#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 2.87 -0.10 -2.67 4.77 -1.26 -2.56 117.00 118.06 2jj2 n LEU 25 Ca 0.00 -1.45 -0.14 0.00 -0.03 0.00 0.00 56.01 54.39 2jj2 n LEU 25 Cb 0.00 -0.46 -0.09 0.00 -2.33 0.00 0.00 43.42 40.55 2jj2 n LEU 25 CO 0.00 0.47 -1.13 -0.62 -1.33 0.00 0.00 177.39 174.78 2jj2 n GLU 26 N 0.44 0.47 -0.01 3.23 1.02 -1.26 -1.63 120.64 122.90 2jj2 n GLU 26 Ca 0.14 0.12 0.10 0.00 -0.02 0.00 0.00 57.16 57.50 2jj2 n GLU 26 Cb 0.57 -1.35 -0.15 0.00 -0.02 0.00 0.00 31.44 30.49 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 -3.18 0.59 -4.47 3.49 -0.58 -1.26 -1.47 120.64 113.77 2jj2 n GLU 27 Ca -0.34 -0.14 -0.22 0.00 -0.42 0.00 0.00 57.16 56.03 2jj2 n GLU 27 Cb 0.85 -1.47 -0.10 0.00 -0.57 0.00 0.00 31.44 30.15 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 -3.28 1.05 0.32 2.62 -4.23 -1.06 -1.93 115.64 109.13 2jj2 s THR 28 Ca -0.04 -2.00 -0.14 0.00 -1.18 0.00 0.00 61.69 58.33 2jj2 s THR 28 Cb 0.13 -2.69 0.02 0.00 1.34 0.00 0.00 72.50 71.31 2jj2 s THR 28 CO 0.84 0.00 0.64 -0.83 -0.54 0.00 0.00 174.62 174.73 2jj2 s GLY 29 N -3.51 0.48 0.13 3.99 0.00 0.20 -0.90 107.32 107.71 2jj2 s GLY 29 Ca 0.33 -0.80 0.10 0.00 0.00 0.00 0.00 44.72 44.35 2jj2 s GLY 29 CO 0.15 -0.45 -0.24 0.50 0.00 0.00 0.00 173.10 173.06 2jj2 s ARG 30 N -3.27 1.31 -0.18 2.90 0.52 -0.53 -0.18 118.95 119.53 2jj2 s ARG 30 Ca 0.19 -1.31 -0.29 0.00 -0.52 0.00 0.00 55.73 53.79 2jj2 s ARG 30 Cb -0.03 -1.67 -0.00 0.00 0.52 0.00 0.00 34.95 33.76 2jj2 s ARG 30 CO 0.11 0.39 1.08 0.08 0.02 0.00 0.00 175.30 176.98 2jj2 s VAL 31 N -1.24 4.60 -0.13 3.52 1.01 -0.05 -0.21 120.40 127.89 2jj2 s VAL 31 Ca 0.12 1.92 -0.27 0.00 0.00 0.00 0.00 61.98 63.75 2jj2 s VAL 31 Cb -0.09 -4.24 -0.24 0.00 0.00 0.00 0.00 36.38 31.81 2jj2 s VAL 31 CO 0.06 -0.12 0.72 -0.07 0.00 0.00 0.00 175.10 175.70 2jj2 h LEU 32 N 9.06 -0.00 -7.61 3.92 3.38 -0.75 1.36 115.31 124.66 2jj2 h LEU 32 Ca -0.24 -0.92 -0.14 0.00 0.09 0.00 0.00 57.88 56.67 2jj2 h LEU 32 Cb 1.10 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.63 2jj2 h LEU 32 CO 0.94 0.95 -0.41 -0.94 0.09 0.00 0.00 178.44 179.08 2jj2 s SER 33 N -6.16 -0.11 -0.08 -0.43 1.04 -1.12 -4.72 113.70 102.12 2jj2 s SER 33 Ca -0.18 0.04 -0.04 0.00 0.48 0.00 0.00 55.95 56.26 2jj2 s SER 33 Cb -0.03 0.31 0.04 0.00 0.10 0.00 0.00 66.02 66.44 2jj2 s SER 33 CO 0.64 -0.33 0.19 -0.51 0.98 0.00 0.00 173.24 174.20 2jj2 s ILE 34 N -1.03 -0.06 -0.21 -1.02 1.10 -1.26 0.30 121.20 119.03 2jj2 s ILE 34 Ca -0.11 0.17 -0.30 0.00 -0.51 0.00 0.00 60.65 59.90 2jj2 s ILE 34 Cb -0.05 -0.30 0.15 0.00 0.15 0.00 0.00 42.46 42.41 2jj2 s ILE 34 CO 0.02 0.07 1.16 -0.83 -2.11 0.00 0.00 174.94 173.25 2jj2 s GLY 35 N 1.26 -0.14 -1.58 1.50 0.00 -0.69 -5.00 107.32 102.66 2jj2 s GLY 35 Ca -0.09 2.24 -0.15 0.00 0.00 0.00 0.00 44.72 46.73 2jj2 s GLY 35 CO -0.07 0.97 0.90 1.22 0.00 0.00 0.00 173.10 176.12 2jj2 n ASP 36 N 0.50 -4.14 -0.12 1.64 8.00 -1.26 -1.09 116.55 120.08 2jj2 n ASP 36 Ca -0.05 -0.86 -0.02 0.00 0.71 0.00 0.00 54.79 54.58 2jj2 n ASP 36 Cb 0.58 -3.51 -0.01 0.00 -0.02 0.00 0.00 41.12 38.17 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 -1.60 0.46 3.08 0.44 0.00 -1.26 -5.01 105.19 101.31 2jj2 n GLY 37 Ca 0.04 -0.17 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 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 -1.81 1.98 -0.25 -0.61 -1.09 -0.25 -0.88 121.20 118.30 2jj2 s ILE 38 Ca 0.00 -1.07 -0.10 0.00 -2.23 0.00 0.00 60.65 57.25 2jj2 s ILE 38 Cb 0.00 -1.90 -0.04 0.00 -1.58 0.00 0.00 42.46 38.94 2jj2 s ILE 38 CO 0.00 0.36 0.14 0.00 -1.23 0.00 0.00 174.94 174.21 2jj2 s ALA 39 N 1.28 3.46 -0.31 9.38 0.00 0.13 -1.70 121.76 134.00 2jj2 s ALA 39 Ca 0.01 -0.98 -0.21 0.00 0.00 0.00 0.00 51.96 50.78 2jj2 s ALA 39 Cb -0.15 -2.26 -0.01 0.00 0.00 0.00 0.00 23.12 20.70 2jj2 s ALA 39 CO -0.10 -0.31 0.67 1.03 0.00 0.00 0.00 175.76 177.04 2jj2 s ARG 40 N 1.29 3.89 -0.13 0.00 1.81 0.15 -0.01 118.95 125.95 2jj2 s ARG 40 Ca 0.06 0.34 0.00 0.00 -1.72 0.00 0.00 55.73 54.41 2jj2 s ARG 40 Cb -0.14 -3.74 -0.01 0.00 -0.45 0.00 0.00 34.95 30.60 2jj2 s ARG 40 CO 0.06 -0.61 -0.13 0.08 -0.68 0.00 0.00 175.30 174.01 2jj2 s VAL 41 N 2.70 3.03 0.10 3.52 1.01 0.80 0.03 120.40 131.59 2jj2 s VAL 41 Ca 0.27 -0.67 -0.23 0.00 0.00 0.00 0.00 61.98 61.35 2jj2 s VAL 41 Cb -0.15 -2.27 -0.07 0.00 0.00 0.00 0.00 36.38 33.90 2jj2 s VAL 41 CO 0.12 0.53 0.68 -2.28 0.00 0.00 0.00 175.10 174.15 2jj2 s HIS 42 N 0.31 3.82 0.00 5.22 2.46 0.70 0.30 115.29 128.11 2jj2 s HIS 42 Ca -0.11 1.43 0.00 0.00 0.47 0.00 0.00 55.06 56.86 2jj2 s HIS 42 Cb -0.16 -2.66 0.00 0.00 -0.13 0.00 0.00 32.58 29.63 2jj2 s HIS 42 CO 0.06 0.49 0.00 0.41 -2.47 0.00 0.00 174.74 173.22 2jj2 n GLY 43 N 1.86 0.70 3.99 1.59 0.00 -1.26 -1.45 105.19 110.62 2jj2 n GLY 43 Ca -0.07 -1.22 -0.28 0.00 0.00 0.00 0.00 46.02 44.45 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 -1.99 0.29 0.99 4.77 -0.08 -4.68 117.00 116.31 2jj2 n LEU 44 Ca 0.00 -1.06 0.17 0.00 -0.03 0.00 0.00 56.01 55.08 2jj2 n LEU 44 Cb 0.00 -2.11 0.91 0.00 -2.33 0.00 0.00 43.42 39.89 2jj2 n LEU 44 CO 0.00 0.46 1.07 0.03 -1.33 0.00 0.00 177.39 177.62 2jj2 h ARG 45 N -1.87 0.00 -0.03 3.23 2.47 -1.20 -2.70 114.38 114.29 2jj2 h ARG 45 Ca -0.64 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.08 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 0.62 0.04 -0.09 0.09 0.56 0.00 0.00 179.97 181.20 2jj2 n ASN 46 N -3.46 2.77 -4.72 7.04 3.02 -0.54 -4.98 115.26 114.38 2jj2 n ASN 46 Ca -0.02 -1.89 -0.39 0.00 -0.03 0.00 0.00 54.58 52.25 2jj2 n ASN 46 Cb 0.16 0.09 0.04 0.00 -0.61 0.00 0.00 39.78 39.46 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 1.06 3.60 -3.55 2.41 0.24 -1.02 -5.01 118.33 116.05 2jj2 n VAL 47 Ca 0.13 -0.50 -0.31 0.00 -2.04 0.00 0.00 64.34 61.63 2jj2 n VAL 47 Cb 0.57 -1.59 -0.04 0.00 -1.47 0.00 0.00 33.84 31.30 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 -2.75 3.66 0.08 7.34 -0.21 -1.26 -5.05 119.66 121.48 2jj2 s GLN 48 Ca 0.70 0.01 -0.34 0.00 0.02 0.00 0.00 55.36 55.75 2jj2 s GLN 48 Cb -0.43 -2.76 -0.13 0.00 1.00 0.00 0.00 33.01 30.69 2jj2 s GLN 48 CO 0.50 0.38 1.69 0.00 -2.12 0.00 0.00 175.29 175.74 2jj2 n ALA 49 N -0.21 1.29 -1.08 6.09 0.00 -1.26 -2.14 120.51 123.21 2jj2 n ALA 49 Ca -0.02 0.39 -0.03 0.00 0.00 0.00 0.00 53.44 53.78 2jj2 n ALA 49 Cb 0.52 -2.42 -0.01 0.00 0.00 0.00 0.00 19.45 17.55 2jj2 n ALA 49 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2jj2 n GLU 50 N 4.57 -0.22 -2.92 0.00 1.02 0.18 -5.01 120.64 118.26 2jj2 n GLU 50 Ca 0.19 0.54 -0.39 0.00 -0.02 0.00 0.00 57.16 57.48 2jj2 n GLU 50 Cb 0.30 -4.12 -0.06 0.00 -0.02 0.00 0.00 31.44 27.54 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 -2.02 4.63 -0.55 3.49 2.12 -0.91 -4.62 118.70 120.84 2jj2 s GLU 51 Ca 0.00 1.24 -0.28 0.00 0.36 0.00 0.00 54.97 56.29 2jj2 s GLU 51 Cb 0.00 -3.22 0.03 0.00 0.26 0.00 0.00 34.13 31.20 2jj2 s GLU 51 CO 0.00 0.54 1.19 -1.64 -0.54 0.00 0.00 175.26 174.80 2jj2 s MET 52 N -1.24 3.56 0.49 4.30 -1.94 -1.26 -1.40 119.30 121.80 2jj2 s MET 52 Ca 0.38 0.34 0.07 0.00 -1.71 0.00 0.00 55.69 54.77 2jj2 s MET 52 Cb -0.23 -3.99 0.04 0.00 2.01 0.00 0.00 34.83 32.65 2jj2 s MET 52 CO 0.27 -1.62 0.67 0.14 -0.01 0.00 0.00 175.02 174.48 2jj2 s VAL 53 N 4.87 2.72 -0.05 -6.03 -7.23 0.08 -4.27 120.40 110.48 2jj2 s VAL 53 Ca 0.45 -0.94 0.01 0.00 -1.81 0.00 0.00 61.98 59.69 2jj2 s VAL 53 Cb -0.07 -2.78 0.02 0.00 0.56 0.00 0.00 36.38 34.11 2jj2 s VAL 53 CO 0.27 0.00 -0.05 -0.70 -0.31 0.00 0.00 175.10 174.31 2jj2 s GLU 54 N -4.51 0.92 0.56 4.82 2.12 0.41 -1.01 118.70 122.02 2jj2 s GLU 54 Ca 0.57 -0.12 -0.10 0.00 0.36 0.00 0.00 54.97 55.68 2jj2 s GLU 54 Cb -0.09 -0.93 -0.04 0.00 0.26 0.00 0.00 34.13 33.33 2jj2 s GLU 54 CO 0.36 -0.09 0.95 -0.06 -0.54 0.00 0.00 175.26 175.87 2jj2 s PHE 55 N 1.00 3.59 0.54 5.30 0.40 -0.08 -0.25 117.98 128.48 2jj2 s PHE 55 Ca -0.10 1.18 0.38 0.00 -0.60 0.00 0.00 56.93 57.79 2jj2 s PHE 55 Cb -0.14 -2.61 2.02 0.00 0.51 0.00 0.00 43.02 42.80 2jj2 s PHE 55 CO -0.00 -0.53 2.25 0.66 0.70 0.00 0.00 175.22 178.30 2jj2 h SER 56 N 0.02 0.00 1.21 1.36 4.64 -1.62 -0.06 113.55 119.11 2jj2 h SER 56 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 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 0.02 -0.25 -1.54 -0.87 0.00 0.00 176.83 174.81 2jj2 n SER 57 N -3.32 0.75 0.00 4.97 3.41 -1.26 -4.94 113.62 113.23 2jj2 n SER 57 Ca -0.02 0.38 0.00 0.00 -0.26 0.00 0.00 58.87 58.97 2jj2 n SER 57 Cb 0.13 -0.40 0.00 0.00 -0.26 0.00 0.00 64.21 63.68 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 1.33 0.64 3.77 5.00 0.00 -0.03 -5.09 105.19 110.80 2jj2 n GLY 58 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 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 0.64 0.99 1.43 -1.26 -4.83 118.68 119.96 2jj2 s LEU 59 Ca 0.00 2.45 -0.05 0.00 -1.03 0.00 0.00 54.13 55.51 2jj2 s LEU 59 Cb 0.00 -3.85 0.04 0.00 0.03 0.00 0.00 46.19 42.41 2jj2 s LEU 59 CO 0.00 -0.57 0.93 -0.54 0.23 0.00 0.00 176.35 176.40 2jj2 s LYS 60 N -2.02 2.47 0.14 1.70 -0.14 -1.26 -0.90 119.74 119.73 2jj2 s LYS 60 Ca 0.53 -0.31 -0.18 0.00 -1.36 0.00 0.00 55.97 54.65 2jj2 s LYS 60 Cb -0.34 -2.27 0.04 0.00 -1.68 0.00 0.00 37.83 33.58 2jj2 s LYS 60 CO 0.44 -0.97 0.46 0.20 -0.76 0.00 0.00 175.35 174.72 2jj2 s GLY 61 N -4.44 -0.34 -0.09 -3.33 0.00 -0.18 -1.99 107.32 96.95 2jj2 s GLY 61 Ca 0.58 0.07 0.04 0.00 0.00 0.00 0.00 44.72 45.41 2jj2 s GLY 61 CO 0.43 -0.18 -0.23 -0.29 0.00 0.00 0.00 173.10 172.83 2jj2 s MET 62 N -3.80 2.86 -1.09 2.90 1.75 -0.40 -0.74 119.30 120.78 2jj2 s MET 62 Ca 0.03 -0.82 -0.19 0.00 -1.25 0.00 0.00 55.69 53.45 2jj2 s MET 62 Cb 0.01 -2.18 0.09 0.00 2.84 0.00 0.00 34.83 35.59 2jj2 s MET 62 CO -0.11 0.17 1.44 -1.12 -0.65 0.00 0.00 175.02 174.74 2jj2 s SER 63 N 0.36 6.70 -0.05 1.11 0.01 -0.50 -0.75 113.70 120.58 2jj2 s SER 63 Ca -0.18 -2.06 -0.06 0.00 1.31 0.00 0.00 55.95 54.97 2jj2 s SER 63 Cb -0.18 -2.51 -0.28 0.00 0.21 0.00 0.00 66.02 63.27 2jj2 s SER 63 CO 0.08 -1.21 0.63 -0.07 0.41 0.00 0.00 173.24 173.09 2jj2 h LEU 64 N 11.71 0.45 -8.50 2.44 3.38 -1.82 0.50 115.31 123.48 2jj2 h LEU 64 Ca 0.26 -0.76 -0.66 0.00 0.09 0.00 0.00 57.88 56.82 2jj2 h LEU 64 Cb 0.96 -0.15 -0.25 0.00 0.09 0.00 0.00 40.66 41.31 2jj2 h LEU 64 CO 1.33 1.65 -0.67 0.20 0.09 0.00 0.00 178.44 181.05 2jj2 s ASN 65 N -7.04 4.78 -0.36 -0.43 -0.87 -1.01 -4.78 114.94 105.23 2jj2 s ASN 65 Ca -0.15 -0.37 -0.10 0.00 -1.57 0.00 0.00 52.86 50.68 2jj2 s ASN 65 Cb 0.06 -1.84 0.03 0.00 -0.02 0.00 0.00 41.25 39.48 2jj2 s ASN 65 CO 0.83 -0.05 0.17 -0.76 -2.57 0.00 0.00 177.10 174.72 2jj2 s LEU 66 N 1.54 4.57 0.31 0.60 1.43 -1.26 0.04 118.68 125.90 2jj2 s LEU 66 Ca 0.05 -1.01 0.09 0.00 -1.03 0.00 0.00 54.13 52.24 2jj2 s LEU 66 Cb -0.15 -1.98 -0.05 0.00 0.03 0.00 0.00 46.19 44.05 2jj2 s LEU 66 CO 0.00 -0.36 0.05 -1.61 0.23 0.00 0.00 176.35 174.67 2jj2 s GLU 67 N 1.52 2.27 0.25 1.70 2.02 -0.11 -5.02 118.70 121.32 2jj2 s GLU 67 Ca 0.01 -1.54 -0.05 0.00 0.02 0.00 0.00 54.97 53.41 2jj2 s GLU 67 Cb -0.19 -2.11 0.48 0.00 0.10 0.00 0.00 34.13 32.40 2jj2 s GLU 67 CO 0.06 0.22 1.68 -1.35 0.02 0.00 0.00 175.26 175.88 2jj2 h PRO 68 N 1.74 0.25 -0.09 0.39 0.11 -2.03 -3.18 132.00 129.20 2jj2 h PRO 68 Ca -0.44 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2jj2 h PRO 68 Cb 1.25 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2jj2 h PRO 68 CO 0.63 0.17 0.00 -0.40 -0.21 0.00 0.00 178.00 178.19 2jj2 n ASP 69 N -5.17 1.99 -3.46 -2.05 5.68 -1.26 -5.02 116.55 107.26 2jj2 n ASP 69 Ca 0.15 -1.65 -0.12 0.00 -0.50 0.00 0.00 54.79 52.67 2jj2 n ASP 69 Cb 0.47 -0.06 -0.03 0.00 -1.14 0.00 0.00 41.12 40.37 2jj2 n ASP 69 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2jj2 s ASN 70 N -0.75 -0.51 -0.22 -1.12 2.20 -1.20 -4.71 114.94 108.63 2jj2 s ASN 70 Ca 0.09 0.09 -0.07 0.00 -0.94 0.00 0.00 52.86 52.03 2jj2 s ASN 70 Cb 0.05 0.52 -0.03 0.00 -2.00 0.00 0.00 41.25 39.79 2jj2 s ASN 70 CO 0.07 -0.81 0.06 -0.69 -2.94 0.00 0.00 177.10 172.80 2jj2 s VAL 71 N -3.19 4.49 -0.57 3.54 1.01 0.15 -0.93 120.40 124.89 2jj2 s VAL 71 Ca 0.01 -0.12 -0.25 0.00 0.00 0.00 0.00 61.98 61.61 2jj2 s VAL 71 Cb -0.01 -3.06 0.04 0.00 0.00 0.00 0.00 36.38 33.35 2jj2 s VAL 71 CO -0.09 0.39 0.99 -0.83 0.00 0.00 0.00 175.10 175.56 2jj2 s GLY 72 N 1.09 1.35 -0.16 4.51 0.00 0.11 -0.14 107.32 114.07 2jj2 s GLY 72 Ca 0.04 -1.21 -0.07 0.00 0.00 0.00 0.00 44.72 43.49 2jj2 s GLY 72 CO 0.03 2.14 0.07 0.14 0.00 0.00 0.00 173.10 175.48 2jj2 s VAL 73 N 4.17 4.87 -0.25 1.40 1.01 0.98 -2.41 120.40 130.16 2jj2 s VAL 73 Ca 0.32 -0.01 -0.16 0.00 0.00 0.00 0.00 61.98 62.13 2jj2 s VAL 73 Cb -0.12 -3.16 -0.03 0.00 0.00 0.00 0.00 36.38 33.06 2jj2 s VAL 73 CO 0.20 0.50 0.43 0.54 0.00 0.00 0.00 175.10 176.77 2jj2 s VAL 74 N -0.01 5.14 -0.11 2.92 0.11 0.08 -0.69 120.40 127.83 2jj2 s VAL 74 Ca 0.06 0.71 -0.25 0.00 -2.93 0.00 0.00 61.98 59.57 2jj2 s VAL 74 Cb -0.12 -3.75 -0.02 0.00 -1.53 0.00 0.00 36.38 30.96 2jj2 s VAL 74 CO 0.01 0.15 0.81 -0.69 -3.33 0.00 0.00 175.10 172.05 2jj2 s VAL 75 N 2.00 4.93 -1.22 2.04 1.01 -0.06 -1.27 120.40 127.83 2jj2 s VAL 75 Ca 0.18 1.63 -0.04 0.00 0.00 0.00 0.00 61.98 63.74 2jj2 s VAL 75 Cb -0.16 -4.13 0.19 0.00 0.00 0.00 0.00 36.38 32.29 2jj2 s VAL 75 CO 0.09 0.12 2.14 0.49 0.00 0.00 0.00 175.10 177.94 2jj2 n PHE 76 N 4.60 2.66 -3.11 5.22 3.01 -0.84 -4.70 117.46 124.29 2jj2 n PHE 76 Ca 0.03 -2.73 0.00 0.00 1.01 0.00 0.00 57.45 55.76 2jj2 n PHE 76 Cb 0.50 -1.62 0.00 0.00 -0.01 0.00 0.00 39.48 38.35 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 1.21 -0.62 3.75 1.37 0.00 -1.26 -4.46 105.19 105.18 2jj2 n GLY 77 Ca 0.55 -1.35 -0.41 0.00 0.00 0.00 0.00 46.02 44.81 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 -4.00 7.24 0.40 1.61 3.84 -1.26 -4.91 114.94 117.86 2jj2 s ASN 78 Ca 0.00 2.24 0.16 0.00 0.21 0.00 0.00 52.86 55.47 2jj2 s ASN 78 Cb 0.00 -2.62 0.86 0.00 -0.55 0.00 0.00 41.25 38.93 2jj2 s ASN 78 CO 0.00 -0.19 1.87 0.44 -2.79 0.00 0.00 177.10 176.43 2jj2 h ASP 79 N 4.22 0.00 -0.72 -4.21 3.32 -1.97 -3.23 116.42 113.82 2jj2 h ASP 79 Ca -0.46 0.00 0.21 0.00 0.02 0.00 0.00 57.03 56.80 2jj2 h ASP 79 Cb 1.21 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.73 2jj2 h ASP 79 CO 0.69 0.32 0.57 0.07 -1.72 0.00 0.00 179.24 179.17 2jj2 h LYS 80 N 0.00 0.00 0.00 3.56 2.10 -2.01 0.43 116.57 120.64 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 0.61 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.94 2jj2 h LYS 80 CO 0.04 0.00 0.00 1.28 -2.00 0.00 0.00 179.45 178.77 2jj2 n LEU 81 N -4.10 0.00 -4.14 7.07 4.77 -1.22 -4.74 117.00 114.63 2jj2 n LEU 81 Ca 0.15 0.10 -0.30 0.00 -0.03 0.00 0.00 56.01 55.93 2jj2 n LEU 81 Cb 0.84 -0.10 -0.17 0.00 -2.33 0.00 0.00 43.42 41.66 2jj2 n LEU 81 CO 0.35 -0.00 -0.53 -0.63 -1.33 0.00 0.00 177.39 175.25 2jj2 s ILE 82 N -2.21 1.77 0.28 -0.08 1.01 0.14 -4.60 121.20 117.50 2jj2 s ILE 82 Ca 0.41 -0.83 0.12 0.00 0.00 0.00 0.00 60.65 60.34 2jj2 s ILE 82 Cb 0.21 -1.56 -0.05 0.00 0.01 0.00 0.00 42.46 41.08 2jj2 s ILE 82 CO 0.40 0.49 -0.20 -0.54 0.00 0.00 0.00 174.94 175.10 2jj2 s LYS 83 N 0.58 1.66 0.23 2.79 1.02 -1.26 -4.96 119.74 119.80 2jj2 s LYS 83 Ca -0.14 -1.76 -0.31 0.00 0.02 0.00 0.00 55.97 53.77 2jj2 s LYS 83 Cb -0.17 -1.73 -0.13 0.00 -0.52 0.00 0.00 37.83 35.28 2jj2 s LYS 83 CO 0.05 0.32 1.42 -1.91 -0.92 0.00 0.00 175.35 174.30 2jj2 n GLU 84 N -0.61 2.03 -0.76 1.68 2.13 -1.26 -2.22 120.64 121.63 2jj2 n GLU 84 Ca -0.05 0.72 0.00 0.00 0.66 0.00 0.00 57.16 58.49 2jj2 n GLU 84 Cb 0.60 -2.39 0.00 0.00 0.27 0.00 0.00 31.44 29.92 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 2.22 0.71 3.77 8.31 0.00 0.47 -4.92 105.19 115.75 2jj2 n GLY 85 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.36 6.89 -0.02 1.61 1.11 -0.94 -4.59 116.67 118.37 2jj2 s ASP 86 Ca 0.00 2.14 -0.30 0.00 0.18 0.00 0.00 52.55 54.57 2jj2 s ASP 86 Cb 0.00 -2.60 -0.03 0.00 1.07 0.00 0.00 42.92 41.36 2jj2 s ASP 86 CO 0.00 -0.40 1.01 -0.63 1.18 0.00 0.00 175.17 176.33 2jj2 s ILE 87 N -1.47 4.77 -0.13 0.77 1.09 -1.26 -0.88 121.20 124.09 2jj2 s ILE 87 Ca 0.53 2.00 -0.00 0.00 -1.10 0.00 0.00 60.65 62.08 2jj2 s ILE 87 Cb -0.26 -4.28 -0.02 0.00 -1.06 0.00 0.00 42.46 36.84 2jj2 s ILE 87 CO 0.33 0.12 -0.12 -0.69 -0.10 0.00 0.00 174.94 174.48 2jj2 s VAL 88 N 1.28 3.17 -0.06 2.92 1.01 0.75 -1.61 120.40 127.86 2jj2 s VAL 88 Ca 0.52 -0.62 0.05 0.00 0.00 0.00 0.00 61.98 61.93 2jj2 s VAL 88 Cb -0.21 -2.33 -0.01 0.00 0.00 0.00 0.00 36.38 33.82 2jj2 s VAL 88 CO 0.26 0.53 -0.23 -0.54 0.00 0.00 0.00 175.10 175.11 2jj2 s LYS 89 N 0.24 2.61 0.33 2.72 1.02 0.65 -0.63 119.74 126.68 2jj2 s LYS 89 Ca -0.08 -0.87 -0.29 0.00 0.02 0.00 0.00 55.97 54.75 2jj2 s LYS 89 Cb -0.15 -2.22 -0.10 0.00 -0.52 0.00 0.00 37.83 34.84 2jj2 s LYS 89 CO 0.05 0.39 1.31 1.03 -0.92 0.00 0.00 175.35 177.22 2jj2 s ARG 90 N -0.19 4.35 0.00 1.68 0.52 -0.81 -0.44 118.95 124.06 2jj2 s ARG 90 Ca -0.03 2.23 0.06 0.00 -0.52 0.00 0.00 55.73 57.48 2jj2 s ARG 90 Cb -0.14 -3.07 0.03 0.00 0.52 0.00 0.00 34.95 32.29 2jj2 s ARG 90 CO 0.03 -0.20 0.60 0.25 0.02 0.00 0.00 175.30 176.00 2jj2 n THR 91 N 0.81 0.00 -1.35 0.02 -2.24 -1.26 -4.93 114.28 105.33 2jj2 n THR 91 Ca 0.00 -0.47 -0.08 0.00 -2.27 0.00 0.00 64.05 61.23 2jj2 n THR 91 Cb 0.42 1.10 -0.03 0.00 -2.10 0.00 0.00 70.33 69.72 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 0.53 0.87 3.79 3.38 0.00 -1.26 -5.02 105.19 107.48 2jj2 n GLY 92 Ca 0.03 -0.67 -0.31 0.00 0.00 0.00 0.00 46.02 45.07 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 -2.31 2.50 -0.10 4.61 0.00 -1.26 -5.08 121.76 120.12 2jj2 s ALA 93 Ca 0.00 0.22 -0.05 0.00 0.00 0.00 0.00 51.96 52.14 2jj2 s ALA 93 Cb 0.00 -3.23 0.05 0.00 0.00 0.00 0.00 23.12 19.94 2jj2 s ALA 93 CO 0.00 -1.41 0.23 -1.50 0.00 0.00 0.00 175.76 173.08 2jj2 s ILE 94 N -2.88 -0.16 -1.04 0.00 -1.16 -1.26 -4.68 121.20 110.03 2jj2 s ILE 94 Ca 0.60 0.21 -0.23 0.00 -0.51 0.00 0.00 60.65 60.72 2jj2 s ILE 94 Cb -0.16 -0.37 -0.03 0.00 0.61 0.00 0.00 42.46 42.51 2jj2 s ILE 94 CO 0.53 0.08 1.85 -0.69 -2.81 0.00 0.00 174.94 173.90 2jj2 s VAL 95 N 1.64 3.61 0.15 4.00 1.01 -1.26 -4.88 120.40 124.66 2jj2 s VAL 95 Ca -0.06 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.22 2jj2 s VAL 95 Cb -0.11 -4.44 -0.05 0.00 0.00 0.00 0.00 36.38 31.79 2jj2 s VAL 95 CO -0.08 -1.20 -0.05 1.51 0.00 0.00 0.00 175.10 175.28 2jj2 s ASP 96 N 6.78 1.47 0.10 3.32 -4.77 -1.26 -1.46 116.67 120.86 2jj2 s ASP 96 Ca 0.65 -1.08 0.09 0.00 -3.30 0.00 0.00 52.55 48.91 2jj2 s ASP 96 Cb -0.03 0.05 -0.04 0.00 -1.09 0.00 0.00 42.92 41.82 2jj2 s ASP 96 CO 0.03 -0.45 -0.23 0.68 0.70 0.00 0.00 175.17 175.90 2jj2 s VAL 97 N -3.50 1.91 0.49 2.11 -7.23 0.11 -4.86 120.40 109.41 2jj2 s VAL 97 Ca 0.19 -1.57 -0.21 0.00 -1.81 0.00 0.00 61.98 58.58 2jj2 s VAL 97 Cb 0.05 -1.70 -0.10 0.00 0.56 0.00 0.00 36.38 35.18 2jj2 s VAL 97 CO 0.01 0.04 0.74 -0.81 -0.31 0.00 0.00 175.10 174.77 2jj2 n PRO 98 N 1.15 0.84 -3.79 4.82 -0.04 -1.26 -1.63 135.00 135.08 2jj2 n PRO 98 Ca -0.19 0.31 -0.13 0.00 -0.04 0.00 0.00 63.50 63.46 2jj2 n PRO 98 Cb 0.53 -1.82 -0.11 0.00 -0.04 0.00 0.00 33.50 32.06 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 -1.48 0.00 -3.45 0.52 1.01 -0.33 -4.78 120.40 111.90 2jj2 s VAL 99 Ca 0.67 -0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.61 2jj2 s VAL 99 Cb -0.52 -0.36 0.00 0.00 0.00 0.00 0.00 36.38 35.51 2jj2 s VAL 99 CO 0.55 -0.02 0.00 0.61 0.00 0.00 0.00 175.10 176.24 2jj2 n GLY 100 N 2.85 0.92 0.04 4.51 0.00 -1.26 -3.84 105.19 108.40 2jj2 n GLY 100 Ca -0.13 -2.06 0.11 0.00 0.00 0.00 0.00 46.02 43.94 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 -1.21 0.07 0.01 1.61 1.02 -1.26 -2.40 120.64 118.48 2jj2 n GLU 101 Ca 0.00 0.18 0.12 0.00 -0.02 0.00 0.00 57.16 57.44 2jj2 n GLU 101 Cb 0.00 -1.60 0.52 0.00 -0.02 0.00 0.00 31.44 30.34 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 -1.73 0.03 0.16 3.49 0.00 -1.26 -2.22 120.64 119.12 2jj2 n GLU 102 Ca 0.05 0.09 0.13 0.00 0.00 0.00 0.00 57.16 57.43 2jj2 n GLU 102 Cb 0.28 -1.54 0.30 0.00 0.00 0.00 0.00 31.44 30.48 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 -9.66 -1.84 3.38 -1.84 -3.42 115.31 101.93 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 0.46 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.25 2jj2 h LEU 103 CO 0.00 0.00 0.79 -0.76 0.09 0.00 0.00 178.44 178.56 2jj2 s LEU 104 N -5.37 4.38 0.00 1.67 1.43 -0.94 -1.70 118.68 118.15 2jj2 s LEU 104 Ca 0.09 2.58 0.00 0.00 -1.03 0.00 0.00 54.13 55.77 2jj2 s LEU 104 Cb 0.09 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.70 2jj2 s LEU 104 CO 0.63 -0.73 0.00 0.61 0.23 0.00 0.00 176.35 177.09 2jj2 n GLY 105 N 2.94 0.84 3.70 -3.19 0.00 0.48 -4.92 105.19 105.04 2jj2 n GLY 105 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.13 2.61 -0.24 1.61 1.81 -0.69 -4.93 118.95 118.99 2jj2 s ARG 106 Ca 0.00 -0.81 -0.07 0.00 -1.72 0.00 0.00 55.73 53.13 2jj2 s ARG 106 Cb 0.00 -2.57 -0.03 0.00 -0.45 0.00 0.00 34.95 31.90 2jj2 s ARG 106 CO 0.00 0.55 0.06 0.08 -0.68 0.00 0.00 175.30 175.31 2jj2 s VAL 107 N -1.32 4.27 0.25 3.52 1.01 -1.26 -1.54 120.40 125.34 2jj2 s VAL 107 Ca 0.26 -0.19 0.09 0.00 0.00 0.00 0.00 61.98 62.14 2jj2 s VAL 107 Cb -0.12 -2.99 -0.05 0.00 0.00 0.00 0.00 36.38 33.23 2jj2 s VAL 107 CO 0.19 0.36 -0.14 0.68 0.00 0.00 0.00 175.10 176.18 2jj2 s VAL 108 N 1.50 2.01 0.15 2.92 -7.23 0.37 -0.60 120.40 119.53 2jj2 s VAL 108 Ca 0.06 -2.26 -0.01 0.00 -1.81 0.00 0.00 61.98 57.95 2jj2 s VAL 108 Cb -0.15 -2.25 0.03 0.00 0.56 0.00 0.00 36.38 34.57 2jj2 s VAL 108 CO 0.03 -0.45 0.20 -0.90 -0.31 0.00 0.00 175.10 173.67 2jj2 n ASP 109 N -0.53 0.12 0.24 4.85 3.85 -0.10 -0.09 116.55 124.90 2jj2 n ASP 109 Ca -0.06 -1.14 0.17 0.00 -0.71 0.00 0.00 54.79 53.05 2jj2 n ASP 109 Cb 0.61 -0.14 0.87 0.00 -1.35 0.00 0.00 41.12 41.11 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 -1.24 1.68 -0.02 2.12 0.00 -1.86 -2.21 119.26 117.73 2jj2 h ALA 110 Ca -0.07 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2jj2 h ALA 110 Cb 0.21 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2jj2 h ALA 110 CO 0.06 -0.20 -0.13 1.28 0.00 0.00 0.00 179.25 180.26 2jj2 n LEU 111 N -3.76 2.34 0.00 0.00 4.77 -1.26 -4.60 117.00 114.50 2jj2 n LEU 111 Ca 0.00 -0.92 0.00 0.00 -0.03 0.00 0.00 56.01 55.06 2jj2 n LEU 111 Cb 0.25 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 2jj2 n LEU 111 CO 0.27 0.41 0.00 0.61 -1.33 0.00 0.00 177.39 177.35 2jj2 n GLY 112 N 1.15 0.86 3.76 -0.72 0.00 -0.83 -4.40 105.19 105.00 2jj2 n GLY 112 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.15 7.38 0.29 1.61 0.01 -1.26 -4.77 114.94 116.04 2jj2 s ASN 113 Ca 0.00 2.14 -0.29 0.00 -0.71 0.00 0.00 52.86 54.00 2jj2 s ASN 113 Cb 0.00 -2.62 -0.10 0.00 0.41 0.00 0.00 41.25 38.94 2jj2 s ASN 113 CO 0.00 -0.05 1.45 0.00 -1.51 0.00 0.00 177.10 176.99 2jj2 s ALA 114 N -1.20 3.61 0.00 0.60 0.00 -1.26 -0.92 121.76 122.59 2jj2 s ALA 114 Ca 0.44 1.39 0.00 0.00 0.00 0.00 0.00 51.96 53.79 2jj2 s ALA 114 Cb -0.29 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.26 2jj2 s ALA 114 CO 0.37 -0.81 0.29 0.44 0.00 0.00 0.00 175.76 176.05 2jj2 n ILE 115 N 1.76 0.04 0.95 0.00 -5.35 0.23 -4.69 119.36 112.30 2jj2 n ILE 115 Ca 0.05 -0.26 0.13 0.00 -0.27 0.00 0.00 62.75 62.40 2jj2 n ILE 115 Cb 0.40 1.45 0.52 0.00 -1.74 0.00 0.00 39.64 40.27 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 -0.02 0.19 -1.22 7.28 5.68 -1.18 -4.95 116.55 122.34 2jj2 n ASP 116 Ca 0.00 0.37 -0.09 0.00 -0.50 0.00 0.00 54.79 54.57 2jj2 n ASP 116 Cb 0.15 -0.38 0.00 0.00 -1.14 0.00 0.00 41.12 39.75 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 1.47 0.06 1.51 6.12 0.00 -1.26 -4.95 105.19 108.14 2jj2 n GLY 117 Ca 0.06 -0.45 -0.11 0.00 0.00 0.00 0.00 46.02 45.52 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 -2.01 2.03 0.00 1.61 5.02 -1.26 -5.08 118.16 118.47 2jj2 n LYS 118 Ca -0.08 -3.20 0.00 0.00 -2.02 0.00 0.00 58.31 53.00 2jj2 n LYS 118 Cb 0.57 -1.94 0.00 0.00 -0.02 0.00 0.00 35.03 33.64 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 -1.11 -2.36 3.76 0.72 0.00 -1.26 -4.95 105.19 100.00 2jj2 n GLY 119 Ca 0.41 -1.58 -0.38 0.00 0.00 0.00 0.00 46.02 44.47 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 -0.58 3.48 0.33 1.61 0.04 -1.26 -4.78 135.00 133.83 2jj2 s PRO 120 Ca 0.00 2.06 -0.29 0.00 0.04 0.00 0.00 61.00 62.82 2jj2 s PRO 120 Cb 0.00 -2.38 -0.10 0.00 0.04 0.00 0.00 34.50 32.05 2jj2 s PRO 120 CO 0.00 -0.86 1.33 0.42 0.04 0.00 0.00 177.00 177.93 2jj2 s ILE 121 N -1.38 2.66 -0.26 0.56 -1.09 -1.26 -4.92 121.20 115.51 2jj2 s ILE 121 Ca 0.67 0.66 0.02 0.00 -2.23 0.00 0.00 60.65 59.76 2jj2 s ILE 121 Cb -0.36 -3.42 0.22 0.00 -1.58 0.00 0.00 42.46 37.33 2jj2 s ILE 121 CO 0.43 0.15 1.22 0.61 -1.23 0.00 0.00 174.94 176.13 2jj2 n GLY 122 N 0.90 2.65 3.67 6.18 0.00 -1.26 -4.98 105.19 112.36 2jj2 n GLY 122 Ca 0.01 -0.34 -0.45 0.00 0.00 0.00 0.00 46.02 45.24 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 0.01 3.02 -0.00 1.61 2.88 -1.26 -4.92 113.62 114.96 2jj2 n SER 123 Ca 0.17 1.11 0.06 0.00 -1.33 0.00 0.00 58.87 58.88 2jj2 n SER 123 Cb 0.82 -1.44 -0.09 0.00 -0.75 0.00 0.00 64.21 62.75 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 2.82 1.17 -4.24 -1.46 5.02 -1.26 -5.01 118.16 115.20 2jj2 n LYS 124 Ca 0.14 -0.08 -0.18 0.00 -2.02 0.00 0.00 58.31 56.17 2jj2 n LYS 124 Cb 0.30 -1.23 -0.11 0.00 -0.02 0.00 0.00 35.03 33.97 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 -2.65 1.50 0.10 7.82 0.00 -1.25 -5.08 121.76 122.20 2jj2 s ALA 125 Ca -0.02 -1.29 0.05 0.00 0.00 0.00 0.00 51.96 50.70 2jj2 s ALA 125 Cb 0.08 -0.08 -0.03 0.00 0.00 0.00 0.00 23.12 23.09 2jj2 s ALA 125 CO 0.51 0.11 -0.12 1.03 0.00 0.00 0.00 175.76 177.29 2jj2 s ARG 126 N -2.64 0.91 -0.03 0.00 0.52 -1.26 -1.18 118.95 115.27 2jj2 s ARG 126 Ca 0.09 -1.14 -0.03 0.00 -0.52 0.00 0.00 55.73 54.12 2jj2 s ARG 126 Cb -0.05 -0.74 0.01 0.00 0.52 0.00 0.00 34.95 34.69 2jj2 s ARG 126 CO 0.03 0.14 0.08 0.50 0.02 0.00 0.00 175.30 176.07 2jj2 s ARG 127 N -2.51 0.11 0.52 3.54 3.52 -0.65 -4.91 118.95 118.56 2jj2 s ARG 127 Ca 0.05 0.08 -0.23 0.00 -0.13 0.00 0.00 55.73 55.50 2jj2 s ARG 127 Cb -0.05 0.05 -0.06 0.00 -1.56 0.00 0.00 34.95 33.33 2jj2 s ARG 127 CO 0.02 -0.01 1.34 0.54 -0.81 0.00 0.00 175.30 176.37 2jj2 n ARG 128 N 2.96 1.78 0.09 5.12 1.74 -1.26 0.04 116.66 127.12 2jj2 n ARG 128 Ca -0.13 0.65 -0.14 0.00 -0.77 0.00 0.00 57.85 57.46 2jj2 n ARG 128 Cb 0.59 -2.54 -0.14 0.00 -1.02 0.00 0.00 32.46 29.36 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 1.53 -3.41 1.55 -1.51 -1.57 -3.42 116.25 111.03 2jj2 h VAL 129 Ca -0.50 -3.13 -0.73 0.00 -1.23 0.00 0.00 66.70 61.11 2jj2 h VAL 129 Cb 1.30 2.92 -0.24 0.00 -2.13 0.00 0.00 31.29 33.14 2jj2 h VAL 129 CO 0.58 0.91 -0.40 -0.83 -1.23 0.00 0.00 177.57 176.59 2jj2 s GLY 130 N -4.68 2.01 -0.01 5.19 0.00 -1.26 -4.60 107.32 103.96 2jj2 s GLY 130 Ca -0.03 -2.01 -0.06 0.00 0.00 0.00 0.00 44.72 42.62 2jj2 s GLY 130 CO 0.87 0.99 0.13 1.08 0.00 0.00 0.00 173.10 176.16 2jj2 s LEU 131 N 1.59 1.58 0.42 0.66 1.43 -1.26 -5.14 118.68 117.95 2jj2 s LEU 131 Ca 0.04 -0.09 -0.26 0.00 -1.03 0.00 0.00 54.13 52.78 2jj2 s LEU 131 Cb -0.22 0.57 -0.09 0.00 0.03 0.00 0.00 46.19 46.48 2jj2 s LEU 131 CO 0.06 -0.28 1.35 -0.54 0.23 0.00 0.00 176.35 177.18 2jj2 s LYS 132 N -0.98 3.90 0.61 1.70 1.02 -1.26 -5.01 119.74 119.71 2jj2 s LYS 132 Ca -0.11 2.26 -0.17 0.00 0.02 0.00 0.00 55.97 57.97 2jj2 s LYS 132 Cb -0.06 -2.74 -0.03 0.00 -0.52 0.00 0.00 37.83 34.48 2jj2 s LYS 132 CO 0.01 -0.59 1.12 0.00 -0.92 0.00 0.00 175.35 174.97 2jj2 s ALA 133 N -1.23 2.57 0.14 5.17 0.00 -1.26 -4.96 121.76 122.19 2jj2 s ALA 133 Ca 0.58 0.67 -0.33 0.00 0.00 0.00 0.00 51.96 52.87 2jj2 s ALA 133 Cb -0.40 -3.34 -0.17 0.00 0.00 0.00 0.00 23.12 19.21 2jj2 s ALA 133 CO 0.52 -1.05 1.04 -2.30 0.00 0.00 0.00 175.76 173.98 2jj2 n PRO 134 N -1.92 0.75 0.00 0.00 -0.02 -1.26 -4.96 135.00 127.58 2jj2 n PRO 134 Ca 0.11 0.27 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 2jj2 n PRO 134 Cb 0.51 -1.69 0.00 0.00 -0.02 0.00 0.00 33.50 32.31 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 1.91 -2.78 0.19 -1.23 0.00 -1.26 -4.94 105.19 97.07 2jj2 n GLY 135 Ca 0.16 -1.36 -0.03 0.00 0.00 0.00 0.00 46.02 44.79 2jj2 n GLY 135 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2jj2 h ILE 136 N -1.36 1.34 0.21 -0.61 6.09 -2.00 -3.37 117.51 117.81 2jj2 h ILE 136 Ca 0.00 -1.71 -0.34 0.00 -1.37 0.00 0.00 64.86 61.44 2jj2 h ILE 136 Cb 0.00 1.81 0.02 0.00 0.47 0.00 0.00 36.82 39.12 2jj2 h ILE 136 CO 0.00 0.51 -1.61 0.40 -3.07 0.00 0.00 178.15 174.38 2jj2 h ILE 137 N 0.20 1.09 0.00 2.19 1.08 -2.02 -3.33 117.51 116.72 2jj2 h ILE 137 Ca 0.01 -2.58 0.00 0.00 -0.39 0.00 0.00 64.86 61.90 2jj2 h ILE 137 Cb 0.94 2.88 0.00 0.00 -3.07 0.00 0.00 36.82 37.57 2jj2 h ILE 137 CO 0.08 0.83 0.00 -2.65 -0.69 0.00 0.00 178.15 175.72 2jj2 n PRO 138 N -3.68 0.14 -4.22 2.37 -0.02 -1.26 -4.78 135.00 123.55 2jj2 n PRO 138 Ca -0.22 0.00 -0.25 0.00 -2.02 0.00 0.00 63.50 61.02 2jj2 n PRO 138 Cb 1.07 -1.23 -0.07 0.00 -0.02 0.00 0.00 33.50 33.25 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 2.44 0.17 -0.52 0.52 -1.25 -0.47 118.95 117.83 2jj2 s ARG 139 Ca 0.03 -1.20 0.07 0.00 -0.52 0.00 0.00 55.73 54.11 2jj2 s ARG 139 Cb 0.01 -2.32 -0.04 0.00 0.52 0.00 0.00 34.95 33.12 2jj2 s ARG 139 CO 0.02 0.42 -0.14 -1.50 0.02 0.00 0.00 175.30 174.13 2jj2 s ILE 140 N -1.97 1.51 0.51 1.52 1.10 -1.08 -4.59 121.20 118.20 2jj2 s ILE 140 Ca 0.29 -2.04 -0.19 0.00 -0.51 0.00 0.00 60.65 58.20 2jj2 s ILE 140 Cb -0.08 -1.87 -0.12 0.00 0.15 0.00 0.00 42.46 40.54 2jj2 s ILE 140 CO 0.20 -0.57 0.23 -1.20 -2.11 0.00 0.00 174.94 171.48 2jj2 n SER 141 N -0.08 -2.24 -4.69 4.50 7.64 -1.26 -4.68 113.62 112.81 2jj2 n SER 141 Ca -0.11 0.74 -0.42 0.00 1.01 0.00 0.00 58.87 60.09 2jj2 n SER 141 Cb 0.59 -1.01 -0.03 0.00 -1.01 0.00 0.00 64.21 62.76 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 -1.79 4.10 0.00 0.44 1.01 -1.26 -4.86 120.40 118.03 2jj2 s VAL 142 Ca 0.62 1.45 0.00 0.00 0.00 0.00 0.00 61.98 64.05 2jj2 s VAL 142 Cb -0.51 -3.93 0.00 0.00 0.00 0.00 0.00 36.38 31.94 2jj2 s VAL 142 CO 0.60 0.01 0.00 0.54 0.00 0.00 0.00 175.10 176.25 2jj2 n ARG 143 N 5.10 0.00 -2.60 2.72 1.74 -1.26 -4.62 116.66 117.75 2jj2 n ARG 143 Ca 0.11 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.77 2jj2 n ARG 143 Cb 0.46 -0.59 -0.03 0.00 -1.02 0.00 0.00 32.46 31.28 2jj2 n ARG 143 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2jj2 s GLU 144 N -1.36 4.43 0.28 5.56 2.02 -1.26 -4.30 118.70 124.07 2jj2 s GLU 144 Ca 0.00 1.52 -0.30 0.00 0.02 0.00 0.00 54.97 56.21 2jj2 s GLU 144 Cb 0.00 -3.51 -0.12 0.00 0.10 0.00 0.00 34.13 30.60 2jj2 s GLU 144 CO 0.00 -0.29 1.52 -2.30 0.02 0.00 0.00 175.26 174.21 2jj2 n PRO 145 N 4.70 2.46 -3.71 0.39 -0.02 -1.26 -0.16 135.00 137.40 2jj2 n PRO 145 Ca 0.09 0.88 -0.38 0.00 -2.02 0.00 0.00 63.50 62.06 2jj2 n PRO 145 Cb 0.48 -2.61 -0.12 0.00 -0.02 0.00 0.00 33.50 31.24 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 -0.52 2.53 -0.34 -0.52 1.75 0.14 -4.59 119.30 117.75 2jj2 s MET 146 Ca 0.65 -1.36 -0.19 0.00 -1.25 0.00 0.00 55.69 53.55 2jj2 s MET 146 Cb -0.55 -3.57 -0.01 0.00 2.84 0.00 0.00 34.83 33.55 2jj2 s MET 146 CO 0.49 -0.81 0.54 -0.65 -0.65 0.00 0.00 175.02 173.95 2jj2 s GLN 147 N 1.37 3.70 0.20 4.11 -1.52 -1.26 -4.23 119.66 122.02 2jj2 s GLN 147 Ca 0.01 -0.03 0.18 0.00 -1.95 0.00 0.00 55.36 53.56 2jj2 s GLN 147 Cb -0.21 -3.78 0.00 0.00 -0.22 0.00 0.00 33.01 28.80 2jj2 s GLN 147 CO 0.02 -0.62 1.15 1.79 -0.25 0.00 0.00 175.29 177.37 2jj2 h THR 148 N 5.60 0.48 0.00 -0.19 1.35 -1.93 -3.44 112.91 114.77 2jj2 h THR 148 Ca -0.28 -1.79 0.00 0.00 -0.55 0.00 0.00 66.41 63.80 2jj2 h THR 148 Cb 1.12 2.06 0.00 0.00 -1.73 0.00 0.00 68.15 69.60 2jj2 h THR 148 CO 0.78 0.27 0.00 0.61 -0.25 0.00 0.00 175.52 176.93 2jj2 n GLY 149 N 1.27 0.66 3.56 5.82 0.00 -1.26 -3.77 105.19 111.47 2jj2 n GLY 149 Ca -0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.80 5.29 0.16 -0.61 1.01 -1.26 0.09 121.20 123.08 2jj2 s ILE 150 Ca 0.00 -0.01 -0.17 0.00 0.00 0.00 0.00 60.65 60.46 2jj2 s ILE 150 Cb 0.00 -3.63 0.08 0.00 0.01 0.00 0.00 42.46 38.92 2jj2 s ILE 150 CO 0.00 0.12 1.67 0.11 0.00 0.00 0.00 174.94 176.84 2jj2 h LYS 151 N 8.43 -0.01 -0.76 2.79 1.57 -1.93 -0.50 116.57 126.16 2jj2 h LYS 151 Ca -0.33 0.00 0.11 0.00 -1.87 0.00 0.00 60.65 58.56 2jj2 h LYS 151 Cb 1.17 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 33.41 2jj2 h LYS 151 CO 0.59 -0.00 0.39 0.00 -0.57 0.00 0.00 179.45 179.86 2jj2 h ALA 152 N 1.37 1.09 0.15 3.86 0.00 -1.91 -1.73 119.26 122.08 2jj2 h ALA 152 Ca 0.18 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 2jj2 h ALA 152 Cb 0.28 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2jj2 h ALA 152 CO -0.39 -0.04 -0.07 0.28 0.00 0.00 0.00 179.25 179.02 2jj2 h VAL 153 N 0.63 0.11 -0.11 0.00 2.07 -1.67 -2.01 116.25 115.27 2jj2 h VAL 153 Ca 0.39 -0.91 0.03 0.00 0.82 0.00 0.00 66.70 67.03 2jj2 h VAL 153 Cb 0.45 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 2jj2 h VAL 153 CO -0.30 0.03 0.10 0.44 0.02 0.00 0.00 177.57 177.87 2jj2 h ASP 154 N -1.04 0.00 0.05 0.57 3.32 -1.13 0.29 116.42 118.47 2jj2 h ASP 154 Ca -0.02 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.79 2jj2 h ASP 154 Cb 0.22 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.75 2jj2 h ASP 154 CO 0.03 0.00 -1.30 0.77 -1.72 0.00 0.00 179.24 177.02 2jj2 h SER 155 N 0.00 0.17 0.00 6.45 4.64 -1.43 -3.40 113.55 119.98 2jj2 h SER 155 Ca 0.05 -0.71 -0.04 0.00 -0.47 0.00 0.00 61.79 60.62 2jj2 h SER 155 Cb 0.26 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 2jj2 h SER 155 CO -0.00 1.54 -1.42 0.18 -0.87 0.00 0.00 176.83 176.25 2jj2 n LEU 156 N -4.17 0.00 -2.96 5.97 4.77 -0.76 -4.69 117.00 115.17 2jj2 n LEU 156 Ca -0.28 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.48 2jj2 n LEU 156 Cb 0.78 0.05 -0.02 0.00 -2.33 0.00 0.00 43.42 41.90 2jj2 n LEU 156 CO 0.30 0.05 -0.03 0.52 -1.33 0.00 0.00 177.39 176.91 2jj2 n VAL 157 N -1.93 1.50 -2.17 4.08 0.31 0.93 -4.72 118.33 116.33 2jj2 n VAL 157 Ca -0.05 -4.85 -0.41 0.00 -0.01 0.00 0.00 64.34 59.03 2jj2 n VAL 157 Cb 0.37 -0.71 -0.03 0.00 -0.91 0.00 0.00 33.84 32.57 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 -3.03 4.39 -0.11 5.55 0.04 -0.74 -4.59 135.00 136.51 2jj2 s PRO 158 Ca 0.43 2.14 -0.01 0.00 0.04 0.00 0.00 61.00 63.60 2jj2 s PRO 158 Cb 0.34 -3.11 -0.03 0.00 0.04 0.00 0.00 34.50 31.74 2jj2 s PRO 158 CO -0.10 -0.16 -0.05 0.42 0.04 0.00 0.00 177.00 177.15 2jj2 s ILE 159 N -0.86 3.86 0.25 0.56 1.01 -1.26 -4.18 121.20 120.58 2jj2 s ILE 159 Ca 0.50 -0.40 0.09 0.00 0.00 0.00 0.00 60.65 60.84 2jj2 s ILE 159 Cb -0.38 -2.63 -0.04 0.00 0.01 0.00 0.00 42.46 39.42 2jj2 s ILE 159 CO 0.48 0.56 0.01 -0.83 0.00 0.00 0.00 174.94 175.17 2jj2 s GLY 160 N -0.34 1.64 -0.09 6.18 0.00 -1.26 0.28 107.32 113.72 2jj2 s GLY 160 Ca 0.05 -1.59 -0.29 0.00 0.00 0.00 0.00 44.72 42.89 2jj2 s GLY 160 CO 0.02 -1.64 1.61 0.50 0.00 0.00 0.00 173.10 173.60 2jj2 s ARG 161 N -3.57 4.11 0.00 2.90 0.52 0.77 -1.78 118.95 121.91 2jj2 s ARG 161 Ca 0.31 2.05 0.00 0.00 -0.52 0.00 0.00 55.73 57.57 2jj2 s ARG 161 Cb -0.07 -3.98 0.00 0.00 0.52 0.00 0.00 34.95 31.42 2jj2 s ARG 161 CO 0.20 -0.92 0.00 0.41 0.02 0.00 0.00 175.30 175.01 2jj2 n GLY 162 N 4.18 2.18 3.76 -3.53 0.00 -1.24 -4.55 105.19 105.98 2jj2 n GLY 162 Ca 0.17 0.00 -0.34 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 -0.57 2.88 -0.27 1.61 0.74 -0.73 -3.72 119.66 119.60 2jj2 s GLN 163 Ca 0.00 1.57 -0.03 0.00 0.05 0.00 0.00 55.36 56.95 2jj2 s GLN 163 Cb 0.00 -1.95 0.03 0.00 1.10 0.00 0.00 33.01 32.19 2jj2 s GLN 163 CO 0.00 -1.22 -0.02 1.03 -0.55 0.00 0.00 175.29 174.53 2jj2 s ARG 164 N -3.74 2.80 -0.14 1.67 3.00 -1.26 -1.90 118.95 119.39 2jj2 s ARG 164 Ca 0.71 -1.02 0.02 0.00 0.00 0.00 0.00 55.73 55.45 2jj2 s ARG 164 Cb -0.24 -3.11 0.01 0.00 0.00 0.00 0.00 34.95 31.61 2jj2 s ARG 164 CO 0.37 -0.46 -0.21 -2.00 0.00 0.00 0.00 175.30 173.00 2jj2 s GLU 165 N 1.34 2.95 -0.07 3.54 2.56 -0.67 -0.28 118.70 128.07 2jj2 s GLU 165 Ca -0.01 -0.83 -0.23 0.00 0.00 0.00 0.00 54.97 53.91 2jj2 s GLU 165 Cb -0.17 -2.38 -0.04 0.00 2.00 0.00 0.00 34.13 33.54 2jj2 s GLU 165 CO -0.02 -0.01 0.67 -1.17 -0.56 0.00 0.00 175.26 174.16 2jj2 s LEU 166 N 0.82 4.32 -0.26 2.70 2.96 0.42 -3.57 118.68 126.07 2jj2 s LEU 166 Ca -0.07 1.15 -0.12 0.00 -0.22 0.00 0.00 54.13 54.87 2jj2 s LEU 166 Cb -0.16 -3.03 -0.05 0.00 0.50 0.00 0.00 46.19 43.46 2jj2 s LEU 166 CO -0.02 -0.09 0.22 -0.63 -1.32 0.00 0.00 176.35 174.52 2jj2 s ILE 167 N 0.71 5.30 -0.04 6.68 1.01 -0.42 0.16 121.20 134.59 2jj2 s ILE 167 Ca 0.36 0.27 -0.06 0.00 0.00 0.00 0.00 60.65 61.22 2jj2 s ILE 167 Cb -0.17 -3.56 0.01 0.00 0.01 0.00 0.00 42.46 38.75 2jj2 s ILE 167 CO 0.17 0.26 0.15 -0.51 0.00 0.00 0.00 174.94 175.02 2jj2 s ILE 168 N 1.58 0.02 0.00 2.92 2.07 -0.51 -1.50 121.20 125.78 2jj2 s ILE 168 Ca 0.09 -0.20 0.00 0.00 -1.41 0.00 0.00 60.65 59.13 2jj2 s ILE 168 Cb -0.15 -0.29 0.00 0.00 0.13 0.00 0.00 42.46 42.15 2jj2 s ILE 168 CO 0.09 -0.11 0.00 0.61 -1.91 0.00 0.00 174.94 173.62 2jj2 n GLY 169 N 2.56 0.73 3.42 1.50 0.00 -1.15 -0.09 105.19 112.15 2jj2 n GLY 169 Ca -0.15 -0.96 -0.30 0.00 0.00 0.00 0.00 46.02 44.60 2jj2 n GLY 169 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jj2 s ASP 170 N 0.00 -0.27 0.53 1.61 -0.00 -1.26 -1.63 116.67 115.65 2jj2 s ASP 170 Ca 0.00 0.78 -0.22 0.00 -0.00 0.00 0.00 52.55 53.10 2jj2 s ASP 170 Cb 0.00 -1.09 -0.05 0.00 -0.00 0.00 0.00 42.92 41.77 2jj2 s ASP 170 CO 0.00 -4.87 1.38 -2.11 -0.00 0.00 0.00 175.17 169.57 2jj2 n ARG 171 N -5.29 1.82 -3.36 8.23 1.85 -1.26 -3.51 116.66 115.14 2jj2 n ARG 171 Ca 0.13 0.66 -0.24 0.00 -1.00 0.00 0.00 57.85 57.40 2jj2 n ARG 171 Cb 0.60 -2.60 0.05 0.00 -1.05 0.00 0.00 32.46 29.46 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 -0.87 -6.08 0.00 2.89 6.02 -1.26 -4.87 117.38 113.21 2jj2 n GLN 172 Ca 0.09 0.82 0.10 0.00 -0.01 0.00 0.00 57.00 58.00 2jj2 n GLN 172 Cb 0.44 -5.76 -0.04 0.00 1.02 0.00 0.00 30.24 25.90 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 -4.70 0.00 0.00 5.09 -2.24 -1.23 -4.98 114.28 106.23 2jj2 n THR 173 Ca -0.04 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 2jj2 n THR 173 Cb 0.58 1.15 0.00 0.00 -2.10 0.00 0.00 70.33 69.97 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 1.40 1.77 0.09 3.38 0.00 -1.26 -4.49 105.19 106.08 2jj2 n GLY 174 Ca 0.07 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.10 -0.87 1.61 1.57 -1.93 -2.83 116.57 114.02 2jj2 h LYS 175 Ca 0.00 0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 2jj2 h LYS 175 Cb 0.00 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.29 2jj2 h LYS 175 CO 0.00 0.31 0.47 1.15 -0.57 0.00 0.00 179.45 180.81 2jj2 h THR 176 N -0.54 1.25 -0.52 -0.16 2.02 -1.99 -2.94 112.91 110.03 2jj2 h THR 176 Ca -0.01 -0.63 0.08 0.00 0.77 0.00 0.00 66.41 66.62 2jj2 h THR 176 Cb 0.46 0.08 -0.06 0.00 -1.74 0.00 0.00 68.15 66.89 2jj2 h THR 176 CO 0.02 0.28 0.16 0.28 0.37 0.00 0.00 175.52 176.63 2jj2 h SER 177 N 1.21 0.13 -0.74 4.18 0.02 -1.97 0.27 113.55 116.64 2jj2 h SER 177 Ca 0.30 0.07 0.15 0.00 -0.84 0.00 0.00 61.79 61.47 2jj2 h SER 177 Cb 0.03 0.07 -0.10 0.00 0.14 0.00 0.00 62.40 62.55 2jj2 h SER 177 CO -0.05 0.10 0.26 0.40 -1.14 0.00 0.00 176.83 176.40 2jj2 h ILE 178 N 0.32 0.62 -0.21 3.27 1.08 -1.31 -0.83 117.51 120.44 2jj2 h ILE 178 Ca 0.26 -0.13 -0.11 0.00 -0.39 0.00 0.00 64.86 64.49 2jj2 h ILE 178 Cb 0.31 0.19 -0.00 0.00 -3.07 0.00 0.00 36.82 34.25 2jj2 h ILE 178 CO -0.28 0.07 -0.28 0.00 -0.69 0.00 0.00 178.15 176.97 2jj2 h ALA 179 N 1.56 0.32 -0.09 1.87 0.00 -1.13 -2.54 119.26 119.25 2jj2 h ALA 179 Ca 0.41 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2jj2 h ALA 179 Cb 0.65 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 2jj2 h ALA 179 CO -0.43 0.32 0.04 0.82 0.00 0.00 0.00 179.25 180.00 2jj2 h ILE 180 N 0.24 1.12 -0.97 0.00 1.08 -0.10 -1.50 117.51 117.38 2jj2 h ILE 180 Ca 0.03 -0.34 0.03 0.00 -0.39 0.00 0.00 64.86 64.19 2jj2 h ILE 180 Cb 0.85 1.18 -0.05 0.00 -3.07 0.00 0.00 36.82 35.72 2jj2 h ILE 180 CO 0.07 0.10 0.64 0.44 -0.69 0.00 0.00 178.15 178.70 2jj2 h ASP 181 N 0.02 1.07 -0.56 1.72 3.45 -1.23 0.18 116.42 121.07 2jj2 h ASP 181 Ca 0.03 -0.02 0.04 0.00 0.43 0.00 0.00 57.03 57.51 2jj2 h ASP 181 Cb 0.12 -0.25 -0.04 0.00 -0.56 0.00 0.00 39.33 38.60 2jj2 h ASP 181 CO -0.00 0.74 0.32 0.74 -1.57 0.00 0.00 179.24 179.47 2jj2 h THR 182 N 1.24 1.01 -0.21 0.35 2.02 -1.23 0.11 112.91 116.21 2jj2 h THR 182 Ca 0.38 -0.21 -0.04 0.00 0.77 0.00 0.00 66.41 67.30 2jj2 h THR 182 Cb -0.03 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 66.71 2jj2 h THR 182 CO -0.11 0.11 -0.02 0.40 0.37 0.00 0.00 175.52 176.27 2jj2 h ILE 183 N 0.62 1.27 -0.88 3.11 2.04 -0.15 -2.84 117.51 120.68 2jj2 h ILE 183 Ca 0.24 -0.96 0.03 0.00 1.00 0.00 0.00 64.86 65.17 2jj2 h ILE 183 Cb 0.09 1.47 -0.05 0.00 -0.74 0.00 0.00 36.82 37.59 2jj2 h ILE 183 CO -0.13 0.29 0.58 0.40 0.00 0.00 0.00 178.15 179.29 2jj2 h ILE 184 N 0.14 1.17 -0.39 -0.67 2.04 -0.52 -2.76 117.51 116.52 2jj2 h ILE 184 Ca 0.06 -0.39 0.07 0.00 1.00 0.00 0.00 64.86 65.60 2jj2 h ILE 184 Cb 0.45 -0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.45 2jj2 h ILE 184 CO 0.02 0.21 0.27 -1.13 0.00 0.00 0.00 178.15 177.51 2jj2 h ASN 185 N 1.13 0.21 0.55 1.72 -1.24 -0.52 -2.95 115.58 114.48 2jj2 h ASN 185 Ca 0.34 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.35 2jj2 h ASN 185 Cb -0.03 -0.04 0.00 0.00 0.73 0.00 0.00 38.32 38.97 2jj2 h ASN 185 CO -0.09 0.14 0.00 0.00 -1.29 0.00 0.00 177.43 176.19 2jj2 n GLN 186 N -4.47 0.13 -0.27 6.67 1.13 -1.04 -2.95 117.38 116.57 2jj2 n GLN 186 Ca 0.05 0.40 0.00 0.00 -1.94 0.00 0.00 57.00 55.52 2jj2 n GLN 186 Cb 0.29 -1.76 0.13 0.00 0.11 0.00 0.00 30.24 29.01 2jj2 n GLN 186 CO 0.00 0.00 0.00 -0.22 -1.44 0.00 0.00 177.06 175.40 2jj2 h LYS 187 N 0.00 0.77 -0.03 -1.09 3.64 -1.71 0.20 116.57 118.35 2jj2 h LYS 187 Ca 0.00 -0.05 0.01 0.00 -1.27 0.00 0.00 60.65 59.34 2jj2 h LYS 187 Cb 0.27 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 31.92 2jj2 h LYS 187 CO 0.00 0.51 0.04 0.07 -2.27 0.00 0.00 179.45 177.81 2jj2 h ARG 188 N 0.80 0.00 0.06 1.90 0.11 -1.79 0.05 114.38 115.50 2jj2 h ARG 188 Ca 0.35 0.00 -0.38 0.00 0.10 0.00 0.00 59.98 60.05 2jj2 h ARG 188 Cb 0.24 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.27 2jj2 h ARG 188 CO -0.20 0.00 -2.24 1.19 0.10 0.00 0.00 179.97 178.82 2jj2 n PHE 189 N -3.74 0.61 0.09 4.08 0.99 -0.64 -3.93 117.46 114.92 2jj2 n PHE 189 Ca -0.02 0.13 -0.02 0.00 -0.00 0.00 0.00 57.45 57.54 2jj2 n PHE 189 Cb 0.13 -1.08 0.22 0.00 -1.00 0.00 0.00 39.48 37.76 2jj2 n PHE 189 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 176.76 175.85 2jj2 h ASN 190 N 0.02 0.27 1.26 4.37 2.35 -0.58 -1.72 115.58 121.55 2jj2 h ASN 190 Ca -0.51 -0.11 -0.02 0.00 -0.55 0.00 0.00 56.30 55.11 2jj2 h ASN 190 Cb 1.96 -0.08 -0.00 0.00 0.05 0.00 0.00 38.32 40.25 2jj2 h ASN 190 CO -0.01 0.64 -0.10 0.44 -1.65 0.00 0.00 177.43 176.76 2jj2 h ASP 191 N 0.22 0.00 -1.32 5.81 3.45 -1.21 -3.46 116.42 119.91 2jj2 h ASP 191 Ca 0.02 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.48 2jj2 h ASP 191 Cb 0.80 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.57 2jj2 h ASP 191 CO 0.06 0.10 0.00 0.61 -1.57 0.00 0.00 179.24 178.44 2jj2 n GLY 192 N 0.40 -2.53 0.00 2.75 0.00 -0.65 -5.02 105.19 100.14 2jj2 n GLY 192 Ca 0.01 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.61 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 -2.36 0.00 -2.73 2.61 -2.24 -1.26 -4.96 114.28 103.34 2jj2 n THR 193 Ca 0.00 -0.36 -0.43 0.00 -2.27 0.00 0.00 64.05 60.99 2jj2 n THR 193 Cb 0.00 1.20 -0.03 0.00 -2.10 0.00 0.00 70.33 69.40 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 -0.20 6.95 0.05 3.42 -1.08 -1.26 -4.95 116.67 119.60 2jj2 s ASP 194 Ca 0.00 1.15 -0.16 0.00 -0.52 0.00 0.00 52.55 53.02 2jj2 s ASP 194 Cb 0.00 -2.51 -0.29 0.00 -1.46 0.00 0.00 42.92 38.67 2jj2 s ASP 194 CO 0.00 -0.69 1.09 -0.33 0.52 0.00 0.00 175.17 175.77 2jj2 h GLU 195 N 7.73 0.61 -1.04 4.34 4.39 -1.92 -3.26 114.58 125.42 2jj2 h GLU 195 Ca -0.21 -0.80 0.31 0.00 0.34 0.00 0.00 59.36 59.01 2jj2 h GLU 195 Cb 1.07 0.26 -0.13 0.00 -0.10 0.00 0.00 28.75 29.85 2jj2 h GLU 195 CO 0.96 1.36 0.62 0.87 -1.16 0.00 0.00 179.01 181.66 2jj2 h LYS 196 N 0.23 0.35 -0.00 2.33 1.79 -1.96 -2.13 116.57 117.18 2jj2 h LYS 196 Ca -0.18 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.27 2jj2 h LYS 196 Cb 1.86 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 32.43 2jj2 h LYS 196 CO 0.23 0.23 -0.24 1.63 -1.08 0.00 0.00 179.45 180.22 2jj2 n LYS 197 N -4.91 0.19 -2.55 3.15 5.02 -1.23 -4.93 118.16 112.90 2jj2 n LYS 197 Ca 0.30 -0.08 -0.34 0.00 -2.02 0.00 0.00 58.31 56.18 2jj2 n LYS 197 Cb 0.97 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 34.45 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 -2.86 3.83 -0.09 1.97 1.02 -0.80 -4.80 119.74 118.01 2jj2 s LYS 198 Ca 0.17 1.32 -0.03 0.00 0.02 0.00 0.00 55.97 57.44 2jj2 s LYS 198 Cb 0.19 -2.10 0.05 0.00 -0.52 0.00 0.00 37.83 35.44 2jj2 s LYS 198 CO 0.59 -0.40 0.12 -1.17 -0.92 0.00 0.00 175.35 173.57 2jj2 s LEU 199 N -3.50 0.05 0.26 3.17 2.96 -1.26 -4.47 118.68 115.89 2jj2 s LEU 199 Ca 0.66 0.06 -0.26 0.00 -0.22 0.00 0.00 54.13 54.38 2jj2 s LEU 199 Cb -0.15 0.07 -0.09 0.00 0.50 0.00 0.00 46.19 46.52 2jj2 s LEU 199 CO 0.20 -0.27 0.88 -0.31 -1.32 0.00 0.00 176.35 175.53 2jj2 s TYR 200 N 2.23 3.79 -0.03 5.38 1.51 -0.76 -4.90 117.35 124.56 2jj2 s TYR 200 Ca 0.04 1.72 0.07 0.00 -1.01 0.00 0.00 57.07 57.89 2jj2 s TYR 200 Cb -0.13 -2.86 -0.02 0.00 -0.11 0.00 0.00 41.96 38.84 2jj2 s TYR 200 CO -0.06 0.34 -0.22 0.00 -1.11 0.00 0.00 175.55 174.49 2jj2 s ILE 202 N -0.62 0.82 -0.27 0.00 1.01 0.19 -0.37 121.20 121.96 2jj2 s ILE 202 Ca 0.10 -0.30 -0.06 0.00 0.00 0.00 0.00 60.65 60.39 2jj2 s ILE 202 Cb -0.10 -0.97 -0.00 0.00 0.01 0.00 0.00 42.46 41.40 2jj2 s ILE 202 CO -0.00 0.21 0.05 -0.47 0.00 0.00 0.00 174.94 174.73 2jj2 s TYR 203 N 1.78 3.09 -0.32 3.97 5.04 -0.23 -0.35 117.35 130.33 2jj2 s TYR 203 Ca 0.03 -0.86 -0.10 0.00 -2.44 0.00 0.00 57.07 53.70 2jj2 s TYR 203 Cb -0.14 -2.21 -0.00 0.00 0.35 0.00 0.00 41.96 39.96 2jj2 s TYR 203 CO -0.07 -0.53 0.17 0.08 -1.34 0.00 0.00 175.55 173.86 2jj2 s VAL 204 N 1.52 4.65 -0.31 3.14 1.01 0.75 -0.96 120.40 130.19 2jj2 s VAL 204 Ca 0.04 -0.48 -0.14 0.00 0.00 0.00 0.00 61.98 61.40 2jj2 s VAL 204 Cb -0.16 -3.41 -0.03 0.00 0.00 0.00 0.00 36.38 32.78 2jj2 s VAL 204 CO 0.01 0.01 0.32 0.00 0.00 0.00 0.00 175.10 175.44 2jj2 s ALA 205 N 1.61 3.52 -0.20 5.51 0.00 0.24 0.33 121.76 132.77 2jj2 s ALA 205 Ca 0.04 -1.12 -0.01 0.00 0.00 0.00 0.00 51.96 50.88 2jj2 s ALA 205 Cb -0.17 -2.72 0.01 0.00 0.00 0.00 0.00 23.12 20.24 2jj2 s ALA 205 CO 0.07 -0.87 -0.13 0.42 0.00 0.00 0.00 175.76 175.24 2jj2 s ILE 206 N 1.95 2.58 0.00 0.00 1.09 0.69 -1.11 121.20 126.40 2jj2 s ILE 206 Ca 0.11 -0.81 0.00 0.00 -1.10 0.00 0.00 60.65 58.85 2jj2 s ILE 206 Cb -0.16 -2.15 0.00 0.00 -1.06 0.00 0.00 42.46 39.09 2jj2 s ILE 206 CO 0.11 0.46 0.00 0.61 -0.10 0.00 0.00 174.94 176.02 2jj2 n GLY 207 N 4.68 0.91 3.85 6.18 0.00 0.49 -3.51 105.19 117.79 2jj2 n GLY 207 Ca -0.19 0.00 -0.29 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 -0.02 1.21 0.20 1.61 -0.21 -1.26 -3.88 119.66 117.31 2jj2 s GLN 208 Ca 0.00 0.05 -0.11 0.00 0.02 0.00 0.00 55.36 55.32 2jj2 s GLN 208 Cb 0.00 -1.87 -0.07 0.00 1.00 0.00 0.00 33.01 32.07 2jj2 s GLN 208 CO 0.00 -2.11 0.55 -1.59 -2.12 0.00 0.00 175.29 170.03 2jj2 s LYS 209 N -5.53 3.87 0.26 2.91 -2.85 -1.26 -0.30 119.74 116.83 2jj2 s LYS 209 Ca 0.66 0.36 -0.03 0.00 -1.00 0.00 0.00 55.97 55.96 2jj2 s LYS 209 Cb -0.11 -2.74 0.43 0.00 -2.06 0.00 0.00 37.83 33.35 2jj2 s LYS 209 CO 0.52 0.37 1.83 0.00 0.10 0.00 0.00 175.35 178.17 2jj2 h ARG 210 N 2.90 0.88 -0.20 1.78 3.08 -1.97 -1.82 114.38 119.02 2jj2 h ARG 210 Ca -0.48 -0.05 -0.08 0.00 0.07 0.00 0.00 59.98 59.44 2jj2 h ARG 210 Cb 1.18 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 31.02 2jj2 h ARG 210 CO 0.68 0.58 -0.22 0.66 -1.07 0.00 0.00 179.97 180.60 2jj2 h SER 211 N 0.90 0.36 -0.74 7.04 4.64 -1.99 0.86 113.55 124.62 2jj2 h SER 211 Ca 0.42 -0.10 -0.04 0.00 -0.47 0.00 0.00 61.79 61.59 2jj2 h SER 211 Cb 0.35 -0.10 -0.03 0.00 -0.31 0.00 0.00 62.40 62.31 2jj2 h SER 211 CO -0.23 0.59 0.30 0.74 -0.87 0.00 0.00 176.83 177.35 2jj2 h THR 212 N 0.33 1.25 -0.27 2.95 2.02 -1.75 -1.81 112.91 115.63 2jj2 h THR 212 Ca 0.05 -0.80 -0.08 0.00 0.77 0.00 0.00 66.41 66.36 2jj2 h THR 212 Cb 0.57 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.36 2jj2 h THR 212 CO 0.04 0.32 -0.14 0.58 0.37 0.00 0.00 175.52 176.69 2jj2 h VAL 213 N 1.07 1.30 -0.11 3.16 2.07 -0.88 -2.30 116.25 120.56 2jj2 h VAL 213 Ca 0.25 -1.23 0.04 0.00 0.82 0.00 0.00 66.70 66.58 2jj2 h VAL 213 Cb 0.21 1.52 -0.06 0.00 -1.52 0.00 0.00 31.29 31.44 2jj2 h VAL 213 CO -0.02 0.39 -0.32 0.00 0.02 0.00 0.00 177.57 177.64 2jj2 h ALA 214 N 0.74 -0.39 -0.78 1.67 0.00 -0.72 0.27 119.26 120.04 2jj2 h ALA 214 Ca 0.06 0.01 0.18 0.00 0.00 0.00 0.00 54.91 55.17 2jj2 h ALA 214 Cb 0.65 0.60 -0.05 0.00 0.00 0.00 0.00 17.79 19.00 2jj2 h ALA 214 CO 0.04 -0.81 0.53 1.96 0.00 0.00 0.00 179.25 180.98 2jj2 h GLN 215 N -0.41 0.27 0.43 0.00 1.08 -1.31 -0.05 115.11 115.12 2jj2 h GLN 215 Ca 0.09 -0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.25 2jj2 h GLN 215 Cb 0.55 -0.06 0.00 0.00 -0.05 0.00 0.00 27.48 27.92 2jj2 h GLN 215 CO -0.34 0.18 -0.21 1.25 -0.95 0.00 0.00 178.83 178.77 2jj2 h LEU 216 N 0.28 -0.49 -1.56 1.46 7.12 -0.44 -1.74 115.31 119.94 2jj2 h LEU 216 Ca 0.39 -0.10 -0.05 0.00 0.13 0.00 0.00 57.88 58.25 2jj2 h LEU 216 Cb 1.10 0.13 -0.01 0.00 -0.53 0.00 0.00 40.66 41.35 2jj2 h LEU 216 CO -0.10 -0.15 -0.23 -0.37 -0.13 0.00 0.00 178.44 177.46 2jj2 h VAL 217 N -0.85 1.08 -0.27 1.05 -1.51 -0.29 -1.84 116.25 113.62 2jj2 h VAL 217 Ca -0.06 -0.81 -0.02 0.00 -1.23 0.00 0.00 66.70 64.58 2jj2 h VAL 217 Cb 0.56 1.45 -0.01 0.00 -2.13 0.00 0.00 31.29 31.15 2jj2 h VAL 217 CO 0.10 0.22 0.09 0.50 -1.23 0.00 0.00 177.57 177.25 2jj2 h LYS 218 N 0.00 0.41 -0.26 5.19 1.63 -0.96 0.37 116.57 122.95 2jj2 h LYS 218 Ca -0.00 -0.09 0.01 0.00 -0.85 0.00 0.00 60.65 59.72 2jj2 h LYS 218 Cb 0.43 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 31.98 2jj2 h LYS 218 CO 0.03 0.48 0.15 -0.09 -3.45 0.00 0.00 179.45 176.56 2jj2 h ARG 219 N 0.27 0.29 -0.31 1.90 9.65 -0.73 -0.34 114.38 125.12 2jj2 h ARG 219 Ca 0.09 -0.02 -0.07 0.00 -1.10 0.00 0.00 59.98 58.88 2jj2 h ARG 219 Cb 0.24 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 28.73 2jj2 h ARG 219 CO -0.00 0.19 -0.10 -0.07 2.80 0.00 0.00 179.97 182.80 2jj2 h LEU 220 N 0.30 0.49 -0.06 3.80 3.38 -1.24 -0.87 115.31 121.11 2jj2 h LEU 220 Ca 0.10 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2jj2 h LEU 220 Cb 0.00 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 2jj2 h LEU 220 CO -0.05 0.63 -0.01 0.74 0.09 0.00 0.00 178.44 179.84 2jj2 h THR 221 N 0.48 1.27 -0.26 0.22 2.02 -0.61 0.87 112.91 116.90 2jj2 h THR 221 Ca 0.09 -0.86 -0.02 0.00 0.77 0.00 0.00 66.41 66.39 2jj2 h THR 221 Cb 0.46 1.72 -0.01 0.00 -1.74 0.00 0.00 68.15 68.58 2jj2 h THR 221 CO 0.03 0.24 0.07 0.44 0.37 0.00 0.00 175.52 176.66 2jj2 h ASP 222 N -0.20 0.34 0.50 4.18 3.32 -0.91 0.50 116.42 124.15 2jj2 h ASP 222 Ca 0.02 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.03 2jj2 h ASP 222 Cb 0.38 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.84 2jj2 h ASP 222 CO 0.00 0.34 0.00 0.00 -1.72 0.00 0.00 179.24 177.87 2jj2 n ALA 223 N -2.49 2.36 -1.91 3.45 0.00 -0.35 -4.89 120.51 116.68 2jj2 n ALA 223 Ca 0.01 -0.13 -0.16 0.00 0.00 0.00 0.00 53.44 53.16 2jj2 n ALA 223 Cb 0.15 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.13 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 -1.28 -4.78 0.12 0.00 2.03 0.17 -4.91 116.55 107.90 2jj2 n ASP 224 Ca 0.13 0.17 0.11 0.00 0.52 0.00 0.00 54.79 55.72 2jj2 n ASP 224 Cb 0.21 -3.79 0.03 0.00 -0.72 0.00 0.00 41.12 36.85 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 0.41 0.59 -0.21 -1.67 0.00 0.54 -3.38 119.26 115.54 2jj2 h ALA 225 Ca -0.35 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 2jj2 h ALA 225 Cb 1.16 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 2jj2 h ALA 225 CO 0.45 0.03 0.04 0.52 0.00 0.00 0.00 179.25 180.29 2jj2 h MET 226 N 0.00 0.29 -0.07 0.00 2.86 -1.80 -3.03 114.93 113.19 2jj2 h MET 226 Ca -0.00 -0.04 0.02 0.00 -2.06 0.00 0.00 59.70 57.62 2jj2 h MET 226 Cb 1.02 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.62 2jj2 h MET 226 CO 0.00 0.29 0.14 1.57 1.06 0.00 0.00 176.91 179.97 2jj2 h LYS 227 N 0.29 0.00 -0.06 1.72 2.10 -1.90 0.79 116.57 119.50 2jj2 h LYS 227 Ca 0.07 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.72 2jj2 h LYS 227 Cb 0.14 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.47 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 -3.40 0.17 -5.14 0.07 0.18 -1.15 -4.17 117.16 103.71 2jj2 n TYR 228 Ca -0.01 -0.79 -0.32 0.00 1.88 0.00 0.00 57.90 58.66 2jj2 n TYR 228 Cb 0.23 -0.13 -0.16 0.00 -0.38 0.00 0.00 39.34 38.90 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 -2.14 2.34 -0.21 -3.48 2.01 0.20 -1.20 115.64 113.15 2jj2 s THR 229 Ca 0.23 -0.96 -0.08 0.00 0.31 0.00 0.00 61.69 61.19 2jj2 s THR 229 Cb 0.19 -1.88 -0.04 0.00 0.01 0.00 0.00 72.50 70.78 2jj2 s THR 229 CO 0.04 0.57 0.09 -0.63 -0.69 0.00 0.00 174.62 174.00 2jj2 s ILE 230 N -0.15 4.87 -0.31 1.82 1.01 0.50 -0.39 121.20 128.55 2jj2 s ILE 230 Ca -0.03 0.00 -0.07 0.00 0.00 0.00 0.00 60.65 60.55 2jj2 s ILE 230 Cb -0.14 -3.23 0.02 0.00 0.01 0.00 0.00 42.46 39.12 2jj2 s ILE 230 CO 0.04 0.41 0.09 -0.69 0.00 0.00 0.00 174.94 174.78 2jj2 s VAL 231 N 0.78 3.94 -0.21 2.92 1.01 -0.59 -1.07 120.40 127.18 2jj2 s VAL 231 Ca 0.05 -0.80 -0.09 0.00 0.00 0.00 0.00 61.98 61.14 2jj2 s VAL 231 Cb -0.13 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.12 2jj2 s VAL 231 CO 0.02 0.01 0.11 -0.69 0.00 0.00 0.00 175.10 174.56 2jj2 s VAL 232 N 1.48 5.07 -0.06 2.92 1.01 -0.13 -0.48 120.40 130.21 2jj2 s VAL 232 Ca 0.02 0.07 -0.01 0.00 0.00 0.00 0.00 61.98 62.06 2jj2 s VAL 232 Cb -0.18 -3.33 0.03 0.00 0.00 0.00 0.00 36.38 32.90 2jj2 s VAL 232 CO 0.03 0.40 0.01 -0.55 0.00 0.00 0.00 175.10 174.99 2jj2 s SER 233 N 0.73 1.46 -0.42 3.32 0.15 0.88 -0.59 113.70 119.23 2jj2 s SER 233 Ca 0.06 -0.05 0.03 0.00 0.70 0.00 0.00 55.95 56.68 2jj2 s SER 233 Cb -0.13 -0.38 0.12 0.00 -1.71 0.00 0.00 66.02 63.92 2jj2 s SER 233 CO 0.02 -0.20 0.18 0.00 1.20 0.00 0.00 173.24 174.43 2jj2 s ALA 234 N 1.96 2.59 0.82 5.45 0.00 -0.27 -3.56 121.76 128.76 2jj2 s ALA 234 Ca 0.04 -2.64 -0.08 0.00 0.00 0.00 0.00 51.96 49.28 2jj2 s ALA 234 Cb -0.12 -1.95 0.15 0.00 0.00 0.00 0.00 23.12 21.20 2jj2 s ALA 234 CO -0.05 -1.89 1.13 0.95 0.00 0.00 0.00 175.76 175.90 2jj2 s THR 235 N 0.49 2.09 0.59 0.00 -4.23 -1.26 -0.38 115.64 112.94 2jj2 s THR 235 Ca 0.15 -0.32 0.29 0.00 -1.18 0.00 0.00 61.69 60.62 2jj2 s THR 235 Cb -0.22 -2.78 0.36 0.00 1.34 0.00 0.00 72.50 71.20 2jj2 s THR 235 CO -0.06 0.00 2.07 0.00 -0.54 0.00 0.00 174.62 176.10 2jj2 h ALA 236 N -0.99 1.86 -0.00 3.99 0.00 -0.77 0.29 119.26 123.63 2jj2 h ALA 236 Ca -0.40 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2jj2 h ALA 236 Cb 1.26 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2jj2 h ALA 236 CO 0.41 -0.35 -0.74 -1.13 0.00 0.00 0.00 179.25 177.45 2jj2 n SER 237 N -3.80 1.20 -4.77 0.00 3.41 -1.26 -4.93 113.62 103.47 2jj2 n SER 237 Ca 0.02 -1.02 -0.38 0.00 -0.26 0.00 0.00 58.87 57.24 2jj2 n SER 237 Cb 0.37 0.69 -0.02 0.00 -0.26 0.00 0.00 64.21 64.99 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 -2.83 6.47 0.63 4.04 1.01 0.09 -4.97 116.67 121.11 2jj2 s ASP 238 Ca 0.12 2.29 -0.19 0.00 0.71 0.00 0.00 52.55 55.48 2jj2 s ASP 238 Cb 0.17 -2.61 -0.02 0.00 1.01 0.00 0.00 42.92 41.47 2jj2 s ASP 238 CO 0.74 -0.71 1.31 0.00 0.21 0.00 0.00 175.17 176.73 2jj2 s ALA 239 N -1.48 2.48 0.21 5.23 0.00 -1.26 -4.78 121.76 122.15 2jj2 s ALA 239 Ca 0.59 1.25 -0.16 0.00 0.00 0.00 0.00 51.96 53.64 2jj2 s ALA 239 Cb -0.29 -3.56 0.21 0.00 0.00 0.00 0.00 23.12 19.48 2jj2 s ALA 239 CO 0.36 -1.56 1.60 0.00 0.00 0.00 0.00 175.76 176.16 2jj2 h ALA 240 N 0.75 0.23 -0.71 0.00 0.00 -1.91 -1.35 119.26 116.28 2jj2 h ALA 240 Ca -0.51 0.23 0.11 0.00 0.00 0.00 0.00 54.91 54.73 2jj2 h ALA 240 Cb 1.33 0.66 -0.05 0.00 0.00 0.00 0.00 17.79 19.74 2jj2 h ALA 240 CO 0.54 -0.54 0.47 -1.00 0.00 0.00 0.00 179.25 178.72 2jj2 h PRO 241 N -0.07 0.53 -0.69 0.00 0.13 -1.87 -1.57 132.00 128.46 2jj2 h PRO 241 Ca 0.29 -0.03 -0.06 0.00 -0.87 0.00 0.00 66.00 65.33 2jj2 h PRO 241 Cb 0.54 -0.12 -0.03 0.00 0.13 0.00 0.00 31.00 31.52 2jj2 h PRO 241 CO -0.72 0.35 0.20 -0.07 -0.23 0.00 0.00 178.00 177.53 2jj2 h LEU 242 N 0.55 1.01 -1.09 1.56 3.38 -1.59 -1.03 115.31 118.11 2jj2 h LEU 242 Ca 0.33 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 58.01 2jj2 h LEU 242 Cb 0.55 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 2jj2 h LEU 242 CO -0.11 0.96 -0.35 1.56 0.09 0.00 0.00 178.44 180.59 2jj2 h GLN 243 N 1.03 0.19 -0.31 1.13 4.20 -1.23 -1.64 115.11 118.49 2jj2 h GLN 243 Ca 0.22 -0.08 -0.14 0.00 0.06 0.00 0.00 58.65 58.71 2jj2 h GLN 243 Cb 0.32 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 2jj2 h GLN 243 CO -0.00 0.53 -0.39 -0.92 -0.67 0.00 0.00 178.83 177.38 2jj2 h TYR 244 N 0.17 0.86 0.00 2.96 3.20 -1.01 -3.28 116.97 119.86 2jj2 h TYR 244 Ca 0.02 -0.25 -0.20 0.00 3.14 0.00 0.00 58.73 61.44 2jj2 h TYR 244 Cb 0.70 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.76 2jj2 h TYR 244 CO 0.01 1.00 -0.96 -0.07 -1.64 0.00 0.00 178.16 176.49 2jj2 h LEU 245 N 0.60 0.00 -0.47 2.82 3.38 -0.88 -3.40 115.31 117.37 2jj2 h LEU 245 Ca 0.05 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.12 2jj2 h LEU 245 Cb 0.92 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.59 2jj2 h LEU 245 CO 0.08 0.90 -0.08 0.00 0.09 0.00 0.00 178.44 179.44 2jj2 h ALA 246 N 1.10 0.35 -0.97 1.53 0.00 -1.37 -0.01 119.26 119.89 2jj2 h ALA 246 Ca -0.03 0.17 0.08 0.00 0.00 0.00 0.00 54.91 55.13 2jj2 h ALA 246 Cb 1.71 0.32 -0.07 0.00 0.00 0.00 0.00 17.79 19.75 2jj2 h ALA 246 CO 0.11 -0.43 0.63 -1.35 0.00 0.00 0.00 179.25 178.21 2jj2 h PRO 247 N 0.03 1.06 -0.31 0.00 0.11 -1.78 -0.35 132.00 130.77 2jj2 h PRO 247 Ca 0.23 -0.06 -0.07 0.00 0.11 0.00 0.00 66.00 66.20 2jj2 h PRO 247 Cb 0.35 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 31.21 2jj2 h PRO 247 CO -0.45 0.70 -0.09 1.88 -0.21 0.00 0.00 178.00 179.83 2jj2 h TYR 248 N 1.09 0.68 -0.12 0.65 -1.99 -1.31 0.17 116.97 116.14 2jj2 h TYR 248 Ca 0.43 -0.15 0.05 0.00 2.00 0.00 0.00 58.73 61.06 2jj2 h TYR 248 Cb 0.24 -0.16 -0.06 0.00 2.00 0.00 0.00 36.73 38.75 2jj2 h TYR 248 CO -0.00 0.80 -0.29 0.77 -0.00 0.00 0.00 178.16 179.44 2jj2 h SER 249 N 0.37 -0.89 -0.84 3.88 0.02 -0.86 0.13 113.55 115.37 2jj2 h SER 249 Ca 0.08 0.13 0.02 0.00 -0.84 0.00 0.00 61.79 61.18 2jj2 h SER 249 Cb 0.58 0.38 -0.04 0.00 0.14 0.00 0.00 62.40 63.46 2jj2 h SER 249 CO 0.03 -0.33 0.55 1.23 -1.14 0.00 0.00 176.83 177.17 2jj2 h GLY 250 N -0.36 1.18 1.00 -3.77 0.00 -0.99 -2.60 103.07 97.54 2jj2 h GLY 250 Ca 0.10 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 47.00 2jj2 h GLY 250 CO -0.33 0.41 0.24 0.00 0.00 0.00 0.00 176.54 176.86 2jj2 h SER 252 N 0.49 0.29 0.02 0.00 0.02 -0.69 -0.29 113.55 113.39 2jj2 h SER 252 Ca 0.13 -0.11 -0.04 0.00 -0.84 0.00 0.00 61.79 60.94 2jj2 h SER 252 Cb -0.06 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.39 2jj2 h SER 252 CO -0.03 0.61 -0.10 0.24 -1.14 0.00 0.00 176.83 176.41 2jj2 h MET 253 N 0.25 0.20 0.00 3.45 2.86 -1.29 -2.33 114.93 118.07 2jj2 h MET 253 Ca 0.03 -0.04 -0.20 0.00 -2.06 0.00 0.00 59.70 57.43 2jj2 h MET 253 Cb 0.70 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.30 2jj2 h MET 253 CO 0.05 0.31 -0.95 0.78 1.06 0.00 0.00 176.91 178.16 2jj2 h GLY 254 N 0.64 0.00 1.68 8.32 0.00 -0.86 -3.30 103.07 109.55 2jj2 h GLY 254 Ca 0.04 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.26 2jj2 h GLY 254 CO 0.02 0.00 -0.39 0.83 0.00 0.00 0.00 176.54 176.99 2jj2 h GLU 255 N 0.00 0.36 -0.76 4.80 5.08 -0.72 -0.97 114.58 122.37 2jj2 h GLU 255 Ca -0.01 -0.17 0.13 0.00 -1.00 0.00 0.00 59.36 58.31 2jj2 h GLU 255 Cb 1.72 -0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.87 2jj2 h GLU 255 CO 0.12 0.70 0.34 -0.92 -1.00 0.00 0.00 179.01 178.26 2jj2 h TYR 256 N 0.30 0.59 0.04 4.33 3.20 -1.51 0.39 116.97 124.32 2jj2 h TYR 256 Ca 0.03 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.93 2jj2 h TYR 256 Cb 0.83 -0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.96 2jj2 h TYR 256 CO 0.02 0.12 -0.02 0.74 -1.64 0.00 0.00 178.16 177.38 2jj2 h PHE 257 N 0.51 -0.05 -0.92 -3.82 -1.00 -1.58 -3.11 116.94 106.97 2jj2 h PHE 257 Ca 0.41 -0.00 0.16 0.00 2.81 0.00 0.00 57.97 61.35 2jj2 h PHE 257 Cb 0.58 0.02 -0.10 0.00 3.61 0.00 0.00 35.95 40.06 2jj2 h PHE 257 CO -0.14 0.42 0.52 -0.09 -1.61 0.00 0.00 178.31 177.41 2jj2 h ARG 258 N -0.55 0.69 -0.00 1.51 2.43 -0.57 -1.51 114.38 116.38 2jj2 h ARG 258 Ca -0.01 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2jj2 h ARG 258 Cb 0.50 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 2jj2 h ARG 258 CO 0.01 0.46 -0.06 -0.25 -1.51 0.00 0.00 179.97 178.62 2jj2 n ASP 259 N -4.81 0.17 -2.12 -3.80 8.00 0.13 -3.66 116.55 110.47 2jj2 n ASP 259 Ca 0.19 -0.24 -0.22 0.00 0.71 0.00 0.00 54.79 55.23 2jj2 n ASP 259 Cb 0.47 -0.21 0.02 0.00 -0.02 0.00 0.00 41.12 41.38 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 -1.20 4.62 -0.48 -2.24 3.02 -0.64 -4.88 115.26 113.46 2jj2 n ASN 260 Ca 0.13 -3.60 -0.06 0.00 -0.03 0.00 0.00 54.58 51.02 2jj2 n ASN 260 Cb 0.26 -0.36 -0.03 0.00 -0.61 0.00 0.00 39.78 39.05 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 -0.69 0.73 3.69 7.41 0.00 -1.24 -4.98 105.19 110.11 2jj2 n GLY 261 Ca 0.40 -0.14 -0.25 0.00 0.00 0.00 0.00 46.02 46.04 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 -2.19 2.15 -0.07 1.61 1.02 -0.78 -4.44 119.74 117.05 2jj2 s LYS 262 Ca 0.00 -1.85 0.05 0.00 0.02 0.00 0.00 55.97 54.19 2jj2 s LYS 262 Cb 0.00 -1.92 -0.01 0.00 -0.52 0.00 0.00 37.83 35.38 2jj2 s LYS 262 CO 0.00 -0.03 -0.22 -1.01 -0.92 0.00 0.00 175.35 173.17 2jj2 s HIS 263 N -2.59 2.52 0.01 3.18 3.76 -1.26 -1.31 115.29 119.60 2jj2 s HIS 263 Ca 0.38 -0.65 0.03 0.00 -0.15 0.00 0.00 55.06 54.68 2jj2 s HIS 263 Cb 0.04 -1.64 -0.01 0.00 1.11 0.00 0.00 32.58 32.08 2jj2 s HIS 263 CO 0.21 -0.17 -0.09 0.00 -0.85 0.00 0.00 174.74 173.84 2jj2 s ALA 264 N -0.17 0.75 -0.09 -1.40 0.00 0.27 -1.84 121.76 119.28 2jj2 s ALA 264 Ca -0.03 -0.51 -0.00 0.00 0.00 0.00 0.00 51.96 51.42 2jj2 s ALA 264 Cb -0.14 -0.14 -0.03 0.00 0.00 0.00 0.00 23.12 22.82 2jj2 s ALA 264 CO 0.04 0.14 -0.08 -1.17 0.00 0.00 0.00 175.76 174.69 2jj2 s LEU 265 N -0.62 3.08 -0.04 0.00 2.96 0.19 -0.28 118.68 123.97 2jj2 s LEU 265 Ca 0.01 -0.10 0.02 0.00 -0.22 0.00 0.00 54.13 53.83 2jj2 s LEU 265 Cb -0.05 -1.69 0.01 0.00 0.50 0.00 0.00 46.19 44.96 2jj2 s LEU 265 CO 0.00 0.29 -0.08 -0.51 -1.32 0.00 0.00 176.35 174.73 2jj2 s ILE 266 N -0.38 0.77 -0.17 6.68 2.07 0.53 0.54 121.20 131.24 2jj2 s ILE 266 Ca 0.05 -0.30 -0.03 0.00 -1.41 0.00 0.00 60.65 58.96 2jj2 s ILE 266 Cb -0.12 -0.72 -0.02 0.00 0.13 0.00 0.00 42.46 41.73 2jj2 s ILE 266 CO 0.02 0.26 -0.05 -0.63 -1.91 0.00 0.00 174.94 172.63 2jj2 s ILE 267 N 0.53 3.61 -0.43 2.00 1.09 0.53 -0.15 121.20 128.37 2jj2 s ILE 267 Ca -0.09 -0.45 -0.11 0.00 -1.10 0.00 0.00 60.65 58.90 2jj2 s ILE 267 Cb -0.12 -2.59 0.07 0.00 -1.06 0.00 0.00 42.46 38.76 2jj2 s ILE 267 CO 0.01 0.48 0.30 -0.31 -0.10 0.00 0.00 174.94 175.31 2jj2 s TYR 268 N 0.68 3.30 -0.48 3.97 4.12 -1.06 -0.18 117.35 127.70 2jj2 s TYR 268 Ca -0.03 -1.31 0.03 0.00 0.02 0.00 0.00 57.07 55.79 2jj2 s TYR 268 Cb -0.15 -2.99 0.13 0.00 -1.52 0.00 0.00 41.96 37.44 2jj2 s TYR 268 CO 0.02 -0.82 0.24 0.34 0.02 0.00 0.00 175.55 175.35 2jj2 s ASP 269 N 2.22 4.17 0.32 2.29 2.15 0.15 -0.88 116.67 127.10 2jj2 s ASP 269 Ca 0.03 -2.83 0.03 0.00 0.43 0.00 0.00 52.55 50.21 2jj2 s ASP 269 Cb -0.23 -1.47 -0.05 0.00 -0.30 0.00 0.00 42.92 40.86 2jj2 s ASP 269 CO 0.04 -0.25 0.08 1.51 -0.17 0.00 0.00 175.17 176.38 2jj2 s ASP 270 N -0.01 2.06 0.30 -0.34 1.47 -1.23 -0.23 116.67 118.69 2jj2 s ASP 270 Ca 0.17 -1.42 0.22 0.00 1.18 0.00 0.00 52.55 52.69 2jj2 s ASP 270 Cb -0.25 0.08 0.14 0.00 -0.34 0.00 0.00 42.92 42.54 2jj2 s ASP 270 CO -0.01 -0.69 1.30 -0.07 0.68 0.00 0.00 175.17 176.38 2jj2 h LEU 271 N 2.15 0.00 -0.15 2.11 3.38 -1.29 -3.03 115.31 118.48 2jj2 h LEU 271 Ca -0.39 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.62 2jj2 h LEU 271 Cb 1.25 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.96 2jj2 h LEU 271 CO 0.65 0.09 -0.12 0.28 0.09 0.00 0.00 178.44 179.43 2jj2 h SER 272 N 0.00 -0.37 -0.47 -0.43 0.02 -1.93 -1.48 113.55 108.89 2jj2 h SER 272 Ca -0.01 0.08 -0.09 0.00 -0.84 0.00 0.00 61.79 60.92 2jj2 h SER 272 Cb 1.08 0.19 -0.02 0.00 0.14 0.00 0.00 62.40 63.79 2jj2 h SER 272 CO 0.01 -0.15 -0.06 0.11 -1.14 0.00 0.00 176.83 175.60 2jj2 h LYS 273 N -0.12 0.88 -0.53 3.45 1.57 -1.86 -2.43 116.57 117.53 2jj2 h LYS 273 Ca 0.10 -0.31 0.09 0.00 -1.87 0.00 0.00 60.65 58.66 2jj2 h LYS 273 Cb 0.26 -0.06 -0.07 0.00 0.08 0.00 0.00 32.23 32.44 2jj2 h LYS 273 CO -0.23 0.95 0.12 0.37 -0.57 0.00 0.00 179.45 180.09 2jj2 h GLN 274 N 0.73 0.25 -0.35 3.15 4.15 -1.44 -1.72 115.11 119.87 2jj2 h GLN 274 Ca 0.13 -0.01 0.02 0.00 0.77 0.00 0.00 58.65 59.55 2jj2 h GLN 274 Cb 0.59 -0.06 -0.03 0.00 0.21 0.00 0.00 27.48 28.20 2jj2 h GLN 274 CO 0.04 0.16 0.20 0.00 -1.93 0.00 0.00 178.83 177.30 2jj2 h ALA 275 N 1.41 0.44 -0.77 3.38 0.00 -1.05 -1.55 119.26 121.12 2jj2 h ALA 275 Ca 0.27 0.00 0.14 0.00 0.00 0.00 0.00 54.91 55.32 2jj2 h ALA 275 Cb 0.36 -0.08 -0.09 0.00 0.00 0.00 0.00 17.79 17.97 2jj2 h ALA 275 CO -0.34 -0.16 0.33 0.28 0.00 0.00 0.00 179.25 179.36 2jj2 h VAL 276 N 0.40 0.67 -0.24 0.00 2.07 -1.10 0.15 116.25 118.21 2jj2 h VAL 276 Ca 0.14 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 2jj2 h VAL 276 Cb 0.02 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 29.93 2jj2 h VAL 276 CO -0.08 0.09 0.07 0.00 0.02 0.00 0.00 177.57 177.67 2jj2 h ALA 277 N 1.55 0.31 -0.51 1.67 0.00 -0.56 -1.64 119.26 120.07 2jj2 h ALA 277 Ca 0.42 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 55.13 2jj2 h ALA 277 Cb 0.63 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 2jj2 h ALA 277 CO -0.39 -0.06 0.06 -0.92 0.00 0.00 0.00 179.25 177.94 2jj2 h TYR 278 N 0.22 0.87 -0.96 0.00 3.20 -0.91 -2.62 116.97 116.76 2jj2 h TYR 278 Ca 0.08 -0.10 0.01 0.00 3.14 0.00 0.00 58.73 61.85 2jj2 h TYR 278 Cb 0.24 -0.24 -0.05 0.00 1.54 0.00 0.00 36.73 38.22 2jj2 h TYR 278 CO 0.00 0.77 0.63 -0.09 -1.64 0.00 0.00 178.16 177.83 2jj2 h ARG 279 N 0.78 1.27 -0.08 1.82 2.43 -0.44 -0.70 114.38 119.46 2jj2 h ARG 279 Ca 0.16 -0.08 0.03 0.00 -0.81 0.00 0.00 59.98 59.28 2jj2 h ARG 279 Cb 0.39 -0.28 -0.03 0.00 -0.42 0.00 0.00 29.97 29.62 2jj2 h ARG 279 CO 0.01 0.85 -0.11 0.37 -1.51 0.00 0.00 179.97 179.58 2jj2 h GLN 280 N 1.31 -0.14 -0.37 0.20 4.15 -0.93 -1.25 115.11 118.06 2jj2 h GLN 280 Ca 0.35 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.78 2jj2 h GLN 280 Cb -0.13 0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.57 2jj2 h GLN 280 CO -0.07 -0.10 0.25 0.52 -1.93 0.00 0.00 178.83 177.50 2jj2 h MET 281 N -0.15 0.49 -0.42 1.69 2.86 -1.25 -2.06 114.93 116.09 2jj2 h MET 281 Ca 0.07 -0.03 -0.09 0.00 -2.06 0.00 0.00 59.70 57.58 2jj2 h MET 281 Cb 0.24 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.78 2jj2 h MET 281 CO -0.16 0.33 -0.10 0.77 1.06 0.00 0.00 176.91 178.81 2jj2 h SER 282 N 0.51 0.81 -0.55 1.22 0.02 -0.81 -0.11 113.55 114.62 2jj2 h SER 282 Ca 0.14 -0.36 0.00 0.00 -0.84 0.00 0.00 61.79 60.73 2jj2 h SER 282 Cb -0.06 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.24 2jj2 h SER 282 CO -0.03 0.98 0.36 -0.07 -1.14 0.00 0.00 176.83 176.93 2jj2 h LEU 283 N 0.62 0.64 -0.41 5.07 3.38 -1.20 0.31 115.31 123.72 2jj2 h LEU 283 Ca 0.11 -0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.92 2jj2 h LEU 283 Cb 0.62 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 2jj2 h LEU 283 CO 0.04 0.47 -0.61 -0.07 0.09 0.00 0.00 178.44 178.36 2jj2 h LEU 284 N 0.75 0.00 0.00 1.67 3.38 -1.19 -0.99 115.31 118.92 2jj2 h LEU 284 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2jj2 h LEU 284 Cb -0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.67 2jj2 h LEU 284 CO -0.04 0.61 0.00 0.18 0.09 0.00 0.00 178.44 179.28 2jj2 n LEU 285 N -3.45 0.00 -1.40 1.67 4.77 -0.07 -4.89 117.00 113.63 2jj2 n LEU 285 Ca 0.00 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.83 2jj2 n LEU 285 Cb 0.70 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.74 2jj2 n LEU 285 CO 0.41 0.00 -0.17 0.54 -1.33 0.00 0.00 177.39 176.85 2jj2 n ARG 286 N -1.00 -1.13 -2.05 3.23 1.74 -0.38 -5.00 116.66 112.08 2jj2 n ARG 286 Ca 0.19 0.94 -0.37 0.00 -0.77 0.00 0.00 57.85 57.84 2jj2 n ARG 286 Cb 0.09 -5.17 0.02 0.00 -1.02 0.00 0.00 32.46 26.38 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 -3.84 3.42 0.29 5.56 0.52 0.01 -4.95 118.95 119.97 2jj2 s ARG 287 Ca 0.00 1.96 -0.30 0.00 -0.52 0.00 0.00 55.73 56.87 2jj2 s ARG 287 Cb 0.00 -2.29 -0.11 0.00 0.52 0.00 0.00 34.95 33.07 2jj2 s ARG 287 CO 0.00 -0.88 1.51 -2.14 0.02 0.00 0.00 175.30 173.82 2jj2 s PRO 288 N -2.86 4.18 0.25 3.54 0.02 -1.26 -4.45 135.00 134.42 2jj2 s PRO 288 Ca 0.68 2.47 -0.21 0.00 0.02 0.00 0.00 61.00 63.96 2jj2 s PRO 288 Cb -0.33 -3.05 -0.09 0.00 0.02 0.00 0.00 34.50 31.06 2jj2 s PRO 288 CO 0.39 -0.53 0.78 -1.25 -0.33 0.00 0.00 177.00 176.07 2jj2 s PRO 289 N -0.76 4.34 0.00 5.54 0.04 -1.26 -4.51 135.00 138.39 2jj2 s PRO 289 Ca 0.60 0.98 0.00 0.00 0.04 0.00 0.00 61.00 62.62 2jj2 s PRO 289 Cb -0.45 -2.86 0.00 0.00 0.04 0.00 0.00 34.50 31.23 2jj2 s PRO 289 CO 0.49 0.37 0.00 0.41 0.04 0.00 0.00 177.00 178.30 2jj2 n GLY 290 N 0.68 4.54 3.69 0.56 0.00 0.68 -4.93 105.19 110.41 2jj2 n GLY 290 Ca -0.01 -1.68 -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 2.34 -1.94 1.61 0.63 -1.26 -0.99 116.66 117.04 2jj2 n ARG 291 Ca 0.00 0.84 -0.17 0.00 -0.92 0.00 0.00 57.85 57.60 2jj2 n ARG 291 Cb 0.00 -2.62 -0.04 0.00 0.45 0.00 0.00 32.46 30.24 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 3.37 -1.63 -0.96 -0.14 1.02 -1.26 -1.64 120.64 119.40 2jj2 n GLU 292 Ca 0.16 0.93 0.00 0.00 -0.02 0.00 0.00 57.16 58.23 2jj2 n GLU 292 Cb 0.31 -5.41 0.00 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 -0.51 0.00 -1.79 0.62 0.00 -0.16 -5.00 120.51 113.67 2jj2 n ALA 293 Ca -0.19 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 52.91 2jj2 n ALA 293 Cb 0.61 -0.97 -0.03 0.00 0.00 0.00 0.00 19.45 19.06 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 -1.40 3.00 0.69 0.00 1.51 -0.65 -4.34 117.35 116.16 2jj2 s TYR 294 Ca 0.00 1.58 -0.07 0.00 -1.01 0.00 0.00 57.07 57.57 2jj2 s TYR 294 Cb 0.00 -3.11 0.05 0.00 -0.11 0.00 0.00 41.96 38.79 2jj2 s TYR 294 CO 0.00 -0.89 1.00 -1.25 -1.11 0.00 0.00 175.55 173.30 2jj2 s PRO 295 N -3.10 2.35 0.10 -1.71 0.04 -1.26 -0.23 135.00 131.18 2jj2 s PRO 295 Ca 0.66 -0.16 0.17 0.00 0.04 0.00 0.00 61.00 61.71 2jj2 s PRO 295 Cb -0.18 -2.18 0.72 0.00 0.04 0.00 0.00 34.50 32.90 2jj2 s PRO 295 CO 0.22 -1.14 1.52 0.41 0.04 0.00 0.00 177.00 178.05 2jj2 n GLY 296 N -2.87 -1.05 1.18 0.56 0.00 -1.26 -2.86 105.19 98.88 2jj2 n GLY 296 Ca 0.07 0.01 0.10 0.00 0.00 0.00 0.00 46.02 46.20 2jj2 n GLY 296 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2jj2 n ASP 297 N -1.77 3.71 0.07 1.61 5.75 -1.26 -4.53 116.55 120.13 2jj2 n ASP 297 Ca 0.03 -2.00 -0.06 0.00 -0.01 0.00 0.00 54.79 52.75 2jj2 n ASP 297 Cb 0.17 -0.43 0.12 0.00 -1.03 0.00 0.00 41.12 39.96 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 3.75 1.37 0.15 2.12 3.04 -1.92 0.14 116.25 124.89 2jj2 h VAL 298 Ca 0.00 -1.92 -0.00 0.00 -1.01 0.00 0.00 66.70 63.77 2jj2 h VAL 298 Cb 0.93 1.94 -0.00 0.00 -2.01 0.00 0.00 31.29 32.15 2jj2 h VAL 298 CO 0.00 0.57 -0.09 0.15 -1.01 0.00 0.00 177.57 177.19 2jj2 h PHE 299 N 0.22 -0.22 -0.46 3.17 3.57 -1.84 -2.62 116.94 118.75 2jj2 h PHE 299 Ca -0.00 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.59 2jj2 h PHE 299 Cb 1.08 0.08 -0.08 0.00 2.79 0.00 0.00 35.95 39.82 2jj2 h PHE 299 CO 0.02 -0.14 -0.04 -0.92 -2.23 0.00 0.00 178.31 175.00 2jj2 h TYR 300 N -0.22 -0.11 -0.62 0.41 3.20 -1.82 0.31 116.97 118.12 2jj2 h TYR 300 Ca -0.01 0.04 0.10 0.00 3.14 0.00 0.00 58.73 61.99 2jj2 h TYR 300 Cb 0.18 0.12 -0.11 0.00 1.54 0.00 0.00 36.73 38.46 2jj2 h TYR 300 CO -0.08 -0.14 -0.41 1.25 -1.64 0.00 0.00 178.16 177.14 2jj2 h LEU 301 N 0.07 -1.43 -0.13 2.82 5.85 -0.57 -1.05 115.31 120.87 2jj2 h LEU 301 Ca 0.23 0.25 -0.24 0.00 0.84 0.00 0.00 57.88 58.96 2jj2 h LEU 301 Cb 0.35 0.67 0.01 0.00 0.37 0.00 0.00 40.66 42.05 2jj2 h LEU 301 CO -0.42 -0.32 -0.96 0.45 -0.34 0.00 0.00 178.44 176.84 2jj2 h HIS 302 N -0.19 0.78 -0.83 1.25 3.86 -1.07 -3.12 115.15 115.82 2jj2 h HIS 302 Ca 0.20 -0.42 -0.03 0.00 -1.16 0.00 0.00 60.37 58.97 2jj2 h HIS 302 Cb 0.56 -0.09 -0.04 0.00 1.06 0.00 0.00 27.41 28.90 2jj2 h HIS 302 CO -0.71 1.24 0.40 0.66 0.86 0.00 0.00 177.93 180.38 2jj2 h SER 303 N 0.30 1.08 1.30 2.45 4.64 -0.05 -1.44 113.55 121.84 2jj2 h SER 303 Ca -0.09 -0.13 -0.04 0.00 -0.47 0.00 0.00 61.79 61.06 2jj2 h SER 303 Cb 1.60 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 63.41 2jj2 h SER 303 CO 0.18 0.91 -0.18 0.08 -0.87 0.00 0.00 176.83 176.94 2jj2 h ARG 304 N 1.18 0.00 -0.05 4.77 0.11 -1.26 -2.08 114.38 117.04 2jj2 h ARG 304 Ca 0.29 0.00 -0.08 0.00 0.10 0.00 0.00 59.98 60.29 2jj2 h ARG 304 Cb 0.11 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.19 2jj2 h ARG 304 CO -0.04 0.18 -0.28 1.25 0.10 0.00 0.00 179.97 181.19 2jj2 h LEU 305 N 0.00 0.34 -0.09 0.08 5.85 -1.38 -3.37 115.31 116.74 2jj2 h LEU 305 Ca -0.00 -0.66 -0.10 0.00 0.84 0.00 0.00 57.88 57.96 2jj2 h LEU 305 Cb 0.88 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.79 2jj2 h LEU 305 CO 0.02 0.94 -0.50 -0.07 -0.34 0.00 0.00 178.44 178.50 2jj2 h LEU 306 N -0.25 0.00 -0.92 2.25 3.38 -1.22 -3.01 115.31 115.53 2jj2 h LEU 306 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2jj2 h LEU 306 Cb 0.94 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.69 2jj2 h LEU 306 CO 0.06 0.50 0.00 -0.33 0.09 0.00 0.00 178.44 178.75 2jj2 h GLU 307 N 0.00 0.00 0.00 1.13 4.39 -1.54 -2.86 114.58 115.71 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 1.35 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.00 2jj2 h GLU 307 CO 0.06 0.00 0.00 0.54 -1.16 0.00 0.00 179.01 178.45 2jj2 n ARG 308 N -2.40 0.20 -2.33 2.33 1.74 -1.14 -4.55 116.66 110.50 2jj2 n ARG 308 Ca 0.02 0.26 -0.42 0.00 -0.77 0.00 0.00 57.85 56.93 2jj2 n ARG 308 Cb 0.23 -1.77 -0.03 0.00 -1.02 0.00 0.00 32.46 29.86 2jj2 n ARG 308 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2jj2 s ALA 309 N -3.15 3.46 0.04 7.54 0.00 -1.08 -4.83 121.76 123.75 2jj2 s ALA 309 Ca 0.09 0.95 -0.27 0.00 0.00 0.00 0.00 51.96 52.73 2jj2 s ALA 309 Cb 0.12 -3.47 0.07 0.00 0.00 0.00 0.00 23.12 19.85 2jj2 s ALA 309 CO 0.51 -0.48 0.67 0.00 0.00 0.00 0.00 175.76 176.46 2jj2 s ALA 310 N 0.87 -1.70 -0.35 0.00 0.00 -0.72 -4.93 121.76 114.93 2jj2 s ALA 310 Ca 0.59 0.93 -0.09 0.00 0.00 0.00 0.00 51.96 53.40 2jj2 s ALA 310 Cb -0.32 0.40 0.03 0.00 0.00 0.00 0.00 23.12 23.22 2jj2 s ALA 310 CO 0.31 -0.57 0.15 0.21 0.00 0.00 0.00 175.76 175.86 2jj2 s LYS 311 N -2.48 2.84 0.44 0.00 2.47 -1.26 -1.09 119.74 120.66 2jj2 s LYS 311 Ca -0.04 -1.05 -0.21 0.00 -1.56 0.00 0.00 55.97 53.11 2jj2 s LYS 311 Cb -0.01 -3.58 -0.10 0.00 -1.46 0.00 0.00 37.83 32.69 2jj2 s LYS 311 CO -0.02 -0.63 1.00 -1.64 0.16 0.00 0.00 175.35 174.22 2jj2 s MET 312 N 1.50 4.06 0.83 4.03 -1.94 -0.37 -2.62 119.30 124.79 2jj2 s MET 312 Ca 0.01 1.27 -0.12 0.00 -1.71 0.00 0.00 55.69 55.14 2jj2 s MET 312 Cb -0.19 -2.21 0.09 0.00 2.01 0.00 0.00 34.83 34.53 2jj2 s MET 312 CO 0.05 -0.20 1.18 0.54 -0.01 0.00 0.00 175.02 176.58 2jj2 s ASN 313 N -2.00 4.32 0.35 3.03 2.20 0.38 -4.17 114.94 119.04 2jj2 s ASN 313 Ca 0.63 0.79 0.05 0.00 -0.94 0.00 0.00 52.86 53.39 2jj2 s ASN 313 Cb -0.14 -1.28 0.65 0.00 -2.00 0.00 0.00 41.25 38.47 2jj2 s ASN 313 CO 0.18 -2.02 1.91 0.44 -2.94 0.00 0.00 177.10 174.67 2jj2 h ASP 314 N -1.14 0.51 -0.37 3.54 3.32 -1.90 0.08 116.42 120.46 2jj2 h ASP 314 Ca -0.47 -0.07 0.11 0.00 0.02 0.00 0.00 57.03 56.62 2jj2 h ASP 314 Cb 1.33 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.73 2jj2 h ASP 314 CO 0.65 0.52 0.33 0.00 -1.72 0.00 0.00 179.24 179.02 2jj2 h ALA 315 N 1.55 2.15 -0.45 3.45 0.00 -1.95 -1.95 119.26 122.06 2jj2 h ALA 315 Ca 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2jj2 h ALA 315 Cb 0.23 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2jj2 h ALA 315 CO -0.00 -0.52 0.00 1.19 0.00 0.00 0.00 179.25 179.92 2jj2 n PHE 316 N -4.01 1.26 0.00 0.00 3.01 -0.09 -4.94 117.46 112.69 2jj2 n PHE 316 Ca 0.06 -0.71 0.00 0.00 1.01 0.00 0.00 57.45 57.81 2jj2 n PHE 316 Cb 0.50 -0.29 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 0.35 2.22 2.52 1.37 0.00 -0.73 -4.47 105.19 106.44 2jj2 n GLY 317 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 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 -1.99 0.30 3.50 -0.02 0.00 -0.57 -4.14 105.19 102.26 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 1.53 -0.06 -0.02 0.00 -1.24 -4.61 107.32 100.91 2jj2 s GLY 319 Ca 0.00 -0.80 -0.26 0.00 0.00 0.00 0.00 44.72 43.66 2jj2 s GLY 319 CO 0.00 0.09 0.59 -1.35 0.00 0.00 0.00 173.10 172.43 2jj2 s SER 320 N -3.52 -0.55 -0.14 1.64 1.04 -0.43 -1.24 113.70 110.50 2jj2 s SER 320 Ca 0.70 0.63 0.00 0.00 0.48 0.00 0.00 55.95 57.76 2jj2 s SER 320 Cb -0.13 0.56 0.02 0.00 0.10 0.00 0.00 66.02 66.58 2jj2 s SER 320 CO 0.57 -0.53 -0.13 -0.22 0.98 0.00 0.00 173.24 173.91 2jj2 s LEU 321 N -1.07 1.62 -0.17 2.42 2.96 -0.25 -0.57 118.68 123.62 2jj2 s LEU 321 Ca -0.11 -0.46 -0.05 0.00 -0.22 0.00 0.00 54.13 53.30 2jj2 s LEU 321 Cb -0.02 -1.13 -0.03 0.00 0.50 0.00 0.00 46.19 45.51 2jj2 s LEU 321 CO 0.08 -0.06 -0.01 -0.89 -1.32 0.00 0.00 176.35 174.15 2jj2 s THR 322 N 1.49 4.03 -0.12 3.68 2.01 0.61 -1.76 115.64 125.59 2jj2 s THR 322 Ca 0.04 -0.30 -0.00 0.00 0.31 0.00 0.00 61.69 61.74 2jj2 s THR 322 Cb -0.13 -2.79 -0.02 0.00 0.01 0.00 0.00 72.50 69.57 2jj2 s THR 322 CO -0.10 0.47 -0.10 0.00 -0.69 0.00 0.00 174.62 174.20 2jj2 s ALA 323 N 0.54 2.76 -0.74 7.40 0.00 -0.80 -0.34 121.76 130.59 2jj2 s ALA 323 Ca -0.02 -0.88 0.01 0.00 0.00 0.00 0.00 51.96 51.07 2jj2 s ALA 323 Cb -0.14 -1.26 0.18 0.00 0.00 0.00 0.00 23.12 21.90 2jj2 s ALA 323 CO 0.02 0.33 0.56 -0.51 0.00 0.00 0.00 175.76 176.16 2jj2 s LEU 324 N 0.05 5.07 0.50 0.00 1.43 0.79 -1.67 118.68 124.85 2jj2 s LEU 324 Ca -0.03 -3.57 -0.22 0.00 -1.03 0.00 0.00 54.13 49.28 2jj2 s LEU 324 Cb -0.14 -1.76 -0.07 0.00 0.03 0.00 0.00 46.19 44.25 2jj2 s LEU 324 CO 0.04 -0.17 1.17 -2.16 0.23 0.00 0.00 176.35 175.46 2jj2 s PRO 325 N -1.09 3.55 -0.06 1.29 0.04 -1.23 -2.57 135.00 134.93 2jj2 s PRO 325 Ca 0.24 1.77 0.02 0.00 0.04 0.00 0.00 61.00 63.07 2jj2 s PRO 325 Cb -0.10 -2.26 -0.03 0.00 0.04 0.00 0.00 34.50 32.15 2jj2 s PRO 325 CO -0.11 -0.72 -0.10 0.08 0.04 0.00 0.00 177.00 176.18 2jj2 s VAL 326 N -1.59 3.43 -0.02 -0.36 1.01 -0.05 -1.30 120.40 121.51 2jj2 s VAL 326 Ca 0.68 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 62.08 2jj2 s VAL 326 Cb -0.28 -2.38 0.01 0.00 0.00 0.00 0.00 36.38 33.73 2jj2 s VAL 326 CO 0.34 0.60 -0.05 -0.63 0.00 0.00 0.00 175.10 175.35 2jj2 s ILE 327 N -0.77 0.45 -0.23 2.22 -1.09 -0.56 -1.24 121.20 119.97 2jj2 s ILE 327 Ca 0.12 -0.17 -0.12 0.00 -2.23 0.00 0.00 60.65 58.26 2jj2 s ILE 327 Cb -0.11 -0.43 -0.05 0.00 -1.58 0.00 0.00 42.46 40.29 2jj2 s ILE 327 CO 0.01 0.16 0.21 -0.70 -1.23 0.00 0.00 174.94 173.39 2jj2 s GLU 328 N 0.35 4.10 0.42 2.79 2.12 -1.26 -2.92 118.70 124.30 2jj2 s GLU 328 Ca -0.04 -0.17 0.02 0.00 0.36 0.00 0.00 54.97 55.14 2jj2 s GLU 328 Cb -0.08 -3.53 -0.01 0.00 0.26 0.00 0.00 34.13 30.77 2jj2 s GLU 328 CO -0.00 0.05 0.62 0.95 -0.54 0.00 0.00 175.26 176.34 2jj2 s THR 329 N 1.09 4.09 -0.24 -1.70 -4.23 -0.65 -4.92 115.64 109.08 2jj2 s THR 329 Ca 0.10 -0.59 -0.01 0.00 -1.18 0.00 0.00 61.69 60.01 2jj2 s THR 329 Cb -0.14 -3.49 0.02 0.00 1.34 0.00 0.00 72.50 70.24 2jj2 s THR 329 CO 0.05 -0.31 -0.08 -1.10 -0.54 0.00 0.00 174.62 172.63 2jj2 s GLN 330 N -4.47 2.88 -1.54 3.99 -1.52 -1.26 -4.22 119.66 113.52 2jj2 s GLN 330 Ca 0.47 -0.94 -0.13 0.00 -1.95 0.00 0.00 55.36 52.80 2jj2 s GLN 330 Cb -0.10 -2.92 0.09 0.00 -0.22 0.00 0.00 33.01 29.86 2jj2 s GLN 330 CO 0.36 -0.36 0.92 0.00 -0.25 0.00 0.00 175.29 175.96 2jj2 n ALA 331 N 4.66 -1.35 -1.04 6.09 0.00 -1.26 -2.10 120.51 125.51 2jj2 n ALA 331 Ca -0.17 0.13 -0.02 0.00 0.00 0.00 0.00 53.44 53.38 2jj2 n ALA 331 Cb 0.48 -4.08 -0.01 0.00 0.00 0.00 0.00 19.45 15.84 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 0.50 3.50 0.00 0.00 -1.26 -4.95 105.19 101.32 2jj2 n GLY 332 Ca 0.01 -0.25 -0.43 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.29 6.84 0.07 1.61 2.15 -0.89 -4.78 116.67 119.38 2jj2 s ASP 333 Ca 0.00 -2.45 0.19 0.00 0.43 0.00 0.00 52.55 50.72 2jj2 s ASP 333 Cb 0.00 -2.46 0.80 0.00 -0.30 0.00 0.00 42.92 40.96 2jj2 s ASP 333 CO 0.00 -1.01 1.60 1.33 -0.17 0.00 0.00 175.17 176.93 2jj2 n VAL 334 N 5.48 0.80 0.74 1.11 0.24 -1.26 -2.66 118.33 122.78 2jj2 n VAL 334 Ca 0.35 0.18 0.11 0.00 -2.04 0.00 0.00 64.34 62.95 2jj2 n VAL 334 Cb 0.46 -0.94 0.27 0.00 -1.47 0.00 0.00 33.84 32.16 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 -1.71 2.72 -4.71 -1.34 7.64 -1.26 -3.24 113.62 111.72 2jj2 n SER 335 Ca 0.04 -1.88 -0.29 0.00 1.01 0.00 0.00 58.87 57.75 2jj2 n SER 335 Cb 0.22 -0.17 0.16 0.00 -1.01 0.00 0.00 64.21 63.41 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 -1.66 1.28 0.04 -0.43 0.00 -1.09 -4.76 121.76 115.14 2jj2 s ALA 336 Ca 0.35 -0.34 -0.31 0.00 0.00 0.00 0.00 51.96 51.66 2jj2 s ALA 336 Cb 0.21 -3.11 -0.18 0.00 0.00 0.00 0.00 23.12 20.04 2jj2 s ALA 336 CO 0.30 -2.59 1.39 -0.92 0.00 0.00 0.00 175.76 173.94 2jj2 h TYR 337 N -1.72 -0.93 -0.37 0.00 -0.00 -1.91 -0.89 116.97 111.14 2jj2 h TYR 337 Ca -0.53 -0.02 -0.04 0.00 -0.00 0.00 0.00 58.73 58.14 2jj2 h TYR 337 Cb 1.32 0.31 -0.01 0.00 -0.00 0.00 0.00 36.73 38.34 2jj2 h TYR 337 CO 0.32 -0.56 0.06 0.82 -0.00 0.00 0.00 178.16 178.80 2jj2 h ILE 338 N -1.14 1.24 -0.47 1.81 1.08 -1.96 -2.09 117.51 115.97 2jj2 h ILE 338 Ca -0.10 -0.84 0.08 0.00 -0.39 0.00 0.00 64.86 63.60 2jj2 h ILE 338 Cb 0.79 1.07 -0.06 0.00 -3.07 0.00 0.00 36.82 35.54 2jj2 h ILE 338 CO 0.17 0.29 0.10 -0.65 -0.69 0.00 0.00 178.15 177.37 2jj2 h PRO 339 N 0.46 0.23 -0.67 2.37 0.11 -1.84 -1.46 132.00 131.20 2jj2 h PRO 339 Ca 0.11 -0.01 0.13 0.00 0.11 0.00 0.00 66.00 66.34 2jj2 h PRO 339 Cb 0.36 -0.05 -0.09 0.00 0.11 0.00 0.00 31.00 31.32 2jj2 h PRO 339 CO 0.01 0.15 0.20 1.15 -0.21 0.00 0.00 178.00 179.30 2jj2 h THR 340 N 0.24 0.64 0.49 -1.15 2.02 -0.94 0.18 112.91 114.38 2jj2 h THR 340 Ca 0.23 -0.11 -0.02 0.00 0.77 0.00 0.00 66.41 67.27 2jj2 h THR 340 Cb 0.29 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 66.98 2jj2 h THR 340 CO -0.29 0.06 -0.23 0.78 0.37 0.00 0.00 175.52 176.20 2jj2 h ASN 341 N 0.33 -0.55 0.43 4.18 2.35 -0.71 -1.97 115.58 119.63 2jj2 h ASN 341 Ca 0.36 -0.01 -0.14 0.00 -0.55 0.00 0.00 56.30 55.96 2jj2 h ASN 341 Cb 0.55 0.14 -0.01 0.00 0.05 0.00 0.00 38.32 39.05 2jj2 h ASN 341 CO -0.41 -0.35 -0.61 0.58 -1.65 0.00 0.00 177.43 174.99 2jj2 h VAL 342 N -0.72 1.40 0.07 2.81 2.07 -0.98 -1.28 116.25 119.62 2jj2 h VAL 342 Ca -0.07 -2.01 0.00 0.00 0.82 0.00 0.00 66.70 65.45 2jj2 h VAL 342 Cb 0.53 2.04 -0.01 0.00 -1.52 0.00 0.00 31.29 32.33 2jj2 h VAL 342 CO 0.11 0.59 -0.08 0.40 0.02 0.00 0.00 177.57 178.61 2jj2 h ILE 343 N 0.13 0.81 0.00 4.57 2.04 -0.66 -2.23 117.51 122.17 2jj2 h ILE 343 Ca -0.01 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.76 2jj2 h ILE 343 Cb 1.10 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 37.98 2jj2 h ILE 343 CO 0.09 0.00 -0.46 0.77 0.00 0.00 0.00 178.15 178.55 2jj2 h SER 344 N -0.18 0.00 -0.38 1.72 4.64 -1.01 -2.96 113.55 115.37 2jj2 h SER 344 Ca 0.01 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.22 2jj2 h SER 344 Cb 0.18 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.26 2jj2 h SER 344 CO -0.03 0.46 -0.17 0.40 -0.87 0.00 0.00 176.83 176.62 2jj2 h ILE 345 N 0.00 1.28 -4.24 0.95 2.04 -1.14 -3.47 117.51 112.94 2jj2 h ILE 345 Ca -0.00 -1.30 -0.45 0.00 1.00 0.00 0.00 64.86 64.10 2jj2 h ILE 345 Cb 0.84 1.31 0.14 0.00 -0.74 0.00 0.00 36.82 38.37 2jj2 h ILE 345 CO 0.06 0.43 0.41 0.42 0.00 0.00 0.00 178.15 179.47 2jj2 s THR 346 N -4.64 1.99 -2.64 -0.27 -4.23 -0.85 -4.98 115.64 100.02 2jj2 s THR 346 Ca -0.12 0.00 0.25 0.00 -1.18 0.00 0.00 61.69 60.64 2jj2 s THR 346 Cb 0.10 -2.97 0.40 0.00 1.34 0.00 0.00 72.50 71.37 2jj2 s THR 346 CO 0.83 0.00 1.52 0.47 -0.54 0.00 0.00 174.62 176.90 2jj2 n ASP 347 N -3.63 2.21 0.00 3.99 8.00 0.61 -5.00 116.55 122.73 2jj2 n ASP 347 Ca 0.12 -1.74 0.00 0.00 0.71 0.00 0.00 54.79 53.88 2jj2 n ASP 347 Cb 0.60 -0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.66 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 1.26 2.18 2.93 0.44 0.00 -1.24 -1.29 105.19 109.47 2jj2 n GLY 348 Ca 0.17 -1.13 -0.14 0.00 0.00 0.00 0.00 46.02 44.91 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 0.27 -0.44 1.61 1.11 -0.17 -0.43 119.66 119.60 2jj2 s GLN 349 Ca 0.00 -0.16 -0.10 0.00 0.01 0.00 0.00 55.36 55.10 2jj2 s GLN 349 Cb 0.00 -0.24 0.09 0.00 -1.01 0.00 0.00 33.01 31.85 2jj2 s GLN 349 CO 0.00 0.06 0.31 0.42 0.01 0.00 0.00 175.29 176.09 2jj2 s ILE 350 N -0.19 4.37 -0.18 1.08 1.01 0.42 -0.80 121.20 126.90 2jj2 s ILE 350 Ca 0.00 -1.48 -0.24 0.00 0.00 0.00 0.00 60.65 58.94 2jj2 s ILE 350 Cb -0.02 -3.73 -0.02 0.00 0.01 0.00 0.00 42.46 38.70 2jj2 s ILE 350 CO -0.00 -0.61 0.76 -0.36 0.00 0.00 0.00 174.94 174.73 2jj2 s PHE 351 N 1.44 3.40 0.03 3.97 0.40 -1.26 -1.43 117.98 124.52 2jj2 s PHE 351 Ca 0.04 1.13 0.01 0.00 -0.60 0.00 0.00 56.93 57.50 2jj2 s PHE 351 Cb -0.24 -2.94 -0.04 0.00 0.51 0.00 0.00 43.02 40.31 2jj2 s PHE 351 CO 0.02 -0.23 0.11 -0.51 0.70 0.00 0.00 175.22 175.30 2jj2 s LEU 352 N 2.12 3.97 0.00 -0.37 1.43 0.86 -0.70 118.68 125.99 2jj2 s LEU 352 Ca 0.35 0.13 0.03 0.00 -1.03 0.00 0.00 54.13 53.60 2jj2 s LEU 352 Cb -0.16 -2.46 -0.01 0.00 0.03 0.00 0.00 46.19 43.59 2jj2 s LEU 352 CO 0.11 0.23 -0.09 -1.61 0.23 0.00 0.00 176.35 175.22 2jj2 s GLU 353 N -2.06 0.69 0.21 1.70 2.02 -0.82 -4.33 118.70 116.11 2jj2 s GLU 353 Ca 0.27 -0.38 -0.08 0.00 0.02 0.00 0.00 54.97 54.80 2jj2 s GLU 353 Cb -0.12 -0.65 0.14 0.00 0.10 0.00 0.00 34.13 33.60 2jj2 s GLU 353 CO 0.19 0.17 1.74 1.15 0.02 0.00 0.00 175.26 178.53 2jj2 h THR 354 N 4.86 1.26 -0.09 3.63 2.02 -1.92 -2.39 112.91 120.28 2jj2 h THR 354 Ca -0.31 -0.93 -0.20 0.00 0.77 0.00 0.00 66.41 65.74 2jj2 h THR 354 Cb 1.18 0.47 -0.00 0.00 -1.74 0.00 0.00 68.15 68.06 2jj2 h THR 354 CO 0.48 0.36 -0.75 1.05 0.37 0.00 0.00 175.52 177.03 2jj2 h GLU 355 N 1.10 0.51 -0.54 6.66 4.11 -1.97 -2.09 114.58 122.35 2jj2 h GLU 355 Ca 0.23 -0.42 0.02 0.00 0.07 0.00 0.00 59.36 59.27 2jj2 h GLU 355 Cb 0.33 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.64 2jj2 h GLU 355 CO -0.00 1.05 0.33 -0.07 0.07 0.00 0.00 179.01 180.39 2jj2 h LEU 356 N 0.34 0.55 -0.20 3.06 3.38 -1.88 -1.71 115.31 118.85 2jj2 h LEU 356 Ca -0.04 -0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.98 2jj2 h LEU 356 Cb 1.35 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.92 2jj2 h LEU 356 CO 0.14 0.39 -0.18 0.15 0.09 0.00 0.00 178.44 179.03 2jj2 h PHE 357 N 0.66 -0.46 0.00 1.13 3.57 -0.88 -1.47 116.94 119.50 2jj2 h PHE 357 Ca 0.21 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.74 2jj2 h PHE 357 Cb -0.00 0.23 0.00 0.00 2.79 0.00 0.00 35.95 38.97 2jj2 h PHE 357 CO -0.06 -0.25 0.00 1.88 -2.23 0.00 0.00 178.31 177.65 2jj2 h TYR 358 N -0.19 0.00 0.00 0.41 -1.99 -1.37 -2.34 116.97 111.49 2jj2 h TYR 358 Ca 0.12 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.85 2jj2 h TYR 358 Cb 0.37 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.10 2jj2 h TYR 358 CO -0.32 0.00 0.00 1.63 -0.00 0.00 0.00 178.16 179.47 2jj2 n LYS 359 N -3.06 0.00 -0.05 4.88 5.02 -0.65 -4.86 118.16 119.45 2jj2 n LYS 359 Ca 0.03 0.34 0.00 0.00 -2.02 0.00 0.00 58.31 56.67 2jj2 n LYS 359 Cb 0.49 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.99 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 -0.53 0.41 3.55 0.72 0.00 -0.88 -5.02 105.19 103.44 2jj2 n GLY 360 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.14 3.41 -0.03 -0.61 -1.09 -0.60 -4.93 121.20 115.21 2jj2 s ILE 361 Ca 0.00 0.05 -0.01 0.00 -2.23 0.00 0.00 60.65 58.46 2jj2 s ILE 361 Cb 0.00 -4.04 0.03 0.00 -1.58 0.00 0.00 42.46 36.87 2jj2 s ILE 361 CO 0.00 -1.00 0.05 -0.13 -1.23 0.00 0.00 174.94 172.62 2jj2 s ARG 362 N 6.91 -0.04 0.41 2.79 0.52 -1.26 -3.25 118.95 125.02 2jj2 s ARG 362 Ca 0.65 0.31 -0.27 0.00 -0.52 0.00 0.00 55.73 55.91 2jj2 s ARG 362 Cb -0.11 -0.45 -0.10 0.00 0.52 0.00 0.00 34.95 34.82 2jj2 s ARG 362 CO 0.14 -0.28 1.42 -0.35 0.02 0.00 0.00 175.30 176.26 2jj2 n PRO 363 N 4.95 2.36 -0.31 3.54 -0.04 -1.26 -1.06 135.00 143.19 2jj2 n PRO 363 Ca -0.11 0.83 0.00 0.00 -0.04 0.00 0.00 63.50 64.19 2jj2 n PRO 363 Cb 0.50 -2.59 0.00 0.00 -0.04 0.00 0.00 33.50 31.37 2jj2 n PRO 363 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jj2 n ALA 364 N 0.07 3.28 -2.32 0.55 0.00 -1.20 -4.90 120.51 115.99 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 0.40 -1.10 -0.03 0.00 0.00 0.00 0.00 19.45 18.72 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 0.25 3.89 -0.49 0.00 1.01 -1.26 -1.94 121.20 122.66 2jj2 s ILE 365 Ca 0.00 1.28 -0.29 0.00 0.00 0.00 0.00 60.65 61.65 2jj2 s ILE 365 Cb 0.00 -3.82 0.03 0.00 0.01 0.00 0.00 42.46 38.68 2jj2 s ILE 365 CO 0.00 0.02 1.14 0.21 0.00 0.00 0.00 174.94 176.31 2jj2 s ASN 366 N 1.58 6.60 0.28 3.58 3.84 0.13 -4.88 114.94 126.06 2jj2 s ASN 366 Ca 0.61 0.39 0.15 0.00 0.21 0.00 0.00 52.86 54.22 2jj2 s ASN 366 Cb -0.29 -2.55 0.13 0.00 -0.55 0.00 0.00 41.25 37.99 2jj2 s ASN 366 CO 0.26 -1.28 1.47 0.58 -2.79 0.00 0.00 177.10 175.34 2jj2 h VAL 367 N 6.22 0.91 -0.16 -5.21 2.07 -1.92 -1.65 116.25 116.52 2jj2 h VAL 367 Ca -0.23 -2.20 -0.13 0.00 0.82 0.00 0.00 66.70 64.95 2jj2 h VAL 367 Cb 1.06 2.39 -0.01 0.00 -1.52 0.00 0.00 31.29 33.21 2jj2 h VAL 367 CO 1.13 0.50 -0.46 1.23 0.02 0.00 0.00 177.57 179.99 2jj2 h GLY 368 N 3.30 0.43 0.00 2.17 0.00 -1.99 -3.35 103.07 103.62 2jj2 h GLY 368 Ca -0.01 -0.45 -0.36 0.00 0.00 0.00 0.00 47.33 46.52 2jj2 h GLY 368 CO 0.07 0.40 -2.34 1.04 0.00 0.00 0.00 176.54 175.71 2jj2 n LEU 369 N -3.99 0.77 -4.75 3.11 4.77 -1.19 -4.98 117.00 110.74 2jj2 n LEU 369 Ca -0.02 -0.03 -0.37 0.00 -0.03 0.00 0.00 56.01 55.55 2jj2 n LEU 369 Cb 0.53 0.13 0.04 0.00 -2.33 0.00 0.00 43.42 41.79 2jj2 n LEU 369 CO 0.44 0.59 0.91 -0.44 -1.33 0.00 0.00 177.39 177.56 2jj2 s SER 370 N -5.63 5.29 -0.14 -1.43 0.01 -0.63 -4.92 113.70 106.26 2jj2 s SER 370 Ca -0.16 2.58 -0.19 0.00 1.31 0.00 0.00 55.95 59.49 2jj2 s SER 370 Cb 0.06 -2.62 0.05 0.00 0.21 0.00 0.00 66.02 63.72 2jj2 s SER 370 CO 0.73 -1.54 0.50 0.54 0.41 0.00 0.00 173.24 173.87 2jj2 s VAL 371 N -1.43 0.01 -0.16 3.43 0.11 0.02 -4.94 120.40 117.45 2jj2 s VAL 371 Ca 0.74 -0.09 0.02 0.00 -2.93 0.00 0.00 61.98 59.71 2jj2 s VAL 371 Cb -0.36 -0.73 0.01 0.00 -1.53 0.00 0.00 36.38 33.77 2jj2 s VAL 371 CO 0.41 -0.05 -0.20 -0.55 -3.33 0.00 0.00 175.10 171.37 2jj2 s SER 372 N -0.24 3.18 0.32 3.54 0.15 -1.26 -1.00 113.70 118.39 2jj2 s SER 372 Ca -0.04 -0.61 0.24 0.00 0.70 0.00 0.00 55.95 56.24 2jj2 s SER 372 Cb -0.03 -1.47 0.48 0.00 -1.71 0.00 0.00 66.02 63.29 2jj2 s SER 372 CO 0.03 0.05 1.61 0.03 1.20 0.00 0.00 173.24 176.16 2jj2 h ARG 373 N 7.55 0.00 0.57 5.44 3.08 -1.54 -3.22 114.38 126.26 2jj2 h ARG 373 Ca -0.37 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.65 2jj2 h ARG 373 Cb 1.17 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.23 2jj2 h ARG 373 CO 0.59 0.00 -0.28 0.28 -1.07 0.00 0.00 179.97 179.49 2jj2 h VAL 374 N 0.00 0.16 0.00 2.04 2.07 -1.88 -3.48 116.25 115.16 2jj2 h VAL 374 Ca 0.00 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.10 2jj2 h VAL 374 Cb 0.89 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.90 2jj2 h VAL 374 CO 0.00 0.03 0.00 0.61 0.02 0.00 0.00 177.57 178.23 2jj2 n GLY 375 N -0.41 0.95 0.34 2.17 0.00 -1.22 -3.60 105.19 103.43 2jj2 n GLY 375 Ca -0.11 -0.69 0.20 0.00 0.00 0.00 0.00 46.02 45.43 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 4.37 0.60 -0.47 1.61 0.02 -1.92 -0.30 113.55 117.46 2jj2 h SER 376 Ca 0.00 0.16 0.14 0.00 -0.84 0.00 0.00 61.79 61.25 2jj2 h SER 376 Cb 0.00 0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.60 2jj2 h SER 376 CO 0.00 -0.00 0.69 0.00 -1.14 0.00 0.00 176.83 176.38 2jj2 h ALA 377 N 1.78 2.20 -0.39 3.77 0.00 -1.89 0.13 119.26 124.86 2jj2 h ALA 377 Ca 0.68 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.58 2jj2 h ALA 377 Cb 1.42 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.25 2jj2 h ALA 377 CO -0.53 -0.93 0.00 0.00 0.00 0.00 0.00 179.25 177.78 2jj2 n ALA 378 N -2.15 2.45 -2.75 0.00 0.00 -0.12 -4.28 120.51 113.65 2jj2 n ALA 378 Ca 0.09 -1.44 -0.29 0.00 0.00 0.00 0.00 53.44 51.81 2jj2 n ALA 378 Cb 0.87 -0.59 -0.07 0.00 0.00 0.00 0.00 19.45 19.66 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 -1.45 2.75 0.48 0.00 -0.21 0.44 -4.04 119.66 117.64 2jj2 s GLN 379 Ca 0.32 -0.81 -0.13 0.00 0.02 0.00 0.00 55.36 54.75 2jj2 s GLN 379 Cb 0.20 -2.62 -0.07 0.00 1.00 0.00 0.00 33.01 31.52 2jj2 s GLN 379 CO 0.17 0.53 0.90 0.95 -2.12 0.00 0.00 175.29 175.72 2jj2 s THR 380 N -1.49 4.67 0.38 -0.19 -4.23 -1.26 -4.86 115.64 108.66 2jj2 s THR 380 Ca 0.29 0.91 0.10 0.00 -1.18 0.00 0.00 61.69 61.80 2jj2 s THR 380 Cb -0.11 -3.75 0.32 0.00 1.34 0.00 0.00 72.50 70.30 2jj2 s THR 380 CO 0.21 -0.69 1.93 0.03 -0.54 0.00 0.00 174.62 175.56 2jj2 h ARG 381 N 0.86 0.61 0.46 3.99 3.08 -1.97 0.20 114.38 121.61 2jj2 h ARG 381 Ca -0.47 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 59.53 2jj2 h ARG 381 Cb 1.19 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 31.10 2jj2 h ARG 381 CO 0.62 0.40 -0.25 0.00 -1.07 0.00 0.00 179.97 179.68 2jj2 h ALA 382 N 1.62 -0.65 -0.15 0.04 0.00 -0.66 -1.35 119.26 118.10 2jj2 h ALA 382 Ca 0.36 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 2jj2 h ALA 382 Cb 0.54 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 2jj2 h ALA 382 CO -0.13 -0.87 0.04 1.98 0.00 0.00 0.00 179.25 180.27 2jj2 h MET 383 N -0.66 0.24 -0.83 0.00 1.85 -1.73 -3.11 114.93 110.70 2jj2 h MET 383 Ca -0.06 -0.06 0.16 0.00 -0.61 0.00 0.00 59.70 59.14 2jj2 h MET 383 Cb 0.52 -0.03 -0.16 0.00 0.43 0.00 0.00 31.60 32.36 2jj2 h MET 383 CO 0.08 0.38 -0.23 -0.22 -0.40 0.00 0.00 176.91 176.52 2jj2 h LYS 384 N 0.06 -0.01 0.00 0.39 3.64 -0.50 0.44 116.57 120.59 2jj2 h LYS 384 Ca 0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 2jj2 h LYS 384 Cb 0.24 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 2jj2 h LYS 384 CO -0.00 -0.01 0.00 0.94 -2.27 0.00 0.00 179.45 178.11 2jj2 n GLN 385 N -5.53 0.00 0.28 1.90 7.27 -0.52 -2.73 117.38 118.05 2jj2 n GLN 385 Ca 0.12 0.43 0.12 0.00 0.07 0.00 0.00 57.00 57.74 2jj2 n GLN 385 Cb 0.42 -1.21 0.79 0.00 2.41 0.00 0.00 30.24 32.65 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 0.71 -0.10 1.69 -1.51 -1.51 -2.97 116.25 112.56 2jj2 h VAL 386 Ca 0.00 -0.10 -0.18 0.00 -1.23 0.00 0.00 66.70 65.19 2jj2 h VAL 386 Cb 0.00 1.06 -0.00 0.00 -2.13 0.00 0.00 31.29 30.21 2jj2 h VAL 386 CO 0.00 0.02 -0.69 0.00 -1.23 0.00 0.00 177.57 175.67 2jj2 h ALA 387 N 1.97 0.62 -0.73 5.19 0.00 -0.91 -2.65 119.26 122.75 2jj2 h ALA 387 Ca -0.00 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.33 2jj2 h ALA 387 Cb 0.06 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 2jj2 h ALA 387 CO 0.00 0.74 0.47 0.78 0.00 0.00 0.00 179.25 181.25 2jj2 h GLY 388 N 1.21 1.04 1.00 0.00 0.00 -1.34 0.13 103.07 105.12 2jj2 h GLY 388 Ca -0.02 -0.40 -0.12 0.00 0.00 0.00 0.00 47.33 46.78 2jj2 h GLY 388 CO 0.12 0.39 -0.24 -0.84 0.00 0.00 0.00 176.54 175.97 2jj2 h THR 389 N 0.99 1.29 -0.39 4.70 2.02 -1.65 -2.12 112.91 117.75 2jj2 h THR 389 Ca 0.27 -1.39 -0.01 0.00 0.77 0.00 0.00 66.41 66.05 2jj2 h THR 389 Cb -0.09 1.42 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 2jj2 h THR 389 CO -0.06 0.46 0.22 -0.03 0.37 0.00 0.00 175.52 176.48 2jj2 h MET 390 N 0.56 0.55 -0.22 6.66 -1.53 -1.32 -0.64 114.93 118.99 2jj2 h MET 390 Ca 0.07 -0.06 0.04 0.00 -3.44 0.00 0.00 59.70 56.30 2jj2 h MET 390 Cb 0.81 -0.11 -0.04 0.00 -0.55 0.00 0.00 31.60 31.71 2jj2 h MET 390 CO 0.07 0.44 -0.02 -0.22 0.14 0.00 0.00 176.91 177.32 2jj2 h LYS 391 N 0.51 0.05 0.05 0.39 3.64 -0.87 0.13 116.57 120.47 2jj2 h LYS 391 Ca 0.14 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.51 2jj2 h LYS 391 Cb 0.05 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 2jj2 h LYS 391 CO -0.02 0.03 -0.03 1.25 -2.27 0.00 0.00 179.45 178.41 2jj2 h LEU 392 N 0.05 -0.06 -1.05 5.20 5.85 -1.26 -0.81 115.31 123.23 2jj2 h LEU 392 Ca 0.10 -0.05 -0.10 0.00 0.84 0.00 0.00 57.88 58.68 2jj2 h LEU 392 Cb 0.14 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 2jj2 h LEU 392 CO -0.19 0.01 -0.41 -0.33 -0.34 0.00 0.00 178.44 177.18 2jj2 h GLU 393 N -0.12 0.13 -0.36 1.25 5.08 -0.93 0.12 114.58 119.74 2jj2 h GLU 393 Ca -0.01 -0.06 -0.15 0.00 -1.00 0.00 0.00 59.36 58.14 2jj2 h GLU 393 Cb 0.10 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 2jj2 h GLU 393 CO 0.01 0.52 -0.36 -0.07 -1.00 0.00 0.00 179.01 178.12 2jj2 h LEU 394 N 0.11 0.95 -0.46 1.33 3.38 -0.90 -0.51 115.31 119.21 2jj2 h LEU 394 Ca 0.01 -0.47 -0.03 0.00 0.09 0.00 0.00 57.88 57.48 2jj2 h LEU 394 Cb 0.77 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 2jj2 h LEU 394 CO 0.06 1.22 0.17 0.00 0.09 0.00 0.00 178.44 179.97 2jj2 h ALA 395 N 0.76 0.60 -0.67 1.53 0.00 -0.49 0.11 119.26 121.10 2jj2 h ALA 395 Ca 0.06 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2jj2 h ALA 395 Cb 0.95 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 2jj2 h ALA 395 CO 0.09 0.23 0.37 1.96 0.00 0.00 0.00 179.25 181.89 2jj2 h GLN 396 N 0.60 0.92 -0.22 0.00 4.20 -0.80 -2.62 115.11 117.19 2jj2 h GLN 396 Ca 0.15 -0.10 -0.00 0.00 0.06 0.00 0.00 58.65 58.76 2jj2 h GLN 396 Cb 0.22 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.81 2jj2 h GLN 396 CO -0.01 0.67 0.12 -0.92 -0.67 0.00 0.00 178.83 178.03 2jj2 h TYR 397 N 0.93 0.31 -0.54 2.96 3.20 -0.48 -3.16 116.97 120.19 2jj2 h TYR 397 Ca 0.24 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.19 2jj2 h TYR 397 Cb 0.02 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.16 2jj2 h TYR 397 CO 0.01 0.28 0.37 0.00 -1.64 0.00 0.00 178.16 177.17 2jj2 h ARG 398 N 0.25 0.34 -0.33 1.82 3.08 -0.43 0.13 114.38 119.24 2jj2 h ARG 398 Ca 0.08 -0.02 -0.13 0.00 0.07 0.00 0.00 59.98 59.98 2jj2 h ARG 398 Cb 0.07 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 2jj2 h ARG 398 CO -0.01 0.22 -0.31 0.93 -1.07 0.00 0.00 179.97 179.73 2jj2 h GLU 399 N 0.35 0.72 -0.02 0.04 5.08 -1.49 -3.22 114.58 116.05 2jj2 h GLU 399 Ca 0.25 -0.33 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2jj2 h GLU 399 Cb 0.53 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.76 2jj2 h GLU 399 CO -0.06 0.94 -0.38 0.28 -1.00 0.00 0.00 179.01 178.78 2jj2 n VAL 400 N -4.08 0.00 -0.00 3.13 0.31 -0.67 -4.62 118.33 112.41 2jj2 n VAL 400 Ca -0.01 -0.31 0.23 0.00 -0.01 0.00 0.00 64.34 64.24 2jj2 n VAL 400 Cb 0.48 1.30 0.71 0.00 -0.91 0.00 0.00 33.84 35.42 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 3.97 2.38 -0.00 3.52 0.00 -0.78 0.15 119.26 128.49 2jj2 h ALA 401 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2jj2 h ALA 401 Cb 0.79 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2jj2 h ALA 401 CO 0.00 -0.88 -0.40 0.00 0.00 0.00 0.00 179.25 177.97 2jj2 n ALA 402 N -2.41 3.33 1.64 0.00 0.00 -1.26 -3.48 120.51 118.32 2jj2 n ALA 402 Ca 0.12 -0.32 0.15 0.00 0.00 0.00 0.00 53.44 53.39 2jj2 n ALA 402 Cb 0.80 -1.18 0.77 0.00 0.00 0.00 0.00 19.45 19.85 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 -1.43 0.00 0.00 0.00 0.99 0.54 -4.35 117.46 113.22 2jj2 n PHE 403 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.51 2jj2 n PHE 403 Cb 0.33 -0.13 0.00 0.00 -1.00 0.00 0.00 39.48 38.68 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 -0.99 -0.06 0.32 4.37 0.00 -1.23 -2.33 120.51 120.60 2jj2 n ALA 404 Ca 0.18 0.00 0.21 0.00 0.00 0.00 0.00 53.44 53.83 2jj2 n ALA 404 Cb 0.21 0.00 1.11 0.00 0.00 0.00 0.00 19.45 20.77 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 -0.98 0.00 4.20 -1.83 -1.62 115.11 114.89 2jj2 h GLN 405 Ca 0.00 0.00 -0.59 0.00 0.06 0.00 0.00 58.65 58.12 2jj2 h GLN 405 Cb 0.00 0.00 -0.39 0.00 0.30 0.00 0.00 27.48 27.39 2jj2 h GLN 405 CO 0.00 0.01 -0.40 1.19 -0.67 0.00 0.00 178.83 178.96 2jj2 n PHE 406 N -3.20 2.96 -3.63 2.96 3.01 -1.26 -4.96 117.46 113.34 2jj2 n PHE 406 Ca -0.03 -2.52 -0.15 0.00 1.01 0.00 0.00 57.45 55.77 2jj2 n PHE 406 Cb 0.10 -0.55 -0.13 0.00 -0.01 0.00 0.00 39.48 38.89 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 -3.14 -0.08 0.00 1.37 0.00 -0.61 -4.89 107.32 99.97 2jj2 s GLY 407 Ca 0.53 0.77 0.00 0.00 0.00 0.00 0.00 44.72 46.02 2jj2 s GLY 407 CO -0.03 1.97 0.00 1.44 0.00 0.00 0.00 173.10 176.48 2jj2 n SER 408 N 5.34 4.19 -3.28 1.64 7.64 -1.26 -4.83 113.62 123.07 2jj2 n SER 408 Ca -0.06 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 59.44 2jj2 n SER 408 Cb 0.50 0.32 0.02 0.00 -1.01 0.00 0.00 64.21 64.03 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 -1.99 6.90 -4.92 6.43 9.92 -1.26 -5.01 116.55 126.62 2jj2 n ASP 409 Ca 0.00 -3.73 -0.28 0.00 -0.53 0.00 0.00 54.79 50.25 2jj2 n ASP 409 Cb 0.44 -1.02 -0.03 0.00 -0.64 0.00 0.00 41.12 39.87 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 0.54 0.64 1.02 -1.26 -5.09 118.68 114.62 2jj2 s LEU 410 Ca 0.44 0.45 -0.19 0.00 0.02 0.00 0.00 54.13 54.85 2jj2 s LEU 410 Cb 0.28 -3.22 -0.06 0.00 0.02 0.00 0.00 46.19 43.21 2jj2 s LEU 410 CO -0.22 -0.06 1.08 1.51 0.02 0.00 0.00 176.35 178.69 2jj2 s ASP 411 N -3.13 5.92 0.57 2.29 -4.77 -1.26 -4.87 116.67 111.43 2jj2 s ASP 411 Ca 0.39 2.02 0.29 0.00 -3.30 0.00 0.00 52.55 51.95 2jj2 s ASP 411 Cb -0.11 -2.56 1.72 0.00 -1.09 0.00 0.00 42.92 40.88 2jj2 s ASP 411 CO 0.29 -1.07 2.20 0.00 0.70 0.00 0.00 175.17 177.29 2jj2 h ALA 412 N 1.15 1.45 -0.24 2.11 0.00 -1.98 -0.80 119.26 120.95 2jj2 h ALA 412 Ca -0.49 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.37 2jj2 h ALA 412 Cb 1.24 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 2jj2 h ALA 412 CO 0.58 0.05 0.10 0.00 0.00 0.00 0.00 179.25 179.97 2jj2 h ALA 413 N 1.96 0.31 0.00 0.00 0.00 -2.00 -1.08 119.26 118.45 2jj2 h ALA 413 Ca -0.00 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 2jj2 h ALA 413 Cb 0.10 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2jj2 h ALA 413 CO 0.00 -0.10 -0.39 1.79 0.00 0.00 0.00 179.25 180.55 2jj2 h THR 414 N 0.23 0.02 -0.49 0.00 1.35 -1.84 -2.91 112.91 109.27 2jj2 h THR 414 Ca 0.08 -1.03 -0.09 0.00 -0.55 0.00 0.00 66.41 64.82 2jj2 h THR 414 Cb 0.17 1.82 -0.02 0.00 -1.73 0.00 0.00 68.15 68.39 2jj2 h THR 414 CO -0.01 0.01 -0.05 1.56 -0.25 0.00 0.00 175.52 176.78 2jj2 h GLN 415 N 0.00 0.86 -0.17 4.72 4.20 -1.07 -2.71 115.11 120.93 2jj2 h GLN 415 Ca -0.00 -0.27 -0.05 0.00 0.06 0.00 0.00 58.65 58.39 2jj2 h GLN 415 Cb 1.01 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.71 2jj2 h GLN 415 CO 0.00 0.89 -0.09 0.37 -0.67 0.00 0.00 178.83 179.33 2jj2 h GLN 416 N 0.78 0.36 -0.95 1.46 5.75 -1.18 -1.78 115.11 119.56 2jj2 h GLN 416 Ca 0.14 -0.16 0.02 0.00 -0.15 0.00 0.00 58.65 58.49 2jj2 h GLN 416 Cb 0.54 -0.01 -0.05 0.00 1.07 0.00 0.00 27.48 29.04 2jj2 h GLN 416 CO 0.03 0.68 0.63 -0.07 -2.65 0.00 0.00 178.83 177.45 2jj2 h LEU 417 N 0.03 1.07 0.05 -2.39 3.38 -1.53 0.14 115.31 116.06 2jj2 h LEU 417 Ca 0.04 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 2jj2 h LEU 417 Cb 0.58 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2jj2 h LEU 417 CO 0.03 0.77 -0.02 -0.07 0.09 0.00 0.00 178.44 179.23 2jj2 h LEU 418 N 1.26 -0.05 -0.01 1.67 3.38 -1.47 -0.89 115.31 119.19 2jj2 h LEU 418 Ca 0.35 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 58.08 2jj2 h LEU 418 Cb -0.11 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 2jj2 h LEU 418 CO -0.09 0.24 -0.13 0.28 0.09 0.00 0.00 178.44 178.83 2jj2 h SER 419 N -0.35 -0.38 -0.74 -0.43 0.02 -0.95 0.26 113.55 110.99 2jj2 h SER 419 Ca -0.01 0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 60.99 2jj2 h SER 419 Cb 0.31 0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.98 2jj2 h SER 419 CO 0.01 -0.18 0.42 -0.09 -1.14 0.00 0.00 176.83 175.85 2jj2 h ARG 420 N -0.22 1.04 0.04 3.45 9.65 -0.77 -2.84 114.38 124.72 2jj2 h ARG 420 Ca 0.05 -0.11 -0.00 0.00 -1.10 0.00 0.00 59.98 58.82 2jj2 h ARG 420 Cb 0.28 -0.21 0.00 0.00 -1.39 0.00 0.00 29.97 28.65 2jj2 h ARG 420 CO -0.14 0.75 -0.02 0.78 2.80 0.00 0.00 179.97 184.15 2jj2 h GLY 421 N 1.08 -0.05 2.00 2.80 0.00 -0.63 -2.06 103.07 106.21 2jj2 h GLY 421 Ca 0.27 0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.60 2jj2 h GLY 421 CO -0.05 -0.02 -0.10 -0.39 0.00 0.00 0.00 176.54 175.99 2jj2 h VAL 422 N -0.23 0.89 0.22 4.60 -1.51 -0.87 -2.19 116.25 117.16 2jj2 h VAL 422 Ca -0.01 -0.36 -0.33 0.00 -1.23 0.00 0.00 66.70 64.78 2jj2 h VAL 422 Cb 0.21 1.20 0.03 0.00 -2.13 0.00 0.00 31.29 30.60 2jj2 h VAL 422 CO 0.01 0.10 -1.45 0.03 -1.23 0.00 0.00 177.57 175.02 2jj2 h ARG 423 N 0.00 0.47 -0.46 5.19 3.08 -1.35 -2.62 114.38 118.69 2jj2 h ARG 423 Ca -0.00 -0.80 -0.10 0.00 0.07 0.00 0.00 59.98 59.15 2jj2 h ARG 423 Cb 0.19 0.30 -0.02 0.00 0.08 0.00 0.00 29.97 30.53 2jj2 h ARG 423 CO 0.01 1.38 -0.12 -0.07 -1.07 0.00 0.00 179.97 180.11 2jj2 h LEU 424 N 0.13 0.84 -0.84 3.04 3.38 -1.23 -2.56 115.31 118.07 2jj2 h LEU 424 Ca -0.24 -0.26 0.09 0.00 0.09 0.00 0.00 57.88 57.56 2jj2 h LEU 424 Cb 2.12 -0.23 -0.07 0.00 0.09 0.00 0.00 40.66 42.58 2jj2 h LEU 424 CO 0.25 0.97 0.50 0.74 0.09 0.00 0.00 178.44 180.99 2jj2 h THR 425 N 0.76 0.94 -0.25 0.22 2.02 -1.42 -1.32 112.91 113.87 2jj2 h THR 425 Ca 0.12 -0.29 -0.07 0.00 0.77 0.00 0.00 66.41 66.94 2jj2 h THR 425 Cb 0.62 0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 2jj2 h THR 425 CO 0.04 0.15 -0.17 -0.33 0.37 0.00 0.00 175.52 175.59 2jj2 h GLU 426 N 0.85 0.42 0.00 6.66 4.39 -1.22 -2.82 114.58 122.86 2jj2 h GLU 426 Ca 0.40 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.97 2jj2 h GLU 426 Cb 0.32 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 2jj2 h GLU 426 CO -0.23 0.58 0.00 -0.07 -1.16 0.00 0.00 179.01 178.13 2jj2 h LEU 427 N 0.39 0.00 0.00 1.33 3.38 -0.86 -2.88 115.31 116.67 2jj2 h LEU 427 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2jj2 h LEU 427 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 2jj2 h LEU 427 CO 0.03 0.00 -0.44 -0.07 0.09 0.00 0.00 178.44 178.05 2jj2 h LEU 428 N 0.00 0.00 -9.98 1.67 3.38 -1.13 -3.46 115.31 105.80 2jj2 h LEU 428 Ca 0.00 -0.01 -0.55 0.00 0.09 0.00 0.00 57.88 57.41 2jj2 h LEU 428 Cb 0.66 0.00 0.13 0.00 0.09 0.00 0.00 40.66 41.54 2jj2 h LEU 428 CO 0.00 0.00 0.64 0.29 0.09 0.00 0.00 178.44 179.46 2jj2 n LYS 429 N -2.87 2.04 -3.65 1.13 5.02 -1.09 -4.35 118.16 114.39 2jj2 n LYS 429 Ca 0.02 0.73 -0.14 0.00 -2.02 0.00 0.00 58.31 56.90 2jj2 n LYS 429 Cb 0.53 -2.58 -0.08 0.00 -0.02 0.00 0.00 35.03 32.89 2jj2 n LYS 429 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 2jj2 s GLN 430 N -2.54 0.76 0.80 1.97 0.74 -0.23 -4.92 119.66 116.24 2jj2 s GLN 430 Ca 0.64 0.60 -0.11 0.00 0.05 0.00 0.00 55.36 56.54 2jj2 s GLN 430 Cb -0.45 0.36 0.07 0.00 1.10 0.00 0.00 33.01 34.10 2jj2 s GLN 430 CO 0.55 -0.14 1.09 0.20 -0.55 0.00 0.00 175.29 176.44 2jj2 s GLY 431 N -0.15 1.63 0.39 2.59 0.00 -1.26 -4.04 107.32 106.48 2jj2 s GLY 431 Ca -0.04 -0.10 -0.14 0.00 0.00 0.00 0.00 44.72 44.45 2jj2 s GLY 431 CO 0.03 0.32 0.80 1.62 0.00 0.00 0.00 173.10 175.87 2jj2 s GLN 432 N -5.08 3.91 -0.13 2.90 0.74 -1.26 -4.24 119.66 116.51 2jj2 s GLN 432 Ca 0.61 0.65 0.00 0.00 0.05 0.00 0.00 55.36 56.67 2jj2 s GLN 432 Cb -0.15 -2.35 0.00 0.00 1.10 0.00 0.00 33.01 31.60 2jj2 s GLN 432 CO 0.55 -0.00 0.00 0.66 -0.55 0.00 0.00 175.29 175.95 2jj2 n TYR 433 N -0.97 0.00 -3.45 1.67 4.02 -1.26 -4.91 117.16 112.26 2jj2 n TYR 433 Ca 0.04 0.00 -0.26 0.00 -0.01 0.00 0.00 57.90 57.66 2jj2 n TYR 433 Cb 0.54 -1.37 -0.09 0.00 -0.02 0.00 0.00 39.34 38.39 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 -0.59 1.31 -4.77 7.72 3.41 -1.26 -5.08 113.62 114.36 2jj2 n SER 434 Ca -0.01 -2.86 -0.35 0.00 -0.26 0.00 0.00 58.87 55.39 2jj2 n SER 434 Cb 0.33 -0.64 0.01 0.00 -0.26 0.00 0.00 64.21 63.64 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 -1.13 3.31 0.14 4.33 0.04 -1.26 -4.83 135.00 135.59 2jj2 s PRO 435 Ca 0.33 1.60 0.05 0.00 0.04 0.00 0.00 61.00 63.03 2jj2 s PRO 435 Cb 0.08 -2.00 -0.04 0.00 0.04 0.00 0.00 34.50 32.58 2jj2 s PRO 435 CO -0.13 -0.89 0.08 -1.64 0.04 0.00 0.00 177.00 174.46 2jj2 s MET 436 N -3.34 2.74 0.50 4.56 -1.94 0.11 -4.97 119.30 116.96 2jj2 s MET 436 Ca 0.73 -0.88 -0.20 0.00 -1.71 0.00 0.00 55.69 53.62 2jj2 s MET 436 Cb -0.24 -2.59 -0.07 0.00 2.01 0.00 0.00 34.83 33.94 2jj2 s MET 436 CO 0.28 0.50 1.09 0.00 -0.01 0.00 0.00 175.02 176.88 2jj2 s ALA 437 N -1.61 2.81 0.35 3.03 0.00 -1.26 -4.19 121.76 120.89 2jj2 s ALA 437 Ca 0.29 0.74 0.06 0.00 0.00 0.00 0.00 51.96 53.05 2jj2 s ALA 437 Cb -0.11 -3.32 0.72 0.00 0.00 0.00 0.00 23.12 20.42 2jj2 s ALA 437 CO 0.21 -0.54 1.91 0.97 0.00 0.00 0.00 175.76 178.31 2jj2 h ILE 438 N 1.47 0.96 -0.00 0.00 6.09 -1.99 -0.97 117.51 123.07 2jj2 h ILE 438 Ca -0.50 -0.27 -0.13 0.00 -1.37 0.00 0.00 64.86 62.59 2jj2 h ILE 438 Cb 1.24 0.10 -0.02 0.00 0.47 0.00 0.00 36.82 38.61 2jj2 h ILE 438 CO 0.58 0.14 -0.64 1.05 -3.07 0.00 0.00 178.15 176.22 2jj2 h GLU 439 N 0.79 0.00 -0.33 2.19 9.09 -1.92 -0.93 114.58 123.48 2jj2 h GLU 439 Ca 0.38 -0.00 -0.11 0.00 0.05 0.00 0.00 59.36 59.68 2jj2 h GLU 439 Cb 0.43 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.52 2jj2 h GLU 439 CO -0.15 0.64 -0.26 0.93 0.05 0.00 0.00 179.01 180.22 2jj2 h GLU 440 N 0.00 0.66 -0.09 1.06 5.08 -1.60 -2.49 114.58 117.21 2jj2 h GLU 440 Ca -0.01 -0.27 -0.02 0.00 -1.00 0.00 0.00 59.36 58.07 2jj2 h GLU 440 Cb 1.13 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.35 2jj2 h GLU 440 CO 0.08 0.85 -0.01 1.96 -1.00 0.00 0.00 179.01 180.89 2jj2 h GLN 441 N 0.57 0.16 -0.45 2.33 4.20 -0.69 -2.57 115.11 118.67 2jj2 h GLN 441 Ca 0.08 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.69 2jj2 h GLN 441 Cb 0.74 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.48 2jj2 h GLN 441 CO 0.06 0.46 0.10 -0.39 -0.67 0.00 0.00 178.83 178.40 2jj2 h VAL 442 N -0.16 1.20 -0.58 -0.54 -1.51 -1.22 -0.70 116.25 112.74 2jj2 h VAL 442 Ca 0.02 -0.71 -0.03 0.00 -1.23 0.00 0.00 66.70 64.75 2jj2 h VAL 442 Cb 0.40 0.75 -0.03 0.00 -2.13 0.00 0.00 31.29 30.28 2jj2 h VAL 442 CO 0.01 0.26 0.25 0.00 -1.23 0.00 0.00 177.57 176.86 2jj2 h ALA 443 N 1.47 0.75 -0.04 5.19 0.00 -1.41 0.22 119.26 125.45 2jj2 h ALA 443 Ca 0.15 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2jj2 h ALA 443 Cb 0.25 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2jj2 h ALA 443 CO -0.00 0.34 -0.01 0.28 0.00 0.00 0.00 179.25 179.86 2jj2 h VAL 444 N 0.80 1.30 -0.72 0.00 2.07 -1.07 -2.99 116.25 115.65 2jj2 h VAL 444 Ca 0.20 -0.91 -0.03 0.00 0.82 0.00 0.00 66.70 66.77 2jj2 h VAL 444 Cb 0.17 1.84 -0.03 0.00 -1.52 0.00 0.00 31.29 31.74 2jj2 h VAL 444 CO -0.02 0.24 0.31 0.40 0.02 0.00 0.00 177.57 178.52 2jj2 h ILE 445 N -0.29 1.24 -0.63 4.57 2.04 -1.05 -2.29 117.51 121.10 2jj2 h ILE 445 Ca 0.01 -0.71 0.13 0.00 1.00 0.00 0.00 64.86 65.28 2jj2 h ILE 445 Cb 0.40 0.36 -0.12 0.00 -0.74 0.00 0.00 36.82 36.72 2jj2 h ILE 445 CO 0.00 0.29 -0.12 0.22 0.00 0.00 0.00 178.15 178.55 2jj2 h TYR 446 N 1.03 -0.26 -0.99 1.37 3.20 -0.52 0.97 116.97 121.76 2jj2 h TYR 446 Ca 0.24 0.05 0.12 0.00 3.14 0.00 0.00 58.73 62.29 2jj2 h TYR 446 Cb 0.16 0.21 -0.08 0.00 1.54 0.00 0.00 36.73 38.56 2jj2 h TYR 446 CO 0.01 -0.25 0.63 0.00 -1.64 0.00 0.00 178.16 176.91 2jj2 h ALA 447 N 1.62 1.55 0.01 1.82 0.00 -1.26 -1.36 119.26 121.63 2jj2 h ALA 447 Ca 0.31 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.24 2jj2 h ALA 447 Cb 0.48 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2jj2 h ALA 447 CO -0.62 0.21 -0.00 0.78 0.00 0.00 0.00 179.25 179.62 2jj2 h GLY 448 N 0.97 -0.01 2.00 0.00 0.00 -1.13 -1.76 103.07 103.15 2jj2 h GLY 448 Ca 0.49 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.82 2jj2 h GLY 448 CO -0.26 -0.00 -0.00 -0.39 0.00 0.00 0.00 176.54 175.89 2jj2 h VAL 449 N -0.94 0.01 -0.01 4.60 -1.51 -0.75 -2.06 116.25 115.59 2jj2 h VAL 449 Ca -0.00 -0.41 0.00 0.00 -1.23 0.00 0.00 66.70 65.06 2jj2 h VAL 449 Cb 0.86 1.41 0.00 0.00 -2.13 0.00 0.00 31.29 31.43 2jj2 h VAL 449 CO 0.00 0.00 -0.27 0.54 -1.23 0.00 0.00 177.57 176.62 2jj2 n ARG 450 N -3.09 1.19 -0.58 5.19 5.12 -0.52 -4.96 116.66 119.00 2jj2 n ARG 450 Ca -0.00 -0.83 0.00 0.00 -1.93 0.00 0.00 57.85 55.09 2jj2 n ARG 450 Cb 0.26 -1.48 0.00 0.00 -1.16 0.00 0.00 32.46 30.07 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 1.34 0.70 0.27 -0.13 0.00 -0.77 -4.95 105.19 101.65 2jj2 n GLY 451 Ca 0.12 -0.11 0.18 0.00 0.00 0.00 0.00 46.02 46.21 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 -0.40 1.61 -1.99 -1.53 -2.95 116.97 111.71 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 -3.02 3.14 0.15 3.88 4.77 -1.23 -4.63 117.00 120.06 2jj2 n LEU 453 Ca 0.00 -1.75 0.05 0.00 -0.03 0.00 0.00 56.01 54.29 2jj2 n LEU 453 Cb 0.27 -0.26 0.50 0.00 -2.33 0.00 0.00 43.42 41.60 2jj2 n LEU 453 CO 0.26 0.74 1.04 0.44 -1.33 0.00 0.00 177.39 178.53 2jj2 h ASP 454 N 3.10 0.19 0.25 -1.43 5.19 -1.86 -2.42 116.42 119.44 2jj2 h ASP 454 Ca 0.00 -0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.39 2jj2 h ASP 454 Cb 0.81 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.27 2jj2 h ASP 454 CO 0.00 0.21 -1.07 0.29 -3.12 0.00 0.00 179.24 175.56 2jj2 n LYS 455 N -4.44 0.20 -2.15 3.56 5.02 -1.26 -4.91 118.16 114.18 2jj2 n LYS 455 Ca -0.01 -0.02 -0.41 0.00 -2.02 0.00 0.00 58.31 55.85 2jj2 n LYS 455 Cb 0.14 -1.54 -0.03 0.00 -0.02 0.00 0.00 35.03 33.58 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 -3.58 4.43 0.32 -0.35 2.96 -0.91 -4.98 118.68 116.56 2jj2 s LEU 456 Ca 0.05 2.57 -0.29 0.00 -0.22 0.00 0.00 54.13 56.24 2jj2 s LEU 456 Cb 0.15 -3.63 -0.10 0.00 0.50 0.00 0.00 46.19 43.11 2jj2 s LEU 456 CO 0.82 -0.53 1.33 -0.70 -1.32 0.00 0.00 176.35 175.95 2jj2 s GLU 457 N -1.01 4.34 0.27 1.98 2.12 -1.26 -4.92 118.70 120.22 2jj2 s GLU 457 Ca 0.53 2.23 0.01 0.00 0.36 0.00 0.00 54.97 58.10 2jj2 s GLU 457 Cb -0.39 -3.08 0.59 0.00 0.26 0.00 0.00 34.13 31.52 2jj2 s GLU 457 CO 0.46 -0.23 1.76 -1.35 -0.54 0.00 0.00 175.26 175.37 2jj2 h PRO 458 N 3.62 0.63 0.00 4.30 0.11 -1.93 -1.52 132.00 137.21 2jj2 h PRO 458 Ca -0.49 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.58 2jj2 h PRO 458 Cb 1.23 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 2jj2 h PRO 458 CO 0.67 0.42 -0.03 0.66 -0.21 0.00 0.00 178.00 179.51 2jj2 h SER 459 N 0.65 0.00 0.10 -2.05 4.64 -2.00 -2.81 113.55 112.08 2jj2 h SER 459 Ca 0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.81 2jj2 h SER 459 Cb 0.73 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.82 2jj2 h SER 459 CO -0.37 0.03 -0.25 0.29 -0.87 0.00 0.00 176.83 175.66 2jj2 n LYS 460 N -3.29 1.22 -0.16 4.77 5.02 -0.57 -4.43 118.16 120.72 2jj2 n LYS 460 Ca -0.02 -0.84 -0.11 0.00 -2.02 0.00 0.00 58.31 55.33 2jj2 n LYS 460 Cb 0.17 -1.48 -0.01 0.00 -0.02 0.00 0.00 35.03 33.69 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 2.05 1.27 -0.52 -0.18 1.08 -1.56 -0.68 117.51 118.97 2jj2 h ILE 461 Ca 0.00 -1.15 -0.06 0.00 -0.39 0.00 0.00 64.86 63.26 2jj2 h ILE 461 Cb 0.62 1.10 -0.02 0.00 -3.07 0.00 0.00 36.82 35.44 2jj2 h ILE 461 CO 0.00 0.39 0.10 0.71 -0.69 0.00 0.00 178.15 178.67 2jj2 h THR 462 N 0.68 1.25 -0.62 -0.27 1.35 -1.81 0.70 112.91 114.19 2jj2 h THR 462 Ca 0.12 -0.91 -0.00 0.00 -0.55 0.00 0.00 66.41 65.07 2jj2 h THR 462 Cb 0.58 0.83 -0.03 0.00 -1.73 0.00 0.00 68.15 67.80 2jj2 h THR 462 CO 0.04 0.33 0.37 0.50 -0.25 0.00 0.00 175.52 176.50 2jj2 h LYS 463 N 0.74 0.84 -0.10 4.72 3.64 -1.81 -2.44 116.57 122.16 2jj2 h LYS 463 Ca 0.16 -0.08 0.01 0.00 -1.27 0.00 0.00 60.65 59.47 2jj2 h LYS 463 Cb 0.37 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 2jj2 h LYS 463 CO 0.01 0.60 0.04 0.35 -2.27 0.00 0.00 179.45 178.18 2jj2 h PHE 464 N 0.83 0.08 0.46 1.91 3.57 -0.55 -2.30 116.94 120.95 2jj2 h PHE 464 Ca 0.22 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.70 2jj2 h PHE 464 Cb -0.02 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.71 2jj2 h PHE 464 CO -0.02 0.04 -0.22 1.49 -2.23 0.00 0.00 178.31 177.37 2jj2 h GLU 465 N 0.10 -0.60 -0.48 1.11 4.81 -0.78 0.32 114.58 119.06 2jj2 h GLU 465 Ca 0.04 0.04 0.09 0.00 -0.13 0.00 0.00 59.36 59.40 2jj2 h GLU 465 Cb 0.01 0.14 -0.10 0.00 0.63 0.00 0.00 28.75 29.43 2jj2 h GLU 465 CO -0.04 -0.40 -0.34 -0.97 -0.73 0.00 0.00 179.01 176.54 2jj2 h ASN 466 N -0.64 -1.14 -0.14 1.04 -1.24 -1.43 0.37 115.58 112.41 2jj2 h ASN 466 Ca -0.06 0.21 -0.00 0.00 0.71 0.00 0.00 56.30 57.15 2jj2 h ASN 466 Cb 0.48 0.54 -0.01 0.00 0.73 0.00 0.00 38.32 40.07 2jj2 h ASN 466 CO 0.10 -0.32 0.07 0.00 -1.29 0.00 0.00 177.43 176.00 2jj2 h ALA 467 N 0.83 0.19 -0.89 1.57 0.00 -1.25 -0.37 119.26 119.33 2jj2 h ALA 467 Ca 0.19 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.04 2jj2 h ALA 467 Cb 0.55 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 2jj2 h ALA 467 CO -0.60 -0.26 0.59 0.35 0.00 0.00 0.00 179.25 179.34 2jj2 h PHE 468 N 0.11 1.13 -0.20 0.00 3.57 0.43 -1.27 116.94 120.71 2jj2 h PHE 468 Ca 0.05 0.02 -0.16 0.00 3.53 0.00 0.00 57.97 61.42 2jj2 h PHE 468 Cb 0.11 -0.38 0.00 0.00 2.79 0.00 0.00 35.95 38.47 2jj2 h PHE 468 CO -0.03 0.71 -0.50 1.25 -2.23 0.00 0.00 178.31 177.51 2jj2 h LEU 469 N 1.21 0.79 -1.37 0.59 5.85 -0.17 -1.48 115.31 120.73 2jj2 h LEU 469 Ca 0.33 -0.57 0.11 0.00 0.84 0.00 0.00 57.88 58.59 2jj2 h LEU 469 Cb -0.14 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 40.61 2jj2 h LEU 469 CO -0.07 1.21 0.52 0.28 -0.34 0.00 0.00 178.44 180.05 2jj2 h SER 470 N 0.40 0.62 0.43 1.25 0.02 -0.75 -0.74 113.55 114.78 2jj2 h SER 470 Ca -0.01 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.95 2jj2 h SER 470 Cb 1.11 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.55 2jj2 h SER 470 CO 0.11 0.36 -0.21 -0.74 -1.14 0.00 0.00 176.83 175.21 2jj2 h HIS 471 N 0.68 -0.54 -0.53 3.45 -0.00 -0.98 -1.72 115.15 115.52 2jj2 h HIS 471 Ca 0.38 -0.01 0.04 0.00 -0.00 0.00 0.00 60.37 60.78 2jj2 h HIS 471 Cb 0.54 0.18 -0.03 0.00 -0.00 0.00 0.00 27.41 28.10 2jj2 h HIS 471 CO -0.00 -0.24 0.35 -0.39 -0.00 0.00 0.00 177.93 177.65 2jj2 h VAL 472 N -1.06 1.02 -0.31 5.26 -1.51 -1.04 0.10 116.25 118.72 2jj2 h VAL 472 Ca -0.06 -0.19 -0.07 0.00 -1.23 0.00 0.00 66.70 65.15 2jj2 h VAL 472 Cb 0.54 0.43 -0.01 0.00 -2.13 0.00 0.00 31.29 30.12 2jj2 h VAL 472 CO 0.10 0.10 -0.09 0.40 -1.23 0.00 0.00 177.57 176.85 2jj2 h ILE 473 N 0.55 1.28 0.11 7.19 2.04 -1.19 -0.39 117.51 127.11 2jj2 h ILE 473 Ca 0.22 -1.15 -0.01 0.00 1.00 0.00 0.00 64.86 64.93 2jj2 h ILE 473 Cb 0.19 1.39 0.00 0.00 -0.74 0.00 0.00 36.82 37.66 2jj2 h ILE 473 CO -0.06 0.37 -0.05 -1.28 0.00 0.00 0.00 178.15 177.13 2jj2 h SER 474 N 0.38 -0.13 -0.00 1.72 0.87 -0.28 -3.38 113.55 112.73 2jj2 h SER 474 Ca 0.08 -0.32 0.00 0.00 -1.23 0.00 0.00 61.79 60.32 2jj2 h SER 474 Cb 0.59 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.58 2jj2 h SER 474 CO 0.03 0.27 -0.51 0.00 -0.53 0.00 0.00 176.83 176.10 2jj2 n GLN 475 N -4.98 2.43 -2.50 2.24 6.02 0.23 -4.63 117.38 116.20 2jj2 n GLN 475 Ca -0.09 -0.24 -0.11 0.00 -0.01 0.00 0.00 57.00 56.55 2jj2 n GLN 475 Cb 0.23 -1.14 0.03 0.00 1.02 0.00 0.00 30.24 30.38 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 -0.94 1.94 -0.27 1.08 8.25 -0.16 -4.85 115.22 120.28 2jj2 n HIS 476 Ca 0.03 -2.28 0.08 0.00 -0.26 0.00 0.00 57.72 55.29 2jj2 n HIS 476 Cb 0.23 -0.27 0.32 0.00 1.12 0.00 0.00 29.99 31.38 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 2.48 0.81 -0.24 -0.41 5.75 -1.73 -0.42 115.11 121.36 2jj2 h GLN 477 Ca 0.08 -0.05 -0.10 0.00 -0.15 0.00 0.00 58.65 58.44 2jj2 h GLN 477 Cb 1.34 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 29.70 2jj2 h GLN 477 CO 0.46 0.54 -0.27 0.00 -2.65 0.00 0.00 178.83 176.91 2jj2 h ALA 478 N 1.57 1.10 -0.45 3.38 0.00 -1.91 0.95 119.26 123.90 2jj2 h ALA 478 Ca 0.40 -0.35 -0.14 0.00 0.00 0.00 0.00 54.91 54.82 2jj2 h ALA 478 Cb 0.44 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2jj2 h ALA 478 CO -0.17 0.56 -0.26 1.25 0.00 0.00 0.00 179.25 180.63 2jj2 h LEU 479 N 0.41 1.01 -0.64 0.00 6.46 -1.51 0.24 115.31 121.27 2jj2 h LEU 479 Ca 0.06 -0.42 -0.14 0.00 -0.12 0.00 0.00 57.88 57.26 2jj2 h LEU 479 Cb 0.68 -0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 40.33 2jj2 h LEU 479 CO 0.05 1.20 -0.53 -0.07 -0.62 0.00 0.00 178.44 178.48 2jj2 h LEU 480 N 0.81 0.45 -1.04 2.25 3.38 -0.93 -2.08 115.31 118.14 2jj2 h LEU 480 Ca 0.09 -0.23 -0.04 0.00 0.09 0.00 0.00 57.88 57.79 2jj2 h LEU 480 Cb 0.85 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.44 2jj2 h LEU 480 CO 0.07 0.89 0.20 -1.28 0.09 0.00 0.00 178.44 178.42 2jj2 h SER 481 N 0.32 0.82 0.12 -0.43 0.87 0.12 -3.00 113.55 112.37 2jj2 h SER 481 Ca 0.01 -0.12 -0.01 0.00 -1.23 0.00 0.00 61.79 60.44 2jj2 h SER 481 Cb 1.03 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 62.78 2jj2 h SER 481 CO 0.09 0.76 -0.06 0.11 -0.53 0.00 0.00 176.83 177.20 2jj2 h LYS 482 N 0.87 -0.16 -0.72 2.24 1.57 -0.34 -1.47 116.57 118.56 2jj2 h LYS 482 Ca 0.20 0.01 0.18 0.00 -1.87 0.00 0.00 60.65 59.17 2jj2 h LYS 482 Cb 0.23 0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.53 2jj2 h LYS 482 CO -0.01 0.27 0.50 0.82 -0.57 0.00 0.00 179.45 180.45 2jj2 h ILE 483 N -0.65 0.71 0.29 1.86 2.04 -1.40 0.60 117.51 120.97 2jj2 h ILE 483 Ca -0.02 -0.06 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 2jj2 h ILE 483 Cb 0.50 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 37.10 2jj2 h ILE 483 CO 0.03 0.03 -0.14 -0.09 0.00 0.00 0.00 178.15 177.98 2jj2 h ARG 484 N 0.18 -0.38 -0.44 2.37 2.43 -1.51 -2.99 114.38 114.04 2jj2 h ARG 484 Ca 0.35 0.03 0.07 0.00 -0.81 0.00 0.00 59.98 59.62 2jj2 h ARG 484 Cb 1.11 0.09 -0.06 0.00 -0.42 0.00 0.00 29.97 30.69 2jj2 h ARG 484 CO -0.06 -0.14 0.07 1.15 -1.51 0.00 0.00 179.97 179.48 2jj2 h THR 485 N -1.05 0.74 0.00 0.20 2.02 -0.11 -2.25 112.91 112.47 2jj2 h THR 485 Ca -0.04 -0.07 -0.02 0.00 0.77 0.00 0.00 66.41 67.05 2jj2 h THR 485 Cb 0.42 0.53 -0.00 0.00 -1.74 0.00 0.00 68.15 67.35 2jj2 h THR 485 CO 0.07 0.04 -0.10 0.44 0.37 0.00 0.00 175.52 176.34 2jj2 h ASP 486 N 0.19 0.00 0.00 4.18 3.32 -0.00 -3.46 116.42 120.65 2jj2 h ASP 486 Ca 0.22 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.27 2jj2 h ASP 486 Cb 0.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.83 2jj2 h ASP 486 CO -0.30 0.10 0.00 0.61 -1.72 0.00 0.00 179.24 177.93 2jj2 n GLY 487 N -0.11 2.86 0.00 2.75 0.00 -0.85 -4.93 105.19 104.92 2jj2 n GLY 487 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.00 0.00 -3.43 1.61 2.85 -1.22 0.12 118.16 116.09 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 -0.08 0.00 -0.65 0.00 0.00 35.03 34.30 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 -2.11 4.99 1.04 0.58 1.01 -1.26 -4.43 121.20 121.02 2jj2 s ILE 489 Ca 0.00 -1.17 -0.15 0.00 0.00 0.00 0.00 60.65 59.33 2jj2 s ILE 489 Cb 0.00 -4.01 0.21 0.00 0.01 0.00 0.00 42.46 38.67 2jj2 s ILE 489 CO 0.00 -0.58 1.14 -0.94 0.00 0.00 0.00 174.94 174.56 2jj2 s SER 490 N 2.55 2.33 0.39 3.58 1.04 -1.26 -4.74 113.70 117.59 2jj2 s SER 490 Ca 0.04 0.83 0.06 0.00 0.48 0.00 0.00 55.95 57.35 2jj2 s SER 490 Cb -0.24 -1.25 0.80 0.00 0.10 0.00 0.00 66.02 65.42 2jj2 s SER 490 CO 0.05 -3.27 2.04 -0.33 0.98 0.00 0.00 173.24 172.71 2jj2 h GLU 491 N -1.99 0.60 -0.21 4.02 5.08 -1.98 0.63 114.58 120.73 2jj2 h GLU 491 Ca -0.49 -0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 57.74 2jj2 h GLU 491 Cb 1.31 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 30.42 2jj2 h GLU 491 CO 0.49 0.41 -0.21 1.49 -1.00 0.00 0.00 179.01 180.19 2jj2 h GLU 492 N 0.62 0.50 -0.46 2.33 4.81 -1.99 -1.36 114.58 119.02 2jj2 h GLU 492 Ca 0.16 -0.27 -0.09 0.00 -0.13 0.00 0.00 59.36 59.04 2jj2 h GLU 492 Cb -0.05 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 2jj2 h GLU 492 CO -0.03 0.85 -0.07 0.77 -0.73 0.00 0.00 179.01 179.79 2jj2 h SER 493 N 0.18 0.80 -0.05 1.04 0.02 -1.84 -2.13 113.55 111.57 2jj2 h SER 493 Ca 0.03 -0.23 0.00 0.00 -0.84 0.00 0.00 61.79 60.76 2jj2 h SER 493 Cb 0.76 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 63.08 2jj2 h SER 493 CO 0.05 0.91 0.02 -0.78 -1.14 0.00 0.00 176.83 175.89 2jj2 h ASP 494 N 0.75 0.03 -0.41 3.07 -0.00 -0.82 -1.36 116.42 117.68 2jj2 h ASP 494 Ca 0.13 0.00 0.06 0.00 -0.00 0.00 0.00 57.03 57.22 2jj2 h ASP 494 Cb 0.55 -0.00 -0.05 0.00 -0.00 0.00 0.00 39.33 39.83 2jj2 h ASP 494 CO 0.03 0.03 0.12 0.00 -0.00 0.00 0.00 179.24 179.42 2jj2 h ALA 495 N 1.03 0.46 -0.13 -0.78 0.00 -1.17 -1.03 119.26 117.65 2jj2 h ALA 495 Ca 0.02 0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.03 2jj2 h ALA 495 Cb 0.01 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 2jj2 h ALA 495 CO -0.02 -0.28 -0.13 -0.22 0.00 0.00 0.00 179.25 178.60 2jj2 h LYS 496 N 0.26 -0.16 -0.45 0.00 1.63 -1.13 -2.71 116.57 114.02 2jj2 h LYS 496 Ca 0.19 0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.98 2jj2 h LYS 496 Cb 0.20 0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 31.85 2jj2 h LYS 496 CO -0.22 -0.10 0.21 -0.07 -3.45 0.00 0.00 179.45 175.81 2jj2 h LEU 497 N -0.16 0.60 -0.63 5.20 3.38 -0.97 -0.95 115.31 121.78 2jj2 h LEU 497 Ca 0.09 -0.14 0.13 0.00 0.09 0.00 0.00 57.88 58.05 2jj2 h LEU 497 Cb 0.29 -0.16 -0.11 0.00 0.09 0.00 0.00 40.66 40.78 2jj2 h LEU 497 CO -0.23 0.58 -0.04 0.50 0.09 0.00 0.00 178.44 179.35 2jj2 h LYS 498 N 0.59 0.08 0.02 1.13 3.64 -0.97 0.22 116.57 121.28 2jj2 h LYS 498 Ca 0.15 -0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 59.32 2jj2 h LYS 498 Cb 0.14 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.92 2jj2 h LYS 498 CO -0.02 0.05 -0.98 0.93 -2.27 0.00 0.00 179.45 177.16 2jj2 h GLU 499 N 0.09 0.05 -0.03 1.90 4.39 -1.17 -2.22 114.58 117.60 2jj2 h GLU 499 Ca 0.32 -0.08 -0.00 0.00 0.34 0.00 0.00 59.36 59.94 2jj2 h GLU 499 Cb 0.52 0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.20 2jj2 h GLU 499 CO -0.57 0.99 0.00 0.82 -1.16 0.00 0.00 179.01 179.10 2jj2 h ILE 500 N 0.02 1.22 -0.01 3.13 2.04 -0.53 -3.07 117.51 120.31 2jj2 h ILE 500 Ca -0.03 -0.67 -0.00 0.00 1.00 0.00 0.00 64.86 65.16 2jj2 h ILE 500 Cb 1.71 1.62 -0.00 0.00 -0.74 0.00 0.00 36.82 39.41 2jj2 h ILE 500 CO 0.14 0.18 0.00 0.58 0.00 0.00 0.00 178.15 179.05 2jj2 h VAL 501 N -0.21 1.21 0.29 1.67 2.07 -0.62 -1.18 116.25 119.47 2jj2 h VAL 501 Ca 0.01 -0.62 -0.01 0.00 0.82 0.00 0.00 66.70 66.90 2jj2 h VAL 501 Cb 0.29 1.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.67 2jj2 h VAL 501 CO 0.00 0.16 -0.21 0.71 0.02 0.00 0.00 177.57 178.25 2jj2 h THR 502 N -0.25 0.55 -0.77 2.57 1.35 -1.51 0.32 112.91 115.17 2jj2 h THR 502 Ca 0.00 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 65.83 2jj2 h THR 502 Cb 0.26 0.55 -0.03 0.00 -1.73 0.00 0.00 68.15 67.20 2jj2 h THR 502 CO 0.00 0.00 0.34 0.78 -0.25 0.00 0.00 175.52 176.39 2jj2 h ASN 503 N -0.50 1.03 -0.03 5.36 2.35 -1.60 -0.72 115.58 121.46 2jj2 h ASN 503 Ca -0.02 -0.15 0.00 0.00 -0.55 0.00 0.00 56.30 55.58 2jj2 h ASN 503 Cb 0.44 -0.27 -0.00 0.00 0.05 0.00 0.00 38.32 38.54 2jj2 h ASN 503 CO 0.00 0.89 0.02 0.15 -1.65 0.00 0.00 177.43 176.85 2jj2 h PHE 504 N 1.09 0.04 -0.63 1.19 3.57 -0.90 -1.49 116.94 119.82 2jj2 h PHE 504 Ca 0.26 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.76 2jj2 h PHE 504 Cb 0.16 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 38.86 2jj2 h PHE 504 CO 0.01 0.04 0.40 1.25 -2.23 0.00 0.00 178.31 177.78 2jj2 h LEU 505 N 0.03 0.73 -0.36 0.59 5.85 -0.07 0.20 115.31 122.28 2jj2 h LEU 505 Ca 0.01 -0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.76 2jj2 h LEU 505 Cb 0.01 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 40.80 2jj2 h LEU 505 CO -0.00 0.55 -0.00 0.00 -0.34 0.00 0.00 178.44 178.64 2jj2 h ALA 506 N 1.21 0.32 -0.87 1.25 0.00 -1.04 -1.22 119.26 118.92 2jj2 h ALA 506 Ca 0.23 0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.25 2jj2 h ALA 506 Cb -0.07 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 2jj2 h ALA 506 CO -0.05 -0.40 0.56 0.78 0.00 0.00 0.00 179.25 180.15 2jj2 h GLY 507 N 0.09 1.23 0.96 0.00 0.00 -0.46 -2.92 103.07 101.97 2jj2 h GLY 507 Ca 0.17 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 47.02 2jj2 h GLY 507 CO -0.29 0.46 0.21 -2.75 0.00 0.00 0.00 176.54 174.17 2jj2 h PHE 508 N 1.18 0.60 -0.32 5.60 3.57 0.23 -2.86 116.94 124.94 2jj2 h PHE 508 Ca 0.32 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.79 2jj2 h PHE 508 Cb -0.12 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 38.43 2jj2 h PHE 508 CO 0.00 0.49 0.00 0.39 -2.23 0.00 0.00 178.31 176.96 2jj2 n GLU 509 N -4.68 2.81 0.00 1.11 1.02 -0.54 -5.09 120.64 115.27 2jj2 n GLU 509 Ca 0.00 -1.61 0.10 0.00 -0.02 0.00 0.00 57.16 55.63 2jj2 n GLU 509 Cb 0.11 -1.78 0.59 0.00 -0.02 0.00 0.00 31.44 30.34 2jj2 n GLU 509 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31