175.10 172.09 2oi4 s TYR 198 N -1.57 3.59 0.00 1.54 1.51 0.49 -4.97 117.35 117.94 2oi4 s TYR 198 Ca 0.55 0.49 0.00 0.00 -1.01 0.00 0.00 57.07 57.10 2oi4 s TYR 198 Cb -0.23 -1.92 0.00 0.00 -0.11 0.00 0.00 41.96 39.70 2oi4 s TYR 198 CO 0.29 0.72 0.39 0.25 -1.11 0.00 0.00 175.55 176.09 2oi4 n THR 199 N 1.77 0.00 -5.03 -0.71 -2.24 -1.26 -1.97 114.28 104.85 2oi4 n THR 199 Ca -0.18 -0.42 -0.31 0.00 -2.27 0.00 0.00 64.05 60.87 2oi4 n THR 199 Cb 0.55 1.14 -0.15 0.00 -2.10 0.00 0.00 70.33 69.77 2oi4 n THR 199 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2oi4 s ASP 200 N -0.07 3.28 -0.23 3.42 -4.77 -1.26 -4.86 116.67 112.18 2oi4 s ASP 200 Ca 0.00 -0.49 -0.20 0.00 -3.30 0.00 0.00 52.55 48.56 2oi4 s ASP 200 Cb 0.00 -0.40 0.06 0.00 -1.09 0.00 0.00 42.92 41.49 2oi4 s ASP 200 CO 0.00 0.29 0.61 0.12 0.70 0.00 0.00 175.17 176.89 2oi4 s PHE 201 N -0.74 -0.73 -0.33 2.11 5.36 -1.26 -5.04 117.98 117.35 2oi4 s PHE 201 Ca 0.11 1.70 0.15 0.00 -0.96 0.00 0.00 56.93 57.94 2oi4 s PHE 201 Cb -0.10 0.29 0.44 0.00 -0.34 0.00 0.00 43.02 43.31 2oi4 s PHE 201 CO 0.01 -0.36 1.36 -3.47 -1.46 0.00 0.00 175.22 171.30 2oi4 n ASP 202 N 3.07 -0.51 -0.33 6.13 4.64 -1.26 -5.09 116.55 123.20 2oi4 n ASP 202 Ca -0.15 -2.25 0.00 0.00 -1.38 0.00 0.00 54.79 51.01 2oi4 n ASP 202 Cb 0.56 0.34 0.00 0.00 -1.04 0.00 0.00 41.12 40.98 2oi4 n ASP 202 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 2oi4 n GLY 203 N -1.04 1.54 3.58 0.27 0.00 -1.26 -4.88 105.19 103.40 2oi4 n GLY 203 Ca -0.07 -1.65 -0.39 0.00 0.00 0.00 0.00 46.02 43.92 2oi4 n GLY 203 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2oi4 s THR 204 N 2.81 5.30 0.27 2.61 2.01 -1.26 -5.01 115.64 122.37 2oi4 s THR 204 Ca 0.00 0.08 -0.01 0.00 0.31 0.00 0.00 61.69 62.07 2oi4 s THR 204 Cb 0.00 -3.58 0.29 0.00 0.01 0.00 0.00 72.50 69.22 2oi4 s THR 204 CO 0.00 0.19 1.66 -0.09 -0.69 0.00 0.00 174.62 175.68 2oi4 h ARG 205 N 8.40 0.22 0.00 4.92 2.43 -1.96 -1.73 114.38 126.67 2oi4 h ARG 205 Ca -0.34 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.82 2oi4 h ARG 205 Cb 1.18 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 2oi4 h ARG 205 CO 0.57 0.15 0.00 1.33 -1.51 0.00 0.00 179.97 180.51 2oi4 n VAL 206 N -5.21 0.77 0.71 0.20 0.24 -1.26 -0.77 118.33 113.01 2oi4 n VAL 206 Ca 0.19 0.11 0.11 0.00 -2.04 0.00 0.00 64.34 62.70 2oi4 n VAL 206 Cb 0.60 -1.01 0.12 0.00 -1.47 0.00 0.00 33.84 32.07 2oi4 n VAL 206 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 2oi4 n TYR 207 N -2.20 0.13 -3.00 6.34 4.02 -0.68 -4.88 117.16 116.90 2oi4 n TYR 207 Ca 0.03 -0.07 -0.34 0.00 -0.01 0.00 0.00 57.90 57.50 2oi4 n TYR 207 Cb 0.27 -0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.53 2oi4 n TYR 207 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 2oi4 s SER 208 N -1.66 6.98 0.48 7.72 1.04 0.05 -3.99 113.70 124.32 2oi4 s SER 208 Ca 0.28 1.50 -0.06 0.00 0.48 0.00 0.00 55.95 58.15 2oi4 s SER 208 Cb 0.19 -2.46 -0.04 0.00 0.10 0.00 0.00 66.02 63.81 2oi4 s SER 208 CO 0.27 -0.15 0.80 -2.16 0.98 0.00 0.00 173.24 172.98 2oi4 s PRO 209 N -2.59 3.57 0.55 4.02 0.04 -1.26 -4.91 135.00 134.41 2oi4 s PRO 209 Ca 0.52 0.25 0.21 0.00 0.04 0.00 0.00 61.00 62.03 2oi4 s PRO 209 Cb -0.13 -2.36 1.49 0.00 0.04 0.00 0.00 34.50 33.53 2oi4 s PRO 209 CO 0.18 -0.21 2.19 -1.00 0.04 0.00 0.00 177.00 178.21 2oi4 h PRO 210 N 0.30 0.00 0.00 0.56 0.13 -1.90 -0.49 132.00 130.60 2oi4 h PRO 210 Ca -0.47 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.59 2oi4 h PRO 210 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 2oi4 h PRO 210 CO 0.62 0.00 -0.35 1.05 -0.23 0.00 0.00 178.00 179.09 2oi4 h GLU 211 N 0.00 0.00 0.15 0.86 9.09 -1.87 0.14 114.58 122.95 2oi4 h GLU 211 Ca 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.40 2oi4 h GLU 211 Cb 0.01 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.11 2oi4 h GLU 211 CO -0.00 0.35 -0.07 2.35 0.05 0.00 0.00 179.01 181.69 2oi4 h TRP 212 N 0.00 -0.18 -0.17 2.06 2.91 -1.12 -0.51 115.95 118.93 2oi4 h TRP 212 Ca -0.00 -0.00 0.05 0.00 1.13 0.00 0.00 58.89 60.06 2oi4 h TRP 212 Cb 0.73 0.06 -0.06 0.00 -0.51 0.00 0.00 29.16 29.37 2oi4 h TRP 212 CO 0.00 0.27 -0.26 0.82 -1.03 0.00 0.00 178.44 178.23 2oi4 h ILE 213 N -0.76 0.37 -0.15 2.65 1.08 -1.34 -0.18 117.51 119.19 2oi4 h ILE 213 Ca -0.02 0.00 -0.19 0.00 -0.39 0.00 0.00 64.86 64.26 2oi4 h ILE 213 Cb 0.53 0.37 0.00 0.00 -3.07 0.00 0.00 36.82 34.65 2oi4 h ILE 213 CO 0.03 0.00 -0.69 0.03 -0.69 0.00 0.00 178.15 176.84 2oi4 h ARG 214 N -0.31 0.61 0.00 2.37 3.08 -0.80 -3.40 114.38 115.93 2oi4 h ARG 214 Ca 0.11 -0.46 0.00 0.00 0.07 0.00 0.00 59.98 59.70 2oi4 h ARG 214 Cb 0.48 0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.62 2oi4 h ARG 214 CO -0.35 1.08 -0.20 0.66 -1.07 0.00 0.00 179.97 180.09 2oi4 n TYR 215 N -3.91 0.00 -2.91 3.04 4.02 -0.23 -5.02 117.16 112.15 2oi4 n TYR 215 Ca -0.05 0.00 -0.22 0.00 -0.01 0.00 0.00 57.90 57.62 2oi4 n TYR 215 Cb 0.69 0.00 0.03 0.00 -0.02 0.00 0.00 39.34 40.04 2oi4 n TYR 215 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 2oi4 n HIS 216 N -0.75 -1.81 -3.80 -0.72 8.25 -0.08 -4.98 115.22 111.33 2oi4 n HIS 216 Ca 0.00 0.43 -0.13 0.00 -0.26 0.00 0.00 57.72 57.76 2oi4 n HIS 216 Cb 0.00 -4.44 -0.14 0.00 1.12 0.00 0.00 29.99 26.52 2oi4 n HIS 216 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 2oi4 s ARG 217 N -5.59 0.06 0.17 -0.41 1.70 -1.22 -4.36 118.95 109.30 2oi4 s ARG 217 Ca 0.25 0.20 -0.16 0.00 -0.47 0.00 0.00 55.73 55.55 2oi4 s ARG 217 Cb -0.11 -0.08 0.03 0.00 -0.57 0.00 0.00 34.95 34.21 2oi4 s ARG 217 CO 0.31 -0.09 0.45 1.52 -1.08 0.00 0.00 175.30 176.41 2oi4 s TYR 218 N 0.59 -0.09 0.14 5.89 1.13 -0.83 -3.43 117.35 120.76 2oi4 s TYR 218 Ca -0.05 -0.25 0.09 0.00 -1.41 0.00 0.00 57.07 55.45 2oi4 s TYR 218 Cb -0.06 0.29 -0.04 0.00 -1.10 0.00 0.00 41.96 41.04 2oi4 s TYR 218 CO -0.02 -0.81 -0.15 -1.01 -2.51 0.00 0.00 175.55 171.04 2oi4 s HIS 219 N -3.86 2.56 0.06 -3.49 3.76 -1.26 -0.38 115.29 112.69 2oi4 s HIS 219 Ca 0.08 -0.25 -0.36 0.00 -0.15 0.00 0.00 55.06 54.38 2oi4 s HIS 219 Cb 0.01 -1.32 -0.20 0.00 1.11 0.00 0.00 32.58 32.18 2oi4 s HIS 219 CO -0.06 0.44 1.59 0.78 -0.85 0.00 0.00 174.74 176.64 2oi4 h GLY 220 N 3.42 -1.27 0.95 -2.22 0.00 -1.84 -2.43 103.07 99.68 2oi4 h GLY 220 Ca -0.48 0.47 -0.04 0.00 0.00 0.00 0.00 47.33 47.28 2oi4 h GLY 220 CO 0.49 -0.46 0.14 3.21 0.00 0.00 0.00 176.54 179.92 2oi4 h ARG 221 N -1.21 0.69 -0.01 4.80 3.08 -1.98 -0.74 114.38 119.01 2oi4 h ARG 221 Ca -0.12 -0.15 -0.12 0.00 0.07 0.00 0.00 59.98 59.66 2oi4 h ARG 221 Cb 0.93 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.86 2oi4 h ARG 221 CO 0.20 0.67 -0.57 0.66 -1.07 0.00 0.00 179.97 179.85 2oi4 h SER 222 N 0.58 0.04 0.97 7.04 4.64 -1.90 -0.14 113.55 124.77 2oi4 h SER 222 Ca 0.14 -0.02 -0.15 0.00 -0.47 0.00 0.00 61.79 61.30 2oi4 h SER 222 Cb 0.27 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.33 2oi4 h SER 222 CO -0.00 0.60 -0.70 0.00 -0.87 0.00 0.00 176.83 175.86 2oi4 h ALA 223 N 1.40 0.68 -0.11 5.18 0.00 -1.09 -2.70 119.26 122.62 2oi4 h ALA 223 Ca -0.01 -0.64 -0.04 0.00 0.00 0.00 0.00 54.91 54.23 2oi4 h ALA 223 Cb 1.02 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 2oi4 h ALA 223 CO 0.08 0.87 -0.08 0.00 0.00 0.00 0.00 179.25 180.12 2oi4 h ALA 224 N 1.30 0.16 -0.65 0.00 0.00 -0.72 -2.65 119.26 116.70 2oi4 h ALA 224 Ca -0.01 -0.28 0.11 0.00 0.00 0.00 0.00 54.91 54.74 2oi4 h ALA 224 Cb 1.37 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 19.04 2oi4 h ALA 224 CO 0.09 -0.02 0.22 0.28 0.00 0.00 0.00 179.25 179.82 2oi4 h VAL 225 N -0.12 0.70 -0.03 0.00 2.07 -1.05 -0.72 116.25 117.11 2oi4 h VAL 225 Ca 0.02 -0.13 0.03 0.00 0.82 0.00 0.00 66.70 67.44 2oi4 h VAL 225 Cb 0.57 0.28 -0.04 0.00 -1.52 0.00 0.00 31.29 30.58 2oi4 h VAL 225 CO 0.02 0.07 -0.20 -0.25 0.02 0.00 0.00 177.57 177.23 2oi4 h TRP 226 N 0.38 -0.52 -0.20 1.57 2.91 -1.36 -1.53 115.95 117.20 2oi4 h TRP 226 Ca 0.34 0.02 -0.01 0.00 1.13 0.00 0.00 58.89 60.38 2oi4 h TRP 226 Cb 0.48 0.23 -0.01 0.00 -0.51 0.00 0.00 29.16 29.35 2oi4 h TRP 226 CO -0.19 -0.28 0.09 0.66 -1.03 0.00 0.00 178.44 177.69 2oi4 h SER 227 N -0.30 0.24 0.03 2.65 4.64 -1.10 0.18 113.55 119.89 2oi4 h SER 227 Ca 0.07 -0.01 -0.09 0.00 -0.47 0.00 0.00 61.79 61.28 2oi4 h SER 227 Cb 0.39 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.41 2oi4 h SER 227 CO -0.20 0.21 -0.27 -0.07 -0.87 0.00 0.00 176.83 175.63 2oi4 h LEU 228 N 0.27 0.37 -0.57 5.97 3.38 -0.50 -1.37 115.31 122.87 2oi4 h LEU 228 Ca 0.07 -0.12 -0.14 0.00 0.09 0.00 0.00 57.88 57.78 2oi4 h LEU 228 Cb 0.04 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2oi4 h LEU 228 CO -0.01 0.64 -0.36 1.23 0.09 0.00 0.00 178.44 180.03 2oi4 h GLY 229 N 1.02 0.81 1.00 0.83 0.00 0.29 -1.47 103.07 105.55 2oi4 h GLY 229 Ca 0.05 -0.79 0.00 0.00 0.00 0.00 0.00 47.33 46.59 2oi4 h GLY 229 CO 0.05 0.72 0.34 -2.22 0.00 0.00 0.00 176.54 175.42 2oi4 h ILE 230 N 0.62 1.13 -0.52 2.60 1.08 -0.95 -1.49 117.51 119.97 2oi4 h ILE 230 Ca 0.06 -0.24 -0.11 0.00 -0.39 0.00 0.00 64.86 64.18 2oi4 h ILE 230 Cb 0.90 0.38 -0.02 0.00 -3.07 0.00 0.00 36.82 35.02 2oi4 h ILE 230 CO 0.08 0.13 -0.12 0.25 -0.69 0.00 0.00 178.15 177.80 2oi4 h LEU 231 N 0.69 1.01 -0.35 1.44 5.85 -1.07 -0.78 115.31 122.11 2oi4 h LEU 231 Ca 0.19 -0.36 -0.12 0.00 0.84 0.00 0.00 57.88 58.43 2oi4 h LEU 231 Cb -0.08 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.67 2oi4 h LEU 231 CO -0.04 1.14 -0.24 0.25 -0.34 0.00 0.00 178.44 179.21 2oi4 h LEU 232 N 0.88 0.81 -0.13 2.25 5.85 -1.21 0.39 115.31 124.16 2oi4 h LEU 232 Ca 0.13 -0.43 0.01 0.00 0.84 0.00 0.00 57.88 58.43 2oi4 h LEU 232 Cb 0.69 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 2oi4 h LEU 232 CO 0.05 1.08 0.04 0.22 -0.34 0.00 0.00 178.44 179.49 2oi4 h TYR 233 N 0.56 0.08 -0.69 1.25 5.03 -1.08 -2.31 116.97 119.81 2oi4 h TYR 233 Ca 0.07 0.01 0.12 0.00 2.58 0.00 0.00 58.73 61.51 2oi4 h TYR 233 Cb 0.80 -0.02 -0.09 0.00 1.55 0.00 0.00 36.73 38.98 2oi4 h TYR 233 CO 0.06 0.04 0.26 0.22 -1.32 0.00 0.00 178.16 177.43 2oi4 h ASP 234 N 0.11 0.24 -0.21 -2.11 3.58 -0.95 -0.84 116.42 116.23 2oi4 h ASP 234 Ca 0.05 0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.60 2oi4 h ASP 234 Cb 0.03 0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.14 2oi4 h ASP 234 CO -0.05 0.12 0.13 0.24 -2.88 0.00 0.00 179.24 176.80 2oi4 h MET 235 N 0.43 0.27 -0.00 0.28 2.86 -0.62 0.46 114.93 118.60 2oi4 h MET 235 Ca 0.37 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.99 2oi4 h MET 235 Cb 0.51 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.11 2oi4 h MET 235 CO -0.37 0.18 -0.22 1.33 1.06 0.00 0.00 176.91 178.89 2oi4 n VAL 236 N -4.95 0.00 -0.00 -2.22 0.24 -0.90 0.25 118.33 110.75 2oi4 n VAL 236 Ca -0.03 -0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.27 2oi4 n VAL 236 Cb 0.03 -0.16 -0.01 0.00 -1.47 0.00 0.00 33.84 32.23 2oi4 n VAL 236 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2oi4 n GLY 238 N 2.63 0.75 3.35 0.00 0.00 0.15 -4.57 105.19 107.51 2oi4 n GLY 238 Ca -0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.90 2oi4 n GLY 238 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2oi4 s ASP 239 N -2.79 -0.36 0.41 1.61 -1.08 -1.23 -4.80 116.67 108.45 2oi4 s ASP 239 Ca 0.00 -0.19 -0.23 0.00 -0.52 0.00 0.00 52.55 51.61 2oi4 s ASP 239 Cb 0.00 0.52 -0.09 0.00 -1.46 0.00 0.00 42.92 41.88 2oi4 s ASP 239 CO 0.00 -0.89 1.02 0.27 0.52 0.00 0.00 175.17 176.09 2oi4 s ILE 240 N -3.74 3.89 0.34 4.11 -4.36 -1.26 -3.31 121.20 116.88 2oi4 s ILE 240 Ca 0.02 1.37 0.11 0.00 -0.26 0.00 0.00 60.65 61.89 2oi4 s ILE 240 Cb 0.01 -3.67 0.06 0.00 1.25 0.00 0.00 42.46 40.11 2oi4 s ILE 240 CO -0.12 -0.07 1.77 1.55 0.24 0.00 0.00 174.94 178.32 2oi4 h PRO 241 N 2.33 0.04 -4.79 0.37 0.13 -1.92 -3.45 132.00 124.69 2oi4 h PRO 241 Ca -0.48 -0.02 -0.49 0.00 -0.87 0.00 0.00 66.00 64.14 2oi4 h PRO 241 Cb 1.21 -0.00 -0.32 0.00 0.13 0.00 0.00 31.00 32.02 2oi4 h PRO 241 CO 0.62 0.45 -0.81 -0.06 -0.23 0.00 0.00 178.00 177.97 2oi4 s PHE 242 N -4.09 1.29 -0.18 1.56 2.99 -1.26 -4.92 117.98 113.36 2oi4 s PHE 242 Ca -0.03 -0.37 -0.01 0.00 0.00 0.00 0.00 56.93 56.52 2oi4 s PHE 242 Cb 0.14 -0.91 -0.11 0.00 0.00 0.00 0.00 43.02 42.15 2oi4 s PHE 242 CO 0.74 -0.16 -0.17 -1.91 -0.00 0.00 0.00 175.22 173.72 2oi4 n GLU 243 N 3.37 0.43 -4.16 0.44 4.07 -1.26 -4.94 120.64 118.58 2oi4 n GLU 243 Ca -0.19 0.11 -0.24 0.00 -0.06 0.00 0.00 57.16 56.78 2oi4 n GLU 243 Cb 0.53 -1.31 -0.06 0.00 -0.06 0.00 0.00 31.44 30.54 2oi4 n GLU 243 CO 0.00 0.00 0.00 -1.01 -0.06 0.00 0.00 177.13 176.06 2oi4 s HIS 244 N -2.35 2.99 0.42 4.31 3.76 -1.26 -4.92 115.29 118.25 2oi4 s HIS 244 Ca -0.24 -0.12 0.25 0.00 -0.15 0.00 0.00 55.06 54.80 2oi4 s HIS 244 Cb 0.07 -1.38 1.28 0.00 1.11 0.00 0.00 32.58 33.66 2oi4 s HIS 244 CO 0.39 0.54 1.69 -0.44 -0.85 0.00 0.00 174.74 176.06 2oi4 h ASP 245 N 1.97 0.33 -0.24 1.40 3.45 -1.98 -1.99 116.42 119.36 2oi4 h ASP 245 Ca -0.47 0.12 -0.20 0.00 0.43 0.00 0.00 57.03 56.91 2oi4 h ASP 245 Cb 1.23 0.08 0.00 0.00 -0.56 0.00 0.00 39.33 40.08 2oi4 h ASP 245 CO 0.61 -0.07 -0.62 -0.33 -1.57 0.00 0.00 179.24 177.26 2oi4 h GLU 246 N 0.22 0.84 -0.06 3.56 3.07 -1.98 -1.81 114.58 118.41 2oi4 h GLU 246 Ca 0.72 -0.59 -0.00 0.00 -0.50 0.00 0.00 59.36 58.99 2oi4 h GLU 246 Cb 2.09 0.09 -0.00 0.00 -0.84 0.00 0.00 28.75 30.09 2oi4 h GLU 246 CO -0.37 1.21 0.04 0.93 -1.40 0.00 0.00 179.01 179.41 2oi4 h GLU 247 N 0.61 0.09 -0.02 2.33 5.08 -1.78 -0.75 114.58 120.13 2oi4 h GLU 247 Ca -0.01 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.38 2oi4 h GLU 247 Cb 1.24 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.42 2oi4 h GLU 247 CO 0.13 0.12 -0.32 0.82 -1.00 0.00 0.00 179.01 178.76 2oi4 h ILE 248 N 0.03 0.30 0.00 3.13 2.04 -1.29 0.13 117.51 121.85 2oi4 h ILE 248 Ca 0.02 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.86 2oi4 h ILE 248 Cb 0.06 0.30 -0.00 0.00 -0.74 0.00 0.00 36.82 36.44 2oi4 h ILE 248 CO -0.00 0.00 -0.09 0.16 0.00 0.00 0.00 178.15 178.22 2oi4 h ILE 249 N -0.46 0.21 0.00 -0.67 3.07 -1.38 -2.26 117.51 116.02 2oi4 h ILE 249 Ca 0.07 -0.82 -0.17 0.00 1.55 0.00 0.00 64.86 65.49 2oi4 h ILE 249 Cb 0.55 1.68 -0.02 0.00 -0.27 0.00 0.00 36.82 38.76 2oi4 h ILE 249 CO -0.28 0.09 -0.80 1.23 -1.05 0.00 0.00 178.15 177.34 2oi4 h GLY 250 N 2.33 0.00 -2.48 0.16 0.00 -0.67 -3.48 103.07 98.93 2oi4 h GLY 250 Ca -0.00 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.07 2oi4 h GLY 250 CO 0.01 0.00 -0.28 0.61 0.00 0.00 0.00 176.54 176.89 2oi4 n GLY 251 N 0.90 0.44 3.69 4.60 0.00 -0.01 -4.96 105.19 109.84 2oi4 n GLY 251 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2oi4 n GLY 251 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2oi4 s GLN 252 N -3.96 4.43 -0.35 1.61 -0.21 -1.26 -4.95 119.66 114.97 2oi4 s GLN 252 Ca 0.00 1.29 -0.13 0.00 0.02 0.00 0.00 55.36 56.55 2oi4 s GLN 252 Cb 0.00 -3.52 -0.01 0.00 1.00 0.00 0.00 33.01 30.48 2oi4 s GLN 252 CO 0.00 -0.22 0.24 0.08 -2.12 0.00 0.00 175.29 173.26 2oi4 s VAL 253 N 1.70 5.13 -0.23 1.09 1.01 -1.26 -5.02 120.40 122.82 2oi4 s VAL 253 Ca 0.47 -0.37 -0.09 0.00 0.00 0.00 0.00 61.98 61.98 2oi4 s VAL 253 Cb -0.19 -3.69 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 2oi4 s VAL 253 CO 0.19 -0.07 0.12 -0.36 0.00 0.00 0.00 175.10 174.99 2oi4 s PHE 254 N 1.69 3.25 -0.26 5.22 0.40 -1.26 -5.08 117.98 121.93 2oi4 s PHE 254 Ca 0.05 0.06 -0.20 0.00 -0.60 0.00 0.00 56.93 56.25 2oi4 s PHE 254 Cb -0.18 -2.23 -0.02 0.00 0.51 0.00 0.00 43.02 41.10 2oi4 s PHE 254 CO 0.10 -0.02 0.61 -0.06 0.70 0.00 0.00 175.22 176.55 2oi4 s PHE 255 N 1.08 3.28 -0.27 0.36 0.08 -1.26 -4.95 117.98 116.30 2oi4 s PHE 255 Ca 0.06 0.79 0.22 0.00 0.12 0.00 0.00 56.93 58.12 2oi4 s PHE 255 Cb -0.14 -2.82 0.06 0.00 -0.57 0.00 0.00 43.02 39.55 2oi4 s PHE 255 CO 0.04 -0.32 1.15 0.07 -0.10 0.00 0.00 175.22 176.06 2oi4 h ARG 256 N 7.92 0.00 -6.01 0.44 0.11 -1.98 -3.47 114.38 111.39 2oi4 h ARG 256 Ca -0.27 0.00 -0.58 0.00 0.10 0.00 0.00 59.98 59.23 2oi4 h ARG 256 Cb 1.13 0.00 -0.11 0.00 1.11 0.00 0.00 29.97 32.10 2oi4 h ARG 256 CO 0.76 0.01 -0.61 -0.65 0.10 0.00 0.00 179.97 179.58 2oi4 s GLN 257 N -3.32 2.08 -0.06 0.08 -1.52 -1.26 -5.10 119.66 110.56 2oi4 s GLN 257 Ca 0.01 -1.75 -0.30 0.00 -1.95 0.00 0.00 55.36 51.37 2oi4 s GLN 257 Cb 0.09 -1.93 -0.06 0.00 -0.22 0.00 0.00 33.01 30.89 2oi4 s GLN 257 CO 0.77 0.13 1.70 0.50 -0.25 0.00 0.00 175.29 178.13 2oi4 s ARG 258 N -3.72 4.12 -0.02 2.91 6.06 -1.26 -5.01 118.95 122.03 2oi4 s ARG 258 Ca 0.35 2.18 0.02 0.00 -2.50 0.00 0.00 55.73 55.78 2oi4 s ARG 258 Cb 0.00 -4.02 0.01 0.00 0.06 0.00 0.00 34.95 31.00 2oi4 s ARG 258 CO 0.19 -0.93 -0.06 0.08 -2.50 0.00 0.00 175.30 172.09 2oi4 s VAL 259 N 4.28 0.55 0.73 7.11 1.01 -1.26 -5.03 120.40 127.79 2oi4 s VAL 259 Ca 0.75 -0.23 -0.16 0.00 0.00 0.00 0.00 61.98 62.34 2oi4 s VAL 259 Cb -0.34 -0.51 0.01 0.00 0.00 0.00 0.00 36.38 35.55 2oi4 s VAL 259 CO 0.31 0.18 1.01 -1.54 0.00 0.00 0.00 175.10 175.06 2oi4 n SER 260 N 3.34 0.61 -0.22 3.32 3.41 -1.26 -4.74 113.62 118.09 2oi4 n SER 260 Ca -0.18 0.67 0.04 0.00 -0.26 0.00 0.00 58.87 59.14 2oi4 n SER 260 Cb 0.55 -1.42 0.30 0.00 -0.26 0.00 0.00 64.21 63.37 2oi4 n SER 260 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2oi4 h SER 261 N -0.28 0.78 -0.09 4.04 0.02 -2.00 -0.46 113.55 115.56 2oi4 h SER 261 Ca -0.47 -0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 60.28 2oi4 h SER 261 Cb 1.33 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 63.70 2oi4 h SER 261 CO 0.47 0.52 -0.64 1.05 -1.14 0.00 0.00 176.83 177.09 2oi4 h GLU 262 N 0.89 0.71 0.24 3.45 4.11 -1.99 -1.55 114.58 120.43 2oi4 h GLU 262 Ca 0.32 -0.50 -0.01 0.00 0.07 0.00 0.00 59.36 59.24 2oi4 h GLU 262 Cb 0.14 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2oi4 h GLU 262 CO -0.10 1.12 -0.11 0.00 0.07 0.00 0.00 179.01 179.98 2oi4 h GLN 264 N -0.53 0.60 0.11 0.00 4.20 -1.11 -1.50 115.11 116.87 2oi4 h GLN 264 Ca -0.03 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 2oi4 h GLN 264 Cb 0.39 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.04 2oi4 h GLN 264 CO 0.05 0.40 -0.05 1.25 -0.67 0.00 0.00 178.83 179.81 2oi4 h HIS 265 N 0.62 -0.13 -0.10 2.96 2.76 -1.09 -1.61 115.15 118.55 2oi4 h HIS 265 Ca 0.62 -0.00 0.04 0.00 -2.20 0.00 0.00 60.37 58.83 2oi4 h HIS 265 Cb 1.15 0.04 -0.05 0.00 1.55 0.00 0.00 27.41 30.10 2oi4 h HIS 265 CO -0.01 0.11 -0.21 1.25 -1.30 0.00 0.00 177.93 177.77 2oi4 h LEU 266 N -0.36 -0.65 -0.78 0.26 5.85 -1.05 0.15 115.31 118.72 2oi4 h LEU 266 Ca -0.01 0.11 0.17 0.00 0.84 0.00 0.00 57.88 58.98 2oi4 h LEU 266 Cb 0.30 0.29 -0.11 0.00 0.37 0.00 0.00 40.66 41.51 2oi4 h LEU 266 CO 0.02 -0.27 0.26 0.40 -0.34 0.00 0.00 178.44 178.51 2oi4 h ILE 267 N -0.28 0.54 0.00 4.05 2.04 -1.28 -1.08 117.51 121.50 2oi4 h ILE 267 Ca 0.09 -0.12 -0.19 0.00 1.00 0.00 0.00 64.86 65.64 2oi4 h ILE 267 Cb 0.42 0.17 -0.03 0.00 -0.74 0.00 0.00 36.82 36.64 2oi4 h ILE 267 CO -0.27 0.06 -0.91 0.03 0.00 0.00 0.00 178.15 177.06 2oi4 h ARG 268 N 0.34 0.02 0.44 2.37 3.08 -0.89 -1.39 114.38 118.35 2oi4 h ARG 268 Ca 0.45 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.46 2oi4 h ARG 268 Cb 0.77 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.82 2oi4 h ARG 268 CO -0.49 0.91 -0.25 2.35 -1.07 0.00 0.00 179.97 181.42 2oi4 h TRP 269 N 0.01 -0.65 -0.26 3.04 7.01 -0.40 -2.75 115.95 121.95 2oi4 h TRP 269 Ca -0.01 -0.01 0.08 0.00 2.11 0.00 0.00 58.89 61.05 2oi4 h TRP 269 Cb 1.60 0.23 -0.01 0.00 -2.10 0.00 0.00 29.16 28.88 2oi4 h TRP 269 CO 0.00 -0.39 0.20 0.00 -2.79 0.00 0.00 178.44 175.46 2oi4 n LEU 271 N -4.33 5.74 -4.64 0.00 4.77 -0.54 -3.77 117.00 114.23 2oi4 n LEU 271 Ca 0.03 -3.20 -0.47 0.00 -0.03 0.00 0.00 56.01 52.35 2oi4 n LEU 271 Cb 0.35 -0.71 -0.04 0.00 -2.33 0.00 0.00 43.42 40.69 2oi4 n LEU 271 CO 0.34 0.80 0.97 0.00 -1.33 0.00 0.00 177.39 178.17 2oi4 n ALA 272 N -0.14 0.44 -0.23 -1.18 0.00 -0.88 -4.92 120.51 113.60 2oi4 n ALA 272 Ca 0.37 0.45 -0.07 0.00 0.00 0.00 0.00 53.44 54.19 2oi4 n ALA 272 Cb 1.30 -2.21 0.04 0.00 0.00 0.00 0.00 19.45 18.58 2oi4 n ALA 272 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2oi4 h LEU 273 N 4.48 0.84 -9.22 0.00 3.38 -1.92 -3.39 115.31 109.47 2oi4 h LEU 273 Ca -0.45 -0.13 -0.56 0.00 0.09 0.00 0.00 57.88 56.83 2oi4 h LEU 273 Cb 1.29 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.79 2oi4 h LEU 273 CO 0.78 0.73 0.68 -0.60 0.09 0.00 0.00 178.44 180.12 2oi4 s ARG 274 N -5.73 4.35 0.29 1.13 3.52 -1.26 -4.79 118.95 116.46 2oi4 s ARG 274 Ca -0.13 1.48 0.03 0.00 -0.13 0.00 0.00 55.73 56.98 2oi4 s ARG 274 Cb 0.14 -3.59 0.73 0.00 -1.56 0.00 0.00 34.95 30.67 2oi4 s ARG 274 CO 0.79 -0.45 1.68 -1.35 -0.81 0.00 0.00 175.30 175.16 2oi4 h PRO 275 N 7.36 0.32 0.00 5.12 0.11 -1.96 -1.48 132.00 141.48 2oi4 h PRO 275 Ca -0.29 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.80 2oi4 h PRO 275 Cb 1.13 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2oi4 h PRO 275 CO 0.90 0.21 0.00 -1.13 -0.21 0.00 0.00 178.00 177.77 2oi4 n SER 276 N -5.11 0.00 -0.11 -2.05 3.41 -1.26 -2.37 113.62 106.13 2oi4 n SER 276 Ca 0.22 0.43 0.14 0.00 -0.26 0.00 0.00 58.87 59.40 2oi4 n SER 276 Cb 0.67 -0.47 0.58 0.00 -0.26 0.00 0.00 64.21 64.73 2oi4 n SER 276 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2oi4 n ASP 277 N -1.47 0.48 -4.82 4.04 8.00 -0.56 -4.93 116.55 117.28 2oi4 n ASP 277 Ca 0.07 -0.52 -0.33 0.00 0.71 0.00 0.00 54.79 54.72 2oi4 n ASP 277 Cb 0.28 -0.07 -0.05 0.00 -0.02 0.00 0.00 41.12 41.25 2oi4 n ASP 277 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2oi4 s ARG 278 N -2.53 4.06 0.63 -1.24 0.52 -1.00 -4.84 118.95 114.56 2oi4 s ARG 278 Ca 0.27 1.09 -0.16 0.00 -0.52 0.00 0.00 55.73 56.42 2oi4 s ARG 278 Cb 0.20 -2.15 -0.01 0.00 0.52 0.00 0.00 34.95 33.50 2oi4 s ARG 278 CO 0.49 -0.18 1.10 -1.25 0.02 0.00 0.00 175.30 175.49 2oi4 s PRO 279 N -3.51 2.97 0.89 3.54 0.04 -1.26 -5.04 135.00 132.62 2oi4 s PRO 279 Ca 0.62 1.39 -0.12 0.00 0.04 0.00 0.00 61.00 62.92 2oi4 s PRO 279 Cb -0.10 -1.97 0.12 0.00 0.04 0.00 0.00 34.50 32.59 2oi4 s PRO 279 CO 0.21 -1.12 1.12 0.95 0.04 0.00 0.00 177.00 178.20 2oi4 s THR 280 N -2.28 2.31 0.30 1.26 -4.23 -1.26 -4.87 115.64 106.87 2oi4 s THR 280 Ca 0.67 0.10 0.05 0.00 -1.18 0.00 0.00 61.69 61.33 2oi4 s THR 280 Cb -0.20 -2.82 0.30 0.00 1.34 0.00 0.00 72.50 71.12 2oi4 s THR 280 CO 0.39 -0.13 1.81 -0.26 -0.54 0.00 0.00 174.62 175.88 2oi4 h PHE 281 N -1.42 1.06 -0.22 3.99 0.05 -1.97 -1.66 116.94 116.77 2oi4 h PHE 281 Ca -0.50 0.03 -0.01 0.00 3.82 0.00 0.00 57.97 61.31 2oi4 h PHE 281 Cb 1.31 -0.33 -0.01 0.00 2.00 0.00 0.00 35.95 38.93 2oi4 h PHE 281 CO 0.34 0.31 0.09 1.49 -0.18 0.00 0.00 178.31 180.36 2oi4 h GLU 282 N 0.83 0.33 -0.80 1.51 4.81 -1.98 -1.74 114.58 117.53 2oi4 h GLU 282 Ca 0.54 -0.06 0.04 0.00 -0.13 0.00 0.00 59.36 59.75 2oi4 h GLU 282 Cb 0.76 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 30.04 2oi4 h GLU 282 CO -0.32 0.39 0.50 0.93 -0.73 0.00 0.00 179.01 179.78 2oi4 h GLU 283 N 0.20 0.93 0.38 1.92 5.08 -1.87 0.15 114.58 121.37 2oi4 h GLU 283 Ca 0.07 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 2oi4 h GLU 283 Cb 0.18 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 2oi4 h GLU 283 CO -0.01 0.62 -0.34 0.82 -1.00 0.00 0.00 179.01 179.10 2oi4 h ILE 284 N 0.96 0.30 0.00 3.13 2.04 -1.15 -1.95 117.51 120.84 2oi4 h ILE 284 Ca 0.33 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.18 2oi4 h ILE 284 Cb 0.07 0.30 -0.00 0.00 -0.74 0.00 0.00 36.82 36.46 2oi4 h ILE 284 CO -0.14 0.00 -0.08 1.56 0.00 0.00 0.00 178.15 179.49 2oi4 h GLN 285 N -0.73 0.00 -0.01 2.37 4.20 -1.15 -0.92 115.11 118.87 2oi4 h GLN 285 Ca -0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.68 2oi4 h GLN 285 Cb 0.65 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.43 2oi4 h GLN 285 CO -0.04 0.08 -0.14 0.09 -0.67 0.00 0.00 178.83 178.15 2oi4 n ASN 286 N -3.28 0.69 -4.77 1.46 3.02 0.50 -4.78 115.26 108.10 2oi4 n ASN 286 Ca -0.00 -0.74 -0.40 0.00 -0.03 0.00 0.00 54.58 53.40 2oi4 n ASN 286 Cb 0.30 -0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.47 2oi4 n ASN 286 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 2oi4 s HIS 287 N -2.44 2.57 0.33 3.10 2.46 -0.35 -4.91 115.29 116.05 2oi4 s HIS 287 Ca 0.29 1.25 0.10 0.00 0.47 0.00 0.00 55.06 57.16 2oi4 s HIS 287 Cb 0.20 -3.93 0.89 0.00 -0.13 0.00 0.00 32.58 29.61 2oi4 s HIS 287 CO 0.48 -2.83 1.75 -1.35 -2.47 0.00 0.00 174.74 170.32 2oi4 h PRO 288 N 2.69 0.57 0.00 2.88 0.11 -1.91 -1.03 132.00 135.31 2oi4 h PRO 288 Ca -0.51 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.56 2oi4 h PRO 288 Cb 1.25 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 2oi4 h PRO 288 CO 0.63 0.38 -0.03 2.35 -0.21 0.00 0.00 178.00 181.11 2oi4 h TRP 289 N 0.59 0.00 -0.06 0.65 7.01 -1.91 -2.99 115.95 119.24 2oi4 h TRP 289 Ca 0.62 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.62 2oi4 h TRP 289 Cb 1.20 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.26 2oi4 h TRP 289 CO -0.01 0.03 0.00 -1.33 -2.79 0.00 0.00 178.44 174.35 2oi4 n MET 290 N -3.63 1.84 -2.41 2.65 2.81 -0.39 -4.95 117.12 113.04 2oi4 n MET 290 Ca -0.03 -1.23 -0.33 0.00 -1.81 0.00 0.00 57.70 54.30 2oi4 n MET 290 Cb 0.13 -1.46 -0.02 0.00 -0.71 0.00 0.00 33.22 31.15 2oi4 n MET 290 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 2oi4 s GLN 291 N -1.94 3.71 -1.20 0.03 -1.52 -1.13 -4.17 119.66 113.44 2oi4 s GLN 291 Ca 0.35 1.25 -0.02 0.00 -1.95 0.00 0.00 55.36 54.99 2oi4 s GLN 291 Cb 0.20 -2.09 0.00 0.00 -0.22 0.00 0.00 33.01 30.91 2oi4 s GLN 291 CO 0.32 -0.49 1.02 -0.25 -0.25 0.00 0.00 175.29 175.63 2oi4 n ASP 292 N -1.31 -3.20 -4.78 5.90 8.00 -1.26 -4.96 116.55 114.94 2oi4 n ASP 292 Ca 0.09 -0.58 -0.36 0.00 0.71 0.00 0.00 54.79 54.65 2oi4 n ASP 292 Cb 0.53 -4.95 -0.02 0.00 -0.02 0.00 0.00 41.12 36.66 2oi4 n ASP 292 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2oi4 s VAL 293 N -3.34 3.38 0.61 2.53 0.11 -1.26 -5.01 120.40 117.42 2oi4 s VAL 293 Ca 0.16 0.93 -0.15 0.00 -2.93 0.00 0.00 61.98 59.99 2oi4 s VAL 293 Cb -0.07 -3.42 -0.03 0.00 -1.53 0.00 0.00 36.38 31.33 2oi4 s VAL 293 CO 0.71 -0.11 1.06 -0.76 -3.33 0.00 0.00 175.10 172.67 2oi4 s LEU 294 N -3.34 3.46 0.64 2.54 1.43 -1.26 -5.05 118.68 117.09 2oi4 s LEU 294 Ca 0.67 1.82 -0.16 0.00 -1.03 0.00 0.00 54.13 55.43 2oi4 s LEU 294 Cb -0.23 -4.53 -0.01 0.00 0.03 0.00 0.00 46.19 41.44 2oi4 s LEU 294 CO 0.27 -1.24 1.13 -0.76 0.23 0.00 0.00 176.35 175.99 2oi4 s LEU 295 N -4.61 3.48 0.23 1.79 1.43 -1.26 -4.85 118.68 114.89 2oi4 s LEU 295 Ca 0.64 2.10 -0.06 0.00 -1.03 0.00 0.00 54.13 55.77 2oi4 s LEU 295 Cb -0.16 -4.56 0.39 0.00 0.03 0.00 0.00 46.19 41.88 2oi4 s LEU 295 CO 0.39 -1.59 1.74 -0.65 0.23 0.00 0.00 176.35 176.46 2oi4 h PRO 296 N 0.32 0.45 -0.37 1.29 0.11 -1.85 0.99 132.00 132.93 2oi4 h PRO 296 Ca -0.48 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.57 2oi4 h PRO 296 Cb 1.26 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 2oi4 h PRO 296 CO 0.54 0.30 0.08 0.37 -0.21 0.00 0.00 178.00 179.08 2oi4 h GLN 297 N 0.46 0.60 -0.86 1.05 5.75 -1.86 -1.79 115.11 118.46 2oi4 h GLN 297 Ca 0.38 -0.15 0.00 0.00 -0.15 0.00 0.00 58.65 58.73 2oi4 h GLN 297 Cb 0.52 -0.08 -0.04 0.00 1.07 0.00 0.00 27.48 28.95 2oi4 h GLN 297 CO -0.36 0.65 0.54 0.93 -2.65 0.00 0.00 178.83 177.94 2oi4 h GLU 298 N 0.45 1.15 -0.05 1.69 5.08 -1.78 -1.85 114.58 119.27 2oi4 h GLU 298 Ca 0.11 -0.09 0.02 0.00 -1.00 0.00 0.00 59.36 58.41 2oi4 h GLU 298 Cb 0.33 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 2oi4 h GLU 298 CO 0.00 0.78 -0.07 1.15 -1.00 0.00 0.00 179.01 179.87 2oi4 h THR 299 N 1.17 0.80 -0.73 1.13 2.02 -0.46 -1.90 112.91 114.95 2oi4 h THR 299 Ca 0.31 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.43 2oi4 h THR 299 Cb -0.09 0.80 -0.03 0.00 -1.74 0.00 0.00 68.15 67.09 2oi4 h THR 299 CO -0.06 0.00 0.23 0.00 0.37 0.00 0.00 175.52 176.06 2oi4 h ALA 300 N 0.93 0.96 -0.29 6.16 0.00 -1.02 0.02 119.26 126.02 2oi4 h ALA 300 Ca 0.05 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.75 2oi4 h ALA 300 Cb 0.17 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2oi4 h ALA 300 CO -0.11 0.64 0.14 0.93 0.00 0.00 0.00 179.25 180.85 2oi4 h GLU 301 N 1.08 0.29 0.19 0.00 5.08 -1.18 0.92 114.58 120.97 2oi4 h GLU 301 Ca 0.24 -0.02 -0.30 0.00 -1.00 0.00 0.00 59.36 58.28 2oi4 h GLU 301 Cb 0.30 -0.07 0.02 0.00 0.50 0.00 0.00 28.75 29.51 2oi4 h GLU 301 CO -0.01 0.19 -1.41 0.82 -1.00 0.00 0.00 179.01 177.61 2oi4 h ILE 302 N 0.30 1.19 0.00 3.13 2.04 -1.30 -3.39 117.51 119.49 2oi4 h ILE 302 Ca 0.12 -2.56 -0.10 0.00 1.00 0.00 0.00 64.86 63.31 2oi4 h ILE 302 Cb 0.04 2.95 -0.02 0.00 -0.74 0.00 0.00 36.82 39.05 2oi4 h ILE 302 CO -0.08 0.79 -1.51 1.41 0.00 0.00 0.00 178.15 178.75 2oi4 n HIS 303 N -3.81 0.00 -0.02 1.37 8.25 -0.01 -4.80 115.22 116.21 2oi4 n HIS 303 Ca -0.20 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.28 2oi4 n HIS 303 Cb 1.00 -0.34 -0.07 0.00 1.12 0.00 0.00 29.99 31.70 2oi4 n HIS 303 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2oi4 n LEU 304 N -2.14 0.00 -4.71 2.41 4.77 0.12 -4.98 117.00 112.47 2oi4 n LEU 304 Ca -0.10 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.47 2oi4 n LEU 304 Cb 0.59 0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.73 2oi4 n LEU 304 CO 0.18 0.07 0.74 -1.00 -1.33 0.00 0.00 177.39 176.06 2oi4 s HIS 305 N -2.51 3.61 0.00 -1.77 3.76 0.30 -4.97 115.29 113.70 2oi4 s HIS 305 Ca -0.04 1.59 0.00 0.00 -0.15 0.00 0.00 55.06 56.46 2oi4 s HIS 305 Cb 0.05 -3.21 0.00 0.00 1.11 0.00 0.00 32.58 30.53 2oi4 s HIS 305 CO 0.39 -0.39 0.00 -1.13 -0.85 0.00 0.00 174.74 172.76