#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ouk n GLN 0 N 0.00 1.01 0.07 1.96 6.02 -1.26 -4.76 117.38 120.41 2ouk n GLN 0 Ca 0.00 0.38 -0.21 0.00 -0.01 0.00 0.00 57.00 57.16 2ouk n GLN 0 Cb 0.00 -2.09 -0.13 0.00 1.02 0.00 0.00 30.24 29.03 2ouk n GLN 0 CO 0.00 0.00 0.00 1.98 -1.01 0.00 0.00 177.06 178.03 2ouk h MET 1 N 0.79 0.47 -4.50 -1.09 1.85 -1.19 -3.33 114.93 107.93 2ouk h MET 1 Ca -0.47 -0.66 -0.57 0.00 -0.61 0.00 0.00 59.70 57.39 2ouk h MET 1 Cb 1.36 0.22 -0.36 0.00 0.43 0.00 0.00 31.60 33.25 2ouk h MET 1 CO 0.52 1.29 -0.82 0.42 -0.40 0.00 0.00 176.91 177.92 2ouk s ILE 2 N -2.81 1.33 -0.21 1.77 1.01 -0.88 -0.12 121.20 121.29 2ouk s ILE 2 Ca -0.12 -0.49 0.01 0.00 0.00 0.00 0.00 60.65 60.05 2ouk s ILE 2 Cb 0.03 -1.27 0.05 0.00 0.01 0.00 0.00 42.46 41.28 2ouk s ILE 2 CO 0.88 0.42 -0.08 -0.62 0.00 0.00 0.00 174.94 175.53 2ouk s ASP 3 N 1.46 3.59 -0.17 3.58 -1.08 -0.26 -1.00 116.67 122.78 2ouk s ASP 3 Ca 0.02 -1.01 0.01 0.00 -0.52 0.00 0.00 52.55 51.05 2ouk s ASP 3 Cb -0.13 -1.20 0.03 0.00 -1.46 0.00 0.00 42.92 40.15 2ouk s ASP 3 CO -0.08 -0.19 -0.14 -0.69 0.52 0.00 0.00 175.17 174.60 2ouk s VAL 4 N 1.40 1.68 -0.13 1.11 1.01 0.12 -0.48 120.40 125.11 2ouk s VAL 4 Ca -0.03 -0.83 0.01 0.00 0.00 0.00 0.00 61.98 61.12 2ouk s VAL 4 Cb -0.17 -1.63 -0.01 0.00 0.00 0.00 0.00 36.38 34.57 2ouk s VAL 4 CO -0.07 0.36 -0.16 -2.28 0.00 0.00 0.00 175.10 172.95 2ouk s HIS 5 N 1.42 2.76 -0.78 5.22 2.46 -0.32 -1.14 115.29 124.92 2ouk s HIS 5 Ca 0.03 -0.85 -0.18 0.00 0.47 0.00 0.00 55.06 54.52 2ouk s HIS 5 Cb -0.14 -1.84 0.03 0.00 -0.13 0.00 0.00 32.58 30.50 2ouk s HIS 5 CO -0.10 -0.34 0.34 1.04 -2.47 0.00 0.00 174.74 173.21 2ouk n GLN 6 N 3.71 -0.61 -2.47 2.88 1.13 -1.10 -0.93 117.38 120.00 2ouk n GLN 6 Ca -0.19 -0.14 -0.41 0.00 -1.94 0.00 0.00 57.00 54.32 2ouk n GLN 6 Cb 0.52 -1.29 -0.03 0.00 0.11 0.00 0.00 30.24 29.55 2ouk n GLN 6 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 2ouk s LEU 7 N -6.38 4.43 -0.01 1.08 2.96 -0.68 -2.50 118.68 117.59 2ouk s LEU 7 Ca 0.25 2.05 -0.03 0.00 -0.22 0.00 0.00 54.13 56.18 2ouk s LEU 7 Cb -0.14 -3.59 -0.00 0.00 0.50 0.00 0.00 46.19 42.96 2ouk s LEU 7 CO 0.60 -0.34 0.06 -0.54 -1.32 0.00 0.00 176.35 174.81 2ouk s LYS 8 N 0.30 0.23 -0.04 1.98 1.02 -0.95 0.18 119.74 122.45 2ouk s LYS 8 Ca 0.54 -0.20 -0.16 0.00 0.02 0.00 0.00 55.97 56.17 2ouk s LYS 8 Cb -0.29 0.09 0.03 0.00 -0.52 0.00 0.00 37.83 37.14 2ouk s LYS 8 CO 0.32 -0.04 0.35 0.21 -0.92 0.00 0.00 175.35 175.27 2ouk s LYS 9 N -0.67 0.66 -0.11 1.68 2.20 -0.74 -0.51 119.74 122.26 2ouk s LYS 9 Ca -0.07 -0.02 -0.05 0.00 -0.36 0.00 0.00 55.97 55.47 2ouk s LYS 9 Cb -0.05 0.30 0.05 0.00 -1.51 0.00 0.00 37.83 36.63 2ouk s LYS 9 CO 0.00 -0.17 0.24 -1.12 -0.36 0.00 0.00 175.35 173.94 2ouk s SER 10 N -1.03 0.07 -0.61 1.43 0.01 -1.26 -1.04 113.70 111.27 2ouk s SER 10 Ca -0.11 0.52 -0.21 0.00 1.31 0.00 0.00 55.95 57.47 2ouk s SER 10 Cb -0.04 0.50 0.08 0.00 0.21 0.00 0.00 66.02 66.76 2ouk s SER 10 CO 0.04 -0.20 0.82 -0.36 0.41 0.00 0.00 173.24 173.95 2ouk s PHE 11 N 1.79 2.86 0.00 2.43 0.08 -0.11 -4.88 117.98 120.15 2ouk s PHE 11 Ca -0.04 -0.68 0.00 0.00 0.12 0.00 0.00 56.93 56.33 2ouk s PHE 11 Cb -0.11 -4.08 0.00 0.00 -0.57 0.00 0.00 43.02 38.26 2ouk s PHE 11 CO -0.08 -1.42 0.00 0.41 -0.10 0.00 0.00 175.22 174.03 2ouk n GLY 12 N 5.28 0.40 0.00 4.36 0.00 -1.26 -2.30 105.19 111.66 2ouk n GLY 12 Ca -0.06 -0.86 0.04 0.00 0.00 0.00 0.00 46.02 45.14 2ouk n GLY 12 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ouk n SER 13 N -1.84 0.00 -4.66 1.61 3.41 -1.26 -4.63 113.62 106.25 2ouk n SER 13 Ca 0.00 0.50 -0.42 0.00 -0.26 0.00 0.00 58.87 58.69 2ouk n SER 13 Cb 0.00 -0.50 -0.03 0.00 -0.26 0.00 0.00 64.21 63.41 2ouk n SER 13 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2ouk s LEU 14 N -3.01 4.13 -0.30 1.04 2.96 -0.97 -5.02 118.68 117.51 2ouk s LEU 14 Ca 0.04 1.20 -0.19 0.00 -0.22 0.00 0.00 54.13 54.97 2ouk s LEU 14 Cb 0.06 -3.32 -0.01 0.00 0.50 0.00 0.00 46.19 43.42 2ouk s LEU 14 CO 0.16 -0.51 0.54 -0.70 -1.32 0.00 0.00 176.35 174.53 2ouk s GLU 15 N 2.65 3.87 -0.13 1.98 2.12 -1.26 -0.93 118.70 126.98 2ouk s GLU 15 Ca 0.39 0.14 -0.09 0.00 0.36 0.00 0.00 54.97 55.77 2ouk s GLU 15 Cb -0.16 -3.73 -0.25 0.00 0.26 0.00 0.00 34.13 30.25 2ouk s GLU 15 CO 0.09 -0.51 0.35 1.33 -0.54 0.00 0.00 175.26 175.97 2ouk n VAL 16 N 5.32 1.75 -4.06 3.70 0.24 -0.21 -4.83 118.33 120.25 2ouk n VAL 16 Ca -0.04 -0.55 -0.34 0.00 -2.04 0.00 0.00 64.34 61.38 2ouk n VAL 16 Cb 0.49 -1.79 -0.15 0.00 -1.47 0.00 0.00 33.84 30.92 2ouk n VAL 16 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2ouk s LEU 17 N -7.19 2.34 -0.77 1.34 1.43 -1.03 -3.99 118.68 110.81 2ouk s LEU 17 Ca -0.23 -0.58 0.02 0.00 -1.03 0.00 0.00 54.13 52.31 2ouk s LEU 17 Cb 0.06 -1.55 0.34 0.00 0.03 0.00 0.00 46.19 45.07 2ouk s LEU 17 CO 0.74 -0.01 1.36 0.29 0.23 0.00 0.00 176.35 178.97 2ouk n LYS 18 N 4.67 4.17 -1.07 1.70 5.02 0.96 -1.79 118.16 131.82 2ouk n LYS 18 Ca -0.20 -4.73 0.00 0.00 -2.02 0.00 0.00 58.31 51.36 2ouk n LYS 18 Cb 0.50 -2.34 0.00 0.00 -0.02 0.00 0.00 35.03 33.17 2ouk n LYS 18 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2ouk n GLY 19 N -0.19 -0.20 3.73 0.72 0.00 0.13 -4.80 105.19 104.58 2ouk n GLY 19 Ca 0.39 -0.29 -0.35 0.00 0.00 0.00 0.00 46.02 45.77 2ouk n GLY 19 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ouk s ILE 20 N -1.28 5.35 -0.19 -0.61 -1.09 -0.19 -4.70 121.20 118.48 2ouk s ILE 20 Ca 0.00 0.17 0.01 0.00 -2.23 0.00 0.00 60.65 58.60 2ouk s ILE 20 Cb 0.00 -3.43 0.03 0.00 -1.58 0.00 0.00 42.46 37.48 2ouk s ILE 20 CO 0.00 0.45 -0.16 0.20 -1.23 0.00 0.00 174.94 174.20 2ouk s ASN 21 N 0.28 3.32 -0.05 3.58 0.01 -1.26 -1.68 114.94 119.14 2ouk s ASN 21 Ca 0.08 -0.79 -0.04 0.00 -0.71 0.00 0.00 52.86 51.40 2ouk s ASN 21 Cb -0.11 -1.40 0.02 0.00 0.41 0.00 0.00 41.25 40.17 2ouk s ASN 21 CO -0.01 -0.07 0.13 -0.69 -1.51 0.00 0.00 177.10 174.95 2ouk s VAL 22 N 1.31 -0.01 -0.11 1.60 1.01 -0.29 -5.01 120.40 118.91 2ouk s VAL 22 Ca 0.02 0.03 -0.03 0.00 0.00 0.00 0.00 61.98 62.00 2ouk s VAL 22 Cb -0.15 -0.20 0.04 0.00 0.00 0.00 0.00 36.38 36.08 2ouk s VAL 22 CO -0.10 0.01 0.04 -1.00 0.00 0.00 0.00 175.10 174.05 2ouk s HIS 23 N 0.26 0.47 -0.17 5.22 3.76 -1.26 0.14 115.29 123.71 2ouk s HIS 23 Ca -0.02 -0.21 0.00 0.00 -0.15 0.00 0.00 55.06 54.69 2ouk s HIS 23 Cb -0.03 -0.74 0.01 0.00 1.11 0.00 0.00 32.58 32.93 2ouk s HIS 23 CO -0.01 -0.38 -0.17 0.42 -0.85 0.00 0.00 174.74 173.75 2ouk s ILE 24 N 2.04 2.44 0.70 0.60 1.01 -0.17 -5.00 121.20 122.82 2ouk s ILE 24 Ca 0.03 -0.83 -0.10 0.00 0.00 0.00 0.00 60.65 59.75 2ouk s ILE 24 Cb -0.14 -2.03 0.03 0.00 0.01 0.00 0.00 42.46 40.33 2ouk s ILE 24 CO -0.06 0.52 1.06 -0.13 0.00 0.00 0.00 174.94 176.33 2ouk s ARG 25 N 1.03 2.60 0.40 2.79 0.52 -1.26 -0.72 118.95 124.31 2ouk s ARG 25 Ca -0.01 0.20 -0.27 0.00 -0.52 0.00 0.00 55.73 55.13 2ouk s ARG 25 Cb -0.15 -2.08 -0.09 0.00 0.52 0.00 0.00 34.95 33.15 2ouk s ARG 25 CO -0.05 -1.11 1.41 -2.00 0.02 0.00 0.00 175.30 173.57 2ouk s GLU 26 N -5.31 3.95 0.00 3.54 2.12 -1.26 -2.42 118.70 119.32 2ouk s GLU 26 Ca 0.58 2.39 0.00 0.00 0.36 0.00 0.00 54.97 58.31 2ouk s GLU 26 Cb -0.11 -2.82 0.00 0.00 0.26 0.00 0.00 34.13 31.46 2ouk s GLU 26 CO 0.49 -0.59 0.00 0.41 -0.54 0.00 0.00 175.26 175.03 2ouk n GLY 27 N 0.58 1.54 3.78 -1.50 0.00 -1.25 -4.95 105.19 103.38 2ouk n GLY 27 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 2ouk n GLY 27 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ouk s GLU 28 N -0.06 4.56 -0.25 1.61 2.12 -1.02 -4.62 118.70 121.03 2ouk s GLU 28 Ca 0.00 1.21 -0.05 0.00 0.36 0.00 0.00 54.97 56.50 2ouk s GLU 28 Cb 0.00 -3.01 0.00 0.00 0.26 0.00 0.00 34.13 31.38 2ouk s GLU 28 CO 0.00 0.42 0.01 0.08 -0.54 0.00 0.00 175.26 175.23 2ouk s VAL 29 N -1.40 3.56 -0.15 3.70 1.01 -1.26 -1.18 120.40 124.68 2ouk s VAL 29 Ca 0.43 -0.64 -0.00 0.00 0.00 0.00 0.00 61.98 61.77 2ouk s VAL 29 Cb -0.21 -2.74 -0.01 0.00 0.00 0.00 0.00 36.38 33.42 2ouk s VAL 29 CO 0.25 0.25 -0.13 -0.69 0.00 0.00 0.00 175.10 174.79 2ouk s VAL 30 N 1.47 2.96 -0.14 2.92 1.01 0.12 -1.08 120.40 127.66 2ouk s VAL 30 Ca 0.04 -0.68 -0.05 0.00 0.00 0.00 0.00 61.98 61.29 2ouk s VAL 30 Cb -0.16 -2.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 2ouk s VAL 30 CO -0.01 0.51 0.04 -0.69 0.00 0.00 0.00 175.10 174.95 2ouk s VAL 31 N 0.65 4.64 -0.27 2.92 1.01 -0.61 0.32 120.40 129.06 2ouk s VAL 31 Ca -0.07 -0.10 0.01 0.00 0.00 0.00 0.00 61.98 61.81 2ouk s VAL 31 Cb -0.15 -3.03 0.05 0.00 0.00 0.00 0.00 36.38 33.25 2ouk s VAL 31 CO 0.02 0.53 -0.06 -0.69 0.00 0.00 0.00 175.10 174.90 2ouk s VAL 32 N -0.23 2.57 0.47 2.92 1.01 0.86 -0.28 120.40 127.71 2ouk s VAL 32 Ca 0.07 -1.45 0.07 0.00 0.00 0.00 0.00 61.98 60.67 2ouk s VAL 32 Cb -0.12 -2.46 0.01 0.00 0.00 0.00 0.00 36.38 33.81 2ouk s VAL 32 CO 0.02 -0.02 0.45 0.27 0.00 0.00 0.00 175.10 175.81 2ouk s ILE 33 N 1.19 2.37 0.00 2.22 -4.36 0.07 -2.73 121.20 119.96 2ouk s ILE 33 Ca -0.06 -1.32 0.00 0.00 -0.26 0.00 0.00 60.65 59.01 2ouk s ILE 33 Cb -0.19 -2.69 0.00 0.00 1.25 0.00 0.00 42.46 40.83 2ouk s ILE 33 CO -0.04 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.75 2ouk n GLY 34 N -1.70 4.18 3.77 6.27 0.00 -1.26 -1.39 105.19 115.06 2ouk n GLY 34 Ca 0.04 -1.59 -0.32 0.00 0.00 0.00 0.00 46.02 44.15 2ouk n GLY 34 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ouk s PRO 35 N -3.04 2.56 0.93 1.61 0.04 -1.26 -4.97 135.00 130.87 2ouk s PRO 35 Ca 0.00 1.24 -0.11 0.00 0.04 0.00 0.00 61.00 62.16 2ouk s PRO 35 Cb 0.00 -1.93 0.10 0.00 0.04 0.00 0.00 34.50 32.71 2ouk s PRO 35 CO 0.00 -1.42 0.80 0.43 0.04 0.00 0.00 177.00 176.85 2ouk n SER 36 N -3.01 -0.80 0.00 6.66 7.64 -1.26 -2.68 113.62 120.17 2ouk n SER 36 Ca 0.09 0.38 0.00 0.00 1.01 0.00 0.00 58.87 60.35 2ouk n SER 36 Cb 0.53 -1.35 0.00 0.00 -1.01 0.00 0.00 64.21 62.37 2ouk n SER 36 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ouk n GLY 37 N 0.84 0.31 0.13 0.23 0.00 -1.26 -4.84 105.19 100.61 2ouk n GLY 37 Ca 0.10 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.26 2ouk n GLY 37 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ouk n SER 38 N -0.31 0.50 0.00 1.61 3.41 -1.09 -4.72 113.62 113.03 2ouk n SER 38 Ca 0.00 -0.69 0.00 0.00 -0.26 0.00 0.00 58.87 57.92 2ouk n SER 38 Cb 0.15 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.04 2ouk n SER 38 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ouk n GLY 39 N 1.24 0.68 0.27 5.00 0.00 -1.26 -1.85 105.19 109.26 2ouk n GLY 39 Ca 0.16 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.09 2ouk n GLY 39 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ouk h LYS 40 N 4.50 -0.42 -0.95 1.61 1.57 -1.91 -0.27 116.57 120.70 2ouk h LYS 40 Ca 0.00 0.03 0.13 0.00 -1.87 0.00 0.00 60.65 58.94 2ouk h LYS 40 Cb 0.00 0.10 -0.08 0.00 0.08 0.00 0.00 32.23 32.33 2ouk h LYS 40 CO 0.00 -0.28 0.60 0.77 -0.57 0.00 0.00 179.45 179.97 2ouk h SER 41 N -0.44 0.81 -0.83 0.86 0.02 -1.99 -0.25 113.55 111.73 2ouk h SER 41 Ca -0.01 0.05 -0.04 0.00 -0.84 0.00 0.00 61.79 60.95 2ouk h SER 41 Cb 0.43 -0.12 -0.04 0.00 0.14 0.00 0.00 62.40 62.82 2ouk h SER 41 CO -0.14 0.42 0.37 0.74 -1.14 0.00 0.00 176.83 177.08 2ouk h THR 42 N 0.86 1.26 0.18 -2.27 2.02 -1.89 0.69 112.91 113.76 2ouk h THR 42 Ca 0.47 -0.77 -0.01 0.00 0.77 0.00 0.00 66.41 66.88 2ouk h THR 42 Cb 0.59 0.23 0.00 0.00 -1.74 0.00 0.00 68.15 67.23 2ouk h THR 42 CO -0.24 0.32 -0.09 0.15 0.37 0.00 0.00 175.52 176.04 2ouk h PHE 43 N 1.19 -0.23 -0.17 3.16 3.57 0.70 -2.07 116.94 123.09 2ouk h PHE 43 Ca 0.28 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.76 2ouk h PHE 43 Cb 0.16 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.96 2ouk h PHE 43 CO 0.02 -0.11 0.02 -0.07 -2.23 0.00 0.00 178.31 175.94 2ouk h LEU 44 N -0.28 0.22 -1.04 0.59 4.07 -1.08 -1.72 115.31 116.07 2ouk h LEU 44 Ca -0.02 -0.02 -0.09 0.00 0.08 0.00 0.00 57.88 57.83 2ouk h LEU 44 Cb 0.21 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 41.89 2ouk h LEU 44 CO 0.04 0.24 -0.42 0.03 -1.08 0.00 0.00 178.44 177.26 2ouk h ARG 45 N 0.24 0.00 -0.21 1.13 3.08 -0.51 -2.35 114.38 115.77 2ouk h ARG 45 Ca 0.06 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.94 2ouk h ARG 45 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.18 2ouk h ARG 45 CO -0.00 0.42 -0.52 0.00 -1.07 0.00 0.00 179.97 178.79 2ouk h LEU 47 N 0.43 0.30 -1.71 0.00 3.38 -1.26 -2.40 115.31 114.05 2ouk h LEU 47 Ca -0.01 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2ouk h LEU 47 Cb 1.14 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2ouk h LEU 47 CO 0.11 0.35 0.00 -3.20 0.09 0.00 0.00 178.44 175.79 2ouk n ASN 48 N -4.37 2.49 -1.49 -0.43 5.15 -0.90 -4.93 115.26 110.78 2ouk n ASN 48 Ca 0.00 -1.99 -0.19 0.00 -0.60 0.00 0.00 54.58 51.80 2ouk n ASN 48 Cb 0.18 -0.31 -0.07 0.00 -0.53 0.00 0.00 39.78 39.05 2ouk n ASN 48 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2ouk n LEU 49 N 0.86 -1.40 0.02 1.20 4.32 -0.91 -4.86 117.00 116.24 2ouk n LEU 49 Ca 0.16 0.42 -0.11 0.00 -0.02 0.00 0.00 56.01 56.45 2ouk n LEU 49 Cb 0.39 -2.62 -0.14 0.00 -1.62 0.00 0.00 43.42 39.44 2ouk n LEU 49 CO 0.11 -0.91 -0.34 -0.07 -1.22 0.00 0.00 177.39 174.96 2ouk h LEU 50 N 0.00 0.14 -8.40 2.23 3.38 -1.11 -3.46 115.31 108.09 2ouk h LEU 50 Ca -0.39 -0.22 -0.60 0.00 0.09 0.00 0.00 57.88 56.76 2ouk h LEU 50 Cb 1.22 -0.05 -0.30 0.00 0.09 0.00 0.00 40.66 41.63 2ouk h LEU 50 CO 0.56 1.19 -0.85 -1.61 0.09 0.00 0.00 178.44 177.81 2ouk s GLU 51 N -2.63 1.74 0.75 1.13 2.02 -0.76 -4.99 118.70 115.97 2ouk s GLU 51 Ca -0.06 -0.73 -0.07 0.00 0.02 0.00 0.00 54.97 54.13 2ouk s GLU 51 Cb 0.08 -1.64 0.10 0.00 0.10 0.00 0.00 34.13 32.77 2ouk s GLU 51 CO 0.83 0.41 1.06 0.34 0.02 0.00 0.00 175.26 177.92 2ouk s ASP 52 N -0.39 4.40 0.18 -0.19 2.15 -1.26 -4.16 116.67 117.40 2ouk s ASP 52 Ca 0.06 0.24 -0.00 0.00 0.43 0.00 0.00 52.55 53.27 2ouk s ASP 52 Cb -0.09 -0.72 -0.04 0.00 -0.30 0.00 0.00 42.92 41.77 2ouk s ASP 52 CO -0.00 -1.86 0.07 0.72 -0.17 0.00 0.00 175.17 173.93 2ouk s PHE 53 N -3.34 1.11 -0.20 -5.34 -0.12 -1.26 -4.95 117.98 103.89 2ouk s PHE 53 Ca 0.64 -1.23 -0.06 0.00 -0.05 0.00 0.00 56.93 56.23 2ouk s PHE 53 Cb -0.08 -0.61 -0.20 0.00 -0.63 0.00 0.00 43.02 41.50 2ouk s PHE 53 CO 0.46 -0.47 0.04 -0.25 -0.05 0.00 0.00 175.22 174.95 2ouk n ASP 54 N -0.23 2.02 -4.11 1.98 8.00 0.34 -4.98 116.55 119.57 2ouk n ASP 54 Ca -0.03 0.12 -0.17 0.00 0.71 0.00 0.00 54.79 55.43 2ouk n ASP 54 Cb 0.65 -0.71 -0.10 0.00 -0.02 0.00 0.00 41.12 40.94 2ouk n ASP 54 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2ouk s GLU 55 N -2.52 1.49 1.46 -1.24 2.02 -0.68 -4.98 118.70 114.25 2ouk s GLU 55 Ca -0.30 -1.83 0.00 0.00 0.02 0.00 0.00 54.97 52.86 2ouk s GLU 55 Cb 0.08 -0.10 0.00 0.00 0.10 0.00 0.00 34.13 34.21 2ouk s GLU 55 CO 0.65 -0.40 0.00 0.41 0.02 0.00 0.00 175.26 175.95 2ouk n GLY 56 N -0.51 -1.70 3.08 -1.39 0.00 -1.04 -2.25 105.19 101.39 2ouk n GLY 56 Ca 0.01 -1.33 -0.09 0.00 0.00 0.00 0.00 46.02 44.61 2ouk n GLY 56 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ouk s GLU 57 N 0.00 0.53 -0.08 1.61 2.02 -0.11 -4.93 118.70 117.74 2ouk s GLU 57 Ca 0.00 -0.81 -0.00 0.00 0.02 0.00 0.00 54.97 54.18 2ouk s GLU 57 Cb 0.00 0.20 0.02 0.00 0.10 0.00 0.00 34.13 34.45 2ouk s GLU 57 CO 0.00 -0.12 -0.05 0.42 0.02 0.00 0.00 175.26 175.53 2ouk s ILE 58 N -2.60 0.71 -0.17 -1.63 1.01 -1.26 -1.17 121.20 116.09 2ouk s ILE 58 Ca -0.05 -0.14 0.01 0.00 0.00 0.00 0.00 60.65 60.47 2ouk s ILE 58 Cb -0.01 -0.76 0.03 0.00 0.01 0.00 0.00 42.46 41.72 2ouk s ILE 58 CO -0.05 0.30 -0.14 -0.63 0.00 0.00 0.00 174.94 174.42 2ouk s ILE 59 N 1.47 1.72 -0.41 2.92 1.01 0.37 -1.59 121.20 126.69 2ouk s ILE 59 Ca -0.01 -0.83 -0.13 0.00 0.00 0.00 0.00 60.65 59.67 2ouk s ILE 59 Cb -0.13 -1.65 0.04 0.00 0.01 0.00 0.00 42.46 40.73 2ouk s ILE 59 CO -0.04 0.38 0.28 -0.63 0.00 0.00 0.00 174.94 174.94 2ouk s ILE 60 N 1.41 4.89 -1.41 2.92 -1.09 0.16 -1.10 121.20 126.97 2ouk s ILE 60 Ca 0.03 -0.90 -0.07 0.00 -2.23 0.00 0.00 60.65 57.48 2ouk s ILE 60 Cb -0.14 -3.80 0.04 0.00 -1.58 0.00 0.00 42.46 36.98 2ouk s ILE 60 CO -0.10 -0.36 0.84 -0.67 -1.23 0.00 0.00 174.94 173.41 2ouk n ASP 61 N 5.08 -2.98 0.00 3.58 2.03 0.83 -1.41 116.55 123.68 2ouk n ASP 61 Ca -0.11 -0.80 0.00 0.00 0.52 0.00 0.00 54.79 54.40 2ouk n ASP 61 Cb 0.45 -3.99 0.00 0.00 -0.72 0.00 0.00 41.12 36.86 2ouk n ASP 61 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2ouk n GLY 62 N -1.65 1.47 3.50 0.27 0.00 -1.26 -5.02 105.19 102.50 2ouk n GLY 62 Ca -0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.49 2ouk n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ouk s ILE 63 N -3.15 5.01 -0.17 -0.61 -1.09 -0.50 -5.06 121.20 115.64 2ouk s ILE 63 Ca 0.00 -0.23 -0.29 0.00 -2.23 0.00 0.00 60.65 57.90 2ouk s ILE 63 Cb 0.00 -3.53 -0.01 0.00 -1.58 0.00 0.00 42.46 37.34 2ouk s ILE 63 CO 0.00 0.07 1.15 0.21 -1.23 0.00 0.00 174.94 175.14 2ouk s ASN 64 N 1.69 7.04 0.38 3.58 3.84 -1.26 -0.67 114.94 129.54 2ouk s ASN 64 Ca 0.06 1.57 0.26 0.00 0.21 0.00 0.00 52.86 54.96 2ouk s ASN 64 Cb -0.17 -2.54 1.38 0.00 -0.55 0.00 0.00 41.25 39.37 2ouk s ASN 64 CO 0.09 -0.68 1.79 -0.07 -2.79 0.00 0.00 177.10 175.44 2ouk h LEU 65 N 9.29 0.00 -1.28 3.21 3.38 -1.69 -1.43 115.31 126.77 2ouk h LEU 65 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2ouk h LEU 65 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 2ouk h LEU 65 CO 0.95 0.00 -0.03 0.29 0.09 0.00 0.00 178.44 179.74 2ouk n LYS 66 N -2.41 0.65 -1.78 1.13 5.02 -1.26 -4.98 118.16 114.53 2ouk n LYS 66 Ca -0.01 -1.01 -0.42 0.00 -2.02 0.00 0.00 58.31 54.84 2ouk n LYS 66 Cb 0.06 -1.17 -0.03 0.00 -0.02 0.00 0.00 35.03 33.87 2ouk n LYS 66 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ouk s ALA 67 N -0.90 3.56 0.16 7.82 0.00 -0.54 -4.86 121.76 126.99 2ouk s ALA 67 Ca 0.11 1.18 -0.03 0.00 0.00 0.00 0.00 51.96 53.22 2ouk s ALA 67 Cb 0.08 -3.82 0.29 0.00 0.00 0.00 0.00 23.12 19.67 2ouk s ALA 67 CO 0.14 -1.57 0.84 0.36 0.00 0.00 0.00 175.76 175.54 2ouk n LYS 68 N 7.46 -0.05 -0.38 0.00 0.00 -1.26 0.28 118.16 124.22 2ouk n LYS 68 Ca 0.19 0.84 0.06 0.00 -0.00 0.00 0.00 58.31 59.40 2ouk n LYS 68 Cb 0.42 -1.27 0.22 0.00 -0.00 0.00 0.00 35.03 34.40 2ouk n LYS 68 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 2ouk n ASP 69 N -4.83 3.06 -4.69 -5.58 5.75 -1.26 -4.94 116.55 104.07 2ouk n ASP 69 Ca 0.10 -2.27 -0.42 0.00 -0.01 0.00 0.00 54.79 52.18 2ouk n ASP 69 Cb 0.31 -0.45 -0.03 0.00 -1.03 0.00 0.00 41.12 39.92 2ouk n ASP 69 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2ouk s THR 70 N -1.72 4.21 -0.57 2.12 2.01 0.14 -4.97 115.64 116.86 2ouk s THR 70 Ca 0.31 1.54 -0.26 0.00 0.31 0.00 0.00 61.69 63.59 2ouk s THR 70 Cb 0.20 -3.99 0.04 0.00 0.01 0.00 0.00 72.50 68.75 2ouk s THR 70 CO 0.15 0.00 1.06 0.21 -0.69 0.00 0.00 174.62 175.35 2ouk s ASN 71 N 1.49 6.38 0.37 3.53 3.04 -1.26 -4.88 114.94 123.60 2ouk s ASN 71 Ca 0.57 -0.16 0.10 0.00 0.04 0.00 0.00 52.86 53.40 2ouk s ASN 71 Cb -0.25 -2.49 0.70 0.00 -1.54 0.00 0.00 41.25 37.67 2ouk s ASN 71 CO 0.23 -1.36 1.85 -0.07 -3.04 0.00 0.00 177.10 174.71 2ouk h LEU 72 N 11.45 0.17 -1.04 3.21 3.38 -1.95 -2.67 115.31 127.86 2ouk h LEU 72 Ca -0.26 -0.05 -0.10 0.00 0.09 0.00 0.00 57.88 57.57 2ouk h LEU 72 Cb 1.07 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 2ouk h LEU 72 CO 1.14 0.43 -0.36 0.78 0.09 0.00 0.00 178.44 180.52 2ouk h ASN 73 N 0.16 0.22 -0.33 -0.43 4.21 -1.99 -1.28 115.58 116.14 2ouk h ASN 73 Ca 0.03 -0.08 -0.15 0.00 1.21 0.00 0.00 56.30 57.30 2ouk h ASN 73 Cb 0.53 -0.06 -0.01 0.00 -1.12 0.00 0.00 38.32 37.66 2ouk h ASN 73 CO 0.04 0.57 -0.35 0.50 -1.29 0.00 0.00 177.43 176.90 2ouk h LYS 74 N 0.19 0.87 -0.26 0.81 3.64 -1.89 -2.10 116.57 117.83 2ouk h LYS 74 Ca 0.02 -0.44 -0.06 0.00 -1.27 0.00 0.00 60.65 58.91 2ouk h LYS 74 Cb 0.73 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.55 2ouk h LYS 74 CO 0.06 1.08 -0.06 0.28 -2.27 0.00 0.00 179.45 178.53 2ouk h VAL 75 N 0.72 1.28 -0.94 2.00 2.07 -1.30 -3.01 116.25 117.07 2ouk h VAL 75 Ca 0.07 -1.08 0.02 0.00 0.82 0.00 0.00 66.70 66.54 2ouk h VAL 75 Cb 0.93 1.46 -0.05 0.00 -1.52 0.00 0.00 31.29 32.10 2ouk h VAL 75 CO 0.09 0.34 0.62 0.03 0.02 0.00 0.00 177.57 178.66 2ouk h ARG 76 N 0.25 1.19 0.00 1.57 3.08 -1.20 -1.70 114.38 117.57 2ouk h ARG 76 Ca 0.07 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 2ouk h ARG 76 Cb 0.53 -0.27 -0.00 0.00 0.08 0.00 0.00 29.97 30.31 2ouk h ARG 76 CO 0.03 0.79 -0.04 0.93 -1.07 0.00 0.00 179.97 180.61 2ouk h GLU 77 N 1.23 0.00 -0.01 0.04 5.08 -1.25 -2.04 114.58 117.62 2ouk h GLU 77 Ca 0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 2ouk h GLU 77 Cb -0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.19 2ouk h GLU 77 CO -0.10 0.04 -0.28 0.39 -1.00 0.00 0.00 179.01 178.06 2ouk n GLU 78 N -3.91 1.28 -4.00 2.33 1.02 -0.66 -4.55 120.64 112.15 2ouk n GLU 78 Ca -0.03 -0.94 -0.34 0.00 -0.02 0.00 0.00 57.16 55.84 2ouk n GLU 78 Cb 0.13 -1.48 -0.15 0.00 -0.02 0.00 0.00 31.44 29.92 2ouk n GLU 78 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2ouk s VAL 79 N -2.36 2.71 0.11 2.62 1.01 -0.77 -1.09 120.40 122.63 2ouk s VAL 79 Ca 0.24 -0.89 -0.01 0.00 0.00 0.00 0.00 61.98 61.31 2ouk s VAL 79 Cb 0.19 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 34.25 2ouk s VAL 79 CO 0.49 0.35 0.28 -0.83 0.00 0.00 0.00 175.10 175.39 2ouk s GLY 80 N 1.34 2.13 -0.00 4.51 0.00 0.11 -4.90 107.32 110.52 2ouk s GLY 80 Ca 0.03 -0.77 -0.01 0.00 0.00 0.00 0.00 44.72 43.97 2ouk s GLY 80 CO -0.07 -0.73 0.01 -0.29 0.00 0.00 0.00 173.10 172.02 2ouk s MET 81 N -2.69 0.09 -0.06 2.90 1.75 -1.26 0.36 119.30 120.39 2ouk s MET 81 Ca 0.37 -0.10 0.06 0.00 -1.25 0.00 0.00 55.69 54.77 2ouk s MET 81 Cb -0.12 0.03 -0.01 0.00 2.84 0.00 0.00 34.83 37.57 2ouk s MET 81 CO 0.27 -0.01 -0.24 0.08 -0.65 0.00 0.00 175.02 174.46 2ouk s VAL 82 N -0.30 2.00 0.14 10.11 1.01 0.64 -4.85 120.40 129.15 2ouk s VAL 82 Ca -0.03 -1.03 0.06 0.00 0.00 0.00 0.00 61.98 60.98 2ouk s VAL 82 Cb -0.02 -1.70 -0.04 0.00 0.00 0.00 0.00 36.38 34.62 2ouk s VAL 82 CO -0.00 0.56 -0.01 -0.36 0.00 0.00 0.00 175.10 175.29 2ouk s PHE 83 N -0.07 2.89 0.23 5.22 0.08 -1.26 -1.27 117.98 123.79 2ouk s PHE 83 Ca -0.06 -0.10 -0.07 0.00 0.12 0.00 0.00 56.93 56.82 2ouk s PHE 83 Cb -0.14 -1.44 0.26 0.00 -0.57 0.00 0.00 43.02 41.13 2ouk s PHE 83 CO 0.04 0.49 1.88 0.37 -0.10 0.00 0.00 175.22 177.91 2ouk h GLN 84 N 3.04 1.07 -3.37 0.44 4.15 -1.48 -3.14 115.11 115.82 2ouk h GLN 84 Ca -0.48 -0.06 -0.80 0.00 0.77 0.00 0.00 58.65 58.08 2ouk h GLN 84 Cb 1.19 -0.24 -0.26 0.00 0.21 0.00 0.00 27.48 28.37 2ouk h GLN 84 CO 0.58 0.71 0.76 0.54 -1.93 0.00 0.00 178.83 179.49 2ouk n ARG 85 N -4.53 3.94 -1.74 1.69 5.12 -1.26 -4.62 116.66 115.26 2ouk n ARG 85 Ca 0.11 -4.40 -0.38 0.00 -1.93 0.00 0.00 57.85 51.25 2ouk n ARG 85 Cb 0.08 -2.59 0.05 0.00 -1.16 0.00 0.00 32.46 28.85 2ouk n ARG 85 CO 0.00 0.00 0.00 1.97 -1.93 0.00 0.00 177.63 177.67 2ouk n PHE 86 N 2.39 2.15 -3.80 -1.55 1.16 -1.19 -5.04 117.46 111.59 2ouk n PHE 86 Ca 0.27 0.43 -0.13 0.00 -1.87 0.00 0.00 57.45 56.15 2ouk n PHE 86 Cb 0.37 -2.32 -0.13 0.00 -1.61 0.00 0.00 39.48 35.78 2ouk n PHE 86 CO 0.00 0.00 0.00 1.21 -1.87 0.00 0.00 176.76 176.10 2ouk s ASN 87 N -1.11 -0.17 0.14 5.98 2.47 -1.26 -5.06 114.94 115.93 2ouk s ASN 87 Ca 0.77 0.35 0.02 0.00 0.42 0.00 0.00 52.86 54.41 2ouk s ASN 87 Cb -0.40 0.32 -0.04 0.00 -1.45 0.00 0.00 41.25 39.68 2ouk s ASN 87 CO 0.45 -0.08 -0.03 -0.76 -3.72 0.00 0.00 177.10 172.96 2ouk s LEU 88 N 0.38 2.29 -0.41 3.21 1.43 -1.26 -4.99 118.68 119.32 2ouk s LEU 88 Ca -0.02 -1.10 -0.19 0.00 -1.03 0.00 0.00 54.13 51.79 2ouk s LEU 88 Cb -0.04 -0.08 0.02 0.00 0.03 0.00 0.00 46.19 46.12 2ouk s LEU 88 CO -0.02 -0.51 0.52 -0.36 0.23 0.00 0.00 176.35 176.21 2ouk s PHE 89 N -3.62 3.13 -0.87 0.29 0.08 -1.26 -4.93 117.98 110.80 2ouk s PHE 89 Ca 0.19 -0.16 0.17 0.00 0.12 0.00 0.00 56.93 57.25 2ouk s PHE 89 Cb 0.05 -3.06 0.72 0.00 -0.57 0.00 0.00 43.02 40.17 2ouk s PHE 89 CO 0.01 -0.73 1.54 -0.35 -0.10 0.00 0.00 175.22 175.58 2ouk n PRO 90 N 5.86 0.05 0.21 0.24 -0.04 -1.26 -2.93 135.00 137.12 2ouk n PRO 90 Ca -0.05 0.29 0.08 0.00 -0.04 0.00 0.00 63.50 63.78 2ouk n PRO 90 Cb 0.48 -1.59 0.40 0.00 -0.04 0.00 0.00 33.50 32.75 2ouk n PRO 90 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2ouk h HIS 91 N 0.00 0.00 -3.12 0.54 3.86 -2.00 -3.43 115.15 111.01 2ouk h HIS 91 Ca 0.00 0.00 -0.39 0.00 -1.16 0.00 0.00 60.37 58.82 2ouk h HIS 91 Cb 0.29 0.00 -0.14 0.00 1.06 0.00 0.00 27.41 28.61 2ouk h HIS 91 CO 0.00 0.29 -0.72 0.00 0.86 0.00 0.00 177.93 178.37 2ouk s MET 92 N -3.65 1.23 0.94 2.45 0.23 -1.15 -5.13 119.30 114.21 2ouk s MET 92 Ca 0.00 -1.55 -0.10 0.00 -1.03 0.00 0.00 55.69 53.01 2ouk s MET 92 Cb 0.11 -0.87 0.16 0.00 -1.53 0.00 0.00 34.83 32.70 2ouk s MET 92 CO 0.66 0.11 1.14 0.95 -2.03 0.00 0.00 175.02 175.85 2ouk s THR 93 N -3.16 2.02 0.24 3.16 -4.23 -1.26 -4.29 115.64 108.11 2ouk s THR 93 Ca 0.21 0.01 -0.05 0.00 -1.18 0.00 0.00 61.69 60.67 2ouk s THR 93 Cb 0.01 -2.01 0.20 0.00 1.34 0.00 0.00 72.50 72.05 2ouk s THR 93 CO 0.05 -0.01 1.81 0.58 -0.54 0.00 0.00 174.62 176.51 2ouk h VAL 94 N -1.97 0.93 -0.05 2.29 2.07 -0.69 0.06 116.25 118.89 2ouk h VAL 94 Ca -0.45 -0.27 -0.00 0.00 0.82 0.00 0.00 66.70 66.80 2ouk h VAL 94 Cb 1.28 0.07 -0.00 0.00 -1.52 0.00 0.00 31.29 31.11 2ouk h VAL 94 CO 0.42 0.14 0.03 0.25 0.02 0.00 0.00 177.57 178.43 2ouk h LEU 95 N 0.79 0.06 -1.74 2.57 5.85 -1.51 -2.37 115.31 118.96 2ouk h LEU 95 Ca 0.38 -0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.99 2ouk h LEU 95 Cb 0.32 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.33 2ouk h LEU 95 CO -0.23 0.13 -0.11 0.78 -0.34 0.00 0.00 178.44 178.66 2ouk h ASN 96 N -0.01 0.02 -0.55 1.25 -0.26 -1.69 -0.52 115.58 113.81 2ouk h ASN 96 Ca 0.02 -0.00 -0.05 0.00 -0.56 0.00 0.00 56.30 55.70 2ouk h ASN 96 Cb 0.08 -0.00 -0.03 0.00 -1.06 0.00 0.00 38.32 37.31 2ouk h ASN 96 CO -0.00 0.14 0.17 0.78 -1.06 0.00 0.00 177.43 177.45 2ouk h ASN 97 N 0.02 0.85 -0.03 5.81 2.35 -0.51 -2.17 115.58 121.90 2ouk h ASN 97 Ca 0.00 -0.15 -0.11 0.00 -0.55 0.00 0.00 56.30 55.50 2ouk h ASN 97 Cb 0.22 -0.22 0.01 0.00 0.05 0.00 0.00 38.32 38.37 2ouk h ASN 97 CO 0.02 0.81 -0.41 0.40 -1.65 0.00 0.00 177.43 176.60 2ouk h ILE 98 N 0.88 1.46 0.00 2.81 2.04 -0.70 -3.33 117.51 120.67 2ouk h ILE 98 Ca 0.19 -1.92 0.00 0.00 1.00 0.00 0.00 64.86 64.13 2ouk h ILE 98 Cb 0.29 2.55 0.00 0.00 -0.74 0.00 0.00 36.82 38.91 2ouk h ILE 98 CO -0.00 0.55 0.00 0.35 0.00 0.00 0.00 178.15 179.04 2ouk n THR 99 N -4.37 0.70 -0.10 -0.27 -2.24 -0.39 -4.32 114.28 103.29 2ouk n THR 99 Ca -0.09 -0.08 -0.05 0.00 -2.27 0.00 0.00 64.05 61.55 2ouk n THR 99 Cb 0.57 -0.83 -0.04 0.00 -2.10 0.00 0.00 70.33 67.93 2ouk n THR 99 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2ouk h LEU 100 N 0.00 -0.81 -0.58 3.22 5.85 -1.50 -1.43 115.31 120.05 2ouk h LEU 100 Ca 0.00 0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.81 2ouk h LEU 100 Cb 0.59 0.34 -0.03 0.00 0.37 0.00 0.00 40.66 41.94 2ouk h LEU 100 CO 0.00 -0.14 0.28 0.00 -0.34 0.00 0.00 178.44 178.25 2ouk h ALA 101 N -0.62 0.75 -0.88 1.25 0.00 -1.84 -1.91 119.26 116.01 2ouk h ALA 101 Ca 0.04 -0.13 0.08 0.00 0.00 0.00 0.00 54.91 54.91 2ouk h ALA 101 Cb 0.21 -0.23 -0.07 0.00 0.00 0.00 0.00 17.79 17.70 2ouk h ALA 101 CO -0.30 0.32 0.54 -1.35 0.00 0.00 0.00 179.25 178.45 2ouk h PRO 102 N 0.80 0.90 0.06 0.00 0.11 -1.72 0.11 132.00 132.26 2ouk h PRO 102 Ca 0.20 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.25 2ouk h PRO 102 Cb 0.12 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 31.03 2ouk h PRO 102 CO -0.03 0.59 -0.03 0.52 -0.21 0.00 0.00 178.00 178.85 2ouk h MET 103 N 0.92 -0.08 0.03 1.05 2.86 -1.12 -2.22 114.93 116.37 2ouk h MET 103 Ca 0.41 0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 58.05 2ouk h MET 103 Cb 0.30 0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.98 2ouk h MET 103 CO -0.22 0.50 -0.01 -0.22 1.06 0.00 0.00 176.91 178.02 2ouk h LYS 104 N -0.78 -0.04 0.00 1.72 3.64 -1.25 -1.81 116.57 118.07 2ouk h LYS 104 Ca -0.01 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 2ouk h LYS 104 Cb 0.62 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.44 2ouk h LYS 104 CO 0.01 0.09 -0.11 0.28 -2.27 0.00 0.00 179.45 177.46 2ouk h VAL 105 N -0.16 0.74 -0.02 2.00 2.07 -0.93 -3.36 116.25 116.59 2ouk h VAL 105 Ca -0.00 -1.58 0.00 0.00 0.82 0.00 0.00 66.70 65.93 2ouk h VAL 105 Cb 0.15 1.42 0.00 0.00 -1.52 0.00 0.00 31.29 31.34 2ouk h VAL 105 CO 0.01 0.25 0.00 0.54 0.02 0.00 0.00 177.57 178.39 2ouk n ARG 106 N -4.68 1.25 -3.84 1.57 1.74 -0.86 -4.94 116.66 106.91 2ouk n ARG 106 Ca -0.06 -0.37 -0.29 0.00 -0.77 0.00 0.00 57.85 56.35 2ouk n ARG 106 Cb 0.24 -1.45 0.03 0.00 -1.02 0.00 0.00 32.46 30.26 2ouk n ARG 106 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2ouk n LYS 107 N -0.51 -5.53 -2.92 5.56 4.76 -0.68 -4.95 118.16 113.89 2ouk n LYS 107 Ca 0.20 0.61 -0.36 0.00 -2.87 0.00 0.00 58.31 55.89 2ouk n LYS 107 Cb 0.19 -5.51 -0.06 0.00 -1.84 0.00 0.00 35.03 27.81 2ouk n LYS 107 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 2ouk s TRP 108 N -3.27 3.66 0.49 2.13 0.51 -1.13 -4.99 118.94 116.34 2ouk s TRP 108 Ca 0.64 1.61 -0.21 0.00 -2.12 0.00 0.00 56.10 56.02 2ouk s TRP 108 Cb -0.32 -2.79 -0.07 0.00 -0.81 0.00 0.00 33.47 29.48 2ouk s TRP 108 CO 0.79 0.25 1.12 -2.14 -0.51 0.00 0.00 176.95 176.46 2ouk s PRO 109 N -2.05 3.67 0.24 4.98 0.02 -1.26 -4.50 135.00 136.09 2ouk s PRO 109 Ca 0.47 1.61 -0.09 0.00 0.02 0.00 0.00 61.00 63.01 2ouk s PRO 109 Cb -0.17 -2.22 0.38 0.00 0.02 0.00 0.00 34.50 32.50 2ouk s PRO 109 CO 0.22 -0.59 1.63 -0.09 -0.33 0.00 0.00 177.00 177.84 2ouk h ARG 110 N 1.71 0.06 -0.74 5.54 2.43 -1.98 -0.70 114.38 120.69 2ouk h ARG 110 Ca -0.49 -0.00 0.09 0.00 -0.81 0.00 0.00 59.98 58.76 2ouk h ARG 110 Cb 1.24 -0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 30.71 2ouk h ARG 110 CO 0.59 0.04 0.40 1.49 -1.51 0.00 0.00 179.97 180.98 2ouk h GLU 111 N 0.06 0.66 -0.25 0.20 4.81 -1.99 0.14 114.58 118.22 2ouk h GLU 111 Ca 0.39 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.47 2ouk h GLU 111 Cb 0.65 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 29.88 2ouk h GLU 111 CO -0.69 0.44 -0.26 -0.22 -0.73 0.00 0.00 179.01 177.55 2ouk h LYS 112 N 0.68 0.61 -0.48 1.92 3.64 -1.55 -2.88 116.57 118.52 2ouk h LYS 112 Ca 0.36 -0.33 -0.11 0.00 -1.27 0.00 0.00 60.65 59.30 2ouk h LYS 112 Cb 0.33 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 2ouk h LYS 112 CO -0.24 0.93 -0.12 0.00 -2.27 0.00 0.00 179.45 177.74 2ouk h ALA 113 N 0.68 0.67 -0.13 5.00 0.00 -0.85 -2.97 119.26 121.64 2ouk h ALA 113 Ca 0.04 -0.35 -0.10 0.00 0.00 0.00 0.00 54.91 54.51 2ouk h ALA 113 Cb 0.82 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2ouk h ALA 113 CO 0.06 0.58 -0.35 0.93 0.00 0.00 0.00 179.25 180.47 2ouk h GLU 114 N 0.79 0.27 -0.12 0.00 5.08 -0.77 -0.65 114.58 119.17 2ouk h GLU 114 Ca 0.12 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 2ouk h GLU 114 Cb 0.68 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.91 2ouk h GLU 114 CO 0.05 0.59 -0.00 0.00 -1.00 0.00 0.00 179.01 178.65 2ouk h ALA 115 N 1.41 0.16 -0.69 3.43 0.00 -1.47 0.36 119.26 122.46 2ouk h ALA 115 Ca 0.03 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 2ouk h ALA 115 Cb 0.73 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 2ouk h ALA 115 CO 0.06 -0.15 0.27 0.87 0.00 0.00 0.00 179.25 180.29 2ouk h LYS 116 N -0.06 1.02 -0.24 0.00 1.57 -1.42 -0.01 116.57 117.43 2ouk h LYS 116 Ca 0.03 -0.18 -0.04 0.00 -1.87 0.00 0.00 60.65 58.59 2ouk h LYS 116 Cb 0.36 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 2ouk h LYS 116 CO 0.01 0.84 -0.02 0.00 -0.57 0.00 0.00 179.45 179.71 2ouk h ALA 117 N 1.29 0.33 -0.80 3.86 0.00 -0.89 0.13 119.26 123.17 2ouk h ALA 117 Ca 0.23 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.96 2ouk h ALA 117 Cb 0.20 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.85 2ouk h ALA 117 CO -0.02 0.07 0.50 0.52 0.00 0.00 0.00 179.25 180.33 2ouk h MET 118 N 0.20 0.92 -0.24 0.00 2.86 0.04 0.35 114.93 119.07 2ouk h MET 118 Ca 0.07 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.65 2ouk h MET 118 Cb 0.44 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 31.88 2ouk h MET 118 CO 0.02 0.61 0.13 1.49 1.06 0.00 0.00 176.91 180.22 2ouk h GLU 119 N 0.95 0.34 -0.84 1.72 4.81 -0.74 -0.43 114.58 120.38 2ouk h GLU 119 Ca 0.34 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.50 2ouk h GLU 119 Cb 0.08 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.36 2ouk h GLU 119 CO -0.14 0.31 0.44 -0.07 -0.73 0.00 0.00 179.01 178.82 2ouk h LEU 120 N 0.27 1.07 -1.01 1.64 3.38 0.17 -0.20 115.31 120.63 2ouk h LEU 120 Ca 0.08 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 2ouk h LEU 120 Cb 0.07 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 2ouk h LEU 120 CO -0.01 0.88 0.13 -0.07 0.09 0.00 0.00 178.44 179.46 2ouk h LEU 121 N 1.18 0.79 -0.48 1.67 3.38 0.07 -1.66 115.31 120.25 2ouk h LEU 121 Ca 0.29 -0.14 -0.14 0.00 0.09 0.00 0.00 57.88 57.99 2ouk h LEU 121 Cb 0.07 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 2ouk h LEU 121 CO -0.04 0.77 -0.23 -0.78 0.09 0.00 0.00 178.44 178.25 2ouk h ASP 122 N 0.81 1.03 -0.77 -0.43 3.58 -0.61 0.18 116.42 120.22 2ouk h ASP 122 Ca 0.18 -0.40 0.11 0.00 0.42 0.00 0.00 57.03 57.34 2ouk h ASP 122 Cb 0.30 -0.28 -0.05 0.00 1.72 0.00 0.00 39.33 41.02 2ouk h ASP 122 CO -0.00 1.20 0.50 0.50 -2.88 0.00 0.00 179.24 178.56 2ouk h LYS 123 N 0.86 0.62 -0.73 0.28 3.64 -0.17 -0.97 116.57 120.10 2ouk h LYS 123 Ca 0.11 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 2ouk h LYS 123 Cb 0.82 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.50 2ouk h LYS 123 CO 0.07 0.41 0.00 1.33 -2.27 0.00 0.00 179.45 178.99 2ouk n VAL 124 N -4.50 1.08 -1.82 2.00 0.24 -0.74 -4.97 118.33 109.61 2ouk n VAL 124 Ca 0.13 -1.02 -0.07 0.00 -2.04 0.00 0.00 64.34 61.34 2ouk n VAL 124 Cb 0.37 0.47 -0.01 0.00 -1.47 0.00 0.00 33.84 33.19 2ouk n VAL 124 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2ouk n GLY 125 N 1.59 0.38 0.92 7.63 0.00 -0.37 -4.95 105.19 110.39 2ouk n GLY 125 Ca 0.25 -0.62 0.05 0.00 0.00 0.00 0.00 46.02 45.69 2ouk n GLY 125 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2ouk n LEU 126 N -0.99 1.83 0.28 0.99 4.77 0.57 -4.80 117.00 119.65 2ouk n LEU 126 Ca -0.08 -2.90 0.15 0.00 -0.03 0.00 0.00 56.01 53.14 2ouk n LEU 126 Cb 0.45 -0.28 0.89 0.00 -2.33 0.00 0.00 43.42 42.15 2ouk n LEU 126 CO 0.11 0.92 1.13 0.50 -1.33 0.00 0.00 177.39 178.72 2ouk h LYS 127 N 0.87 0.00 0.00 3.23 3.64 -1.84 0.78 116.57 123.26 2ouk h LYS 127 Ca -0.09 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 2ouk h LYS 127 Cb 1.39 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.21 2ouk h LYS 127 CO 0.04 0.00 0.00 -0.40 -2.27 0.00 0.00 179.45 176.82 2ouk n ASP 128 N -3.89 0.00 -0.71 4.20 5.75 -1.26 -2.89 116.55 117.75 2ouk n ASP 128 Ca -0.02 -0.09 0.10 0.00 -0.01 0.00 0.00 54.79 54.77 2ouk n ASP 128 Cb 0.12 -0.29 0.07 0.00 -1.03 0.00 0.00 41.12 39.98 2ouk n ASP 128 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2ouk n LYS 129 N -1.29 1.67 -0.30 0.11 4.76 0.27 -4.67 118.16 118.71 2ouk n LYS 129 Ca 0.13 -1.51 0.00 0.00 -2.87 0.00 0.00 58.31 54.06 2ouk n LYS 129 Cb 0.22 -1.37 0.07 0.00 -1.84 0.00 0.00 35.03 32.11 2ouk n LYS 129 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2ouk h ALA 130 N 3.71 0.32 -0.46 7.82 0.00 -1.54 0.03 119.26 129.14 2ouk h ALA 130 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2ouk h ALA 130 Cb 0.78 0.77 0.00 0.00 0.00 0.00 0.00 17.79 19.34 2ouk h ALA 130 CO 0.00 -0.52 0.00 0.72 0.00 0.00 0.00 179.25 179.45 2ouk n HIS 131 N -5.50 1.03 -2.90 0.00 8.25 -1.26 -1.43 115.22 113.41 2ouk n HIS 131 Ca 0.10 -0.41 -0.22 0.00 -0.26 0.00 0.00 57.72 56.93 2ouk n HIS 131 Cb 0.41 -0.18 0.02 0.00 1.12 0.00 0.00 29.99 31.36 2ouk n HIS 131 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2ouk s ALA 132 N -1.73 3.88 -0.10 -1.41 0.00 -0.00 -4.85 121.76 117.55 2ouk s ALA 132 Ca 0.36 -1.22 -0.04 0.00 0.00 0.00 0.00 51.96 51.06 2ouk s ALA 132 Cb 0.23 -2.06 -0.04 0.00 0.00 0.00 0.00 23.12 21.25 2ouk s ALA 132 CO 0.17 -0.48 0.07 0.71 0.00 0.00 0.00 175.76 176.23 2ouk s TYR 133 N -2.59 3.36 0.49 0.00 2.02 -1.26 -0.55 117.35 118.82 2ouk s TYR 133 Ca 0.52 0.35 0.37 0.00 -0.37 0.00 0.00 57.07 57.93 2ouk s TYR 133 Cb -0.10 -1.85 1.53 0.00 -0.40 0.00 0.00 41.96 41.13 2ouk s TYR 133 CO 0.37 0.60 1.65 -1.35 -1.57 0.00 0.00 175.55 175.24 2ouk h PRO 134 N 5.03 0.06 0.00 -1.71 0.11 -1.78 -1.52 132.00 132.19 2ouk h PRO 134 Ca -0.53 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.58 2ouk h PRO 134 Cb 1.21 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2ouk h PRO 134 CO 0.56 0.04 0.00 -0.40 -0.21 0.00 0.00 178.00 177.99 2ouk n ASP 135 N -4.36 0.00 -0.86 -2.05 5.75 -1.26 -1.95 116.55 111.81 2ouk n ASP 135 Ca 0.37 -0.07 0.11 0.00 -0.01 0.00 0.00 54.79 55.19 2ouk n ASP 135 Cb 1.55 -0.23 0.09 0.00 -1.03 0.00 0.00 41.12 41.51 2ouk n ASP 135 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 2ouk n SER 136 N -1.23 2.79 -4.85 -1.12 3.41 -0.57 -4.98 113.62 107.08 2ouk n SER 136 Ca 0.09 -1.90 -0.34 0.00 -0.26 0.00 0.00 58.87 56.46 2ouk n SER 136 Cb 0.11 0.01 -0.06 0.00 -0.26 0.00 0.00 64.21 64.02 2ouk n SER 136 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2ouk s LEU 137 N -1.83 4.25 0.62 1.04 1.43 -0.82 -5.09 118.68 118.29 2ouk s LEU 137 Ca 0.25 1.05 -0.09 0.00 -1.03 0.00 0.00 54.13 54.31 2ouk s LEU 137 Cb 0.18 -3.51 -0.00 0.00 0.03 0.00 0.00 46.19 42.89 2ouk s LEU 137 CO 0.28 0.01 0.98 -0.94 0.23 0.00 0.00 176.35 176.90 2ouk s SER 138 N -2.01 5.70 0.28 2.29 1.04 -1.26 -4.75 113.70 114.99 2ouk s SER 138 Ca 0.43 0.98 0.01 0.00 0.48 0.00 0.00 55.95 57.86 2ouk s SER 138 Cb -0.13 -1.95 0.59 0.00 0.10 0.00 0.00 66.02 64.63 2ouk s SER 138 CO 0.20 -1.09 1.78 1.23 0.98 0.00 0.00 173.24 176.34 2ouk h GLY 139 N -0.33 1.55 1.56 7.32 0.00 -1.98 0.22 103.07 111.41 2ouk h GLY 139 Ca -0.45 -0.32 -0.06 0.00 0.00 0.00 0.00 47.33 46.50 2ouk h GLY 139 CO 0.62 -0.00 -0.06 -1.33 0.00 0.00 0.00 176.54 175.77 2ouk h GLY 140 N 0.74 0.58 0.66 4.60 0.00 -1.93 -2.09 103.07 105.63 2ouk h GLY 140 Ca 0.50 -0.38 -0.12 0.00 0.00 0.00 0.00 47.33 47.34 2ouk h GLY 140 CO -0.35 0.35 -0.46 1.46 0.00 0.00 0.00 176.54 177.54 2ouk h GLN 141 N 0.51 0.32 -0.60 4.80 4.20 -1.48 -2.97 115.11 119.89 2ouk h GLN 141 Ca 0.10 -0.34 0.06 0.00 0.06 0.00 0.00 58.65 58.53 2ouk h GLN 141 Cb 0.42 0.10 -0.05 0.00 0.30 0.00 0.00 27.48 28.24 2ouk h GLN 141 CO 0.02 1.03 0.31 0.00 -0.67 0.00 0.00 178.83 179.52 2ouk h ALA 142 N 0.30 0.78 -0.55 3.87 0.00 -0.54 -0.59 119.26 122.52 2ouk h ALA 142 Ca -0.06 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 2ouk h ALA 142 Cb 1.19 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 2ouk h ALA 142 CO 0.09 -0.04 0.14 0.37 0.00 0.00 0.00 179.25 179.81 2ouk h GLN 143 N 0.57 0.89 -0.84 0.00 5.75 -1.47 -0.16 115.11 119.85 2ouk h GLN 143 Ca 0.27 -0.21 0.00 0.00 -0.15 0.00 0.00 58.65 58.56 2ouk h GLN 143 Cb 0.19 -0.12 -0.04 0.00 1.07 0.00 0.00 27.48 28.58 2ouk h GLN 143 CO -0.19 0.83 0.53 0.00 -2.65 0.00 0.00 178.83 177.35 2ouk h ARG 144 N 0.79 1.12 -0.60 1.69 3.08 -1.24 0.25 114.38 119.47 2ouk h ARG 144 Ca 0.17 -0.09 -0.08 0.00 0.07 0.00 0.00 59.98 60.06 2ouk h ARG 144 Cb 0.34 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 2ouk h ARG 144 CO 0.00 0.77 0.05 0.28 -1.07 0.00 0.00 179.97 179.99 2ouk h VAL 145 N 1.15 1.26 -0.74 2.04 2.07 -0.59 -0.66 116.25 120.77 2ouk h VAL 145 Ca 0.30 -1.07 -0.05 0.00 0.82 0.00 0.00 66.70 66.70 2ouk h VAL 145 Cb -0.08 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.40 2ouk h VAL 145 CO -0.06 0.39 0.25 0.00 0.02 0.00 0.00 177.57 178.18 2ouk h ALA 146 N 1.09 1.04 -0.61 1.67 0.00 0.29 0.13 119.26 122.88 2ouk h ALA 146 Ca 0.18 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 2ouk h ALA 146 Cb 0.48 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2ouk h ALA 146 CO 0.02 0.65 0.01 0.82 0.00 0.00 0.00 179.25 180.76 2ouk h ILE 147 N 1.10 1.26 -0.78 0.00 2.04 -0.23 -1.86 117.51 119.04 2ouk h ILE 147 Ca 0.24 -1.13 -0.04 0.00 1.00 0.00 0.00 64.86 64.93 2ouk h ILE 147 Cb 0.27 0.78 -0.03 0.00 -0.74 0.00 0.00 36.82 37.10 2ouk h ILE 147 CO -0.01 0.41 0.32 0.00 0.00 0.00 0.00 178.15 178.87 2ouk h ALA 148 N 1.03 1.01 0.07 1.87 0.00 -0.34 -1.17 119.26 121.74 2ouk h ALA 148 Ca 0.18 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2ouk h ALA 148 Cb 0.54 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2ouk h ALA 148 CO 0.03 0.63 -0.04 -0.09 0.00 0.00 0.00 179.25 179.78 2ouk h ARG 149 N 1.12 -0.10 -0.64 0.00 2.43 -0.50 -0.17 114.38 116.52 2ouk h ARG 149 Ca 0.26 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.44 2ouk h ARG 149 Cb 0.21 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.75 2ouk h ARG 149 CO -0.02 0.01 0.43 0.00 -1.51 0.00 0.00 179.97 178.88 2ouk h ALA 150 N 0.74 1.54 0.00 2.80 0.00 -1.18 -1.60 119.26 121.55 2ouk h ALA 150 Ca -0.01 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 2ouk h ALA 150 Cb 0.15 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2ouk h ALA 150 CO 0.02 0.43 -0.43 -0.07 0.00 0.00 0.00 179.25 179.19 2ouk h LEU 151 N 0.87 0.00 -2.14 0.00 3.38 -0.97 -3.27 115.31 113.19 2ouk h LEU 151 Ca 0.24 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.28 2ouk h LEU 151 Cb -0.10 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2ouk h LEU 151 CO -0.05 0.43 0.25 0.00 0.09 0.00 0.00 178.44 179.16 2ouk h ALA 152 N 1.57 1.97 -0.00 1.53 0.00 0.01 0.24 119.26 124.58 2ouk h ALA 152 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2ouk h ALA 152 Cb 1.05 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2ouk h ALA 152 CO 0.06 -0.39 -0.02 -1.33 0.00 0.00 0.00 179.25 177.57 2ouk n MET 153 N -3.92 1.04 -3.54 0.00 2.81 -1.23 -4.82 117.12 107.46 2ouk n MET 153 Ca 0.03 -0.25 -0.25 0.00 -1.81 0.00 0.00 57.70 55.43 2ouk n MET 153 Cb 0.40 -1.49 0.05 0.00 -0.71 0.00 0.00 33.22 31.46 2ouk n MET 153 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 2ouk n GLU 154 N -0.77 -2.02 -1.70 0.03 1.02 0.86 -4.93 120.64 113.12 2ouk n GLU 154 Ca 0.20 0.61 -0.31 0.00 -0.02 0.00 0.00 57.16 57.65 2ouk n GLU 154 Cb 0.20 -4.82 0.04 0.00 -0.02 0.00 0.00 31.44 26.84 2ouk n GLU 154 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2ouk s PRO 155 N -5.45 3.02 0.00 3.49 0.04 -1.26 -4.95 135.00 129.89 2ouk s PRO 155 Ca 0.41 0.78 0.24 0.00 0.04 0.00 0.00 61.00 62.48 2ouk s PRO 155 Cb -0.11 -2.01 0.31 0.00 0.04 0.00 0.00 34.50 32.73 2ouk s PRO 155 CO 0.81 -0.99 1.29 0.36 0.04 0.00 0.00 177.00 178.51 2ouk n LYS 156 N -3.03 1.20 -3.83 4.56 2.85 -0.25 -4.88 118.16 114.78 2ouk n LYS 156 Ca 0.07 -0.90 -0.13 0.00 -1.05 0.00 0.00 58.31 56.29 2ouk n LYS 156 Cb 0.55 -1.48 -0.15 0.00 -0.65 0.00 0.00 35.03 33.30 2ouk n LYS 156 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 2ouk s ILE 157 N -2.42 -0.02 -0.17 0.58 1.01 -1.13 -4.12 121.20 114.92 2ouk s ILE 157 Ca 0.22 0.08 0.01 0.00 0.00 0.00 0.00 60.65 60.96 2ouk s ILE 157 Cb 0.19 -0.06 0.03 0.00 0.01 0.00 0.00 42.46 42.63 2ouk s ILE 157 CO 0.52 0.03 -0.16 -0.04 0.00 0.00 0.00 174.94 175.30 2ouk s MET 158 N 0.43 2.50 -0.16 2.79 -1.94 -0.85 0.10 119.30 122.18 2ouk s MET 158 Ca -0.04 -0.72 -0.07 0.00 -1.71 0.00 0.00 55.69 53.16 2ouk s MET 158 Cb -0.05 -2.34 -0.04 0.00 2.01 0.00 0.00 34.83 34.41 2ouk s MET 158 CO -0.01 -0.26 0.09 -0.51 -0.01 0.00 0.00 175.02 174.31 2ouk s LEU 159 N 1.39 4.01 -0.18 -0.03 1.43 0.16 -2.18 118.68 123.27 2ouk s LEU 159 Ca 0.04 0.22 0.01 0.00 -1.03 0.00 0.00 54.13 53.37 2ouk s LEU 159 Cb -0.14 -1.99 0.03 0.00 0.03 0.00 0.00 46.19 44.12 2ouk s LEU 159 CO -0.11 0.27 -0.13 -0.36 0.23 0.00 0.00 176.35 176.25 2ouk s PHE 160 N -0.18 2.45 -0.84 0.29 0.08 -0.31 -0.26 117.98 119.21 2ouk s PHE 160 Ca 0.09 -1.53 -0.10 0.00 0.12 0.00 0.00 56.93 55.50 2ouk s PHE 160 Cb -0.12 -1.69 0.22 0.00 -0.57 0.00 0.00 43.02 40.86 2ouk s PHE 160 CO 0.01 -0.74 0.76 0.34 -0.10 0.00 0.00 175.22 175.49 2ouk s ASP 161 N 1.39 6.47 -1.06 1.36 -1.08 -0.40 -0.56 116.67 122.80 2ouk s ASP 161 Ca 0.01 -2.96 -0.19 0.00 -0.52 0.00 0.00 52.55 48.89 2ouk s ASP 161 Cb -0.15 -2.11 0.01 0.00 -1.46 0.00 0.00 42.92 39.21 2ouk s ASP 161 CO -0.09 -0.45 0.71 -0.62 0.52 0.00 0.00 175.17 175.24 2ouk n GLU 162 N 3.52 -1.00 0.29 4.34 1.02 0.10 -1.93 120.64 126.98 2ouk n GLU 162 Ca 0.15 0.50 0.14 0.00 -0.02 0.00 0.00 57.16 57.93 2ouk n GLU 162 Cb 0.43 -3.37 0.88 0.00 -0.02 0.00 0.00 31.44 29.36 2ouk n GLU 162 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2ouk h PRO 163 N -1.55 0.00 -0.26 3.49 0.13 -1.83 -3.08 132.00 128.89 2ouk h PRO 163 Ca -0.62 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.51 2ouk h PRO 163 Cb 1.35 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.48 2ouk h PRO 163 CO 0.45 0.03 0.00 0.25 -0.23 0.00 0.00 178.00 178.50 2ouk n THR 164 N -3.82 0.85 0.89 1.56 -2.24 -1.26 -4.67 114.28 105.60 2ouk n THR 164 Ca -0.03 -0.93 0.08 0.00 -2.27 0.00 0.00 64.05 60.91 2ouk n THR 164 Cb 0.11 0.60 0.45 0.00 -2.10 0.00 0.00 70.33 69.40 2ouk n THR 164 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2ouk n SER 165 N 0.41 0.00 0.00 3.42 7.64 -1.16 -2.59 113.62 121.34 2ouk n SER 165 Ca 0.10 -0.17 0.00 0.00 1.01 0.00 0.00 58.87 59.81 2ouk n SER 165 Cb 0.38 -0.18 0.00 0.00 -1.01 0.00 0.00 64.21 63.40 2ouk n SER 165 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ouk n ALA 166 N -1.18 2.20 -2.70 -0.43 0.00 -1.26 -5.03 120.51 112.10 2ouk n ALA 166 Ca 0.10 -0.58 -0.35 0.00 0.00 0.00 0.00 53.44 52.60 2ouk n ALA 166 Cb 0.11 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.50 2ouk n ALA 166 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2ouk s LEU 167 N -0.22 4.39 0.63 0.00 1.43 -1.07 -5.07 118.68 118.77 2ouk s LEU 167 Ca 0.00 0.66 -0.18 0.00 -1.03 0.00 0.00 54.13 53.58 2ouk s LEU 167 Cb 0.00 -2.63 -0.02 0.00 0.03 0.00 0.00 46.19 43.57 2ouk s LEU 167 CO 0.00 0.27 1.20 -1.81 0.23 0.00 0.00 176.35 176.24 2ouk s ASP 168 N -1.51 4.98 0.29 2.29 1.01 -1.26 -4.68 116.67 117.78 2ouk s ASP 168 Ca 0.26 2.35 -0.05 0.00 0.71 0.00 0.00 52.55 55.82 2ouk s ASP 168 Cb -0.14 -2.59 0.56 0.00 1.01 0.00 0.00 42.92 41.76 2ouk s ASP 168 CO 0.14 -1.73 1.55 -2.65 0.21 0.00 0.00 175.17 172.69 2ouk n PRO 169 N -1.89 -0.09 0.26 8.23 -0.02 -1.26 -0.32 135.00 139.92 2ouk n PRO 169 Ca 0.13 1.53 0.10 0.00 -2.02 0.00 0.00 63.50 63.24 2ouk n PRO 169 Cb 0.50 -2.33 0.70 0.00 -0.02 0.00 0.00 33.50 32.35 2ouk n PRO 169 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 2ouk h GLU 170 N 0.00 0.00 0.00 -0.52 4.11 -2.03 -2.68 114.58 113.46 2ouk h GLU 170 Ca 0.52 0.00 -0.14 0.00 0.07 0.00 0.00 59.36 59.81 2ouk h GLU 170 Cb 0.90 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.12 2ouk h GLU 170 CO -1.00 0.05 -1.19 0.52 0.07 0.00 0.00 179.01 177.46 2ouk h MET 171 N 0.00 0.00 -0.67 1.06 2.86 -1.01 -3.38 114.93 113.79 2ouk h MET 171 Ca -0.00 0.00 0.09 0.00 -2.06 0.00 0.00 59.70 57.73 2ouk h MET 171 Cb 0.09 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 31.68 2ouk h MET 171 CO 0.01 0.31 0.32 0.28 1.06 0.00 0.00 176.91 178.89 2ouk h VAL 172 N 0.00 0.83 -0.98 -2.22 2.07 -1.09 -2.97 116.25 111.89 2ouk h VAL 172 Ca -0.12 -0.19 0.15 0.00 0.82 0.00 0.00 66.70 67.37 2ouk h VAL 172 Cb 1.50 0.24 -0.09 0.00 -1.52 0.00 0.00 31.29 31.42 2ouk h VAL 172 CO 0.05 0.10 0.62 1.23 0.02 0.00 0.00 177.57 179.58 2ouk h GLY 173 N 0.55 1.59 2.00 2.17 0.00 -1.74 -2.12 103.07 105.52 2ouk h GLY 173 Ca 0.33 -0.37 -0.08 0.00 0.00 0.00 0.00 47.33 47.21 2ouk h GLY 173 CO -0.27 0.06 -0.40 1.05 0.00 0.00 0.00 176.54 176.98 2ouk h GLU 174 N 0.84 0.00 0.03 4.80 4.11 -1.78 -2.26 114.58 120.32 2ouk h GLU 174 Ca 0.52 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.95 2ouk h GLU 174 Cb 0.71 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.96 2ouk h GLU 174 CO -0.29 0.40 -0.01 0.28 0.07 0.00 0.00 179.01 179.45 2ouk h VAL 175 N 0.00 1.31 -0.90 -1.06 2.07 -1.49 -3.09 116.25 113.09 2ouk h VAL 175 Ca -0.00 -1.78 0.18 0.00 0.82 0.00 0.00 66.70 65.91 2ouk h VAL 175 Cb 0.81 2.38 -0.07 0.00 -1.52 0.00 0.00 31.29 32.89 2ouk h VAL 175 CO 0.05 0.41 0.58 -0.07 0.02 0.00 0.00 177.57 178.57 2ouk h LEU 176 N -0.91 0.51 -0.45 2.57 3.38 -1.48 -0.35 115.31 118.58 2ouk h LEU 176 Ca -0.00 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2ouk h LEU 176 Cb 0.70 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 2ouk h LEU 176 CO 0.01 0.22 0.24 -1.28 0.09 0.00 0.00 178.44 177.72 2ouk h SER 177 N 0.52 0.56 0.17 -0.43 0.87 -1.44 0.26 113.55 114.06 2ouk h SER 177 Ca 0.47 -0.10 -0.14 0.00 -1.23 0.00 0.00 61.79 60.79 2ouk h SER 177 Cb 0.99 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.80 2ouk h SER 177 CO -0.20 0.50 -0.50 -0.37 -0.53 0.00 0.00 176.83 175.72 2ouk h VAL 178 N 0.59 1.33 -0.71 2.23 -1.51 -1.04 -0.86 116.25 116.29 2ouk h VAL 178 Ca 0.16 -1.74 -0.06 0.00 -1.23 0.00 0.00 66.70 63.83 2ouk h VAL 178 Cb 0.06 1.78 -0.03 0.00 -2.13 0.00 0.00 31.29 30.97 2ouk h VAL 178 CO -0.02 0.53 0.22 0.24 -1.23 0.00 0.00 177.57 177.31 2ouk h MET 179 N 0.30 1.09 -0.61 5.19 2.07 -0.75 0.66 114.93 122.89 2ouk h MET 179 Ca 0.01 -0.23 -0.05 0.00 -2.07 0.00 0.00 59.70 57.36 2ouk h MET 179 Cb 0.99 -0.16 -0.03 0.00 -1.87 0.00 0.00 31.60 30.54 2ouk h MET 179 CO 0.09 0.94 0.18 -0.22 1.07 0.00 0.00 176.91 178.96 2ouk h LYS 180 N 1.04 0.96 -0.72 1.72 3.64 -0.23 -1.25 116.57 121.73 2ouk h LYS 180 Ca 0.23 -0.21 -0.04 0.00 -1.27 0.00 0.00 60.65 59.35 2ouk h LYS 180 Cb 0.30 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 31.95 2ouk h LYS 180 CO -0.01 0.86 0.29 0.37 -2.27 0.00 0.00 179.45 178.69 2ouk h GLN 181 N 0.88 1.07 -0.35 1.90 4.15 -0.64 -1.81 115.11 120.30 2ouk h GLN 181 Ca 0.19 -0.19 -0.07 0.00 0.77 0.00 0.00 58.65 59.35 2ouk h GLN 181 Cb 0.31 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 27.81 2ouk h GLN 181 CO -0.00 0.87 -0.08 1.25 -1.93 0.00 0.00 178.83 178.94 2ouk h LEU 182 N 1.02 0.57 -0.75 -2.39 5.85 -0.54 -2.09 115.31 116.98 2ouk h LEU 182 Ca 0.24 -0.14 -0.12 0.00 0.84 0.00 0.00 57.88 58.70 2ouk h LEU 182 Cb 0.20 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 2ouk h LEU 182 CO -0.02 0.70 -0.32 0.00 -0.34 0.00 0.00 178.44 178.46 2ouk h ALA 183 N 1.36 0.92 0.00 1.25 0.00 -0.75 -2.64 119.26 119.40 2ouk h ALA 183 Ca 0.10 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 2ouk h ALA 183 Cb 0.48 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 2ouk h ALA 183 CO 0.03 0.62 -0.15 -0.91 0.00 0.00 0.00 179.25 178.83 2ouk h ASN 184 N 0.50 0.00 0.27 0.00 2.35 -0.93 -2.46 115.58 115.32 2ouk h ASN 184 Ca 0.06 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 2ouk h ASN 184 Cb 0.80 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.17 2ouk h ASN 184 CO 0.07 0.15 0.00 -0.62 -1.65 0.00 0.00 177.43 175.38 2ouk n GLU 185 N -3.24 0.67 -0.40 0.81 1.02 -0.82 -4.90 120.64 113.77 2ouk n GLU 185 Ca 0.01 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 2ouk n GLU 185 Cb 0.44 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.36 2ouk n GLU 185 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ouk n GLY 186 N 1.01 0.77 3.72 0.62 0.00 -0.92 -5.07 105.19 105.32 2ouk n GLY 186 Ca 0.18 -0.29 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 2ouk n GLY 186 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2ouk s MET 187 N -0.73 4.50 0.00 1.61 0.00 -1.16 -3.97 119.30 119.56 2ouk s MET 187 Ca 0.00 1.75 -0.30 0.00 0.00 0.00 0.00 55.69 57.14 2ouk s MET 187 Cb 0.00 -3.31 -0.06 0.00 0.00 0.00 0.00 34.83 31.46 2ouk s MET 187 CO 0.00 -0.11 1.44 0.99 0.00 0.00 0.00 175.02 177.34 2ouk s THR 188 N 0.46 3.62 0.01 10.11 2.01 -1.26 -4.52 115.64 126.08 2ouk s THR 188 Ca 0.54 1.00 0.02 0.00 0.31 0.00 0.00 61.69 63.57 2ouk s THR 188 Cb -0.29 -3.65 -0.01 0.00 0.01 0.00 0.00 72.50 68.56 2ouk s THR 188 CO 0.32 -0.01 -0.08 -0.04 -0.69 0.00 0.00 174.62 174.13 2ouk s MET 189 N 2.52 0.57 -0.24 4.92 1.00 -0.32 -2.00 119.30 125.75 2ouk s MET 189 Ca 0.65 -0.44 0.01 0.00 0.00 0.00 0.00 55.69 55.91 2ouk s MET 189 Cb -0.32 -0.50 0.06 0.00 0.00 0.00 0.00 34.83 34.07 2ouk s MET 189 CO 0.27 0.13 -0.06 0.08 0.00 0.00 0.00 175.02 175.43 2ouk s VAL 190 N -0.57 1.60 -0.26 -6.03 1.01 -0.93 0.15 120.40 115.37 2ouk s VAL 190 Ca -0.01 -1.25 -0.01 0.00 0.00 0.00 0.00 61.98 60.70 2ouk s VAL 190 Cb -0.05 -1.84 0.03 0.00 0.00 0.00 0.00 36.38 34.52 2ouk s VAL 190 CO 0.00 -0.08 -0.06 -0.69 0.00 0.00 0.00 175.10 174.28 2ouk s VAL 191 N 1.36 2.81 -0.41 2.92 1.01 0.15 -1.16 120.40 127.08 2ouk s VAL 191 Ca -0.06 -1.16 -0.24 0.00 0.00 0.00 0.00 61.98 60.52 2ouk s VAL 191 Cb -0.19 -2.48 0.02 0.00 0.00 0.00 0.00 36.38 33.73 2ouk s VAL 191 CO -0.06 0.12 0.82 -0.69 0.00 0.00 0.00 175.10 175.29 2ouk s VAL 192 N 1.29 4.64 0.14 2.92 1.01 0.28 -0.09 120.40 130.58 2ouk s VAL 192 Ca -0.02 0.74 -0.12 0.00 0.00 0.00 0.00 61.98 62.58 2ouk s VAL 192 Cb -0.18 -4.30 0.01 0.00 0.00 0.00 0.00 36.38 31.92 2ouk s VAL 192 CO -0.04 -0.61 0.33 0.28 0.00 0.00 0.00 175.10 175.06 2ouk s THR 193 N 3.32 0.08 -1.20 3.92 -1.32 -1.10 0.02 115.64 119.35 2ouk s THR 193 Ca 0.33 -1.00 0.11 0.00 -1.21 0.00 0.00 61.69 59.92 2ouk s THR 193 Cb -0.12 -1.46 0.05 0.00 -1.51 0.00 0.00 72.50 69.46 2ouk s THR 193 CO 0.21 -0.37 0.77 1.41 -2.21 0.00 0.00 174.62 174.42 2ouk n HIS 194 N -0.19 0.00 -2.68 9.09 8.25 -1.26 -4.47 115.22 123.95 2ouk n HIS 194 Ca -0.12 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 56.91 2ouk n HIS 194 Cb 0.63 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.73 2ouk n HIS 194 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2ouk s GLU 195 N -1.11 3.83 0.57 -0.41 0.41 -1.26 -4.80 118.70 115.95 2ouk s GLU 195 Ca 0.11 -1.80 0.27 0.00 -0.41 0.00 0.00 54.97 53.15 2ouk s GLU 195 Cb 0.09 -5.33 1.57 0.00 -1.78 0.00 0.00 34.13 28.68 2ouk s GLU 195 CO 0.19 -2.10 2.07 0.52 -0.49 0.00 0.00 175.26 175.44 2ouk h MET 196 N 8.35 0.00 -0.12 1.61 2.86 -1.99 -0.88 114.93 124.75 2ouk h MET 196 Ca 0.31 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.94 2ouk h MET 196 Cb 0.93 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.59 2ouk h MET 196 CO 1.37 0.00 0.03 0.78 1.06 0.00 0.00 176.91 180.15 2ouk h GLY 197 N 0.00 0.22 0.93 8.32 0.00 -2.00 -0.70 103.07 109.84 2ouk h GLY 197 Ca 0.12 -0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.30 2ouk h GLY 197 CO -0.00 0.13 -0.10 -2.75 0.00 0.00 0.00 176.54 173.82 2ouk h PHE 198 N -0.00 -0.26 -0.63 5.60 3.57 -1.61 -0.58 116.94 123.03 2ouk h PHE 198 Ca 0.04 -0.01 0.13 0.00 3.53 0.00 0.00 57.97 61.66 2ouk h PHE 198 Cb 0.26 0.09 -0.11 0.00 2.79 0.00 0.00 35.95 38.98 2ouk h PHE 198 CO 0.01 -0.10 -0.00 0.00 -2.23 0.00 0.00 178.31 175.98 2ouk h ALA 199 N 0.42 0.61 0.08 2.41 0.00 -1.24 0.53 119.26 122.07 2ouk h ALA 199 Ca -0.03 0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 2ouk h ALA 199 Cb 0.27 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2ouk h ALA 199 CO 0.05 -0.39 -0.04 -0.09 0.00 0.00 0.00 179.25 178.78 2ouk h ARG 200 N 0.11 -0.10 -0.49 0.00 2.43 -0.97 0.14 114.38 115.50 2ouk h ARG 200 Ca 0.33 0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.41 2ouk h ARG 200 Cb 0.53 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.09 2ouk h ARG 200 CO -0.54 0.28 -0.09 1.49 -1.51 0.00 0.00 179.97 179.60 2ouk h GLU 201 N -0.49 0.88 0.00 0.20 4.81 -0.57 -3.38 114.58 116.03 2ouk h GLU 201 Ca -0.01 -0.29 -0.13 0.00 -0.13 0.00 0.00 59.36 58.79 2ouk h GLU 201 Cb 0.42 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.70 2ouk h GLU 201 CO 0.02 0.93 -1.64 0.28 -0.73 0.00 0.00 179.01 177.86 2ouk n VAL 202 N -4.16 0.50 -2.23 0.32 0.31 0.18 -5.03 118.33 108.22 2ouk n VAL 202 Ca 0.02 -0.38 -0.39 0.00 -0.01 0.00 0.00 64.34 63.58 2ouk n VAL 202 Cb 0.37 -0.46 -0.02 0.00 -0.91 0.00 0.00 33.84 32.82 2ouk n VAL 202 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2ouk s GLY 203 N -3.98 2.91 -0.10 2.92 0.00 0.04 -4.86 107.32 104.26 2ouk s GLY 203 Ca -0.05 1.06 0.04 0.00 0.00 0.00 0.00 44.72 45.77 2ouk s GLY 203 CO 0.43 1.61 0.46 1.22 0.00 0.00 0.00 173.10 176.82 2ouk n ASP 204 N 0.27 1.40 -3.96 1.64 8.00 -0.24 -4.63 116.55 119.03 2ouk n ASP 204 Ca 0.03 0.28 -0.09 0.00 0.71 0.00 0.00 54.79 55.72 2ouk n ASP 204 Cb 0.45 -0.35 -0.10 0.00 -0.02 0.00 0.00 41.12 41.10 2ouk n ASP 204 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2ouk s ARG 205 N -2.57 0.56 -0.03 -1.24 3.52 -1.14 -4.34 118.95 113.72 2ouk s ARG 205 Ca -0.14 -0.81 0.02 0.00 -0.13 0.00 0.00 55.73 54.68 2ouk s ARG 205 Cb 0.07 0.22 0.01 0.00 -1.56 0.00 0.00 34.95 33.69 2ouk s ARG 205 CO 0.79 -0.13 -0.09 0.08 -0.81 0.00 0.00 175.30 175.14 2ouk s VAL 206 N -2.69 0.81 -0.20 7.11 1.01 -0.66 -1.58 120.40 124.19 2ouk s VAL 206 Ca -0.04 -0.35 -0.02 0.00 0.00 0.00 0.00 61.98 61.58 2ouk s VAL 206 Cb -0.01 -0.74 0.01 0.00 0.00 0.00 0.00 36.38 35.64 2ouk s VAL 206 CO -0.05 0.26 -0.11 -0.76 0.00 0.00 0.00 175.10 174.44 2ouk s LEU 207 N 0.38 2.56 -0.34 3.92 1.02 0.61 -3.31 118.68 123.53 2ouk s LEU 207 Ca -0.06 -0.53 -0.16 0.00 0.02 0.00 0.00 54.13 53.39 2ouk s LEU 207 Cb -0.11 -1.62 -0.01 0.00 0.02 0.00 0.00 46.19 44.47 2ouk s LEU 207 CO 0.01 -0.02 0.43 0.12 0.02 0.00 0.00 176.35 176.92 2ouk s PHE 208 N 1.39 3.20 0.14 0.29 5.36 -0.36 -0.75 117.98 127.25 2ouk s PHE 208 Ca 0.05 0.13 0.06 0.00 -0.96 0.00 0.00 56.93 56.21 2ouk s PHE 208 Cb -0.14 -2.77 -0.04 0.00 -0.34 0.00 0.00 43.02 39.73 2ouk s PHE 208 CO -0.08 -0.45 0.04 -1.64 -1.46 0.00 0.00 175.22 171.63 2ouk s MET 209 N 2.19 2.60 -0.30 10.12 -1.94 -0.48 -0.25 119.30 131.24 2ouk s MET 209 Ca 0.15 -0.95 -0.18 0.00 -1.71 0.00 0.00 55.69 53.01 2ouk s MET 209 Cb -0.16 -2.50 0.21 0.00 2.01 0.00 0.00 34.83 34.38 2ouk s MET 209 CO 0.12 0.49 1.29 0.34 -0.01 0.00 0.00 175.02 177.25 2ouk s ASP 210 N -2.78 -0.04 0.00 3.03 2.15 -0.74 -4.20 116.67 114.08 2ouk s ASP 210 Ca 0.28 0.05 0.00 0.00 0.43 0.00 0.00 52.55 53.31 2ouk s ASP 210 Cb -0.10 1.03 0.00 0.00 -0.30 0.00 0.00 42.92 43.54 2ouk s ASP 210 CO 0.20 -0.01 0.00 0.61 -0.17 0.00 0.00 175.17 175.80 2ouk n GLY 211 N 3.67 0.39 1.60 2.66 0.00 -1.26 -3.65 105.19 108.60 2ouk n GLY 211 Ca -0.13 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.82 2ouk n GLY 211 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ouk n GLY 212 N -2.89 0.75 3.46 -0.02 0.00 -0.77 -4.74 105.19 100.98 2ouk n GLY 212 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2ouk n GLY 212 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2ouk s TYR 213 N -2.68 0.77 -0.08 1.61 -0.85 -1.24 -0.03 117.35 114.86 2ouk s TYR 213 Ca 0.00 -1.06 -0.22 0.00 -0.52 0.00 0.00 57.07 55.27 2ouk s TYR 213 Cb 0.00 -0.08 -0.04 0.00 0.38 0.00 0.00 41.96 42.22 2ouk s TYR 213 CO 0.00 -0.95 0.65 0.42 -1.52 0.00 0.00 175.55 174.16 2ouk s ILE 214 N -3.78 5.08 -0.20 -3.49 1.01 -1.26 -1.80 121.20 116.76 2ouk s ILE 214 Ca 0.29 1.34 0.08 0.00 0.00 0.00 0.00 60.65 62.36 2ouk s ILE 214 Cb 0.01 -3.99 -0.22 0.00 0.01 0.00 0.00 42.46 38.27 2ouk s ILE 214 CO 0.13 0.27 0.05 -0.38 0.00 0.00 0.00 174.94 175.01 2ouk n ILE 215 N 3.75 1.50 -3.56 2.92 -0.00 0.65 -4.99 119.36 119.63 2ouk n ILE 215 Ca -0.02 -0.71 -0.17 0.00 -0.00 0.00 0.00 62.75 61.84 2ouk n ILE 215 Cb 0.51 -1.06 -0.06 0.00 -0.00 0.00 0.00 39.64 39.03 2ouk n ILE 215 CO 0.00 0.00 0.00 -0.70 -0.00 0.00 0.00 176.55 175.85 2ouk s GLU 216 N -2.52 0.99 0.00 0.38 2.12 -1.23 -4.92 118.70 113.51 2ouk s GLU 216 Ca -0.21 0.38 0.00 0.00 0.36 0.00 0.00 54.97 55.50 2ouk s GLU 216 Cb 0.07 0.47 0.00 0.00 0.26 0.00 0.00 34.13 34.93 2ouk s GLU 216 CO 0.73 -0.27 0.00 0.39 -0.54 0.00 0.00 175.26 175.57 2ouk n GLU 217 N 1.30 0.94 0.00 4.30 1.02 -1.26 -1.23 120.64 125.72 2ouk n GLU 217 Ca -0.18 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.96 2ouk n GLU 217 Cb 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.99 2ouk n GLU 217 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ouk n GLY 218 N 2.00 2.63 3.65 0.62 0.00 -1.21 -4.70 105.19 108.19 2ouk n GLY 218 Ca 0.00 -2.09 -0.31 0.00 0.00 0.00 0.00 46.02 43.62 2ouk n GLY 218 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ouk n LYS 219 N -1.14 -0.54 -0.14 1.61 5.02 -1.26 -1.65 118.16 120.06 2ouk n LYS 219 Ca 0.00 -0.09 -0.06 0.00 -2.02 0.00 0.00 58.31 56.14 2ouk n LYS 219 Cb 0.00 -2.34 0.03 0.00 -0.02 0.00 0.00 35.03 32.70 2ouk n LYS 219 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 2ouk h PRO 220 N -1.92 0.45 0.32 1.97 0.11 -1.82 -0.74 132.00 130.37 2ouk h PRO 220 Ca -0.44 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2ouk h PRO 220 Cb 1.27 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 32.25 2ouk h PRO 220 CO 0.41 0.30 -0.40 0.93 -0.21 0.00 0.00 178.00 179.03 2ouk h GLU 221 N 0.47 -0.73 -0.06 1.05 4.39 -1.91 -1.26 114.58 116.52 2ouk h GLU 221 Ca 0.19 0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.95 2ouk h GLU 221 Cb 0.09 0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.90 2ouk h GLU 221 CO -0.13 -0.49 0.02 -0.44 -1.16 0.00 0.00 179.01 176.82 2ouk h ASP 222 N -0.76 0.03 0.36 1.42 3.32 -1.88 0.30 116.42 119.21 2ouk h ASP 222 Ca -0.02 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.97 2ouk h ASP 222 Cb 0.71 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.25 2ouk h ASP 222 CO -0.11 0.03 -0.31 0.25 -1.72 0.00 0.00 179.24 177.38 2ouk h LEU 223 N 0.06 0.00 0.01 1.55 6.46 -1.10 0.30 115.31 122.59 2ouk h LEU 223 Ca 0.03 0.00 -0.16 0.00 -0.12 0.00 0.00 57.88 57.62 2ouk h LEU 223 Cb 0.01 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 39.92 2ouk h LEU 223 CO -0.02 0.31 -0.89 -0.26 -0.62 0.00 0.00 178.44 176.95 2ouk h PHE 224 N 0.00 0.03 0.04 1.25 0.04 -1.08 -3.33 116.94 113.89 2ouk h PHE 224 Ca -0.00 -0.02 -0.28 0.00 2.80 0.00 0.00 57.97 60.46 2ouk h PHE 224 Cb 0.57 -0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.68 2ouk h PHE 224 CO 0.00 1.35 -1.53 -0.44 -0.60 0.00 0.00 178.31 177.09 2ouk h ASP 225 N -0.95 0.12 -2.28 2.17 3.32 -1.00 -3.40 116.42 114.40 2ouk h ASP 225 Ca -0.24 -0.19 -0.59 0.00 0.02 0.00 0.00 57.03 56.03 2ouk h ASP 225 Cb 1.25 -0.04 -0.42 0.00 0.22 0.00 0.00 39.33 40.34 2ouk h ASP 225 CO -0.13 1.17 -0.64 0.54 -1.72 0.00 0.00 179.24 178.46 2ouk n ARG 226 N -3.24 3.19 -2.39 3.56 1.74 0.11 -5.05 116.66 114.58 2ouk n ARG 226 Ca -0.14 -4.85 -0.43 0.00 -0.77 0.00 0.00 57.85 51.66 2ouk n ARG 226 Cb 1.02 -2.24 -0.02 0.00 -1.02 0.00 0.00 32.46 30.20 2ouk n ARG 226 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2ouk s PRO 227 N -3.40 4.28 -0.03 5.56 0.04 -1.19 -4.50 135.00 135.75 2ouk s PRO 227 Ca 0.48 1.73 -0.10 0.00 0.04 0.00 0.00 61.00 63.15 2ouk s PRO 227 Cb 0.27 -3.68 -0.31 0.00 0.04 0.00 0.00 34.50 30.82 2ouk s PRO 227 CO -0.13 -0.61 0.72 1.96 0.04 0.00 0.00 177.00 178.98 2ouk h GLN 228 N 7.98 0.38 -6.79 4.56 1.08 -1.89 -3.46 115.11 116.97 2ouk h GLN 228 Ca -0.31 -0.65 -0.48 0.00 -1.45 0.00 0.00 58.65 55.76 2ouk h GLN 228 Cb 1.14 0.24 0.03 0.00 -0.05 0.00 0.00 27.48 28.83 2ouk h GLN 228 CO 0.93 1.29 0.00 -1.01 -0.95 0.00 0.00 178.83 179.10 2ouk s HIS 229 N -2.59 3.51 0.00 2.96 3.76 -1.26 -5.02 115.29 116.65 2ouk s HIS 229 Ca -0.14 0.62 0.00 0.00 -0.15 0.00 0.00 55.06 55.39 2ouk s HIS 229 Cb 0.06 -2.19 0.00 0.00 1.11 0.00 0.00 32.58 31.55 2ouk s HIS 229 CO 0.86 -0.18 0.87 0.39 -0.85 0.00 0.00 174.74 175.83 2ouk n GLU 230 N -2.11 0.00 -0.30 1.40 -0.58 -1.26 -2.67 120.64 115.11 2ouk n GLU 230 Ca -0.01 0.54 0.15 0.00 -0.42 0.00 0.00 57.16 57.42 2ouk n GLU 230 Cb 0.56 -1.37 0.32 0.00 -0.57 0.00 0.00 31.44 30.38 2ouk n GLU 230 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2ouk h ARG 231 N 0.00 0.23 -0.85 3.49 3.08 -1.96 0.92 114.38 119.29 2ouk h ARG 231 Ca 0.00 -0.01 0.18 0.00 0.07 0.00 0.00 59.98 60.21 2ouk h ARG 231 Cb 0.00 -0.05 -0.06 0.00 0.08 0.00 0.00 29.97 29.94 2ouk h ARG 231 CO 0.00 0.16 0.56 1.15 -1.07 0.00 0.00 179.97 180.77 2ouk h THR 232 N 0.24 0.74 0.17 2.04 2.02 -1.94 0.49 112.91 116.68 2ouk h THR 232 Ca 0.58 -0.15 -0.32 0.00 0.77 0.00 0.00 66.41 67.29 2ouk h THR 232 Cb 1.19 0.25 0.03 0.00 -1.74 0.00 0.00 68.15 67.88 2ouk h THR 232 CO -0.64 0.08 -1.34 0.11 0.37 0.00 0.00 175.52 174.10 2ouk h LYS 233 N 0.45 0.60 -1.07 6.66 1.57 0.91 -3.22 116.57 122.47 2ouk h LYS 233 Ca 0.43 -0.88 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 2ouk h LYS 233 Cb 1.00 0.30 0.00 0.00 0.08 0.00 0.00 32.23 33.61 2ouk h LYS 233 CO -0.16 1.41 0.00 0.00 -0.57 0.00 0.00 179.45 180.13 2ouk n ALA 234 N -2.70 2.36 0.05 3.86 0.00 0.16 -3.01 120.51 121.23 2ouk n ALA 234 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.29 2ouk n ALA 234 Cb 1.04 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.49 2ouk n ALA 234 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2ouk n PHE 235 N 0.45 -0.68 0.50 0.00 -0.00 -0.30 -4.36 117.46 113.07 2ouk n PHE 235 Ca 0.00 0.12 0.05 0.00 -0.00 0.00 0.00 57.45 57.62 2ouk n PHE 235 Cb 0.39 0.33 0.26 0.00 -0.00 0.00 0.00 39.48 40.46 2ouk n PHE 235 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.76 176.65 2ouk n LEU 236 N -3.04 0.00 -2.73 -2.13 7.94 -1.22 -3.43 117.00 112.41 2ouk n LEU 236 Ca 0.00 0.24 -0.07 0.00 -1.11 0.00 0.00 56.01 55.07 2ouk n LEU 236 Cb 0.11 -0.24 0.06 0.00 0.53 0.00 0.00 43.42 43.88 2ouk n LEU 236 CO 0.00 -0.16 0.32 -1.54 -1.11 0.00 0.00 177.39 174.90 2ouk n SER 237 N -1.24 -2.43 0.00 1.96 3.41 -1.16 -4.54 113.62 109.61 2ouk n SER 237 Ca 0.05 -2.97 0.00 0.00 -0.26 0.00 0.00 58.87 55.69 2ouk n SER 237 Cb 0.07 1.58 0.00 0.00 -0.26 0.00 0.00 64.21 65.60 2ouk n SER 237 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2ouk n LYS 238 N 1.43 0.00 0.00 4.33 4.76 -1.24 -4.68 118.16 122.76 2ouk n LYS 238 Ca 0.06 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.50 2ouk n LYS 238 Cb 0.66 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.85 2ouk n LYS 238 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 2ouk n VAL 239 N 0.00 0.00 -1.09 -0.18 0.24 -1.25 -4.96 118.33 111.08 2ouk n VAL 239 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 2ouk n VAL 239 Cb 0.04 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.41 2ouk n VAL 239 CO 0.00 0.00 0.00 0.33 -2.14 0.00 0.00 176.83 175.02