#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jj2 n LEU 25 N 0.00 3.47 -0.12 -2.67 4.77 -1.26 -2.65 117.00 118.54 2jj2 n LEU 25 Ca 0.00 -1.75 -0.20 0.00 -0.03 0.00 0.00 56.01 54.03 2jj2 n LEU 25 Cb 0.00 -0.50 -0.11 0.00 -2.33 0.00 0.00 43.42 40.49 2jj2 n LEU 25 CO 0.00 0.56 -1.31 -0.62 -1.33 0.00 0.00 177.39 174.69 2jj2 n GLU 26 N 0.62 0.58 -0.01 3.23 1.02 -1.26 -1.39 120.64 123.43 2jj2 n GLU 26 Ca 0.17 0.17 0.08 0.00 -0.02 0.00 0.00 57.16 57.56 2jj2 n GLU 26 Cb 0.68 -1.46 -0.12 0.00 -0.02 0.00 0.00 31.44 30.52 2jj2 n GLU 26 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2jj2 n GLU 27 N -3.46 0.62 -4.55 3.49 -0.58 -1.26 -1.25 120.64 113.65 2jj2 n GLU 27 Ca -0.45 -0.13 -0.25 0.00 -0.42 0.00 0.00 57.16 55.91 2jj2 n GLU 27 Cb 0.92 -1.35 -0.10 0.00 -0.57 0.00 0.00 31.44 30.34 2jj2 n GLU 27 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 2jj2 s THR 28 N -3.01 1.51 0.36 2.62 -4.23 -1.08 -1.73 115.64 110.07 2jj2 s THR 28 Ca -0.05 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 58.40 2jj2 s THR 28 Cb 0.10 -2.82 0.03 0.00 1.34 0.00 0.00 72.50 71.15 2jj2 s THR 28 CO 0.64 0.00 0.59 0.61 -0.54 0.00 0.00 174.62 175.92 2jj2 n GLY 29 N -0.86 1.71 3.14 3.99 0.00 0.20 -1.15 105.19 112.23 2jj2 n GLY 29 Ca -0.05 -1.48 -0.18 0.00 0.00 0.00 0.00 46.02 44.31 2jj2 n GLY 29 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2jj2 s ARG 30 N -2.53 0.82 0.03 1.61 1.70 -0.67 -0.56 118.95 119.34 2jj2 s ARG 30 Ca 0.24 -0.84 -0.30 0.00 -0.47 0.00 0.00 55.73 54.35 2jj2 s ARG 30 Cb -0.02 -0.80 -0.06 0.00 -0.57 0.00 0.00 34.95 33.49 2jj2 s ARG 30 CO 0.17 0.18 1.47 0.08 -1.08 0.00 0.00 175.30 176.12 2jj2 s VAL 31 N -1.10 3.50 -0.18 4.99 1.01 0.30 -0.49 120.40 128.43 2jj2 s VAL 31 Ca -0.01 0.92 -0.21 0.00 0.00 0.00 0.00 61.98 62.67 2jj2 s VAL 31 Cb -0.09 -3.59 -0.22 0.00 0.00 0.00 0.00 36.38 32.48 2jj2 s VAL 31 CO 0.02 0.00 0.37 -0.07 0.00 0.00 0.00 175.10 175.42 2jj2 h LEU 32 N 8.29 0.08 -7.55 3.92 3.38 -0.37 1.00 115.31 124.07 2jj2 h LEU 32 Ca -0.39 -0.67 -0.14 0.00 0.09 0.00 0.00 57.88 56.77 2jj2 h LEU 32 Cb 1.19 -0.02 -0.22 0.00 0.09 0.00 0.00 40.66 41.69 2jj2 h LEU 32 CO 0.91 1.44 -0.38 -0.94 0.09 0.00 0.00 178.44 179.56 2jj2 s SER 33 N -6.78 -0.17 -0.03 -0.43 1.04 -1.15 -4.76 113.70 101.42 2jj2 s SER 33 Ca -0.25 0.20 0.00 0.00 0.48 0.00 0.00 55.95 56.38 2jj2 s SER 33 Cb 0.04 0.38 0.02 0.00 0.10 0.00 0.00 66.02 66.57 2jj2 s SER 33 CO 0.64 -0.28 -0.00 -0.51 0.98 0.00 0.00 173.24 174.07 2jj2 s ILE 34 N -0.74 0.18 -0.25 -1.02 1.10 -1.26 0.13 121.20 119.34 2jj2 s ILE 34 Ca -0.08 0.06 -0.30 0.00 -0.51 0.00 0.00 60.65 59.82 2jj2 s ILE 34 Cb -0.04 -0.27 0.18 0.00 0.15 0.00 0.00 42.46 42.48 2jj2 s ILE 34 CO 0.02 0.14 1.27 -0.83 -2.11 0.00 0.00 174.94 173.43 2jj2 s GLY 35 N 0.89 -0.01 -1.57 1.50 0.00 -0.44 -5.00 107.32 102.69 2jj2 s GLY 35 Ca -0.09 2.60 -0.13 0.00 0.00 0.00 0.00 44.72 47.10 2jj2 s GLY 35 CO -0.01 1.07 0.82 1.22 0.00 0.00 0.00 173.10 176.19 2jj2 n ASP 36 N 0.54 -3.42 -0.54 1.64 8.00 -1.26 -0.69 116.55 120.81 2jj2 n ASP 36 Ca -0.02 -0.90 -0.07 0.00 0.71 0.00 0.00 54.79 54.50 2jj2 n ASP 36 Cb 0.59 -3.34 -0.03 0.00 -0.02 0.00 0.00 41.12 38.31 2jj2 n ASP 36 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jj2 n GLY 37 N -1.61 0.84 3.16 0.44 0.00 -1.26 -4.99 105.19 101.78 2jj2 n GLY 37 Ca -0.01 -0.23 -0.33 0.00 0.00 0.00 0.00 46.02 45.44 2jj2 n GLY 37 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jj2 s ILE 38 N -1.98 2.37 -0.17 -0.61 -1.09 0.13 -1.23 121.20 118.62 2jj2 s ILE 38 Ca 0.00 -0.85 -0.07 0.00 -2.23 0.00 0.00 60.65 57.50 2jj2 s ILE 38 Cb 0.00 -2.03 -0.04 0.00 -1.58 0.00 0.00 42.46 38.81 2jj2 s ILE 38 CO 0.00 0.50 0.06 0.00 -1.23 0.00 0.00 174.94 174.27 2jj2 s ALA 39 N 1.33 3.41 -0.34 9.38 0.00 0.27 -1.32 121.76 134.49 2jj2 s ALA 39 Ca 0.05 -0.74 -0.13 0.00 0.00 0.00 0.00 51.96 51.13 2jj2 s ALA 39 Cb -0.13 -1.89 -0.02 0.00 0.00 0.00 0.00 23.12 21.08 2jj2 s ALA 39 CO -0.11 0.22 0.27 1.03 0.00 0.00 0.00 175.76 177.18 2jj2 s ARG 40 N 0.24 3.51 -0.13 0.00 1.81 0.12 -0.14 118.95 124.36 2jj2 s ARG 40 Ca 0.04 -0.59 -0.01 0.00 -1.72 0.00 0.00 55.73 53.45 2jj2 s ARG 40 Cb -0.12 -3.81 -0.02 0.00 -0.45 0.00 0.00 34.95 30.55 2jj2 s ARG 40 CO 0.00 -0.47 -0.10 0.08 -0.68 0.00 0.00 175.30 174.14 2jj2 s VAL 41 N 1.80 3.35 0.27 3.52 1.01 0.26 0.44 120.40 131.04 2jj2 s VAL 41 Ca 0.08 -0.56 -0.24 0.00 0.00 0.00 0.00 61.98 61.26 2jj2 s VAL 41 Cb -0.17 -2.42 -0.09 0.00 0.00 0.00 0.00 36.38 33.69 2jj2 s VAL 41 CO 0.11 0.52 0.85 -2.28 0.00 0.00 0.00 175.10 174.29 2jj2 s HIS 42 N 0.29 3.71 0.00 5.22 2.46 0.36 -0.01 115.29 127.32 2jj2 s HIS 42 Ca -0.08 1.63 0.00 0.00 0.47 0.00 0.00 55.06 57.08 2jj2 s HIS 42 Cb -0.15 -2.80 0.00 0.00 -0.13 0.00 0.00 32.58 29.50 2jj2 s HIS 42 CO 0.05 0.30 0.00 0.41 -2.47 0.00 0.00 174.74 173.02 2jj2 n GLY 43 N 0.75 0.37 3.98 1.59 0.00 -1.26 -1.68 105.19 108.94 2jj2 n GLY 43 Ca -0.01 -0.95 -0.28 0.00 0.00 0.00 0.00 46.02 44.79 2jj2 n GLY 43 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2jj2 n LEU 44 N 0.00 -2.25 0.29 0.99 4.77 -0.30 -4.67 117.00 115.83 2jj2 n LEU 44 Ca 0.00 -0.96 0.14 0.00 -0.03 0.00 0.00 56.01 55.16 2jj2 n LEU 44 Cb 0.00 -2.28 0.89 0.00 -2.33 0.00 0.00 43.42 39.69 2jj2 n LEU 44 CO 0.00 0.41 1.11 0.03 -1.33 0.00 0.00 177.39 177.61 2jj2 h ARG 45 N -1.80 0.00 -0.07 3.23 2.47 -1.14 -2.36 114.38 114.71 2jj2 h ARG 45 Ca -0.62 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.10 2jj2 h ARG 45 Cb 1.38 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.70 2jj2 h ARG 45 CO 0.65 0.01 0.00 0.09 0.56 0.00 0.00 179.97 181.28 2jj2 n ASN 46 N -3.89 2.41 -4.70 7.04 3.02 -0.38 -4.96 115.26 113.79 2jj2 n ASN 46 Ca -0.03 -1.80 -0.40 0.00 -0.03 0.00 0.00 54.58 52.32 2jj2 n ASN 46 Cb 0.09 -0.03 0.02 0.00 -0.61 0.00 0.00 39.78 39.25 2jj2 n ASN 46 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 2jj2 n VAL 47 N 0.87 3.00 -3.49 2.41 0.24 -0.89 -5.01 118.33 115.46 2jj2 n VAL 47 Ca 0.16 -0.50 -0.29 0.00 -2.04 0.00 0.00 64.34 61.67 2jj2 n VAL 47 Cb 0.49 -1.55 -0.04 0.00 -1.47 0.00 0.00 33.84 31.28 2jj2 n VAL 47 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 2jj2 s GLN 48 N -2.44 3.62 0.13 7.34 -0.21 -1.26 -5.04 119.66 121.80 2jj2 s GLN 48 Ca 0.65 -0.06 -0.31 0.00 0.02 0.00 0.00 55.36 55.66 2jj2 s GLN 48 Cb -0.47 -2.73 -0.11 0.00 1.00 0.00 0.00 33.01 30.70 2jj2 s GLN 48 CO 0.55 0.31 1.84 0.00 -2.12 0.00 0.00 175.29 175.87 2jj2 s ALA 49 N -1.93 3.78 -0.23 6.09 0.00 -1.26 -1.96 121.76 126.25 2jj2 s ALA 49 Ca 0.42 1.47 0.00 0.00 0.00 0.00 0.00 51.96 53.86 2jj2 s ALA 49 Cb -0.11 -3.76 0.00 0.00 0.00 0.00 0.00 23.12 19.24 2jj2 s ALA 49 CO 0.28 -1.22 0.00 0.39 0.00 0.00 0.00 175.76 175.21 2jj2 n GLU 50 N 5.59 -0.22 -2.69 0.00 1.02 0.19 -5.02 120.64 119.51 2jj2 n GLU 50 Ca 0.18 0.46 -0.39 0.00 -0.02 0.00 0.00 57.16 57.39 2jj2 n GLU 50 Cb 0.38 -3.97 -0.06 0.00 -0.02 0.00 0.00 31.44 27.78 2jj2 n GLU 50 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 2jj2 s GLU 51 N -1.71 4.65 -0.40 3.49 2.12 -0.83 -4.63 118.70 121.40 2jj2 s GLU 51 Ca 0.00 1.49 -0.27 0.00 0.36 0.00 0.00 54.97 56.55 2jj2 s GLU 51 Cb 0.00 -3.02 0.02 0.00 0.26 0.00 0.00 34.13 31.39 2jj2 s GLU 51 CO 0.00 0.31 1.01 -1.64 -0.54 0.00 0.00 175.26 174.40 2jj2 s MET 52 N -1.66 3.80 0.50 4.30 -1.94 -1.26 -1.24 119.30 121.80 2jj2 s MET 52 Ca 0.47 0.59 0.09 0.00 -1.71 0.00 0.00 55.69 55.12 2jj2 s MET 52 Cb -0.24 -3.84 0.05 0.00 2.01 0.00 0.00 34.83 32.81 2jj2 s MET 52 CO 0.30 -1.10 0.68 0.14 -0.01 0.00 0.00 175.02 175.04 2jj2 s VAL 53 N 3.80 2.54 -0.05 -6.03 -7.23 -0.18 -4.37 120.40 108.88 2jj2 s VAL 53 Ca 0.42 -1.01 0.00 0.00 -1.81 0.00 0.00 61.98 59.58 2jj2 s VAL 53 Cb -0.10 -2.55 0.03 0.00 0.56 0.00 0.00 36.38 34.31 2jj2 s VAL 53 CO 0.23 0.00 -0.02 -0.70 -0.31 0.00 0.00 175.10 174.30 2jj2 s GLU 54 N -4.51 0.60 0.56 4.82 2.12 0.45 -1.57 118.70 121.17 2jj2 s GLU 54 Ca 0.58 0.02 -0.14 0.00 0.36 0.00 0.00 54.97 55.79 2jj2 s GLU 54 Cb -0.08 -0.78 -0.06 0.00 0.26 0.00 0.00 34.13 33.47 2jj2 s GLU 54 CO 0.36 -0.17 1.00 -0.06 -0.54 0.00 0.00 175.26 175.85 2jj2 s PHE 55 N 1.31 3.52 0.60 5.30 0.40 0.08 -0.50 117.98 128.68 2jj2 s PHE 55 Ca -0.05 1.40 0.31 0.00 -0.60 0.00 0.00 56.93 57.99 2jj2 s PHE 55 Cb -0.13 -2.77 1.89 0.00 0.51 0.00 0.00 43.02 42.52 2jj2 s PHE 55 CO -0.02 -0.50 2.27 0.66 0.70 0.00 0.00 175.22 178.33 2jj2 h SER 56 N 0.44 0.00 0.45 1.36 4.64 -1.42 0.43 113.55 119.45 2jj2 h SER 56 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2jj2 h SER 56 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2jj2 h SER 56 CO 0.62 0.00 -0.13 -1.54 -0.87 0.00 0.00 176.83 174.91 2jj2 n SER 57 N -3.77 0.40 0.00 4.97 3.41 -1.26 -4.92 113.62 112.45 2jj2 n SER 57 Ca -0.03 -0.41 0.00 0.00 -0.26 0.00 0.00 58.87 58.17 2jj2 n SER 57 Cb 0.09 -0.10 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 2jj2 n SER 57 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jj2 n GLY 58 N 1.32 0.26 3.77 5.00 0.00 0.14 -5.08 105.19 110.60 2jj2 n GLY 58 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 2jj2 n GLY 58 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jj2 s LEU 59 N 0.00 4.31 0.50 0.99 1.43 -1.26 -4.78 118.68 119.87 2jj2 s LEU 59 Ca 0.00 2.77 -0.04 0.00 -1.03 0.00 0.00 54.13 55.83 2jj2 s LEU 59 Cb 0.00 -3.76 -0.02 0.00 0.03 0.00 0.00 46.19 42.44 2jj2 s LEU 59 CO 0.00 -0.76 0.79 -0.54 0.23 0.00 0.00 176.35 176.07 2jj2 s LYS 60 N -2.05 3.33 0.10 1.70 -0.14 -1.26 -0.74 119.74 120.68 2jj2 s LYS 60 Ca 0.53 0.05 -0.09 0.00 -1.36 0.00 0.00 55.97 55.10 2jj2 s LYS 60 Cb -0.41 -2.39 -0.00 0.00 -1.68 0.00 0.00 37.83 33.35 2jj2 s LYS 60 CO 0.54 -0.31 0.21 0.20 -0.76 0.00 0.00 175.35 175.22 2jj2 s GLY 61 N -4.16 0.17 -0.09 -3.33 0.00 -0.61 -1.63 107.32 97.67 2jj2 s GLY 61 Ca 0.49 -0.67 0.04 0.00 0.00 0.00 0.00 44.72 44.57 2jj2 s GLY 61 CO 0.44 -0.81 -0.22 -0.29 0.00 0.00 0.00 173.10 172.22 2jj2 s MET 62 N -3.88 2.80 -1.05 2.90 1.75 0.09 -1.01 119.30 120.90 2jj2 s MET 62 Ca 0.07 -0.80 -0.21 0.00 -1.25 0.00 0.00 55.69 53.51 2jj2 s MET 62 Cb 0.05 -2.14 0.08 0.00 2.84 0.00 0.00 34.83 35.65 2jj2 s MET 62 CO -0.09 0.16 1.42 -1.12 -0.65 0.00 0.00 175.02 174.74 2jj2 s SER 63 N 0.38 6.62 -0.13 1.11 0.01 -0.37 -0.64 113.70 120.67 2jj2 s SER 63 Ca -0.18 -1.83 0.02 0.00 1.31 0.00 0.00 55.95 55.27 2jj2 s SER 63 Cb -0.17 -2.52 -0.24 0.00 0.21 0.00 0.00 66.02 63.29 2jj2 s SER 63 CO 0.08 -1.31 0.33 0.18 0.41 0.00 0.00 173.24 172.93 2jj2 n LEU 64 N 8.10 2.01 -4.40 2.44 4.77 -0.93 0.53 117.00 129.51 2jj2 n LEU 64 Ca 0.34 0.19 -0.37 0.00 -0.03 0.00 0.00 56.01 56.14 2jj2 n LEU 64 Cb 0.49 -0.62 -0.12 0.00 -2.33 0.00 0.00 43.42 40.84 2jj2 n LEU 64 CO 0.64 0.72 -0.26 0.20 -1.33 0.00 0.00 177.39 177.36 2jj2 s ASN 65 N -6.58 5.24 -0.36 -1.43 -0.87 -0.95 -4.78 114.94 105.20 2jj2 s ASN 65 Ca -0.19 -0.51 -0.11 0.00 -1.57 0.00 0.00 52.86 50.49 2jj2 s ASN 65 Cb 0.07 -1.93 0.02 0.00 -0.02 0.00 0.00 41.25 39.39 2jj2 s ASN 65 CO 0.76 -0.15 0.21 -0.76 -2.57 0.00 0.00 177.10 174.60 2jj2 s LEU 66 N 1.57 4.63 0.34 0.60 1.43 -1.26 0.25 118.68 126.24 2jj2 s LEU 66 Ca 0.04 -0.85 0.09 0.00 -1.03 0.00 0.00 54.13 52.38 2jj2 s LEU 66 Cb -0.16 -2.04 -0.05 0.00 0.03 0.00 0.00 46.19 43.96 2jj2 s LEU 66 CO 0.04 -0.35 0.02 -1.61 0.23 0.00 0.00 176.35 174.68 2jj2 s GLU 67 N 1.59 2.09 0.19 1.70 2.02 -0.09 -5.02 118.70 121.18 2jj2 s GLU 67 Ca 0.03 -1.76 -0.12 0.00 0.02 0.00 0.00 54.97 53.14 2jj2 s GLU 67 Cb -0.19 -1.93 0.21 0.00 0.10 0.00 0.00 34.13 32.33 2jj2 s GLU 67 CO 0.07 0.12 1.71 -1.35 0.02 0.00 0.00 175.26 175.83 2jj2 h PRO 68 N 1.79 0.21 -0.01 0.39 0.11 -2.03 -3.20 132.00 129.27 2jj2 h PRO 68 Ca -0.43 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2jj2 h PRO 68 Cb 1.25 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2jj2 h PRO 68 CO 0.67 0.14 -0.47 -0.40 -0.21 0.00 0.00 178.00 177.74 2jj2 n ASP 69 N -5.14 1.32 -3.64 -2.05 5.75 -1.26 -5.01 116.55 106.52 2jj2 n ASP 69 Ca 0.06 -1.16 -0.10 0.00 -0.01 0.00 0.00 54.79 53.58 2jj2 n ASP 69 Cb 0.26 0.65 -0.04 0.00 -1.03 0.00 0.00 41.12 40.96 2jj2 n ASP 69 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2jj2 s ASN 70 N -2.08 -0.31 -0.18 -1.12 2.20 -1.21 -4.64 114.94 107.59 2jj2 s ASN 70 Ca 0.11 -0.33 -0.04 0.00 -0.94 0.00 0.00 52.86 51.66 2jj2 s ASN 70 Cb 0.13 0.55 -0.02 0.00 -2.00 0.00 0.00 41.25 39.90 2jj2 s ASN 70 CO 0.48 -0.97 -0.02 -0.69 -2.94 0.00 0.00 177.10 172.95 2jj2 s VAL 71 N -3.83 3.81 -0.61 3.54 1.01 0.99 -0.91 120.40 124.40 2jj2 s VAL 71 Ca 0.05 -0.37 -0.25 0.00 0.00 0.00 0.00 61.98 61.42 2jj2 s VAL 71 Cb -0.00 -2.70 0.04 0.00 0.00 0.00 0.00 36.38 33.72 2jj2 s VAL 71 CO -0.08 0.45 1.04 -0.83 0.00 0.00 0.00 175.10 175.69 2jj2 s GLY 72 N 0.82 1.27 -0.19 4.51 0.00 0.14 -0.57 107.32 113.30 2jj2 s GLY 72 Ca -0.00 -1.33 -0.08 0.00 0.00 0.00 0.00 44.72 43.31 2jj2 s GLY 72 CO 0.02 2.23 0.07 0.14 0.00 0.00 0.00 173.10 175.56 2jj2 s VAL 73 N 4.43 4.84 -0.26 1.40 1.01 0.81 -2.19 120.40 130.44 2jj2 s VAL 73 Ca 0.31 -0.01 -0.17 0.00 0.00 0.00 0.00 61.98 62.11 2jj2 s VAL 73 Cb -0.12 -3.19 -0.03 0.00 0.00 0.00 0.00 36.38 33.04 2jj2 s VAL 73 CO 0.17 0.44 0.46 0.54 0.00 0.00 0.00 175.10 176.72 2jj2 s VAL 74 N 0.48 5.11 -0.12 2.92 0.11 0.18 -0.56 120.40 128.52 2jj2 s VAL 74 Ca 0.04 0.76 -0.24 0.00 -2.93 0.00 0.00 61.98 59.61 2jj2 s VAL 74 Cb -0.12 -3.78 -0.03 0.00 -1.53 0.00 0.00 36.38 30.92 2jj2 s VAL 74 CO 0.01 0.12 0.74 -0.69 -3.33 0.00 0.00 175.10 171.95 2jj2 s VAL 75 N 2.17 4.98 -1.18 2.04 1.01 -0.36 -0.73 120.40 128.32 2jj2 s VAL 75 Ca 0.19 1.48 -0.09 0.00 0.00 0.00 0.00 61.98 63.56 2jj2 s VAL 75 Cb -0.16 -4.06 0.22 0.00 0.00 0.00 0.00 36.38 32.38 2jj2 s VAL 75 CO 0.09 0.15 1.51 0.49 0.00 0.00 0.00 175.10 177.33 2jj2 n PHE 76 N 4.52 3.88 -0.67 5.22 3.01 -0.64 -4.66 117.46 128.10 2jj2 n PHE 76 Ca 0.01 -3.15 0.00 0.00 1.01 0.00 0.00 57.45 55.32 2jj2 n PHE 76 Cb 0.50 -1.82 0.00 0.00 -0.01 0.00 0.00 39.48 38.15 2jj2 n PHE 76 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2jj2 n GLY 77 N 2.82 0.20 3.74 1.37 0.00 -1.26 -4.30 105.19 107.76 2jj2 n GLY 77 Ca 0.33 -1.75 -0.41 0.00 0.00 0.00 0.00 46.02 44.19 2jj2 n GLY 77 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2jj2 s ASN 78 N -2.50 7.06 0.42 1.61 3.84 -1.26 -4.90 114.94 119.21 2jj2 s ASN 78 Ca 0.00 2.28 0.16 0.00 0.21 0.00 0.00 52.86 55.51 2jj2 s ASN 78 Cb 0.00 -2.61 0.93 0.00 -0.55 0.00 0.00 41.25 39.02 2jj2 s ASN 78 CO 0.00 -0.38 1.92 0.44 -2.79 0.00 0.00 177.10 176.29 2jj2 h ASP 79 N 5.04 0.00 -0.37 -4.21 3.32 -1.97 -3.20 116.42 115.03 2jj2 h ASP 79 Ca -0.45 0.00 0.11 0.00 0.02 0.00 0.00 57.03 56.71 2jj2 h ASP 79 Cb 1.21 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.75 2jj2 h ASP 79 CO 0.74 0.27 0.51 0.07 -1.72 0.00 0.00 179.24 179.10 2jj2 h LYS 80 N 0.00 0.00 -0.00 3.56 2.10 -2.01 0.69 116.57 120.91 2jj2 h LYS 80 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2jj2 h LYS 80 Cb 0.50 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.83 2jj2 h LYS 80 CO 0.03 0.00 -0.07 1.28 -2.00 0.00 0.00 179.45 178.70 2jj2 n LEU 81 N -3.46 0.28 -4.21 7.07 4.77 -1.21 -4.78 117.00 115.47 2jj2 n LEU 81 Ca 0.07 0.10 -0.32 0.00 -0.03 0.00 0.00 56.01 55.83 2jj2 n LEU 81 Cb 0.66 -0.21 -0.17 0.00 -2.33 0.00 0.00 43.42 41.38 2jj2 n LEU 81 CO 0.23 0.05 -0.55 -0.63 -1.33 0.00 0.00 177.39 175.17 2jj2 s ILE 82 N -2.49 2.12 0.34 -0.08 1.01 0.23 -4.60 121.20 117.73 2jj2 s ILE 82 Ca 0.30 -0.98 0.09 0.00 0.00 0.00 0.00 60.65 60.06 2jj2 s ILE 82 Cb 0.20 -1.83 -0.06 0.00 0.01 0.00 0.00 42.46 40.78 2jj2 s ILE 82 CO 0.47 0.55 -0.08 -0.54 0.00 0.00 0.00 174.94 175.33 2jj2 s LYS 83 N 0.56 1.78 0.31 2.79 1.02 -1.26 -4.94 119.74 120.00 2jj2 s LYS 83 Ca -0.13 -1.92 -0.29 0.00 0.02 0.00 0.00 55.97 53.64 2jj2 s LYS 83 Cb -0.17 -1.61 -0.12 0.00 -0.52 0.00 0.00 37.83 35.41 2jj2 s LYS 83 CO 0.04 0.11 1.45 -1.91 -0.92 0.00 0.00 175.35 174.12 2jj2 n GLU 84 N -0.77 2.38 -0.96 1.68 2.13 -1.26 -2.55 120.64 121.29 2jj2 n GLU 84 Ca -0.05 0.84 0.00 0.00 0.66 0.00 0.00 57.16 58.61 2jj2 n GLU 84 Cb 0.64 -2.53 0.00 0.00 0.27 0.00 0.00 31.44 29.82 2jj2 n GLU 84 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2jj2 n GLY 85 N 1.47 0.51 3.78 8.31 0.00 0.35 -4.91 105.19 114.70 2jj2 n GLY 85 Ca 0.07 -0.08 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 2jj2 n GLY 85 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jj2 s ASP 86 N -2.08 7.11 0.04 1.61 1.11 -1.06 -4.62 116.67 118.80 2jj2 s ASP 86 Ca 0.00 1.95 -0.30 0.00 0.18 0.00 0.00 52.55 54.38 2jj2 s ASP 86 Cb 0.00 -2.59 -0.04 0.00 1.07 0.00 0.00 42.92 41.36 2jj2 s ASP 86 CO 0.00 -0.23 0.98 -0.63 1.18 0.00 0.00 175.17 176.47 2jj2 s ILE 87 N -1.60 4.70 -0.10 0.77 1.09 -1.26 -0.54 121.20 124.25 2jj2 s ILE 87 Ca 0.53 2.04 0.04 0.00 -1.10 0.00 0.00 60.65 62.15 2jj2 s ILE 87 Cb -0.21 -4.31 -0.00 0.00 -1.06 0.00 0.00 42.46 36.88 2jj2 s ILE 87 CO 0.26 0.22 -0.23 -0.69 -0.10 0.00 0.00 174.94 174.40 2jj2 s VAL 88 N 0.63 2.17 -0.04 2.92 1.01 0.27 -1.08 120.40 126.29 2jj2 s VAL 88 Ca 0.50 -0.98 0.05 0.00 0.00 0.00 0.00 61.98 61.56 2jj2 s VAL 88 Cb -0.22 -1.84 -0.02 0.00 0.00 0.00 0.00 36.38 34.30 2jj2 s VAL 88 CO 0.29 0.56 -0.19 -0.54 0.00 0.00 0.00 175.10 175.21 2jj2 s LYS 89 N 0.35 2.38 0.22 2.72 1.02 0.35 -0.62 119.74 126.15 2jj2 s LYS 89 Ca -0.18 -0.80 -0.30 0.00 0.02 0.00 0.00 55.97 54.72 2jj2 s LYS 89 Cb -0.18 -2.24 -0.09 0.00 -0.52 0.00 0.00 37.83 34.80 2jj2 s LYS 89 CO 0.08 0.57 1.22 1.03 -0.92 0.00 0.00 175.35 177.34 2jj2 s ARG 90 N -0.62 4.47 0.00 1.68 0.52 -0.70 -0.41 118.95 123.89 2jj2 s ARG 90 Ca 0.09 1.94 0.09 0.00 -0.52 0.00 0.00 55.73 57.33 2jj2 s ARG 90 Cb -0.11 -3.20 0.03 0.00 0.52 0.00 0.00 34.95 32.19 2jj2 s ARG 90 CO 0.00 -0.10 0.67 0.25 0.02 0.00 0.00 175.30 176.15 2jj2 n THR 91 N 2.18 0.00 -1.73 0.02 -2.24 -1.26 -4.94 114.28 106.31 2jj2 n THR 91 Ca 0.04 -0.46 -0.09 0.00 -2.27 0.00 0.00 64.05 61.27 2jj2 n THR 91 Cb 0.44 1.14 -0.02 0.00 -2.10 0.00 0.00 70.33 69.79 2jj2 n THR 91 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jj2 n GLY 92 N 0.65 0.51 3.81 3.38 0.00 -1.26 -5.02 105.19 107.26 2jj2 n GLY 92 Ca 0.04 -0.57 -0.32 0.00 0.00 0.00 0.00 46.02 45.17 2jj2 n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jj2 s ALA 93 N -2.39 2.72 -0.08 4.61 0.00 -1.26 -5.08 121.76 120.28 2jj2 s ALA 93 Ca 0.00 0.33 -0.03 0.00 0.00 0.00 0.00 51.96 52.25 2jj2 s ALA 93 Cb 0.00 -3.22 0.04 0.00 0.00 0.00 0.00 23.12 19.94 2jj2 s ALA 93 CO 0.00 -0.92 0.16 -1.50 0.00 0.00 0.00 175.76 173.50 2jj2 s ILE 94 N -2.59 -0.15 -1.08 0.00 -1.16 -1.26 -4.64 121.20 110.31 2jj2 s ILE 94 Ca 0.62 0.26 -0.23 0.00 -0.51 0.00 0.00 60.65 60.79 2jj2 s ILE 94 Cb -0.16 -0.27 -0.05 0.00 0.61 0.00 0.00 42.46 42.59 2jj2 s ILE 94 CO 0.41 0.11 1.90 -0.69 -2.81 0.00 0.00 174.94 173.86 2jj2 s VAL 95 N 1.71 3.57 0.33 4.00 1.01 -1.26 -4.88 120.40 124.88 2jj2 s VAL 95 Ca -0.03 -0.78 0.04 0.00 0.00 0.00 0.00 61.98 61.20 2jj2 s VAL 95 Cb -0.12 -4.44 -0.07 0.00 0.00 0.00 0.00 36.38 31.76 2jj2 s VAL 95 CO -0.06 -1.10 0.05 1.51 0.00 0.00 0.00 175.10 175.50 2jj2 s ASP 96 N 6.81 2.53 0.08 3.32 1.47 -1.26 -1.48 116.67 128.14 2jj2 s ASP 96 Ca 0.67 -1.37 0.05 0.00 1.18 0.00 0.00 52.55 53.08 2jj2 s ASP 96 Cb -0.03 -0.12 -0.03 0.00 -0.34 0.00 0.00 42.92 42.41 2jj2 s ASP 96 CO 0.07 -0.58 -0.13 0.68 0.68 0.00 0.00 175.17 175.88 2jj2 s VAL 97 N -3.23 1.06 0.37 2.11 -7.23 0.82 -4.84 120.40 109.46 2jj2 s VAL 97 Ca 0.36 -1.36 -0.27 0.00 -1.81 0.00 0.00 61.98 58.90 2jj2 s VAL 97 Cb 0.09 -1.10 -0.12 0.00 0.56 0.00 0.00 36.38 35.81 2jj2 s VAL 97 CO 0.16 -0.29 1.27 -0.81 -0.31 0.00 0.00 175.10 175.12 2jj2 n PRO 98 N 1.15 2.04 -3.84 4.82 -0.04 -1.26 -1.73 135.00 136.15 2jj2 n PRO 98 Ca -0.20 0.72 -0.13 0.00 -0.04 0.00 0.00 63.50 63.85 2jj2 n PRO 98 Cb 0.55 -2.33 -0.14 0.00 -0.04 0.00 0.00 33.50 31.54 2jj2 n PRO 98 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2jj2 s VAL 99 N -1.13 -0.01 -5.00 0.52 1.01 -0.23 -4.84 120.40 110.72 2jj2 s VAL 99 Ca 0.57 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.58 2jj2 s VAL 99 Cb -0.55 -0.10 0.00 0.00 0.00 0.00 0.00 36.38 35.73 2jj2 s VAL 99 CO 0.61 0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.33 2jj2 n GLY 100 N 3.23 0.98 0.11 4.51 0.00 -1.26 -3.86 105.19 108.90 2jj2 n GLY 100 Ca -0.15 -1.93 0.12 0.00 0.00 0.00 0.00 46.02 44.07 2jj2 n GLY 100 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jj2 n GLU 101 N -1.16 0.21 0.05 1.61 1.02 -1.26 -2.55 120.64 118.56 2jj2 n GLU 101 Ca 0.00 0.29 0.10 0.00 -0.02 0.00 0.00 57.16 57.53 2jj2 n GLU 101 Cb 0.00 -1.81 0.43 0.00 -0.02 0.00 0.00 31.44 30.04 2jj2 n GLU 101 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 2jj2 n GLU 102 N -2.19 0.08 0.18 3.49 0.00 -1.26 -2.05 120.64 118.89 2jj2 n GLU 102 Ca 0.04 0.24 0.08 0.00 0.00 0.00 0.00 57.16 57.52 2jj2 n GLU 102 Cb 0.33 -1.63 0.10 0.00 0.00 0.00 0.00 31.44 30.24 2jj2 n GLU 102 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.13 177.06 2jj2 h LEU 103 N 0.00 0.00 -9.80 -1.84 3.38 -1.86 -3.41 115.31 101.78 2jj2 h LEU 103 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 2jj2 h LEU 103 Cb 0.38 0.00 0.08 0.00 0.09 0.00 0.00 40.66 41.21 2jj2 h LEU 103 CO 0.00 0.22 0.84 -0.76 0.09 0.00 0.00 178.44 178.82 2jj2 s LEU 104 N -6.28 4.35 0.00 1.67 1.43 -0.87 -0.93 118.68 118.05 2jj2 s LEU 104 Ca 0.05 2.88 0.00 0.00 -1.03 0.00 0.00 54.13 56.03 2jj2 s LEU 104 Cb 0.06 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.65 2jj2 s LEU 104 CO 0.71 -0.85 0.00 0.61 0.23 0.00 0.00 176.35 177.05 2jj2 n GLY 105 N 1.99 1.74 3.77 -3.19 0.00 0.08 -4.93 105.19 104.65 2jj2 n GLY 105 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 2jj2 n GLY 105 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jj2 s ARG 106 N -0.20 3.04 -0.24 1.61 1.81 -0.11 -4.94 118.95 119.92 2jj2 s ARG 106 Ca 0.00 -0.49 -0.10 0.00 -1.72 0.00 0.00 55.73 53.42 2jj2 s ARG 106 Cb 0.00 -2.84 -0.04 0.00 -0.45 0.00 0.00 34.95 31.61 2jj2 s ARG 106 CO 0.00 0.65 0.14 0.08 -0.68 0.00 0.00 175.30 175.48 2jj2 s VAL 107 N -1.17 5.07 0.17 3.52 1.01 -1.26 -1.44 120.40 126.29 2jj2 s VAL 107 Ca 0.22 0.08 0.05 0.00 0.00 0.00 0.00 61.98 62.33 2jj2 s VAL 107 Cb -0.12 -3.37 -0.05 0.00 0.00 0.00 0.00 36.38 32.85 2jj2 s VAL 107 CO 0.13 0.34 -0.10 0.68 0.00 0.00 0.00 175.10 176.15 2jj2 s VAL 108 N 1.24 1.30 0.35 2.92 -7.23 0.62 -0.83 120.40 118.76 2jj2 s VAL 108 Ca 0.06 -2.10 -0.05 0.00 -1.81 0.00 0.00 61.98 58.09 2jj2 s VAL 108 Cb -0.14 -1.97 0.08 0.00 0.56 0.00 0.00 36.38 34.91 2jj2 s VAL 108 CO 0.05 -0.65 0.48 -0.90 -0.31 0.00 0.00 175.10 173.77 2jj2 n ASP 109 N -0.27 0.15 0.22 4.85 3.85 0.45 -0.37 116.55 125.43 2jj2 n ASP 109 Ca -0.09 -1.24 0.15 0.00 -0.71 0.00 0.00 54.79 52.90 2jj2 n ASP 109 Cb 0.61 -0.36 0.80 0.00 -1.35 0.00 0.00 41.12 40.83 2jj2 n ASP 109 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2jj2 h ALA 110 N -1.59 1.84 -0.32 2.12 0.00 -1.87 -2.35 119.26 117.09 2jj2 h ALA 110 Ca -0.16 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2jj2 h ALA 110 Cb 0.46 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2jj2 h ALA 110 CO 0.12 -0.19 0.00 1.28 0.00 0.00 0.00 179.25 180.47 2jj2 n LEU 111 N -4.03 2.98 0.00 0.00 4.77 -1.26 -4.60 117.00 114.86 2jj2 n LEU 111 Ca 0.00 -1.59 0.00 0.00 -0.03 0.00 0.00 56.01 54.39 2jj2 n LEU 111 Cb 0.23 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 2jj2 n LEU 111 CO 0.30 0.67 0.00 0.61 -1.33 0.00 0.00 177.39 177.64 2jj2 n GLY 112 N 0.98 0.78 3.74 -0.72 0.00 -0.88 -4.42 105.19 104.67 2jj2 n GLY 112 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 2jj2 n GLY 112 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2jj2 s ASN 113 N -2.06 7.26 0.25 1.61 0.01 -1.26 -4.76 114.94 115.98 2jj2 s ASN 113 Ca 0.00 2.12 -0.31 0.00 -0.71 0.00 0.00 52.86 53.97 2jj2 s ASN 113 Cb 0.00 -2.61 -0.11 0.00 0.41 0.00 0.00 41.25 38.94 2jj2 s ASN 113 CO 0.00 -0.22 1.57 0.00 -1.51 0.00 0.00 177.10 176.95 2jj2 s ALA 114 N -0.36 3.75 0.00 0.60 0.00 -1.26 -0.41 121.76 124.08 2jj2 s ALA 114 Ca 0.49 1.48 0.00 0.00 0.00 0.00 0.00 51.96 53.93 2jj2 s ALA 114 Cb -0.30 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 19.19 2jj2 s ALA 114 CO 0.36 -0.88 0.55 0.44 0.00 0.00 0.00 175.76 176.23 2jj2 n ILE 115 N 2.80 0.30 1.13 0.00 -5.35 -0.01 -4.68 119.36 113.55 2jj2 n ILE 115 Ca 0.10 -0.42 0.12 0.00 -0.27 0.00 0.00 62.75 62.29 2jj2 n ILE 115 Cb 0.38 1.05 0.30 0.00 -1.74 0.00 0.00 39.64 39.63 2jj2 n ILE 115 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 2jj2 n ASP 116 N -0.15 0.81 -1.14 7.28 5.68 -1.19 -4.97 116.55 122.87 2jj2 n ASP 116 Ca 0.00 -0.62 -0.09 0.00 -0.50 0.00 0.00 54.79 53.57 2jj2 n ASP 116 Cb 0.26 0.22 0.00 0.00 -1.14 0.00 0.00 41.12 40.45 2jj2 n ASP 116 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jj2 n GLY 117 N 1.42 0.03 1.45 6.12 0.00 -1.26 -4.94 105.19 108.01 2jj2 n GLY 117 Ca 0.09 -0.47 -0.03 0.00 0.00 0.00 0.00 46.02 45.61 2jj2 n GLY 117 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jj2 n LYS 118 N -1.95 2.79 0.00 1.61 5.02 -1.26 -5.08 118.16 119.28 2jj2 n LYS 118 Ca -0.10 -3.04 0.00 0.00 -2.02 0.00 0.00 58.31 53.15 2jj2 n LYS 118 Cb 0.58 -1.99 0.00 0.00 -0.02 0.00 0.00 35.03 33.60 2jj2 n LYS 118 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jj2 n GLY 119 N -0.65 -2.73 3.77 0.72 0.00 -1.26 -4.96 105.19 100.08 2jj2 n GLY 119 Ca 0.35 -1.69 -0.35 0.00 0.00 0.00 0.00 46.02 44.32 2jj2 n GLY 119 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2jj2 s PRO 120 N -0.80 3.24 0.31 1.61 0.04 -1.26 -4.81 135.00 133.33 2jj2 s PRO 120 Ca 0.00 1.61 -0.29 0.00 0.04 0.00 0.00 61.00 62.36 2jj2 s PRO 120 Cb 0.00 -1.99 -0.10 0.00 0.04 0.00 0.00 34.50 32.45 2jj2 s PRO 120 CO 0.00 -0.94 1.29 0.42 0.04 0.00 0.00 177.00 177.81 2jj2 s ILE 121 N -1.81 2.83 -0.31 0.56 -1.09 -1.26 -4.92 121.20 115.19 2jj2 s ILE 121 Ca 0.73 0.81 0.01 0.00 -2.23 0.00 0.00 60.65 59.97 2jj2 s ILE 121 Cb -0.24 -3.52 0.13 0.00 -1.58 0.00 0.00 42.46 37.25 2jj2 s ILE 121 CO 0.29 0.19 1.03 0.61 -1.23 0.00 0.00 174.94 175.83 2jj2 n GLY 122 N 1.03 2.24 3.69 6.18 0.00 -1.26 -4.97 105.19 112.10 2jj2 n GLY 122 Ca 0.01 -0.18 -0.44 0.00 0.00 0.00 0.00 46.02 45.40 2jj2 n GLY 122 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2jj2 n SER 123 N 0.18 3.11 -0.00 1.61 2.88 -1.26 -4.91 113.62 115.23 2jj2 n SER 123 Ca 0.09 1.12 0.03 0.00 -1.33 0.00 0.00 58.87 58.79 2jj2 n SER 123 Cb 0.62 -1.46 -0.04 0.00 -0.75 0.00 0.00 64.21 62.58 2jj2 n SER 123 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2jj2 n LYS 124 N 2.55 4.06 -4.15 -1.46 5.02 -1.26 -5.02 118.16 117.91 2jj2 n LYS 124 Ca 0.13 -0.01 -0.16 0.00 -2.02 0.00 0.00 58.31 56.25 2jj2 n LYS 124 Cb 0.32 -0.88 -0.12 0.00 -0.02 0.00 0.00 35.03 34.32 2jj2 n LYS 124 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2jj2 s ALA 125 N -1.79 0.80 0.19 7.82 0.00 -1.25 -5.09 121.76 122.45 2jj2 s ALA 125 Ca 0.02 -0.78 0.08 0.00 0.00 0.00 0.00 51.96 51.28 2jj2 s ALA 125 Cb 0.05 -0.04 -0.04 0.00 0.00 0.00 0.00 23.12 23.09 2jj2 s ALA 125 CO 0.30 0.08 -0.15 1.03 0.00 0.00 0.00 175.76 177.01 2jj2 s ARG 126 N -1.40 1.31 -0.10 0.00 0.52 -1.26 -1.06 118.95 116.95 2jj2 s ARG 126 Ca -0.05 -1.53 -0.08 0.00 -0.52 0.00 0.00 55.73 53.56 2jj2 s ARG 126 Cb -0.09 -1.17 0.03 0.00 0.52 0.00 0.00 34.95 34.24 2jj2 s ARG 126 CO 0.01 0.21 0.25 0.50 0.02 0.00 0.00 175.30 176.29 2jj2 s ARG 127 N -3.38 0.27 0.50 3.54 3.52 -0.70 -4.91 118.95 117.79 2jj2 s ARG 127 Ca 0.20 0.40 -0.23 0.00 -0.13 0.00 0.00 55.73 55.97 2jj2 s ARG 127 Cb -0.02 0.06 -0.07 0.00 -1.56 0.00 0.00 34.95 33.36 2jj2 s ARG 127 CO 0.07 -0.07 1.28 0.54 -0.81 0.00 0.00 175.30 176.30 2jj2 n ARG 128 N 3.32 1.72 0.07 5.12 1.74 -1.26 -0.13 116.66 127.25 2jj2 n ARG 128 Ca -0.16 0.62 -0.10 0.00 -0.77 0.00 0.00 57.85 57.43 2jj2 n ARG 128 Cb 0.57 -2.45 -0.13 0.00 -1.02 0.00 0.00 32.46 29.43 2jj2 n ARG 128 CO 0.00 0.00 0.00 -0.39 -1.52 0.00 0.00 177.63 175.72 2jj2 h VAL 129 N 1.61 1.60 -3.31 1.55 -1.51 -1.57 -3.42 116.25 111.20 2jj2 h VAL 129 Ca -0.49 -3.26 -0.73 0.00 -1.23 0.00 0.00 66.70 60.98 2jj2 h VAL 129 Cb 1.31 2.87 -0.26 0.00 -2.13 0.00 0.00 31.29 33.07 2jj2 h VAL 129 CO 0.58 0.93 -0.37 -0.83 -1.23 0.00 0.00 177.57 176.65 2jj2 s GLY 130 N -4.71 2.03 0.02 5.19 0.00 -1.26 -4.63 107.32 103.96 2jj2 s GLY 130 Ca -0.01 -2.29 0.00 0.00 0.00 0.00 0.00 44.72 42.42 2jj2 s GLY 130 CO 0.84 1.06 -0.03 1.08 0.00 0.00 0.00 173.10 176.05 2jj2 s LEU 131 N 1.50 2.18 0.45 0.66 1.43 -1.26 -5.14 118.68 118.50 2jj2 s LEU 131 Ca 0.04 -0.39 -0.25 0.00 -1.03 0.00 0.00 54.13 52.50 2jj2 s LEU 131 Cb -0.25 0.01 -0.08 0.00 0.03 0.00 0.00 46.19 45.90 2jj2 s LEU 131 CO 0.03 -0.20 1.44 0.29 0.23 0.00 0.00 176.35 178.13 2jj2 n LYS 132 N 1.95 2.27 -1.81 1.70 5.02 -1.26 -5.00 118.16 121.02 2jj2 n LYS 132 Ca -0.21 0.81 -0.34 0.00 -2.02 0.00 0.00 58.31 56.55 2jj2 n LYS 132 Cb 0.56 -2.64 0.05 0.00 -0.02 0.00 0.00 35.03 32.98 2jj2 n LYS 132 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2jj2 s ALA 133 N -1.19 2.46 0.34 7.82 0.00 -1.26 -4.98 121.76 124.95 2jj2 s ALA 133 Ca 0.61 0.68 -0.27 0.00 0.00 0.00 0.00 51.96 52.97 2jj2 s ALA 133 Cb -0.45 -3.36 -0.13 0.00 0.00 0.00 0.00 23.12 19.19 2jj2 s ALA 133 CO 0.58 -1.27 1.11 -2.30 0.00 0.00 0.00 175.76 173.88 2jj2 n PRO 134 N -2.21 1.63 0.00 0.00 -0.02 -1.26 -4.98 135.00 128.15 2jj2 n PRO 134 Ca 0.11 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 2jj2 n PRO 134 Cb 0.51 -2.06 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 2jj2 n PRO 134 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jj2 n GLY 135 N 1.05 -2.32 0.11 -1.23 0.00 -1.26 -4.96 105.19 96.58 2jj2 n GLY 135 Ca 0.08 -1.41 -0.08 0.00 0.00 0.00 0.00 46.02 44.62 2jj2 n GLY 135 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2jj2 h ILE 136 N -0.89 1.53 0.17 -0.61 2.04 -2.00 -3.37 117.51 114.39 2jj2 h ILE 136 Ca 0.00 -2.73 -0.31 0.00 1.00 0.00 0.00 64.86 62.81 2jj2 h ILE 136 Cb 0.00 2.52 0.03 0.00 -0.74 0.00 0.00 36.82 38.63 2jj2 h ILE 136 CO 0.00 0.79 -1.33 0.40 0.00 0.00 0.00 178.15 178.01 2jj2 h ILE 137 N 0.07 1.30 0.00 -0.67 1.08 -2.03 -3.31 117.51 113.95 2jj2 h ILE 137 Ca -0.04 -2.59 0.00 0.00 -0.39 0.00 0.00 64.86 61.84 2jj2 h ILE 137 Cb 1.53 2.83 0.00 0.00 -3.07 0.00 0.00 36.82 38.11 2jj2 h ILE 137 CO 0.13 0.78 0.00 -2.65 -0.69 0.00 0.00 178.15 175.72 2jj2 n PRO 138 N -3.75 0.15 -4.29 2.37 -0.02 -1.26 -4.81 135.00 123.39 2jj2 n PRO 138 Ca -0.14 0.00 -0.24 0.00 -2.02 0.00 0.00 63.50 61.09 2jj2 n PRO 138 Cb 1.03 -1.29 -0.08 0.00 -0.02 0.00 0.00 33.50 33.14 2jj2 n PRO 138 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2jj2 s ARG 139 N -2.00 2.23 0.12 -0.52 0.52 -1.25 -0.44 118.95 117.61 2jj2 s ARG 139 Ca 0.04 -1.37 0.05 0.00 -0.52 0.00 0.00 55.73 53.93 2jj2 s ARG 139 Cb 0.02 -2.16 -0.04 0.00 0.52 0.00 0.00 34.95 33.29 2jj2 s ARG 139 CO 0.03 0.39 -0.12 -1.50 0.02 0.00 0.00 175.30 174.12 2jj2 s ILE 140 N -2.14 1.19 0.50 1.52 1.10 -1.00 -4.56 121.20 117.81 2jj2 s ILE 140 Ca 0.29 -1.78 -0.20 0.00 -0.51 0.00 0.00 60.65 58.46 2jj2 s ILE 140 Cb -0.07 -1.56 -0.11 0.00 0.15 0.00 0.00 42.46 40.87 2jj2 s ILE 140 CO 0.18 -0.53 0.43 -1.20 -2.11 0.00 0.00 174.94 171.71 2jj2 n SER 141 N 0.36 -1.41 -4.66 4.50 7.64 -1.26 -4.66 113.62 114.14 2jj2 n SER 141 Ca -0.14 0.79 -0.43 0.00 1.01 0.00 0.00 58.87 60.10 2jj2 n SER 141 Cb 0.58 -1.10 -0.02 0.00 -1.01 0.00 0.00 64.21 62.66 2jj2 n SER 141 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2jj2 s VAL 142 N -1.67 3.85 0.00 0.44 1.01 -1.26 -4.84 120.40 117.93 2jj2 s VAL 142 Ca 0.65 1.02 0.00 0.00 0.00 0.00 0.00 61.98 63.65 2jj2 s VAL 142 Cb -0.51 -3.67 0.00 0.00 0.00 0.00 0.00 36.38 32.20 2jj2 s VAL 142 CO 0.58 -0.10 0.00 0.54 0.00 0.00 0.00 175.10 176.12 2jj2 n ARG 143 N 6.96 0.61 -2.49 2.72 5.12 -1.26 -4.57 116.66 123.75 2jj2 n ARG 143 Ca 0.16 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.66 2jj2 n ARG 143 Cb 0.44 -0.70 -0.03 0.00 -1.16 0.00 0.00 32.46 31.01 2jj2 n ARG 143 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 2jj2 s GLU 144 N -1.39 4.36 0.27 5.56 2.02 -1.26 -4.33 118.70 123.92 2jj2 s GLU 144 Ca 0.00 1.63 -0.31 0.00 0.02 0.00 0.00 54.97 56.32 2jj2 s GLU 144 Cb 0.00 -3.55 -0.12 0.00 0.10 0.00 0.00 34.13 30.56 2jj2 s GLU 144 CO 0.00 -0.42 1.54 -2.30 0.02 0.00 0.00 175.26 174.10 2jj2 n PRO 145 N 5.14 2.47 -3.57 0.39 -0.02 -1.25 -0.29 135.00 137.86 2jj2 n PRO 145 Ca 0.11 0.88 -0.41 0.00 -2.02 0.00 0.00 63.50 62.05 2jj2 n PRO 145 Cb 0.47 -2.62 -0.11 0.00 -0.02 0.00 0.00 33.50 31.21 2jj2 n PRO 145 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 2jj2 s MET 146 N -0.33 2.83 -0.29 -0.52 1.75 0.26 -4.60 119.30 118.40 2jj2 s MET 146 Ca 0.67 -1.09 -0.19 0.00 -1.25 0.00 0.00 55.69 53.82 2jj2 s MET 146 Cb -0.55 -3.78 -0.02 0.00 2.84 0.00 0.00 34.83 33.32 2jj2 s MET 146 CO 0.48 -0.73 0.56 -0.65 -0.65 0.00 0.00 175.02 174.02 2jj2 s GLN 147 N 1.57 3.93 0.16 4.11 -1.52 -1.26 -4.24 119.66 122.41 2jj2 s GLN 147 Ca 0.02 0.23 0.10 0.00 -1.95 0.00 0.00 55.36 53.76 2jj2 s GLN 147 Cb -0.19 -3.71 -0.12 0.00 -0.22 0.00 0.00 33.01 28.77 2jj2 s GLN 147 CO 0.07 -0.48 1.31 1.79 -0.25 0.00 0.00 175.29 177.72 2jj2 h THR 148 N 5.49 1.40 0.00 -0.19 1.35 -1.93 -3.44 112.91 115.58 2jj2 h THR 148 Ca -0.28 -3.00 0.00 0.00 -0.55 0.00 0.00 66.41 62.58 2jj2 h THR 148 Cb 1.13 2.69 0.00 0.00 -1.73 0.00 0.00 68.15 70.24 2jj2 h THR 148 CO 0.76 0.80 0.00 0.61 -0.25 0.00 0.00 175.52 177.43 2jj2 n GLY 149 N 1.32 1.37 3.61 5.82 0.00 -1.26 -3.71 105.19 112.33 2jj2 n GLY 149 Ca -0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 2jj2 n GLY 149 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jj2 s ILE 150 N -3.76 5.21 0.10 -0.61 1.01 -1.26 -0.35 121.20 121.55 2jj2 s ILE 150 Ca 0.00 0.47 -0.30 0.00 0.00 0.00 0.00 60.65 60.82 2jj2 s ILE 150 Cb 0.00 -3.65 -0.11 0.00 0.01 0.00 0.00 42.46 38.70 2jj2 s ILE 150 CO 0.00 0.19 1.61 0.11 0.00 0.00 0.00 174.94 176.85 2jj2 h LYS 151 N 8.14 -0.64 -0.96 2.79 1.57 -1.94 -0.03 116.57 125.50 2jj2 h LYS 151 Ca -0.33 0.04 0.24 0.00 -1.87 0.00 0.00 60.65 58.73 2jj2 h LYS 151 Cb 1.17 0.15 -0.13 0.00 0.08 0.00 0.00 32.23 33.50 2jj2 h LYS 151 CO 0.63 -0.43 0.52 0.00 -0.57 0.00 0.00 179.45 179.60 2jj2 h ALA 152 N -0.14 1.66 0.17 3.86 0.00 -1.92 -0.36 119.26 122.53 2jj2 h ALA 152 Ca 0.00 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 2jj2 h ALA 152 Cb 0.64 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2jj2 h ALA 152 CO -0.13 -0.31 -0.08 0.28 0.00 0.00 0.00 179.25 179.01 2jj2 h VAL 153 N 0.50 0.05 -0.31 0.00 2.07 -1.71 -2.05 116.25 114.81 2jj2 h VAL 153 Ca 0.62 -0.87 0.06 0.00 0.82 0.00 0.00 66.70 67.33 2jj2 h VAL 153 Cb 1.18 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 2jj2 h VAL 153 CO -0.50 0.02 0.22 0.44 0.02 0.00 0.00 177.57 177.76 2jj2 h ASP 154 N -1.05 0.13 0.01 0.57 3.32 -0.83 0.25 116.42 118.82 2jj2 h ASP 154 Ca -0.02 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.86 2jj2 h ASP 154 Cb 0.20 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 2jj2 h ASP 154 CO 0.04 0.08 -0.89 0.77 -1.72 0.00 0.00 179.24 177.52 2jj2 h SER 155 N 0.15 0.03 0.00 6.45 4.64 -1.20 -3.40 113.55 120.21 2jj2 h SER 155 Ca 0.14 -0.68 -0.08 0.00 -0.47 0.00 0.00 61.79 60.70 2jj2 h SER 155 Cb 0.38 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.45 2jj2 h SER 155 CO -0.02 1.35 -1.70 0.18 -0.87 0.00 0.00 176.83 175.77 2jj2 n LEU 156 N -4.45 0.00 -3.05 5.97 4.77 -0.78 -4.67 117.00 114.80 2jj2 n LEU 156 Ca -0.25 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.49 2jj2 n LEU 156 Cb 0.64 0.11 -0.04 0.00 -2.33 0.00 0.00 43.42 41.80 2jj2 n LEU 156 CO 0.25 0.11 0.00 0.52 -1.33 0.00 0.00 177.39 176.95 2jj2 n VAL 157 N -2.15 1.84 -2.36 4.08 0.31 0.82 -4.72 118.33 116.15 2jj2 n VAL 157 Ca -0.09 -5.19 -0.39 0.00 -0.01 0.00 0.00 64.34 58.65 2jj2 n VAL 157 Cb 0.55 -1.02 -0.03 0.00 -0.91 0.00 0.00 33.84 32.43 2jj2 n VAL 157 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2jj2 s PRO 158 N -3.04 4.33 -0.03 5.55 0.04 -0.78 -4.56 135.00 136.52 2jj2 s PRO 158 Ca 0.45 1.85 0.05 0.00 0.04 0.00 0.00 61.00 63.40 2jj2 s PRO 158 Cb 0.30 -2.92 -0.03 0.00 0.04 0.00 0.00 34.50 31.90 2jj2 s PRO 158 CO -0.11 -0.08 -0.17 0.42 0.04 0.00 0.00 177.00 177.10 2jj2 s ILE 159 N -1.30 2.85 0.31 0.56 1.01 -1.26 -4.22 121.20 119.15 2jj2 s ILE 159 Ca 0.51 -0.87 0.10 0.00 0.00 0.00 0.00 60.65 60.39 2jj2 s ILE 159 Cb -0.32 -2.11 -0.05 0.00 0.01 0.00 0.00 42.46 39.99 2jj2 s ILE 159 CO 0.41 0.54 -0.06 -0.83 0.00 0.00 0.00 174.94 175.00 2jj2 s GLY 160 N -0.84 1.93 -0.10 6.18 0.00 -1.26 -0.57 107.32 112.66 2jj2 s GLY 160 Ca 0.12 -1.88 -0.29 0.00 0.00 0.00 0.00 44.72 42.67 2jj2 s GLY 160 CO 0.01 -1.89 1.56 0.50 0.00 0.00 0.00 173.10 173.28 2jj2 s ARG 161 N -3.64 4.15 0.00 2.90 0.52 0.60 -1.81 118.95 121.66 2jj2 s ARG 161 Ca 0.33 2.01 0.00 0.00 -0.52 0.00 0.00 55.73 57.54 2jj2 s ARG 161 Cb -0.03 -3.94 0.00 0.00 0.52 0.00 0.00 34.95 31.50 2jj2 s ARG 161 CO 0.18 -0.87 0.00 0.41 0.02 0.00 0.00 175.30 175.05 2jj2 n GLY 162 N 4.07 1.22 3.78 -3.53 0.00 -1.24 -4.54 105.19 104.95 2jj2 n GLY 162 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 2jj2 n GLY 162 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jj2 s GLN 163 N -0.80 3.07 -0.29 1.61 0.74 -0.75 -3.67 119.66 119.57 2jj2 s GLN 163 Ca 0.00 1.37 -0.03 0.00 0.05 0.00 0.00 55.36 56.75 2jj2 s GLN 163 Cb 0.00 -1.99 0.04 0.00 1.10 0.00 0.00 33.01 32.16 2jj2 s GLN 163 CO 0.00 -1.03 0.01 1.03 -0.55 0.00 0.00 175.29 174.74 2jj2 s ARG 164 N -3.94 2.62 -0.18 1.67 3.00 -1.26 -1.76 118.95 119.09 2jj2 s ARG 164 Ca 0.67 -1.14 -0.01 0.00 0.00 0.00 0.00 55.73 55.25 2jj2 s ARG 164 Cb -0.19 -3.19 0.00 0.00 0.00 0.00 0.00 34.95 31.57 2jj2 s ARG 164 CO 0.37 -0.55 -0.13 -2.00 0.00 0.00 0.00 175.30 172.99 2jj2 s GLU 165 N 1.32 3.19 0.01 3.54 2.56 -0.70 -0.51 118.70 128.11 2jj2 s GLU 165 Ca -0.03 -0.74 -0.28 0.00 0.00 0.00 0.00 54.97 53.93 2jj2 s GLU 165 Cb -0.19 -2.73 -0.04 0.00 2.00 0.00 0.00 34.13 33.17 2jj2 s GLU 165 CO -0.01 -0.13 0.90 -1.17 -0.56 0.00 0.00 175.26 174.29 2jj2 s LEU 166 N 1.19 4.39 -0.29 2.70 2.96 0.45 -3.73 118.68 126.36 2jj2 s LEU 166 Ca 0.02 1.57 -0.12 0.00 -0.22 0.00 0.00 54.13 55.38 2jj2 s LEU 166 Cb -0.14 -3.44 -0.04 0.00 0.50 0.00 0.00 46.19 43.07 2jj2 s LEU 166 CO -0.06 -0.17 0.25 -0.63 -1.32 0.00 0.00 176.35 174.43 2jj2 s ILE 167 N 0.67 5.26 -0.06 6.68 1.01 0.34 0.13 121.20 135.24 2jj2 s ILE 167 Ca 0.47 0.20 -0.05 0.00 0.00 0.00 0.00 60.65 61.27 2jj2 s ILE 167 Cb -0.21 -3.62 0.02 0.00 0.01 0.00 0.00 42.46 38.66 2jj2 s ILE 167 CO 0.26 0.17 0.15 -0.51 0.00 0.00 0.00 174.94 175.01 2jj2 s ILE 168 N 1.85 -0.00 0.00 2.92 2.07 -0.39 -1.11 121.20 126.54 2jj2 s ILE 168 Ca 0.09 0.02 0.00 0.00 -1.41 0.00 0.00 60.65 59.35 2jj2 s ILE 168 Cb -0.16 -0.22 0.00 0.00 0.13 0.00 0.00 42.46 42.21 2jj2 s ILE 168 CO 0.11 0.01 0.00 0.61 -1.91 0.00 0.00 174.94 173.75 2jj2 n GLY 169 N 3.11 1.20 3.19 1.50 0.00 -1.13 -1.04 105.19 112.03 2jj2 n GLY 169 Ca -0.14 -0.89 -0.26 0.00 0.00 0.00 0.00 46.02 44.73 2jj2 n GLY 169 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jj2 n ASP 170 N 0.00 -3.36 -4.72 1.61 10.43 -1.26 -2.04 116.55 117.21 2jj2 n ASP 170 Ca 0.00 -0.57 -0.37 0.00 2.57 0.00 0.00 54.79 56.41 2jj2 n ASP 170 Cb 0.00 -0.96 0.06 0.00 1.84 0.00 0.00 41.12 42.06 2jj2 n ASP 170 CO 0.00 0.00 0.00 -2.11 -1.07 0.00 0.00 177.20 174.02 2jj2 n ARG 171 N -4.18 1.20 -2.97 -1.24 1.85 -1.26 -3.62 116.66 106.44 2jj2 n ARG 171 Ca 0.09 0.46 -0.22 0.00 -1.00 0.00 0.00 57.85 57.18 2jj2 n ARG 171 Cb 0.52 -2.50 0.03 0.00 -1.05 0.00 0.00 32.46 29.45 2jj2 n ARG 171 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 2jj2 n GLN 172 N -1.64 -4.44 0.00 2.89 6.02 -1.26 -4.85 117.38 114.09 2jj2 n GLN 172 Ca 0.15 0.89 0.09 0.00 -0.01 0.00 0.00 57.00 58.12 2jj2 n GLN 172 Cb 0.47 -5.72 -0.09 0.00 1.02 0.00 0.00 30.24 25.92 2jj2 n GLN 172 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2jj2 n THR 173 N -4.41 0.00 0.00 5.09 -2.24 -1.24 -4.99 114.28 106.49 2jj2 n THR 173 Ca -0.12 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 2jj2 n THR 173 Cb 0.62 1.03 0.00 0.00 -2.10 0.00 0.00 70.33 69.88 2jj2 n THR 173 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jj2 n GLY 174 N 1.42 1.70 0.05 3.38 0.00 -1.26 -4.52 105.19 105.96 2jj2 n GLY 174 Ca 0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 2jj2 n GLY 174 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jj2 h LYS 175 N 0.00 -0.00 -0.66 1.61 1.57 -1.94 -3.06 116.57 114.10 2jj2 h LYS 175 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2jj2 h LYS 175 Cb 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.28 2jj2 h LYS 175 CO 0.00 0.48 0.36 1.15 -0.57 0.00 0.00 179.45 180.87 2jj2 h THR 176 N -0.48 1.20 -0.49 -0.16 2.02 -1.99 -2.91 112.91 110.11 2jj2 h THR 176 Ca -0.00 -0.49 0.02 0.00 0.77 0.00 0.00 66.41 66.71 2jj2 h THR 176 Cb 0.48 0.31 -0.03 0.00 -1.74 0.00 0.00 68.15 67.16 2jj2 h THR 176 CO 0.00 0.22 0.29 0.28 0.37 0.00 0.00 175.52 176.68 2jj2 h SER 177 N 0.91 0.46 -0.80 4.18 0.02 -1.98 0.22 113.55 116.57 2jj2 h SER 177 Ca 0.23 0.00 0.15 0.00 -0.84 0.00 0.00 61.79 61.34 2jj2 h SER 177 Cb 0.02 -0.09 -0.10 0.00 0.14 0.00 0.00 62.40 62.37 2jj2 h SER 177 CO -0.04 0.33 0.35 0.40 -1.14 0.00 0.00 176.83 176.73 2jj2 h ILE 178 N 0.58 0.65 -0.25 3.27 1.08 -1.41 0.14 117.51 121.58 2jj2 h ILE 178 Ca 0.19 -0.17 -0.19 0.00 -0.39 0.00 0.00 64.86 64.31 2jj2 h ILE 178 Cb 0.02 0.12 0.00 0.00 -3.07 0.00 0.00 36.82 33.89 2jj2 h ILE 178 CO -0.09 0.09 -0.57 0.00 -0.69 0.00 0.00 178.15 176.89 2jj2 h ALA 179 N 1.57 0.40 0.02 1.87 0.00 -1.21 -2.58 119.26 119.33 2jj2 h ALA 179 Ca 0.45 -0.52 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2jj2 h ALA 179 Cb 0.69 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2jj2 h ALA 179 CO -0.41 0.63 -0.01 0.82 0.00 0.00 0.00 179.25 180.28 2jj2 h ILE 180 N 0.58 1.13 -0.52 0.00 1.08 0.37 -1.92 117.51 118.23 2jj2 h ILE 180 Ca -0.00 -0.46 0.01 0.00 -0.39 0.00 0.00 64.86 64.01 2jj2 h ILE 180 Cb 1.19 1.43 -0.03 0.00 -3.07 0.00 0.00 36.82 36.35 2jj2 h ILE 180 CO 0.13 0.12 0.34 0.44 -0.69 0.00 0.00 178.15 178.49 2jj2 h ASP 181 N -0.23 0.59 -0.61 1.72 3.45 -1.07 0.22 116.42 120.49 2jj2 h ASP 181 Ca -0.00 -0.02 -0.04 0.00 0.43 0.00 0.00 57.03 57.40 2jj2 h ASP 181 Cb 0.22 -0.15 -0.03 0.00 -0.56 0.00 0.00 39.33 38.81 2jj2 h ASP 181 CO 0.01 0.43 0.21 0.74 -1.57 0.00 0.00 179.24 179.06 2jj2 h THR 182 N 0.70 1.24 -0.22 0.35 2.02 -1.31 0.18 112.91 115.88 2jj2 h THR 182 Ca 0.19 -0.79 -0.05 0.00 0.77 0.00 0.00 66.41 66.53 2jj2 h THR 182 Cb -0.08 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 66.93 2jj2 h THR 182 CO -0.04 0.30 -0.05 0.40 0.37 0.00 0.00 175.52 176.50 2jj2 h ILE 183 N 0.87 1.28 -0.92 3.11 2.04 -0.42 -3.04 117.51 120.43 2jj2 h ILE 183 Ca 0.20 -1.04 0.02 0.00 1.00 0.00 0.00 64.86 65.04 2jj2 h ILE 183 Cb 0.26 1.52 -0.05 0.00 -0.74 0.00 0.00 36.82 37.81 2jj2 h ILE 183 CO -0.01 0.32 0.61 0.40 0.00 0.00 0.00 178.15 179.47 2jj2 h ILE 184 N 0.14 1.21 -0.62 -0.67 2.04 -0.91 -2.76 117.51 115.95 2jj2 h ILE 184 Ca 0.05 -0.42 0.13 0.00 1.00 0.00 0.00 64.86 65.62 2jj2 h ILE 184 Cb 0.50 -0.12 -0.04 0.00 -0.74 0.00 0.00 36.82 36.43 2jj2 h ILE 184 CO 0.02 0.22 0.42 -1.13 0.00 0.00 0.00 178.15 177.69 2jj2 h ASN 185 N 1.23 0.28 0.84 1.72 -1.24 -0.51 -2.94 115.58 114.96 2jj2 h ASN 185 Ca 0.35 0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.37 2jj2 h ASN 185 Cb -0.10 -0.05 0.00 0.00 0.73 0.00 0.00 38.32 38.91 2jj2 h ASN 185 CO -0.09 0.16 0.00 1.56 -1.29 0.00 0.00 177.43 177.77 2jj2 h GLN 186 N 0.30 0.00 -0.93 6.67 1.08 -1.50 -3.10 115.11 117.63 2jj2 h GLN 186 Ca 0.30 0.00 0.18 0.00 -1.45 0.00 0.00 58.65 57.67 2jj2 h GLN 186 Cb 0.75 0.00 -0.10 0.00 -0.05 0.00 0.00 27.48 28.08 2jj2 h GLN 186 CO -0.07 0.00 0.51 -0.22 -0.95 0.00 0.00 178.83 178.10 2jj2 h LYS 187 N 0.00 0.64 0.00 1.46 3.64 -1.69 -0.53 116.57 120.09 2jj2 h LYS 187 Ca 0.00 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 2jj2 h LYS 187 Cb 0.42 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.10 2jj2 h LYS 187 CO 0.00 0.42 -0.03 0.07 -2.27 0.00 0.00 179.45 177.65 2jj2 h ARG 188 N 0.66 0.00 0.04 1.90 0.11 -1.79 -0.59 114.38 114.71 2jj2 h ARG 188 Ca 0.53 0.00 -0.38 0.00 0.10 0.00 0.00 59.98 60.23 2jj2 h ARG 188 Cb 0.82 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.85 2jj2 h ARG 188 CO -0.39 0.03 -2.32 1.19 0.10 0.00 0.00 179.97 178.57 2jj2 n PHE 189 N -3.48 0.41 0.19 4.08 3.01 -0.44 -4.04 117.46 117.19 2jj2 n PHE 189 Ca -0.02 0.09 0.05 0.00 1.01 0.00 0.00 57.45 58.58 2jj2 n PHE 189 Cb 0.13 -1.05 0.35 0.00 -0.01 0.00 0.00 39.48 38.90 2jj2 n PHE 189 CO 0.00 0.00 0.00 -0.91 1.01 0.00 0.00 176.76 176.86 2jj2 h ASN 190 N 0.02 0.00 1.78 4.37 2.35 -0.87 -2.04 115.58 121.19 2jj2 h ASN 190 Ca -0.53 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.20 2jj2 h ASN 190 Cb 1.94 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 40.31 2jj2 h ASN 190 CO -0.03 0.37 -0.08 0.44 -1.65 0.00 0.00 177.43 176.48 2jj2 h ASP 191 N 0.00 0.00 -0.92 5.81 3.45 -1.33 -3.46 116.42 119.97 2jj2 h ASP 191 Ca -0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 2jj2 h ASP 191 Cb 0.86 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.63 2jj2 h ASP 191 CO 0.05 0.08 0.00 0.61 -1.57 0.00 0.00 179.24 178.41 2jj2 n GLY 192 N 0.97 -1.98 0.00 2.75 0.00 -0.77 -5.04 105.19 101.12 2jj2 n GLY 192 Ca 0.03 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.57 2jj2 n GLY 192 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jj2 n THR 193 N -1.52 0.00 -2.44 2.61 -2.24 -1.26 -4.95 114.28 104.48 2jj2 n THR 193 Ca 0.00 -0.27 -0.43 0.00 -2.27 0.00 0.00 64.05 61.08 2jj2 n THR 193 Cb 0.00 0.81 -0.02 0.00 -2.10 0.00 0.00 70.33 69.01 2jj2 n THR 193 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2jj2 s ASP 194 N -1.08 6.73 0.12 3.42 -1.08 -1.26 -4.93 116.67 118.59 2jj2 s ASP 194 Ca 0.00 1.26 -0.07 0.00 -0.52 0.00 0.00 52.55 53.22 2jj2 s ASP 194 Cb 0.00 -2.54 -0.10 0.00 -1.46 0.00 0.00 42.92 38.82 2jj2 s ASP 194 CO 0.00 -1.02 1.30 -0.33 0.52 0.00 0.00 175.17 175.64 2jj2 h GLU 195 N 9.04 0.51 -0.78 4.34 4.39 -1.92 -3.27 114.58 126.88 2jj2 h GLU 195 Ca -0.26 -0.51 0.17 0.00 0.34 0.00 0.00 59.36 59.11 2jj2 h GLU 195 Cb 1.09 0.13 -0.11 0.00 -0.10 0.00 0.00 28.75 29.77 2jj2 h GLU 195 CO 1.02 1.14 0.25 0.87 -1.16 0.00 0.00 179.01 181.13 2jj2 h LYS 196 N 0.30 0.31 -0.00 2.33 1.79 -1.96 -2.29 116.57 117.05 2jj2 h LYS 196 Ca -0.08 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.37 2jj2 h LYS 196 Cb 1.54 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 32.12 2jj2 h LYS 196 CO 0.16 0.21 -0.02 1.63 -1.08 0.00 0.00 179.45 180.35 2jj2 n LYS 197 N -5.11 0.40 -2.35 3.15 5.02 -1.23 -4.89 118.16 113.14 2jj2 n LYS 197 Ca 0.16 -0.03 -0.36 0.00 -2.02 0.00 0.00 58.31 56.07 2jj2 n LYS 197 Cb 0.51 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 34.00 2jj2 n LYS 197 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2jj2 s LYS 198 N -2.62 3.74 -0.10 1.97 1.02 -0.86 -4.80 119.74 118.08 2jj2 s LYS 198 Ca 0.26 1.62 -0.03 0.00 0.02 0.00 0.00 55.97 57.84 2jj2 s LYS 198 Cb 0.20 -2.28 0.05 0.00 -0.52 0.00 0.00 37.83 35.28 2jj2 s LYS 198 CO 0.48 -0.53 0.13 -1.17 -0.92 0.00 0.00 175.35 173.34 2jj2 s LEU 199 N -3.22 0.04 0.25 3.17 2.96 -1.26 -4.42 118.68 116.21 2jj2 s LEU 199 Ca 0.65 0.04 -0.25 0.00 -0.22 0.00 0.00 54.13 54.35 2jj2 s LEU 199 Cb -0.24 0.10 -0.09 0.00 0.50 0.00 0.00 46.19 46.46 2jj2 s LEU 199 CO 0.29 -0.27 0.85 -0.31 -1.32 0.00 0.00 176.35 175.59 2jj2 s TYR 200 N 2.24 3.77 -0.03 5.38 1.51 -0.87 -4.92 117.35 124.43 2jj2 s TYR 200 Ca 0.04 1.67 0.07 0.00 -1.01 0.00 0.00 57.07 57.84 2jj2 s TYR 200 Cb -0.13 -2.82 -0.02 0.00 -0.11 0.00 0.00 41.96 38.88 2jj2 s TYR 200 CO -0.06 0.34 -0.24 0.00 -1.11 0.00 0.00 175.55 174.47 2jj2 s ILE 202 N -0.51 1.60 -0.19 0.00 1.01 0.27 -0.71 121.20 122.68 2jj2 s ILE 202 Ca 0.07 -0.73 -0.01 0.00 0.00 0.00 0.00 60.65 59.98 2jj2 s ILE 202 Cb -0.11 -1.43 0.00 0.00 0.01 0.00 0.00 42.46 40.93 2jj2 s ILE 202 CO 0.00 0.46 -0.13 -0.47 0.00 0.00 0.00 174.94 174.80 2jj2 s TYR 203 N 0.75 2.84 -0.33 3.97 5.04 0.39 -1.02 117.35 128.99 2jj2 s TYR 203 Ca -0.11 -1.24 -0.08 0.00 -2.44 0.00 0.00 57.07 53.20 2jj2 s TYR 203 Cb -0.16 -1.97 0.02 0.00 0.35 0.00 0.00 41.96 40.20 2jj2 s TYR 203 CO 0.02 -0.62 0.13 0.08 -1.34 0.00 0.00 175.55 173.82 2jj2 s VAL 204 N 1.21 4.18 -0.31 3.14 1.01 0.29 -0.49 120.40 129.43 2jj2 s VAL 204 Ca 0.02 -0.81 -0.14 0.00 0.00 0.00 0.00 61.98 61.05 2jj2 s VAL 204 Cb -0.14 -3.25 -0.03 0.00 0.00 0.00 0.00 36.38 32.96 2jj2 s VAL 204 CO -0.06 -0.07 0.31 0.00 0.00 0.00 0.00 175.10 175.27 2jj2 s ALA 205 N 1.51 3.52 -0.22 5.51 0.00 0.13 -0.20 121.76 132.01 2jj2 s ALA 205 Ca 0.02 -1.11 0.00 0.00 0.00 0.00 0.00 51.96 50.86 2jj2 s ALA 205 Cb -0.18 -2.70 0.03 0.00 0.00 0.00 0.00 23.12 20.27 2jj2 s ALA 205 CO 0.04 -0.84 -0.13 0.42 0.00 0.00 0.00 175.76 175.25 2jj2 s ILE 206 N 1.93 2.41 0.00 0.00 1.09 0.34 -0.70 121.20 126.27 2jj2 s ILE 206 Ca 0.11 -1.06 0.00 0.00 -1.10 0.00 0.00 60.65 58.60 2jj2 s ILE 206 Cb -0.16 -2.16 0.00 0.00 -1.06 0.00 0.00 42.46 39.08 2jj2 s ILE 206 CO 0.11 0.33 0.00 0.61 -0.10 0.00 0.00 174.94 175.89 2jj2 n GLY 207 N 4.61 0.89 3.83 6.18 0.00 0.73 -3.52 105.19 117.91 2jj2 n GLY 207 Ca -0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.53 2jj2 n GLY 207 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jj2 s GLN 208 N -0.22 2.59 0.42 1.61 -0.21 -1.26 -3.87 119.66 118.73 2jj2 s GLN 208 Ca 0.00 0.71 -0.22 0.00 0.02 0.00 0.00 55.36 55.87 2jj2 s GLN 208 Cb 0.00 -1.97 -0.10 0.00 1.00 0.00 0.00 33.01 31.94 2jj2 s GLN 208 CO 0.00 -1.28 0.99 -1.59 -2.12 0.00 0.00 175.29 171.29 2jj2 s LYS 209 N -5.16 4.16 0.40 2.91 -2.85 -1.26 -0.92 119.74 117.01 2jj2 s LYS 209 Ca 0.59 1.28 0.10 0.00 -1.00 0.00 0.00 55.97 56.94 2jj2 s LYS 209 Cb -0.13 -2.31 0.89 0.00 -2.06 0.00 0.00 37.83 34.21 2jj2 s LYS 209 CO 0.54 -0.11 1.98 0.00 0.10 0.00 0.00 175.35 177.86 2jj2 h ARG 210 N 2.11 0.56 -0.11 1.78 3.08 -1.97 -2.19 114.38 117.62 2jj2 h ARG 210 Ca -0.49 -0.03 -0.13 0.00 0.07 0.00 0.00 59.98 59.39 2jj2 h ARG 210 Cb 1.20 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 31.11 2jj2 h ARG 210 CO 0.61 0.37 -0.52 0.66 -1.07 0.00 0.00 179.97 180.02 2jj2 h SER 211 N 0.57 0.34 -0.49 7.04 4.64 -1.99 0.30 113.55 123.97 2jj2 h SER 211 Ca 0.27 -0.17 -0.01 0.00 -0.47 0.00 0.00 61.79 61.41 2jj2 h SER 211 Cb 0.34 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 62.31 2jj2 h SER 211 CO -0.08 0.80 0.27 0.74 -0.87 0.00 0.00 176.83 177.69 2jj2 h THR 212 N 0.24 1.17 -0.39 2.95 2.02 -1.81 -1.95 112.91 115.15 2jj2 h THR 212 Ca 0.01 -0.44 -0.07 0.00 0.77 0.00 0.00 66.41 66.68 2jj2 h THR 212 Cb 1.00 0.57 -0.01 0.00 -1.74 0.00 0.00 68.15 67.96 2jj2 h THR 212 CO 0.08 0.18 -0.03 0.58 0.37 0.00 0.00 175.52 176.71 2jj2 h VAL 213 N 0.65 1.27 -0.23 3.16 2.07 -1.14 -1.38 116.25 120.63 2jj2 h VAL 213 Ca 0.17 -1.06 0.06 0.00 0.82 0.00 0.00 66.70 66.69 2jj2 h VAL 213 Cb 0.05 1.17 -0.07 0.00 -1.52 0.00 0.00 31.29 30.92 2jj2 h VAL 213 CO -0.03 0.35 -0.38 0.00 0.02 0.00 0.00 177.57 177.54 2jj2 h ALA 214 N 0.87 -0.43 -0.68 1.67 0.00 -0.76 0.58 119.26 120.52 2jj2 h ALA 214 Ca 0.11 0.03 0.13 0.00 0.00 0.00 0.00 54.91 55.18 2jj2 h ALA 214 Cb 0.51 0.75 -0.09 0.00 0.00 0.00 0.00 17.79 18.95 2jj2 h ALA 214 CO 0.03 -0.84 0.19 1.96 0.00 0.00 0.00 179.25 180.58 2jj2 h GLN 215 N -0.39 0.31 0.02 0.00 1.08 -1.28 -0.48 115.11 114.36 2jj2 h GLN 215 Ca 0.11 -0.02 0.03 0.00 -1.45 0.00 0.00 58.65 57.32 2jj2 h GLN 215 Cb 0.58 -0.07 -0.05 0.00 -0.05 0.00 0.00 27.48 27.89 2jj2 h GLN 215 CO -0.45 0.20 -0.33 1.25 -0.95 0.00 0.00 178.83 178.56 2jj2 h LEU 216 N 0.32 -0.99 -1.12 1.46 7.12 -0.01 -0.93 115.31 121.16 2jj2 h LEU 216 Ca 0.37 0.13 -0.08 0.00 0.13 0.00 0.00 57.88 58.43 2jj2 h LEU 216 Cb 0.57 0.39 -0.01 0.00 -0.53 0.00 0.00 40.66 41.08 2jj2 h LEU 216 CO -0.43 -0.40 -0.36 -0.37 -0.13 0.00 0.00 178.44 176.75 2jj2 h VAL 217 N -0.50 0.97 -0.17 1.05 -1.51 -0.37 -1.87 116.25 113.85 2jj2 h VAL 217 Ca 0.06 -1.39 -0.01 0.00 -1.23 0.00 0.00 66.70 64.13 2jj2 h VAL 217 Cb 0.57 1.82 -0.01 0.00 -2.13 0.00 0.00 31.29 31.54 2jj2 h VAL 217 CO -0.26 0.36 0.08 0.50 -1.23 0.00 0.00 177.57 177.02 2jj2 h LYS 218 N 0.00 0.24 -0.78 5.19 1.63 -0.80 0.65 116.57 122.71 2jj2 h LYS 218 Ca -0.00 -0.04 0.01 0.00 -0.85 0.00 0.00 60.65 59.77 2jj2 h LYS 218 Cb 0.79 -0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 32.34 2jj2 h LYS 218 CO 0.05 0.28 0.51 -0.09 -3.45 0.00 0.00 179.45 176.75 2jj2 h ARG 219 N 0.15 1.02 -0.13 1.90 9.65 -0.70 0.19 114.38 126.46 2jj2 h ARG 219 Ca 0.06 -0.06 -0.13 0.00 -1.10 0.00 0.00 59.98 58.74 2jj2 h ARG 219 Cb 0.12 -0.23 -0.01 0.00 -1.39 0.00 0.00 29.97 28.45 2jj2 h ARG 219 CO -0.01 0.68 -0.50 -0.07 2.80 0.00 0.00 179.97 182.88 2jj2 h LEU 220 N 1.05 0.37 -0.02 3.80 3.38 -1.21 -1.83 115.31 120.86 2jj2 h LEU 220 Ca 0.28 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 2jj2 h LEU 220 Cb -0.12 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.52 2jj2 h LEU 220 CO -0.06 0.81 -0.01 0.74 0.09 0.00 0.00 178.44 180.01 2jj2 h THR 221 N 0.27 1.32 -0.89 0.22 2.02 -0.33 0.38 112.91 115.91 2jj2 h THR 221 Ca 0.01 -0.95 0.11 0.00 0.77 0.00 0.00 66.41 66.36 2jj2 h THR 221 Cb 0.97 1.93 -0.07 0.00 -1.74 0.00 0.00 68.15 69.24 2jj2 h THR 221 CO 0.08 0.25 0.57 0.44 0.37 0.00 0.00 175.52 177.24 2jj2 h ASP 222 N -0.36 0.76 0.39 4.18 3.32 -0.64 0.44 116.42 124.52 2jj2 h ASP 222 Ca 0.00 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.08 2jj2 h ASP 222 Cb 0.41 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.83 2jj2 h ASP 222 CO 0.00 0.43 0.00 0.00 -1.72 0.00 0.00 179.24 177.95 2jj2 n ALA 223 N -2.41 2.54 -1.47 3.45 0.00 -0.69 -4.90 120.51 117.02 2jj2 n ALA 223 Ca 0.16 -0.16 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 2jj2 n ALA 223 Cb 0.36 -1.50 -0.05 0.00 0.00 0.00 0.00 19.45 18.26 2jj2 n ALA 223 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2jj2 n ASP 224 N -1.20 -4.62 0.10 0.00 2.03 0.14 -4.91 116.55 108.09 2jj2 n ASP 224 Ca 0.17 0.31 0.12 0.00 0.52 0.00 0.00 54.79 55.91 2jj2 n ASP 224 Cb 0.20 -3.37 0.20 0.00 -0.72 0.00 0.00 41.12 37.42 2jj2 n ASP 224 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jj2 h ALA 225 N 0.06 0.72 -0.28 -1.67 0.00 -0.47 -3.37 119.26 114.24 2jj2 h ALA 225 Ca -0.29 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 2jj2 h ALA 225 Cb 0.93 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 2jj2 h ALA 225 CO 0.41 0.00 0.05 0.52 0.00 0.00 0.00 179.25 180.23 2jj2 h MET 226 N 0.00 0.41 -0.02 0.00 2.86 -1.82 -2.96 114.93 113.40 2jj2 h MET 226 Ca 0.00 -0.06 0.01 0.00 -2.06 0.00 0.00 59.70 57.58 2jj2 h MET 226 Cb 0.82 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 32.40 2jj2 h MET 226 CO 0.00 0.40 0.10 1.57 1.06 0.00 0.00 176.91 180.04 2jj2 h LYS 227 N 0.41 0.00 -0.06 1.72 2.10 -1.91 0.78 116.57 119.61 2jj2 h LYS 227 Ca 0.10 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.75 2jj2 h LYS 227 Cb 0.20 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.53 2jj2 h LYS 227 CO -0.00 0.00 0.00 2.48 -2.00 0.00 0.00 179.45 179.93 2jj2 n TYR 228 N -3.22 0.17 -5.22 0.07 0.18 -1.12 -4.22 117.16 103.79 2jj2 n TYR 228 Ca -0.02 -0.83 -0.32 0.00 1.88 0.00 0.00 57.90 58.61 2jj2 n TYR 228 Cb 0.17 -0.14 -0.16 0.00 -0.38 0.00 0.00 39.34 38.82 2jj2 n TYR 228 CO 0.00 0.00 0.00 0.99 -2.08 0.00 0.00 176.86 175.77 2jj2 s THR 229 N -2.31 2.17 -0.21 -3.48 2.01 0.18 -0.90 115.64 113.10 2jj2 s THR 229 Ca 0.25 -1.03 -0.08 0.00 0.31 0.00 0.00 61.69 61.15 2jj2 s THR 229 Cb 0.21 -1.79 -0.04 0.00 0.01 0.00 0.00 72.50 70.89 2jj2 s THR 229 CO 0.04 0.57 0.08 -0.63 -0.69 0.00 0.00 174.62 173.99 2jj2 s ILE 230 N -0.16 4.78 -0.34 1.82 1.01 0.12 -0.74 121.20 127.70 2jj2 s ILE 230 Ca -0.04 -0.03 -0.09 0.00 0.00 0.00 0.00 60.65 60.50 2jj2 s ILE 230 Cb -0.14 -3.19 0.01 0.00 0.01 0.00 0.00 42.46 39.16 2jj2 s ILE 230 CO 0.04 0.41 0.16 -0.69 0.00 0.00 0.00 174.94 174.85 2jj2 s VAL 231 N 0.81 4.40 -0.24 2.92 1.01 -0.52 -0.46 120.40 128.32 2jj2 s VAL 231 Ca 0.04 -0.71 -0.10 0.00 0.00 0.00 0.00 61.98 61.21 2jj2 s VAL 231 Cb -0.13 -3.36 -0.05 0.00 0.00 0.00 0.00 36.38 32.84 2jj2 s VAL 231 CO 0.02 -0.08 0.14 -0.69 0.00 0.00 0.00 175.10 174.50 2jj2 s VAL 232 N 1.55 5.15 -0.20 2.92 1.01 0.35 -0.28 120.40 130.90 2jj2 s VAL 232 Ca 0.03 0.11 -0.02 0.00 0.00 0.00 0.00 61.98 62.09 2jj2 s VAL 232 Cb -0.18 -3.40 0.06 0.00 0.00 0.00 0.00 36.38 32.86 2jj2 s VAL 232 CO 0.05 0.34 0.03 -0.55 0.00 0.00 0.00 175.10 174.98 2jj2 s SER 233 N 1.15 3.07 -0.55 3.32 0.15 0.50 0.18 113.70 121.51 2jj2 s SER 233 Ca 0.07 -0.90 -0.02 0.00 0.70 0.00 0.00 55.95 55.80 2jj2 s SER 233 Cb -0.14 -0.67 0.14 0.00 -1.71 0.00 0.00 66.02 63.64 2jj2 s SER 233 CO 0.05 -0.30 0.35 0.00 1.20 0.00 0.00 173.24 174.54 2jj2 s ALA 234 N 1.80 3.43 0.90 5.45 0.00 0.13 -3.86 121.76 129.61 2jj2 s ALA 234 Ca -0.01 -3.07 -0.10 0.00 0.00 0.00 0.00 51.96 48.78 2jj2 s ALA 234 Cb -0.17 -2.52 0.19 0.00 0.00 0.00 0.00 23.12 20.61 2jj2 s ALA 234 CO -0.08 -2.01 1.15 0.25 0.00 0.00 0.00 175.76 175.07 2jj2 n THR 235 N 3.73 0.00 0.26 0.00 -2.24 -1.26 -0.19 114.28 114.58 2jj2 n THR 235 Ca 0.05 -1.13 0.10 0.00 -2.27 0.00 0.00 64.05 60.80 2jj2 n THR 235 Cb 0.38 -1.32 0.70 0.00 -2.10 0.00 0.00 70.33 68.00 2jj2 n THR 235 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jj2 h ALA 236 N -1.39 1.67 0.00 6.98 0.00 -1.14 -1.71 119.26 123.68 2jj2 h ALA 236 Ca -0.38 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2jj2 h ALA 236 Cb 1.14 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2jj2 h ALA 236 CO 0.31 0.08 -0.71 -1.13 0.00 0.00 0.00 179.25 177.79 2jj2 n SER 237 N -4.14 0.62 -4.77 0.00 3.41 -1.26 -4.91 113.62 102.58 2jj2 n SER 237 Ca -0.03 -0.30 -0.39 0.00 -0.26 0.00 0.00 58.87 57.89 2jj2 n SER 237 Cb 0.15 0.48 -0.02 0.00 -0.26 0.00 0.00 64.21 64.56 2jj2 n SER 237 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2jj2 s ASP 238 N -3.38 6.60 0.55 4.04 1.11 -0.64 -4.98 116.67 119.97 2jj2 s ASP 238 Ca 0.08 2.45 -0.20 0.00 0.18 0.00 0.00 52.55 55.06 2jj2 s ASP 238 Cb 0.16 -2.63 -0.06 0.00 1.07 0.00 0.00 42.92 41.46 2jj2 s ASP 238 CO 0.75 -0.63 0.95 0.00 1.18 0.00 0.00 175.17 177.42 2jj2 n ALA 239 N 0.31 0.13 -0.20 5.23 0.00 -1.26 -4.78 120.51 119.95 2jj2 n ALA 239 Ca 0.03 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2jj2 n ALA 239 Cb 0.45 -2.09 0.09 0.00 0.00 0.00 0.00 19.45 17.90 2jj2 n ALA 239 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jj2 h ALA 240 N 0.76 0.57 -0.53 0.00 0.00 -1.91 -1.43 119.26 116.71 2jj2 h ALA 240 Ca -0.47 0.19 0.12 0.00 0.00 0.00 0.00 54.91 54.74 2jj2 h ALA 240 Cb 1.36 0.32 -0.03 0.00 0.00 0.00 0.00 17.79 19.44 2jj2 h ALA 240 CO 0.52 -0.39 0.36 -1.35 0.00 0.00 0.00 179.25 178.39 2jj2 h PRO 241 N 0.11 0.19 -0.24 0.00 0.11 -1.87 -1.78 132.00 128.52 2jj2 h PRO 241 Ca 0.31 -0.01 -0.20 0.00 0.11 0.00 0.00 66.00 66.20 2jj2 h PRO 241 Cb 0.49 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.56 2jj2 h PRO 241 CO -0.51 0.13 -0.64 -0.07 -0.21 0.00 0.00 178.00 176.70 2jj2 h LEU 242 N 0.20 0.97 -1.04 2.35 3.38 -1.60 -1.56 115.31 118.01 2jj2 h LEU 242 Ca 0.25 -0.56 -0.09 0.00 0.09 0.00 0.00 57.88 57.56 2jj2 h LEU 242 Cb 0.71 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 2jj2 h LEU 242 CO -0.04 1.37 -0.33 1.56 0.09 0.00 0.00 178.44 181.08 2jj2 h GLN 243 N 0.63 0.26 -0.49 1.13 4.20 -1.34 -0.72 115.11 118.78 2jj2 h GLN 243 Ca -0.01 -0.11 -0.04 0.00 0.06 0.00 0.00 58.65 58.55 2jj2 h GLN 243 Cb 1.25 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 29.00 2jj2 h GLN 243 CO 0.14 0.57 0.13 -0.92 -0.67 0.00 0.00 178.83 178.08 2jj2 h TYR 244 N 0.23 0.82 0.00 2.96 3.20 -1.30 -3.27 116.97 119.61 2jj2 h TYR 244 Ca 0.03 -0.09 -0.17 0.00 3.14 0.00 0.00 58.73 61.64 2jj2 h TYR 244 Cb 0.71 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.72 2jj2 h TYR 244 CO 0.01 0.72 -0.80 -0.07 -1.64 0.00 0.00 178.16 176.39 2jj2 h LEU 245 N 0.67 0.01 -0.39 2.82 3.38 -0.90 -3.39 115.31 117.51 2jj2 h LEU 245 Ca 0.16 -0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.20 2jj2 h LEU 245 Cb 0.31 -0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.97 2jj2 h LEU 245 CO -0.00 0.81 -0.23 0.00 0.09 0.00 0.00 178.44 179.10 2jj2 h ALA 246 N 1.19 0.01 -0.99 1.53 0.00 -1.19 0.09 119.26 119.91 2jj2 h ALA 246 Ca -0.01 0.13 0.13 0.00 0.00 0.00 0.00 54.91 55.16 2jj2 h ALA 246 Cb 1.41 0.54 -0.09 0.00 0.00 0.00 0.00 17.79 19.66 2jj2 h ALA 246 CO 0.10 -0.61 0.62 -1.35 0.00 0.00 0.00 179.25 178.02 2jj2 h PRO 247 N -0.17 0.91 -0.44 0.00 0.11 -1.78 -1.26 132.00 129.37 2jj2 h PRO 247 Ca 0.19 -0.05 -0.13 0.00 0.11 0.00 0.00 66.00 66.11 2jj2 h PRO 247 Cb 0.46 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.36 2jj2 h PRO 247 CO -0.49 0.60 -0.24 1.88 -0.21 0.00 0.00 178.00 179.54 2jj2 h TYR 248 N 0.93 1.05 0.27 0.65 -1.99 -1.27 -0.58 116.97 116.03 2jj2 h TYR 248 Ca 0.50 -0.26 -0.01 0.00 2.00 0.00 0.00 58.73 60.96 2jj2 h TYR 248 Cb 0.57 -0.24 0.00 0.00 2.00 0.00 0.00 36.73 39.06 2jj2 h TYR 248 CO -0.00 1.05 -0.13 0.77 -0.00 0.00 0.00 178.16 179.85 2jj2 h SER 249 N 0.78 -0.30 -0.75 3.88 0.02 -0.60 -0.44 113.55 116.14 2jj2 h SER 249 Ca 0.10 -0.07 0.10 0.00 -0.84 0.00 0.00 61.79 61.07 2jj2 h SER 249 Cb 0.80 0.08 -0.07 0.00 0.14 0.00 0.00 62.40 63.35 2jj2 h SER 249 CO 0.07 -0.12 0.39 1.23 -1.14 0.00 0.00 176.83 177.26 2jj2 h GLY 250 N -0.48 1.14 0.46 -3.77 0.00 -1.28 -2.46 103.07 96.69 2jj2 h GLY 250 Ca -0.04 -0.24 0.07 0.00 0.00 0.00 0.00 47.33 47.12 2jj2 h GLY 250 CO 0.06 0.06 0.13 0.00 0.00 0.00 0.00 176.54 176.79 2jj2 h SER 252 N 0.28 0.66 0.22 0.00 0.02 -0.65 -0.00 113.55 114.08 2jj2 h SER 252 Ca 0.23 -0.10 -0.07 0.00 -0.84 0.00 0.00 61.79 61.01 2jj2 h SER 252 Cb 0.28 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 2jj2 h SER 252 CO -0.28 0.64 -0.29 0.24 -1.14 0.00 0.00 176.83 176.00 2jj2 h MET 253 N 0.70 0.12 0.00 3.45 2.86 -0.97 -2.47 114.93 118.61 2jj2 h MET 253 Ca 0.16 -0.04 -0.20 0.00 -2.06 0.00 0.00 59.70 57.57 2jj2 h MET 253 Cb 0.22 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.85 2jj2 h MET 253 CO -0.01 0.41 -0.94 0.78 1.06 0.00 0.00 176.91 178.21 2jj2 h GLY 254 N 0.98 0.00 1.92 8.32 0.00 -0.53 -3.28 103.07 110.47 2jj2 h GLY 254 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.24 2jj2 h GLY 254 CO 0.04 0.00 -0.45 0.83 0.00 0.00 0.00 176.54 176.96 2jj2 h GLU 255 N 0.00 0.09 -0.96 4.80 5.08 -0.68 -1.34 114.58 121.57 2jj2 h GLU 255 Ca -0.01 -0.04 0.07 0.00 -1.00 0.00 0.00 59.36 58.37 2jj2 h GLU 255 Cb 1.68 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.86 2jj2 h GLU 255 CO 0.12 0.52 0.61 -0.92 -1.00 0.00 0.00 179.01 178.35 2jj2 h TYR 256 N 0.07 1.14 0.11 4.33 3.20 -1.51 0.24 116.97 124.55 2jj2 h TYR 256 Ca 0.00 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.90 2jj2 h TYR 256 Cb 0.83 -0.37 0.00 0.00 1.54 0.00 0.00 36.73 38.73 2jj2 h TYR 256 CO 0.01 0.58 -0.05 0.74 -1.64 0.00 0.00 178.16 177.79 2jj2 h PHE 257 N 1.11 -0.14 -0.83 -3.82 -1.00 -1.57 -3.12 116.94 107.58 2jj2 h PHE 257 Ca 0.42 -0.00 0.19 0.00 2.81 0.00 0.00 57.97 61.39 2jj2 h PHE 257 Cb 0.18 0.04 -0.12 0.00 3.61 0.00 0.00 35.95 39.67 2jj2 h PHE 257 CO -0.01 0.33 0.29 -0.09 -1.61 0.00 0.00 178.31 177.22 2jj2 h ARG 258 N -0.69 0.33 0.00 1.51 2.43 -0.93 -1.49 114.38 115.54 2jj2 h ARG 258 Ca -0.01 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2jj2 h ARG 258 Cb 0.53 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 2jj2 h ARG 258 CO 0.02 0.22 0.00 -0.25 -1.51 0.00 0.00 179.97 178.45 2jj2 n ASP 259 N -5.10 0.54 -2.04 -3.80 8.00 0.83 -3.64 116.55 111.33 2jj2 n ASP 259 Ca 0.18 0.56 -0.25 0.00 0.71 0.00 0.00 54.79 56.00 2jj2 n ASP 259 Cb 0.56 -0.70 0.03 0.00 -0.02 0.00 0.00 41.12 41.00 2jj2 n ASP 259 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2jj2 n ASN 260 N -2.02 5.32 -0.12 -2.24 3.02 -0.64 -4.81 115.26 113.78 2jj2 n ASN 260 Ca 0.05 -3.76 -0.02 0.00 -0.03 0.00 0.00 54.58 50.83 2jj2 n ASN 260 Cb 0.37 -0.45 -0.01 0.00 -0.61 0.00 0.00 39.78 39.08 2jj2 n ASN 260 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jj2 n GLY 261 N -0.75 0.41 3.62 7.41 0.00 -1.24 -4.99 105.19 109.64 2jj2 n GLY 261 Ca 0.47 -0.10 -0.24 0.00 0.00 0.00 0.00 46.02 46.15 2jj2 n GLY 261 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jj2 s LYS 262 N -1.21 2.10 -0.06 1.61 1.02 -0.70 -4.45 119.74 118.05 2jj2 s LYS 262 Ca 0.00 -1.64 0.01 0.00 0.02 0.00 0.00 55.97 54.35 2jj2 s LYS 262 Cb 0.00 -1.99 -0.03 0.00 -0.52 0.00 0.00 37.83 35.29 2jj2 s LYS 262 CO 0.00 0.23 -0.05 -1.01 -0.92 0.00 0.00 175.35 173.60 2jj2 s HIS 263 N -2.46 2.98 0.03 3.18 3.76 -1.26 -1.34 115.29 120.19 2jj2 s HIS 263 Ca 0.33 0.05 0.01 0.00 -0.15 0.00 0.00 55.06 55.31 2jj2 s HIS 263 Cb -0.03 -1.71 -0.02 0.00 1.11 0.00 0.00 32.58 31.94 2jj2 s HIS 263 CO 0.19 0.37 -0.06 0.00 -0.85 0.00 0.00 174.74 174.40 2jj2 s ALA 264 N -0.87 0.41 -0.10 -1.40 0.00 -0.63 -2.05 121.76 117.13 2jj2 s ALA 264 Ca 0.14 -0.61 0.03 0.00 0.00 0.00 0.00 51.96 51.51 2jj2 s ALA 264 Cb -0.11 0.05 -0.01 0.00 0.00 0.00 0.00 23.12 23.05 2jj2 s ALA 264 CO 0.03 -0.04 -0.19 -1.17 0.00 0.00 0.00 175.76 174.40 2jj2 s LEU 265 N -1.28 2.40 -0.07 0.00 2.96 0.13 -0.73 118.68 122.09 2jj2 s LEU 265 Ca -0.09 -0.42 0.03 0.00 -0.22 0.00 0.00 54.13 53.43 2jj2 s LEU 265 Cb -0.08 -1.50 0.01 0.00 0.50 0.00 0.00 46.19 45.12 2jj2 s LEU 265 CO -0.00 0.20 -0.17 -0.51 -1.32 0.00 0.00 176.35 174.55 2jj2 s ILE 266 N 0.12 1.51 -0.16 6.68 2.07 0.47 0.95 121.20 132.83 2jj2 s ILE 266 Ca -0.09 -0.71 -0.03 0.00 -1.41 0.00 0.00 60.65 58.41 2jj2 s ILE 266 Cb -0.15 -1.33 -0.02 0.00 0.13 0.00 0.00 42.46 41.08 2jj2 s ILE 266 CO 0.06 0.44 -0.06 -0.63 -1.91 0.00 0.00 174.94 172.83 2jj2 s ILE 267 N 0.45 3.59 -0.44 2.00 1.09 -0.19 0.03 121.20 127.73 2jj2 s ILE 267 Ca -0.14 -0.46 -0.09 0.00 -1.10 0.00 0.00 60.65 58.86 2jj2 s ILE 267 Cb -0.16 -2.57 0.10 0.00 -1.06 0.00 0.00 42.46 38.77 2jj2 s ILE 267 CO 0.05 0.48 0.29 -0.31 -0.10 0.00 0.00 174.94 175.36 2jj2 s TYR 268 N 0.59 3.40 -0.51 3.97 4.12 -1.05 -0.54 117.35 127.32 2jj2 s TYR 268 Ca -0.04 -1.76 0.04 0.00 0.02 0.00 0.00 57.07 55.32 2jj2 s TYR 268 Cb -0.15 -3.21 0.13 0.00 -1.52 0.00 0.00 41.96 37.21 2jj2 s TYR 268 CO 0.03 -0.92 0.26 0.34 0.02 0.00 0.00 175.55 175.28 2jj2 s ASP 269 N 2.34 4.16 0.24 2.29 -1.08 0.72 -0.88 116.67 124.46 2jj2 s ASP 269 Ca 0.05 -2.96 0.01 0.00 -0.52 0.00 0.00 52.55 49.13 2jj2 s ASP 269 Cb -0.24 -1.49 -0.05 0.00 -1.46 0.00 0.00 42.92 39.68 2jj2 s ASP 269 CO 0.00 -0.23 0.09 1.51 0.52 0.00 0.00 175.17 177.06 2jj2 s ASP 270 N -0.18 1.09 0.29 -0.34 1.47 -1.23 -0.51 116.67 117.25 2jj2 s ASP 270 Ca 0.18 -1.36 0.18 0.00 1.18 0.00 0.00 52.55 52.73 2jj2 s ASP 270 Cb -0.25 0.18 0.11 0.00 -0.34 0.00 0.00 42.92 42.62 2jj2 s ASP 270 CO -0.01 -0.72 1.38 -0.07 0.68 0.00 0.00 175.17 176.43 2jj2 h LEU 271 N 2.45 0.00 -0.71 2.11 3.38 -1.29 -2.99 115.31 118.26 2jj2 h LEU 271 Ca -0.38 0.00 0.09 0.00 0.09 0.00 0.00 57.88 57.69 2jj2 h LEU 271 Cb 1.24 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.92 2jj2 h LEU 271 CO 0.60 0.33 0.35 0.28 0.09 0.00 0.00 178.44 180.10 2jj2 h SER 272 N 0.00 0.46 0.08 -0.43 0.02 -1.92 -1.44 113.55 110.31 2jj2 h SER 272 Ca -0.02 0.06 -0.26 0.00 -0.84 0.00 0.00 61.79 60.73 2jj2 h SER 272 Cb 1.27 -0.01 0.02 0.00 0.14 0.00 0.00 62.40 63.82 2jj2 h SER 272 CO 0.04 0.26 -1.05 0.11 -1.14 0.00 0.00 176.83 175.05 2jj2 h LYS 273 N 0.60 0.64 -0.36 3.45 1.57 -1.86 -2.73 116.57 117.89 2jj2 h LYS 273 Ca 0.35 -0.71 0.06 0.00 -1.87 0.00 0.00 60.65 58.48 2jj2 h LYS 273 Cb 0.38 0.20 -0.05 0.00 0.08 0.00 0.00 32.23 32.84 2jj2 h LYS 273 CO -0.27 1.29 0.05 0.37 -0.57 0.00 0.00 179.45 180.32 2jj2 h GLN 274 N 0.35 0.16 -0.89 3.15 4.15 -1.46 -1.44 115.11 119.13 2jj2 h GLN 274 Ca -0.13 -0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.27 2jj2 h GLN 274 Cb 1.70 -0.04 -0.04 0.00 0.21 0.00 0.00 27.48 29.31 2jj2 h GLN 274 CO 0.20 0.11 0.50 0.00 -1.93 0.00 0.00 178.83 177.70 2jj2 h ALA 275 N 1.28 1.19 -0.69 3.38 0.00 -1.25 -1.06 119.26 122.10 2jj2 h ALA 275 Ca 0.17 -0.13 0.06 0.00 0.00 0.00 0.00 54.91 55.01 2jj2 h ALA 275 Cb 0.21 -0.36 -0.05 0.00 0.00 0.00 0.00 17.79 17.58 2jj2 h ALA 275 CO -0.24 0.65 0.39 0.28 0.00 0.00 0.00 179.25 180.34 2jj2 h VAL 276 N 1.24 0.98 -0.48 0.00 2.07 -1.18 0.14 116.25 119.03 2jj2 h VAL 276 Ca 0.31 -0.25 -0.00 0.00 0.82 0.00 0.00 66.70 67.58 2jj2 h VAL 276 Cb 0.01 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 29.95 2jj2 h VAL 276 CO -0.05 0.13 0.30 0.00 0.02 0.00 0.00 177.57 177.97 2jj2 h ALA 277 N 1.35 0.62 -0.17 1.67 0.00 -0.22 -1.68 119.26 120.82 2jj2 h ALA 277 Ca 0.31 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 2jj2 h ALA 277 Cb 0.18 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2jj2 h ALA 277 CO -0.18 0.09 -0.02 -0.92 0.00 0.00 0.00 179.25 178.22 2jj2 h TYR 278 N 0.65 0.35 -0.90 0.00 3.20 -0.89 -2.61 116.97 116.77 2jj2 h TYR 278 Ca 0.17 -0.07 0.24 0.00 3.14 0.00 0.00 58.73 62.21 2jj2 h TYR 278 Cb -0.03 -0.09 -0.13 0.00 1.54 0.00 0.00 36.73 38.02 2jj2 h TYR 278 CO -0.03 0.56 0.35 -0.09 -1.64 0.00 0.00 178.16 177.31 2jj2 h ARG 279 N 0.04 0.31 0.20 1.82 2.43 -0.62 -0.14 114.38 118.42 2jj2 h ARG 279 Ca 0.05 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.20 2jj2 h ARG 279 Cb 0.44 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.90 2jj2 h ARG 279 CO 0.01 0.21 -0.21 0.37 -1.51 0.00 0.00 179.97 178.84 2jj2 h GLN 280 N 0.32 -0.43 -0.13 0.20 4.15 -0.93 -1.62 115.11 116.67 2jj2 h GLN 280 Ca 0.57 0.03 0.03 0.00 0.77 0.00 0.00 58.65 60.06 2jj2 h GLN 280 Cb 1.15 0.10 -0.03 0.00 0.21 0.00 0.00 27.48 28.90 2jj2 h GLN 280 CO -0.58 -0.29 -0.08 0.52 -1.93 0.00 0.00 178.83 176.47 2jj2 h MET 281 N -0.45 -0.08 -0.54 1.69 2.86 -1.00 -2.03 114.93 115.38 2jj2 h MET 281 Ca 0.00 0.01 -0.06 0.00 -2.06 0.00 0.00 59.70 57.59 2jj2 h MET 281 Cb 0.43 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.08 2jj2 h MET 281 CO -0.06 -0.05 0.12 0.77 1.06 0.00 0.00 176.91 178.74 2jj2 h SER 282 N -0.08 0.83 -0.68 1.22 0.02 -0.86 -0.11 113.55 113.89 2jj2 h SER 282 Ca 0.08 -0.24 -0.02 0.00 -0.84 0.00 0.00 61.79 60.77 2jj2 h SER 282 Cb 0.20 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.48 2jj2 h SER 282 CO -0.18 0.86 0.36 -0.07 -1.14 0.00 0.00 176.83 176.67 2jj2 h LEU 283 N 0.77 0.86 -0.32 5.07 3.38 -1.24 0.11 115.31 123.94 2jj2 h LEU 283 Ca 0.17 -0.10 -0.14 0.00 0.09 0.00 0.00 57.88 57.90 2jj2 h LEU 283 Cb 0.36 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 2jj2 h LEU 283 CO 0.00 0.72 -0.66 -0.07 0.09 0.00 0.00 178.44 178.52 2jj2 h LEU 284 N 0.94 0.00 0.00 1.67 3.38 -1.02 -1.52 115.31 118.77 2jj2 h LEU 284 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 2jj2 h LEU 284 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 2jj2 h LEU 284 CO -0.04 0.66 0.00 0.18 0.09 0.00 0.00 178.44 179.33 2jj2 n LEU 285 N -3.42 0.00 -1.35 1.67 4.77 -0.09 -4.90 117.00 113.69 2jj2 n LEU 285 Ca 0.00 0.07 -0.13 0.00 -0.03 0.00 0.00 56.01 55.93 2jj2 n LEU 285 Cb 0.74 -0.07 -0.02 0.00 -2.33 0.00 0.00 43.42 41.73 2jj2 n LEU 285 CO 0.42 -0.01 -0.15 0.54 -1.33 0.00 0.00 177.39 176.85 2jj2 n ARG 286 N -1.07 -1.00 -2.10 3.23 1.74 -0.57 -5.02 116.66 111.87 2jj2 n ARG 286 Ca 0.18 0.71 -0.34 0.00 -0.77 0.00 0.00 57.85 57.63 2jj2 n ARG 286 Cb 0.12 -4.88 0.02 0.00 -1.02 0.00 0.00 32.46 26.69 2jj2 n ARG 286 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2jj2 s ARG 287 N -4.24 3.17 0.25 5.56 0.52 0.32 -4.95 118.95 119.58 2jj2 s ARG 287 Ca 0.00 1.55 -0.30 0.00 -0.52 0.00 0.00 55.73 56.45 2jj2 s ARG 287 Cb 0.00 -1.99 -0.11 0.00 0.52 0.00 0.00 34.95 33.37 2jj2 s ARG 287 CO 0.00 -0.98 1.57 -2.14 0.02 0.00 0.00 175.30 173.77 2jj2 s PRO 288 N -3.53 4.17 0.27 3.54 0.02 -1.26 -4.53 135.00 133.68 2jj2 s PRO 288 Ca 0.71 2.48 -0.26 0.00 0.02 0.00 0.00 61.00 63.95 2jj2 s PRO 288 Cb -0.23 -3.07 -0.09 0.00 0.02 0.00 0.00 34.50 31.12 2jj2 s PRO 288 CO 0.32 -0.59 0.89 -1.25 -0.33 0.00 0.00 177.00 176.04 2jj2 s PRO 289 N 0.01 4.60 0.00 5.54 0.04 -1.26 -4.50 135.00 139.44 2jj2 s PRO 289 Ca 0.65 1.28 0.00 0.00 0.04 0.00 0.00 61.00 62.97 2jj2 s PRO 289 Cb -0.46 -2.99 0.00 0.00 0.04 0.00 0.00 34.50 31.10 2jj2 s PRO 289 CO 0.42 0.39 0.00 0.41 0.04 0.00 0.00 177.00 178.26 2jj2 n GLY 290 N 0.94 4.90 3.68 0.56 0.00 0.62 -4.93 105.19 110.96 2jj2 n GLY 290 Ca -0.01 -1.69 -0.45 0.00 0.00 0.00 0.00 46.02 43.88 2jj2 n GLY 290 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2jj2 n ARG 291 N 0.00 2.23 -2.06 1.61 0.63 -1.26 -0.84 116.66 116.97 2jj2 n ARG 291 Ca 0.00 0.80 -0.16 0.00 -0.92 0.00 0.00 57.85 57.56 2jj2 n ARG 291 Cb 0.00 -2.54 -0.03 0.00 0.45 0.00 0.00 32.46 30.34 2jj2 n ARG 291 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 2jj2 n GLU 292 N 2.88 -1.73 -1.20 -0.14 1.02 -1.26 -1.41 120.64 118.79 2jj2 n GLU 292 Ca 0.14 0.87 -0.07 0.00 -0.02 0.00 0.00 57.16 58.08 2jj2 n GLU 292 Cb 0.31 -5.37 -0.03 0.00 -0.02 0.00 0.00 31.44 26.32 2jj2 n GLU 292 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2jj2 n ALA 293 N -0.97 -0.11 -1.89 0.62 0.00 -0.02 -5.00 120.51 113.14 2jj2 n ALA 293 Ca -0.18 0.11 -0.33 0.00 0.00 0.00 0.00 53.44 53.04 2jj2 n ALA 293 Cb 0.61 -1.43 -0.06 0.00 0.00 0.00 0.00 19.45 18.57 2jj2 n ALA 293 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2jj2 s TYR 294 N -1.80 3.35 0.71 0.00 1.51 -0.50 -4.44 117.35 116.18 2jj2 s TYR 294 Ca 0.00 1.50 -0.09 0.00 -1.01 0.00 0.00 57.07 57.47 2jj2 s TYR 294 Cb 0.00 -2.77 0.05 0.00 -0.11 0.00 0.00 41.96 39.13 2jj2 s TYR 294 CO 0.00 -0.11 1.05 -1.25 -1.11 0.00 0.00 175.55 174.14 2jj2 s PRO 295 N -3.29 2.36 0.41 -1.71 0.04 -1.26 -0.27 135.00 131.28 2jj2 s PRO 295 Ca 0.60 0.01 0.29 0.00 0.04 0.00 0.00 61.00 61.93 2jj2 s PRO 295 Cb -0.09 -2.10 1.27 0.00 0.04 0.00 0.00 34.50 33.61 2jj2 s PRO 295 CO 0.17 -1.21 1.86 0.78 0.04 0.00 0.00 177.00 178.64 2jj2 h GLY 296 N -0.66 0.00 -2.63 0.56 0.00 -1.97 -2.89 103.07 95.48 2jj2 h GLY 296 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 2jj2 h GLY 296 CO 0.63 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.26 2jj2 n ASP 297 N -2.62 3.94 0.12 0.19 5.75 -1.26 -4.51 116.55 118.15 2jj2 n ASP 297 Ca 0.01 -2.21 -0.01 0.00 -0.01 0.00 0.00 54.79 52.57 2jj2 n ASP 297 Cb 0.22 -0.50 0.07 0.00 -1.03 0.00 0.00 41.12 39.88 2jj2 n ASP 297 CO 0.00 0.00 0.00 1.62 -0.11 0.00 0.00 177.20 178.71 2jj2 h VAL 298 N 3.76 1.32 0.20 2.12 3.04 -1.90 0.22 116.25 125.01 2jj2 h VAL 298 Ca 0.00 -2.50 -0.01 0.00 -1.01 0.00 0.00 66.70 63.18 2jj2 h VAL 298 Cb 1.12 2.42 0.00 0.00 -2.01 0.00 0.00 31.29 32.81 2jj2 h VAL 298 CO 0.11 0.67 -0.10 0.15 -1.01 0.00 0.00 177.57 177.40 2jj2 h PHE 299 N 0.00 -0.25 -0.63 3.17 3.57 -1.84 -2.98 116.94 117.99 2jj2 h PHE 299 Ca -0.01 -0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.61 2jj2 h PHE 299 Cb 1.36 0.08 -0.12 0.00 2.79 0.00 0.00 35.95 40.06 2jj2 h PHE 299 CO 0.00 0.03 -0.20 -0.92 -2.23 0.00 0.00 178.31 175.00 2jj2 h TYR 300 N -0.53 -0.46 -0.74 0.41 3.20 -1.80 0.32 116.97 117.37 2jj2 h TYR 300 Ca -0.03 0.06 0.12 0.00 3.14 0.00 0.00 58.73 62.03 2jj2 h TYR 300 Cb 0.40 0.30 -0.13 0.00 1.54 0.00 0.00 36.73 38.83 2jj2 h TYR 300 CO 0.01 -0.30 -0.35 1.25 -1.64 0.00 0.00 178.16 177.12 2jj2 h LEU 301 N -0.04 -1.26 0.00 2.82 5.85 -0.95 -0.27 115.31 121.46 2jj2 h LEU 301 Ca 0.29 0.26 -0.25 0.00 0.84 0.00 0.00 57.88 59.02 2jj2 h LEU 301 Cb 0.49 0.64 0.00 0.00 0.37 0.00 0.00 40.66 42.17 2jj2 h LEU 301 CO -0.66 -0.30 -1.12 0.45 -0.34 0.00 0.00 178.44 176.46 2jj2 h HIS 302 N -0.10 0.53 -0.61 1.25 3.86 -1.10 -3.19 115.15 115.79 2jj2 h HIS 302 Ca 0.27 -0.35 -0.09 0.00 -1.16 0.00 0.00 60.37 59.05 2jj2 h HIS 302 Cb 0.57 -0.04 -0.02 0.00 1.06 0.00 0.00 27.41 28.98 2jj2 h HIS 302 CO -0.72 1.22 0.04 0.66 0.86 0.00 0.00 177.93 179.99 2jj2 h SER 303 N 0.13 1.01 1.30 2.45 4.64 -0.04 -0.94 113.55 122.11 2jj2 h SER 303 Ca -0.11 -0.29 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 2jj2 h SER 303 Cb 1.81 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 63.63 2jj2 h SER 303 CO 0.19 1.05 0.00 0.08 -0.87 0.00 0.00 176.83 177.27 2jj2 h ARG 304 N 0.94 0.00 0.01 4.77 0.11 -1.16 -1.75 114.38 117.30 2jj2 h ARG 304 Ca 0.18 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.26 2jj2 h ARG 304 Cb 0.50 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.58 2jj2 h ARG 304 CO 0.02 0.00 -0.00 1.25 0.10 0.00 0.00 179.97 181.34 2jj2 h LEU 305 N 0.00 -0.01 -0.93 0.08 5.85 -1.43 -3.37 115.31 115.50 2jj2 h LEU 305 Ca 0.00 -0.84 -0.01 0.00 0.84 0.00 0.00 57.88 57.86 2jj2 h LEU 305 Cb 0.65 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.68 2jj2 h LEU 305 CO 0.00 0.86 -0.07 -0.07 -0.34 0.00 0.00 178.44 178.83 2jj2 h LEU 306 N -0.90 0.00 -0.63 2.25 3.38 -1.13 -2.71 115.31 115.57 2jj2 h LEU 306 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2jj2 h LEU 306 Cb 0.85 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.60 2jj2 h LEU 306 CO 0.00 0.07 0.00 -0.33 0.09 0.00 0.00 178.44 178.27 2jj2 h GLU 307 N 0.00 0.00 0.00 1.13 4.39 -1.48 -3.04 114.58 115.57 2jj2 h GLU 307 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2jj2 h GLU 307 Cb 0.73 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.38 2jj2 h GLU 307 CO 0.01 0.00 0.00 0.00 -1.16 0.00 0.00 179.01 177.86 2jj2 h ARG 308 N 0.00 0.00 -6.68 2.33 3.08 -1.63 -3.42 114.38 108.05 2jj2 h ARG 308 Ca 0.00 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.53 2jj2 h ARG 308 Cb 0.55 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.63 2jj2 h ARG 308 CO 0.00 0.00 0.62 0.00 -1.07 0.00 0.00 179.97 179.52 2jj2 s ALA 309 N -3.27 3.49 -0.02 0.04 0.00 -1.15 -4.83 121.76 116.03 2jj2 s ALA 309 Ca 0.07 1.06 -0.29 0.00 0.00 0.00 0.00 51.96 52.80 2jj2 s ALA 309 Cb 0.09 -3.46 0.09 0.00 0.00 0.00 0.00 23.12 19.84 2jj2 s ALA 309 CO 0.56 -0.48 0.77 0.00 0.00 0.00 0.00 175.76 176.61 2jj2 s ALA 310 N -0.01 -1.77 -0.39 0.00 0.00 -0.62 -4.93 121.76 114.04 2jj2 s ALA 310 Ca 0.55 1.12 -0.10 0.00 0.00 0.00 0.00 51.96 53.54 2jj2 s ALA 310 Cb -0.35 0.14 0.05 0.00 0.00 0.00 0.00 23.12 22.95 2jj2 s ALA 310 CO 0.38 -0.51 0.21 0.21 0.00 0.00 0.00 175.76 176.05 2jj2 s LYS 311 N -2.13 2.72 0.50 0.00 2.47 -1.26 -1.01 119.74 121.02 2jj2 s LYS 311 Ca -0.03 -1.23 -0.19 0.00 -1.56 0.00 0.00 55.97 52.96 2jj2 s LYS 311 Cb -0.01 -3.71 -0.08 0.00 -1.46 0.00 0.00 37.83 32.57 2jj2 s LYS 311 CO -0.01 -0.79 1.02 -1.64 0.16 0.00 0.00 175.35 174.10 2jj2 s MET 312 N 1.49 3.79 0.87 4.03 -1.94 -0.51 -2.38 119.30 124.65 2jj2 s MET 312 Ca 0.02 1.27 -0.14 0.00 -1.71 0.00 0.00 55.69 55.13 2jj2 s MET 312 Cb -0.21 -2.10 0.13 0.00 2.01 0.00 0.00 34.83 34.66 2jj2 s MET 312 CO 0.05 -0.43 1.23 0.54 -0.01 0.00 0.00 175.02 176.40 2jj2 s ASN 313 N -2.24 3.95 0.29 3.03 2.20 0.42 -4.24 114.94 118.34 2jj2 s ASN 313 Ca 0.65 0.59 -0.01 0.00 -0.94 0.00 0.00 52.86 53.15 2jj2 s ASN 313 Cb -0.15 -0.91 0.42 0.00 -2.00 0.00 0.00 41.25 38.62 2jj2 s ASN 313 CO 0.23 -2.24 1.87 0.44 -2.94 0.00 0.00 177.10 174.46 2jj2 h ASP 314 N -1.29 0.82 -0.42 3.54 3.32 -1.90 -0.75 116.42 119.73 2jj2 h ASP 314 Ca -0.45 -0.11 0.12 0.00 0.02 0.00 0.00 57.03 56.61 2jj2 h ASP 314 Cb 1.29 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 40.62 2jj2 h ASP 314 CO 0.55 0.73 0.33 0.00 -1.72 0.00 0.00 179.24 179.13 2jj2 h ALA 315 N 1.39 2.32 -0.53 3.45 0.00 -1.95 -1.97 119.26 121.98 2jj2 h ALA 315 Ca 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2jj2 h ALA 315 Cb 0.17 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2jj2 h ALA 315 CO -0.02 -0.55 0.00 1.19 0.00 0.00 0.00 179.25 179.88 2jj2 n PHE 316 N -4.24 1.45 0.00 0.00 3.01 -0.39 -4.94 117.46 112.35 2jj2 n PHE 316 Ca 0.07 -0.69 0.00 0.00 1.01 0.00 0.00 57.45 57.84 2jj2 n PHE 316 Cb 0.52 -0.31 0.00 0.00 -0.01 0.00 0.00 39.48 39.68 2jj2 n PHE 316 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2jj2 n GLY 317 N 0.61 2.97 2.19 1.37 0.00 -0.74 -4.47 105.19 107.12 2jj2 n GLY 317 Ca 0.24 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.26 2jj2 n GLY 317 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jj2 n GLY 318 N -1.06 0.41 3.64 -0.02 0.00 -0.60 -4.20 105.19 103.36 2jj2 n GLY 318 Ca 0.00 -0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2jj2 n GLY 318 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jj2 s GLY 319 N -2.00 1.59 0.11 -0.02 0.00 -1.24 -4.65 107.32 101.10 2jj2 s GLY 319 Ca 0.00 -0.80 -0.15 0.00 0.00 0.00 0.00 44.72 43.77 2jj2 s GLY 319 CO 0.00 -0.00 0.37 -1.35 0.00 0.00 0.00 173.10 172.12 2jj2 s SER 320 N -3.85 -0.19 -0.11 1.64 1.04 -0.45 -1.43 113.70 110.36 2jj2 s SER 320 Ca 0.69 -0.31 -0.01 0.00 0.48 0.00 0.00 55.95 56.80 2jj2 s SER 320 Cb -0.12 0.44 0.03 0.00 0.10 0.00 0.00 66.02 66.48 2jj2 s SER 320 CO 0.56 -0.80 -0.01 -0.22 0.98 0.00 0.00 173.24 173.75 2jj2 s LEU 321 N -2.67 0.91 -0.17 2.42 2.96 -0.18 -1.61 118.68 120.34 2jj2 s LEU 321 Ca 0.02 -0.32 -0.07 0.00 -0.22 0.00 0.00 54.13 53.54 2jj2 s LEU 321 Cb 0.02 -0.59 -0.04 0.00 0.50 0.00 0.00 46.19 46.08 2jj2 s LEU 321 CO -0.10 -0.20 0.05 -0.89 -1.32 0.00 0.00 176.35 173.89 2jj2 s THR 322 N 1.87 4.72 -0.12 3.68 2.01 0.09 -1.59 115.64 126.30 2jj2 s THR 322 Ca 0.04 -0.06 -0.01 0.00 0.31 0.00 0.00 61.69 61.96 2jj2 s THR 322 Cb -0.13 -3.11 -0.03 0.00 0.01 0.00 0.00 72.50 69.24 2jj2 s THR 322 CO -0.07 0.48 -0.06 0.00 -0.69 0.00 0.00 174.62 174.28 2jj2 s ALA 323 N 0.23 2.93 -0.77 7.40 0.00 -0.72 -0.40 121.76 130.43 2jj2 s ALA 323 Ca 0.03 -0.85 0.01 0.00 0.00 0.00 0.00 51.96 51.15 2jj2 s ALA 323 Cb -0.12 -1.38 0.19 0.00 0.00 0.00 0.00 23.12 21.81 2jj2 s ALA 323 CO 0.01 0.35 0.61 -0.51 0.00 0.00 0.00 175.76 176.22 2jj2 s LEU 324 N -0.08 5.17 0.45 0.00 1.43 0.10 -1.73 118.68 124.03 2jj2 s LEU 324 Ca 0.01 -3.65 -0.24 0.00 -1.03 0.00 0.00 54.13 49.22 2jj2 s LEU 324 Cb -0.13 -1.78 -0.08 0.00 0.03 0.00 0.00 46.19 44.23 2jj2 s LEU 324 CO 0.03 -0.17 1.27 -2.16 0.23 0.00 0.00 176.35 175.55 2jj2 s PRO 325 N -1.20 3.75 -0.12 1.29 0.04 -1.24 -2.54 135.00 134.97 2jj2 s PRO 325 Ca 0.25 2.05 -0.01 0.00 0.04 0.00 0.00 61.00 63.33 2jj2 s PRO 325 Cb -0.09 -2.56 -0.02 0.00 0.04 0.00 0.00 34.50 31.87 2jj2 s PRO 325 CO -0.12 -0.64 -0.08 0.08 0.04 0.00 0.00 177.00 176.28 2jj2 s VAL 326 N -1.35 3.59 -0.05 -0.36 1.01 -0.06 -0.50 120.40 122.67 2jj2 s VAL 326 Ca 0.62 -0.49 0.03 0.00 0.00 0.00 0.00 61.98 62.14 2jj2 s VAL 326 Cb -0.36 -2.52 0.01 0.00 0.00 0.00 0.00 36.38 33.51 2jj2 s VAL 326 CO 0.44 0.54 -0.14 -0.63 0.00 0.00 0.00 175.10 175.31 2jj2 s ILE 327 N -0.05 1.21 -0.27 2.22 -1.09 -0.27 -1.24 121.20 121.72 2jj2 s ILE 327 Ca -0.00 -0.56 -0.15 0.00 -2.23 0.00 0.00 60.65 57.71 2jj2 s ILE 327 Cb -0.13 -1.07 -0.04 0.00 -1.58 0.00 0.00 42.46 39.63 2jj2 s ILE 327 CO 0.03 0.36 0.37 -0.70 -1.23 0.00 0.00 174.94 173.77 2jj2 s GLU 328 N 0.38 4.02 0.67 2.79 2.12 -1.26 -2.82 118.70 124.60 2jj2 s GLU 328 Ca -0.10 0.04 -0.03 0.00 0.36 0.00 0.00 54.97 55.24 2jj2 s GLU 328 Cb -0.13 -3.65 0.07 0.00 0.26 0.00 0.00 34.13 30.68 2jj2 s GLU 328 CO 0.03 -0.26 0.94 0.95 -0.54 0.00 0.00 175.26 176.38 2jj2 s THR 329 N 2.01 2.37 -0.21 -1.70 -4.23 -0.87 -4.93 115.64 108.09 2jj2 s THR 329 Ca 0.15 -0.46 0.01 0.00 -1.18 0.00 0.00 61.69 60.21 2jj2 s THR 329 Cb -0.16 -2.90 0.04 0.00 1.34 0.00 0.00 72.50 70.82 2jj2 s THR 329 CO 0.10 0.00 -0.10 -1.10 -0.54 0.00 0.00 174.62 172.98 2jj2 s GLN 330 N -5.09 2.01 -1.52 3.99 -1.52 -1.26 -4.24 119.66 112.04 2jj2 s GLN 330 Ca 0.61 -0.88 -0.11 0.00 -1.95 0.00 0.00 55.36 53.03 2jj2 s GLN 330 Cb -0.09 -2.46 0.08 0.00 -0.22 0.00 0.00 33.01 30.32 2jj2 s GLN 330 CO 0.43 -0.45 0.80 0.00 -0.25 0.00 0.00 175.29 175.82 2jj2 n ALA 331 N 4.67 -1.51 -1.03 6.09 0.00 -1.26 -2.23 120.51 125.24 2jj2 n ALA 331 Ca -0.14 0.02 -0.01 0.00 0.00 0.00 0.00 53.44 53.30 2jj2 n ALA 331 Cb 0.46 -3.37 -0.00 0.00 0.00 0.00 0.00 19.45 16.53 2jj2 n ALA 331 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jj2 n GLY 332 N -1.65 0.43 3.55 0.00 0.00 -1.26 -4.95 105.19 101.30 2jj2 n GLY 332 Ca -0.06 -0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 2jj2 n GLY 332 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jj2 s ASP 333 N -2.14 6.67 0.00 1.61 2.15 -0.95 -4.79 116.67 119.22 2jj2 s ASP 333 Ca 0.00 -1.95 0.26 0.00 0.43 0.00 0.00 52.55 51.29 2jj2 s ASP 333 Cb 0.00 -2.54 1.43 0.00 -0.30 0.00 0.00 42.92 41.51 2jj2 s ASP 333 CO 0.00 -1.30 1.88 1.33 -0.17 0.00 0.00 175.17 176.91 2jj2 n VAL 334 N 6.42 0.09 0.91 1.11 0.24 -1.26 -2.82 118.33 123.01 2jj2 n VAL 334 Ca 0.38 0.02 0.11 0.00 -2.04 0.00 0.00 64.34 62.81 2jj2 n VAL 334 Cb 0.49 -0.61 0.10 0.00 -1.47 0.00 0.00 33.84 32.35 2jj2 n VAL 334 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2jj2 n SER 335 N -1.12 2.93 -4.58 -1.34 7.64 -1.26 -3.53 113.62 112.35 2jj2 n SER 335 Ca 0.16 -1.95 -0.29 0.00 1.01 0.00 0.00 58.87 57.81 2jj2 n SER 335 Cb 0.14 -0.02 0.21 0.00 -1.01 0.00 0.00 64.21 63.54 2jj2 n SER 335 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jj2 s ALA 336 N -1.87 0.26 0.03 -0.43 0.00 -1.13 -4.70 121.76 113.93 2jj2 s ALA 336 Ca 0.27 -0.14 -0.28 0.00 0.00 0.00 0.00 51.96 51.81 2jj2 s ALA 336 Cb 0.19 -3.22 -0.15 0.00 0.00 0.00 0.00 23.12 19.94 2jj2 s ALA 336 CO 0.29 -3.35 1.30 -0.92 0.00 0.00 0.00 175.76 173.08 2jj2 h TYR 337 N -2.27 -0.94 -0.29 0.00 -0.00 -1.92 -0.45 116.97 111.10 2jj2 h TYR 337 Ca -0.57 -0.02 -0.01 0.00 -0.00 0.00 0.00 58.73 58.13 2jj2 h TYR 337 Cb 1.32 0.31 -0.01 0.00 -0.00 0.00 0.00 36.73 38.35 2jj2 h TYR 337 CO 0.30 -0.58 0.14 0.82 -0.00 0.00 0.00 178.16 178.84 2jj2 h ILE 338 N -1.11 1.15 -0.32 1.81 1.08 -1.97 -1.98 117.51 116.17 2jj2 h ILE 338 Ca -0.10 -0.44 0.07 0.00 -0.39 0.00 0.00 64.86 64.00 2jj2 h ILE 338 Cb 0.77 0.91 -0.08 0.00 -3.07 0.00 0.00 36.82 35.35 2jj2 h ILE 338 CO 0.17 0.16 -0.22 -0.65 -0.69 0.00 0.00 178.15 176.91 2jj2 h PRO 339 N 0.34 -0.18 -0.72 2.37 0.11 -1.87 -0.50 132.00 131.54 2jj2 h PRO 339 Ca 0.10 0.01 0.16 0.00 0.11 0.00 0.00 66.00 66.38 2jj2 h PRO 339 Cb 0.12 0.04 -0.12 0.00 0.11 0.00 0.00 31.00 31.16 2jj2 h PRO 339 CO -0.01 -0.12 0.10 1.15 -0.21 0.00 0.00 178.00 178.90 2jj2 h THR 340 N -0.19 0.45 0.52 -1.15 2.02 -0.78 0.27 112.91 114.04 2jj2 h THR 340 Ca 0.16 -0.06 -0.02 0.00 0.77 0.00 0.00 66.41 67.26 2jj2 h THR 340 Cb 0.45 0.25 -0.00 0.00 -1.74 0.00 0.00 68.15 67.10 2jj2 h THR 340 CO -0.43 0.03 -0.29 0.78 0.37 0.00 0.00 175.52 175.98 2jj2 h ASN 341 N 0.19 -0.71 0.07 4.18 2.35 -0.62 -2.14 115.58 118.90 2jj2 h ASN 341 Ca 0.40 0.04 -0.18 0.00 -0.55 0.00 0.00 56.30 56.01 2jj2 h ASN 341 Cb 0.70 0.20 -0.00 0.00 0.05 0.00 0.00 38.32 39.27 2jj2 h ASN 341 CO -0.57 -0.47 -0.65 0.58 -1.65 0.00 0.00 177.43 174.67 2jj2 h VAL 342 N -0.75 1.33 -0.34 2.81 2.07 -0.24 -1.45 116.25 119.68 2jj2 h VAL 342 Ca -0.06 -1.95 0.05 0.00 0.82 0.00 0.00 66.70 65.56 2jj2 h VAL 342 Cb 0.60 1.93 -0.05 0.00 -1.52 0.00 0.00 31.29 32.25 2jj2 h VAL 342 CO 0.08 0.60 0.05 0.40 0.02 0.00 0.00 177.57 178.73 2jj2 h ILE 343 N 0.40 0.82 -0.49 4.57 2.04 -0.57 -2.34 117.51 121.94 2jj2 h ILE 343 Ca -0.02 -0.06 -0.07 0.00 1.00 0.00 0.00 64.86 65.72 2jj2 h ILE 343 Cb 1.23 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.92 2jj2 h ILE 343 CO 0.12 0.03 0.03 -1.28 0.00 0.00 0.00 178.15 177.06 2jj2 h SER 344 N 0.17 0.75 -0.25 1.72 0.87 -1.02 -3.21 113.55 112.58 2jj2 h SER 344 Ca 0.16 -0.17 -0.09 0.00 -1.23 0.00 0.00 61.79 60.46 2jj2 h SER 344 Cb 0.19 -0.20 -0.00 0.00 -0.44 0.00 0.00 62.40 61.95 2jj2 h SER 344 CO -0.22 0.80 -0.20 0.40 -0.53 0.00 0.00 176.83 177.07 2jj2 h ILE 345 N 0.74 1.31 -3.84 2.23 2.04 -1.10 -3.47 117.51 115.43 2jj2 h ILE 345 Ca 0.15 -1.35 -0.44 0.00 1.00 0.00 0.00 64.86 64.23 2jj2 h ILE 345 Cb 0.40 1.63 0.17 0.00 -0.74 0.00 0.00 36.82 38.28 2jj2 h ILE 345 CO 0.01 0.42 0.24 0.42 0.00 0.00 0.00 178.15 179.25 2jj2 s THR 346 N -4.42 1.83 -2.68 -0.27 -4.23 -0.90 -4.98 115.64 99.99 2jj2 s THR 346 Ca -0.13 0.00 0.25 0.00 -1.18 0.00 0.00 61.69 60.63 2jj2 s THR 346 Cb 0.08 -2.66 0.29 0.00 1.34 0.00 0.00 72.50 71.55 2jj2 s THR 346 CO 0.80 0.00 1.41 0.47 -0.54 0.00 0.00 174.62 176.76 2jj2 n ASP 347 N -4.24 2.32 0.00 3.99 8.00 0.33 -5.00 116.55 121.95 2jj2 n ASP 347 Ca 0.11 -1.73 0.00 0.00 0.71 0.00 0.00 54.79 53.88 2jj2 n ASP 347 Cb 0.59 0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.75 2jj2 n ASP 347 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jj2 n GLY 348 N 1.30 1.80 2.96 0.44 0.00 -1.24 -0.90 105.19 109.55 2jj2 n GLY 348 Ca 0.15 -1.04 -0.13 0.00 0.00 0.00 0.00 46.02 45.00 2jj2 n GLY 348 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jj2 s GLN 349 N -2.00 0.30 -0.41 1.61 1.11 -0.27 -0.41 119.66 119.60 2jj2 s GLN 349 Ca 0.00 -0.33 -0.09 0.00 0.01 0.00 0.00 55.36 54.95 2jj2 s GLN 349 Cb 0.00 -0.17 0.07 0.00 -1.01 0.00 0.00 33.01 31.90 2jj2 s GLN 349 CO 0.00 0.04 0.25 0.42 0.01 0.00 0.00 175.29 176.01 2jj2 s ILE 350 N -0.60 4.29 -0.20 1.08 1.01 0.36 -1.12 121.20 126.02 2jj2 s ILE 350 Ca -0.04 -1.31 -0.21 0.00 0.00 0.00 0.00 60.65 59.09 2jj2 s ILE 350 Cb -0.05 -3.59 -0.02 0.00 0.01 0.00 0.00 42.46 38.81 2jj2 s ILE 350 CO -0.00 -0.46 0.62 -0.36 0.00 0.00 0.00 174.94 174.74 2jj2 s PHE 351 N 1.45 3.37 -0.03 3.97 0.40 -1.26 -1.26 117.98 124.62 2jj2 s PHE 351 Ca 0.03 0.91 0.00 0.00 -0.60 0.00 0.00 56.93 57.27 2jj2 s PHE 351 Cb -0.22 -2.79 -0.04 0.00 0.51 0.00 0.00 43.02 40.48 2jj2 s PHE 351 CO 0.03 -0.18 0.01 -0.51 0.70 0.00 0.00 175.22 175.27 2jj2 s LEU 352 N 1.94 3.57 -0.01 -0.37 1.43 -0.21 0.31 118.68 125.35 2jj2 s LEU 352 Ca 0.28 0.05 0.04 0.00 -1.03 0.00 0.00 54.13 53.47 2jj2 s LEU 352 Cb -0.16 -1.99 -0.01 0.00 0.03 0.00 0.00 46.19 44.07 2jj2 s LEU 352 CO 0.10 0.31 -0.12 -1.61 0.23 0.00 0.00 176.35 175.26 2jj2 s GLU 353 N -1.38 0.99 0.25 1.70 2.02 -0.74 -4.34 118.70 117.19 2jj2 s GLU 353 Ca 0.18 -0.41 -0.06 0.00 0.02 0.00 0.00 54.97 54.70 2jj2 s GLU 353 Cb -0.11 -0.95 0.30 0.00 0.10 0.00 0.00 34.13 33.47 2jj2 s GLU 353 CO 0.08 0.24 1.89 1.15 0.02 0.00 0.00 175.26 178.64 2jj2 h THR 354 N 4.93 1.15 -0.40 3.63 2.02 -1.91 -2.11 112.91 120.23 2jj2 h THR 354 Ca -0.33 -0.40 -0.02 0.00 0.77 0.00 0.00 66.41 66.43 2jj2 h THR 354 Cb 1.17 -0.12 -0.02 0.00 -1.74 0.00 0.00 68.15 67.44 2jj2 h THR 354 CO 0.49 0.21 0.15 -0.08 0.37 0.00 0.00 175.52 176.67 2jj2 h GLU 355 N 1.17 0.60 -0.46 6.66 4.81 -1.97 -1.92 114.58 123.46 2jj2 h GLU 355 Ca 0.37 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 59.49 2jj2 h GLU 355 Cb 0.01 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 2jj2 h GLU 355 CO -0.12 0.57 0.26 -0.07 -0.73 0.00 0.00 179.01 178.91 2jj2 h LEU 356 N 0.50 0.58 -0.26 1.64 3.38 -1.87 -1.60 115.31 117.67 2jj2 h LEU 356 Ca 0.13 -0.09 0.05 0.00 0.09 0.00 0.00 57.88 58.07 2jj2 h LEU 356 Cb 0.20 -0.15 -0.08 0.00 0.09 0.00 0.00 40.66 40.72 2jj2 h LEU 356 CO -0.01 0.50 -0.44 0.15 0.09 0.00 0.00 178.44 178.73 2jj2 h PHE 357 N 0.61 -1.28 0.00 1.13 3.57 -0.91 -0.84 116.94 119.23 2jj2 h PHE 357 Ca 0.16 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.72 2jj2 h PHE 357 Cb 0.05 0.60 0.00 0.00 2.79 0.00 0.00 35.95 39.38 2jj2 h PHE 357 CO -0.02 -0.47 0.00 1.88 -2.23 0.00 0.00 178.31 177.47 2jj2 h TYR 358 N -0.42 0.00 0.00 0.41 -1.99 -1.29 -2.23 116.97 111.44 2jj2 h TYR 358 Ca 0.10 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.83 2jj2 h TYR 358 Cb 0.61 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.34 2jj2 h TYR 358 CO -0.56 0.00 0.00 1.63 -0.00 0.00 0.00 178.16 179.23 2jj2 n LYS 359 N -2.45 0.13 -0.00 4.88 5.02 -0.61 -4.88 118.16 120.25 2jj2 n LYS 359 Ca 0.04 0.16 0.00 0.00 -2.02 0.00 0.00 58.31 56.48 2jj2 n LYS 359 Cb 0.37 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.88 2jj2 n LYS 359 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jj2 n GLY 360 N 0.28 0.19 3.56 0.72 0.00 -0.84 -5.02 105.19 104.07 2jj2 n GLY 360 Ca 0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 2jj2 n GLY 360 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jj2 s ILE 361 N -2.01 3.65 -0.06 -0.61 -1.09 -0.37 -4.93 121.20 115.78 2jj2 s ILE 361 Ca 0.00 -0.35 0.01 0.00 -2.23 0.00 0.00 60.65 58.08 2jj2 s ILE 361 Cb 0.00 -4.52 0.02 0.00 -1.58 0.00 0.00 42.46 36.38 2jj2 s ILE 361 CO 0.00 -1.44 -0.05 -0.13 -1.23 0.00 0.00 174.94 172.08 2jj2 s ARG 362 N 6.07 1.04 0.44 2.79 0.52 -1.26 -2.86 118.95 125.68 2jj2 s ARG 362 Ca 0.56 -0.14 -0.26 0.00 -0.52 0.00 0.00 55.73 55.37 2jj2 s ARG 362 Cb -0.05 -1.06 -0.09 0.00 0.52 0.00 0.00 34.95 34.27 2jj2 s ARG 362 CO 0.00 -0.13 1.45 -1.25 0.02 0.00 0.00 175.30 175.40 2jj2 s PRO 363 N 1.16 3.74 0.00 3.54 0.04 -1.25 -0.74 135.00 141.49 2jj2 s PRO 363 Ca -0.07 2.47 0.00 0.00 0.04 0.00 0.00 61.00 63.44 2jj2 s PRO 363 Cb -0.14 -2.71 0.00 0.00 0.04 0.00 0.00 34.50 31.69 2jj2 s PRO 363 CO -0.01 -0.79 1.31 0.00 0.04 0.00 0.00 177.00 177.55 2jj2 n ALA 364 N -0.10 3.08 -2.38 8.56 0.00 -1.13 -4.90 120.51 123.63 2jj2 n ALA 364 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.06 2jj2 n ALA 364 Cb 0.41 -1.16 -0.03 0.00 0.00 0.00 0.00 19.45 18.67 2jj2 n ALA 364 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2jj2 s ILE 365 N 0.39 4.02 -0.65 0.00 1.01 -1.26 -1.80 121.20 122.92 2jj2 s ILE 365 Ca 0.00 1.40 -0.27 0.00 0.00 0.00 0.00 60.65 61.78 2jj2 s ILE 365 Cb 0.00 -3.90 0.03 0.00 0.01 0.00 0.00 42.46 38.60 2jj2 s ILE 365 CO 0.00 0.03 1.20 0.21 0.00 0.00 0.00 174.94 176.38 2jj2 s ASN 366 N 1.44 6.31 0.39 3.58 3.84 0.15 -4.88 114.94 125.77 2jj2 s ASN 366 Ca 0.59 -0.21 0.21 0.00 0.21 0.00 0.00 52.86 53.66 2jj2 s ASN 366 Cb -0.28 -2.54 0.69 0.00 -0.55 0.00 0.00 41.25 38.56 2jj2 s ASN 366 CO 0.25 -1.61 1.73 0.58 -2.79 0.00 0.00 177.10 175.26 2jj2 h VAL 367 N 6.09 0.68 -0.09 -5.21 2.07 -1.92 -0.38 116.25 117.48 2jj2 h VAL 367 Ca -0.26 -1.42 -0.19 0.00 0.82 0.00 0.00 66.70 65.65 2jj2 h VAL 367 Cb 1.06 1.93 -0.00 0.00 -1.52 0.00 0.00 31.29 32.75 2jj2 h VAL 367 CO 1.22 0.30 -0.73 1.23 0.02 0.00 0.00 177.57 179.61 2jj2 h GLY 368 N 2.38 0.49 0.44 2.17 0.00 -1.98 -3.36 103.07 103.21 2jj2 h GLY 368 Ca -0.00 -0.69 -0.36 0.00 0.00 0.00 0.00 47.33 46.28 2jj2 h GLY 368 CO 0.04 0.61 -2.13 1.04 0.00 0.00 0.00 176.54 176.11 2jj2 n LEU 369 N -3.85 2.06 -4.75 3.11 4.77 -1.10 -4.96 117.00 112.28 2jj2 n LEU 369 Ca -0.05 0.13 -0.39 0.00 -0.03 0.00 0.00 56.01 55.67 2jj2 n LEU 369 Cb 0.71 -0.61 0.03 0.00 -2.33 0.00 0.00 43.42 41.22 2jj2 n LEU 369 CO 0.48 0.75 1.00 -0.44 -1.33 0.00 0.00 177.39 177.85 2jj2 s SER 370 N -6.52 5.46 -0.13 -1.43 0.01 -0.17 -4.91 113.70 106.01 2jj2 s SER 370 Ca -0.21 2.79 -0.16 0.00 1.31 0.00 0.00 55.95 59.68 2jj2 s SER 370 Cb 0.07 -2.64 0.04 0.00 0.21 0.00 0.00 66.02 63.70 2jj2 s SER 370 CO 0.74 -1.44 0.42 0.54 0.41 0.00 0.00 173.24 173.90 2jj2 s VAL 371 N -1.28 0.01 -0.17 3.43 0.11 -0.27 -4.94 120.40 117.29 2jj2 s VAL 371 Ca 0.68 -0.09 0.01 0.00 -2.93 0.00 0.00 61.98 59.66 2jj2 s VAL 371 Cb -0.41 -0.62 0.01 0.00 -1.53 0.00 0.00 36.38 33.84 2jj2 s VAL 371 CO 0.50 -0.05 -0.20 -0.55 -3.33 0.00 0.00 175.10 171.47 2jj2 s SER 372 N -0.15 3.20 0.19 3.54 0.15 -1.26 -1.11 113.70 118.26 2jj2 s SER 372 Ca -0.03 -0.62 0.26 0.00 0.70 0.00 0.00 55.95 56.26 2jj2 s SER 372 Cb -0.03 -1.48 0.85 0.00 -1.71 0.00 0.00 66.02 63.64 2jj2 s SER 372 CO 0.02 0.03 1.79 0.54 1.20 0.00 0.00 173.24 176.81 2jj2 n ARG 373 N 4.44 0.24 0.06 5.44 1.74 -0.08 -3.13 116.66 125.38 2jj2 n ARG 373 Ca -0.21 0.20 -0.12 0.00 -0.77 0.00 0.00 57.85 56.95 2jj2 n ARG 373 Cb 0.51 -1.78 -0.08 0.00 -1.02 0.00 0.00 32.46 30.08 2jj2 n ARG 373 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2jj2 h VAL 374 N 0.00 0.98 0.00 1.55 2.07 -1.88 -3.48 116.25 115.48 2jj2 h VAL 374 Ca 0.00 -0.98 0.00 0.00 0.82 0.00 0.00 66.70 66.54 2jj2 h VAL 374 Cb 0.72 1.54 0.00 0.00 -1.52 0.00 0.00 31.29 32.02 2jj2 h VAL 374 CO 0.00 0.21 0.00 0.61 0.02 0.00 0.00 177.57 178.41 2jj2 n GLY 375 N 0.21 2.01 0.33 2.17 0.00 -1.18 -3.32 105.19 105.41 2jj2 n GLY 375 Ca -0.08 -0.47 0.19 0.00 0.00 0.00 0.00 46.02 45.66 2jj2 n GLY 375 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2jj2 h SER 376 N 3.95 -0.09 -0.54 1.61 0.02 -1.92 -0.99 113.55 115.59 2jj2 h SER 376 Ca 0.00 0.25 0.16 0.00 -0.84 0.00 0.00 61.79 61.36 2jj2 h SER 376 Cb 0.00 0.35 -0.02 0.00 0.14 0.00 0.00 62.40 62.87 2jj2 h SER 376 CO 0.00 -0.31 0.71 0.00 -1.14 0.00 0.00 176.83 176.09 2jj2 h ALA 377 N 1.93 2.30 -0.31 3.77 0.00 -1.88 0.13 119.26 125.20 2jj2 h ALA 377 Ca 0.66 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.55 2jj2 h ALA 377 Cb 1.49 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.32 2jj2 h ALA 377 CO -0.79 -0.99 0.00 0.00 0.00 0.00 0.00 179.25 177.46 2jj2 n ALA 378 N -2.21 2.44 -2.76 0.00 0.00 -0.37 -4.25 120.51 113.36 2jj2 n ALA 378 Ca 0.11 -1.52 -0.31 0.00 0.00 0.00 0.00 53.44 51.72 2jj2 n ALA 378 Cb 0.91 -0.52 -0.07 0.00 0.00 0.00 0.00 19.45 19.77 2jj2 n ALA 378 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2jj2 s GLN 379 N -1.60 2.88 0.50 0.00 -0.21 0.46 -3.93 119.66 117.77 2jj2 s GLN 379 Ca 0.29 -0.65 -0.15 0.00 0.02 0.00 0.00 55.36 54.87 2jj2 s GLN 379 Cb 0.19 -2.73 -0.07 0.00 1.00 0.00 0.00 33.01 31.39 2jj2 s GLN 379 CO 0.13 0.59 0.94 0.95 -2.12 0.00 0.00 175.29 175.78 2jj2 s THR 380 N -1.31 4.60 0.32 -0.19 -4.23 -1.26 -4.85 115.64 108.73 2jj2 s THR 380 Ca 0.26 1.06 0.06 0.00 -1.18 0.00 0.00 61.69 61.89 2jj2 s THR 380 Cb -0.12 -3.74 0.31 0.00 1.34 0.00 0.00 72.50 70.29 2jj2 s THR 380 CO 0.19 -0.69 1.85 0.03 -0.54 0.00 0.00 174.62 175.46 2jj2 h ARG 381 N 0.89 0.79 0.30 3.99 3.08 -1.97 0.13 114.38 121.58 2jj2 h ARG 381 Ca -0.47 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 59.52 2jj2 h ARG 381 Cb 1.19 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 31.06 2jj2 h ARG 381 CO 0.62 0.52 -0.14 0.00 -1.07 0.00 0.00 179.97 179.90 2jj2 h ALA 382 N 1.58 -0.40 -0.32 0.04 0.00 -0.51 -1.67 119.26 117.99 2jj2 h ALA 382 Ca 0.47 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.26 2jj2 h ALA 382 Cb 0.63 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 2jj2 h ALA 382 CO -0.24 -0.70 0.10 1.98 0.00 0.00 0.00 179.25 180.39 2jj2 h MET 383 N -0.45 0.49 -0.80 0.00 1.85 -1.71 -2.95 114.93 111.36 2jj2 h MET 383 Ca -0.04 -0.10 0.19 0.00 -0.61 0.00 0.00 59.70 59.14 2jj2 h MET 383 Cb 0.34 -0.07 -0.14 0.00 0.43 0.00 0.00 31.60 32.16 2jj2 h MET 383 CO 0.07 0.53 0.03 -0.22 -0.40 0.00 0.00 176.91 176.92 2jj2 h LYS 384 N 0.36 0.10 0.00 0.39 3.64 -0.64 0.78 116.57 121.20 2jj2 h LYS 384 Ca 0.10 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 2jj2 h LYS 384 Cb 0.24 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 2jj2 h LYS 384 CO -0.00 0.07 0.00 0.94 -2.27 0.00 0.00 179.45 178.18 2jj2 n GLN 385 N -5.35 0.00 0.26 1.90 7.27 -0.64 -3.01 117.38 117.81 2jj2 n GLN 385 Ca 0.16 0.57 0.14 0.00 0.07 0.00 0.00 57.00 57.94 2jj2 n GLN 385 Cb 0.53 -1.39 0.66 0.00 2.41 0.00 0.00 30.24 32.45 2jj2 n GLN 385 CO 0.00 0.00 0.00 -0.39 0.07 0.00 0.00 177.06 176.74 2jj2 h VAL 386 N 0.00 0.36 -0.23 1.69 -1.51 -1.48 -3.21 116.25 111.87 2jj2 h VAL 386 Ca 0.00 -0.69 -0.08 0.00 -1.23 0.00 0.00 66.70 64.70 2jj2 h VAL 386 Cb 0.00 1.51 -0.00 0.00 -2.13 0.00 0.00 31.29 30.67 2jj2 h VAL 386 CO 0.00 0.11 -0.17 0.00 -1.23 0.00 0.00 177.57 176.28 2jj2 h ALA 387 N 1.89 0.33 -0.88 5.19 0.00 -0.87 -2.54 119.26 122.36 2jj2 h ALA 387 Ca -0.00 -0.34 0.09 0.00 0.00 0.00 0.00 54.91 54.66 2jj2 h ALA 387 Cb 0.50 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.15 2jj2 h ALA 387 CO 0.01 0.24 0.53 0.78 0.00 0.00 0.00 179.25 180.82 2jj2 h GLY 388 N 0.22 1.38 1.23 0.00 0.00 -1.53 0.16 103.07 104.52 2jj2 h GLY 388 Ca 0.04 -0.37 -0.21 0.00 0.00 0.00 0.00 47.33 46.79 2jj2 h GLY 388 CO 0.05 0.19 -0.74 -0.84 0.00 0.00 0.00 176.54 175.20 2jj2 h THR 389 N 0.91 1.29 -0.32 4.70 2.02 -1.68 -2.06 112.91 117.77 2jj2 h THR 389 Ca 0.41 -1.95 -0.01 0.00 0.77 0.00 0.00 66.41 65.63 2jj2 h THR 389 Cb 0.32 1.93 -0.01 0.00 -1.74 0.00 0.00 68.15 68.65 2jj2 h THR 389 CO -0.22 0.62 0.15 -0.03 0.37 0.00 0.00 175.52 176.40 2jj2 h MET 390 N 0.54 0.46 -0.40 6.66 -1.53 -1.00 -0.86 114.93 118.80 2jj2 h MET 390 Ca -0.04 -0.07 0.07 0.00 -3.44 0.00 0.00 59.70 56.22 2jj2 h MET 390 Cb 1.36 -0.08 -0.06 0.00 -0.55 0.00 0.00 31.60 32.27 2jj2 h MET 390 CO 0.15 0.44 0.04 -0.22 0.14 0.00 0.00 176.91 177.46 2jj2 h LYS 391 N 0.38 0.15 -0.04 0.39 3.64 -0.63 0.56 116.57 121.02 2jj2 h LYS 391 Ca 0.11 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.48 2jj2 h LYS 391 Cb 0.13 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 31.92 2jj2 h LYS 391 CO -0.01 0.10 0.01 1.25 -2.27 0.00 0.00 179.45 178.53 2jj2 h LEU 392 N 0.16 0.06 -1.10 5.20 5.85 -1.29 -1.66 115.31 122.52 2jj2 h LEU 392 Ca 0.19 -0.19 -0.09 0.00 0.84 0.00 0.00 57.88 58.63 2jj2 h LEU 392 Cb 0.25 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 2jj2 h LEU 392 CO -0.29 0.24 -0.36 -0.33 -0.34 0.00 0.00 178.44 177.36 2jj2 h GLU 393 N -0.12 0.17 -0.12 1.25 5.08 -0.90 0.22 114.58 120.16 2jj2 h GLU 393 Ca 0.01 -0.07 -0.17 0.00 -1.00 0.00 0.00 59.36 58.14 2jj2 h GLU 393 Cb 0.20 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 2jj2 h GLU 393 CO -0.00 0.51 -0.64 -0.07 -1.00 0.00 0.00 179.01 177.81 2jj2 h LEU 394 N 0.14 0.51 -0.34 1.33 3.38 -0.89 -0.76 115.31 118.68 2jj2 h LEU 394 Ca 0.02 -0.30 -0.08 0.00 0.09 0.00 0.00 57.88 57.61 2jj2 h LEU 394 Cb 0.70 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 2jj2 h LEU 394 CO 0.05 1.01 -0.10 0.00 0.09 0.00 0.00 178.44 179.50 2jj2 h ALA 395 N 0.99 0.47 -0.32 1.53 0.00 -0.74 0.05 119.26 121.24 2jj2 h ALA 395 Ca -0.01 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 2jj2 h ALA 395 Cb 1.18 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 2jj2 h ALA 395 CO 0.11 0.33 0.05 1.96 0.00 0.00 0.00 179.25 181.70 2jj2 h GLN 396 N 0.45 0.47 0.12 0.00 4.20 -1.00 -2.73 115.11 116.63 2jj2 h GLN 396 Ca 0.08 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.71 2jj2 h GLN 396 Cb 0.61 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.31 2jj2 h GLN 396 CO 0.04 0.46 -0.06 -0.92 -0.67 0.00 0.00 178.83 177.68 2jj2 h TYR 397 N 0.46 -0.15 -0.66 2.96 3.20 -0.88 -3.25 116.97 118.66 2jj2 h TYR 397 Ca 0.11 -0.00 0.17 0.00 3.14 0.00 0.00 58.73 62.15 2jj2 h TYR 397 Cb 0.23 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.52 2jj2 h TYR 397 CO 0.01 0.11 0.46 0.00 -1.64 0.00 0.00 178.16 177.10 2jj2 h ARG 398 N -0.39 0.11 -0.24 1.82 3.08 -0.68 0.73 114.38 118.80 2jj2 h ARG 398 Ca -0.02 -0.01 -0.15 0.00 0.07 0.00 0.00 59.98 59.88 2jj2 h ARG 398 Cb 0.32 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 2jj2 h ARG 398 CO 0.03 0.07 -0.45 0.93 -1.07 0.00 0.00 179.97 179.48 2jj2 h GLU 399 N 0.11 0.63 -0.02 0.04 5.08 -1.55 -3.21 114.58 115.66 2jj2 h GLU 399 Ca 0.32 -0.35 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2jj2 h GLU 399 Cb 1.10 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.37 2jj2 h GLU 399 CO -0.04 0.95 -0.24 0.28 -1.00 0.00 0.00 179.01 178.96 2jj2 n VAL 400 N -4.01 0.00 0.30 3.13 0.31 -0.51 -4.62 118.33 112.93 2jj2 n VAL 400 Ca -0.02 -0.38 0.17 0.00 -0.01 0.00 0.00 64.34 64.10 2jj2 n VAL 400 Cb 0.55 1.34 0.89 0.00 -0.91 0.00 0.00 33.84 35.71 2jj2 n VAL 400 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2jj2 h ALA 401 N 3.91 1.39 0.00 3.52 0.00 -0.91 0.15 119.26 127.31 2jj2 h ALA 401 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2jj2 h ALA 401 Cb 0.80 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2jj2 h ALA 401 CO 0.00 -0.30 -0.50 0.00 0.00 0.00 0.00 179.25 178.45 2jj2 n ALA 402 N -2.00 3.43 1.42 0.00 0.00 -1.26 -3.64 120.51 118.46 2jj2 n ALA 402 Ca -0.01 -0.33 0.08 0.00 0.00 0.00 0.00 53.44 53.18 2jj2 n ALA 402 Cb 0.34 -1.14 0.34 0.00 0.00 0.00 0.00 19.45 18.99 2jj2 n ALA 402 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2jj2 n PHE 403 N -1.57 0.19 0.00 0.00 0.99 0.53 -4.39 117.46 113.21 2jj2 n PHE 403 Ca 0.05 -0.09 0.00 0.00 -0.00 0.00 0.00 57.45 57.41 2jj2 n PHE 403 Cb 0.35 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.83 2jj2 n PHE 403 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2jj2 n ALA 404 N 0.02 -0.04 0.30 4.37 0.00 -1.24 -2.81 120.51 121.11 2jj2 n ALA 404 Ca 0.13 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.74 2jj2 n ALA 404 Cb 0.23 0.00 0.77 0.00 0.00 0.00 0.00 19.45 20.45 2jj2 n ALA 404 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2jj2 h GLN 405 N 0.00 0.00 -0.87 0.00 4.20 -1.84 -2.43 115.11 114.18 2jj2 h GLN 405 Ca 0.00 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.14 2jj2 h GLN 405 Cb 0.00 0.00 -0.41 0.00 0.30 0.00 0.00 27.48 27.37 2jj2 h GLN 405 CO 0.00 0.00 -0.57 1.19 -0.67 0.00 0.00 178.83 178.78 2jj2 n PHE 406 N -2.73 2.87 -3.58 2.96 3.01 -1.26 -4.96 117.46 113.78 2jj2 n PHE 406 Ca -0.00 -2.40 -0.16 0.00 1.01 0.00 0.00 57.45 55.89 2jj2 n PHE 406 Cb 0.17 -0.47 -0.14 0.00 -0.01 0.00 0.00 39.48 39.03 2jj2 n PHE 406 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2jj2 s GLY 407 N -3.33 -0.02 -0.02 1.37 0.00 -0.91 -4.90 107.32 99.50 2jj2 s GLY 407 Ca 0.53 0.52 0.01 0.00 0.00 0.00 0.00 44.72 45.78 2jj2 s GLY 407 CO 0.01 2.00 -0.01 1.44 0.00 0.00 0.00 173.10 176.53 2jj2 n SER 408 N 5.33 4.02 -3.42 1.64 7.64 -1.26 -4.82 113.62 122.75 2jj2 n SER 408 Ca -0.05 -0.01 -0.37 0.00 1.01 0.00 0.00 58.87 59.44 2jj2 n SER 408 Cb 0.50 0.15 0.01 0.00 -1.01 0.00 0.00 64.21 63.85 2jj2 n SER 408 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2jj2 n ASP 409 N -2.42 6.65 -4.94 6.43 9.92 -1.26 -5.01 116.55 125.92 2jj2 n ASP 409 Ca -0.04 -3.70 -0.25 0.00 -0.53 0.00 0.00 54.79 50.27 2jj2 n ASP 409 Cb 0.55 -1.01 -0.03 0.00 -0.64 0.00 0.00 41.12 40.00 2jj2 n ASP 409 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2jj2 s LEU 410 N -4.11 4.21 0.55 0.64 1.02 -1.26 -5.10 118.68 114.64 2jj2 s LEU 410 Ca 0.42 0.33 -0.18 0.00 0.02 0.00 0.00 54.13 54.72 2jj2 s LEU 410 Cb 0.23 -3.12 -0.05 0.00 0.02 0.00 0.00 46.19 43.26 2jj2 s LEU 410 CO -0.15 -0.09 1.07 1.51 0.02 0.00 0.00 176.35 178.71 2jj2 s ASP 411 N -3.50 5.88 0.55 2.29 -4.77 -1.26 -4.87 116.67 110.98 2jj2 s ASP 411 Ca 0.38 1.95 0.27 0.00 -3.30 0.00 0.00 52.55 51.86 2jj2 s ASP 411 Cb -0.10 -2.55 1.58 0.00 -1.09 0.00 0.00 42.92 40.75 2jj2 s ASP 411 CO 0.30 -1.10 2.15 0.00 0.70 0.00 0.00 175.17 177.22 2jj2 h ALA 412 N 0.93 1.42 -0.27 2.11 0.00 -1.98 -0.70 119.26 120.76 2jj2 h ALA 412 Ca -0.48 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.35 2jj2 h ALA 412 Cb 1.23 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 2jj2 h ALA 412 CO 0.57 0.09 0.12 0.00 0.00 0.00 0.00 179.25 180.03 2jj2 h ALA 413 N 1.93 0.35 0.00 0.00 0.00 -2.00 -1.38 119.26 118.16 2jj2 h ALA 413 Ca -0.00 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 2jj2 h ALA 413 Cb 0.19 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2jj2 h ALA 413 CO 0.01 -0.07 -0.39 1.79 0.00 0.00 0.00 179.25 180.59 2jj2 h THR 414 N 0.30 0.33 -0.12 0.00 1.35 -1.82 -2.98 112.91 109.96 2jj2 h THR 414 Ca 0.09 -1.48 -0.12 0.00 -0.55 0.00 0.00 66.41 64.35 2jj2 h THR 414 Cb 0.15 2.08 -0.01 0.00 -1.73 0.00 0.00 68.15 68.64 2jj2 h THR 414 CO -0.01 0.19 -0.45 1.56 -0.25 0.00 0.00 175.52 176.56 2jj2 h GLN 415 N 0.00 0.30 -0.18 4.72 4.20 -1.06 -2.81 115.11 120.27 2jj2 h GLN 415 Ca -0.01 -0.15 -0.14 0.00 0.06 0.00 0.00 58.65 58.40 2jj2 h GLN 415 Cb 1.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.96 2jj2 h GLN 415 CO 0.03 0.69 -0.43 0.37 -0.67 0.00 0.00 178.83 178.81 2jj2 h GLN 416 N 0.24 0.60 -0.92 1.46 5.75 -1.24 -1.96 115.11 119.04 2jj2 h GLN 416 Ca 0.02 -0.41 -0.01 0.00 -0.15 0.00 0.00 58.65 58.09 2jj2 h GLN 416 Cb 0.89 0.06 -0.04 0.00 1.07 0.00 0.00 27.48 29.46 2jj2 h GLN 416 CO 0.07 1.03 0.54 -0.07 -2.65 0.00 0.00 178.83 177.75 2jj2 h LEU 417 N 0.27 1.12 -0.14 -2.39 3.38 -1.53 0.24 115.31 116.27 2jj2 h LEU 417 Ca -0.00 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 2jj2 h LEU 417 Cb 1.05 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.51 2jj2 h LEU 417 CO 0.09 0.88 0.00 -0.07 0.09 0.00 0.00 178.44 179.44 2jj2 h LEU 418 N 1.28 0.23 0.33 1.67 3.38 -1.54 -1.33 115.31 119.32 2jj2 h LEU 418 Ca 0.33 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2jj2 h LEU 418 Cb -0.02 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 2jj2 h LEU 418 CO -0.06 0.47 -0.44 0.28 0.09 0.00 0.00 178.44 178.79 2jj2 h SER 419 N -0.02 -1.23 -0.96 -0.43 0.02 -0.87 -0.85 113.55 109.21 2jj2 h SER 419 Ca 0.04 0.11 0.07 0.00 -0.84 0.00 0.00 61.79 61.17 2jj2 h SER 419 Cb 0.35 0.43 -0.06 0.00 0.14 0.00 0.00 62.40 63.26 2jj2 h SER 419 CO 0.01 -0.56 0.62 -0.09 -1.14 0.00 0.00 176.83 175.66 2jj2 h ARG 420 N -0.82 1.07 0.61 3.45 9.65 -0.59 -2.75 114.38 125.00 2jj2 h ARG 420 Ca -0.02 -0.06 -0.03 0.00 -1.10 0.00 0.00 59.98 58.76 2jj2 h ARG 420 Cb 0.76 -0.24 0.01 0.00 -1.39 0.00 0.00 29.97 29.10 2jj2 h ARG 420 CO -0.13 0.71 -0.29 0.78 2.80 0.00 0.00 179.97 183.84 2jj2 h GLY 421 N 1.10 -0.86 1.97 2.80 0.00 -0.87 -2.03 103.07 105.19 2jj2 h GLY 421 Ca 0.42 0.32 0.00 0.00 0.00 0.00 0.00 47.33 48.07 2jj2 h GLY 421 CO -0.16 -0.31 0.01 -0.39 0.00 0.00 0.00 176.54 175.68 2jj2 h VAL 422 N -0.94 0.85 -0.16 4.60 -1.51 -1.07 -0.79 116.25 117.24 2jj2 h VAL 422 Ca -0.08 0.00 -0.17 0.00 -1.23 0.00 0.00 66.70 65.21 2jj2 h VAL 422 Cb 0.67 0.99 0.01 0.00 -2.13 0.00 0.00 31.29 30.83 2jj2 h VAL 422 CO 0.14 0.00 -0.58 0.03 -1.23 0.00 0.00 177.57 175.93 2jj2 h ARG 423 N 0.00 0.67 -0.33 5.19 3.08 -1.37 -2.35 114.38 119.28 2jj2 h ARG 423 Ca 0.01 -0.51 -0.12 0.00 0.07 0.00 0.00 59.98 59.43 2jj2 h ARG 423 Cb 0.02 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 2jj2 h ARG 423 CO -0.00 1.13 -0.28 -0.07 -1.07 0.00 0.00 179.97 179.68 2jj2 h LEU 424 N 0.35 0.70 -0.81 3.04 3.38 -0.76 -2.07 115.31 119.13 2jj2 h LEU 424 Ca -0.03 -0.26 0.06 0.00 0.09 0.00 0.00 57.88 57.74 2jj2 h LEU 424 Cb 1.21 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.70 2jj2 h LEU 424 CO 0.12 0.94 0.49 0.74 0.09 0.00 0.00 178.44 180.82 2jj2 h THR 425 N 0.58 1.01 -0.02 0.22 2.02 -1.16 -1.28 112.91 114.28 2jj2 h THR 425 Ca 0.07 -0.31 -0.10 0.00 0.77 0.00 0.00 66.41 66.85 2jj2 h THR 425 Cb 0.77 0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 67.21 2jj2 h THR 425 CO 0.06 0.16 -0.46 -0.33 0.37 0.00 0.00 175.52 175.33 2jj2 h GLU 426 N 0.89 0.05 0.00 6.66 4.39 -1.15 -2.79 114.58 122.63 2jj2 h GLU 426 Ca 0.36 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 60.04 2jj2 h GLU 426 Cb 0.19 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 2jj2 h GLU 426 CO -0.18 0.50 0.00 -0.07 -1.16 0.00 0.00 179.01 178.09 2jj2 h LEU 427 N 0.04 0.00 0.00 1.33 3.38 -0.56 -2.93 115.31 116.58 2jj2 h LEU 427 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2jj2 h LEU 427 Cb 0.82 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.57 2jj2 h LEU 427 CO 0.06 0.00 -0.57 0.18 0.09 0.00 0.00 178.44 178.20 2jj2 n LEU 428 N -2.97 0.57 -4.77 1.67 4.77 -0.73 -4.84 117.00 110.71 2jj2 n LEU 428 Ca 0.01 0.11 -0.39 0.00 -0.03 0.00 0.00 56.01 55.71 2jj2 n LEU 428 Cb 0.33 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 2jj2 n LEU 428 CO 0.27 0.04 0.99 -0.54 -1.33 0.00 0.00 177.39 176.83 2jj2 s LYS 429 N -3.08 3.82 -0.19 3.23 1.02 -1.11 -4.43 119.74 119.01 2jj2 s LYS 429 Ca 0.09 2.23 -0.16 0.00 0.02 0.00 0.00 55.97 58.15 2jj2 s LYS 429 Cb 0.16 -2.68 0.05 0.00 -0.52 0.00 0.00 37.83 34.83 2jj2 s LYS 429 CO 0.71 -0.64 0.49 -1.14 -0.92 0.00 0.00 175.35 173.85 2jj2 s GLN 430 N -2.36 0.55 0.86 1.68 0.74 0.08 -4.92 119.66 116.30 2jj2 s GLN 430 Ca 0.59 0.73 -0.11 0.00 0.05 0.00 0.00 55.36 56.62 2jj2 s GLN 430 Cb -0.40 0.23 0.11 0.00 1.10 0.00 0.00 33.01 34.05 2jj2 s GLN 430 CO 0.51 -0.09 1.10 0.20 -0.55 0.00 0.00 175.29 176.46 2jj2 s GLY 431 N 0.50 1.65 0.46 2.59 0.00 -1.26 -3.94 107.32 107.32 2jj2 s GLY 431 Ca -0.02 0.15 -0.11 0.00 0.00 0.00 0.00 44.72 44.74 2jj2 s GLY 431 CO -0.02 0.59 0.84 1.62 0.00 0.00 0.00 173.10 176.12 2jj2 s GLN 432 N -4.86 3.77 -0.68 2.90 0.74 -1.26 -4.26 119.66 116.01 2jj2 s GLN 432 Ca 0.63 0.56 0.00 0.00 0.05 0.00 0.00 55.36 56.60 2jj2 s GLN 432 Cb -0.19 -2.31 0.00 0.00 1.10 0.00 0.00 33.01 31.61 2jj2 s GLN 432 CO 0.57 -0.15 0.00 0.66 -0.55 0.00 0.00 175.29 175.82 2jj2 n TYR 433 N -1.61 0.00 -3.31 1.67 4.02 -1.26 -4.90 117.16 111.76 2jj2 n TYR 433 Ca 0.03 0.00 -0.25 0.00 -0.01 0.00 0.00 57.90 57.67 2jj2 n TYR 433 Cb 0.54 -1.98 -0.08 0.00 -0.02 0.00 0.00 39.34 37.80 2jj2 n TYR 433 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 2jj2 n SER 434 N -0.63 1.04 -4.77 7.72 3.41 -1.26 -5.08 113.62 114.06 2jj2 n SER 434 Ca -0.06 -2.84 -0.38 0.00 -0.26 0.00 0.00 58.87 55.33 2jj2 n SER 434 Cb 0.42 -0.64 0.00 0.00 -0.26 0.00 0.00 64.21 63.74 2jj2 n SER 434 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 2jj2 s PRO 435 N -1.31 3.65 0.14 4.33 0.04 -1.26 -4.87 135.00 135.73 2jj2 s PRO 435 Ca 0.35 1.92 0.05 0.00 0.04 0.00 0.00 61.00 63.36 2jj2 s PRO 435 Cb 0.13 -2.42 -0.04 0.00 0.04 0.00 0.00 34.50 32.21 2jj2 s PRO 435 CO -0.10 -0.68 0.11 -1.64 0.04 0.00 0.00 177.00 174.73 2jj2 s MET 436 N -2.68 2.86 0.68 4.56 -1.94 0.53 -4.95 119.30 118.36 2jj2 s MET 436 Ca 0.64 -0.83 -0.13 0.00 -1.71 0.00 0.00 55.69 53.66 2jj2 s MET 436 Cb -0.32 -2.65 0.01 0.00 2.01 0.00 0.00 34.83 33.87 2jj2 s MET 436 CO 0.39 0.51 1.08 0.00 -0.01 0.00 0.00 175.02 176.99 2jj2 s ALA 437 N -1.64 2.53 0.24 3.03 0.00 -1.26 -4.21 121.76 120.44 2jj2 s ALA 437 Ca 0.30 0.35 -0.07 0.00 0.00 0.00 0.00 51.96 52.54 2jj2 s ALA 437 Cb -0.11 -3.26 0.24 0.00 0.00 0.00 0.00 23.12 20.00 2jj2 s ALA 437 CO 0.23 -1.27 1.90 0.97 0.00 0.00 0.00 175.76 177.59 2jj2 h ILE 438 N -0.31 1.20 0.00 0.00 6.09 -1.99 -1.34 117.51 121.17 2jj2 h ILE 438 Ca -0.45 -0.41 -0.10 0.00 -1.37 0.00 0.00 64.86 62.52 2jj2 h ILE 438 Cb 1.23 -0.11 -0.01 0.00 0.47 0.00 0.00 36.82 38.40 2jj2 h ILE 438 CO 0.55 0.22 -0.48 1.05 -3.07 0.00 0.00 178.15 176.41 2jj2 h GLU 439 N 1.20 0.00 -0.29 2.19 9.09 -1.93 -1.14 114.58 123.71 2jj2 h GLU 439 Ca 0.34 0.00 -0.12 0.00 0.05 0.00 0.00 59.36 59.64 2jj2 h GLU 439 Cb -0.09 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.01 2jj2 h GLU 439 CO -0.09 0.48 -0.28 0.93 0.05 0.00 0.00 179.01 180.11 2jj2 h GLU 440 N 0.00 0.70 0.01 1.06 5.08 -1.82 -2.71 114.58 116.90 2jj2 h GLU 440 Ca -0.00 -0.37 0.01 0.00 -1.00 0.00 0.00 59.36 58.00 2jj2 h GLU 440 Cb 0.94 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.19 2jj2 h GLU 440 CO 0.06 0.98 -0.08 1.96 -1.00 0.00 0.00 179.01 180.94 2jj2 h GLN 441 N 0.45 -0.14 -0.46 2.33 4.20 -0.70 -2.27 115.11 118.53 2jj2 h GLN 441 Ca 0.05 0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.71 2jj2 h GLN 441 Cb 0.85 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.64 2jj2 h GLN 441 CO 0.07 -0.09 0.03 -0.39 -0.67 0.00 0.00 178.83 177.78 2jj2 h VAL 442 N -0.14 1.23 -0.41 -0.54 -1.51 -1.30 -1.12 116.25 112.46 2jj2 h VAL 442 Ca 0.03 -0.90 0.00 0.00 -1.23 0.00 0.00 66.70 64.59 2jj2 h VAL 442 Cb 0.17 0.85 -0.02 0.00 -2.13 0.00 0.00 31.29 30.16 2jj2 h VAL 442 CO -0.07 0.32 0.26 0.00 -1.23 0.00 0.00 177.57 176.85 2jj2 h ALA 443 N 1.34 0.52 -0.36 5.19 0.00 -1.27 0.27 119.26 124.95 2jj2 h ALA 443 Ca 0.14 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2jj2 h ALA 443 Cb 0.38 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 2jj2 h ALA 443 CO 0.01 -0.01 0.13 0.28 0.00 0.00 0.00 179.25 179.66 2jj2 h VAL 444 N 0.54 1.20 -0.40 0.00 2.07 -1.15 -2.87 116.25 115.65 2jj2 h VAL 444 Ca 0.15 -0.61 -0.05 0.00 0.82 0.00 0.00 66.70 67.01 2jj2 h VAL 444 Cb -0.04 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 2jj2 h VAL 444 CO -0.03 0.22 0.05 0.40 0.02 0.00 0.00 177.57 178.22 2jj2 h ILE 445 N 0.43 1.25 -0.85 4.57 2.04 -0.91 -2.69 117.51 121.35 2jj2 h ILE 445 Ca 0.12 -0.90 0.21 0.00 1.00 0.00 0.00 64.86 65.29 2jj2 h ILE 445 Cb 0.21 1.06 -0.15 0.00 -0.74 0.00 0.00 36.82 37.20 2jj2 h ILE 445 CO -0.01 0.31 0.08 0.22 0.00 0.00 0.00 178.15 178.75 2jj2 h TYR 446 N 0.51 0.07 -0.96 1.37 3.20 -0.44 0.62 116.97 121.35 2jj2 h TYR 446 Ca 0.12 0.06 0.03 0.00 3.14 0.00 0.00 58.73 62.08 2jj2 h TYR 446 Cb 0.40 0.10 -0.06 0.00 1.54 0.00 0.00 36.73 38.71 2jj2 h TYR 446 CO 0.03 -0.27 0.63 0.00 -1.64 0.00 0.00 178.16 176.91 2jj2 h ALA 447 N 1.79 1.27 0.10 1.82 0.00 -1.24 -1.31 119.26 121.70 2jj2 h ALA 447 Ca 0.50 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.36 2jj2 h ALA 447 Cb 0.95 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2jj2 h ALA 447 CO -0.72 0.52 -0.05 0.78 0.00 0.00 0.00 179.25 179.78 2jj2 h GLY 448 N 1.23 -0.15 2.00 0.00 0.00 -1.18 -2.31 103.07 102.66 2jj2 h GLY 448 Ca 0.38 0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.77 2jj2 h GLY 448 CO -0.12 -0.05 0.00 -0.39 0.00 0.00 0.00 176.54 175.98 2jj2 h VAL 449 N -0.93 0.00 0.00 4.60 -1.51 -0.87 -0.46 116.25 117.08 2jj2 h VAL 449 Ca -0.01 -0.21 0.00 0.00 -1.23 0.00 0.00 66.70 65.25 2jj2 h VAL 449 Cb 0.51 0.96 0.00 0.00 -2.13 0.00 0.00 31.29 30.63 2jj2 h VAL 449 CO 0.02 0.00 -0.73 0.54 -1.23 0.00 0.00 177.57 176.17 2jj2 n ARG 450 N -2.50 0.20 0.00 5.19 5.12 -0.50 -4.97 116.66 119.20 2jj2 n ARG 450 Ca 0.00 0.03 0.00 0.00 -1.93 0.00 0.00 57.85 55.96 2jj2 n ARG 450 Cb 0.18 -1.60 0.00 0.00 -1.16 0.00 0.00 32.46 29.88 2jj2 n ARG 450 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2jj2 n GLY 451 N 1.39 0.62 0.18 -0.13 0.00 -0.18 -4.97 105.19 102.11 2jj2 n GLY 451 Ca 0.03 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.18 2jj2 n GLY 451 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2jj2 h TYR 452 N 0.00 0.00 -0.34 1.61 -1.99 -1.61 -2.29 116.97 112.35 2jj2 h TYR 452 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2jj2 h TYR 452 Cb 0.00 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.73 2jj2 h TYR 452 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 178.16 179.44 2jj2 n LEU 453 N -2.40 2.95 0.24 3.88 4.77 -1.23 -4.66 117.00 120.55 2jj2 n LEU 453 Ca -0.00 -1.76 0.08 0.00 -0.03 0.00 0.00 56.01 54.30 2jj2 n LEU 453 Cb 0.13 -0.23 0.58 0.00 -2.33 0.00 0.00 43.42 41.57 2jj2 n LEU 453 CO 0.16 0.70 0.92 0.44 -1.33 0.00 0.00 177.39 178.28 2jj2 h ASP 454 N 2.67 0.00 0.32 -1.43 3.32 -1.75 -2.55 116.42 116.99 2jj2 h ASP 454 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2jj2 h ASP 454 Cb 0.75 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.30 2jj2 h ASP 454 CO 0.00 0.17 -1.40 0.29 -1.72 0.00 0.00 179.24 176.58 2jj2 n LYS 455 N -4.07 0.46 -1.97 3.56 5.02 -1.26 -4.92 118.16 114.97 2jj2 n LYS 455 Ca -0.02 -0.06 -0.42 0.00 -2.02 0.00 0.00 58.31 55.79 2jj2 n LYS 455 Cb 0.25 -1.60 -0.03 0.00 -0.02 0.00 0.00 35.03 33.63 2jj2 n LYS 455 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2jj2 s LEU 456 N -4.32 4.37 0.31 -0.35 2.96 -0.96 -4.97 118.68 115.73 2jj2 s LEU 456 Ca -0.01 2.60 -0.29 0.00 -0.22 0.00 0.00 54.13 56.21 2jj2 s LEU 456 Cb 0.14 -3.60 -0.12 0.00 0.50 0.00 0.00 46.19 43.11 2jj2 s LEU 456 CO 0.85 -0.79 1.49 -0.62 -1.32 0.00 0.00 176.35 175.97 2jj2 n GLU 457 N 3.62 2.51 -0.32 1.98 1.02 -1.26 -4.90 120.64 123.29 2jj2 n GLU 457 Ca 0.12 0.89 0.05 0.00 -0.02 0.00 0.00 57.16 58.20 2jj2 n GLU 457 Cb 0.39 -2.61 0.20 0.00 -0.02 0.00 0.00 31.44 29.40 2jj2 n GLU 457 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 2jj2 h PRO 458 N 3.88 0.81 0.00 3.49 0.11 -1.93 -1.07 132.00 137.29 2jj2 h PRO 458 Ca -0.48 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2jj2 h PRO 458 Cb 1.25 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2jj2 h PRO 458 CO 0.72 0.54 0.00 0.66 -0.21 0.00 0.00 178.00 179.71 2jj2 h SER 459 N 0.84 0.00 0.17 -2.05 4.64 -1.99 -2.50 113.55 112.66 2jj2 h SER 459 Ca 0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.76 2jj2 h SER 459 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 2jj2 h SER 459 CO -0.27 0.00 -0.36 0.29 -0.87 0.00 0.00 176.83 175.62 2jj2 n LYS 460 N -2.72 0.87 -0.13 4.77 5.02 -0.41 -4.46 118.16 121.09 2jj2 n LYS 460 Ca -0.01 -0.59 -0.10 0.00 -2.02 0.00 0.00 58.31 55.59 2jj2 n LYS 460 Cb 0.15 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 33.66 2jj2 n LYS 460 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2jj2 h ILE 461 N 1.44 1.26 -0.59 -0.18 1.08 -1.50 -0.04 117.51 118.98 2jj2 h ILE 461 Ca 0.00 -1.00 -0.06 0.00 -0.39 0.00 0.00 64.86 63.40 2jj2 h ILE 461 Cb 0.58 1.14 -0.02 0.00 -3.07 0.00 0.00 36.82 35.44 2jj2 h ILE 461 CO 0.00 0.34 0.12 0.71 -0.69 0.00 0.00 178.15 178.62 2jj2 h THR 462 N 0.51 1.25 -0.75 -0.27 1.35 -1.80 0.14 112.91 113.35 2jj2 h THR 462 Ca 0.11 -0.95 -0.01 0.00 -0.55 0.00 0.00 66.41 65.01 2jj2 h THR 462 Cb 0.47 0.73 -0.04 0.00 -1.73 0.00 0.00 68.15 67.59 2jj2 h THR 462 CO 0.02 0.35 0.42 0.50 -0.25 0.00 0.00 175.52 176.56 2jj2 h LYS 463 N 0.87 1.04 -0.01 4.72 3.64 -1.80 -2.43 116.57 122.60 2jj2 h LYS 463 Ca 0.18 -0.11 -0.00 0.00 -1.27 0.00 0.00 60.65 59.45 2jj2 h LYS 463 Cb 0.39 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 32.00 2jj2 h LYS 463 CO 0.01 0.76 0.00 0.35 -2.27 0.00 0.00 179.45 178.30 2jj2 h PHE 464 N 1.03 0.01 -0.18 1.91 3.57 -0.44 -2.65 116.94 120.19 2jj2 h PHE 464 Ca 0.27 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.78 2jj2 h PHE 464 Cb 0.01 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.73 2jj2 h PHE 464 CO -0.00 0.05 0.07 1.49 -2.23 0.00 0.00 178.31 177.69 2jj2 h GLU 465 N -0.04 0.16 -0.33 1.11 4.81 -0.59 0.29 114.58 119.99 2jj2 h GLU 465 Ca 0.00 -0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.27 2jj2 h GLU 465 Cb 0.05 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.35 2jj2 h GLU 465 CO -0.00 0.10 0.07 -0.97 -0.73 0.00 0.00 179.01 177.48 2jj2 h ASN 466 N 0.16 0.02 -0.11 1.04 -1.24 -1.46 0.10 115.58 114.10 2jj2 h ASN 466 Ca 0.08 0.05 -0.02 0.00 0.71 0.00 0.00 56.30 57.12 2jj2 h ASN 466 Cb 0.04 0.07 -0.00 0.00 0.73 0.00 0.00 38.32 39.16 2jj2 h ASN 466 CO -0.07 0.05 -0.02 0.00 -1.29 0.00 0.00 177.43 176.09 2jj2 h ALA 467 N 1.24 0.15 -0.70 1.57 0.00 -1.14 -0.87 119.26 119.51 2jj2 h ALA 467 Ca 0.15 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.89 2jj2 h ALA 467 Cb 0.17 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.87 2jj2 h ALA 467 CO -0.20 -0.12 0.42 0.35 0.00 0.00 0.00 179.25 179.70 2jj2 h PHE 468 N -0.10 0.79 -0.22 0.00 3.57 -0.21 -0.64 116.94 120.12 2jj2 h PHE 468 Ca 0.03 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.47 2jj2 h PHE 468 Cb 0.42 -0.25 -0.00 0.00 2.79 0.00 0.00 35.95 38.90 2jj2 h PHE 468 CO 0.05 0.42 -0.17 1.25 -2.23 0.00 0.00 178.31 177.63 2jj2 h LEU 469 N 0.81 0.54 -1.39 0.59 5.85 -0.77 -0.82 115.31 120.12 2jj2 h LEU 469 Ca 0.30 -0.45 0.11 0.00 0.84 0.00 0.00 57.88 58.67 2jj2 h LEU 469 Cb 0.09 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 40.91 2jj2 h LEU 469 CO -0.14 0.88 0.52 0.28 -0.34 0.00 0.00 178.44 179.64 2jj2 h SER 470 N 0.21 0.60 -0.02 1.25 0.02 -0.81 -0.26 113.55 114.53 2jj2 h SER 470 Ca 0.04 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.99 2jj2 h SER 470 Cb 0.71 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.14 2jj2 h SER 470 CO 0.05 0.34 -0.06 -0.74 -1.14 0.00 0.00 176.83 175.29 2jj2 h HIS 471 N 0.66 0.10 0.00 3.45 -0.00 -0.86 -1.99 115.15 116.50 2jj2 h HIS 471 Ca 0.37 -0.04 -0.06 0.00 -0.00 0.00 0.00 60.37 60.65 2jj2 h HIS 471 Cb 0.55 -0.02 -0.01 0.00 -0.00 0.00 0.00 27.41 27.93 2jj2 h HIS 471 CO -0.00 0.66 -0.28 -0.39 -0.00 0.00 0.00 177.93 177.93 2jj2 h VAL 472 N -0.50 1.01 -0.18 5.26 -1.51 -0.82 0.11 116.25 119.61 2jj2 h VAL 472 Ca -0.00 -1.01 -0.16 0.00 -1.23 0.00 0.00 66.70 64.30 2jj2 h VAL 472 Cb 0.66 1.57 0.00 0.00 -2.13 0.00 0.00 31.29 31.40 2jj2 h VAL 472 CO 0.01 0.27 -0.53 0.40 -1.23 0.00 0.00 177.57 176.49 2jj2 h ILE 473 N 0.00 1.32 0.02 7.19 2.04 -1.09 -0.57 117.51 126.42 2jj2 h ILE 473 Ca -0.00 -1.76 -0.00 0.00 1.00 0.00 0.00 64.86 64.09 2jj2 h ILE 473 Cb 0.55 1.93 0.00 0.00 -0.74 0.00 0.00 36.82 38.56 2jj2 h ILE 473 CO 0.04 0.55 -0.01 -1.28 0.00 0.00 0.00 178.15 177.45 2jj2 h SER 474 N 0.37 -0.02 0.00 1.72 0.87 -0.84 -3.38 113.55 112.27 2jj2 h SER 474 Ca -0.01 -0.49 0.00 0.00 -1.23 0.00 0.00 61.79 60.05 2jj2 h SER 474 Cb 1.15 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 2jj2 h SER 474 CO 0.11 0.49 -1.06 0.00 -0.53 0.00 0.00 176.83 175.84 2jj2 n GLN 475 N -4.86 1.42 -2.32 2.24 6.02 0.32 -4.67 117.38 115.54 2jj2 n GLN 475 Ca -0.09 -0.05 -0.17 0.00 -0.01 0.00 0.00 57.00 56.68 2jj2 n GLN 475 Cb 0.26 -1.28 0.03 0.00 1.02 0.00 0.00 30.24 30.27 2jj2 n GLN 475 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 2jj2 n HIS 476 N -1.60 2.36 -0.30 1.08 8.25 -0.23 -4.82 115.22 119.98 2jj2 n HIS 476 Ca 0.01 -2.34 0.10 0.00 -0.26 0.00 0.00 57.72 55.23 2jj2 n HIS 476 Cb 0.30 -0.28 0.32 0.00 1.12 0.00 0.00 29.99 31.45 2jj2 n HIS 476 CO 0.00 0.00 0.00 0.37 0.64 0.00 0.00 176.34 177.35 2jj2 h GLN 477 N 2.38 0.79 0.00 -0.41 5.75 -1.72 -0.04 115.11 121.86 2jj2 h GLN 477 Ca 0.21 -0.05 -0.12 0.00 -0.15 0.00 0.00 58.65 58.54 2jj2 h GLN 477 Cb 1.38 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 29.73 2jj2 h GLN 477 CO 0.61 0.52 -0.56 0.00 -2.65 0.00 0.00 178.83 176.75 2jj2 h ALA 478 N 1.58 0.91 -0.20 3.38 0.00 -1.91 0.88 119.26 123.90 2jj2 h ALA 478 Ca 0.46 -0.51 -0.20 0.00 0.00 0.00 0.00 54.91 54.66 2jj2 h ALA 478 Cb 0.60 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2jj2 h ALA 478 CO -0.22 0.70 -0.66 1.25 0.00 0.00 0.00 179.25 180.33 2jj2 h LEU 479 N 0.00 0.86 -0.31 0.00 6.46 -1.55 -0.87 115.31 119.90 2jj2 h LEU 479 Ca -0.01 -0.51 -0.18 0.00 -0.12 0.00 0.00 57.88 57.07 2jj2 h LEU 479 Cb 1.10 -0.25 -0.00 0.00 -0.73 0.00 0.00 40.66 40.78 2jj2 h LEU 479 CO 0.07 1.29 -0.51 -0.07 -0.62 0.00 0.00 178.44 178.61 2jj2 h LEU 480 N 0.54 0.98 -1.57 2.25 3.38 -0.77 -2.53 115.31 117.60 2jj2 h LEU 480 Ca -0.02 -0.52 -0.03 0.00 0.09 0.00 0.00 57.88 57.41 2jj2 h LEU 480 Cb 1.26 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 2jj2 h LEU 480 CO 0.13 1.31 -0.01 -1.28 0.09 0.00 0.00 178.44 178.68 2jj2 h SER 481 N 0.68 0.23 -0.00 -0.43 0.87 0.80 -3.00 113.55 112.69 2jj2 h SER 481 Ca 0.02 -0.03 -0.16 0.00 -1.23 0.00 0.00 61.79 60.40 2jj2 h SER 481 Cb 1.11 -0.06 0.01 0.00 -0.44 0.00 0.00 62.40 63.03 2jj2 h SER 481 CO 0.12 0.29 -0.61 0.50 -0.53 0.00 0.00 176.83 176.60 2jj2 h LYS 482 N 0.25 0.42 -0.29 2.24 3.64 -0.99 -1.26 116.57 120.58 2jj2 h LYS 482 Ca 0.06 -0.45 0.05 0.00 -1.27 0.00 0.00 60.65 59.04 2jj2 h LYS 482 Cb 0.20 0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 2jj2 h LYS 482 CO 0.01 1.11 0.20 0.82 -2.27 0.00 0.00 179.45 179.31 2jj2 h ILE 483 N -0.09 0.95 0.29 2.00 2.04 -1.44 0.56 117.51 121.81 2jj2 h ILE 483 Ca -0.08 -0.06 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 2jj2 h ILE 483 Cb 1.32 0.76 0.00 0.00 -0.74 0.00 0.00 36.82 38.16 2jj2 h ILE 483 CO 0.12 0.03 -0.14 -0.09 0.00 0.00 0.00 178.15 178.07 2jj2 h ARG 484 N 0.17 -0.38 -0.48 2.37 2.43 -1.51 -3.02 114.38 113.96 2jj2 h ARG 484 Ca 0.13 0.03 0.08 0.00 -0.81 0.00 0.00 59.98 59.40 2jj2 h ARG 484 Cb 0.29 0.09 -0.06 0.00 -0.42 0.00 0.00 29.97 29.87 2jj2 h ARG 484 CO -0.02 -0.12 0.11 1.15 -1.51 0.00 0.00 179.97 179.58 2jj2 h THR 485 N -1.03 0.75 0.00 0.20 2.02 -0.59 -2.26 112.91 112.00 2jj2 h THR 485 Ca -0.04 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.05 2jj2 h THR 485 Cb 0.43 0.48 0.00 0.00 -1.74 0.00 0.00 68.15 67.32 2jj2 h THR 485 CO 0.07 0.05 0.00 0.44 0.37 0.00 0.00 175.52 176.44 2jj2 h ASP 486 N 0.26 0.00 0.00 4.18 3.32 -0.05 -3.47 116.42 120.66 2jj2 h ASP 486 Ca 0.24 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.29 2jj2 h ASP 486 Cb 0.30 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.85 2jj2 h ASP 486 CO -0.30 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 177.83 2jj2 n GLY 487 N 0.60 2.99 0.00 2.75 0.00 -0.85 -4.91 105.19 105.76 2jj2 n GLY 487 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2jj2 n GLY 487 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2jj2 n LYS 488 N -1.72 0.00 -3.39 1.61 2.85 -1.22 0.29 118.16 116.58 2jj2 n LYS 488 Ca 0.00 0.00 -0.44 0.00 -1.05 0.00 0.00 58.31 56.82 2jj2 n LYS 488 Cb 0.00 0.00 -0.07 0.00 -0.65 0.00 0.00 35.03 34.31 2jj2 n LYS 488 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 2jj2 s ILE 489 N -1.74 5.12 1.06 0.58 1.01 -1.26 -4.43 121.20 121.53 2jj2 s ILE 489 Ca 0.00 -1.22 -0.14 0.00 0.00 0.00 0.00 60.65 59.29 2jj2 s ILE 489 Cb 0.00 -4.13 0.22 0.00 0.01 0.00 0.00 42.46 38.56 2jj2 s ILE 489 CO 0.00 -0.65 1.10 -0.94 0.00 0.00 0.00 174.94 174.44 2jj2 s SER 490 N 2.82 2.10 0.45 3.58 1.04 -1.26 -4.72 113.70 117.71 2jj2 s SER 490 Ca 0.04 1.04 0.12 0.00 0.48 0.00 0.00 55.95 57.63 2jj2 s SER 490 Cb -0.26 -1.61 1.04 0.00 0.10 0.00 0.00 66.02 65.29 2jj2 s SER 490 CO 0.05 -3.44 2.05 -0.33 0.98 0.00 0.00 173.24 172.56 2jj2 h GLU 491 N -2.10 0.34 -0.09 4.02 5.08 -1.98 0.37 114.58 120.22 2jj2 h GLU 491 Ca -0.53 -0.02 -0.17 0.00 -1.00 0.00 0.00 59.36 57.64 2jj2 h GLU 491 Cb 1.33 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 30.51 2jj2 h GLU 491 CO 0.52 0.23 -0.60 1.49 -1.00 0.00 0.00 179.01 179.65 2jj2 h GLU 492 N 0.35 0.56 -0.05 2.33 4.81 -1.99 -1.40 114.58 119.18 2jj2 h GLU 492 Ca 0.16 -0.49 -0.12 0.00 -0.13 0.00 0.00 59.36 58.78 2jj2 h GLU 492 Cb 0.19 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 2jj2 h GLU 492 CO -0.04 1.11 -0.50 0.77 -0.73 0.00 0.00 179.01 179.63 2jj2 h SER 493 N 0.17 0.14 -0.42 1.04 0.02 -1.83 -2.19 113.55 110.48 2jj2 h SER 493 Ca -0.05 -0.07 -0.07 0.00 -0.84 0.00 0.00 61.79 60.76 2jj2 h SER 493 Cb 1.26 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.74 2jj2 h SER 493 CO 0.12 0.62 -0.01 -0.78 -1.14 0.00 0.00 176.83 175.65 2jj2 h ASP 494 N 0.11 0.73 -0.65 3.07 -0.00 -0.89 -1.91 116.42 116.87 2jj2 h ASP 494 Ca 0.00 -0.31 -0.03 0.00 -0.00 0.00 0.00 57.03 56.69 2jj2 h ASP 494 Cb 0.93 -0.20 -0.03 0.00 -0.00 0.00 0.00 39.33 40.03 2jj2 h ASP 494 CO 0.07 0.87 0.27 0.00 -0.00 0.00 0.00 179.24 180.45 2jj2 h ALA 495 N 0.89 0.84 -0.22 -0.78 0.00 -1.12 -1.53 119.26 117.34 2jj2 h ALA 495 Ca 0.12 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.87 2jj2 h ALA 495 Cb 0.49 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2jj2 h ALA 495 CO 0.02 0.45 0.12 0.87 0.00 0.00 0.00 179.25 180.71 2jj2 h LYS 496 N 0.91 0.24 -0.44 0.00 1.57 -1.33 -2.93 116.57 114.59 2jj2 h LYS 496 Ca 0.22 -0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 58.93 2jj2 h LYS 496 Cb 0.19 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 2jj2 h LYS 496 CO -0.02 0.16 0.05 -0.07 -0.57 0.00 0.00 179.45 179.00 2jj2 h LEU 497 N 0.25 0.72 -0.60 2.94 3.38 -1.24 -1.30 115.31 119.46 2jj2 h LEU 497 Ca 0.09 -0.28 0.12 0.00 0.09 0.00 0.00 57.88 57.90 2jj2 h LEU 497 Cb 0.01 -0.19 -0.11 0.00 0.09 0.00 0.00 40.66 40.46 2jj2 h LEU 497 CO -0.05 0.81 -0.12 0.50 0.09 0.00 0.00 178.44 179.67 2jj2 h LYS 498 N 0.60 0.02 -0.05 1.13 3.64 -1.22 0.63 116.57 121.31 2jj2 h LYS 498 Ca 0.13 -0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.31 2jj2 h LYS 498 Cb 0.42 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.23 2jj2 h LYS 498 CO 0.01 0.01 -0.81 0.93 -2.27 0.00 0.00 179.45 177.33 2jj2 h GLU 499 N 0.02 0.43 0.02 1.90 4.39 -1.32 -2.12 114.58 117.89 2jj2 h GLU 499 Ca 0.29 -0.38 -0.00 0.00 0.34 0.00 0.00 59.36 59.61 2jj2 h GLU 499 Cb 0.46 0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 2jj2 h GLU 499 CO -0.60 1.03 -0.01 0.82 -1.16 0.00 0.00 179.01 179.10 2jj2 h ILE 500 N 0.27 1.15 0.10 3.13 2.04 -0.77 -2.96 117.51 120.47 2jj2 h ILE 500 Ca -0.05 -0.50 -0.00 0.00 1.00 0.00 0.00 64.86 65.31 2jj2 h ILE 500 Cb 1.41 1.48 0.00 0.00 -0.74 0.00 0.00 36.82 38.97 2jj2 h ILE 500 CO 0.14 0.13 -0.05 0.58 0.00 0.00 0.00 178.15 178.95 2jj2 h VAL 501 N -0.24 0.99 0.33 1.67 2.07 -0.92 -1.36 116.25 118.80 2jj2 h VAL 501 Ca -0.00 -0.35 -0.00 0.00 0.82 0.00 0.00 66.70 67.17 2jj2 h VAL 501 Cb 0.23 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 2jj2 h VAL 501 CO 0.00 0.08 -0.30 0.71 0.02 0.00 0.00 177.57 178.09 2jj2 h THR 502 N -0.29 0.37 -0.83 2.57 1.35 -1.47 0.30 112.91 114.90 2jj2 h THR 502 Ca -0.01 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.84 2jj2 h THR 502 Cb 0.24 0.37 -0.04 0.00 -1.73 0.00 0.00 68.15 66.99 2jj2 h THR 502 CO 0.02 0.00 0.48 0.78 -0.25 0.00 0.00 175.52 176.55 2jj2 h ASN 503 N -0.66 1.02 -0.18 5.36 2.35 -1.59 -0.49 115.58 121.39 2jj2 h ASN 503 Ca -0.02 -0.07 -0.02 0.00 -0.55 0.00 0.00 56.30 55.64 2jj2 h ASN 503 Cb 0.59 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.69 2jj2 h ASN 503 CO -0.04 0.80 0.04 0.15 -1.65 0.00 0.00 177.43 176.73 2jj2 h PHE 504 N 1.16 0.31 -0.73 1.19 3.57 -0.87 -1.70 116.94 119.87 2jj2 h PHE 504 Ca 0.30 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.73 2jj2 h PHE 504 Cb -0.01 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 38.61 2jj2 h PHE 504 CO 0.01 0.42 0.35 1.25 -2.23 0.00 0.00 178.31 178.11 2jj2 h LEU 505 N 0.11 0.96 -1.19 0.59 5.85 0.02 0.23 115.31 121.86 2jj2 h LEU 505 Ca 0.06 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.64 2jj2 h LEU 505 Cb 0.27 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.01 2jj2 h LEU 505 CO 0.00 0.82 0.48 0.00 -0.34 0.00 0.00 178.44 179.40 2jj2 h ALA 506 N 1.17 1.40 -0.35 1.25 0.00 -1.06 -0.37 119.26 121.30 2jj2 h ALA 506 Ca 0.25 -0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.97 2jj2 h ALA 506 Cb 0.12 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2jj2 h ALA 506 CO -0.03 0.53 -0.27 0.78 0.00 0.00 0.00 179.25 180.26 2jj2 h GLY 507 N 1.06 0.80 0.99 0.00 0.00 -0.40 -2.99 103.07 102.53 2jj2 h GLY 507 Ca 0.28 -0.71 -0.06 0.00 0.00 0.00 0.00 47.33 46.84 2jj2 h GLY 507 CO -0.06 0.65 0.10 -2.75 0.00 0.00 0.00 176.54 174.49 2jj2 h PHE 508 N 0.63 0.89 -0.29 5.60 3.57 0.13 -2.89 116.94 124.58 2jj2 h PHE 508 Ca 0.08 -0.12 0.00 0.00 3.53 0.00 0.00 57.97 61.46 2jj2 h PHE 508 Cb 0.79 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 39.28 2jj2 h PHE 508 CO 0.04 0.79 0.00 0.39 -2.23 0.00 0.00 178.31 177.30 2jj2 n GLU 509 N -4.42 2.18 0.00 1.11 1.02 -0.22 -5.09 120.64 115.23 2jj2 n GLU 509 Ca 0.02 -1.26 0.06 0.00 -0.02 0.00 0.00 57.16 55.96 2jj2 n GLU 509 Cb 0.24 -1.51 0.37 0.00 -0.02 0.00 0.00 31.44 30.52 2jj2 n GLU 509 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31