#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2uxt s GLN 32 N 0.00 3.95 0.51 3.69 -1.52 -1.26 -4.81 119.66 120.22 2uxt s GLN 32 Ca 0.00 0.93 -0.19 0.00 -1.95 0.00 0.00 55.36 54.15 2uxt s GLN 32 Cb 0.00 -2.16 -0.07 0.00 -0.22 0.00 0.00 33.01 30.56 2uxt s GLN 32 CO 0.00 -0.24 1.02 -1.25 -0.25 0.00 0.00 175.29 174.57 2uxt s PRO 33 N -4.00 3.75 -0.10 2.91 0.04 -1.26 -0.85 135.00 135.50 2uxt s PRO 33 Ca 0.59 1.22 -0.30 0.00 0.04 0.00 0.00 61.00 62.55 2uxt s PRO 33 Cb -0.10 -2.10 -0.03 0.00 0.04 0.00 0.00 34.50 32.31 2uxt s PRO 33 CO 0.30 -0.45 1.36 -1.17 0.04 0.00 0.00 177.00 177.08 2uxt s LEU 34 N -3.81 4.25 0.30 -3.56 2.96 0.27 -4.72 118.68 114.37 2uxt s LEU 34 Ca 0.64 1.90 -0.29 0.00 -0.22 0.00 0.00 54.13 56.16 2uxt s LEU 34 Cb -0.14 -3.54 -0.10 0.00 0.50 0.00 0.00 46.19 42.90 2uxt s LEU 34 CO 0.25 -0.77 1.32 -2.84 -1.32 0.00 0.00 176.35 172.99 2uxt s PRO 35 N 3.26 4.36 -0.28 0.98 0.02 -1.26 -5.00 135.00 137.08 2uxt s PRO 35 Ca 0.60 2.19 -0.02 0.00 0.02 0.00 0.00 61.00 63.80 2uxt s PRO 35 Cb -0.26 -3.10 0.04 0.00 0.02 0.00 0.00 34.50 31.20 2uxt s PRO 35 CO 0.21 -0.21 -0.02 0.08 -0.33 0.00 0.00 177.00 176.73 2uxt s VAL 36 N -0.83 2.93 0.37 3.83 1.01 -1.26 -4.89 120.40 121.57 2uxt s VAL 36 Ca 0.51 -1.29 -0.28 0.00 0.00 0.00 0.00 61.98 60.92 2uxt s VAL 36 Cb -0.39 -2.63 -0.11 0.00 0.00 0.00 0.00 36.38 33.24 2uxt s VAL 36 CO 0.49 -0.02 1.50 -2.84 0.00 0.00 0.00 175.10 174.23 2uxt s PRO 37 N 1.27 4.10 0.44 2.72 0.02 -1.26 -4.91 135.00 137.38 2uxt s PRO 37 Ca -0.04 2.58 -0.26 0.00 0.02 0.00 0.00 61.00 63.30 2uxt s PRO 37 Cb -0.19 -2.97 -0.09 0.00 0.02 0.00 0.00 34.50 31.27 2uxt s PRO 37 CO -0.02 -0.55 1.44 -0.35 -0.33 0.00 0.00 177.00 177.19 2uxt n PRO 38 N 0.57 2.34 -3.16 5.54 -0.04 -1.26 -4.47 135.00 134.51 2uxt n PRO 38 Ca 0.01 0.83 -0.40 0.00 -0.04 0.00 0.00 63.50 63.90 2uxt n PRO 38 Cb 0.39 -2.64 -0.07 0.00 -0.04 0.00 0.00 33.50 31.15 2uxt n PRO 38 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2uxt s LEU 39 N -2.52 4.09 -0.29 1.53 2.96 -1.26 -1.06 118.68 122.13 2uxt s LEU 39 Ca 0.59 0.69 -0.02 0.00 -0.22 0.00 0.00 54.13 55.18 2uxt s LEU 39 Cb -0.46 -2.80 0.04 0.00 0.50 0.00 0.00 46.19 43.48 2uxt s LEU 39 CO 0.59 -0.30 -0.00 -1.48 -1.32 0.00 0.00 176.35 173.84 2uxt s LEU 40 N 2.18 3.80 0.09 -0.68 2.34 -0.27 -4.95 118.68 121.18 2uxt s LEU 40 Ca 0.25 -1.19 0.07 0.00 0.06 0.00 0.00 54.13 53.33 2uxt s LEU 40 Cb -0.16 -1.71 -0.04 0.00 -0.56 0.00 0.00 46.19 43.72 2uxt s LEU 40 CO 0.09 -0.24 -0.12 -0.70 -1.06 0.00 0.00 176.35 174.32 2uxt s GLU 41 N 1.28 2.09 -0.90 1.48 2.12 -1.26 -1.99 118.70 121.52 2uxt s GLU 41 Ca -0.04 -1.02 -0.03 0.00 0.36 0.00 0.00 54.97 54.24 2uxt s GLU 41 Cb -0.19 -2.27 0.22 0.00 0.26 0.00 0.00 34.13 32.15 2uxt s GLU 41 CO -0.01 0.51 0.80 -1.54 -0.54 0.00 0.00 175.26 174.48 2uxt s SER 42 N -2.03 6.13 0.50 -1.70 1.04 -0.98 -4.98 113.70 111.67 2uxt s SER 42 Ca 0.19 -3.61 0.38 0.00 0.48 0.00 0.00 55.95 53.39 2uxt s SER 42 Cb -0.11 -1.95 1.55 0.00 0.10 0.00 0.00 66.02 65.61 2uxt s SER 42 CO 0.11 -0.22 1.65 0.03 0.98 0.00 0.00 173.24 175.79 2uxt h ARG 43 N 6.22 0.05 -0.08 4.02 2.47 -1.97 -3.42 114.38 121.68 2uxt h ARG 43 Ca 0.15 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.86 2uxt h ARG 43 Cb 0.84 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.15 2uxt h ARG 43 CO 0.86 0.03 0.00 0.94 0.56 0.00 0.00 179.97 182.37 2uxt n GLN 46 N -4.32 0.00 -1.65 0.04 7.27 -1.26 -5.04 117.38 112.42 2uxt n GLN 46 Ca 0.37 0.01 -0.32 0.00 0.07 0.00 0.00 57.00 57.13 2uxt n GLN 46 Cb 1.58 -0.03 0.05 0.00 2.41 0.00 0.00 30.24 34.26 2uxt n GLN 46 CO 0.00 0.00 0.00 -2.14 0.07 0.00 0.00 177.06 174.99 2uxt s PRO 47 N -0.02 2.83 -0.09 3.69 0.02 -1.26 -4.64 135.00 135.52 2uxt s PRO 47 Ca 0.00 1.16 0.02 0.00 0.02 0.00 0.00 61.00 62.20 2uxt s PRO 47 Cb 0.00 -1.97 -0.02 0.00 0.02 0.00 0.00 34.50 32.53 2uxt s PRO 47 CO 0.00 -1.20 -0.16 -0.51 -0.33 0.00 0.00 177.00 174.81 2uxt s LEU 48 N -5.25 2.60 -0.21 -5.54 1.43 -0.11 -5.00 118.68 106.60 2uxt s LEU 48 Ca 0.62 -0.33 -0.08 0.00 -1.03 0.00 0.00 54.13 53.32 2uxt s LEU 48 Cb -0.17 -1.55 -0.04 0.00 0.03 0.00 0.00 46.19 44.47 2uxt s LEU 48 CO 0.48 0.23 0.08 -0.36 0.23 0.00 0.00 176.35 177.01 2uxt s PHE 49 N -0.04 3.19 -0.29 0.29 0.40 -1.26 -0.32 117.98 119.95 2uxt s PHE 49 Ca -0.04 -0.07 0.01 0.00 -0.60 0.00 0.00 56.93 56.23 2uxt s PHE 49 Cb -0.14 -2.15 0.08 0.00 0.51 0.00 0.00 43.02 41.32 2uxt s PHE 49 CO 0.04 -0.03 0.02 1.41 0.70 0.00 0.00 175.22 177.37 2uxt s MET 50 N 0.87 1.27 -0.29 0.44 1.75 0.95 -4.96 119.30 119.34 2uxt s MET 50 Ca 0.04 -1.25 -0.09 0.00 -1.25 0.00 0.00 55.69 53.15 2uxt s MET 50 Cb -0.14 -2.56 -0.02 0.00 2.84 0.00 0.00 34.83 34.95 2uxt s MET 50 CO 0.03 -0.81 0.12 0.99 -0.65 0.00 0.00 175.02 174.69 2uxt s THR 51 N 1.34 4.49 -0.26 10.11 2.01 -1.26 -0.93 115.64 131.14 2uxt s THR 51 Ca 0.04 -0.31 -0.24 0.00 0.31 0.00 0.00 61.69 61.49 2uxt s THR 51 Cb -0.18 -3.22 -0.01 0.00 0.01 0.00 0.00 72.50 69.11 2uxt s THR 51 CO -0.13 0.18 0.79 0.68 -0.69 0.00 0.00 174.62 175.46 2uxt s VAL 52 N 1.61 4.84 0.28 3.82 -7.23 0.50 -1.83 120.40 122.40 2uxt s VAL 52 Ca 0.05 1.41 -0.09 0.00 -1.81 0.00 0.00 61.98 61.54 2uxt s VAL 52 Cb -0.16 -4.10 -0.00 0.00 0.56 0.00 0.00 36.38 32.68 2uxt s VAL 52 CO 0.05 -0.11 0.47 0.00 -0.31 0.00 0.00 175.10 175.21 2uxt s GLN 53 N 2.83 1.67 0.59 4.82 -2.07 -0.55 -1.43 119.66 125.52 2uxt s GLN 53 Ca 0.33 -1.43 -0.14 0.00 -1.82 0.00 0.00 55.36 52.30 2uxt s GLN 53 Cb -0.15 0.46 -0.05 0.00 -1.09 0.00 0.00 33.01 32.18 2uxt s GLN 53 CO 0.09 -0.69 1.02 1.03 -1.32 0.00 0.00 175.29 175.42 2uxt s ARG 54 N -3.66 3.60 0.28 9.60 0.52 -1.26 -1.51 118.95 126.53 2uxt s ARG 54 Ca 0.25 0.91 -0.20 0.00 -0.52 0.00 0.00 55.73 56.17 2uxt s ARG 54 Cb -0.00 -2.08 0.03 0.00 0.52 0.00 0.00 34.95 33.42 2uxt s ARG 54 CO 0.12 -0.56 0.77 0.00 0.02 0.00 0.00 175.30 175.65 2uxt s ALA 55 N -2.86 -1.18 -0.01 2.13 0.00 0.23 -4.88 121.76 115.19 2uxt s ALA 55 Ca 0.58 -0.35 0.03 0.00 0.00 0.00 0.00 51.96 52.22 2uxt s ALA 55 Cb -0.12 0.79 -0.03 0.00 0.00 0.00 0.00 23.12 23.76 2uxt s ALA 55 CO 0.44 -1.03 -0.07 -1.01 0.00 0.00 0.00 175.76 174.08 2uxt s HIS 56 N -3.46 2.87 0.02 0.00 3.76 -1.26 0.59 115.29 117.81 2uxt s HIS 56 Ca 0.12 -0.04 -0.17 0.00 -0.15 0.00 0.00 55.06 54.82 2uxt s HIS 56 Cb -0.05 -1.62 0.03 0.00 1.11 0.00 0.00 32.58 32.05 2uxt s HIS 56 CO 0.07 0.36 0.37 -0.46 -0.85 0.00 0.00 174.74 174.23 2uxt s TRP 57 N -0.96 -0.22 -0.38 1.40 -0.11 0.07 -4.82 118.94 113.92 2uxt s TRP 57 Ca 0.16 0.22 -0.06 0.00 1.22 0.00 0.00 56.10 57.65 2uxt s TRP 57 Cb -0.11 0.16 0.07 0.00 -1.50 0.00 0.00 33.47 32.09 2uxt s TRP 57 CO 0.06 -0.50 0.17 -1.54 -4.62 0.00 0.00 176.95 170.52 2uxt s SER 58 N -1.78 5.34 0.00 5.86 1.04 -1.26 -0.38 113.70 122.52 2uxt s SER 58 Ca -0.08 -1.54 0.16 0.00 0.48 0.00 0.00 55.95 54.97 2uxt s SER 58 Cb -0.02 -1.87 0.59 0.00 0.10 0.00 0.00 66.02 64.82 2uxt s SER 58 CO 0.00 -0.45 1.43 0.49 0.98 0.00 0.00 173.24 175.69 2uxt n PHE 59 N 4.75 0.27 0.00 5.02 3.01 -1.26 -4.85 117.46 124.40 2uxt n PHE 59 Ca -0.09 -0.13 0.00 0.00 1.01 0.00 0.00 57.45 58.24 2uxt n PHE 59 Cb 0.43 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.90 2uxt n PHE 59 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 2uxt n THR 60 N 0.24 0.00 0.00 4.37 -2.24 -1.26 -4.76 114.28 110.63 2uxt n THR 60 Ca 0.13 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.91 2uxt n THR 60 Cb 0.27 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.50 2uxt n THR 60 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2uxt n GLY 62 N 0.00 0.42 3.20 3.38 0.00 -1.26 -4.97 105.19 105.96 2uxt n GLY 62 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 2uxt n GLY 62 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2uxt s THR 63 N 1.31 0.30 -0.01 2.61 -1.32 -1.26 -5.09 115.64 112.18 2uxt s THR 63 Ca 0.00 -1.95 -0.00 0.00 -1.21 0.00 0.00 61.69 58.52 2uxt s THR 63 Cb 0.00 -2.20 0.01 0.00 -1.51 0.00 0.00 72.50 68.80 2uxt s THR 63 CO 0.00 -0.34 0.02 -0.60 -2.21 0.00 0.00 174.62 171.48 2uxt s ARG 64 N -4.03 0.00 0.24 7.08 3.52 -1.26 -4.49 118.95 120.02 2uxt s ARG 64 Ca 0.28 0.07 0.08 0.00 -0.13 0.00 0.00 55.73 56.03 2uxt s ARG 64 Cb 0.07 -0.06 -0.05 0.00 -1.56 0.00 0.00 34.95 33.35 2uxt s ARG 64 CO 0.05 -0.05 -0.13 0.00 -0.81 0.00 0.00 175.30 174.36 2uxt s ALA 65 N 0.29 2.29 -0.17 6.12 0.00 0.49 -4.92 121.76 125.86 2uxt s ALA 65 Ca -0.02 -1.78 -0.16 0.00 0.00 0.00 0.00 51.96 49.99 2uxt s ALA 65 Cb -0.03 -0.06 -0.04 0.00 0.00 0.00 0.00 23.12 22.99 2uxt s ALA 65 CO -0.01 0.08 0.42 0.45 0.00 0.00 0.00 175.76 176.70 2uxt s SER 66 N -3.40 6.52 0.24 0.00 0.15 -1.26 -0.75 113.70 115.19 2uxt s SER 66 Ca 0.26 0.61 0.03 0.00 0.70 0.00 0.00 55.95 57.55 2uxt s SER 66 Cb -0.00 -2.25 -0.01 0.00 -1.71 0.00 0.00 66.02 62.05 2uxt s SER 66 CO 0.10 -0.04 0.10 1.33 1.20 0.00 0.00 173.24 175.94 2uxt n VAL 67 N 4.07 0.00 -4.40 4.45 0.24 0.20 -4.94 118.33 117.94 2uxt n VAL 67 Ca -0.08 -1.44 -0.24 0.00 -2.04 0.00 0.00 64.34 60.54 2uxt n VAL 67 Cb 0.51 0.56 -0.09 0.00 -1.47 0.00 0.00 33.84 33.35 2uxt n VAL 67 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 2uxt s TRP 68 N -2.54 2.46 -0.91 6.34 0.52 -0.60 -0.60 118.94 123.61 2uxt s TRP 68 Ca 0.15 -0.33 0.00 0.00 0.02 0.00 0.00 56.10 55.94 2uxt s TRP 68 Cb 0.01 -1.16 0.00 0.00 -1.15 0.00 0.00 33.47 31.17 2uxt s TRP 68 CO 0.10 0.64 0.00 0.41 0.02 0.00 0.00 176.95 178.13 2uxt n GLY 69 N -0.77 -0.60 2.92 0.98 0.00 -0.57 -3.57 105.19 103.59 2uxt n GLY 69 Ca -0.05 -0.70 -0.24 0.00 0.00 0.00 0.00 46.02 45.03 2uxt n GLY 69 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2uxt s ILE 70 N -3.00 0.85 -1.55 -0.61 1.09 -0.28 -1.48 121.20 116.23 2uxt s ILE 70 Ca 0.00 -0.26 0.00 0.00 -1.10 0.00 0.00 60.65 59.29 2uxt s ILE 70 Cb 0.00 -0.85 0.00 0.00 -1.06 0.00 0.00 42.46 40.55 2uxt s ILE 70 CO 0.00 0.31 0.00 0.59 -0.10 0.00 0.00 174.94 175.74 2uxt n ASN 71 N 4.35 -4.99 -3.59 3.58 3.02 -0.76 -3.05 115.26 113.83 2uxt n ASN 71 Ca -0.19 0.12 -0.29 0.00 -0.03 0.00 0.00 54.58 54.19 2uxt n ASN 71 Cb 0.51 -4.05 -0.15 0.00 -0.61 0.00 0.00 39.78 35.48 2uxt n ASN 71 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2uxt s GLY 72 N -2.42 0.74 0.04 7.41 0.00 -1.26 -5.03 107.32 106.79 2uxt s GLY 72 Ca 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 44.72 43.32 2uxt s GLY 72 CO 0.00 1.92 0.01 0.54 0.00 0.00 0.00 173.10 175.56 2uxt n ARG 73 N 4.94 1.82 -2.97 2.90 1.74 -1.17 -4.85 116.66 119.07 2uxt n ARG 73 Ca -0.02 -0.27 -0.40 0.00 -0.77 0.00 0.00 57.85 56.39 2uxt n ARG 73 Cb 0.41 0.07 -0.05 0.00 -1.02 0.00 0.00 32.46 31.86 2uxt n ARG 73 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 2uxt s TYR 74 N -0.96 3.81 0.00 -1.55 5.04 -1.26 -3.48 117.35 118.95 2uxt s TYR 74 Ca 0.00 1.56 0.00 0.00 -2.44 0.00 0.00 57.07 56.19 2uxt s TYR 74 Cb -0.00 -2.81 0.00 0.00 0.35 0.00 0.00 41.96 39.50 2uxt s TYR 74 CO 0.00 0.37 0.00 1.28 -1.34 0.00 0.00 175.55 175.86 2uxt n LEU 75 N 2.30 0.00 0.00 6.97 4.77 -0.74 -4.85 117.00 125.46 2uxt n LEU 75 Ca -0.04 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 55.91 2uxt n LEU 75 Cb 0.49 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.57 2uxt n LEU 75 CO 0.47 -0.22 0.02 0.61 -1.33 0.00 0.00 177.39 176.93 2uxt n GLY 76 N 0.00 3.23 3.81 -0.72 0.00 -0.60 -1.13 105.19 109.79 2uxt n GLY 76 Ca 0.00 -1.53 -0.31 0.00 0.00 0.00 0.00 46.02 44.18 2uxt n GLY 76 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2uxt s PRO 77 N -2.22 2.74 -0.32 1.61 0.04 -1.26 -4.73 135.00 130.86 2uxt s PRO 77 Ca 0.07 0.96 -0.22 0.00 0.04 0.00 0.00 61.00 61.85 2uxt s PRO 77 Cb 0.00 -1.97 -0.00 0.00 0.04 0.00 0.00 34.50 32.57 2uxt s PRO 77 CO 0.05 -1.24 0.71 0.99 0.04 0.00 0.00 177.00 177.55 2uxt s THR 78 N -3.03 4.85 0.35 1.26 2.01 -0.22 -4.24 115.64 116.61 2uxt s THR 78 Ca 0.59 0.93 -0.19 0.00 0.31 0.00 0.00 61.69 63.32 2uxt s THR 78 Cb -0.15 -4.10 -0.10 0.00 0.01 0.00 0.00 72.50 68.17 2uxt s THR 78 CO 0.55 -0.26 0.83 -0.63 -0.69 0.00 0.00 174.62 174.43 2uxt s ILE 79 N 2.83 4.51 -0.03 1.82 1.09 -0.64 -1.11 121.20 129.67 2uxt s ILE 79 Ca 0.28 1.28 -0.01 0.00 -1.10 0.00 0.00 60.65 61.10 2uxt s ILE 79 Cb -0.14 -3.68 0.03 0.00 -1.06 0.00 0.00 42.46 37.60 2uxt s ILE 79 CO 0.13 -0.14 0.03 -0.60 -0.10 0.00 0.00 174.94 174.26 2uxt s ARG 80 N -2.82 0.03 0.10 2.79 3.52 -0.84 0.51 118.95 122.24 2uxt s ARG 80 Ca 0.55 0.22 0.01 0.00 -0.13 0.00 0.00 55.73 56.38 2uxt s ARG 80 Cb -0.12 -0.39 -0.04 0.00 -1.56 0.00 0.00 34.95 32.84 2uxt s ARG 80 CO 0.17 -0.21 -0.04 0.14 -0.81 0.00 0.00 175.30 174.55 2uxt s VAL 81 N 1.41 0.50 -0.07 7.11 -7.23 0.00 -2.33 120.40 119.79 2uxt s VAL 81 Ca -0.05 -1.90 0.01 0.00 -1.81 0.00 0.00 61.98 58.23 2uxt s VAL 81 Cb -0.13 -1.72 -0.03 0.00 0.56 0.00 0.00 36.38 35.07 2uxt s VAL 81 CO -0.03 -0.83 -0.08 0.26 -0.31 0.00 0.00 175.10 174.12 2uxt s TRP 82 N -3.75 2.91 0.25 2.82 0.52 -1.26 -0.26 118.94 120.18 2uxt s TRP 82 Ca 0.13 -0.04 -0.31 0.00 0.02 0.00 0.00 56.10 55.90 2uxt s TRP 82 Cb 0.06 -1.72 -0.13 0.00 -1.15 0.00 0.00 33.47 30.53 2uxt s TRP 82 CO -0.05 0.28 1.47 1.17 0.02 0.00 0.00 176.95 179.84 2uxt n LYS 83 N 2.35 2.23 0.00 4.98 4.81 0.34 -1.25 118.16 131.61 2uxt n LYS 83 Ca -0.18 0.79 0.00 0.00 -0.87 0.00 0.00 58.31 58.05 2uxt n LYS 83 Cb 0.53 -2.49 0.00 0.00 0.02 0.00 0.00 35.03 33.09 2uxt n LYS 83 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2uxt n GLY 84 N 2.20 0.99 3.89 3.14 0.00 0.14 -4.97 105.19 110.58 2uxt n GLY 84 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 2uxt n GLY 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2uxt s ASP 85 N -2.01 6.30 -0.41 1.61 1.11 -0.38 -4.89 116.67 118.01 2uxt s ASP 85 Ca 0.00 1.15 0.04 0.00 0.18 0.00 0.00 52.55 53.92 2uxt s ASP 85 Cb 0.00 -2.35 0.11 0.00 1.07 0.00 0.00 42.92 41.76 2uxt s ASP 85 CO 0.00 -0.66 0.13 -1.81 1.18 0.00 0.00 175.17 174.01 2uxt s ASP 86 N -3.97 4.55 -0.22 0.27 1.01 -1.26 -0.93 116.67 116.13 2uxt s ASP 86 Ca 0.51 -2.46 -0.15 0.00 0.71 0.00 0.00 52.55 51.16 2uxt s ASP 86 Cb -0.11 -1.59 -0.04 0.00 1.01 0.00 0.00 42.92 42.19 2uxt s ASP 86 CO 0.46 -0.32 0.36 0.68 0.21 0.00 0.00 175.17 176.56 2uxt s VAL 87 N 0.48 5.22 -0.27 -1.27 -7.23 0.24 -4.81 120.40 112.76 2uxt s VAL 87 Ca 0.13 0.62 -0.21 0.00 -1.81 0.00 0.00 61.98 60.71 2uxt s VAL 87 Cb -0.22 -3.69 -0.01 0.00 0.56 0.00 0.00 36.38 33.02 2uxt s VAL 87 CO -0.05 0.25 0.66 -0.75 -0.31 0.00 0.00 175.10 174.90 2uxt s LYS 88 N 1.39 4.05 -0.22 4.82 2.47 -1.26 0.12 119.74 131.11 2uxt s LYS 88 Ca 0.17 0.53 -0.05 0.00 -1.56 0.00 0.00 55.97 55.06 2uxt s LYS 88 Cb -0.15 -3.68 -0.02 0.00 -1.46 0.00 0.00 37.83 32.53 2uxt s LYS 88 CO 0.08 -0.49 -0.01 -1.17 0.16 0.00 0.00 175.35 173.92 2uxt s LEU 89 N 2.61 3.09 -0.46 5.43 2.96 -0.33 -0.93 118.68 131.04 2uxt s LEU 89 Ca 0.27 -0.31 -0.11 0.00 -0.22 0.00 0.00 54.13 53.76 2uxt s LEU 89 Cb -0.15 -1.80 0.10 0.00 0.50 0.00 0.00 46.19 44.84 2uxt s LEU 89 CO 0.10 -0.00 0.33 -0.63 -1.32 0.00 0.00 176.35 174.83 2uxt s ILE 90 N 1.40 4.48 0.02 6.68 1.01 0.56 -2.94 121.20 132.41 2uxt s ILE 90 Ca 0.05 -1.48 -0.18 0.00 0.00 0.00 0.00 60.65 59.04 2uxt s ILE 90 Cb -0.15 -3.81 -0.06 0.00 0.01 0.00 0.00 42.46 38.45 2uxt s ILE 90 CO -0.00 -0.64 0.52 -0.31 0.00 0.00 0.00 174.94 174.50 2uxt s TYR 91 N 1.46 3.73 -0.07 3.97 1.51 -0.17 -0.03 117.35 127.75 2uxt s TYR 91 Ca 0.04 1.14 0.01 0.00 -1.01 0.00 0.00 57.07 57.25 2uxt s TYR 91 Cb -0.25 -2.46 0.02 0.00 -0.11 0.00 0.00 41.96 39.16 2uxt s TYR 91 CO 0.02 0.52 -0.08 -1.12 -1.11 0.00 0.00 175.55 173.78 2uxt s SER 92 N -0.74 1.60 -0.33 2.29 0.01 -0.11 -1.46 113.70 114.97 2uxt s SER 92 Ca 0.27 -0.23 -0.15 0.00 1.31 0.00 0.00 55.95 57.15 2uxt s SER 92 Cb -0.18 -0.68 -0.02 0.00 0.21 0.00 0.00 66.02 65.35 2uxt s SER 92 CO 0.16 -0.05 0.37 0.21 0.41 0.00 0.00 173.24 174.34 2uxt s ASN 93 N 1.09 6.20 -0.15 2.44 2.47 -0.34 -0.37 114.94 126.27 2uxt s ASN 93 Ca -0.07 -0.10 0.17 0.00 0.42 0.00 0.00 52.86 53.28 2uxt s ASN 93 Cb -0.14 -2.20 0.34 0.00 -1.45 0.00 0.00 41.25 37.79 2uxt s ASN 93 CO -0.01 -0.31 1.19 0.54 -3.72 0.00 0.00 177.10 174.80 2uxt n ARG 94 N 5.39 1.50 -2.84 0.43 5.12 -0.51 0.17 116.66 125.91 2uxt n ARG 94 Ca -0.09 -2.72 -0.20 0.00 -1.93 0.00 0.00 57.85 52.91 2uxt n ARG 94 Cb 0.50 -1.56 0.06 0.00 -1.16 0.00 0.00 32.46 30.29 2uxt n ARG 94 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2uxt s LEU 95 N -2.94 3.24 0.00 0.55 1.43 -1.25 -4.71 118.68 115.00 2uxt s LEU 95 Ca 0.34 -0.46 0.15 0.00 -1.03 0.00 0.00 54.13 53.13 2uxt s LEU 95 Cb 0.30 -2.21 0.47 0.00 0.03 0.00 0.00 46.19 44.78 2uxt s LEU 95 CO 0.02 -1.29 1.37 0.35 0.23 0.00 0.00 176.35 177.03 2uxt n THR 96 N -2.32 0.43 -4.13 5.49 -2.24 -1.26 -4.51 114.28 105.74 2uxt n THR 96 Ca 0.12 -0.48 -0.11 0.00 -2.27 0.00 0.00 64.05 61.32 2uxt n THR 96 Cb 0.60 0.32 -0.09 0.00 -2.10 0.00 0.00 70.33 69.06 2uxt n THR 96 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2uxt s GLU 97 N -1.57 1.17 0.55 -0.78 -1.05 -1.26 -4.93 118.70 110.83 2uxt s GLU 97 Ca 0.28 -1.47 -0.20 0.00 -0.15 0.00 0.00 54.97 53.43 2uxt s GLU 97 Cb 0.15 0.30 -0.05 0.00 -0.44 0.00 0.00 34.13 34.10 2uxt s GLU 97 CO 0.21 -0.39 1.23 -0.80 0.95 0.00 0.00 175.26 176.46 2uxt s ASN 98 N -3.09 5.41 -0.09 0.83 0.01 -1.26 -4.30 114.94 112.45 2uxt s ASN 98 Ca 0.30 2.46 -0.04 0.00 -0.71 0.00 0.00 52.86 54.87 2uxt s ASN 98 Cb 0.06 -2.61 0.05 0.00 0.41 0.00 0.00 41.25 39.15 2uxt s ASN 98 CO 0.07 -1.45 0.21 -0.69 -1.51 0.00 0.00 177.10 173.73 2uxt s VAL 99 N -1.51 -0.12 -0.08 1.60 1.01 -0.01 -4.93 120.40 116.34 2uxt s VAL 99 Ca 0.73 0.20 0.01 0.00 0.00 0.00 0.00 61.98 62.92 2uxt s VAL 99 Cb -0.32 -0.34 -0.03 0.00 0.00 0.00 0.00 36.38 35.69 2uxt s VAL 99 CO 0.37 0.08 -0.09 -0.94 0.00 0.00 0.00 175.10 174.52 2uxt s SER 100 N 1.52 4.46 0.05 3.32 1.04 -1.26 -0.54 113.70 122.29 2uxt s SER 100 Ca -0.06 -0.11 0.09 0.00 0.48 0.00 0.00 55.95 56.34 2uxt s SER 100 Cb -0.11 -1.23 -0.03 0.00 0.10 0.00 0.00 66.02 64.74 2uxt s SER 100 CO -0.07 0.31 -0.23 -0.04 0.98 0.00 0.00 173.24 174.18 2uxt s MET 101 N -0.50 1.87 0.03 4.02 -1.94 -1.26 -0.98 119.30 120.54 2uxt s MET 101 Ca 0.07 -1.08 -0.03 0.00 -1.71 0.00 0.00 55.69 52.95 2uxt s MET 101 Cb -0.12 -2.05 -0.02 0.00 2.01 0.00 0.00 34.83 34.65 2uxt s MET 101 CO 0.02 0.52 0.03 -0.08 -0.01 0.00 0.00 175.02 175.49 2uxt s THR 102 N -0.87 0.13 -0.50 2.05 -1.32 -0.55 -3.65 115.64 110.93 2uxt s THR 102 Ca 0.13 -1.06 -0.12 0.00 -1.21 0.00 0.00 61.69 59.43 2uxt s THR 102 Cb -0.10 -0.64 0.12 0.00 -1.51 0.00 0.00 72.50 70.37 2uxt s THR 102 CO 0.03 -0.59 0.40 -0.69 -2.21 0.00 0.00 174.62 171.57 2uxt s VAL 103 N -2.12 4.62 0.15 5.08 1.01 -1.25 -0.96 120.40 126.92 2uxt s VAL 103 Ca -0.09 -1.65 -0.31 0.00 0.00 0.00 0.00 61.98 59.93 2uxt s VAL 103 Cb -0.05 -3.99 -0.10 0.00 0.00 0.00 0.00 36.38 32.24 2uxt s VAL 103 CO -0.03 -0.80 1.69 0.00 0.00 0.00 0.00 175.10 175.96 2uxt s ALA 104 N 1.46 3.80 0.00 5.51 0.00 0.15 -1.96 121.76 130.73 2uxt s ALA 104 Ca 0.05 1.42 0.00 0.00 0.00 0.00 0.00 51.96 53.42 2uxt s ALA 104 Cb -0.28 -3.69 0.00 0.00 0.00 0.00 0.00 23.12 19.15 2uxt s ALA 104 CO 0.01 -0.99 0.00 0.41 0.00 0.00 0.00 175.76 175.19 2uxt n GLY 105 N 3.98 1.22 3.70 0.00 0.00 -1.26 -3.38 105.19 109.45 2uxt n GLY 105 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 2uxt n GLY 105 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2uxt s LEU 106 N 0.00 4.33 -0.95 0.99 2.96 -0.83 -4.95 118.68 120.23 2uxt s LEU 106 Ca 0.00 1.87 -0.20 0.00 -0.22 0.00 0.00 54.13 55.58 2uxt s LEU 106 Cb 0.00 -3.57 0.11 0.00 0.50 0.00 0.00 46.19 43.23 2uxt s LEU 106 CO 0.00 -0.48 1.20 -1.10 -1.32 0.00 0.00 176.35 174.65 2uxt s GLN 107 N 1.55 3.59 0.09 1.98 -1.52 -1.26 -4.53 119.66 119.55 2uxt s GLN 107 Ca 0.56 -1.58 -0.02 0.00 -1.95 0.00 0.00 55.36 52.37 2uxt s GLN 107 Cb -0.26 -5.01 -0.04 0.00 -0.22 0.00 0.00 33.01 27.49 2uxt s GLN 107 CO 0.26 -1.88 0.03 0.14 -0.25 0.00 0.00 175.29 173.59 2uxt s VAL 108 N 3.28 0.17 0.74 1.09 -7.23 -1.26 -4.58 120.40 112.61 2uxt s VAL 108 Ca 0.36 -1.77 -0.15 0.00 -1.81 0.00 0.00 61.98 58.61 2uxt s VAL 108 Cb -0.04 -1.69 0.05 0.00 0.56 0.00 0.00 36.38 35.25 2uxt s VAL 108 CO -0.09 -0.76 1.21 -2.84 -0.31 0.00 0.00 175.10 172.31 2uxt s PRO 109 N -3.96 2.05 0.27 4.82 0.02 -1.26 -4.78 135.00 132.16 2uxt s PRO 109 Ca 0.13 1.76 -0.05 0.00 0.02 0.00 0.00 61.00 62.86 2uxt s PRO 109 Cb 0.07 -1.82 0.52 0.00 0.02 0.00 0.00 34.50 33.29 2uxt s PRO 109 CO -0.06 -1.90 1.59 0.78 -0.33 0.00 0.00 177.00 177.08 2uxt h GLY 110 N -0.40 0.89 2.00 0.52 0.00 -1.24 -0.50 103.07 104.35 2uxt h GLY 110 Ca -0.47 0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.06 2uxt h GLY 110 CO 0.49 -0.38 0.00 -2.55 0.00 0.00 0.00 176.54 174.10 2uxt h PRO 111 N 0.03 0.00 -0.40 4.80 0.11 -1.86 -2.42 132.00 132.26 2uxt h PRO 111 Ca 0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.59 2uxt h PRO 111 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 2uxt h PRO 111 CO -0.85 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 178.22 2uxt n LEU 112 N -2.98 3.42 0.16 2.35 4.77 -0.20 -4.73 117.00 119.78 2uxt n LEU 112 Ca -0.02 -1.56 -0.14 0.00 -0.03 0.00 0.00 56.01 54.27 2uxt n LEU 112 Cb 0.11 -0.26 -0.08 0.00 -2.33 0.00 0.00 43.42 40.86 2uxt n LEU 112 CO 0.20 0.75 0.59 0.24 -1.33 0.00 0.00 177.39 177.84 2uxt h MET 113 N 4.21 -0.39 0.00 3.23 2.86 -1.43 -3.48 114.93 119.92 2uxt h MET 113 Ca 0.00 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 2uxt h MET 113 Cb 0.95 0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.70 2uxt h MET 113 CO 0.00 -0.09 -0.08 0.41 1.06 0.00 0.00 176.91 178.22 2uxt n GLY 114 N -0.47 -0.05 0.00 8.32 0.00 -1.24 -3.81 105.19 107.94 2uxt n GLY 114 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2uxt n GLY 114 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2uxt n GLY 115 N 3.34 -0.19 0.48 -0.02 0.00 -1.26 -4.72 105.19 102.82 2uxt n GLY 115 Ca 0.00 -2.00 0.35 0.00 0.00 0.00 0.00 46.02 44.38 2uxt n GLY 115 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2uxt h PRO 116 N 0.00 0.13 0.00 1.61 0.13 -1.98 0.92 132.00 132.82 2uxt h PRO 116 Ca 0.00 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 2uxt h PRO 116 Cb 0.00 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.10 2uxt h PRO 116 CO 0.00 0.09 -0.02 0.00 -0.23 0.00 0.00 178.00 177.84 2uxt h ALA 117 N 1.55 0.99 -0.08 -0.56 0.00 -1.91 -3.19 119.26 116.04 2uxt h ALA 117 Ca 0.77 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.65 2uxt h ALA 117 Cb 2.43 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 20.21 2uxt h ALA 117 CO -0.34 0.00 -0.15 0.54 0.00 0.00 0.00 179.25 179.30 2uxt n ARG 118 N -2.37 1.68 -1.87 0.00 5.12 0.31 -5.05 116.66 114.47 2uxt n ARG 118 Ca 0.05 -2.91 -0.40 0.00 -1.93 0.00 0.00 57.85 52.67 2uxt n ARG 118 Cb 0.44 -1.63 0.01 0.00 -1.16 0.00 0.00 32.46 30.13 2uxt n ARG 118 CO 0.00 0.00 0.00 1.41 -1.93 0.00 0.00 177.63 177.11 2uxt s MET 119 N -3.03 3.72 -0.22 5.56 1.75 -0.50 -4.75 119.30 121.84 2uxt s MET 119 Ca 0.37 2.33 -0.08 0.00 -1.25 0.00 0.00 55.69 57.06 2uxt s MET 119 Cb 0.33 -2.65 -0.04 0.00 2.84 0.00 0.00 34.83 35.31 2uxt s MET 119 CO 0.01 -0.76 0.08 -1.64 -0.65 0.00 0.00 175.02 172.06 2uxt s MET 120 N -2.43 3.84 0.72 4.11 -1.94 0.30 -4.91 119.30 118.99 2uxt s MET 120 Ca 0.61 -0.40 -0.11 0.00 -1.71 0.00 0.00 55.69 54.08 2uxt s MET 120 Cb -0.42 -3.32 0.02 0.00 2.01 0.00 0.00 34.83 33.12 2uxt s MET 120 CO 0.53 0.02 1.09 -1.12 -0.01 0.00 0.00 175.02 175.54 2uxt s SER 121 N 1.07 5.29 0.25 3.03 0.01 -1.26 -0.83 113.70 121.25 2uxt s SER 121 Ca 0.05 1.22 -0.31 0.00 1.31 0.00 0.00 55.95 58.22 2uxt s SER 121 Cb -0.14 -2.03 -0.14 0.00 0.21 0.00 0.00 66.02 63.92 2uxt s SER 121 CO 0.03 -1.45 1.29 -2.65 0.41 0.00 0.00 173.24 170.87 2uxt n PRO 122 N -3.09 1.79 -0.99 12.44 -0.02 -1.26 -1.45 135.00 142.42 2uxt n PRO 122 Ca 0.07 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 2uxt n PRO 122 Cb 0.56 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 2uxt n PRO 122 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2uxt n ASN 123 N 1.82 -4.30 -4.95 2.55 5.03 0.13 -5.01 115.26 110.53 2uxt n ASN 123 Ca 0.11 0.00 -0.19 0.00 0.87 0.00 0.00 54.58 55.37 2uxt n ASN 123 Cb 0.31 -1.89 -0.01 0.00 -1.02 0.00 0.00 39.78 37.17 2uxt n ASN 123 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2uxt s ALA 124 N -1.56 4.32 0.30 5.41 0.00 -0.53 -4.86 121.76 124.85 2uxt s ALA 124 Ca 0.00 -1.73 0.03 0.00 0.00 0.00 0.00 51.96 50.25 2uxt s ALA 124 Cb 0.00 -1.39 -0.05 0.00 0.00 0.00 0.00 23.12 21.68 2uxt s ALA 124 CO 0.00 -0.23 0.10 0.16 0.00 0.00 0.00 175.76 175.78 2uxt s ASP 125 N -4.25 1.79 -0.15 0.00 1.47 -1.26 -1.20 116.67 113.07 2uxt s ASP 125 Ca 0.51 -1.44 -0.06 0.00 1.18 0.00 0.00 52.55 52.74 2uxt s ASP 125 Cb -0.07 0.15 0.07 0.00 -0.34 0.00 0.00 42.92 42.73 2uxt s ASP 125 CO 0.31 -0.74 0.33 0.86 0.68 0.00 0.00 175.17 176.61 2uxt s TRP 126 N -3.53 -0.54 -0.61 2.11 -0.00 -0.54 -4.98 118.94 110.85 2uxt s TRP 126 Ca 0.36 1.15 0.06 0.00 -0.00 0.00 0.00 56.10 57.66 2uxt s TRP 126 Cb 0.07 0.12 0.22 0.00 -0.00 0.00 0.00 33.47 33.88 2uxt s TRP 126 CO 0.15 -0.37 0.60 0.00 -0.00 0.00 0.00 176.95 177.33 2uxt n ALA 127 N 5.02 3.55 -1.79 5.86 0.00 -1.26 -1.00 120.51 130.90 2uxt n ALA 127 Ca -0.12 -4.37 -0.36 0.00 0.00 0.00 0.00 53.44 48.58 2uxt n ALA 127 Cb 0.51 -0.92 -0.06 0.00 0.00 0.00 0.00 19.45 18.98 2uxt n ALA 127 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2uxt s PRO 128 N -1.76 4.47 -0.34 0.00 0.04 -1.15 -4.78 135.00 131.47 2uxt s PRO 128 Ca 0.34 1.31 -0.14 0.00 0.04 0.00 0.00 61.00 62.55 2uxt s PRO 128 Cb 0.08 -2.65 -0.01 0.00 0.04 0.00 0.00 34.50 31.95 2uxt s PRO 128 CO -0.09 0.17 0.29 0.08 0.04 0.00 0.00 177.00 177.48 2uxt s VAL 129 N -1.73 5.24 -0.30 -0.36 1.01 -1.26 -1.19 120.40 121.81 2uxt s VAL 129 Ca 0.53 -0.13 -0.15 0.00 0.00 0.00 0.00 61.98 62.24 2uxt s VAL 129 Cb -0.17 -3.76 -0.03 0.00 0.00 0.00 0.00 36.38 32.42 2uxt s VAL 129 CO 0.22 -0.05 0.36 -0.76 0.00 0.00 0.00 175.10 174.87 2uxt s LEU 130 N 1.84 4.18 -0.68 3.92 1.43 0.32 -4.88 118.68 124.81 2uxt s LEU 130 Ca 0.08 0.07 -0.25 0.00 -1.03 0.00 0.00 54.13 53.00 2uxt s LEU 130 Cb -0.17 -2.38 0.04 0.00 0.03 0.00 0.00 46.19 43.72 2uxt s LEU 130 CO 0.11 -0.24 1.13 -2.16 0.23 0.00 0.00 176.35 175.42 2uxt s PRO 131 N 2.04 3.20 -0.57 1.29 0.04 -1.26 -0.59 135.00 139.15 2uxt s PRO 131 Ca 0.13 -0.40 -0.27 0.00 0.04 0.00 0.00 61.00 60.49 2uxt s PRO 131 Cb -0.16 -4.17 0.00 0.00 0.04 0.00 0.00 34.50 30.21 2uxt s PRO 131 CO 0.11 -1.93 1.58 0.42 0.04 0.00 0.00 177.00 177.21 2uxt s ILE 132 N 4.93 3.62 -0.43 0.56 -1.09 -0.10 -4.85 121.20 123.84 2uxt s ILE 132 Ca 0.31 0.48 0.09 0.00 -2.23 0.00 0.00 60.65 59.30 2uxt s ILE 132 Cb -0.11 -4.25 0.28 0.00 -1.58 0.00 0.00 42.46 36.79 2uxt s ILE 132 CO 0.15 -1.08 0.63 0.54 -1.23 0.00 0.00 174.94 173.95 2uxt n ARG 133 N 8.87 1.17 -3.44 2.79 5.12 -1.26 0.26 116.66 130.16 2uxt n ARG 133 Ca 0.15 -3.55 -0.12 0.00 -1.93 0.00 0.00 57.85 52.41 2uxt n ARG 133 Cb 0.50 -1.54 -0.02 0.00 -1.16 0.00 0.00 32.46 30.24 2uxt n ARG 133 CO 0.00 0.00 0.00 1.14 -1.93 0.00 0.00 177.63 176.84 2uxt s GLN 134 N -1.82 1.17 0.88 5.56 -2.07 -1.26 -4.92 119.66 117.21 2uxt s GLN 134 Ca 0.38 -0.40 -0.11 0.00 -1.82 0.00 0.00 55.36 53.41 2uxt s GLN 134 Cb 0.22 0.54 0.12 0.00 -1.09 0.00 0.00 33.01 32.80 2uxt s GLN 134 CO -0.09 -0.51 1.09 -0.80 -1.32 0.00 0.00 175.29 173.67 2uxt s ASN 135 N -2.60 3.58 0.38 12.60 0.01 -1.26 -4.67 114.94 122.97 2uxt s ASN 135 Ca 0.01 1.64 -0.25 0.00 -0.71 0.00 0.00 52.86 53.55 2uxt s ASN 135 Cb -0.01 -2.31 -0.12 0.00 0.41 0.00 0.00 41.25 39.23 2uxt s ASN 135 CO -0.11 -2.60 0.99 0.00 -1.51 0.00 0.00 177.10 173.88 2uxt n ALA 136 N -3.87 0.01 -3.56 0.60 0.00 -1.26 -4.87 120.51 107.56 2uxt n ALA 136 Ca 0.08 0.28 -0.06 0.00 0.00 0.00 0.00 53.44 53.74 2uxt n ALA 136 Cb 0.54 -2.05 -0.02 0.00 0.00 0.00 0.00 19.45 17.92 2uxt n ALA 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2uxt s ALA 137 N -1.21 -1.98 -0.51 0.00 0.00 -0.73 -3.97 121.76 113.36 2uxt s ALA 137 Ca 0.61 1.41 -0.16 0.00 0.00 0.00 0.00 51.96 53.82 2uxt s ALA 137 Cb -0.60 -0.03 0.09 0.00 0.00 0.00 0.00 23.12 22.58 2uxt s ALA 137 CO 0.58 -0.59 0.48 0.99 0.00 0.00 0.00 175.76 177.21 2uxt s THR 138 N -2.52 5.16 0.00 0.00 2.01 -1.26 -1.55 115.64 117.48 2uxt s THR 138 Ca 0.07 -1.13 0.00 0.00 0.31 0.00 0.00 61.69 60.94 2uxt s THR 138 Cb -0.01 -4.24 0.00 0.00 0.01 0.00 0.00 72.50 68.26 2uxt s THR 138 CO -0.06 -0.73 0.00 0.18 -0.69 0.00 0.00 174.62 173.32 2uxt n LEU 139 N 5.41 0.00 -3.69 4.42 4.77 0.16 -4.82 117.00 123.25 2uxt n LEU 139 Ca -0.12 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.73 2uxt n LEU 139 Cb 0.43 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.45 2uxt n LEU 139 CO 0.51 -0.45 0.12 -1.66 -1.33 0.00 0.00 177.39 174.59 2uxt s TRP 140 N 0.87 -0.24 0.05 -1.77 1.48 -1.22 -1.52 118.94 116.59 2uxt s TRP 140 Ca 0.00 0.23 0.08 0.00 -1.06 0.00 0.00 56.10 55.35 2uxt s TRP 140 Cb 0.00 0.19 -0.03 0.00 -1.16 0.00 0.00 33.47 32.46 2uxt s TRP 140 CO 0.00 -0.53 -0.21 1.52 -4.06 0.00 0.00 176.95 173.67 2uxt s TYR 141 N -2.24 2.47 0.24 1.66 -0.85 -0.17 0.32 117.35 118.78 2uxt s TYR 141 Ca -0.07 -0.31 -0.22 0.00 -0.52 0.00 0.00 57.07 55.95 2uxt s TYR 141 Cb -0.01 -1.43 0.04 0.00 0.38 0.00 0.00 41.96 40.93 2uxt s TYR 141 CO -0.01 0.22 0.75 -3.38 -1.52 0.00 0.00 175.55 171.62 2uxt s HIS 142 N -0.90 -0.22 0.21 -3.49 -3.43 -0.14 -0.99 115.29 106.33 2uxt s HIS 142 Ca 0.14 -0.18 -0.30 0.00 -0.80 0.00 0.00 55.06 53.92 2uxt s HIS 142 Cb -0.10 0.68 -0.08 0.00 -1.43 0.00 0.00 32.58 31.64 2uxt s HIS 142 CO 0.04 -1.11 1.10 0.00 -2.00 0.00 0.00 174.74 172.77 2uxt s ALA 143 N -3.77 3.38 -0.10 -1.38 0.00 -0.68 -1.48 121.76 117.73 2uxt s ALA 143 Ca 0.10 0.83 0.19 0.00 0.00 0.00 0.00 51.96 53.08 2uxt s ALA 143 Cb -0.05 -3.34 0.43 0.00 0.00 0.00 0.00 23.12 20.16 2uxt s ALA 143 CO 0.04 -0.18 1.19 0.27 0.00 0.00 0.00 175.76 177.08 2uxt n ASN 144 N 2.05 1.35 -4.69 0.00 6.94 -0.15 -4.74 115.26 116.02 2uxt n ASN 144 Ca 0.02 -2.87 -0.43 0.00 -0.02 0.00 0.00 54.58 51.27 2uxt n ASN 144 Cb 0.46 -0.40 -0.03 0.00 -2.36 0.00 0.00 39.78 37.44 2uxt n ASN 144 CO 0.00 0.00 0.00 0.41 -1.03 0.00 0.00 177.26 176.64 2uxt n THR 145 N -0.24 0.29 -1.64 5.53 -1.04 -1.24 -4.74 114.28 111.20 2uxt n THR 145 Ca 0.12 -0.05 -0.49 0.00 -2.04 0.00 0.00 64.05 61.59 2uxt n THR 145 Cb 0.94 -1.99 -0.05 0.00 -1.82 0.00 0.00 70.33 67.41 2uxt n THR 145 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2uxt n PRO 146 N 5.22 1.73 0.00 -2.82 -0.02 -1.26 -1.63 135.00 136.22 2uxt n PRO 146 Ca 0.18 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 2uxt n PRO 146 Cb 0.35 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.49 2uxt n PRO 146 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2uxt n ASN 147 N 3.16 0.00 -0.03 2.55 3.02 -1.26 -4.71 115.26 117.99 2uxt n ASN 147 Ca 0.18 0.00 0.01 0.00 -0.03 0.00 0.00 54.58 54.73 2uxt n ASN 147 Cb 0.25 -0.39 0.01 0.00 -0.61 0.00 0.00 39.78 39.03 2uxt n ASN 147 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2uxt n ARG 148 N -1.97 1.56 -0.21 3.52 1.74 -0.65 -4.83 116.66 115.82 2uxt n ARG 148 Ca 0.00 -1.13 -0.04 0.00 -0.77 0.00 0.00 57.85 55.91 2uxt n ARG 148 Cb 0.00 -0.80 0.06 0.00 -1.02 0.00 0.00 32.46 30.70 2uxt n ARG 148 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 2uxt h THR 149 N 1.53 1.07 -0.13 0.55 2.02 -1.62 -0.12 112.91 116.21 2uxt h THR 149 Ca 0.00 -0.25 0.04 0.00 0.77 0.00 0.00 66.41 66.97 2uxt h THR 149 Cb 0.77 0.27 -0.05 0.00 -1.74 0.00 0.00 68.15 67.40 2uxt h THR 149 CO 0.00 0.13 -0.18 0.00 0.37 0.00 0.00 175.52 175.84 2uxt h ALA 150 N 1.27 -0.12 -0.30 6.16 0.00 -1.88 -1.01 119.26 123.38 2uxt h ALA 150 Ca 0.25 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.13 2uxt h ALA 150 Cb 0.03 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2uxt h ALA 150 CO -0.11 -0.64 -0.12 1.96 0.00 0.00 0.00 179.25 180.35 2uxt h GLN 151 N -0.23 0.61 -0.39 0.00 1.08 -1.88 -2.21 115.11 112.09 2uxt h GLN 151 Ca 0.10 -0.25 -0.06 0.00 -1.45 0.00 0.00 58.65 56.99 2uxt h GLN 151 Cb 0.37 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.76 2uxt h GLN 151 CO -0.27 0.82 0.00 1.96 -0.95 0.00 0.00 178.83 180.40 2uxt h GLN 152 N 0.36 0.62 0.08 1.46 4.20 -0.83 -0.95 115.11 120.04 2uxt h GLN 152 Ca 0.07 -0.14 -0.19 0.00 0.06 0.00 0.00 58.65 58.45 2uxt h GLN 152 Cb 0.63 -0.08 0.02 0.00 0.30 0.00 0.00 27.48 28.34 2uxt h GLN 152 CO 0.04 0.63 -0.79 0.28 -0.67 0.00 0.00 178.83 178.32 2uxt h VAL 153 N 0.59 1.44 0.00 -0.54 2.07 -1.23 -2.26 116.25 116.31 2uxt h VAL 153 Ca 0.12 -2.32 -0.00 0.00 0.82 0.00 0.00 66.70 65.32 2uxt h VAL 153 Cb 0.36 2.86 -0.00 0.00 -1.52 0.00 0.00 31.29 32.99 2uxt h VAL 153 CO 0.01 0.67 -0.01 0.22 0.02 0.00 0.00 177.57 178.48 2uxt h TYR 154 N -0.15 0.00 0.00 1.57 3.20 -1.31 -0.56 116.97 119.72 2uxt h TYR 154 Ca -0.12 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.72 2uxt h TYR 154 Cb 1.54 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 39.81 2uxt h TYR 154 CO 0.16 0.01 -0.16 -0.91 -1.64 0.00 0.00 178.16 175.63 2uxt h ASN 155 N 0.00 0.00 0.00 -2.11 2.35 -1.18 -3.47 115.58 111.18 2uxt h ASN 155 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2uxt h ASN 155 Cb 0.03 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.40 2uxt h ASN 155 CO 0.00 0.16 0.00 0.61 -1.65 0.00 0.00 177.43 176.55 2uxt n GLY 156 N 0.16 0.64 2.97 2.83 0.00 -0.22 -1.55 105.19 110.02 2uxt n GLY 156 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 2uxt n GLY 156 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2uxt n LEU 157 N 0.00 6.38 -3.50 0.99 4.77 -0.86 -1.78 117.00 123.00 2uxt n LEU 157 Ca 0.00 -4.43 -0.13 0.00 -0.03 0.00 0.00 56.01 51.41 2uxt n LEU 157 Cb 0.00 -1.57 -0.04 0.00 -2.33 0.00 0.00 43.42 39.49 2uxt n LEU 157 CO 0.00 1.13 0.35 0.00 -1.33 0.00 0.00 177.39 177.53 2uxt s ALA 158 N 1.56 -1.48 0.12 -1.18 0.00 -1.26 -1.69 121.76 117.84 2uxt s ALA 158 Ca 0.43 0.60 -0.26 0.00 0.00 0.00 0.00 51.96 52.73 2uxt s ALA 158 Cb 0.09 0.58 0.07 0.00 0.00 0.00 0.00 23.12 23.86 2uxt s ALA 158 CO -0.01 -0.62 1.02 0.20 0.00 0.00 0.00 175.76 176.35 2uxt s GLY 159 N -2.28 -0.26 0.16 0.00 0.00 -0.16 -1.55 107.32 103.23 2uxt s GLY 159 Ca -0.02 0.21 -0.16 0.00 0.00 0.00 0.00 44.72 44.75 2uxt s GLY 159 CO -0.06 0.04 0.60 -0.29 0.00 0.00 0.00 173.10 173.39 2uxt s MET 160 N -3.13 4.06 -0.15 2.90 1.75 -1.26 -0.99 119.30 122.47 2uxt s MET 160 Ca 0.13 0.60 -0.02 0.00 -1.25 0.00 0.00 55.69 55.15 2uxt s MET 160 Cb -0.00 -2.92 0.05 0.00 2.84 0.00 0.00 34.83 34.79 2uxt s MET 160 CO 0.01 0.46 -0.00 -0.46 -0.65 0.00 0.00 175.02 174.38 2uxt s TRP 161 N -1.47 1.15 -0.15 4.11 -0.11 -0.58 -1.61 118.94 120.27 2uxt s TRP 161 Ca 0.39 -0.75 -0.08 0.00 1.22 0.00 0.00 56.10 56.88 2uxt s TRP 161 Cb -0.16 -1.06 -0.04 0.00 -1.50 0.00 0.00 33.47 30.71 2uxt s TRP 161 CO 0.20 -0.54 0.11 -0.51 -4.62 0.00 0.00 176.95 171.58 2uxt s LEU 162 N 1.82 4.14 -0.15 5.86 1.43 0.18 0.36 118.68 132.33 2uxt s LEU 162 Ca 0.01 0.29 -0.03 0.00 -1.03 0.00 0.00 54.13 53.37 2uxt s LEU 162 Cb -0.15 -2.03 -0.02 0.00 0.03 0.00 0.00 46.19 44.01 2uxt s LEU 162 CO -0.07 0.29 -0.06 -0.69 0.23 0.00 0.00 176.35 176.05 2uxt s VAL 163 N -0.31 3.68 0.24 -1.59 1.01 -0.59 -0.82 120.40 122.02 2uxt s VAL 163 Ca 0.10 -0.44 0.10 0.00 0.00 0.00 0.00 61.98 61.75 2uxt s VAL 163 Cb -0.12 -2.60 -0.04 0.00 0.00 0.00 0.00 36.38 33.62 2uxt s VAL 163 CO 0.01 0.50 -0.11 -1.61 0.00 0.00 0.00 175.10 173.89 2uxt s GLU 164 N 0.32 1.96 0.11 2.72 0.41 0.64 -1.78 118.70 123.09 2uxt s GLU 164 Ca -0.06 -1.49 0.00 0.00 -0.41 0.00 0.00 54.97 53.02 2uxt s GLU 164 Cb -0.15 -2.01 -0.00 0.00 -1.78 0.00 0.00 34.13 30.19 2uxt s GLU 164 CO 0.04 0.38 0.14 -0.40 -0.49 0.00 0.00 175.26 174.92 2uxt n ASP 165 N -0.42 -0.38 0.26 -0.19 5.68 -1.26 -0.51 116.55 119.73 2uxt n ASP 165 Ca -0.08 -1.64 0.14 0.00 -0.50 0.00 0.00 54.79 52.71 2uxt n ASP 165 Cb 0.58 0.75 0.63 0.00 -1.14 0.00 0.00 41.12 41.94 2uxt n ASP 165 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2uxt h GLU 166 N 0.00 0.00 0.07 0.11 5.08 -2.00 -2.58 114.58 115.27 2uxt h GLU 166 Ca -0.08 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.27 2uxt h GLU 166 Cb 0.39 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.64 2uxt h GLU 166 CO 0.12 0.10 -0.03 0.28 -1.00 0.00 0.00 179.01 178.48 2uxt h VAL 167 N 0.00 1.12 -0.70 3.13 2.07 -1.98 -2.85 116.25 117.04 2uxt h VAL 167 Ca -0.00 -1.49 0.08 0.00 0.82 0.00 0.00 66.70 66.11 2uxt h VAL 167 Cb 0.55 1.98 -0.05 0.00 -1.52 0.00 0.00 31.29 32.25 2uxt h VAL 167 CO 0.01 0.33 0.46 0.77 0.02 0.00 0.00 177.57 179.16 2uxt h SER 168 N -0.87 0.56 -0.21 0.57 4.64 -1.94 -1.44 113.55 114.86 2uxt h SER 168 Ca -0.01 0.01 -0.15 0.00 -0.47 0.00 0.00 61.79 61.17 2uxt h SER 168 Cb 0.61 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 2uxt h SER 168 CO 0.02 0.35 -0.40 0.50 -0.87 0.00 0.00 176.83 176.42 2uxt h LYS 169 N 0.63 0.76 -0.00 4.77 3.64 -1.54 -3.25 116.57 121.58 2uxt h LYS 169 Ca 0.32 -0.40 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 2uxt h LYS 169 Cb 0.40 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 2uxt h LYS 169 CO -0.11 1.02 -0.26 -1.13 -2.27 0.00 0.00 179.45 176.70 2uxt n SER 170 N -4.04 0.43 -4.74 4.20 3.41 -0.66 -4.90 113.62 107.33 2uxt n SER 170 Ca -0.02 -0.22 -0.41 0.00 -0.26 0.00 0.00 58.87 57.96 2uxt n SER 170 Cb 0.54 -0.02 -0.04 0.00 -0.26 0.00 0.00 64.21 64.43 2uxt n SER 170 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2uxt s LEU 171 N -2.82 4.49 -1.36 1.04 1.43 -0.64 -4.92 118.68 115.90 2uxt s LEU 171 Ca 0.17 2.09 -0.14 0.00 -1.03 0.00 0.00 54.13 55.23 2uxt s LEU 171 Cb 0.19 -3.60 -0.03 0.00 0.03 0.00 0.00 46.19 42.78 2uxt s LEU 171 CO 0.59 -0.23 2.35 -0.81 0.23 0.00 0.00 176.35 178.48 2uxt n PRO 172 N 2.40 2.80 -4.15 1.29 -0.04 -1.26 -4.85 135.00 131.19 2uxt n PRO 172 Ca 0.03 -2.31 -0.12 0.00 -0.04 0.00 0.00 63.50 61.06 2uxt n PRO 172 Cb 0.46 -3.06 -0.10 0.00 -0.04 0.00 0.00 33.50 30.76 2uxt n PRO 172 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2uxt s ILE 173 N 3.24 0.71 0.15 0.52 -4.36 -1.26 -4.70 121.20 115.50 2uxt s ILE 173 Ca 0.53 -1.74 -0.34 0.00 -0.26 0.00 0.00 60.65 58.84 2uxt s ILE 173 Cb 0.15 -1.45 -0.15 0.00 1.25 0.00 0.00 42.46 42.26 2uxt s ILE 173 CO -0.05 -0.74 1.39 -2.65 0.24 0.00 0.00 174.94 173.13 2uxt n PRO 174 N 0.31 1.59 -0.75 0.37 -0.02 -1.26 -4.87 135.00 130.36 2uxt n PRO 174 Ca -0.15 0.57 -0.00 0.00 -2.02 0.00 0.00 63.50 61.90 2uxt n PRO 174 Cb 0.59 -2.23 -0.01 0.00 -0.02 0.00 0.00 33.50 31.84 2uxt n PRO 174 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2uxt n ASN 175 N 2.63 0.03 -4.32 2.55 0.23 -1.26 -4.81 115.26 110.30 2uxt n ASN 175 Ca 0.16 -1.69 -0.46 0.00 -0.53 0.00 0.00 54.58 52.06 2uxt n ASN 175 Cb 0.25 -0.08 -0.03 0.00 -2.08 0.00 0.00 39.78 37.83 2uxt n ASN 175 CO 0.00 0.00 0.00 -1.00 -0.93 0.00 0.00 177.26 175.33 2uxt s HIS 176 N 0.00 3.53 -0.02 -2.53 3.76 -1.26 -4.96 115.29 113.82 2uxt s HIS 176 Ca 0.06 -1.68 -0.37 0.00 -0.15 0.00 0.00 55.06 52.92 2uxt s HIS 176 Cb 0.07 -3.82 -0.16 0.00 1.11 0.00 0.00 32.58 29.78 2uxt s HIS 176 CO -0.03 -1.02 1.51 0.98 -0.85 0.00 0.00 174.74 175.33 2uxt n TYR 177 N 4.57 1.78 -0.84 1.40 9.36 -1.26 -0.52 117.16 131.66 2uxt n TYR 177 Ca 0.02 0.54 0.00 0.00 3.32 0.00 0.00 57.90 61.78 2uxt n TYR 177 Cb 0.44 -2.41 0.00 0.00 -0.63 0.00 0.00 39.34 36.74 2uxt n TYR 177 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2uxt n GLY 178 N 3.18 0.96 1.10 2.98 0.00 0.11 -4.81 105.19 108.71 2uxt n GLY 178 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 2uxt n GLY 178 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2uxt n VAL 179 N -2.00 0.35 -1.35 1.61 0.31 0.32 -4.88 118.33 112.69 2uxt n VAL 179 Ca 0.00 0.12 0.01 0.00 -0.01 0.00 0.00 64.34 64.46 2uxt n VAL 179 Cb 0.00 -1.44 0.02 0.00 -0.91 0.00 0.00 33.84 31.51 2uxt n VAL 179 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 2uxt n ASP 180 N -3.13 0.52 -3.45 4.52 5.75 -0.63 -4.70 116.55 115.44 2uxt n ASP 180 Ca 0.00 -1.83 -0.17 0.00 -0.01 0.00 0.00 54.79 52.79 2uxt n ASP 180 Cb 0.32 -0.15 -0.11 0.00 -1.03 0.00 0.00 41.12 40.15 2uxt n ASP 180 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2uxt s ASP 181 N -0.93 1.30 0.09 -1.12 2.15 -1.13 -0.09 116.67 116.94 2uxt s ASP 181 Ca 0.04 -0.29 0.08 0.00 0.43 0.00 0.00 52.55 52.81 2uxt s ASP 181 Cb 0.04 0.52 -0.03 0.00 -0.30 0.00 0.00 42.92 43.14 2uxt s ASP 181 CO 0.00 -0.34 -0.22 -0.36 -0.17 0.00 0.00 175.17 174.09 2uxt s PHE 182 N 2.37 1.88 0.08 -5.34 0.40 -0.15 -0.71 117.98 116.50 2uxt s PHE 182 Ca 0.08 -0.40 -0.23 0.00 -0.60 0.00 0.00 56.93 55.78 2uxt s PHE 182 Cb -0.15 -1.05 -0.06 0.00 0.51 0.00 0.00 43.02 42.26 2uxt s PHE 182 CO -0.18 0.19 0.70 -1.25 0.70 0.00 0.00 175.22 175.38 2uxt s PRO 183 N -1.73 4.42 -0.45 0.24 0.04 -1.26 -0.11 135.00 136.16 2uxt s PRO 183 Ca 0.08 0.97 0.02 0.00 0.04 0.00 0.00 61.00 62.11 2uxt s PRO 183 Cb -0.10 -3.30 0.13 0.00 0.04 0.00 0.00 34.50 31.27 2uxt s PRO 183 CO 0.04 0.47 0.23 0.08 0.04 0.00 0.00 177.00 177.86 2uxt s VAL 184 N -0.65 1.69 -0.54 -0.36 1.01 0.72 -4.84 120.40 117.43 2uxt s VAL 184 Ca 0.34 -2.69 -0.20 0.00 0.00 0.00 0.00 61.98 59.44 2uxt s VAL 184 Cb -0.21 -2.18 0.06 0.00 0.00 0.00 0.00 36.38 34.05 2uxt s VAL 184 CO 0.22 -0.86 0.71 -0.63 0.00 0.00 0.00 175.10 174.54 2uxt s ILE 185 N 0.26 4.76 -0.13 2.22 1.01 -1.26 -1.12 121.20 126.94 2uxt s ILE 185 Ca 0.17 -0.45 -0.18 0.00 0.00 0.00 0.00 60.65 60.19 2uxt s ILE 185 Cb -0.25 -4.39 -0.04 0.00 0.01 0.00 0.00 42.46 37.79 2uxt s ILE 185 CO -0.01 -0.95 0.48 -0.63 0.00 0.00 0.00 174.94 173.84 2uxt s ILE 186 N 2.93 5.18 0.04 2.92 1.01 0.47 -1.09 121.20 132.66 2uxt s ILE 186 Ca 0.17 0.95 -0.06 0.00 0.00 0.00 0.00 60.65 61.71 2uxt s ILE 186 Cb -0.19 -3.82 -0.01 0.00 0.01 0.00 0.00 42.46 38.46 2uxt s ILE 186 CO 0.12 0.31 0.11 -1.10 0.00 0.00 0.00 174.94 174.39 2uxt s GLN 187 N 0.71 0.60 0.03 2.79 -0.21 -0.37 -1.41 119.66 121.81 2uxt s GLN 187 Ca 0.26 -0.72 0.07 0.00 0.02 0.00 0.00 55.36 54.98 2uxt s GLN 187 Cb -0.15 0.24 -0.03 0.00 1.00 0.00 0.00 33.01 34.07 2uxt s GLN 187 CO 0.10 -0.15 -0.17 0.16 -2.12 0.00 0.00 175.29 173.11 2uxt s ASP 188 N -2.09 3.87 0.26 5.90 -4.77 -1.26 -0.01 116.67 118.58 2uxt s ASP 188 Ca -0.05 -0.39 -0.05 0.00 -3.30 0.00 0.00 52.55 48.75 2uxt s ASP 188 Cb -0.01 -0.66 -0.02 0.00 -1.09 0.00 0.00 42.92 41.14 2uxt s ASP 188 CO -0.04 0.26 0.35 -0.54 0.70 0.00 0.00 175.17 175.90 2uxt s LYS 189 N -1.40 1.53 -0.13 2.11 1.02 0.30 -4.58 119.74 118.59 2uxt s LYS 189 Ca 0.15 -1.53 0.03 0.00 0.02 0.00 0.00 55.97 54.63 2uxt s LYS 189 Cb -0.11 0.39 0.01 0.00 -0.52 0.00 0.00 37.83 37.60 2uxt s LYS 189 CO 0.05 -0.59 -0.23 1.03 -0.92 0.00 0.00 175.35 174.69 2uxt s ARG 190 N -3.82 3.03 -0.08 1.68 0.52 -1.26 -1.09 118.95 117.93 2uxt s ARG 190 Ca 0.31 -0.86 0.04 0.00 -0.52 0.00 0.00 55.73 54.69 2uxt s ARG 190 Cb 0.02 -2.39 -0.01 0.00 0.52 0.00 0.00 34.95 33.09 2uxt s ARG 190 CO 0.14 0.05 -0.19 -0.51 0.02 0.00 0.00 175.30 174.81 2uxt s LEU 191 N 0.65 2.39 0.79 2.53 1.43 -1.26 -0.72 118.68 124.49 2uxt s LEU 191 Ca -0.11 -0.40 -0.08 0.00 -1.03 0.00 0.00 54.13 52.51 2uxt s LEU 191 Cb -0.16 -1.48 0.12 0.00 0.03 0.00 0.00 46.19 44.70 2uxt s LEU 191 CO 0.02 0.24 1.11 1.51 0.23 0.00 0.00 176.35 179.45 2uxt s ASP 192 N -0.09 4.17 0.59 2.29 1.47 -0.41 -4.88 116.67 119.81 2uxt s ASP 192 Ca -0.04 0.21 0.31 0.00 1.18 0.00 0.00 52.55 54.21 2uxt s ASP 192 Cb -0.14 -0.60 1.34 0.00 -0.34 0.00 0.00 42.92 43.17 2uxt s ASP 192 CO 0.04 -2.02 1.68 0.78 0.68 0.00 0.00 175.17 176.33 2uxt h ASN 193 N -0.92 0.00 -0.52 2.11 4.21 -2.01 0.88 115.58 119.34 2uxt h ASN 193 Ca -0.42 0.00 -0.09 0.00 1.21 0.00 0.00 56.30 56.99 2uxt h ASN 193 Cb 1.28 0.00 -0.06 0.00 -1.12 0.00 0.00 38.32 38.42 2uxt h ASN 193 CO 0.49 0.00 0.12 0.49 -1.29 0.00 0.00 177.43 177.24 2uxt n PHE 194 N -3.65 1.79 -2.86 1.19 3.01 -1.26 -4.88 117.46 110.80 2uxt n PHE 194 Ca 0.18 -0.79 -0.20 0.00 1.01 0.00 0.00 57.45 57.65 2uxt n PHE 194 Cb 1.10 -0.51 0.01 0.00 -0.01 0.00 0.00 39.48 40.07 2uxt n PHE 194 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2uxt n GLY 195 N 0.19 -0.51 3.44 1.37 0.00 0.30 -4.44 105.19 105.55 2uxt n GLY 195 Ca 0.27 0.07 -0.34 0.00 0.00 0.00 0.00 46.02 46.02 2uxt n GLY 195 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2uxt s THR 196 N -2.97 3.71 0.25 2.61 2.01 -1.25 -4.45 115.64 115.56 2uxt s THR 196 Ca 0.20 -0.41 -0.30 0.00 0.31 0.00 0.00 61.69 61.49 2uxt s THR 196 Cb -0.10 -2.64 -0.11 0.00 0.01 0.00 0.00 72.50 69.66 2uxt s THR 196 CO 0.25 0.47 1.53 -2.84 -0.69 0.00 0.00 174.62 173.34 2uxt s PRO 197 N 0.69 4.20 -0.06 4.92 0.02 -1.26 -1.29 135.00 142.21 2uxt s PRO 197 Ca -0.02 2.43 0.05 0.00 0.02 0.00 0.00 61.00 63.47 2uxt s PRO 197 Cb -0.15 -3.08 -0.00 0.00 0.02 0.00 0.00 34.50 31.29 2uxt s PRO 197 CO 0.02 -0.54 -0.22 -1.83 -0.33 0.00 0.00 177.00 174.10 2uxt s GLU 198 N -0.15 2.41 -0.12 5.54 -1.05 0.10 -4.91 118.70 120.53 2uxt s GLU 198 Ca 0.63 -0.79 0.03 0.00 -0.15 0.00 0.00 54.97 54.69 2uxt s GLU 198 Cb -0.45 -1.99 0.00 0.00 -0.44 0.00 0.00 34.13 31.26 2uxt s GLU 198 CO 0.43 0.28 -0.23 -0.47 0.95 0.00 0.00 175.26 176.22 2uxt s TYR 199 N 0.06 2.62 -0.22 4.83 5.04 -1.26 -4.22 117.35 124.19 2uxt s TYR 199 Ca -0.08 -1.16 0.02 0.00 -2.44 0.00 0.00 57.07 53.41 2uxt s TYR 199 Cb -0.14 -1.76 0.05 0.00 0.35 0.00 0.00 41.96 40.45 2uxt s TYR 199 CO 0.05 -0.49 -0.10 1.21 -1.34 0.00 0.00 175.55 174.87 2uxt s ASN 200 N 0.55 3.79 -0.30 4.32 3.04 -1.26 -5.08 114.94 120.00 2uxt s ASN 200 Ca -0.13 -1.08 -0.28 0.00 0.04 0.00 0.00 52.86 51.40 2uxt s ASN 200 Cb -0.17 -1.34 -0.02 0.00 -1.54 0.00 0.00 41.25 38.18 2uxt s ASN 200 CO 0.04 -0.16 1.80 -0.70 -3.04 0.00 0.00 177.10 175.03 2uxt s GLU 201 N 1.29 3.41 0.95 0.43 2.12 -1.26 -4.85 118.70 120.79 2uxt s GLU 201 Ca -0.04 1.51 -0.11 0.00 0.36 0.00 0.00 54.97 56.70 2uxt s GLU 201 Cb -0.18 -4.18 0.17 0.00 0.26 0.00 0.00 34.13 30.20 2uxt s GLU 201 CO -0.07 -1.77 1.11 -1.25 -0.54 0.00 0.00 175.26 172.74 2uxt s PRO 202 N 5.53 0.74 -0.03 4.30 0.04 -1.26 -4.97 135.00 139.35 2uxt s PRO 202 Ca 0.80 1.32 -0.10 0.00 0.04 0.00 0.00 61.00 63.06 2uxt s PRO 202 Cb -0.24 -1.71 -0.31 0.00 0.04 0.00 0.00 34.50 32.28 2uxt s PRO 202 CO 0.33 -2.75 0.74 0.78 0.04 0.00 0.00 177.00 176.15 2uxt h GLY 203 N -1.94 0.45 -7.13 0.56 0.00 -1.97 -3.44 103.07 89.60 2uxt h GLY 203 Ca -0.47 -1.16 -0.54 0.00 0.00 0.00 0.00 47.33 45.15 2uxt h GLY 203 CO 0.45 1.01 -0.79 -0.45 0.00 0.00 0.00 176.54 176.77 2uxt s SER 204 N -7.29 2.84 0.00 0.19 0.15 -1.26 -5.10 113.70 103.23 2uxt s SER 204 Ca -0.14 -0.69 0.00 0.00 0.70 0.00 0.00 55.95 55.82 2uxt s SER 204 Cb 0.05 -0.85 0.00 0.00 -1.71 0.00 0.00 66.02 63.51 2uxt s SER 204 CO 0.87 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 175.71 2uxt n GLY 205 N 4.91 -0.06 3.74 9.45 0.00 -1.26 -5.03 105.19 116.94 2uxt n GLY 205 Ca -0.11 -1.99 -0.23 0.00 0.00 0.00 0.00 46.02 43.69 2uxt n GLY 205 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2uxt s GLY 206 N 0.00 1.97 0.23 -0.02 0.00 -1.26 -4.46 107.32 103.78 2uxt s GLY 206 Ca 0.00 -1.84 -0.30 0.00 0.00 0.00 0.00 44.72 42.58 2uxt s GLY 206 CO 0.00 -1.76 1.18 -0.12 0.00 0.00 0.00 173.10 172.40 2uxt s PHE 207 N -2.43 3.44 -0.05 1.90 2.19 -1.26 -4.85 117.98 116.92 2uxt s PHE 207 Ca 0.38 1.52 0.01 0.00 0.33 0.00 0.00 56.93 59.17 2uxt s PHE 207 Cb -0.02 -3.41 0.02 0.00 -1.31 0.00 0.00 43.02 38.30 2uxt s PHE 207 CO 0.23 -1.05 -0.04 0.08 1.83 0.00 0.00 175.22 176.27 2uxt s VAL 208 N -0.53 0.53 0.50 3.12 1.01 -1.26 -3.67 120.40 120.10 2uxt s VAL 208 Ca 0.50 -0.11 0.08 0.00 0.00 0.00 0.00 61.98 62.45 2uxt s VAL 208 Cb -0.33 -0.57 0.04 0.00 0.00 0.00 0.00 36.38 35.52 2uxt s VAL 208 CO 0.40 0.23 0.55 -0.83 0.00 0.00 0.00 175.10 175.45 2uxt s GLY 209 N 1.02 2.03 0.00 4.51 0.00 -1.26 -4.93 107.32 108.69 2uxt s GLY 209 Ca -0.09 -1.78 0.08 0.00 0.00 0.00 0.00 44.72 42.92 2uxt s GLY 209 CO -0.00 -1.73 0.74 2.09 0.00 0.00 0.00 173.10 174.20 2uxt n ASP 210 N -1.89 1.63 -4.19 1.64 5.75 -0.52 -4.49 116.55 114.49 2uxt n ASP 210 Ca 0.07 -1.32 -0.33 0.00 -0.01 0.00 0.00 54.79 53.20 2uxt n ASP 210 Cb 0.62 0.01 -0.16 0.00 -1.03 0.00 0.00 41.12 40.56 2uxt n ASP 210 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2uxt s THR 211 N -0.66 2.28 -0.09 2.12 2.01 -0.25 -1.79 115.64 119.26 2uxt s THR 211 Ca 0.09 -0.89 -0.22 0.00 0.31 0.00 0.00 61.69 60.98 2uxt s THR 211 Cb 0.06 -1.95 -0.04 0.00 0.01 0.00 0.00 72.50 70.59 2uxt s THR 211 CO 0.10 0.53 0.65 -0.22 -0.69 0.00 0.00 174.62 174.99 2uxt s LEU 212 N 1.00 4.29 0.06 4.42 0.20 -1.26 -0.54 118.68 126.85 2uxt s LEU 212 Ca -0.02 1.07 0.09 0.00 0.69 0.00 0.00 54.13 55.96 2uxt s LEU 212 Cb -0.15 -2.98 -0.03 0.00 -0.43 0.00 0.00 46.19 42.60 2uxt s LEU 212 CO -0.05 -0.11 -0.25 -0.76 -0.29 0.00 0.00 176.35 174.89 2uxt s LEU 213 N 0.89 2.20 -0.18 -0.68 1.02 0.99 -3.40 118.68 119.53 2uxt s LEU 213 Ca 0.34 -0.60 -0.00 0.00 0.02 0.00 0.00 54.13 53.88 2uxt s LEU 213 Cb -0.17 -1.18 0.04 0.00 0.02 0.00 0.00 46.19 44.91 2uxt s LEU 213 CO 0.15 0.21 -0.05 -0.69 0.02 0.00 0.00 176.35 176.00 2uxt s VAL 214 N -0.86 1.14 -1.97 -1.59 1.01 0.18 -1.24 120.40 117.06 2uxt s VAL 214 Ca 0.11 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.39 2uxt s VAL 214 Cb -0.10 -1.34 0.00 0.00 0.00 0.00 0.00 36.38 34.95 2uxt s VAL 214 CO 0.03 0.09 0.00 0.59 0.00 0.00 0.00 175.10 175.80 2uxt n ASN 215 N 4.86 -5.54 0.00 3.32 3.02 -0.25 -2.28 115.26 118.39 2uxt n ASN 215 Ca -0.12 0.30 0.00 0.00 -0.03 0.00 0.00 54.58 54.73 2uxt n ASN 215 Cb 0.47 -4.71 0.00 0.00 -0.61 0.00 0.00 39.78 34.93 2uxt n ASN 215 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2uxt n GLY 216 N -0.71 0.07 3.53 7.41 0.00 -1.26 -4.71 105.19 109.52 2uxt n GLY 216 Ca -0.22 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.53 2uxt n GLY 216 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2uxt s VAL 217 N -2.00 2.98 0.13 1.61 0.11 -0.97 -4.60 120.40 117.66 2uxt s VAL 217 Ca 0.00 -1.70 -0.30 0.00 -2.93 0.00 0.00 61.98 57.05 2uxt s VAL 217 Cb 0.00 -2.45 -0.06 0.00 -1.53 0.00 0.00 36.38 32.34 2uxt s VAL 217 CO 0.00 -0.08 0.98 -1.10 -3.33 0.00 0.00 175.10 171.57 2uxt s GLN 218 N -2.69 4.70 -0.06 1.54 -0.21 -1.26 0.47 119.66 122.15 2uxt s GLN 218 Ca 0.23 1.49 -0.01 0.00 0.02 0.00 0.00 55.36 57.09 2uxt s GLN 218 Cb -0.09 -3.36 0.00 0.00 1.00 0.00 0.00 33.01 30.57 2uxt s GLN 218 CO 0.13 0.23 0.04 0.43 -2.12 0.00 0.00 175.29 174.00 2uxt n SER 219 N 2.62 -0.28 -4.10 5.90 7.64 -1.22 -4.60 113.62 119.58 2uxt n SER 219 Ca 0.02 -0.07 -0.30 0.00 1.01 0.00 0.00 58.87 59.53 2uxt n SER 219 Cb 0.49 -0.10 0.19 0.00 -1.01 0.00 0.00 64.21 63.78 2uxt n SER 219 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2uxt s PRO 220 N -3.52 0.31 0.21 1.43 0.04 -1.26 -4.65 135.00 127.55 2uxt s PRO 220 Ca 0.01 -0.31 0.10 0.00 0.04 0.00 0.00 61.00 60.85 2uxt s PRO 220 Cb -0.01 -1.80 -0.05 0.00 0.04 0.00 0.00 34.50 32.69 2uxt s PRO 220 CO 0.06 -2.65 -0.20 1.52 0.04 0.00 0.00 177.00 175.77 2uxt s TYR 221 N -3.69 2.07 -0.04 0.56 1.13 -0.03 -1.79 117.35 115.56 2uxt s TYR 221 Ca 0.73 -0.41 0.01 0.00 -1.41 0.00 0.00 57.07 55.98 2uxt s TYR 221 Cb -0.05 -0.98 0.02 0.00 -1.10 0.00 0.00 41.96 39.84 2uxt s TYR 221 CO 0.53 0.48 -0.04 0.54 -2.51 0.00 0.00 175.55 174.56 2uxt s VAL 222 N -2.16 0.51 -0.08 -3.49 0.11 0.32 -0.56 120.40 115.04 2uxt s VAL 222 Ca 0.22 -0.10 -0.24 0.00 -2.93 0.00 0.00 61.98 58.92 2uxt s VAL 222 Cb -0.06 -0.55 -0.03 0.00 -1.53 0.00 0.00 36.38 34.22 2uxt s VAL 222 CO 0.10 0.22 0.73 -1.61 -3.33 0.00 0.00 175.10 171.21 2uxt s GLU 223 N 0.96 4.41 0.19 1.54 2.02 -1.26 -0.75 118.70 125.81 2uxt s GLU 223 Ca -0.10 0.92 0.01 0.00 0.02 0.00 0.00 54.97 55.82 2uxt s GLU 223 Cb -0.14 -3.47 -0.05 0.00 0.10 0.00 0.00 34.13 30.57 2uxt s GLU 223 CO -0.00 -0.02 0.04 0.14 0.02 0.00 0.00 175.26 175.44 2uxt s VAL 224 N 1.08 0.55 0.64 2.63 -7.23 0.99 -4.92 120.40 114.13 2uxt s VAL 224 Ca 0.38 -1.98 -0.04 0.00 -1.81 0.00 0.00 61.98 58.53 2uxt s VAL 224 Cb -0.18 -2.27 0.05 0.00 0.56 0.00 0.00 36.38 34.54 2uxt s VAL 224 CO 0.17 -0.32 0.92 -0.94 -0.31 0.00 0.00 175.10 174.62 2uxt s SER 225 N -3.20 5.07 -1.37 4.85 1.04 -1.26 -0.85 113.70 117.99 2uxt s SER 225 Ca 0.28 0.34 -0.16 0.00 0.48 0.00 0.00 55.95 56.89 2uxt s SER 225 Cb 0.07 -1.11 0.06 0.00 0.10 0.00 0.00 66.02 65.13 2uxt s SER 225 CO 0.07 -1.38 1.95 0.54 0.98 0.00 0.00 173.24 175.40 2uxt n ARG 226 N -2.69 3.05 -0.63 4.02 1.74 -1.10 -4.75 116.66 116.30 2uxt n ARG 226 Ca 0.07 -3.00 0.00 0.00 -0.77 0.00 0.00 57.85 54.16 2uxt n ARG 226 Cb 0.60 -3.41 0.00 0.00 -1.02 0.00 0.00 32.46 28.63 2uxt n ARG 226 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2uxt n GLY 227 N 4.84 2.33 3.74 -0.13 0.00 -1.26 -4.12 105.19 110.58 2uxt n GLY 227 Ca 0.50 -0.91 -0.41 0.00 0.00 0.00 0.00 46.02 45.20 2uxt n GLY 227 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2uxt s TRP 228 N -6.53 3.44 -0.07 1.61 0.52 0.27 -1.47 118.94 116.70 2uxt s TRP 228 Ca 0.00 1.42 0.04 0.00 0.02 0.00 0.00 56.10 57.59 2uxt s TRP 228 Cb 0.00 -3.42 0.00 0.00 -1.15 0.00 0.00 33.47 28.90 2uxt s TRP 228 CO 0.00 -1.18 -0.20 0.08 0.02 0.00 0.00 176.95 175.67 2uxt s VAL 229 N 0.00 1.75 -0.19 4.03 1.01 0.05 -4.64 120.40 122.41 2uxt s VAL 229 Ca 0.53 -0.86 -0.10 0.00 0.00 0.00 0.00 61.98 61.55 2uxt s VAL 229 Cb -0.32 -1.51 -0.05 0.00 0.00 0.00 0.00 36.38 34.49 2uxt s VAL 229 CO 0.36 0.49 0.12 -0.60 0.00 0.00 0.00 175.10 175.48 2uxt s ARG 230 N 0.26 4.13 -0.15 2.72 3.52 0.88 -0.40 118.95 129.90 2uxt s ARG 230 Ca -0.12 -0.23 0.01 0.00 -0.13 0.00 0.00 55.73 55.26 2uxt s ARG 230 Cb -0.16 -3.39 0.02 0.00 -1.56 0.00 0.00 34.95 29.87 2uxt s ARG 230 CO 0.06 0.33 -0.16 -0.51 -0.81 0.00 0.00 175.30 174.20 2uxt s LEU 231 N 0.28 1.83 -0.66 -0.88 1.43 -0.09 -0.98 118.68 119.61 2uxt s LEU 231 Ca 0.08 -0.53 -0.19 0.00 -1.03 0.00 0.00 54.13 52.46 2uxt s LEU 231 Cb -0.11 -1.27 0.12 0.00 0.03 0.00 0.00 46.19 44.96 2uxt s LEU 231 CO -0.01 -0.03 0.77 -0.13 0.23 0.00 0.00 176.35 177.18 2uxt s ARG 232 N 1.36 3.17 0.01 1.70 0.52 0.85 -1.44 118.95 125.12 2uxt s ARG 232 Ca 0.04 -1.46 -0.29 0.00 -0.52 0.00 0.00 55.73 53.49 2uxt s ARG 232 Cb -0.13 -4.36 -0.04 0.00 0.52 0.00 0.00 34.95 30.94 2uxt s ARG 232 CO -0.10 -1.56 0.95 -0.51 0.02 0.00 0.00 175.30 174.10 2uxt s LEU 233 N 2.51 4.39 -0.03 2.53 1.43 0.76 -0.20 118.68 130.07 2uxt s LEU 233 Ca 0.15 1.64 0.01 0.00 -1.03 0.00 0.00 54.13 54.90 2uxt s LEU 233 Cb -0.20 -3.53 0.02 0.00 0.03 0.00 0.00 46.19 42.51 2uxt s LEU 233 CO 0.03 -0.21 -0.02 -0.22 0.23 0.00 0.00 176.35 176.15 2uxt s LEU 234 N 0.81 1.45 -0.49 1.79 2.96 -0.28 -1.43 118.68 123.49 2uxt s LEU 234 Ca 0.50 -0.07 -0.15 0.00 -0.22 0.00 0.00 54.13 54.19 2uxt s LEU 234 Cb -0.21 -0.28 0.09 0.00 0.50 0.00 0.00 46.19 46.29 2uxt s LEU 234 CO 0.27 -0.04 0.42 0.21 -1.32 0.00 0.00 176.35 175.89 2uxt s ASN 235 N 0.67 6.13 -0.37 3.68 3.84 -0.95 -0.40 114.94 127.54 2uxt s ASN 235 Ca -0.07 -1.49 0.07 0.00 0.21 0.00 0.00 52.86 51.57 2uxt s ASN 235 Cb -0.11 -2.18 0.60 0.00 -0.55 0.00 0.00 41.25 39.01 2uxt s ASN 235 CO -0.01 -0.71 1.71 0.00 -2.79 0.00 0.00 177.10 175.30 2uxt n ALA 236 N 5.20 4.94 -2.11 1.71 0.00 -0.50 -0.47 120.51 129.29 2uxt n ALA 236 Ca -0.13 -2.96 -0.29 0.00 0.00 0.00 0.00 53.44 50.06 2uxt n ALA 236 Cb 0.42 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 18.76 2uxt n ALA 236 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2uxt s SER 237 N -1.84 6.27 0.28 0.00 0.01 -1.24 -4.85 113.70 112.33 2uxt s SER 237 Ca 0.51 1.14 0.06 0.00 1.31 0.00 0.00 55.95 58.97 2uxt s SER 237 Cb 0.44 -2.34 0.42 0.00 0.21 0.00 0.00 66.02 64.75 2uxt s SER 237 CO 0.06 -0.68 1.67 0.78 0.41 0.00 0.00 173.24 175.48 2uxt h ASN 238 N 0.07 0.25 0.00 2.44 4.21 -1.88 -3.44 115.58 117.23 2uxt h ASN 238 Ca -0.46 -0.11 0.00 0.00 1.21 0.00 0.00 56.30 56.94 2uxt h ASN 238 Cb 1.20 -0.07 0.00 0.00 -1.12 0.00 0.00 38.32 38.33 2uxt h ASN 238 CO 0.62 0.67 0.00 -1.54 -1.29 0.00 0.00 177.43 175.89 2uxt n SER 239 N -4.00 0.00 -4.76 5.81 3.41 -1.24 -1.14 113.62 111.70 2uxt n SER 239 Ca -0.02 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.18 2uxt n SER 239 Cb 0.50 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.45 2uxt n SER 239 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2uxt s ARG 240 N -0.35 4.10 -0.13 4.33 3.52 -1.26 -4.73 118.95 124.43 2uxt s ARG 240 Ca 0.00 2.60 -0.03 0.00 -0.13 0.00 0.00 55.73 58.17 2uxt s ARG 240 Cb 0.00 -2.99 -0.03 0.00 -1.56 0.00 0.00 34.95 30.37 2uxt s ARG 240 CO 0.00 -0.61 -0.02 0.50 -0.81 0.00 0.00 175.30 174.37 2uxt s ARG 241 N -1.23 3.40 0.00 5.12 3.52 -1.26 -4.07 118.95 124.43 2uxt s ARG 241 Ca 0.59 -0.47 0.01 0.00 -0.13 0.00 0.00 55.73 55.73 2uxt s ARG 241 Cb -0.48 -2.88 -0.04 0.00 -1.56 0.00 0.00 34.95 30.00 2uxt s ARG 241 CO 0.55 0.44 0.05 0.71 -0.81 0.00 0.00 175.30 176.23 2uxt s TYR 242 N -0.15 3.19 -0.31 5.12 1.51 -0.43 -4.95 117.35 121.33 2uxt s TYR 242 Ca 0.04 0.15 -0.01 0.00 -1.01 0.00 0.00 57.07 56.24 2uxt s TYR 242 Cb -0.13 -1.70 0.06 0.00 -0.11 0.00 0.00 41.96 40.09 2uxt s TYR 242 CO 0.02 0.51 0.02 -0.65 -1.11 0.00 0.00 175.55 174.34 2uxt s GLN 243 N -1.70 2.27 -0.02 -0.62 -1.52 -1.26 0.26 119.66 117.08 2uxt s GLN 243 Ca 0.22 -1.40 -0.03 0.00 -1.95 0.00 0.00 55.36 52.20 2uxt s GLN 243 Cb -0.12 -3.20 -0.04 0.00 -0.22 0.00 0.00 33.01 29.43 2uxt s GLN 243 CO 0.13 -0.70 0.16 -0.51 -0.25 0.00 0.00 175.29 174.11 2uxt s LEU 244 N 1.19 4.27 0.20 2.90 1.43 0.31 -4.18 118.68 124.80 2uxt s LEU 244 Ca -0.03 0.32 -0.13 0.00 -1.03 0.00 0.00 54.13 53.26 2uxt s LEU 244 Cb -0.20 -2.48 0.00 0.00 0.03 0.00 0.00 46.19 43.54 2uxt s LEU 244 CO -0.03 0.28 0.41 -1.10 0.23 0.00 0.00 176.35 176.14 2uxt s GLN 245 N -1.80 1.33 -0.05 1.70 -0.21 -0.40 0.26 119.66 120.48 2uxt s GLN 245 Ca 0.25 -1.10 -0.16 0.00 0.02 0.00 0.00 55.36 54.38 2uxt s GLN 245 Cb -0.12 0.45 -0.05 0.00 1.00 0.00 0.00 33.01 34.28 2uxt s GLN 245 CO 0.16 -0.53 0.42 -1.64 -2.12 0.00 0.00 175.29 171.58 2uxt s MET 246 N -3.95 4.11 0.32 2.91 -1.94 -1.26 -0.54 119.30 118.94 2uxt s MET 246 Ca 0.16 0.40 0.25 0.00 -1.71 0.00 0.00 55.69 54.79 2uxt s MET 246 Cb 0.01 -3.31 1.15 0.00 2.01 0.00 0.00 34.83 34.68 2uxt s MET 246 CO 0.01 0.46 1.74 -2.95 -0.01 0.00 0.00 175.02 174.28 2uxt h ASN 247 N 5.58 0.00 -0.33 3.03 -1.07 -1.36 -1.67 115.58 119.76 2uxt h ASN 247 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.90 2uxt h ASN 247 Cb 1.20 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.45 2uxt h ASN 247 CO 0.68 0.00 0.00 -0.90 0.07 0.00 0.00 177.43 177.28 2uxt n ASP 248 N -2.35 2.99 0.00 6.14 5.75 -1.26 -4.94 116.55 122.88 2uxt n ASP 248 Ca 0.00 -1.93 0.00 0.00 -0.01 0.00 0.00 54.79 52.86 2uxt n ASP 248 Cb 0.16 -0.21 0.00 0.00 -1.03 0.00 0.00 41.12 40.04 2uxt n ASP 248 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2uxt n GLY 249 N 1.41 1.12 3.77 6.12 0.00 -0.63 -5.02 105.19 111.95 2uxt n GLY 249 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 2uxt n GLY 249 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2uxt s ARG 250 N -0.10 2.22 0.47 1.61 1.70 -1.26 -4.95 118.95 118.65 2uxt s ARG 250 Ca 0.00 1.18 -0.16 0.00 -0.47 0.00 0.00 55.73 56.28 2uxt s ARG 250 Cb 0.00 -1.89 -0.08 0.00 -0.57 0.00 0.00 34.95 32.41 2uxt s ARG 250 CO 0.00 -1.67 0.93 -1.25 -1.08 0.00 0.00 175.30 172.23 2uxt s PRO 251 N -4.89 3.97 -0.20 3.89 0.04 -1.26 -4.27 135.00 132.27 2uxt s PRO 251 Ca 0.61 0.89 -0.14 0.00 0.04 0.00 0.00 61.00 62.41 2uxt s PRO 251 Cb -0.17 -2.20 -0.04 0.00 0.04 0.00 0.00 34.50 32.12 2uxt s PRO 251 CO 0.56 -0.17 0.29 -0.51 0.04 0.00 0.00 177.00 177.21 2uxt s LEU 252 N -3.83 4.16 -0.57 -3.56 1.43 0.94 -4.86 118.68 112.38 2uxt s LEU 252 Ca 0.58 0.38 -0.18 0.00 -1.03 0.00 0.00 54.13 53.87 2uxt s LEU 252 Cb -0.10 -2.34 0.10 0.00 0.03 0.00 0.00 46.19 43.88 2uxt s LEU 252 CO 0.28 0.02 0.66 -1.00 0.23 0.00 0.00 176.35 176.53 2uxt s HIS 253 N 1.00 3.04 0.06 0.29 3.76 -1.23 -0.65 115.29 121.57 2uxt s HIS 253 Ca 0.14 -0.96 -0.29 0.00 -0.15 0.00 0.00 55.06 53.81 2uxt s HIS 253 Cb -0.14 -3.91 -0.05 0.00 1.11 0.00 0.00 32.58 29.59 2uxt s HIS 253 CO 0.05 -1.22 0.91 0.08 -0.85 0.00 0.00 174.74 173.72 2uxt s VAL 254 N 2.50 4.66 0.00 -0.90 1.01 0.98 -0.76 120.40 127.89 2uxt s VAL 254 Ca 0.10 1.95 0.00 0.00 0.00 0.00 0.00 61.98 64.03 2uxt s VAL 254 Cb -0.24 -4.26 0.00 0.00 0.00 0.00 0.00 36.38 31.87 2uxt s VAL 254 CO 0.06 0.29 0.00 2.30 0.00 0.00 0.00 175.10 177.75 2uxt n ILE 255 N 3.09 0.00 -3.73 2.22 -5.35 -0.08 -1.13 119.36 114.38 2uxt n ILE 255 Ca 0.02 -0.38 -0.09 0.00 -0.27 0.00 0.00 62.75 62.03 2uxt n ILE 255 Cb 0.50 0.90 -0.02 0.00 -1.74 0.00 0.00 39.64 39.27 2uxt n ILE 255 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 2uxt s SER 256 N -1.12 -0.33 0.00 7.28 0.01 -1.18 -1.20 113.70 117.17 2uxt s SER 256 Ca 0.00 -0.45 0.00 0.00 1.31 0.00 0.00 55.95 56.81 2uxt s SER 256 Cb 0.00 0.67 0.00 0.00 0.21 0.00 0.00 66.02 66.90 2uxt s SER 256 CO 0.00 -1.19 0.00 0.61 0.41 0.00 0.00 173.24 173.07 2uxt n GLY 257 N -0.42 1.17 0.28 3.44 0.00 -1.23 -1.86 105.19 106.57 2uxt n GLY 257 Ca -0.08 -0.39 -0.05 0.00 0.00 0.00 0.00 46.02 45.50 2uxt n GLY 257 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2uxt h ASP 258 N 0.00 -0.82 -0.59 1.61 3.32 -1.61 -1.58 116.42 116.75 2uxt h ASP 258 Ca 0.00 0.18 0.00 0.00 0.02 0.00 0.00 57.03 57.23 2uxt h ASP 258 Cb 0.00 0.43 0.00 0.00 0.22 0.00 0.00 39.33 39.98 2uxt h ASP 258 CO 0.00 -0.26 0.00 0.00 -1.72 0.00 0.00 179.24 177.26 2uxt n GLN 259 N -5.41 3.93 0.00 3.56 1.13 -0.72 -4.28 117.38 115.59 2uxt n GLN 259 Ca 0.03 -2.93 0.00 0.00 -1.94 0.00 0.00 57.00 52.17 2uxt n GLN 259 Cb 0.32 -1.96 0.00 0.00 0.11 0.00 0.00 30.24 28.71 2uxt n GLN 259 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2uxt n GLY 260 N 0.86 0.89 3.73 1.08 0.00 -0.60 -4.71 105.19 106.44 2uxt n GLY 260 Ca 0.25 -2.04 -0.39 0.00 0.00 0.00 0.00 46.02 43.84 2uxt n GLY 260 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2uxt n PHE 261 N 1.94 2.23 -1.87 1.61 3.01 -1.26 -3.98 117.46 119.15 2uxt n PHE 261 Ca 0.00 0.44 -0.31 0.00 1.01 0.00 0.00 57.45 58.59 2uxt n PHE 261 Cb 0.00 -2.36 0.01 0.00 -0.01 0.00 0.00 39.48 37.12 2uxt n PHE 261 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 2uxt s LEU 262 N -3.02 3.20 0.30 4.37 1.43 -0.34 -4.66 118.68 119.97 2uxt s LEU 262 Ca 0.69 1.40 -0.01 0.00 -1.03 0.00 0.00 54.13 55.18 2uxt s LEU 262 Cb -0.43 -4.43 0.48 0.00 0.03 0.00 0.00 46.19 41.84 2uxt s LEU 262 CO 0.51 -0.91 1.95 -0.65 0.23 0.00 0.00 176.35 177.48 2uxt h PRO 263 N -0.35 1.05 -3.50 1.29 0.11 -1.88 -2.47 132.00 126.24 2uxt h PRO 263 Ca -0.44 -0.06 -0.08 0.00 0.11 0.00 0.00 66.00 65.53 2uxt h PRO 263 Cb 1.20 -0.24 -0.15 0.00 0.11 0.00 0.00 31.00 31.92 2uxt h PRO 263 CO 0.62 0.69 -0.24 0.00 -0.21 0.00 0.00 178.00 178.86 2uxt s ALA 264 N -5.91 -0.59 0.44 -0.75 0.00 -1.26 -0.12 121.76 113.56 2uxt s ALA 264 Ca -0.11 -0.22 -0.25 0.00 0.00 0.00 0.00 51.96 51.37 2uxt s ALA 264 Cb 0.19 0.48 -0.08 0.00 0.00 0.00 0.00 23.12 23.70 2uxt s ALA 264 CO 0.79 -0.51 1.41 -2.14 0.00 0.00 0.00 175.76 175.31 2uxt s PRO 265 N -3.35 3.72 -0.13 0.00 0.02 -1.26 -4.89 135.00 129.11 2uxt s PRO 265 Ca 0.01 2.37 0.01 0.00 0.02 0.00 0.00 61.00 63.41 2uxt s PRO 265 Cb 0.02 -2.66 0.02 0.00 0.02 0.00 0.00 34.50 31.89 2uxt s PRO 265 CO -0.08 -0.77 -0.15 0.08 -0.33 0.00 0.00 177.00 175.74 2uxt s VAL 266 N -1.21 1.58 -0.19 3.83 1.01 -0.28 -4.94 120.40 120.19 2uxt s VAL 266 Ca 0.60 -0.67 -0.18 0.00 0.00 0.00 0.00 61.98 61.74 2uxt s VAL 266 Cb -0.43 -1.46 -0.03 0.00 0.00 0.00 0.00 36.38 34.46 2uxt s VAL 266 CO 0.55 0.46 0.49 -0.44 0.00 0.00 0.00 175.10 176.15 2uxt s SER 267 N 1.18 6.55 0.13 3.32 0.01 -1.26 -0.02 113.70 123.61 2uxt s SER 267 Ca -0.02 0.66 0.05 0.00 1.31 0.00 0.00 55.95 57.95 2uxt s SER 267 Cb -0.14 -2.28 -0.04 0.00 0.21 0.00 0.00 66.02 63.77 2uxt s SER 267 CO -0.05 -0.13 -0.11 0.68 0.41 0.00 0.00 173.24 174.03 2uxt s VAL 268 N 1.43 1.16 -0.07 3.43 -7.23 0.18 -4.92 120.40 114.38 2uxt s VAL 268 Ca 0.23 -1.87 -0.10 0.00 -1.81 0.00 0.00 61.98 58.44 2uxt s VAL 268 Cb -0.15 -1.64 -0.29 0.00 0.56 0.00 0.00 36.38 34.85 2uxt s VAL 268 CO 0.09 -0.61 0.57 0.50 -0.31 0.00 0.00 175.10 175.34 2uxt h LYS 269 N 3.17 0.36 -4.41 4.82 3.64 -1.91 0.27 116.57 122.50 2uxt h LYS 269 Ca -0.38 -0.61 -0.34 0.00 -1.27 0.00 0.00 60.65 58.05 2uxt h LYS 269 Cb 1.19 0.23 -0.28 0.00 -0.41 0.00 0.00 32.23 32.96 2uxt h LYS 269 CO 0.57 1.29 -0.76 -1.14 -2.27 0.00 0.00 179.45 177.15 2uxt s GLN 270 N -2.57 0.50 -0.12 1.90 0.74 -1.26 -4.49 119.66 114.35 2uxt s GLN 270 Ca -0.18 -0.24 0.03 0.00 0.05 0.00 0.00 55.36 55.02 2uxt s GLN 270 Cb 0.06 -0.47 0.01 0.00 1.10 0.00 0.00 33.01 33.70 2uxt s GLN 270 CO 0.83 0.13 -0.21 -1.17 -0.55 0.00 0.00 175.29 174.32 2uxt s LEU 271 N -0.19 2.03 0.04 3.68 2.96 0.14 -4.91 118.68 122.43 2uxt s LEU 271 Ca 0.02 -0.55 -0.21 0.00 -0.22 0.00 0.00 54.13 53.17 2uxt s LEU 271 Cb -0.03 -1.36 -0.06 0.00 0.50 0.00 0.00 46.19 45.25 2uxt s LEU 271 CO -0.00 0.09 0.62 -0.55 -1.32 0.00 0.00 176.35 175.19 2uxt s SER 272 N 0.70 7.07 -0.30 3.68 0.15 -1.26 0.11 113.70 123.86 2uxt s SER 272 Ca -0.11 1.27 -0.03 0.00 0.70 0.00 0.00 55.95 57.79 2uxt s SER 272 Cb -0.16 -2.39 0.10 0.00 -1.71 0.00 0.00 66.02 61.86 2uxt s SER 272 CO 0.01 0.15 0.13 -0.22 1.20 0.00 0.00 173.24 174.52 2uxt s LEU 273 N -0.54 0.96 0.55 3.45 2.96 0.14 -4.96 118.68 121.24 2uxt s LEU 273 Ca 0.32 -1.43 -0.05 0.00 -0.22 0.00 0.00 54.13 52.75 2uxt s LEU 273 Cb -0.19 -0.47 -0.00 0.00 0.50 0.00 0.00 46.19 46.02 2uxt s LEU 273 CO 0.19 -0.43 0.84 0.00 -1.32 0.00 0.00 176.35 175.64 2uxt s ALA 274 N 1.92 3.38 0.06 5.97 0.00 -1.26 -1.31 121.76 130.52 2uxt s ALA 274 Ca 0.10 -0.69 -0.36 0.00 0.00 0.00 0.00 51.96 51.01 2uxt s ALA 274 Cb -0.17 -2.54 -0.15 0.00 0.00 0.00 0.00 23.12 20.26 2uxt s ALA 274 CO -0.32 -0.64 1.53 -2.30 0.00 0.00 0.00 175.76 174.03 2uxt n PRO 275 N -2.44 1.65 -0.26 0.00 -0.02 -1.26 -0.97 135.00 131.70 2uxt n PRO 275 Ca 0.03 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 2uxt n PRO 275 Cb 0.57 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 2uxt n PRO 275 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2uxt n GLY 276 N 3.24 1.65 3.83 -1.23 0.00 0.38 -4.85 105.19 108.20 2uxt n GLY 276 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 2uxt n GLY 276 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2uxt s GLU 277 N -0.29 4.18 -0.01 1.61 2.02 -0.15 -4.85 118.70 121.22 2uxt s GLU 277 Ca 0.00 0.91 0.04 0.00 0.02 0.00 0.00 54.97 55.94 2uxt s GLU 277 Cb 0.00 -2.49 -0.01 0.00 0.10 0.00 0.00 34.13 31.73 2uxt s GLU 277 CO 0.00 0.16 -0.13 1.03 0.02 0.00 0.00 175.26 176.35 2uxt s ARG 278 N -2.74 1.00 -0.10 1.61 3.00 -1.26 -2.25 118.95 118.20 2uxt s ARG 278 Ca 0.54 -0.47 -0.08 0.00 0.00 0.00 0.00 55.73 55.72 2uxt s ARG 278 Cb -0.12 -0.97 0.03 0.00 0.00 0.00 0.00 34.95 33.90 2uxt s ARG 278 CO 0.18 0.26 0.26 1.03 0.00 0.00 0.00 175.30 177.03 2uxt s ARG 279 N -0.37 0.27 -0.14 3.54 0.52 -0.51 -2.96 118.95 119.31 2uxt s ARG 279 Ca 0.04 0.43 -0.05 0.00 -0.52 0.00 0.00 55.73 55.63 2uxt s ARG 279 Cb -0.05 0.05 -0.04 0.00 0.52 0.00 0.00 34.95 35.43 2uxt s ARG 279 CO -0.00 -0.08 0.05 -1.21 0.02 0.00 0.00 175.30 174.07 2uxt s GLU 280 N 0.56 3.54 0.18 3.54 2.02 -0.77 -0.17 118.70 127.60 2uxt s GLU 280 Ca -0.04 -0.34 0.06 0.00 0.02 0.00 0.00 54.97 54.68 2uxt s GLU 280 Cb -0.05 -3.05 -0.05 0.00 0.10 0.00 0.00 34.13 31.09 2uxt s GLU 280 CO -0.03 0.49 -0.13 0.96 0.02 0.00 0.00 175.26 176.58 2uxt s ILE 281 N -0.27 1.51 -0.08 -1.63 -4.36 -0.52 -0.90 121.20 114.95 2uxt s ILE 281 Ca 0.08 -2.15 0.05 0.00 -0.26 0.00 0.00 60.65 58.36 2uxt s ILE 281 Cb -0.12 -1.98 -0.00 0.00 1.25 0.00 0.00 42.46 41.61 2uxt s ILE 281 CO 0.02 -0.65 -0.23 -0.76 0.24 0.00 0.00 174.94 173.55 2uxt s LEU 282 N -3.26 2.05 -0.12 0.37 1.43 0.06 -0.91 118.68 118.30 2uxt s LEU 282 Ca 0.20 -0.52 0.02 0.00 -1.03 0.00 0.00 54.13 52.80 2uxt s LEU 282 Cb 0.01 -1.34 -0.01 0.00 0.03 0.00 0.00 46.19 44.88 2uxt s LEU 282 CO 0.04 0.18 -0.18 -0.69 0.23 0.00 0.00 176.35 175.93 2uxt s VAL 283 N 0.19 2.58 -0.45 -1.59 1.01 0.46 -3.55 120.40 119.05 2uxt s VAL 283 Ca -0.13 -0.83 -0.23 0.00 0.00 0.00 0.00 61.98 60.79 2uxt s VAL 283 Cb -0.16 -2.05 0.02 0.00 0.00 0.00 0.00 36.38 34.20 2uxt s VAL 283 CO 0.07 0.54 0.78 -0.62 0.00 0.00 0.00 175.10 175.86 2uxt s ASP 284 N 0.41 6.41 0.00 3.32 2.15 -1.26 -0.77 116.67 126.93 2uxt s ASP 284 Ca -0.14 -0.10 0.21 0.00 0.43 0.00 0.00 52.55 52.95 2uxt s ASP 284 Cb -0.17 -2.38 0.52 0.00 -0.30 0.00 0.00 42.92 40.59 2uxt s ASP 284 CO 0.06 -0.90 1.44 0.23 -0.17 0.00 0.00 175.17 175.83 2uxt n MET 285 N 6.68 2.61 0.26 4.34 2.81 -0.55 -4.61 117.12 128.67 2uxt n MET 285 Ca 0.02 -2.43 0.18 0.00 -1.81 0.00 0.00 57.70 53.66 2uxt n MET 285 Cb 0.48 -1.51 0.89 0.00 -0.71 0.00 0.00 33.22 32.37 2uxt n MET 285 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 2uxt h SER 286 N 4.07 0.00 -0.10 7.83 4.64 -1.72 -1.75 113.55 126.53 2uxt h SER 286 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2uxt h SER 286 Cb 0.95 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 2uxt h SER 286 CO 0.00 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 175.50 2uxt n ASN 287 N -3.33 0.70 0.00 4.97 0.23 -1.26 -4.89 115.26 111.68 2uxt n ASN 287 Ca 0.00 -1.74 0.00 0.00 -0.53 0.00 0.00 54.58 52.31 2uxt n ASN 287 Cb 0.33 -0.06 0.00 0.00 -2.08 0.00 0.00 39.78 37.97 2uxt n ASN 287 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2uxt n GLY 288 N 0.83 0.11 3.83 4.83 0.00 -0.66 -4.98 105.19 109.16 2uxt n GLY 288 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 2uxt n GLY 288 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2uxt s ASP 289 N -2.01 6.88 0.25 1.61 1.01 -1.26 -4.78 116.67 118.36 2uxt s ASP 289 Ca 0.00 1.07 -0.30 0.00 0.71 0.00 0.00 52.55 54.03 2uxt s ASP 289 Cb 0.00 -2.29 -0.09 0.00 1.01 0.00 0.00 42.92 41.55 2uxt s ASP 289 CO 0.00 0.24 1.11 -0.70 0.21 0.00 0.00 175.17 176.03 2uxt s GLU 290 N -1.37 4.62 0.02 8.23 2.12 -1.26 -4.68 118.70 126.39 2uxt s GLU 290 Ca 0.29 1.79 -0.02 0.00 0.36 0.00 0.00 54.97 57.40 2uxt s GLU 290 Cb -0.17 -3.21 -0.02 0.00 0.26 0.00 0.00 34.13 30.99 2uxt s GLU 290 CO 0.17 0.16 0.00 0.54 -0.54 0.00 0.00 175.26 175.60 2uxt s VAL 291 N -0.88 0.13 0.04 3.70 0.11 -0.98 -5.00 120.40 117.52 2uxt s VAL 291 Ca 0.46 -1.04 0.05 0.00 -2.93 0.00 0.00 61.98 58.52 2uxt s VAL 291 Cb -0.31 -0.53 -0.02 0.00 -1.53 0.00 0.00 36.38 33.98 2uxt s VAL 291 CO 0.39 -0.57 -0.13 -0.44 -3.33 0.00 0.00 175.10 171.02 2uxt s SER 292 N -1.74 1.58 -0.07 3.54 0.01 -1.26 0.91 113.70 116.68 2uxt s SER 292 Ca -0.11 -0.47 -0.17 0.00 1.31 0.00 0.00 55.95 56.50 2uxt s SER 292 Cb -0.06 -0.09 -0.05 0.00 0.21 0.00 0.00 66.02 66.03 2uxt s SER 292 CO -0.02 0.00 0.46 -0.63 0.41 0.00 0.00 173.24 173.46 2uxt s ILE 293 N -0.92 5.10 0.22 1.44 1.01 0.84 -0.87 121.20 128.02 2uxt s ILE 293 Ca 0.00 0.93 0.07 0.00 0.00 0.00 0.00 60.65 61.65 2uxt s ILE 293 Cb -0.08 -3.79 -0.05 0.00 0.01 0.00 0.00 42.46 38.55 2uxt s ILE 293 CO 0.01 0.42 -0.11 0.42 0.00 0.00 0.00 174.94 175.69 2uxt s THR 294 N -0.05 1.60 0.00 2.92 -4.23 0.30 0.16 115.64 116.34 2uxt s THR 294 Ca 0.25 -2.16 0.00 0.00 -1.18 0.00 0.00 61.69 58.60 2uxt s THR 294 Cb -0.16 -2.13 0.00 0.00 1.34 0.00 0.00 72.50 71.55 2uxt s THR 294 CO 0.12 -0.53 0.00 0.00 -0.54 0.00 0.00 174.62 173.67 2uxt n SER 313 N 0.00 0.00 -4.68 0.00 7.64 -1.26 -4.81 113.62 110.51 2uxt n SER 313 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.46 2uxt n SER 313 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 2uxt n SER 313 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 2uxt s ILE 314 N -0.24 4.83 0.53 0.44 -4.36 -1.26 -4.53 121.20 116.60 2uxt s ILE 314 Ca 0.00 1.89 -0.18 0.00 -0.26 0.00 0.00 60.65 62.10 2uxt s ILE 314 Cb 0.00 -4.25 -0.15 0.00 1.25 0.00 0.00 42.46 39.31 2uxt s ILE 314 CO 0.00 0.02 -0.16 0.18 0.24 0.00 0.00 174.94 175.22 2uxt n LEU 315 N 5.01 -3.80 -0.05 0.37 4.77 -1.26 -4.93 117.00 117.12 2uxt n LEU 315 Ca 0.07 0.63 -0.13 0.00 -0.03 0.00 0.00 56.01 56.55 2uxt n LEU 315 Cb 0.49 -0.84 -0.11 0.00 -2.33 0.00 0.00 43.42 40.62 2uxt n LEU 315 CO 0.51 -4.86 0.44 1.62 -1.33 0.00 0.00 177.39 173.77 2uxt h VAL 316 N -0.06 1.57 -3.41 4.08 3.04 -1.73 -3.44 116.25 116.30 2uxt h VAL 316 Ca -0.41 -1.91 -0.65 0.00 -1.01 0.00 0.00 66.70 62.72 2uxt h VAL 316 Cb 1.44 2.84 -0.25 0.00 -2.01 0.00 0.00 31.29 33.31 2uxt h VAL 316 CO 0.41 0.48 -0.70 -0.55 -1.01 0.00 0.00 177.57 176.21 2uxt s SER 317 N -6.01 4.54 0.00 3.17 0.15 -1.26 -4.96 113.70 109.33 2uxt s SER 317 Ca -0.17 -0.28 0.30 0.00 0.70 0.00 0.00 55.95 56.49 2uxt s SER 317 Cb -0.01 -1.77 1.42 0.00 -1.71 0.00 0.00 66.02 63.94 2uxt s SER 317 CO 0.65 0.05 1.96 0.35 1.20 0.00 0.00 173.24 177.45 2uxt n THR 318 N 4.36 0.00 -2.28 6.45 -2.24 -1.26 -4.66 114.28 114.64 2uxt n THR 318 Ca -0.18 -0.07 -0.42 0.00 -2.27 0.00 0.00 64.05 61.11 2uxt n THR 318 Cb 0.52 -0.13 -0.03 0.00 -2.10 0.00 0.00 70.33 68.58 2uxt n THR 318 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2uxt s LEU 319 N -2.25 4.27 -0.24 3.22 2.96 -1.26 -0.17 118.68 125.20 2uxt s LEU 319 Ca 0.36 1.96 -0.16 0.00 -0.22 0.00 0.00 54.13 56.07 2uxt s LEU 319 Cb 0.21 -3.55 -0.12 0.00 0.50 0.00 0.00 46.19 43.23 2uxt s LEU 319 CO 0.42 -0.75 -0.24 0.52 -1.32 0.00 0.00 176.35 174.98 2uxt n VAL 320 N 5.00 1.52 -3.65 1.68 0.31 0.12 -4.40 118.33 118.91 2uxt n VAL 320 Ca 0.14 -0.18 -0.11 0.00 -0.01 0.00 0.00 64.34 64.17 2uxt n VAL 320 Cb 0.44 -2.03 -0.08 0.00 -0.91 0.00 0.00 33.84 31.26 2uxt n VAL 320 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 2uxt s LEU 321 N -7.70 -0.60 -0.19 7.52 2.96 -1.04 -4.05 118.68 115.59 2uxt s LEU 321 Ca -0.34 1.34 -0.06 0.00 -0.22 0.00 0.00 54.13 54.84 2uxt s LEU 321 Cb 0.10 2.19 -0.03 0.00 0.50 0.00 0.00 46.19 48.95 2uxt s LEU 321 CO 0.48 -0.23 0.04 -0.89 -1.32 0.00 0.00 176.35 174.43 2uxt s THR 322 N 0.91 4.46 -0.29 3.68 2.01 -0.74 -0.11 115.64 125.56 2uxt s THR 322 Ca -0.05 -0.15 -0.12 0.00 0.31 0.00 0.00 61.69 61.69 2uxt s THR 322 Cb -0.05 -3.01 -0.04 0.00 0.01 0.00 0.00 72.50 69.40 2uxt s THR 322 CO -0.08 0.44 0.23 -0.76 -0.69 0.00 0.00 174.62 173.76 2uxt s LEU 323 N 0.63 4.09 -0.36 4.42 1.02 0.26 -0.52 118.68 128.21 2uxt s LEU 323 Ca 0.02 -0.02 -0.09 0.00 0.02 0.00 0.00 54.13 54.06 2uxt s LEU 323 Cb -0.13 -2.17 0.04 0.00 0.02 0.00 0.00 46.19 43.94 2uxt s LEU 323 CO 0.02 -0.10 0.16 -0.13 0.02 0.00 0.00 176.35 176.32 2uxt s ARG 324 N 1.81 2.70 -1.31 1.70 0.52 0.07 -2.31 118.95 122.12 2uxt s ARG 324 Ca 0.08 -1.16 -0.14 0.00 -0.52 0.00 0.00 55.73 53.99 2uxt s ARG 324 Cb -0.16 -3.60 0.11 0.00 0.52 0.00 0.00 34.95 31.81 2uxt s ARG 324 CO 0.11 -0.70 1.81 -0.35 0.02 0.00 0.00 175.30 176.18 2uxt n PRO 325 N 4.90 3.25 0.01 3.54 -0.04 -1.25 -0.01 135.00 145.40 2uxt n PRO 325 Ca -0.12 -3.31 0.11 0.00 -0.04 0.00 0.00 63.50 60.14 2uxt n PRO 325 Cb 0.45 -3.22 -0.10 0.00 -0.04 0.00 0.00 33.50 30.59 2uxt n PRO 325 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2uxt n THR 326 N 5.01 0.12 -2.17 0.52 -2.24 -0.39 -4.73 114.28 110.41 2uxt n THR 326 Ca 0.45 -0.39 -0.41 0.00 -2.27 0.00 0.00 64.05 61.43 2uxt n THR 326 Cb 0.42 0.13 -0.03 0.00 -2.10 0.00 0.00 70.33 68.74 2uxt n THR 326 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2uxt s GLY 327 N -4.13 2.65 0.00 3.38 0.00 -0.03 -4.94 107.32 104.25 2uxt s GLY 327 Ca -0.03 1.18 0.22 0.00 0.00 0.00 0.00 44.72 46.09 2uxt s GLY 327 CO 0.87 2.02 0.99 1.04 0.00 0.00 0.00 173.10 178.01 2uxt n LEU 328 N 1.89 1.01 -3.98 0.66 7.99 -1.26 -2.69 117.00 120.61 2uxt n LEU 328 Ca 0.04 -0.45 -0.31 0.00 -0.01 0.00 0.00 56.01 55.27 2uxt n LEU 328 Cb 0.42 -0.03 -0.12 0.00 -0.11 0.00 0.00 43.42 43.58 2uxt n LEU 328 CO 0.58 0.24 -0.04 -0.76 -1.51 0.00 0.00 177.39 175.90 2uxt s LEU 329 N -2.96 4.77 0.30 2.23 1.43 -1.26 -4.87 118.68 118.31 2uxt s LEU 329 Ca 0.09 -3.27 -0.29 0.00 -1.03 0.00 0.00 54.13 49.63 2uxt s LEU 329 Cb 0.16 -1.71 -0.09 0.00 0.03 0.00 0.00 46.19 44.58 2uxt s LEU 329 CO 0.82 -0.22 1.10 -2.16 0.23 0.00 0.00 176.35 176.13 2uxt s PRO 330 N -0.66 4.56 -0.17 1.29 0.04 -1.26 -4.87 135.00 133.93 2uxt s PRO 330 Ca 0.20 1.78 -0.19 0.00 0.04 0.00 0.00 61.00 62.83 2uxt s PRO 330 Cb -0.17 -3.09 -0.16 0.00 0.04 0.00 0.00 34.50 31.11 2uxt s PRO 330 CO -0.06 0.14 0.26 -0.07 0.04 0.00 0.00 177.00 177.31 2uxt h LEU 331 N 3.61 0.00 -8.51 -3.56 3.38 -1.92 -3.45 115.31 104.86 2uxt h LEU 331 Ca -0.47 -0.49 -0.67 0.00 0.09 0.00 0.00 57.88 56.34 2uxt h LEU 331 Cb 1.21 0.00 -0.24 0.00 0.09 0.00 0.00 40.66 41.73 2uxt h LEU 331 CO 0.66 1.14 -0.58 -0.69 0.09 0.00 0.00 178.44 179.06 2uxt s VAL 332 N -2.22 4.38 0.00 1.22 1.01 -1.26 -4.93 120.40 118.59 2uxt s VAL 332 Ca -0.21 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 61.27 2uxt s VAL 332 Cb 0.02 -3.24 0.00 0.00 0.00 0.00 0.00 36.38 33.17 2uxt s VAL 332 CO 0.49 0.08 0.00 1.07 0.00 0.00 0.00 175.10 176.74 2uxt n THR 333 N 4.94 0.00 -1.29 3.92 5.66 -1.26 -0.56 114.28 125.69 2uxt n THR 333 Ca -0.14 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.57 2uxt n THR 333 Cb 0.49 0.39 0.18 0.00 -1.55 0.00 0.00 70.33 69.84 2uxt n THR 333 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2uxt s ASP 334 N -2.01 2.56 0.98 1.09 1.01 -1.26 -4.92 116.67 114.12 2uxt s ASP 334 Ca 0.00 0.98 -0.11 0.00 0.71 0.00 0.00 52.55 54.13 2uxt s ASP 334 Cb 0.00 -1.53 0.18 0.00 1.01 0.00 0.00 42.92 42.58 2uxt s ASP 334 CO 0.00 -3.15 1.09 -0.44 0.21 0.00 0.00 175.17 172.89 2uxt s SER 335 N -3.75 2.49 0.39 0.27 0.01 -1.26 -4.94 113.70 106.91 2uxt s SER 335 Ca 0.66 1.81 -0.27 0.00 1.31 0.00 0.00 55.95 59.47 2uxt s SER 335 Cb -0.16 -2.40 -0.09 0.00 0.21 0.00 0.00 66.02 63.58 2uxt s SER 335 CO 0.56 -3.30 1.29 -0.76 0.41 0.00 0.00 173.24 171.44 2uxt s LEU 336 N -6.69 4.26 0.63 2.44 1.43 -1.26 -4.96 118.68 114.53 2uxt s LEU 336 Ca 0.66 2.63 -0.19 0.00 -1.03 0.00 0.00 54.13 56.21 2uxt s LEU 336 Cb -0.22 -3.86 -0.02 0.00 0.03 0.00 0.00 46.19 42.12 2uxt s LEU 336 CO 0.60 -0.77 1.30 -2.16 0.23 0.00 0.00 176.35 175.55 2uxt s PRO 337 N -2.15 2.66 0.11 1.29 0.04 -1.26 -4.93 135.00 130.76 2uxt s PRO 337 Ca 0.55 2.08 -0.11 0.00 0.04 0.00 0.00 61.00 63.56 2uxt s PRO 337 Cb -0.38 -1.91 -0.12 0.00 0.04 0.00 0.00 34.50 32.13 2uxt s PRO 337 CO 0.49 -1.52 1.34 0.52 0.04 0.00 0.00 177.00 177.86 2uxt h MET 338 N 0.70 0.78 -5.55 4.56 2.86 -1.97 -3.42 114.93 112.89 2uxt h MET 338 Ca -0.51 -0.61 -0.49 0.00 -2.06 0.00 0.00 59.70 56.03 2uxt h MET 338 Cb 1.33 0.12 -0.25 0.00 0.06 0.00 0.00 31.60 32.86 2uxt h MET 338 CO 0.54 1.22 -0.81 0.50 1.06 0.00 0.00 176.91 179.42 2uxt s ARG 339 N -3.81 1.08 0.00 1.72 6.06 -1.26 -4.54 118.95 118.20 2uxt s ARG 339 Ca -0.10 -0.80 0.00 0.00 -2.50 0.00 0.00 55.73 52.33 2uxt s ARG 339 Cb 0.09 -1.12 0.00 0.00 0.06 0.00 0.00 34.95 33.98 2uxt s ARG 339 CO 0.90 0.28 0.00 1.28 -2.50 0.00 0.00 175.30 175.26 2uxt n LEU 340 N 1.93 0.00 -4.72 -0.88 4.77 0.83 -4.96 117.00 113.96 2uxt n LEU 340 Ca -0.18 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.39 2uxt n LEU 340 Cb 0.54 -0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.57 2uxt n LEU 340 CO 0.23 -0.11 1.25 -0.22 -1.33 0.00 0.00 177.39 177.20 2uxt s LEU 341 N -2.91 4.37 0.17 2.23 0.20 -0.93 -4.90 118.68 116.92 2uxt s LEU 341 Ca 0.00 2.66 -0.05 0.00 0.69 0.00 0.00 54.13 57.43 2uxt s LEU 341 Cb 0.00 -3.60 0.06 0.00 -0.43 0.00 0.00 46.19 42.22 2uxt s LEU 341 CO 0.00 -0.84 1.47 1.55 -0.29 0.00 0.00 176.35 178.24 2uxt h PRO 342 N 6.68 0.62 -6.97 0.98 0.13 -1.92 -3.44 132.00 128.08 2uxt h PRO 342 Ca -0.43 -0.40 -0.46 0.00 -0.87 0.00 0.00 66.00 63.84 2uxt h PRO 342 Cb 1.20 0.05 0.07 0.00 0.13 0.00 0.00 31.00 32.45 2uxt h PRO 342 CO 0.91 1.02 0.04 -0.08 -0.23 0.00 0.00 178.00 179.66 2uxt s THR 343 N -3.99 2.28 0.21 1.56 -1.32 -1.26 -5.10 115.64 108.02 2uxt s THR 343 Ca -0.08 -0.67 0.00 0.00 -1.21 0.00 0.00 61.69 59.73 2uxt s THR 343 Cb 0.11 -2.61 -0.04 0.00 -1.51 0.00 0.00 72.50 68.45 2uxt s THR 343 CO 0.85 0.00 0.39 -1.61 -2.21 0.00 0.00 174.62 172.04 2uxt s GLU 344 N -4.97 3.50 -0.79 7.08 0.41 -1.26 -4.84 118.70 117.82 2uxt s GLU 344 Ca 0.63 -0.42 -0.19 0.00 -0.41 0.00 0.00 54.97 54.59 2uxt s GLU 344 Cb -0.07 -2.85 0.13 0.00 -1.78 0.00 0.00 34.13 29.57 2uxt s GLU 344 CO 0.42 0.40 0.95 0.42 -0.49 0.00 0.00 175.26 176.95 2uxt s ILE 345 N -1.90 4.82 -0.16 -1.63 -1.09 -1.26 -5.01 121.20 114.97 2uxt s ILE 345 Ca 0.38 -1.38 -0.07 0.00 -2.23 0.00 0.00 60.65 57.35 2uxt s ILE 345 Cb -0.11 -4.65 -0.04 0.00 -1.58 0.00 0.00 42.46 36.08 2uxt s ILE 345 CO 0.30 -1.34 0.07 -0.04 -1.23 0.00 0.00 174.94 172.69 2uxt s MET 346 N 2.53 3.75 -0.08 2.79 -1.94 -1.26 -5.08 119.30 120.00 2uxt s MET 346 Ca 0.24 -0.32 -0.26 0.00 -1.71 0.00 0.00 55.69 53.64 2uxt s MET 346 Cb -0.12 -3.15 -0.03 0.00 2.01 0.00 0.00 34.83 33.54 2uxt s MET 346 CO -0.03 0.42 0.84 0.00 -0.01 0.00 0.00 175.02 176.25 2uxt s ALA 347 N -0.05 3.35 1.07 3.03 0.00 -1.26 -5.05 121.76 122.84 2uxt s ALA 347 Ca 0.07 0.24 -0.17 0.00 0.00 0.00 0.00 51.96 52.09 2uxt s ALA 347 Cb -0.12 -3.19 0.24 0.00 0.00 0.00 0.00 23.12 20.05 2uxt s ALA 347 CO 0.01 -0.35 1.24 0.20 0.00 0.00 0.00 175.76 176.85 2uxt s GLY 348 N 0.99 1.70 -0.24 0.00 0.00 -1.26 -5.03 107.32 103.49 2uxt s GLY 348 Ca 0.43 -1.11 -0.14 0.00 0.00 0.00 0.00 44.72 43.90 2uxt s GLY 348 CO 0.19 -0.29 0.32 -0.56 0.00 0.00 0.00 173.10 172.76 2uxt s SER 349 N -4.49 6.27 0.19 1.64 0.01 -1.26 -5.03 113.70 111.03 2uxt s SER 349 Ca 0.73 0.31 -0.30 0.00 1.31 0.00 0.00 55.95 58.00 2uxt s SER 349 Cb -0.06 -2.19 -0.08 0.00 0.21 0.00 0.00 66.02 63.90 2uxt s SER 349 CO 0.54 -0.08 0.97 -2.16 0.41 0.00 0.00 173.24 172.92 2uxt s PRO 350 N 1.54 4.78 0.38 12.44 0.04 -1.26 -4.42 135.00 148.49 2uxt s PRO 350 Ca 0.14 1.51 0.20 0.00 0.04 0.00 0.00 61.00 62.90 2uxt s PRO 350 Cb -0.15 -3.31 0.51 0.00 0.04 0.00 0.00 34.50 31.59 2uxt s PRO 350 CO 0.08 0.37 1.65 0.97 0.04 0.00 0.00 177.00 180.11 2uxt h ILE 351 N 3.48 0.59 -2.24 0.56 2.10 -1.16 -3.48 117.51 117.36 2uxt h ILE 351 Ca -0.44 -1.53 0.20 0.00 1.08 0.00 0.00 64.86 64.17 2uxt h ILE 351 Cb 1.21 2.05 -0.08 0.00 -1.09 0.00 0.00 36.82 38.91 2uxt h ILE 351 CO 0.69 0.29 0.54 0.00 -1.08 0.00 0.00 178.15 178.60 2uxt s ARG 352 N -3.32 1.10 0.28 2.19 1.70 -1.26 -5.09 118.95 114.56 2uxt s ARG 352 Ca 0.03 -0.62 0.10 0.00 -0.47 0.00 0.00 55.73 54.77 2uxt s ARG 352 Cb 0.08 0.37 -0.05 0.00 -0.57 0.00 0.00 34.95 34.79 2uxt s ARG 352 CO 0.68 -0.51 -0.04 -1.54 -1.08 0.00 0.00 175.30 172.81 2uxt s SER 353 N -2.99 4.31 0.08 -2.89 1.04 -1.26 -1.63 113.70 110.36 2uxt s SER 353 Ca 0.13 -0.76 0.03 0.00 0.48 0.00 0.00 55.95 55.84 2uxt s SER 353 Cb -0.01 -0.70 -0.03 0.00 0.10 0.00 0.00 66.02 65.38 2uxt s SER 353 CO 0.02 -0.02 -0.09 -0.13 0.98 0.00 0.00 173.24 173.99 2uxt s ARG 354 N -3.65 0.76 -0.27 4.02 1.81 0.34 -4.90 118.95 117.06 2uxt s ARG 354 Ca 0.32 -1.05 -0.00 0.00 -1.72 0.00 0.00 55.73 53.28 2uxt s ARG 354 Cb -0.05 -0.46 0.08 0.00 -0.45 0.00 0.00 34.95 34.06 2uxt s ARG 354 CO 0.19 0.07 0.03 0.34 -0.68 0.00 0.00 175.30 175.26 2uxt s ASP 355 N -2.20 3.87 -0.31 0.23 -1.08 -1.26 -0.82 116.67 115.10 2uxt s ASP 355 Ca 0.01 -1.42 -0.06 0.00 -0.52 0.00 0.00 52.55 50.57 2uxt s ASP 355 Cb -0.05 -1.01 0.03 0.00 -1.46 0.00 0.00 42.92 40.43 2uxt s ASP 355 CO -0.00 -0.34 0.07 -0.63 0.52 0.00 0.00 175.17 174.79 2uxt s ILE 356 N 1.50 3.67 -0.25 4.11 -1.09 0.50 -4.97 121.20 124.67 2uxt s ILE 356 Ca 0.03 -1.01 -0.05 0.00 -2.23 0.00 0.00 60.65 57.39 2uxt s ILE 356 Cb -0.18 -3.00 -0.01 0.00 -1.58 0.00 0.00 42.46 37.69 2uxt s ILE 356 CO -0.14 -0.05 0.02 -0.55 -1.23 0.00 0.00 174.94 172.99 2uxt s SER 357 N 1.41 4.75 0.26 3.58 0.15 -1.26 -0.88 113.70 121.71 2uxt s SER 357 Ca -0.01 -0.45 0.23 0.00 0.70 0.00 0.00 55.95 56.43 2uxt s SER 357 Cb -0.18 -1.82 0.19 0.00 -1.71 0.00 0.00 66.02 62.49 2uxt s SER 357 CO 0.02 -0.07 1.29 -0.07 1.20 0.00 0.00 173.24 175.60 2uxt h LEU 358 N 8.17 0.00 0.00 3.45 3.38 -1.01 0.16 115.31 129.47 2uxt h LEU 358 Ca -0.38 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.56 2uxt h LEU 358 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 2uxt h LEU 358 CO 0.59 0.02 0.00 0.61 0.09 0.00 0.00 178.44 179.75 2uxt n GLY 359 N 1.19 2.55 0.00 0.83 0.00 -1.25 -4.17 105.19 104.34 2uxt n GLY 359 Ca 0.02 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.74 2uxt n GLY 359 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2uxt n ASP 360 N 0.56 0.15 -4.70 1.61 5.68 -1.26 -1.64 116.55 116.94 2uxt n ASP 360 Ca 0.00 -0.47 -0.24 0.00 -0.50 0.00 0.00 54.79 53.58 2uxt n ASP 360 Cb 0.00 0.46 -0.07 0.00 -1.14 0.00 0.00 41.12 40.36 2uxt n ASP 360 CO 0.00 0.00 0.00 -1.81 -1.33 0.00 0.00 177.20 174.06 2uxt s ASP 361 N -0.46 4.43 0.41 -1.12 1.01 -1.26 -4.87 116.67 114.81 2uxt s ASP 361 Ca 0.00 -0.94 -0.27 0.00 0.71 0.00 0.00 52.55 52.06 2uxt s ASP 361 Cb 0.00 -0.59 -0.10 0.00 1.01 0.00 0.00 42.92 43.24 2uxt s ASP 361 CO 0.00 -0.35 1.43 -2.65 0.21 0.00 0.00 175.17 173.81 2uxt n PRO 362 N -1.10 2.38 0.00 8.23 -0.02 -1.26 -4.84 135.00 138.39 2uxt n PRO 362 Ca -0.03 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 2uxt n PRO 362 Cb 0.63 -2.60 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 2uxt n PRO 362 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2uxt n GLY 363 N 0.57 2.92 3.30 -1.23 0.00 -1.26 -4.80 105.19 104.69 2uxt n GLY 363 Ca 0.04 -1.92 -0.32 0.00 0.00 0.00 0.00 46.02 43.82 2uxt n GLY 363 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2uxt s ILE 364 N -2.82 2.38 -1.53 -0.61 1.01 0.53 -4.63 121.20 115.52 2uxt s ILE 364 Ca 0.00 -0.93 -0.13 0.00 0.00 0.00 0.00 60.65 59.59 2uxt s ILE 364 Cb 0.00 -1.91 0.08 0.00 0.01 0.00 0.00 42.46 40.64 2uxt s ILE 364 CO 0.00 0.56 0.93 0.59 0.00 0.00 0.00 174.94 177.02 2uxt n ASN 365 N 3.15 -4.29 -0.08 3.58 3.02 0.56 -1.21 115.26 119.99 2uxt n ASN 365 Ca -0.18 -0.81 -0.01 0.00 -0.03 0.00 0.00 54.58 53.55 2uxt n ASN 365 Cb 0.52 -3.79 -0.00 0.00 -0.61 0.00 0.00 39.78 35.90 2uxt n ASN 365 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2uxt n GLY 366 N -1.67 0.42 3.14 7.41 0.00 -1.26 -5.01 105.19 108.22 2uxt n GLY 366 Ca 0.01 -0.11 -0.21 0.00 0.00 0.00 0.00 46.02 45.71 2uxt n GLY 366 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2uxt s GLN 367 N -0.95 1.04 0.36 1.61 -0.21 -0.35 -5.05 119.66 116.11 2uxt s GLN 367 Ca 0.00 -0.68 -0.10 0.00 0.02 0.00 0.00 55.36 54.60 2uxt s GLN 367 Cb 0.00 -1.04 -0.07 0.00 1.00 0.00 0.00 33.01 32.90 2uxt s GLN 367 CO 0.00 0.27 0.72 -0.51 -2.12 0.00 0.00 175.29 173.65 2uxt s LEU 368 N -0.85 3.92 0.19 2.90 1.43 -1.26 -0.35 118.68 124.66 2uxt s LEU 368 Ca 0.03 1.08 -0.33 0.00 -1.03 0.00 0.00 54.13 53.89 2uxt s LEU 368 Cb -0.07 -3.93 -0.15 0.00 0.03 0.00 0.00 46.19 42.07 2uxt s LEU 368 CO 0.01 -0.32 1.32 1.87 0.23 0.00 0.00 176.35 179.46 2uxt n TRP 369 N -1.03 1.76 -3.71 0.29 -0.00 0.20 -4.95 117.44 110.01 2uxt n TRP 369 Ca 0.02 0.54 -0.25 0.00 -0.00 0.00 0.00 57.50 57.80 2uxt n TRP 369 Cb 0.54 -2.38 -0.17 0.00 -0.00 0.00 0.00 31.31 29.29 2uxt n TRP 369 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 177.69 178.03 2uxt s ASP 370 N 0.26 2.26 0.52 5.87 -1.08 -1.26 -5.00 116.67 118.24 2uxt s ASP 370 Ca 0.73 -0.49 0.25 0.00 -0.52 0.00 0.00 52.55 52.52 2uxt s ASP 370 Cb -0.77 -0.42 1.38 0.00 -1.46 0.00 0.00 42.92 41.65 2uxt s ASP 370 CO 0.49 -0.28 1.98 -0.37 0.52 0.00 0.00 175.17 177.50 2uxt h VAL 371 N 6.44 0.72 0.00 1.11 -1.51 -1.99 -0.23 116.25 120.78 2uxt h VAL 371 Ca -0.16 -0.01 0.00 0.00 -1.23 0.00 0.00 66.70 65.29 2uxt h VAL 371 Cb 1.13 0.68 0.00 0.00 -2.13 0.00 0.00 31.29 30.97 2uxt h VAL 371 CO 0.29 0.01 0.00 0.78 -1.23 0.00 0.00 177.57 177.41 2uxt h ASN 372 N 0.04 0.00 -3.41 4.19 4.21 -1.95 -3.45 115.58 115.21 2uxt h ASN 372 Ca 0.28 0.00 -0.64 0.00 1.21 0.00 0.00 56.30 57.16 2uxt h ASN 372 Cb 1.08 0.00 -0.21 0.00 -1.12 0.00 0.00 38.32 38.07 2uxt h ASN 372 CO -0.01 0.00 -0.64 -0.60 -1.29 0.00 0.00 177.43 174.89 2uxt s ARG 373 N -3.24 3.71 -0.22 0.81 3.52 -0.10 -5.08 118.95 118.35 2uxt s ARG 373 Ca 0.07 -0.48 -0.20 0.00 -0.13 0.00 0.00 55.73 55.00 2uxt s ARG 373 Cb 0.10 -3.11 -0.03 0.00 -1.56 0.00 0.00 34.95 30.35 2uxt s ARG 373 CO 0.56 0.09 0.59 0.42 -0.81 0.00 0.00 175.30 176.15 2uxt s ILE 374 N 0.82 5.04 -0.08 4.11 -1.09 -1.26 -4.49 121.20 124.25 2uxt s ILE 374 Ca 0.01 1.07 -0.01 0.00 -2.23 0.00 0.00 60.65 59.49 2uxt s ILE 374 Cb -0.14 -3.90 -0.26 0.00 -1.58 0.00 0.00 42.46 36.58 2uxt s ILE 374 CO 0.02 0.10 0.53 0.44 -1.23 0.00 0.00 174.94 174.80 2uxt h ASP 375 N 7.68 0.31 -3.71 3.58 3.32 -1.55 -3.47 116.42 122.57 2uxt h ASP 375 Ca -0.30 -0.63 -0.40 0.00 0.02 0.00 0.00 57.03 55.71 2uxt h ASP 375 Cb 1.14 -0.10 -0.31 0.00 0.22 0.00 0.00 39.33 40.27 2uxt h ASP 375 CO 0.76 1.56 -0.77 -0.69 -1.72 0.00 0.00 179.24 178.38 2uxt s VAL 376 N -2.58 0.62 -0.26 -1.35 1.01 -0.76 -5.01 120.40 112.07 2uxt s VAL 376 Ca -0.15 -0.25 0.03 0.00 0.00 0.00 0.00 61.98 61.61 2uxt s VAL 376 Cb 0.07 -0.57 0.06 0.00 0.00 0.00 0.00 36.38 35.93 2uxt s VAL 376 CO 0.80 0.21 -0.11 -0.89 0.00 0.00 0.00 175.10 175.11 2uxt s THR 377 N 0.38 2.15 0.43 3.92 2.01 -1.26 -0.22 115.64 123.04 2uxt s THR 377 Ca -0.05 -1.59 0.07 0.00 0.31 0.00 0.00 61.69 60.43 2uxt s THR 377 Cb -0.09 -2.24 -0.04 0.00 0.01 0.00 0.00 72.50 70.13 2uxt s THR 377 CO 0.00 -0.00 0.22 0.00 -0.69 0.00 0.00 174.62 174.15 2uxt s ALA 378 N 1.12 3.73 -0.16 7.40 0.00 0.12 -4.98 121.76 128.98 2uxt s ALA 378 Ca -0.08 -1.97 -0.02 0.00 0.00 0.00 0.00 51.96 49.89 2uxt s ALA 378 Cb -0.20 -0.48 -0.01 0.00 0.00 0.00 0.00 23.12 22.43 2uxt s ALA 378 CO -0.05 -0.19 -0.10 -1.14 0.00 0.00 0.00 175.76 174.28 2uxt s GLN 379 N -3.96 3.41 0.31 0.00 2.00 -1.26 -0.71 119.66 119.45 2uxt s GLN 379 Ca 0.41 -0.65 -0.29 0.00 -2.00 0.00 0.00 55.36 52.82 2uxt s GLN 379 Cb 0.02 -2.77 -0.12 0.00 0.80 0.00 0.00 33.01 30.94 2uxt s GLN 379 CO 0.23 0.09 1.38 0.94 -0.50 0.00 0.00 175.29 177.43 2uxt n GLN 380 N 3.90 2.23 -0.52 1.67 7.27 -0.04 -2.11 117.38 129.77 2uxt n GLN 380 Ca -0.18 0.79 0.00 0.00 0.07 0.00 0.00 57.00 57.67 2uxt n GLN 380 Cb 0.52 -2.43 0.00 0.00 2.41 0.00 0.00 30.24 30.74 2uxt n GLN 380 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2uxt n GLY 381 N 1.29 0.76 3.83 1.69 0.00 0.26 -4.57 105.19 108.44 2uxt n GLY 381 Ca 0.07 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.84 2uxt n GLY 381 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2uxt s THR 382 N -2.85 2.15 0.16 2.61 -4.23 -0.90 -4.93 115.64 107.65 2uxt s THR 382 Ca 0.00 -1.55 0.10 0.00 -1.18 0.00 0.00 61.69 59.05 2uxt s THR 382 Cb 0.00 -2.70 -0.04 0.00 1.34 0.00 0.00 72.50 71.09 2uxt s THR 382 CO 0.00 0.00 -0.17 0.26 -0.54 0.00 0.00 174.62 174.17 2uxt s TRP 383 N -2.63 2.51 0.01 3.99 0.52 -1.26 -1.95 118.94 120.12 2uxt s TRP 383 Ca 0.39 -0.27 -0.02 0.00 0.02 0.00 0.00 56.10 56.22 2uxt s TRP 383 Cb 0.00 -1.27 -0.01 0.00 -1.15 0.00 0.00 33.47 31.04 2uxt s TRP 383 CO 0.23 0.46 0.02 -1.21 0.02 0.00 0.00 176.95 176.47 2uxt s GLU 384 N -2.52 0.29 -0.41 4.98 2.02 -0.21 -0.48 118.70 122.37 2uxt s GLU 384 Ca 0.21 -0.41 -0.14 0.00 0.02 0.00 0.00 54.97 54.65 2uxt s GLU 384 Cb -0.09 0.11 0.03 0.00 0.10 0.00 0.00 34.13 34.28 2uxt s GLU 384 CO 0.12 -0.05 0.29 0.50 0.02 0.00 0.00 175.26 176.14 2uxt s ARG 385 N -1.10 2.93 -0.22 1.61 3.52 -0.64 -0.06 118.95 124.99 2uxt s ARG 385 Ca -0.12 -1.09 -0.08 0.00 -0.13 0.00 0.00 55.73 54.31 2uxt s ARG 385 Cb -0.07 -3.95 -0.04 0.00 -1.56 0.00 0.00 34.95 29.33 2uxt s ARG 385 CO -0.00 -0.78 0.09 -1.58 -0.81 0.00 0.00 175.30 172.22 2uxt s TRP 386 N 1.65 3.21 -0.25 5.12 0.52 0.73 -0.50 118.94 129.42 2uxt s TRP 386 Ca 0.04 -0.04 -0.10 0.00 0.02 0.00 0.00 56.10 56.02 2uxt s TRP 386 Cb -0.20 -2.19 -0.05 0.00 -1.15 0.00 0.00 33.47 29.88 2uxt s TRP 386 CO 0.09 -0.04 0.16 -0.08 0.02 0.00 0.00 176.95 177.10 2uxt s THR 387 N 0.99 5.30 -0.11 2.01 -1.32 0.00 -0.42 115.64 122.10 2uxt s THR 387 Ca 0.05 0.16 0.03 0.00 -1.21 0.00 0.00 61.69 60.72 2uxt s THR 387 Cb -0.14 -3.48 -0.01 0.00 -1.51 0.00 0.00 72.50 67.36 2uxt s THR 387 CO 0.03 0.32 -0.20 -0.69 -2.21 0.00 0.00 174.62 171.87 2uxt s VAL 388 N 1.23 2.39 0.14 5.08 1.01 -0.09 -0.37 120.40 129.78 2uxt s VAL 388 Ca 0.07 -0.90 0.08 0.00 0.00 0.00 0.00 61.98 61.23 2uxt s VAL 388 Cb -0.14 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.26 2uxt s VAL 388 CO 0.06 0.55 -0.18 -0.13 0.00 0.00 0.00 175.10 175.39 2uxt s ARG 389 N 0.32 1.18 -0.25 2.72 0.52 -0.06 -0.26 118.95 123.12 2uxt s ARG 389 Ca -0.16 -1.29 -0.12 0.00 -0.52 0.00 0.00 55.73 53.64 2uxt s ARG 389 Cb -0.17 -1.28 0.09 0.00 0.52 0.00 0.00 34.95 34.10 2uxt s ARG 389 CO 0.08 0.27 0.57 0.00 0.02 0.00 0.00 175.30 176.24 2uxt s ALA 390 N -1.75 -1.62 0.06 2.13 0.00 -0.03 -0.39 121.76 120.16 2uxt s ALA 390 Ca 0.11 2.06 0.09 0.00 0.00 0.00 0.00 51.96 54.22 2uxt s ALA 390 Cb -0.07 -1.39 -0.22 0.00 0.00 0.00 0.00 23.12 21.44 2uxt s ALA 390 CO 0.05 -0.55 1.05 -0.44 0.00 0.00 0.00 175.76 175.87 2uxt h ASP 391 N 7.47 0.01 -3.51 0.00 5.19 -1.59 -2.20 116.42 121.79 2uxt h ASP 391 Ca -0.26 -0.01 -0.71 0.00 -0.62 0.00 0.00 57.03 55.43 2uxt h ASP 391 Cb 1.17 -0.00 -0.26 0.00 0.18 0.00 0.00 39.33 40.42 2uxt h ASP 391 CO 0.17 1.01 -0.48 -0.70 -3.12 0.00 0.00 179.24 176.12 2uxt s GLU 392 N -2.67 2.74 0.13 3.56 2.56 -0.96 -4.91 118.70 119.15 2uxt s GLU 392 Ca -0.01 -1.26 -0.35 0.00 0.00 0.00 0.00 54.97 53.35 2uxt s GLU 392 Cb 0.09 -3.79 -0.16 0.00 2.00 0.00 0.00 34.13 32.27 2uxt s GLU 392 CO 0.82 -0.84 1.25 -2.30 -0.56 0.00 0.00 175.26 173.64 2uxt n PRO 393 N 4.98 1.14 -3.51 4.30 -0.02 -1.26 -4.93 135.00 135.71 2uxt n PRO 393 Ca -0.11 0.41 -0.08 0.00 -2.02 0.00 0.00 63.50 61.70 2uxt n PRO 393 Cb 0.44 -1.98 -0.02 0.00 -0.02 0.00 0.00 33.50 31.92 2uxt n PRO 393 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 2uxt s GLN 394 N 0.06 0.77 0.48 -0.52 -2.07 -0.53 -5.00 119.66 112.85 2uxt s GLN 394 Ca 0.79 -0.26 -0.12 0.00 -1.82 0.00 0.00 55.36 53.95 2uxt s GLN 394 Cb -0.91 0.35 -0.06 0.00 -1.09 0.00 0.00 33.01 31.30 2uxt s GLN 394 CO 0.49 -0.33 0.88 0.00 -1.32 0.00 0.00 175.29 175.02 2uxt s ALA 395 N -2.95 3.22 -0.01 2.60 0.00 -1.26 -0.13 121.76 123.23 2uxt s ALA 395 Ca 0.05 -0.07 0.01 0.00 0.00 0.00 0.00 51.96 51.95 2uxt s ALA 395 Cb -0.01 -2.90 0.01 0.00 0.00 0.00 0.00 23.12 20.22 2uxt s ALA 395 CO -0.08 -0.20 -0.01 0.12 0.00 0.00 0.00 175.76 175.58 2uxt s PHE 396 N -2.59 0.24 0.04 0.00 2.19 0.11 0.50 117.98 118.47 2uxt s PHE 396 Ca 0.54 -0.02 0.06 0.00 0.33 0.00 0.00 56.93 57.85 2uxt s PHE 396 Cb -0.10 -0.24 -0.02 0.00 -1.31 0.00 0.00 43.02 41.34 2uxt s PHE 396 CO 0.35 -0.05 -0.18 -1.58 1.83 0.00 0.00 175.22 175.58 2uxt s HIS 397 N 0.40 1.60 -0.09 10.12 5.65 -0.16 -0.62 115.29 132.20 2uxt s HIS 397 Ca -0.04 -0.36 0.02 0.00 0.25 0.00 0.00 55.06 54.93 2uxt s HIS 397 Cb -0.06 -0.95 0.01 0.00 -1.18 0.00 0.00 32.58 30.40 2uxt s HIS 397 CO -0.01 0.07 -0.13 0.42 -0.65 0.00 0.00 174.74 174.44 2uxt s ILE 398 N -0.80 1.32 0.44 0.89 1.01 -0.96 -1.00 121.20 122.10 2uxt s ILE 398 Ca 0.05 -0.55 -0.14 0.00 0.00 0.00 0.00 60.65 60.01 2uxt s ILE 398 Cb -0.08 -1.22 -0.08 0.00 0.01 0.00 0.00 42.46 41.09 2uxt s ILE 398 CO 0.02 0.40 0.86 -1.61 0.00 0.00 0.00 174.94 174.61 2uxt s GLU 399 N 0.94 3.92 0.00 2.79 2.02 -0.22 -4.23 118.70 123.92 2uxt s GLU 399 Ca -0.08 0.74 0.00 0.00 0.02 0.00 0.00 54.97 55.65 2uxt s GLU 399 Cb -0.15 -2.28 0.00 0.00 0.10 0.00 0.00 34.13 31.80 2uxt s GLU 399 CO -0.00 -0.10 0.00 0.41 0.02 0.00 0.00 175.26 175.59 2uxt n GLY 400 N -1.22 0.56 3.32 -1.39 0.00 -1.26 -4.67 105.19 100.53 2uxt n GLY 400 Ca 0.05 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.87 2uxt n GLY 400 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2uxt s VAL 401 N -2.44 0.11 -0.01 1.61 -7.23 -1.26 -3.87 120.40 107.30 2uxt s VAL 401 Ca 0.00 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.16 2uxt s VAL 401 Cb 0.00 -2.47 0.00 0.00 0.56 0.00 0.00 36.38 34.47 2uxt s VAL 401 CO 0.00 0.00 0.03 0.00 -0.31 0.00 0.00 175.10 174.82 2uxt s MET 402 N -3.55 0.03 0.14 4.82 0.23 -1.19 -4.82 119.30 114.96 2uxt s MET 402 Ca 0.37 0.05 0.01 0.00 -1.03 0.00 0.00 55.69 55.09 2uxt s MET 402 Cb 0.03 0.01 -0.04 0.00 -1.53 0.00 0.00 34.83 33.29 2uxt s MET 402 CO 0.24 -0.01 -0.01 -0.59 -2.03 0.00 0.00 175.02 172.63 2uxt s PHE 403 N 0.04 1.05 -0.10 3.16 -0.71 0.19 -1.36 117.98 120.25 2uxt s PHE 403 Ca -0.00 -1.03 0.02 0.00 -1.04 0.00 0.00 56.93 54.88 2uxt s PHE 403 Cb -0.01 -0.60 -0.01 0.00 -1.21 0.00 0.00 43.02 41.19 2uxt s PHE 403 CO -0.00 -0.25 -0.19 -1.14 -1.34 0.00 0.00 175.22 172.30 2uxt s GLN 404 N -3.92 3.09 -0.27 1.99 0.74 -0.65 -0.17 119.66 120.47 2uxt s GLN 404 Ca 0.20 -0.79 -0.29 0.00 0.05 0.00 0.00 55.36 54.53 2uxt s GLN 404 Cb 0.06 -2.43 0.00 0.00 1.10 0.00 0.00 33.01 31.75 2uxt s GLN 404 CO 0.01 0.25 1.18 0.42 -0.55 0.00 0.00 175.29 176.60 2uxt s ILE 405 N 0.20 4.37 -0.10 -2.34 1.01 -1.26 -1.33 121.20 121.74 2uxt s ILE 405 Ca -0.11 1.60 0.05 0.00 0.00 0.00 0.00 60.65 62.18 2uxt s ILE 405 Cb -0.16 -4.23 -0.24 0.00 0.01 0.00 0.00 42.46 37.84 2uxt s ILE 405 CO 0.06 -0.36 0.42 0.54 0.00 0.00 0.00 174.94 175.61 2uxt n ARG 406 N 6.87 0.69 -3.76 2.79 5.12 0.65 -4.76 116.66 124.26 2uxt n ARG 406 Ca 0.13 0.24 -0.13 0.00 -1.93 0.00 0.00 57.85 56.16 2uxt n ARG 406 Cb 0.46 -1.71 -0.09 0.00 -1.16 0.00 0.00 32.46 29.96 2uxt n ARG 406 CO 0.00 0.00 0.00 -0.80 -1.93 0.00 0.00 177.63 174.90 2uxt s ASN 407 N -6.43 -0.24 -0.27 0.55 -0.87 -1.13 -4.52 114.94 102.03 2uxt s ASN 407 Ca -0.14 0.26 0.01 0.00 -1.57 0.00 0.00 52.86 51.41 2uxt s ASN 407 Cb 0.07 0.42 0.08 0.00 -0.02 0.00 0.00 41.25 41.80 2uxt s ASN 407 CO 0.79 -0.35 0.01 -0.69 -2.57 0.00 0.00 177.10 174.28 2uxt s VAL 408 N -0.89 1.46 -1.34 1.60 1.01 0.23 -1.02 120.40 121.45 2uxt s VAL 408 Ca -0.10 -1.45 -0.08 0.00 0.00 0.00 0.00 61.98 60.36 2uxt s VAL 408 Cb -0.04 -1.90 0.01 0.00 0.00 0.00 0.00 36.38 34.45 2uxt s VAL 408 CO 0.03 -0.35 1.15 0.59 0.00 0.00 0.00 175.10 176.52 2uxt n ASN 409 N 4.65 -5.61 0.00 3.32 3.02 -0.14 -1.90 115.26 118.59 2uxt n ASN 409 Ca -0.06 -0.56 0.00 0.00 -0.03 0.00 0.00 54.58 53.92 2uxt n ASN 409 Cb 0.43 -5.00 0.00 0.00 -0.61 0.00 0.00 39.78 34.60 2uxt n ASN 409 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2uxt n GLY 410 N -1.86 1.26 3.64 7.41 0.00 -1.26 -5.01 105.19 109.36 2uxt n GLY 410 Ca -0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.71 2uxt n GLY 410 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2uxt s ALA 411 N -3.83 3.23 0.42 4.61 0.00 -0.80 -5.04 121.76 120.35 2uxt s ALA 411 Ca 0.00 -2.27 -0.26 0.00 0.00 0.00 0.00 51.96 49.44 2uxt s ALA 411 Cb 0.00 0.07 -0.08 0.00 0.00 0.00 0.00 23.12 23.10 2uxt s ALA 411 CO 0.00 -0.12 1.30 -1.64 0.00 0.00 0.00 175.76 175.31 2uxt s MET 412 N -3.74 3.90 0.70 0.00 -1.94 -1.26 0.76 119.30 117.72 2uxt s MET 412 Ca 0.36 2.15 -0.11 0.00 -1.71 0.00 0.00 55.69 56.38 2uxt s MET 412 Cb 0.09 -2.71 0.01 0.00 2.01 0.00 0.00 34.83 34.23 2uxt s MET 412 CO 0.19 -0.55 1.06 -1.25 -0.01 0.00 0.00 175.02 174.46 2uxt s PRO 413 N -2.31 2.93 0.61 2.03 0.05 -1.26 -4.61 135.00 132.43 2uxt s PRO 413 Ca 0.58 0.87 -0.18 0.00 0.05 0.00 0.00 61.00 62.33 2uxt s PRO 413 Cb -0.38 -2.00 -0.03 0.00 0.05 0.00 0.00 34.50 32.15 2uxt s PRO 413 CO 0.48 -1.08 1.15 -0.06 0.05 0.00 0.00 177.00 177.54 2uxt s PHE 414 N -3.09 2.53 0.32 0.56 0.40 -1.26 -4.89 117.98 112.55 2uxt s PHE 414 Ca 0.58 1.54 0.10 0.00 -0.60 0.00 0.00 56.93 58.55 2uxt s PHE 414 Cb -0.14 -3.32 0.89 0.00 0.51 0.00 0.00 43.02 40.97 2uxt s PHE 414 CO 0.55 -1.87 1.72 -1.35 0.70 0.00 0.00 175.22 174.97 2uxt h PRO 415 N 0.66 0.52 0.00 0.24 0.11 -2.01 0.65 132.00 132.17 2uxt h PRO 415 Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2uxt h PRO 415 Cb 1.27 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2uxt h PRO 415 CO 0.55 0.34 0.00 1.05 -0.21 0.00 0.00 178.00 179.73 2uxt h GLU 416 N 0.53 0.00 -0.51 1.05 9.09 -1.94 -2.50 114.58 120.30 2uxt h GLU 416 Ca 0.65 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.06 2uxt h GLU 416 Cb 1.26 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.36 2uxt h GLU 416 CO -0.50 0.00 0.00 -0.25 0.05 0.00 0.00 179.01 178.31 2uxt n ASP 417 N -2.36 4.35 -1.10 3.06 8.00 0.22 -4.54 116.55 124.18 2uxt n ASP 417 Ca 0.00 -2.53 0.12 0.00 0.71 0.00 0.00 54.79 53.09 2uxt n ASP 417 Cb 0.15 -0.52 0.20 0.00 -0.02 0.00 0.00 41.12 40.93 2uxt n ASP 417 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2uxt n ARG 418 N 0.63 2.45 -0.38 -1.24 1.74 -0.94 -4.29 116.66 114.63 2uxt n ARG 418 Ca 0.23 -2.18 0.00 0.00 -0.77 0.00 0.00 57.85 55.13 2uxt n ARG 418 Cb 0.84 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.77 2uxt n ARG 418 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2uxt n GLY 419 N 1.47 1.07 3.75 -0.13 0.00 -1.26 -4.89 105.19 105.19 2uxt n GLY 419 Ca 0.18 -1.96 -0.41 0.00 0.00 0.00 0.00 46.02 43.84 2uxt n GLY 419 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2uxt s TRP 420 N 0.87 3.64 0.15 1.61 0.52 -1.26 -4.55 118.94 119.92 2uxt s TRP 420 Ca 0.00 1.67 -0.01 0.00 0.02 0.00 0.00 56.10 57.79 2uxt s TRP 420 Cb 0.00 -3.23 -0.04 0.00 -1.15 0.00 0.00 33.47 29.05 2uxt s TRP 420 CO 0.00 -0.43 0.08 0.15 0.02 0.00 0.00 176.95 176.77 2uxt s LYS 421 N -0.77 1.02 0.00 4.98 1.02 0.76 -1.76 119.74 125.00 2uxt s LYS 421 Ca 0.47 -1.51 0.00 0.00 0.02 0.00 0.00 55.97 54.95 2uxt s LYS 421 Cb -0.29 0.23 0.00 0.00 -0.52 0.00 0.00 37.83 37.25 2uxt s LYS 421 CO 0.36 -0.30 0.03 -0.40 -0.92 0.00 0.00 175.35 174.12 2uxt n ASP 422 N -0.16 0.05 -3.98 2.83 5.68 -1.26 -0.63 116.55 119.08 2uxt n ASP 422 Ca -0.03 -0.36 -0.17 0.00 -0.50 0.00 0.00 54.79 53.73 2uxt n ASP 422 Cb 0.64 0.13 -0.15 0.00 -1.14 0.00 0.00 41.12 40.61 2uxt n ASP 422 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 2uxt s THR 423 N -0.13 0.54 -0.04 2.12 2.01 -1.26 -2.26 115.64 116.62 2uxt s THR 423 Ca 0.00 -0.28 -0.05 0.00 0.31 0.00 0.00 61.69 61.66 2uxt s THR 423 Cb 0.00 -0.47 0.01 0.00 0.01 0.00 0.00 72.50 72.05 2uxt s THR 423 CO 0.00 0.16 0.14 0.54 -0.69 0.00 0.00 174.62 174.77 2uxt s VAL 424 N -0.09 0.02 -0.05 3.82 0.11 0.21 -4.95 120.40 119.48 2uxt s VAL 424 Ca 0.02 -0.15 -0.28 0.00 -2.93 0.00 0.00 61.98 58.64 2uxt s VAL 424 Cb -0.04 -0.25 -0.03 0.00 -1.53 0.00 0.00 36.38 34.53 2uxt s VAL 424 CO -0.00 -0.08 0.90 0.86 -3.33 0.00 0.00 175.10 173.44 2uxt s TRP 425 N -0.22 3.59 -0.24 1.54 -0.11 -1.26 0.05 118.94 122.29 2uxt s TRP 425 Ca -0.03 1.52 0.02 0.00 1.22 0.00 0.00 56.10 58.83 2uxt s TRP 425 Cb -0.02 -3.04 0.05 0.00 -1.50 0.00 0.00 33.47 28.96 2uxt s TRP 425 CO 0.00 -0.04 -0.12 0.08 -4.62 0.00 0.00 176.95 172.25 2uxt s VAL 426 N 1.22 2.24 -0.40 5.86 1.01 0.82 -4.95 120.40 126.21 2uxt s VAL 426 Ca 0.46 -1.41 0.02 0.00 0.00 0.00 0.00 61.98 61.05 2uxt s VAL 426 Cb -0.19 -2.22 0.15 0.00 0.00 0.00 0.00 36.38 34.12 2uxt s VAL 426 CO 0.22 0.12 0.27 -0.62 0.00 0.00 0.00 175.10 175.09 2uxt s ASP 427 N 1.17 2.49 0.00 3.32 2.15 -1.26 -1.45 116.67 123.09 2uxt s ASP 427 Ca -0.05 -2.63 0.00 0.00 0.43 0.00 0.00 52.55 50.30 2uxt s ASP 427 Cb -0.18 -0.52 0.00 0.00 -0.30 0.00 0.00 42.92 41.92 2uxt s ASP 427 CO -0.07 -0.24 0.00 0.61 -0.17 0.00 0.00 175.17 175.30 2uxt n GLY 428 N 3.45 1.35 3.31 2.66 0.00 -0.83 -4.94 105.19 110.19 2uxt n GLY 428 Ca 0.19 -0.86 -0.13 0.00 0.00 0.00 0.00 46.02 45.22 2uxt n GLY 428 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2uxt s GLN 429 N 0.00 0.89 0.10 1.61 -2.07 -1.26 -0.85 119.66 118.07 2uxt s GLN 429 Ca 0.00 -0.36 0.02 0.00 -1.82 0.00 0.00 55.36 53.20 2uxt s GLN 429 Cb 0.00 0.39 -0.04 0.00 -1.09 0.00 0.00 33.01 32.28 2uxt s GLN 429 CO 0.00 -0.30 -0.08 0.14 -1.32 0.00 0.00 175.29 173.73 2uxt s VAL 430 N -2.39 0.78 -0.12 3.63 -7.23 0.64 -0.97 120.40 114.74 2uxt s VAL 430 Ca -0.06 -1.79 0.02 0.00 -1.81 0.00 0.00 61.98 58.34 2uxt s VAL 430 Cb -0.01 -1.50 0.02 0.00 0.56 0.00 0.00 36.38 35.44 2uxt s VAL 430 CO -0.02 -0.74 -0.16 -0.70 -0.31 0.00 0.00 175.10 173.17 2uxt s GLU 431 N -3.34 2.34 -0.00 4.82 2.12 -0.19 -0.91 118.70 123.54 2uxt s GLU 431 Ca 0.08 -0.60 0.08 0.00 0.36 0.00 0.00 54.97 54.90 2uxt s GLU 431 Cb 0.01 -2.00 -0.02 0.00 0.26 0.00 0.00 34.13 32.39 2uxt s GLU 431 CO -0.03 -0.09 -0.26 -0.51 -0.54 0.00 0.00 175.26 173.84 2uxt s LEU 432 N 1.05 2.08 -0.48 2.70 1.43 0.44 -0.25 118.68 125.64 2uxt s LEU 432 Ca -0.05 -0.50 -0.14 0.00 -1.03 0.00 0.00 54.13 52.42 2uxt s LEU 432 Cb -0.15 -1.32 0.09 0.00 0.03 0.00 0.00 46.19 44.85 2uxt s LEU 432 CO -0.03 0.30 0.39 -0.22 0.23 0.00 0.00 176.35 177.02 2uxt s LEU 433 N -0.76 5.67 -0.10 1.79 2.96 -0.44 -0.19 118.68 127.61 2uxt s LEU 433 Ca 0.10 -1.48 -0.12 0.00 -0.22 0.00 0.00 54.13 52.41 2uxt s LEU 433 Cb -0.10 -2.15 -0.05 0.00 0.50 0.00 0.00 46.19 44.40 2uxt s LEU 433 CO -0.00 -0.67 0.29 -0.69 -1.32 0.00 0.00 176.35 173.95 2uxt s VAL 434 N 1.58 5.27 -0.17 1.68 1.01 0.92 -1.64 120.40 129.06 2uxt s VAL 434 Ca 0.04 0.55 -0.03 0.00 0.00 0.00 0.00 61.98 62.54 2uxt s VAL 434 Cb -0.25 -3.60 -0.02 0.00 0.00 0.00 0.00 36.38 32.51 2uxt s VAL 434 CO 0.05 0.51 -0.06 -0.47 0.00 0.00 0.00 175.10 175.12 2uxt s TYR 435 N -0.38 2.95 -0.98 5.22 5.04 -0.47 -1.05 117.35 127.68 2uxt s TYR 435 Ca 0.18 -0.54 -0.09 0.00 -2.44 0.00 0.00 57.07 54.18 2uxt s TYR 435 Cb -0.14 -1.97 0.25 0.00 0.35 0.00 0.00 41.96 40.46 2uxt s TYR 435 CO 0.07 -0.21 0.94 -0.06 -1.34 0.00 0.00 175.55 174.95 2uxt s PHE 436 N 0.64 4.05 -0.92 4.97 0.08 -0.83 -3.20 117.98 122.78 2uxt s PHE 436 Ca -0.04 -2.59 0.25 0.00 0.12 0.00 0.00 56.93 54.68 2uxt s PHE 436 Cb -0.15 -3.70 0.52 0.00 -0.57 0.00 0.00 43.02 39.12 2uxt s PHE 436 CO 0.02 -0.92 1.43 0.41 -0.10 0.00 0.00 175.22 176.06 2uxt n GLY 437 N 2.98 -1.30 3.33 4.36 0.00 -1.26 0.89 105.19 114.19 2uxt n GLY 437 Ca 0.20 -0.31 -0.30 0.00 0.00 0.00 0.00 46.02 45.61 2uxt n GLY 437 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2uxt s GLN 438 N -3.04 1.82 0.43 1.61 -1.52 -1.25 -4.80 119.66 112.90 2uxt s GLN 438 Ca 0.10 -1.05 -0.06 0.00 -1.95 0.00 0.00 55.36 52.40 2uxt s GLN 438 Cb 0.17 -1.93 -0.04 0.00 -0.22 0.00 0.00 33.01 30.98 2uxt s GLN 438 CO 0.69 0.51 0.73 -1.25 -0.25 0.00 0.00 175.29 175.72 2uxt s PRO 439 N -1.09 3.60 0.20 2.91 0.04 -1.26 -4.77 135.00 134.62 2uxt s PRO 439 Ca 0.11 0.18 -0.10 0.00 0.04 0.00 0.00 61.00 61.22 2uxt s PRO 439 Cb -0.10 -2.44 -0.01 0.00 0.04 0.00 0.00 34.50 32.00 2uxt s PRO 439 CO 0.01 -0.09 0.36 -1.54 0.04 0.00 0.00 177.00 175.79 2uxt s SER 440 N -3.79 -0.03 0.21 6.66 1.04 -0.62 -0.90 113.70 116.28 2uxt s SER 440 Ca 0.47 -0.92 0.07 0.00 0.48 0.00 0.00 55.95 56.06 2uxt s SER 440 Cb -0.10 0.50 -0.05 0.00 0.10 0.00 0.00 66.02 66.47 2uxt s SER 440 CO 0.39 -1.00 -0.12 0.26 0.98 0.00 0.00 173.24 173.75 2uxt s TRP 441 N -4.00 1.70 0.44 5.02 0.51 -0.60 -4.01 118.94 118.00 2uxt s TRP 441 Ca 0.21 -0.62 0.18 0.00 -2.12 0.00 0.00 56.10 53.75 2uxt s TRP 441 Cb 0.02 -0.83 1.12 0.00 -0.81 0.00 0.00 33.47 32.97 2uxt s TRP 441 CO 0.05 0.31 1.89 0.00 -0.51 0.00 0.00 176.95 178.69 2uxt h ALA 442 N 2.54 2.23 -0.03 0.98 0.00 -1.98 0.67 119.26 123.67 2uxt h ALA 442 Ca -0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2uxt h ALA 442 Cb 1.22 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2uxt h ALA 442 CO 0.63 -0.47 -0.05 -2.39 0.00 0.00 0.00 179.25 176.97 2uxt n HIS 443 N -4.47 0.00 -3.18 0.00 1.44 -1.26 -4.30 115.22 103.45 2uxt n HIS 443 Ca 0.16 0.00 -0.20 0.00 -2.01 0.00 0.00 57.72 55.68 2uxt n HIS 443 Cb 0.64 -0.00 -0.04 0.00 0.12 0.00 0.00 29.99 30.71 2uxt n HIS 443 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 2uxt n PHE 444 N 1.16 0.35 -1.95 -1.40 3.01 0.02 -4.92 117.46 113.73 2uxt n PHE 444 Ca 0.14 -3.78 -0.28 0.00 1.01 0.00 0.00 57.45 54.53 2uxt n PHE 444 Cb 0.58 -0.41 0.09 0.00 -0.01 0.00 0.00 39.48 39.72 2uxt n PHE 444 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 2uxt s PRO 445 N -2.24 2.01 0.32 -1.08 0.04 -0.02 -1.55 135.00 132.48 2uxt s PRO 445 Ca 0.39 0.05 -0.01 0.00 0.04 0.00 0.00 61.00 61.48 2uxt s PRO 445 Cb 0.31 -1.99 -0.04 0.00 0.04 0.00 0.00 34.50 32.82 2uxt s PRO 445 CO -0.09 -1.53 0.53 -0.06 0.04 0.00 0.00 177.00 175.89 2uxt s PHE 446 N -3.52 3.49 0.18 0.56 0.08 -0.11 -4.88 117.98 113.77 2uxt s PHE 446 Ca 0.62 0.40 0.11 0.00 0.12 0.00 0.00 56.93 58.17 2uxt s PHE 446 Cb -0.11 -1.92 -0.04 0.00 -0.57 0.00 0.00 43.02 40.37 2uxt s PHE 446 CO 0.48 0.16 -0.24 0.71 -0.10 0.00 0.00 175.22 176.24 2uxt s TYR 447 N -2.22 2.33 -0.02 0.36 2.02 -1.26 -0.13 117.35 118.43 2uxt s TYR 447 Ca 0.40 -0.35 0.04 0.00 -0.37 0.00 0.00 57.07 56.79 2uxt s TYR 447 Cb -0.10 -1.18 -0.00 0.00 -0.40 0.00 0.00 41.96 40.28 2uxt s TYR 447 CO 0.34 0.46 -0.13 -0.59 -1.57 0.00 0.00 175.55 174.07 2uxt s PHE 448 N -1.52 1.22 0.20 2.71 -0.12 -0.77 -1.05 117.98 118.65 2uxt s PHE 448 Ca 0.19 -0.29 -0.18 0.00 -0.05 0.00 0.00 56.93 56.61 2uxt s PHE 448 Cb -0.09 -0.82 0.03 0.00 -0.63 0.00 0.00 43.02 41.51 2uxt s PHE 448 CO 0.09 -0.08 0.53 0.54 -0.05 0.00 0.00 175.22 176.25 2uxt s ASN 449 N -0.04 -0.27 0.27 1.98 2.20 -0.17 -0.55 114.94 118.35 2uxt s ASN 449 Ca 0.00 -0.48 -0.29 0.00 -0.94 0.00 0.00 52.86 51.15 2uxt s ASN 449 Cb -0.08 0.59 -0.09 0.00 -2.00 0.00 0.00 41.25 39.66 2uxt s ASN 449 CO 0.00 -1.07 1.21 -0.55 -2.94 0.00 0.00 177.10 173.76 2uxt s SER 450 N -2.87 7.03 0.00 3.54 0.15 -0.79 -0.99 113.70 119.77 2uxt s SER 450 Ca 0.09 2.42 0.29 0.00 0.70 0.00 0.00 55.95 59.45 2uxt s SER 450 Cb -0.01 -2.63 1.34 0.00 -1.71 0.00 0.00 66.02 63.01 2uxt s SER 450 CO -0.02 -0.36 1.91 0.00 1.20 0.00 0.00 173.24 175.96 2uxt n GLN 451 N 1.50 1.36 -2.60 5.44 1.13 0.18 -4.35 117.38 120.05 2uxt n GLN 451 Ca 0.01 -0.59 -0.41 0.00 -1.94 0.00 0.00 57.00 54.07 2uxt n GLN 451 Cb 0.43 -1.49 -0.03 0.00 0.11 0.00 0.00 30.24 29.27 2uxt n GLN 451 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 2uxt s THR 452 N -2.04 3.84 0.32 5.09 2.01 -1.26 -4.70 115.64 118.90 2uxt s THR 452 Ca 0.40 0.38 0.10 0.00 0.31 0.00 0.00 61.69 62.88 2uxt s THR 452 Cb 0.21 -4.86 0.33 0.00 0.01 0.00 0.00 72.50 68.19 2uxt s THR 452 CO 0.36 -1.73 1.64 -0.07 -0.69 0.00 0.00 174.62 174.13 2uxt h LEU 453 N 12.65 0.24 -1.19 4.42 3.38 -1.38 0.16 115.31 133.58 2uxt h LEU 453 Ca -0.28 0.21 -0.08 0.00 0.09 0.00 0.00 57.88 57.82 2uxt h LEU 453 Cb 1.05 0.22 -0.01 0.00 0.09 0.00 0.00 40.66 42.01 2uxt h LEU 453 CO 1.25 -0.19 -0.40 -0.33 0.09 0.00 0.00 178.44 178.86 2uxt h GLU 454 N 0.23 0.00 -0.15 1.13 3.07 -1.83 -1.33 114.58 115.70 2uxt h GLU 454 Ca 0.67 0.00 -0.09 0.00 -0.50 0.00 0.00 59.36 59.44 2uxt h GLU 454 Cb 1.50 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.41 2uxt h GLU 454 CO -0.66 0.40 -0.27 0.52 -1.40 0.00 0.00 179.01 177.59 2uxt h MET 455 N 0.00 0.44 -0.45 2.33 2.86 -0.93 -2.21 114.93 116.97 2uxt h MET 455 Ca -0.00 -0.28 0.03 0.00 -2.06 0.00 0.00 59.70 57.38 2uxt h MET 455 Cb 0.72 0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.38 2uxt h MET 455 CO 0.05 0.88 0.25 0.00 1.06 0.00 0.00 176.91 179.15 2uxt h ALA 456 N 0.56 0.57 -0.19 6.32 0.00 -1.18 -1.38 119.26 123.96 2uxt h ALA 456 Ca 0.01 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2uxt h ALA 456 Cb 0.86 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 2uxt h ALA 456 CO 0.06 -0.09 0.11 -0.44 0.00 0.00 0.00 179.25 178.90 2uxt h ASP 457 N 0.49 0.22 0.21 0.00 3.32 -1.19 -1.32 116.42 118.16 2uxt h ASP 457 Ca 0.19 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.23 2uxt h ASP 457 Cb 0.06 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2uxt h ASP 457 CO -0.11 0.17 -0.01 0.54 -1.72 0.00 0.00 179.24 178.10 2uxt n ARG 458 N -4.50 0.83 0.00 3.56 1.74 -0.60 -4.49 116.66 113.20 2uxt n ARG 458 Ca -0.00 -0.09 0.00 0.00 -0.77 0.00 0.00 57.85 56.99 2uxt n ARG 458 Cb 0.08 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.03 2uxt n ARG 458 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2uxt n GLY 459 N 1.13 1.30 2.41 -0.13 0.00 -0.50 -4.71 105.19 104.70 2uxt n GLY 459 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 2uxt n GLY 459 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2uxt n SER 460 N 0.00 7.97 -3.92 1.61 7.64 -0.73 -0.63 113.62 125.57 2uxt n SER 460 Ca 0.00 -2.74 -0.11 0.00 1.01 0.00 0.00 58.87 57.03 2uxt n SER 460 Cb 0.00 -1.53 -0.13 0.00 -1.01 0.00 0.00 64.21 61.55 2uxt n SER 460 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2uxt s ILE 461 N 1.52 0.05 0.24 0.44 1.01 -1.26 -1.88 121.20 121.31 2uxt s ILE 461 Ca 0.63 -0.40 0.07 0.00 0.00 0.00 0.00 60.65 60.94 2uxt s ILE 461 Cb 0.17 -0.13 -0.05 0.00 0.01 0.00 0.00 42.46 42.47 2uxt s ILE 461 CO -0.07 -0.22 -0.09 -0.83 0.00 0.00 0.00 174.94 173.73 2uxt s GLY 462 N -0.65 1.60 -0.16 6.18 0.00 0.28 -3.47 107.32 111.11 2uxt s GLY 462 Ca -0.07 -1.77 -0.02 0.00 0.00 0.00 0.00 44.72 42.86 2uxt s GLY 462 CO -0.00 -1.77 -0.08 1.20 0.00 0.00 0.00 173.10 172.44 2uxt s GLN 463 N -3.71 3.50 -0.22 2.90 -0.21 -1.26 -1.85 119.66 118.81 2uxt s GLN 463 Ca 0.26 -0.61 -0.05 0.00 0.02 0.00 0.00 55.36 54.98 2uxt s GLN 463 Cb 0.02 -2.81 -0.02 0.00 1.00 0.00 0.00 33.01 31.21 2uxt s GLN 463 CO 0.09 0.16 -0.00 -1.17 -2.12 0.00 0.00 175.29 172.24 2uxt s LEU 464 N 0.55 3.17 -0.25 2.90 2.96 0.82 -1.22 118.68 127.61 2uxt s LEU 464 Ca -0.06 -0.26 -0.08 0.00 -0.22 0.00 0.00 54.13 53.51 2uxt s LEU 464 Cb -0.15 -1.81 -0.03 0.00 0.50 0.00 0.00 46.19 44.69 2uxt s LEU 464 CO 0.03 0.02 0.08 -0.22 -1.32 0.00 0.00 176.35 174.94 2uxt s LEU 465 N 1.26 3.53 -0.37 -0.68 0.20 0.69 -0.94 118.68 122.38 2uxt s LEU 465 Ca 0.04 -0.16 -0.03 0.00 0.69 0.00 0.00 54.13 54.66 2uxt s LEU 465 Cb -0.15 -1.95 0.08 0.00 -0.43 0.00 0.00 46.19 43.75 2uxt s LEU 465 CO 0.01 -0.02 0.13 -0.69 -0.29 0.00 0.00 176.35 175.49 2uxt s VAL 466 N 1.53 3.32 0.00 1.68 1.01 -1.26 0.13 120.40 126.81 2uxt s VAL 466 Ca 0.06 -1.68 -0.30 0.00 0.00 0.00 0.00 61.98 60.06 2uxt s VAL 466 Cb -0.15 -3.10 -0.07 0.00 0.00 0.00 0.00 36.38 33.07 2uxt s VAL 466 CO 0.04 -0.43 1.66 0.20 0.00 0.00 0.00 175.10 176.58 2uxt s ASN 467 N 1.61 6.64 0.50 3.32 0.01 0.11 -1.58 114.94 125.55 2uxt s ASN 467 Ca 0.02 2.35 -0.21 0.00 -0.71 0.00 0.00 52.86 54.32 2uxt s ASN 467 Cb -0.21 -2.55 -0.10 0.00 0.41 0.00 0.00 41.25 38.80 2uxt s ASN 467 CO -0.02 -0.91 0.73 -0.81 -1.51 0.00 0.00 177.10 174.58 2uxt n PRO 468 N 6.50 0.81 -2.18 -0.60 -0.04 -1.26 -0.86 135.00 137.36 2uxt n PRO 468 Ca 0.17 0.30 -0.43 0.00 -0.04 0.00 0.00 63.50 63.50 2uxt n PRO 468 Cb 0.42 -1.82 -0.02 0.00 -0.04 0.00 0.00 33.50 32.04 2uxt n PRO 468 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2uxt s VAL 469 N -1.50 3.86 0.00 0.52 -7.23 -1.26 -4.71 120.40 110.07 2uxt s VAL 469 Ca 0.67 1.03 0.00 0.00 -1.81 0.00 0.00 61.98 61.87 2uxt s VAL 469 Cb -0.51 -3.69 0.00 0.00 0.56 0.00 0.00 36.38 32.74 2uxt s VAL 469 CO 0.55 -0.12 0.00 -2.65 -0.31 0.00 0.00 175.10 172.57