#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jj1 n LEU 25 N 0.00 1.48 -0.09 -2.67 4.77 -1.26 -2.58 117.00 116.65 2jj1 n LEU 25 Ca 0.00 -0.66 -0.18 0.00 -0.03 0.00 0.00 56.01 55.14 2jj1 n LEU 25 Cb 0.00 -0.13 -0.13 0.00 -2.33 0.00 0.00 43.42 40.84 2jj1 n LEU 25 CO 0.00 0.33 -1.19 -0.62 -1.33 0.00 0.00 177.39 174.58 2jj1 n GLU 26 N 0.23 0.68 0.00 3.23 1.02 -1.26 -0.85 120.64 123.70 2jj1 n GLU 26 Ca 0.14 0.17 0.11 0.00 -0.02 0.00 0.00 57.16 57.56 2jj1 n GLU 26 Cb 0.28 -1.57 -0.15 0.00 -0.02 0.00 0.00 31.44 29.98 2jj1 n GLU 26 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2jj1 n GLU 27 N -3.27 0.63 -4.52 3.49 -0.58 -1.25 -2.20 120.64 112.93 2jj1 n GLU 27 Ca -0.41 -0.16 -0.26 0.00 -0.42 0.00 0.00 57.16 55.91 2jj1 n GLU 27 Cb 1.02 -1.55 -0.08 0.00 -0.57 0.00 0.00 31.44 30.25 2jj1 n GLU 27 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 2jj1 s THR 28 N -3.48 0.58 0.32 2.62 -4.23 -1.06 -1.75 115.64 108.64 2jj1 s THR 28 Ca -0.07 -2.00 -0.18 0.00 -1.18 0.00 0.00 61.69 58.26 2jj1 s THR 28 Cb 0.14 -2.34 0.03 0.00 1.34 0.00 0.00 72.50 71.67 2jj1 s THR 28 CO 0.90 0.00 0.74 -0.83 -0.54 0.00 0.00 174.62 174.88 2jj1 s GLY 29 N -3.61 0.15 0.10 3.99 0.00 0.03 0.35 107.32 108.33 2jj1 s GLY 29 Ca 0.24 -0.53 0.10 0.00 0.00 0.00 0.00 44.72 44.53 2jj1 s GLY 29 CO 0.15 -0.21 -0.26 1.09 0.00 0.00 0.00 173.10 173.86 2jj1 s ARG 30 N -3.24 1.46 0.00 2.90 3.03 -0.29 0.25 118.95 123.06 2jj1 s ARG 30 Ca 0.14 -1.26 -0.30 0.00 2.03 0.00 0.00 55.73 56.33 2jj1 s ARG 30 Cb -0.05 -1.85 -0.05 0.00 -1.03 0.00 0.00 34.95 31.97 2jj1 s ARG 30 CO 0.09 0.45 1.24 0.08 -1.13 0.00 0.00 175.30 176.03 2jj1 s VAL 31 N -1.00 4.05 -0.11 4.99 1.01 -0.48 -0.44 120.40 128.41 2jj1 s VAL 31 Ca 0.12 1.43 -0.19 0.00 0.00 0.00 0.00 61.98 63.35 2jj1 s VAL 31 Cb -0.10 -3.92 -0.27 0.00 0.00 0.00 0.00 36.38 32.10 2jj1 s VAL 31 CO 0.05 0.05 0.58 -0.07 0.00 0.00 0.00 175.10 175.71 2jj1 h LEU 32 N 7.64 0.30 -7.23 3.92 3.38 -0.40 0.13 115.31 123.06 2jj1 h LEU 32 Ca -0.38 -0.84 -0.10 0.00 0.09 0.00 0.00 57.88 56.65 2jj1 h LEU 32 Cb 1.19 -0.10 -0.23 0.00 0.09 0.00 0.00 40.66 41.61 2jj1 h LEU 32 CO 0.86 1.50 -0.13 -0.94 0.09 0.00 0.00 178.44 179.82 2jj1 s SER 33 N -6.91 -0.51 -0.01 -0.43 1.04 -1.11 -4.81 113.70 100.96 2jj1 s SER 33 Ca -0.20 0.95 0.02 0.00 0.48 0.00 0.00 55.95 57.20 2jj1 s SER 33 Cb 0.03 0.97 -0.01 0.00 0.10 0.00 0.00 66.02 67.12 2jj1 s SER 33 CO 0.74 -0.20 -0.08 -0.51 0.98 0.00 0.00 173.24 174.18 2jj1 s ILE 34 N 0.14 0.60 0.00 -1.02 1.10 -1.26 -0.34 121.20 120.42 2jj1 s ILE 34 Ca -0.01 -0.33 0.00 0.00 -0.51 0.00 0.00 60.65 59.80 2jj1 s ILE 34 Cb -0.03 -0.50 0.00 0.00 0.15 0.00 0.00 42.46 42.07 2jj1 s ILE 34 CO 0.01 0.17 0.00 0.61 -2.11 0.00 0.00 174.94 173.62 2jj1 n GLY 35 N 2.89 3.22 3.06 1.50 0.00 -0.42 -5.00 105.19 110.43 2jj1 n GLY 35 Ca -0.13 -0.19 -0.23 0.00 0.00 0.00 0.00 46.02 45.47 2jj1 n GLY 35 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jj1 n ASP 36 N 0.00 -6.18 -0.21 1.61 8.00 -1.26 -2.16 116.55 116.36 2jj1 n ASP 36 Ca 0.00 -0.31 -0.03 0.00 0.71 0.00 0.00 54.79 55.17 2jj1 n ASP 36 Cb 0.00 -4.97 -0.01 0.00 -0.02 0.00 0.00 41.12 36.12 2jj1 n ASP 36 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jj1 n GLY 37 N -1.57 0.60 3.08 0.44 0.00 -1.26 -5.01 105.19 101.48 2jj1 n GLY 37 Ca -0.11 -0.64 -0.29 0.00 0.00 0.00 0.00 46.02 44.98 2jj1 n GLY 37 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jj1 s ILE 38 N -2.05 1.62 -0.21 -0.61 -1.09 -0.92 -1.84 121.20 116.10 2jj1 s ILE 38 Ca 0.00 -0.72 -0.03 0.00 -2.23 0.00 0.00 60.65 57.67 2jj1 s ILE 38 Cb 0.00 -1.47 -0.00 0.00 -1.58 0.00 0.00 42.46 39.41 2jj1 s ILE 38 CO 0.00 0.46 -0.06 0.00 -1.23 0.00 0.00 174.94 174.11 2jj1 s ALA 39 N 0.91 2.75 -0.25 9.38 0.00 0.51 -1.30 121.76 133.77 2jj1 s ALA 39 Ca -0.08 -1.17 -0.21 0.00 0.00 0.00 0.00 51.96 50.51 2jj1 s ALA 39 Cb -0.15 -1.63 -0.02 0.00 0.00 0.00 0.00 23.12 21.32 2jj1 s ALA 39 CO -0.01 -0.41 0.66 1.03 0.00 0.00 0.00 175.76 177.04 2jj1 s ARG 40 N 1.43 4.13 -0.14 0.00 1.81 0.54 0.01 118.95 126.73 2jj1 s ARG 40 Ca 0.05 0.61 0.01 0.00 -1.72 0.00 0.00 55.73 54.69 2jj1 s ARG 40 Cb -0.14 -3.65 -0.00 0.00 -0.45 0.00 0.00 34.95 30.71 2jj1 s ARG 40 CO -0.04 -0.42 -0.17 0.08 -0.68 0.00 0.00 175.30 174.06 2jj1 s VAL 41 N 2.53 2.55 0.10 3.52 1.01 -0.70 0.41 120.40 129.82 2jj1 s VAL 41 Ca 0.28 -0.82 -0.24 0.00 0.00 0.00 0.00 61.98 61.20 2jj1 s VAL 41 Cb -0.15 -2.05 -0.07 0.00 0.00 0.00 0.00 36.38 34.11 2jj1 s VAL 41 CO 0.08 0.53 0.72 -2.28 0.00 0.00 0.00 175.10 174.15 2jj1 s HIS 42 N 0.64 3.83 0.00 5.22 2.46 0.42 -1.06 115.29 126.79 2jj1 s HIS 42 Ca -0.09 1.49 0.00 0.00 0.47 0.00 0.00 55.06 56.93 2jj1 s HIS 42 Cb -0.16 -2.72 0.00 0.00 -0.13 0.00 0.00 32.58 29.57 2jj1 s HIS 42 CO 0.02 0.45 0.00 0.41 -2.47 0.00 0.00 174.74 173.16 2jj1 n GLY 43 N 1.90 0.02 3.77 1.59 0.00 -1.26 -1.14 105.19 110.07 2jj1 n GLY 43 Ca -0.06 -1.71 -0.24 0.00 0.00 0.00 0.00 46.02 44.02 2jj1 n GLY 43 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2jj1 n LEU 44 N 0.00 -2.91 -0.22 0.99 4.77 0.15 -4.77 117.00 115.00 2jj1 n LEU 44 Ca 0.00 -0.83 0.08 0.00 -0.03 0.00 0.00 56.01 55.24 2jj1 n LEU 44 Cb 0.00 -2.60 0.35 0.00 -2.33 0.00 0.00 43.42 38.84 2jj1 n LEU 44 CO 0.00 0.42 1.22 0.03 -1.33 0.00 0.00 177.39 177.74 2jj1 h ARG 45 N -1.92 0.73 -0.62 3.23 2.47 -1.01 -2.55 114.38 114.71 2jj1 h ARG 45 Ca -0.61 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.07 2jj1 h ARG 45 Cb 1.36 -0.17 0.00 0.00 -1.65 0.00 0.00 29.97 29.52 2jj1 h ARG 45 CO 0.59 0.48 0.00 0.09 0.56 0.00 0.00 179.97 181.70 2jj1 n ASN 46 N -4.51 3.72 -4.76 7.04 3.02 -0.94 -4.96 115.26 113.89 2jj1 n ASN 46 Ca 0.13 -2.34 -0.37 0.00 -0.03 0.00 0.00 54.58 51.97 2jj1 n ASN 46 Cb 0.31 -0.50 0.02 0.00 -0.61 0.00 0.00 39.78 39.00 2jj1 n ASN 46 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 2jj1 s VAL 47 N -1.78 2.71 -0.07 2.41 -7.23 -0.96 -5.02 120.40 110.45 2jj1 s VAL 47 Ca 0.39 0.48 -0.08 0.00 -1.81 0.00 0.00 61.98 60.96 2jj1 s VAL 47 Cb 0.25 -3.21 -0.04 0.00 0.56 0.00 0.00 36.38 33.93 2jj1 s VAL 47 CO 0.18 -0.06 0.21 -1.10 -0.31 0.00 0.00 175.10 174.02 2jj1 s GLN 48 N -3.09 3.53 0.03 4.82 -0.21 -1.26 -5.04 119.66 118.44 2jj1 s GLN 48 Ca 0.72 -0.06 -0.37 0.00 0.02 0.00 0.00 55.36 55.67 2jj1 s GLN 48 Cb -0.31 -3.16 -0.16 0.00 1.00 0.00 0.00 33.01 30.37 2jj1 s GLN 48 CO 0.35 0.73 1.44 0.00 -2.12 0.00 0.00 175.29 175.69 2jj1 n ALA 49 N 1.70 -0.62 -1.04 6.09 0.00 -1.26 -1.00 120.51 124.38 2jj1 n ALA 49 Ca -0.17 0.49 -0.02 0.00 0.00 0.00 0.00 53.44 53.74 2jj1 n ALA 49 Cb 0.54 -2.13 -0.01 0.00 0.00 0.00 0.00 19.45 17.85 2jj1 n ALA 49 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2jj1 n GLU 50 N 3.13 -0.29 -2.89 0.00 1.02 0.83 -5.02 120.64 117.42 2jj1 n GLU 50 Ca 0.20 0.32 -0.33 0.00 -0.02 0.00 0.00 57.16 57.33 2jj1 n GLU 50 Cb 0.19 -3.74 -0.06 0.00 -0.02 0.00 0.00 31.44 27.81 2jj1 n GLU 50 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 2jj1 s GLU 51 N -1.19 4.12 -0.34 3.49 2.12 -0.17 -4.59 118.70 122.13 2jj1 s GLU 51 Ca 0.00 0.93 -0.19 0.00 0.36 0.00 0.00 54.97 56.08 2jj1 s GLU 51 Cb 0.00 -2.27 -0.00 0.00 0.26 0.00 0.00 34.13 32.12 2jj1 s GLU 51 CO 0.00 0.01 0.54 -1.64 -0.54 0.00 0.00 175.26 173.63 2jj1 s MET 52 N -3.21 3.67 0.37 4.30 -1.94 -1.26 -0.66 119.30 120.56 2jj1 s MET 52 Ca 0.59 -0.08 0.08 0.00 -1.71 0.00 0.00 55.69 54.56 2jj1 s MET 52 Cb -0.09 -3.80 -0.04 0.00 2.01 0.00 0.00 34.83 32.91 2jj1 s MET 52 CO 0.17 -0.64 0.18 0.14 -0.01 0.00 0.00 175.02 174.85 2jj1 s VAL 53 N 2.45 2.76 -0.09 -6.03 -7.23 0.97 -4.18 120.40 109.06 2jj1 s VAL 53 Ca 0.20 -1.66 0.03 0.00 -1.81 0.00 0.00 61.98 58.74 2jj1 s VAL 53 Cb -0.15 -2.98 0.01 0.00 0.56 0.00 0.00 36.38 33.81 2jj1 s VAL 53 CO 0.13 -0.11 -0.18 -0.70 -0.31 0.00 0.00 175.10 173.94 2jj1 s GLU 54 N -3.89 2.33 0.55 4.82 2.12 0.36 -0.83 118.70 124.16 2jj1 s GLU 54 Ca 0.40 -0.63 -0.08 0.00 0.36 0.00 0.00 54.97 55.01 2jj1 s GLU 54 Cb -0.01 -1.84 -0.04 0.00 0.26 0.00 0.00 34.13 32.50 2jj1 s GLU 54 CO 0.23 0.08 0.91 -0.06 -0.54 0.00 0.00 175.26 175.88 2jj1 s PHE 55 N 0.57 3.59 0.40 5.30 0.40 -0.58 -0.75 117.98 126.91 2jj1 s PHE 55 Ca -0.15 1.07 0.11 0.00 -0.60 0.00 0.00 56.93 57.35 2jj1 s PHE 55 Cb -0.17 -2.53 0.90 0.00 0.51 0.00 0.00 43.02 41.74 2jj1 s PHE 55 CO 0.05 -0.48 1.95 0.66 0.70 0.00 0.00 175.22 178.09 2jj1 h SER 56 N -0.01 0.52 0.90 1.36 4.64 -1.59 0.16 113.55 119.52 2jj1 h SER 56 Ca -0.45 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2jj1 h SER 56 Cb 1.20 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 2jj1 h SER 56 CO 0.62 0.31 0.00 0.77 -0.87 0.00 0.00 176.83 177.65 2jj1 h SER 57 N 0.57 0.00 0.00 4.97 4.64 -1.88 -3.47 113.55 118.39 2jj1 h SER 57 Ca 0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 2jj1 h SER 57 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 2jj1 h SER 57 CO -0.11 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.46 2jj1 n GLY 58 N 0.05 0.76 3.81 -0.77 0.00 0.05 -5.10 105.19 103.98 2jj1 n GLY 58 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 2jj1 n GLY 58 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jj1 s LEU 59 N 0.00 3.83 0.35 0.99 1.43 -1.26 -4.85 118.68 119.18 2jj1 s LEU 59 Ca 0.00 1.83 -0.04 0.00 -1.03 0.00 0.00 54.13 54.89 2jj1 s LEU 59 Cb 0.00 -4.55 -0.04 0.00 0.03 0.00 0.00 46.19 41.63 2jj1 s LEU 59 CO 0.00 -0.68 0.61 -0.54 0.23 0.00 0.00 176.35 175.97 2jj1 s LYS 60 N -3.33 3.58 0.00 1.70 -0.14 -1.26 -1.53 119.74 118.76 2jj1 s LYS 60 Ca 0.65 -0.04 -0.11 0.00 -1.36 0.00 0.00 55.97 55.12 2jj1 s LYS 60 Cb -0.14 -2.59 0.01 0.00 -1.68 0.00 0.00 37.83 33.44 2jj1 s LYS 60 CO 0.20 0.10 0.22 0.20 -0.76 0.00 0.00 175.35 175.31 2jj1 s GLY 61 N -3.61 -0.04 -0.08 -3.33 0.00 -0.01 -0.97 107.32 99.28 2jj1 s GLY 61 Ca 0.44 0.04 0.04 0.00 0.00 0.00 0.00 44.72 45.23 2jj1 s GLY 61 CO 0.35 -0.14 -0.20 -0.29 0.00 0.00 0.00 173.10 172.82 2jj1 s MET 62 N -1.51 2.51 -0.86 2.90 1.75 -0.42 -0.02 119.30 123.65 2jj1 s MET 62 Ca -0.13 -0.72 -0.19 0.00 -1.25 0.00 0.00 55.69 53.40 2jj1 s MET 62 Cb -0.06 -1.96 0.12 0.00 2.84 0.00 0.00 34.83 35.77 2jj1 s MET 62 CO 0.02 0.15 1.06 -1.12 -0.65 0.00 0.00 175.02 174.48 2jj1 s SER 63 N 0.38 6.53 -0.02 1.11 0.01 0.17 -0.47 113.70 121.40 2jj1 s SER 63 Ca -0.15 -1.85 0.12 0.00 1.31 0.00 0.00 55.95 55.38 2jj1 s SER 63 Cb -0.17 -2.39 -0.22 0.00 0.21 0.00 0.00 66.02 63.45 2jj1 s SER 63 CO 0.07 -1.12 0.74 -0.07 0.41 0.00 0.00 173.24 173.27 2jj1 h LEU 64 N 10.46 0.00 -8.43 2.44 3.38 -1.72 0.23 115.31 121.68 2jj1 h LEU 64 Ca 0.05 0.00 -0.66 0.00 0.09 0.00 0.00 57.88 57.36 2jj1 h LEU 64 Cb 1.04 0.00 -0.29 0.00 0.09 0.00 0.00 40.66 41.50 2jj1 h LEU 64 CO 1.11 0.97 -0.76 0.20 0.09 0.00 0.00 178.44 180.04 2jj1 s ASN 65 N -6.13 3.97 -0.37 -0.43 -0.87 -0.98 -4.77 114.94 105.36 2jj1 s ASN 65 Ca -0.04 -0.41 -0.08 0.00 -1.57 0.00 0.00 52.86 50.76 2jj1 s ASN 65 Cb 0.08 -1.64 0.05 0.00 -0.02 0.00 0.00 41.25 39.72 2jj1 s ASN 65 CO 0.82 0.06 0.17 -0.76 -2.57 0.00 0.00 177.10 174.82 2jj1 s LEU 66 N 0.99 4.67 0.30 0.60 1.43 -1.26 -0.39 118.68 125.02 2jj1 s LEU 66 Ca -0.01 -1.27 0.09 0.00 -1.03 0.00 0.00 54.13 51.91 2jj1 s LEU 66 Cb -0.15 -1.93 -0.04 0.00 0.03 0.00 0.00 46.19 44.10 2jj1 s LEU 66 CO -0.01 -0.41 0.08 -1.61 0.23 0.00 0.00 176.35 174.63 2jj1 s GLU 67 N 1.42 2.36 0.32 1.70 2.02 0.07 -5.02 118.70 121.58 2jj1 s GLU 67 Ca 0.01 -1.47 0.06 0.00 0.02 0.00 0.00 54.97 53.59 2jj1 s GLU 67 Cb -0.21 -2.18 0.71 0.00 0.10 0.00 0.00 34.13 32.55 2jj1 s GLU 67 CO 0.03 0.24 1.85 -1.35 0.02 0.00 0.00 175.26 176.05 2jj1 h PRO 68 N 1.70 0.79 -0.02 0.39 0.11 -2.03 -3.09 132.00 129.85 2jj1 h PRO 68 Ca -0.44 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2jj1 h PRO 68 Cb 1.25 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2jj1 h PRO 68 CO 0.62 0.52 0.00 -0.40 -0.21 0.00 0.00 178.00 178.53 2jj1 n ASP 69 N -4.60 1.46 -3.49 -2.05 5.75 -1.26 -5.05 116.55 107.31 2jj1 n ASP 69 Ca 0.19 -1.34 -0.11 0.00 -0.01 0.00 0.00 54.79 53.51 2jj1 n ASP 69 Cb 0.44 -0.01 -0.02 0.00 -1.03 0.00 0.00 41.12 40.49 2jj1 n ASP 69 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2jj1 s ASN 70 N -0.41 -0.52 -0.18 -1.12 2.20 -1.17 -4.70 114.94 109.05 2jj1 s ASN 70 Ca 0.03 -0.09 0.01 0.00 -0.94 0.00 0.00 52.86 51.87 2jj1 s ASN 70 Cb 0.02 0.61 0.02 0.00 -2.00 0.00 0.00 41.25 39.89 2jj1 s ASN 70 CO 0.03 -1.01 -0.19 -0.69 -2.94 0.00 0.00 177.10 172.30 2jj1 s VAL 71 N -3.74 2.15 -0.59 3.54 1.01 -0.23 -0.75 120.40 121.78 2jj1 s VAL 71 Ca 0.03 -0.92 -0.27 0.00 0.00 0.00 0.00 61.98 60.82 2jj1 s VAL 71 Cb -0.02 -1.90 0.01 0.00 0.00 0.00 0.00 36.38 34.47 2jj1 s VAL 71 CO -0.10 0.53 1.51 -0.83 0.00 0.00 0.00 175.10 176.21 2jj1 s GLY 72 N 1.23 0.73 -0.17 4.51 0.00 0.47 -1.71 107.32 112.38 2jj1 s GLY 72 Ca 0.03 -0.75 -0.08 0.00 0.00 0.00 0.00 44.72 43.92 2jj1 s GLY 72 CO -0.11 2.93 0.12 0.14 0.00 0.00 0.00 173.10 176.19 2jj1 s VAL 73 N 6.71 5.33 -0.27 1.40 1.01 0.10 -1.94 120.40 132.74 2jj1 s VAL 73 Ca 0.54 0.15 -0.11 0.00 0.00 0.00 0.00 61.98 62.56 2jj1 s VAL 73 Cb -0.11 -3.38 -0.05 0.00 0.00 0.00 0.00 36.38 32.83 2jj1 s VAL 73 CO 0.23 0.51 0.18 -0.69 0.00 0.00 0.00 175.10 175.33 2jj1 s VAL 74 N -0.16 5.33 -0.20 2.92 1.01 0.38 -0.36 120.40 129.31 2jj1 s VAL 74 Ca 0.10 0.18 -0.20 0.00 0.00 0.00 0.00 61.98 62.06 2jj1 s VAL 74 Cb -0.12 -3.52 -0.03 0.00 0.00 0.00 0.00 36.38 32.72 2jj1 s VAL 74 CO 0.00 0.28 0.59 -0.69 0.00 0.00 0.00 175.10 175.29 2jj1 s VAL 75 N 1.51 5.05 -1.00 2.92 1.01 -0.76 -1.30 120.40 127.82 2jj1 s VAL 75 Ca 0.07 1.10 -0.06 0.00 0.00 0.00 0.00 61.98 63.10 2jj1 s VAL 75 Cb -0.15 -3.91 0.04 0.00 0.00 0.00 0.00 36.38 32.36 2jj1 s VAL 75 CO 0.09 0.13 2.69 0.49 0.00 0.00 0.00 175.10 178.50 2jj1 n PHE 76 N 5.00 2.05 -3.78 5.22 3.01 -0.14 -4.69 117.46 124.14 2jj1 n PHE 76 Ca -0.02 -2.49 0.00 0.00 1.01 0.00 0.00 57.45 55.94 2jj1 n PHE 76 Cb 0.50 -1.78 0.00 0.00 -0.01 0.00 0.00 39.48 38.19 2jj1 n PHE 76 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2jj1 n GLY 77 N 1.82 -0.69 3.73 1.37 0.00 -1.26 -4.36 105.19 105.80 2jj1 n GLY 77 Ca 0.59 -1.20 -0.41 0.00 0.00 0.00 0.00 46.02 45.00 2jj1 n GLY 77 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2jj1 s ASN 78 N -4.00 7.02 0.49 1.61 3.84 -1.26 -4.94 114.94 117.70 2jj1 s ASN 78 Ca 0.00 2.26 0.27 0.00 0.21 0.00 0.00 52.86 55.60 2jj1 s ASN 78 Cb 0.00 -2.60 1.23 0.00 -0.55 0.00 0.00 41.25 39.32 2jj1 s ASN 78 CO 0.00 -0.44 1.96 0.44 -2.79 0.00 0.00 177.10 176.27 2jj1 h ASP 79 N 5.54 0.00 -0.15 -4.21 3.32 -1.96 -3.19 116.42 115.76 2jj1 h ASP 79 Ca -0.44 0.00 0.04 0.00 0.02 0.00 0.00 57.03 56.65 2jj1 h ASP 79 Cb 1.21 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.76 2jj1 h ASP 79 CO 0.77 0.16 0.22 0.07 -1.72 0.00 0.00 179.24 178.74 2jj1 h LYS 80 N 0.00 0.00 0.00 3.56 2.10 -2.02 0.78 116.57 120.99 2jj1 h LYS 80 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2jj1 h LYS 80 Cb 0.53 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.86 2jj1 h LYS 80 CO 0.02 0.00 0.00 -0.07 -2.00 0.00 0.00 179.45 177.40 2jj1 h LEU 81 N 0.00 0.00 -8.70 7.07 3.38 -1.97 -3.44 115.31 111.64 2jj1 h LEU 81 Ca 0.07 0.00 -0.64 0.00 0.09 0.00 0.00 57.88 57.40 2jj1 h LEU 81 Cb 0.52 0.00 -0.24 0.00 0.09 0.00 0.00 40.66 41.03 2jj1 h LEU 81 CO -0.00 0.00 -0.69 -0.63 0.09 0.00 0.00 178.44 177.21 2jj1 s ILE 82 N -3.18 3.73 0.36 1.22 1.01 0.26 -4.68 121.20 119.93 2jj1 s ILE 82 Ca 0.08 -0.40 0.09 0.00 0.00 0.00 0.00 60.65 60.42 2jj1 s ILE 82 Cb 0.10 -2.65 -0.06 0.00 0.01 0.00 0.00 42.46 39.86 2jj1 s ILE 82 CO 0.59 0.47 0.01 -0.54 0.00 0.00 0.00 174.94 175.47 2jj1 s LYS 83 N 0.73 2.03 0.20 2.79 1.02 -1.26 -4.94 119.74 120.30 2jj1 s LYS 83 Ca -0.02 -1.85 -0.32 0.00 0.02 0.00 0.00 55.97 53.80 2jj1 s LYS 83 Cb -0.14 -1.85 -0.13 0.00 -0.52 0.00 0.00 37.83 35.19 2jj1 s LYS 83 CO 0.02 0.08 1.55 -1.91 -0.92 0.00 0.00 175.35 174.17 2jj1 n GLU 84 N -0.96 2.27 -0.14 1.68 2.13 -1.26 -2.24 120.64 122.12 2jj1 n GLU 84 Ca -0.04 0.82 0.00 0.00 0.66 0.00 0.00 57.16 58.59 2jj1 n GLU 84 Cb 0.64 -2.57 0.00 0.00 0.27 0.00 0.00 31.44 29.78 2jj1 n GLU 84 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2jj1 n GLY 85 N 3.00 1.15 3.74 8.31 0.00 0.47 -4.94 105.19 116.92 2jj1 n GLY 85 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 2jj1 n GLY 85 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jj1 n ASP 86 N 0.00 3.85 -4.73 1.61 9.92 -0.95 -4.50 116.55 121.76 2jj1 n ASP 86 Ca 0.00 1.15 -0.41 0.00 -0.53 0.00 0.00 54.79 54.99 2jj1 n ASP 86 Cb 0.00 -1.59 -0.03 0.00 -0.64 0.00 0.00 41.12 38.85 2jj1 n ASP 86 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2jj1 s ILE 87 N -0.00 4.04 -0.21 0.53 1.09 -1.26 -1.39 121.20 124.00 2jj1 s ILE 87 Ca 0.64 1.60 0.02 0.00 -1.10 0.00 0.00 60.65 61.81 2jj1 s ILE 87 Cb -0.50 -4.02 0.04 0.00 -1.06 0.00 0.00 42.46 36.92 2jj1 s ILE 87 CO 0.48 0.20 -0.16 -0.69 -0.10 0.00 0.00 174.94 174.68 2jj1 s VAL 88 N 0.40 2.02 -0.01 2.92 1.01 0.14 -1.49 120.40 125.39 2jj1 s VAL 88 Ca 0.53 -1.15 -0.05 0.00 0.00 0.00 0.00 61.98 61.31 2jj1 s VAL 88 Cb -0.29 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 2jj1 s VAL 88 CO 0.32 0.32 0.22 -0.54 0.00 0.00 0.00 175.10 175.42 2jj1 s LYS 89 N 1.25 3.51 -0.04 2.72 1.02 0.07 -0.79 119.74 127.49 2jj1 s LYS 89 Ca -0.00 -0.18 -0.27 0.00 0.02 0.00 0.00 55.97 55.54 2jj1 s LYS 89 Cb -0.16 -3.09 -0.03 0.00 -0.52 0.00 0.00 37.83 34.03 2jj1 s LYS 89 CO -0.10 0.67 0.87 1.03 -0.92 0.00 0.00 175.35 176.90 2jj1 s ARG 90 N -1.77 4.50 -0.14 1.68 0.52 -0.72 -0.48 118.95 122.53 2jj1 s ARG 90 Ca 0.26 1.19 0.16 0.00 -0.52 0.00 0.00 55.73 56.83 2jj1 s ARG 90 Cb -0.13 -3.46 0.47 0.00 0.52 0.00 0.00 34.95 32.35 2jj1 s ARG 90 CO 0.16 -0.02 1.37 0.25 0.02 0.00 0.00 175.30 177.07 2jj1 n THR 91 N 3.90 2.04 -2.98 0.02 -2.24 -1.26 -4.94 114.28 108.82 2jj1 n THR 91 Ca 0.03 -1.76 -0.17 0.00 -2.27 0.00 0.00 64.05 59.88 2jj1 n THR 91 Cb 0.51 -0.13 0.04 0.00 -2.10 0.00 0.00 70.33 68.65 2jj1 n THR 91 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jj1 n GLY 92 N -0.44 -0.20 3.77 3.38 0.00 -1.26 -4.99 105.19 105.46 2jj1 n GLY 92 Ca 0.19 -0.06 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 2jj1 n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jj1 s ALA 93 N -3.08 2.62 -0.18 4.61 0.00 -1.26 -5.06 121.76 119.41 2jj1 s ALA 93 Ca 0.29 0.70 -0.02 0.00 0.00 0.00 0.00 51.96 52.93 2jj1 s ALA 93 Cb -0.13 -3.34 0.05 0.00 0.00 0.00 0.00 23.12 19.71 2jj1 s ALA 93 CO 0.36 -0.95 0.01 -1.50 0.00 0.00 0.00 175.76 173.68 2jj1 s ILE 94 N -2.02 0.71 -1.03 0.00 2.07 -1.26 -4.61 121.20 115.05 2jj1 s ILE 94 Ca 0.70 -0.55 -0.24 0.00 -1.41 0.00 0.00 60.65 59.15 2jj1 s ILE 94 Cb -0.22 -1.09 -0.08 0.00 0.13 0.00 0.00 42.46 41.20 2jj1 s ILE 94 CO 0.33 -0.08 1.98 -0.69 -1.91 0.00 0.00 174.94 174.57 2jj1 s VAL 95 N 1.79 3.44 0.29 4.00 1.01 -1.26 -4.85 120.40 124.81 2jj1 s VAL 95 Ca -0.00 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 61.43 2jj1 s VAL 95 Cb -0.16 -4.20 -0.06 0.00 0.00 0.00 0.00 36.38 31.95 2jj1 s VAL 95 CO -0.07 -0.86 0.05 1.51 0.00 0.00 0.00 175.10 175.72 2jj1 s ASP 96 N 7.53 2.00 0.03 3.32 -4.77 -1.26 -2.41 116.67 121.12 2jj1 s ASP 96 Ca 0.71 -1.33 0.04 0.00 -3.30 0.00 0.00 52.55 48.67 2jj1 s ASP 96 Cb -0.04 -0.01 -0.02 0.00 -1.09 0.00 0.00 42.92 41.76 2jj1 s ASP 96 CO 0.07 -0.60 -0.11 0.68 0.70 0.00 0.00 175.17 175.91 2jj1 s VAL 97 N -3.41 0.85 0.35 2.11 -7.23 0.15 -4.87 120.40 108.35 2jj1 s VAL 97 Ca 0.35 -0.90 -0.28 0.00 -1.81 0.00 0.00 61.98 59.34 2jj1 s VAL 97 Cb 0.08 -0.80 -0.12 0.00 0.56 0.00 0.00 36.38 36.10 2jj1 s VAL 97 CO 0.13 -0.08 1.43 -0.81 -0.31 0.00 0.00 175.10 175.47 2jj1 n PRO 98 N 1.95 2.48 -4.02 4.82 -0.04 -1.26 -0.69 135.00 138.25 2jj1 n PRO 98 Ca -0.18 0.87 -0.12 0.00 -0.04 0.00 0.00 63.50 64.03 2jj1 n PRO 98 Cb 0.55 -2.56 -0.12 0.00 -0.04 0.00 0.00 33.50 31.33 2jj1 n PRO 98 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2jj1 s VAL 99 N -0.96 0.29 -3.91 0.52 0.11 -0.32 -4.81 120.40 111.32 2jj1 s VAL 99 Ca 0.56 -0.71 0.00 0.00 -2.93 0.00 0.00 61.98 58.89 2jj1 s VAL 99 Cb -0.51 -0.35 0.00 0.00 -1.53 0.00 0.00 36.38 33.98 2jj1 s VAL 99 CO 0.61 -0.28 0.00 0.61 -3.33 0.00 0.00 175.10 172.71 2jj1 n GLY 100 N 2.00 0.93 0.29 6.54 0.00 -1.26 -4.00 105.19 109.69 2jj1 n GLY 100 Ca -0.20 -2.02 0.18 0.00 0.00 0.00 0.00 46.02 43.98 2jj1 n GLY 100 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2jj1 h GLU 101 N 7.29 0.00 0.00 1.61 5.08 -1.99 -2.69 114.58 123.88 2jj1 h GLU 101 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2jj1 h GLU 101 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2jj1 h GLU 101 CO 0.00 0.03 0.00 -0.85 -1.00 0.00 0.00 179.01 177.19 2jj1 n GLU 102 N -3.20 0.12 0.22 2.33 0.00 -1.26 -1.66 120.64 117.20 2jj1 n GLU 102 Ca -0.01 0.32 0.13 0.00 0.00 0.00 0.00 57.16 57.60 2jj1 n GLU 102 Cb 0.23 -1.72 0.25 0.00 0.00 0.00 0.00 31.44 30.20 2jj1 n GLU 102 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.13 177.06 2jj1 h LEU 103 N 0.00 0.00 -9.78 -1.84 3.38 -1.83 -3.42 115.31 101.81 2jj1 h LEU 103 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 2jj1 h LEU 103 Cb 0.37 0.00 0.07 0.00 0.09 0.00 0.00 40.66 41.19 2jj1 h LEU 103 CO 0.00 0.00 0.81 -0.76 0.09 0.00 0.00 178.44 178.58 2jj1 s LEU 104 N -6.11 4.37 -0.00 1.67 1.43 -0.66 -1.59 118.68 117.79 2jj1 s LEU 104 Ca 0.06 2.81 0.00 0.00 -1.03 0.00 0.00 54.13 55.97 2jj1 s LEU 104 Cb 0.06 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.65 2jj1 s LEU 104 CO 0.65 -0.79 0.00 0.61 0.23 0.00 0.00 176.35 177.04 2jj1 n GLY 105 N 2.06 0.47 3.59 -3.19 0.00 -0.83 -4.94 105.19 102.35 2jj1 n GLY 105 Ca 0.07 -0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.80 2jj1 n GLY 105 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jj1 s ARG 106 N -0.13 2.16 -0.18 1.61 1.81 -0.62 -4.96 118.95 118.64 2jj1 s ARG 106 Ca 0.00 -1.10 -0.01 0.00 -1.72 0.00 0.00 55.73 52.90 2jj1 s ARG 106 Cb 0.00 -2.28 -0.00 0.00 -0.45 0.00 0.00 34.95 32.22 2jj1 s ARG 106 CO 0.00 0.48 -0.12 0.08 -0.68 0.00 0.00 175.30 175.06 2jj1 s VAL 107 N -1.43 2.87 0.22 3.52 1.01 -1.26 -1.95 120.40 123.39 2jj1 s VAL 107 Ca 0.23 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.56 2jj1 s VAL 107 Cb -0.10 -2.25 -0.05 0.00 0.00 0.00 0.00 36.38 33.98 2jj1 s VAL 107 CO 0.15 0.49 -0.01 0.68 0.00 0.00 0.00 175.10 176.41 2jj1 s VAL 108 N 1.05 1.04 0.17 2.92 -7.23 -0.40 -1.01 120.40 116.94 2jj1 s VAL 108 Ca -0.01 -2.04 -0.01 0.00 -1.81 0.00 0.00 61.98 58.12 2jj1 s VAL 108 Cb -0.15 -2.29 0.04 0.00 0.56 0.00 0.00 36.38 34.54 2jj1 s VAL 108 CO -0.03 -0.37 0.23 -0.90 -0.31 0.00 0.00 175.10 173.73 2jj1 n ASP 109 N -0.39 0.18 0.05 4.85 3.85 0.37 -1.06 116.55 124.41 2jj1 n ASP 109 Ca -0.06 -1.18 0.05 0.00 -0.71 0.00 0.00 54.79 52.89 2jj1 n ASP 109 Cb 0.64 -0.16 0.24 0.00 -1.35 0.00 0.00 41.12 40.48 2jj1 n ASP 109 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2jj1 n ALA 110 N -3.05 1.14 -0.17 2.12 0.00 -1.26 -1.44 120.51 117.86 2jj1 n ALA 110 Ca -0.04 0.05 0.04 0.00 0.00 0.00 0.00 53.44 53.50 2jj1 n ALA 110 Cb 0.12 -1.14 0.11 0.00 0.00 0.00 0.00 19.45 18.53 2jj1 n ALA 110 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2jj1 n LEU 111 N -1.76 2.65 0.00 0.00 4.77 -1.26 -4.52 117.00 116.89 2jj1 n LEU 111 Ca 0.00 -2.06 0.00 0.00 -0.03 0.00 0.00 56.01 53.93 2jj1 n LEU 111 Cb 0.05 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 2jj1 n LEU 111 CO 0.06 0.65 0.00 0.61 -1.33 0.00 0.00 177.39 177.38 2jj1 n GLY 112 N 0.12 0.84 3.73 -0.72 0.00 -0.52 -4.53 105.19 104.10 2jj1 n GLY 112 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2jj1 n GLY 112 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2jj1 s ASN 113 N -2.72 6.73 0.32 1.61 0.01 -1.26 -4.68 114.94 114.95 2jj1 s ASN 113 Ca 0.00 2.49 -0.29 0.00 -0.71 0.00 0.00 52.86 54.36 2jj1 s ASN 113 Cb 0.00 -2.60 -0.10 0.00 0.41 0.00 0.00 41.25 38.96 2jj1 s ASN 113 CO 0.00 -0.69 1.33 0.00 -1.51 0.00 0.00 177.10 176.23 2jj1 s ALA 114 N 0.70 3.52 0.00 0.60 0.00 -1.26 -0.48 121.76 124.83 2jj1 s ALA 114 Ca 0.63 1.28 0.00 0.00 0.00 0.00 0.00 51.96 53.88 2jj1 s ALA 114 Cb -0.40 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.23 2jj1 s ALA 114 CO 0.35 -0.68 0.51 0.44 0.00 0.00 0.00 175.76 176.38 2jj1 n ILE 115 N 0.97 0.20 1.25 0.00 -5.35 -0.18 -4.77 119.36 111.48 2jj1 n ILE 115 Ca 0.01 -0.23 0.13 0.00 -0.27 0.00 0.00 62.75 62.39 2jj1 n ILE 115 Cb 0.41 1.08 0.38 0.00 -1.74 0.00 0.00 39.64 39.78 2jj1 n ILE 115 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 2jj1 n ASP 116 N -0.10 1.03 0.00 7.28 5.75 -1.12 -4.96 116.55 124.43 2jj1 n ASP 116 Ca 0.00 -0.90 0.00 0.00 -0.01 0.00 0.00 54.79 53.88 2jj1 n ASP 116 Cb 0.38 0.13 0.00 0.00 -1.03 0.00 0.00 41.12 40.59 2jj1 n ASP 116 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jj1 n GLY 117 N 1.34 0.43 0.96 6.12 0.00 -1.26 -4.94 105.19 107.84 2jj1 n GLY 117 Ca 0.12 -0.97 0.04 0.00 0.00 0.00 0.00 46.02 45.22 2jj1 n GLY 117 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jj1 n LYS 118 N -2.26 2.50 0.00 1.61 5.02 -1.26 -5.09 118.16 118.68 2jj1 n LYS 118 Ca 0.00 -2.94 0.00 0.00 -2.02 0.00 0.00 58.31 53.35 2jj1 n LYS 118 Cb 0.17 -1.83 0.00 0.00 -0.02 0.00 0.00 35.03 33.35 2jj1 n LYS 118 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jj1 n GLY 119 N -0.76 -1.24 3.73 0.72 0.00 -1.26 -4.92 105.19 101.46 2jj1 n GLY 119 Ca 0.25 -1.26 -0.38 0.00 0.00 0.00 0.00 46.02 44.63 2jj1 n GLY 119 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2jj1 n PRO 120 N -0.04 1.62 -2.67 1.61 -0.04 -1.26 -4.77 135.00 129.45 2jj1 n PRO 120 Ca 0.00 0.60 -0.43 0.00 -0.04 0.00 0.00 63.50 63.63 2jj1 n PRO 120 Cb 0.00 -2.54 -0.02 0.00 -0.04 0.00 0.00 33.50 30.89 2jj1 n PRO 120 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2jj1 s ILE 121 N -1.30 4.61 0.00 0.52 -1.09 -1.26 -4.95 121.20 117.73 2jj1 s ILE 121 Ca 0.72 1.84 -0.05 0.00 -2.23 0.00 0.00 60.65 60.93 2jj1 s ILE 121 Cb -0.42 -4.34 -0.21 0.00 -1.58 0.00 0.00 42.46 35.91 2jj1 s ILE 121 CO 0.49 -0.32 2.95 0.61 -1.23 0.00 0.00 174.94 177.44 2jj1 n GLY 122 N 3.63 2.59 3.72 6.18 0.00 -1.26 -4.91 105.19 115.14 2jj1 n GLY 122 Ca 0.11 -0.92 -0.41 0.00 0.00 0.00 0.00 46.02 44.79 2jj1 n GLY 122 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2jj1 s SER 123 N 2.18 7.44 0.00 1.61 0.15 -1.26 -4.88 113.70 118.94 2jj1 s SER 123 Ca 0.51 1.73 0.12 0.00 0.70 0.00 0.00 55.95 59.01 2jj1 s SER 123 Cb 0.24 -2.58 -0.03 0.00 -1.71 0.00 0.00 66.02 61.95 2jj1 s SER 123 CO 0.00 -0.14 0.64 0.29 1.20 0.00 0.00 173.24 175.23 2jj1 n LYS 124 N 3.25 2.29 -4.13 5.44 5.02 -1.26 -5.01 118.16 123.75 2jj1 n LYS 124 Ca 0.04 -0.51 -0.09 0.00 -2.02 0.00 0.00 58.31 55.73 2jj1 n LYS 124 Cb 0.50 -1.11 -0.10 0.00 -0.02 0.00 0.00 35.03 34.30 2jj1 n LYS 124 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2jj1 s ALA 125 N -1.64 0.74 0.04 7.82 0.00 -1.26 -5.08 121.76 122.39 2jj1 s ALA 125 Ca 0.08 -1.30 0.01 0.00 0.00 0.00 0.00 51.96 50.75 2jj1 s ALA 125 Cb 0.09 0.28 -0.03 0.00 0.00 0.00 0.00 23.12 23.47 2jj1 s ALA 125 CO 0.33 -0.33 -0.05 1.03 0.00 0.00 0.00 175.76 176.75 2jj1 s ARG 126 N -3.90 0.49 0.02 0.00 0.52 -1.26 -1.17 118.95 113.64 2jj1 s ARG 126 Ca 0.11 -0.86 0.04 0.00 -0.52 0.00 0.00 55.73 54.49 2jj1 s ARG 126 Cb 0.07 -0.00 -0.01 0.00 0.52 0.00 0.00 34.95 35.52 2jj1 s ARG 126 CO -0.07 -0.03 -0.11 0.50 0.02 0.00 0.00 175.30 175.61 2jj1 s ARG 127 N -2.28 0.81 0.55 3.54 3.52 0.14 -4.88 118.95 120.35 2jj1 s ARG 127 Ca -0.06 -0.54 -0.20 0.00 -0.13 0.00 0.00 55.73 54.79 2jj1 s ARG 127 Cb -0.04 -0.77 -0.05 0.00 -1.56 0.00 0.00 34.95 32.52 2jj1 s ARG 127 CO -0.03 0.20 1.23 1.03 -0.81 0.00 0.00 175.30 176.91 2jj1 s ARG 128 N -0.71 3.21 0.13 5.12 0.52 -1.26 0.29 118.95 126.24 2jj1 s ARG 128 Ca 0.01 1.89 0.23 0.00 -0.52 0.00 0.00 55.73 57.35 2jj1 s ARG 128 Cb -0.06 -2.11 0.15 0.00 0.52 0.00 0.00 34.95 33.45 2jj1 s ARG 128 CO 0.00 -1.03 1.14 1.33 0.02 0.00 0.00 175.30 176.76 2jj1 n VAL 129 N -1.20 0.39 -3.94 3.52 0.24 -1.01 -4.65 118.33 111.66 2jj1 n VAL 129 Ca 0.11 -0.36 -0.32 0.00 -2.04 0.00 0.00 64.34 61.73 2jj1 n VAL 129 Cb 0.48 -0.11 -0.14 0.00 -1.47 0.00 0.00 33.84 32.61 2jj1 n VAL 129 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2jj1 s GLY 130 N -3.90 2.07 0.02 7.63 0.00 -1.26 -4.55 107.32 107.33 2jj1 s GLY 130 Ca 0.03 -2.71 -0.03 0.00 0.00 0.00 0.00 44.72 42.01 2jj1 s GLY 130 CO 0.77 0.98 0.04 1.08 0.00 0.00 0.00 173.10 175.96 2jj1 s LEU 131 N 0.68 1.98 0.46 0.66 1.43 -1.26 -5.15 118.68 117.48 2jj1 s LEU 131 Ca 0.12 -0.44 -0.24 0.00 -1.03 0.00 0.00 54.13 52.53 2jj1 s LEU 131 Cb -0.21 0.35 -0.07 0.00 0.03 0.00 0.00 46.19 46.29 2jj1 s LEU 131 CO -0.06 -0.37 1.34 -0.54 0.23 0.00 0.00 176.35 176.96 2jj1 s LYS 132 N -1.74 3.64 0.58 1.70 1.02 -1.26 -5.01 119.74 118.67 2jj1 s LYS 132 Ca -0.13 2.22 -0.18 0.00 0.02 0.00 0.00 55.97 57.90 2jj1 s LYS 132 Cb -0.07 -2.56 -0.04 0.00 -0.52 0.00 0.00 37.83 34.64 2jj1 s LYS 132 CO -0.01 -0.78 1.12 0.00 -0.92 0.00 0.00 175.35 174.75 2jj1 s ALA 133 N -1.28 2.64 0.18 5.17 0.00 -1.26 -4.96 121.76 122.25 2jj1 s ALA 133 Ca 0.63 0.72 -0.32 0.00 0.00 0.00 0.00 51.96 52.98 2jj1 s ALA 133 Cb -0.39 -3.34 -0.16 0.00 0.00 0.00 0.00 23.12 19.23 2jj1 s ALA 133 CO 0.50 -0.90 1.14 -2.30 0.00 0.00 0.00 175.76 174.20 2jj1 n PRO 134 N -1.64 1.17 0.00 0.00 -0.02 -1.26 -4.97 135.00 128.28 2jj1 n PRO 134 Ca 0.11 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 2jj1 n PRO 134 Cb 0.51 -1.90 0.00 0.00 -0.02 0.00 0.00 33.50 32.09 2jj1 n PRO 134 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jj1 n GLY 135 N 1.95 -1.29 0.19 -1.23 0.00 -1.26 -4.98 105.19 98.57 2jj1 n GLY 135 Ca 0.15 -1.51 -0.16 0.00 0.00 0.00 0.00 46.02 44.50 2jj1 n GLY 135 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2jj1 h ILE 136 N -0.22 1.33 -0.29 -0.61 2.04 -1.98 -3.36 117.51 114.43 2jj1 h ILE 136 Ca 0.00 -1.75 -0.11 0.00 1.00 0.00 0.00 64.86 63.99 2jj1 h ILE 136 Cb 0.00 2.00 -0.01 0.00 -0.74 0.00 0.00 36.82 38.07 2jj1 h ILE 136 CO 0.00 0.54 -0.26 0.40 0.00 0.00 0.00 178.15 178.83 2jj1 h ILE 137 N 0.28 1.30 0.00 -0.67 1.08 -2.03 -3.29 117.51 114.18 2jj1 h ILE 137 Ca -0.02 -1.42 0.00 0.00 -0.39 0.00 0.00 64.86 63.03 2jj1 h ILE 137 Cb 1.12 1.56 0.00 0.00 -3.07 0.00 0.00 36.82 36.42 2jj1 h ILE 137 CO 0.11 0.46 0.00 -2.65 -0.69 0.00 0.00 178.15 175.37 2jj1 n PRO 138 N -4.28 0.56 -4.40 2.37 -0.02 -1.26 -4.81 135.00 123.15 2jj1 n PRO 138 Ca -0.04 0.00 -0.26 0.00 -2.02 0.00 0.00 63.50 61.18 2jj1 n PRO 138 Cb 0.46 -1.03 -0.12 0.00 -0.02 0.00 0.00 33.50 32.78 2jj1 n PRO 138 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2jj1 s ARG 139 N -1.88 1.45 0.26 -0.52 0.52 -1.24 -2.15 118.95 115.38 2jj1 s ARG 139 Ca 0.00 -1.47 0.12 0.00 -0.52 0.00 0.00 55.73 53.85 2jj1 s ARG 139 Cb 0.00 -1.75 -0.05 0.00 0.52 0.00 0.00 34.95 33.67 2jj1 s ARG 139 CO 0.00 0.38 -0.18 -1.50 0.02 0.00 0.00 175.30 174.02 2jj1 s ILE 140 N -1.64 2.58 0.40 1.52 1.10 -0.98 -4.60 121.20 119.58 2jj1 s ILE 140 Ca 0.19 -2.26 -0.23 0.00 -0.51 0.00 0.00 60.65 57.84 2jj1 s ILE 140 Cb -0.08 -2.33 -0.13 0.00 0.15 0.00 0.00 42.46 40.07 2jj1 s ILE 140 CO 0.09 -0.33 0.52 -1.20 -2.11 0.00 0.00 174.94 171.90 2jj1 n SER 141 N -0.46 -1.01 -4.65 4.50 7.64 -1.26 -4.67 113.62 113.71 2jj1 n SER 141 Ca -0.07 0.92 -0.43 0.00 1.01 0.00 0.00 58.87 60.31 2jj1 n SER 141 Cb 0.59 -1.09 -0.03 0.00 -1.01 0.00 0.00 64.21 62.67 2jj1 n SER 141 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2jj1 s VAL 142 N -1.45 3.76 0.00 0.44 1.01 -1.26 -4.82 120.40 118.08 2jj1 s VAL 142 Ca 0.63 0.90 0.00 0.00 0.00 0.00 0.00 61.98 63.51 2jj1 s VAL 142 Cb -0.63 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.13 2jj1 s VAL 142 CO 0.59 -0.13 0.00 0.54 0.00 0.00 0.00 175.10 176.10 2jj1 n ARG 143 N 7.13 0.00 -2.84 2.72 5.12 -1.26 -4.71 116.66 122.82 2jj1 n ARG 143 Ca 0.17 0.00 -0.41 0.00 -1.93 0.00 0.00 57.85 55.68 2jj1 n ARG 143 Cb 0.44 -0.66 -0.05 0.00 -1.16 0.00 0.00 32.46 31.03 2jj1 n ARG 143 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 2jj1 s GLU 144 N -1.59 4.60 0.70 5.56 2.02 -1.26 -4.26 118.70 124.47 2jj1 s GLU 144 Ca 0.00 1.28 -0.16 0.00 0.02 0.00 0.00 54.97 56.11 2jj1 s GLU 144 Cb 0.00 -3.38 0.02 0.00 0.10 0.00 0.00 34.13 30.87 2jj1 s GLU 144 CO 0.00 0.22 1.23 -2.14 0.02 0.00 0.00 175.26 174.59 2jj1 s PRO 145 N 0.06 2.31 -0.39 0.39 0.02 -1.26 -0.61 135.00 135.53 2jj1 s PRO 145 Ca 0.44 1.85 0.02 0.00 0.02 0.00 0.00 61.00 63.33 2jj1 s PRO 145 Cb -0.22 -1.84 0.11 0.00 0.02 0.00 0.00 34.50 32.57 2jj1 s PRO 145 CO 0.27 -1.72 0.15 1.41 -0.33 0.00 0.00 177.00 176.77 2jj1 s MET 146 N -3.71 1.29 -0.40 5.54 1.75 -0.96 -4.38 119.30 118.42 2jj1 s MET 146 Ca 0.77 -1.81 -0.27 0.00 -1.25 0.00 0.00 55.69 53.13 2jj1 s MET 146 Cb -0.32 -2.64 0.02 0.00 2.84 0.00 0.00 34.83 34.74 2jj1 s MET 146 CO 0.43 -1.04 0.98 -0.65 -0.65 0.00 0.00 175.02 174.09 2jj1 s GLN 147 N 0.76 3.80 0.22 4.11 -1.52 -1.26 -4.39 119.66 121.38 2jj1 s GLN 147 Ca 0.13 0.58 0.10 0.00 -1.95 0.00 0.00 55.36 54.22 2jj1 s GLN 147 Cb -0.21 -3.83 0.12 0.00 -0.22 0.00 0.00 33.01 28.87 2jj1 s GLN 147 CO -0.09 -1.06 1.47 1.79 -0.25 0.00 0.00 175.29 177.14 2jj1 h THR 148 N 5.93 1.49 0.00 -0.19 1.35 -1.94 -3.45 112.91 116.09 2jj1 h THR 148 Ca -0.23 -2.64 0.00 0.00 -0.55 0.00 0.00 66.41 62.99 2jj1 h THR 148 Cb 1.07 2.45 0.00 0.00 -1.73 0.00 0.00 68.15 69.94 2jj1 h THR 148 CO 1.02 0.74 0.00 0.61 -0.25 0.00 0.00 175.52 177.64 2jj1 n GLY 149 N 0.77 1.47 3.67 5.82 0.00 -1.26 -3.74 105.19 111.92 2jj1 n GLY 149 Ca -0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 2jj1 n GLY 149 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jj1 s ILE 150 N -2.96 5.23 0.08 -0.61 1.01 -1.26 -0.67 121.20 122.01 2jj1 s ILE 150 Ca 0.00 0.63 -0.27 0.00 0.00 0.00 0.00 60.65 61.01 2jj1 s ILE 150 Cb 0.00 -3.69 -0.16 0.00 0.01 0.00 0.00 42.46 38.61 2jj1 s ILE 150 CO 0.00 0.27 1.69 0.11 0.00 0.00 0.00 174.94 177.01 2jj1 h LYS 151 N 7.34 -0.39 -1.02 2.79 1.57 -1.94 -0.32 116.57 124.61 2jj1 h LYS 151 Ca -0.37 0.03 0.24 0.00 -1.87 0.00 0.00 60.65 58.68 2jj1 h LYS 151 Cb 1.16 0.09 -0.10 0.00 0.08 0.00 0.00 32.23 33.46 2jj1 h LYS 151 CO 0.71 -0.26 0.64 0.00 -0.57 0.00 0.00 179.45 179.97 2jj1 h ALA 152 N 0.30 2.05 0.03 3.86 0.00 -1.91 -1.36 119.26 122.23 2jj1 h ALA 152 Ca -0.04 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2jj1 h ALA 152 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2jj1 h ALA 152 CO 0.06 -0.45 -0.02 0.28 0.00 0.00 0.00 179.25 179.12 2jj1 h VAL 153 N 0.49 0.41 0.00 0.00 2.07 -1.75 -2.66 116.25 114.81 2jj1 h VAL 153 Ca 0.59 -1.26 -0.01 0.00 0.82 0.00 0.00 66.70 66.84 2jj1 h VAL 153 Cb 1.32 0.77 -0.00 0.00 -1.52 0.00 0.00 31.29 31.86 2jj1 h VAL 153 CO -0.34 0.14 -0.07 0.44 0.02 0.00 0.00 177.57 177.76 2jj1 h ASP 154 N -1.00 0.00 0.00 0.57 3.32 -0.97 -0.36 116.42 117.97 2jj1 h ASP 154 Ca -0.00 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.85 2jj1 h ASP 154 Cb 0.26 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.78 2jj1 h ASP 154 CO 0.01 0.07 -1.18 -1.54 -1.72 0.00 0.00 179.24 174.88 2jj1 n SER 155 N -3.75 1.85 -0.00 6.45 3.41 -0.52 -4.48 113.62 116.58 2jj1 n SER 155 Ca -0.02 0.46 0.08 0.00 -0.26 0.00 0.00 58.87 59.12 2jj1 n SER 155 Cb 0.17 -0.94 -0.10 0.00 -0.26 0.00 0.00 64.21 63.08 2jj1 n SER 155 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2jj1 n LEU 156 N -4.46 0.70 -2.73 1.04 4.77 -1.01 -4.61 117.00 110.71 2jj1 n LEU 156 Ca -0.29 -0.45 -0.09 0.00 -0.03 0.00 0.00 56.01 55.15 2jj1 n LEU 156 Cb 0.62 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.76 2jj1 n LEU 156 CO 0.17 0.18 0.06 0.52 -1.33 0.00 0.00 177.39 176.99 2jj1 n VAL 157 N -1.46 0.56 -2.11 4.08 0.31 -0.21 -4.84 118.33 114.67 2jj1 n VAL 157 Ca 0.02 -2.70 -0.42 0.00 -0.01 0.00 0.00 64.34 61.24 2jj1 n VAL 157 Cb 0.28 0.71 -0.03 0.00 -0.91 0.00 0.00 33.84 33.89 2jj1 n VAL 157 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2jj1 s PRO 158 N -1.98 4.31 0.38 5.55 0.04 -0.81 -4.69 135.00 137.79 2jj1 s PRO 158 Ca 0.27 2.17 0.01 0.00 0.04 0.00 0.00 61.00 63.49 2jj1 s PRO 158 Cb 0.43 -3.18 -0.02 0.00 0.04 0.00 0.00 34.50 31.77 2jj1 s PRO 158 CO -0.01 -0.40 0.58 0.42 0.04 0.00 0.00 177.00 177.63 2jj1 s ILE 159 N 0.48 4.67 0.02 0.56 1.01 -1.26 -4.30 121.20 122.37 2jj1 s ILE 159 Ca 0.61 -0.52 -0.02 0.00 0.00 0.00 0.00 60.65 60.72 2jj1 s ILE 159 Cb -0.39 -3.70 -0.02 0.00 0.01 0.00 0.00 42.46 38.36 2jj1 s ILE 159 CO 0.37 -0.45 0.02 -0.83 0.00 0.00 0.00 174.94 174.04 2jj1 s GLY 160 N -4.11 0.22 -0.28 6.18 0.00 -1.26 -2.27 107.32 105.80 2jj1 s GLY 160 Ca 0.43 -0.58 -0.29 0.00 0.00 0.00 0.00 44.72 44.29 2jj1 s GLY 160 CO 0.36 -0.68 1.80 0.50 0.00 0.00 0.00 173.10 175.09 2jj1 s ARG 161 N -1.93 3.45 0.00 2.90 0.52 0.22 -1.09 118.95 123.01 2jj1 s ARG 161 Ca -0.11 1.58 0.00 0.00 -0.52 0.00 0.00 55.73 56.68 2jj1 s ARG 161 Cb -0.06 -4.18 0.00 0.00 0.52 0.00 0.00 34.95 31.23 2jj1 s ARG 161 CO -0.02 -1.72 0.00 0.41 0.02 0.00 0.00 175.30 173.99 2jj1 n GLY 162 N 5.26 1.16 3.73 -3.53 0.00 -1.26 -4.59 105.19 105.97 2jj1 n GLY 162 Ca 0.23 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.94 2jj1 n GLY 162 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jj1 s GLN 163 N -0.01 1.70 -0.24 1.61 0.74 -0.25 -3.07 119.66 120.14 2jj1 s GLN 163 Ca 0.00 1.13 0.02 0.00 0.05 0.00 0.00 55.36 56.56 2jj1 s GLN 163 Cb 0.00 -1.84 0.05 0.00 1.10 0.00 0.00 33.01 32.32 2jj1 s GLN 163 CO 0.00 -2.02 -0.12 1.03 -0.55 0.00 0.00 175.29 173.62 2jj1 s ARG 164 N -4.86 2.46 -0.20 1.67 3.00 -1.26 -2.26 118.95 117.51 2jj1 s ARG 164 Ca 0.63 -1.20 -0.01 0.00 0.00 0.00 0.00 55.73 55.15 2jj1 s ARG 164 Cb -0.18 -2.84 0.01 0.00 0.00 0.00 0.00 34.95 31.94 2jj1 s ARG 164 CO 0.57 -0.48 -0.14 -2.00 0.00 0.00 0.00 175.30 173.25 2jj1 s GLU 165 N 1.16 3.10 0.19 3.54 2.56 -0.65 0.18 118.70 128.79 2jj1 s GLU 165 Ca -0.05 -0.78 -0.29 0.00 0.00 0.00 0.00 54.97 53.85 2jj1 s GLU 165 Cb -0.18 -2.74 -0.08 0.00 2.00 0.00 0.00 34.13 33.13 2jj1 s GLU 165 CO -0.07 -0.22 0.92 -1.17 -0.56 0.00 0.00 175.26 174.17 2jj1 s LEU 166 N 1.35 4.60 -0.31 2.70 2.96 -0.34 -3.86 118.68 125.78 2jj1 s LEU 166 Ca 0.05 1.86 -0.08 0.00 -0.22 0.00 0.00 54.13 55.73 2jj1 s LEU 166 Cb -0.14 -3.56 0.01 0.00 0.50 0.00 0.00 46.19 43.00 2jj1 s LEU 166 CO -0.09 0.10 0.12 -0.63 -1.32 0.00 0.00 176.35 174.52 2jj1 s ILE 167 N -0.81 4.24 -0.05 6.68 1.01 -0.69 0.10 121.20 131.69 2jj1 s ILE 167 Ca 0.42 -0.63 -0.02 0.00 0.00 0.00 0.00 60.65 60.41 2jj1 s ILE 167 Cb -0.25 -3.20 0.03 0.00 0.01 0.00 0.00 42.46 39.05 2jj1 s ILE 167 CO 0.30 0.03 0.10 -0.51 0.00 0.00 0.00 174.94 174.87 2jj1 s ILE 168 N 1.54 -0.04 -0.05 2.92 2.07 0.35 -1.83 121.20 126.16 2jj1 s ILE 168 Ca 0.03 0.15 -0.31 0.00 -1.41 0.00 0.00 60.65 59.11 2jj1 s ILE 168 Cb -0.17 -0.17 0.12 0.00 0.13 0.00 0.00 42.46 42.36 2jj1 s ILE 168 CO 0.04 0.06 1.34 -0.83 -1.91 0.00 0.00 174.94 173.65 2jj1 s GLY 169 N 0.90 -0.32 1.24 1.50 0.00 -1.17 -0.59 107.32 108.86 2jj1 s GLY 169 Ca -0.07 0.49 -0.18 0.00 0.00 0.00 0.00 44.72 44.96 2jj1 s GLY 169 CO -0.04 2.86 1.03 0.99 0.00 0.00 0.00 173.10 177.94 2jj1 s ASP 170 N -3.39 0.54 0.48 1.64 -0.00 -1.26 -1.81 116.67 112.87 2jj1 s ASP 170 Ca 0.22 0.99 -0.22 0.00 -0.00 0.00 0.00 52.55 53.54 2jj1 s ASP 170 Cb 0.03 -1.48 -0.09 0.00 -0.00 0.00 0.00 42.92 41.39 2jj1 s ASP 170 CO -0.04 -4.40 0.94 -2.11 -0.00 0.00 0.00 175.17 169.56 2jj1 n ARG 171 N -5.00 1.13 -2.89 8.23 1.85 -1.26 -3.31 116.66 115.41 2jj1 n ARG 171 Ca 0.09 0.42 -0.20 0.00 -1.00 0.00 0.00 57.85 57.15 2jj1 n ARG 171 Cb 0.58 -2.02 0.03 0.00 -1.05 0.00 0.00 32.46 30.00 2jj1 n ARG 171 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 2jj1 n GLN 172 N -0.14 -4.22 -0.00 2.89 6.02 -1.26 -4.85 117.38 115.81 2jj1 n GLN 172 Ca 0.11 0.85 0.09 0.00 -0.01 0.00 0.00 57.00 58.04 2jj1 n GLN 172 Cb 0.42 -5.55 -0.11 0.00 1.02 0.00 0.00 30.24 26.02 2jj1 n GLN 172 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2jj1 n THR 173 N -4.38 0.00 0.00 5.09 -2.24 -1.21 -4.97 114.28 106.57 2jj1 n THR 173 Ca -0.12 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 2jj1 n THR 173 Cb 0.62 0.94 0.00 0.00 -2.10 0.00 0.00 70.33 69.79 2jj1 n THR 173 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jj1 n GLY 174 N 1.44 1.83 0.17 3.38 0.00 -1.26 -4.46 105.19 106.28 2jj1 n GLY 174 Ca 0.03 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.90 2jj1 n GLY 174 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jj1 h LYS 175 N 0.00 0.54 -0.27 1.61 1.57 -1.93 -3.05 116.57 115.04 2jj1 h LYS 175 Ca 0.00 -0.39 -0.16 0.00 -1.87 0.00 0.00 60.65 58.23 2jj1 h LYS 175 Cb 0.00 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 2jj1 h LYS 175 CO 0.00 1.01 -0.48 1.15 -0.57 0.00 0.00 179.45 180.57 2jj1 h THR 176 N 0.17 1.29 -0.83 -0.16 2.02 -1.98 -3.05 112.91 110.38 2jj1 h THR 176 Ca -0.01 -1.68 0.21 0.00 0.77 0.00 0.00 66.41 65.70 2jj1 h THR 176 Cb 1.05 1.60 -0.14 0.00 -1.74 0.00 0.00 68.15 68.92 2jj1 h THR 176 CO 0.09 0.54 0.12 0.28 0.37 0.00 0.00 175.52 176.92 2jj1 h SER 177 N 0.57 -0.17 -0.73 4.18 0.02 -1.98 0.63 113.55 116.06 2jj1 h SER 177 Ca 0.03 0.20 -0.02 0.00 -0.84 0.00 0.00 61.79 61.16 2jj1 h SER 177 Cb 1.04 0.31 -0.03 0.00 0.14 0.00 0.00 62.40 63.85 2jj1 h SER 177 CO 0.10 -0.17 0.38 0.40 -1.14 0.00 0.00 176.83 176.41 2jj1 h ILE 178 N 0.16 1.23 0.09 3.27 1.08 -1.42 -1.63 117.51 120.28 2jj1 h ILE 178 Ca 0.49 -0.59 -0.00 0.00 -0.39 0.00 0.00 64.86 64.36 2jj1 h ILE 178 Cb 0.93 0.28 0.00 0.00 -3.07 0.00 0.00 36.82 34.96 2jj1 h ILE 178 CO -0.67 0.26 -0.04 0.00 -0.69 0.00 0.00 178.15 177.01 2jj1 h ALA 179 N 1.19 -0.12 0.34 1.87 0.00 -1.31 -2.80 119.26 118.43 2jj1 h ALA 179 Ca 0.26 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2jj1 h ALA 179 Cb 0.06 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2jj1 h ALA 179 CO -0.04 -0.48 -0.35 0.82 0.00 0.00 0.00 179.25 179.20 2jj1 h ILE 180 N -0.29 0.28 -0.95 0.00 1.08 -0.58 -1.72 117.51 115.34 2jj1 h ILE 180 Ca -0.01 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.49 2jj1 h ILE 180 Cb 0.25 0.28 -0.06 0.00 -3.07 0.00 0.00 36.82 34.22 2jj1 h ILE 180 CO 0.02 0.00 0.62 0.44 -0.69 0.00 0.00 178.15 178.54 2jj1 h ASP 181 N -0.72 1.03 -0.90 1.72 3.45 -1.42 -0.08 116.42 119.51 2jj1 h ASP 181 Ca -0.02 -0.01 0.10 0.00 0.43 0.00 0.00 57.03 57.53 2jj1 h ASP 181 Cb 0.65 -0.23 -0.08 0.00 -0.56 0.00 0.00 39.33 39.11 2jj1 h ASP 181 CO -0.07 0.71 0.54 0.74 -1.57 0.00 0.00 179.24 179.59 2jj1 h THR 182 N 1.20 0.94 -0.23 0.35 2.02 -1.14 0.78 112.91 116.83 2jj1 h THR 182 Ca 0.38 -0.31 -0.08 0.00 0.77 0.00 0.00 66.41 67.17 2jj1 h THR 182 Cb -0.00 -0.04 -0.00 0.00 -1.74 0.00 0.00 68.15 66.36 2jj1 h THR 182 CO -0.12 0.16 -0.18 0.40 0.37 0.00 0.00 175.52 176.16 2jj1 h ILE 183 N 0.90 1.32 -0.02 3.11 2.04 -0.24 -2.95 117.51 121.68 2jj1 h ILE 183 Ca 0.43 -1.31 0.00 0.00 1.00 0.00 0.00 64.86 64.98 2jj1 h ILE 183 Cb 0.37 1.67 -0.00 0.00 -0.74 0.00 0.00 36.82 38.12 2jj1 h ILE 183 CO -0.24 0.40 0.01 0.40 0.00 0.00 0.00 178.15 178.73 2jj1 h ILE 184 N 0.22 0.76 0.00 -0.67 2.04 -0.26 -2.35 117.51 117.25 2jj1 h ILE 184 Ca 0.04 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.78 2jj1 h ILE 184 Cb 0.71 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 2jj1 h ILE 184 CO 0.05 0.00 -0.56 -1.13 0.00 0.00 0.00 178.15 176.51 2jj1 h ASN 185 N 0.00 0.00 1.02 1.72 -1.24 -0.69 -3.25 115.58 113.14 2jj1 h ASN 185 Ca 0.01 0.00 -0.02 0.00 0.71 0.00 0.00 56.30 56.99 2jj1 h ASN 185 Cb 0.04 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.08 2jj1 h ASN 185 CO -0.00 0.56 -0.12 1.56 -1.29 0.00 0.00 177.43 178.14 2jj1 h GLN 186 N 0.00 0.00 -1.00 6.67 1.08 -1.45 -3.10 115.11 117.32 2jj1 h GLN 186 Ca -0.01 0.00 0.19 0.00 -1.45 0.00 0.00 58.65 57.39 2jj1 h GLN 186 Cb 1.00 0.00 -0.19 0.00 -0.05 0.00 0.00 27.48 28.25 2jj1 h GLN 186 CO 0.07 0.12 -0.27 1.17 -0.95 0.00 0.00 178.83 178.97 2jj1 n LYS 187 N -3.25 -0.11 0.27 1.46 4.81 -1.23 -0.21 118.16 119.90 2jj1 n LYS 187 Ca 0.01 1.55 0.18 0.00 -0.87 0.00 0.00 58.31 59.18 2jj1 n LYS 187 Cb 0.38 -2.31 0.96 0.00 0.02 0.00 0.00 35.03 34.07 2jj1 n LYS 187 CO 0.00 0.00 0.00 0.07 1.17 0.00 0.00 177.40 178.64 2jj1 h ARG 188 N 0.00 0.00 0.00 1.64 0.11 -1.80 -0.53 114.38 113.80 2jj1 h ARG 188 Ca 0.46 0.00 -0.39 0.00 0.10 0.00 0.00 59.98 60.15 2jj1 h ARG 188 Cb 0.71 0.00 -0.07 0.00 1.11 0.00 0.00 29.97 31.72 2jj1 h ARG 188 CO -1.02 0.00 -2.46 1.19 0.10 0.00 0.00 179.97 177.78 2jj1 n PHE 189 N -2.78 0.02 0.19 4.08 0.99 0.70 -4.26 117.46 116.42 2jj1 n PHE 189 Ca -0.02 0.01 0.04 0.00 -0.00 0.00 0.00 57.45 57.48 2jj1 n PHE 189 Cb 0.08 -1.00 0.40 0.00 -1.00 0.00 0.00 39.48 37.95 2jj1 n PHE 189 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 176.76 175.85 2jj1 h ASN 190 N 0.00 0.00 0.56 4.37 2.35 -0.05 -1.57 115.58 121.24 2jj1 h ASN 190 Ca -0.57 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.18 2jj1 h ASN 190 Cb 1.94 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.31 2jj1 h ASN 190 CO -0.07 0.35 -0.24 0.47 -1.65 0.00 0.00 177.43 176.28 2jj1 n ASP 191 N -3.89 0.42 -3.05 5.81 10.43 -0.29 -4.90 116.55 121.09 2jj1 n ASP 191 Ca -0.01 -0.22 -0.16 0.00 2.57 0.00 0.00 54.79 56.97 2jj1 n ASP 191 Cb 0.42 -0.04 0.12 0.00 1.84 0.00 0.00 41.12 43.46 2jj1 n ASP 191 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2jj1 n GLY 192 N 1.42 -1.76 0.47 0.44 0.00 -0.59 -5.01 105.19 100.16 2jj1 n GLY 192 Ca 0.09 -1.62 0.06 0.00 0.00 0.00 0.00 46.02 44.55 2jj1 n GLY 192 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jj1 n THR 193 N -3.26 1.54 -3.21 2.61 -2.24 -1.26 -4.89 114.28 103.56 2jj1 n THR 193 Ca 0.09 -1.49 -0.44 0.00 -2.27 0.00 0.00 64.05 59.94 2jj1 n THR 193 Cb 0.32 0.15 -0.06 0.00 -2.10 0.00 0.00 70.33 68.63 2jj1 n THR 193 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2jj1 s ASP 194 N -1.62 6.20 0.34 3.42 2.15 -1.26 -4.93 116.67 120.97 2jj1 s ASP 194 Ca 0.25 -1.13 0.06 0.00 0.43 0.00 0.00 52.55 52.17 2jj1 s ASP 194 Cb 0.19 -2.26 0.63 0.00 -0.30 0.00 0.00 42.92 41.17 2jj1 s ASP 194 CO 0.08 -0.86 1.85 -0.33 -0.17 0.00 0.00 175.17 175.74 2jj1 h GLU 195 N 8.96 0.40 -0.74 4.34 4.39 -1.93 -2.74 114.58 127.26 2jj1 h GLU 195 Ca -0.28 -0.10 0.17 0.00 0.34 0.00 0.00 59.36 59.48 2jj1 h GLU 195 Cb 1.10 -0.05 -0.12 0.00 -0.10 0.00 0.00 28.75 29.58 2jj1 h GLU 195 CO 0.97 0.52 0.08 0.87 -1.16 0.00 0.00 179.01 180.28 2jj1 h LYS 196 N 0.37 0.16 0.00 2.33 1.79 -1.97 -3.14 116.57 116.11 2jj1 h LYS 196 Ca 0.07 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.53 2jj1 h LYS 196 Cb 0.43 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.04 2jj1 h LYS 196 CO 0.02 0.11 -0.73 0.87 -1.08 0.00 0.00 179.45 178.64 2jj1 h LYS 197 N 0.16 0.00 -7.04 3.15 1.57 -1.86 -3.48 116.57 109.08 2jj1 h LYS 197 Ca 0.41 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.63 2jj1 h LYS 197 Cb 0.72 0.00 0.15 0.00 0.08 0.00 0.00 32.23 33.19 2jj1 h LYS 197 CO -0.59 0.00 0.49 1.63 -0.57 0.00 0.00 179.45 180.41 2jj1 n LYS 198 N -2.44 1.30 -3.58 3.15 5.02 -1.18 -4.85 118.16 115.59 2jj1 n LYS 198 Ca 0.02 0.49 -0.17 0.00 -2.02 0.00 0.00 58.31 56.63 2jj1 n LYS 198 Cb 0.49 -2.50 -0.14 0.00 -0.02 0.00 0.00 35.03 32.87 2jj1 n LYS 198 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2jj1 s LEU 199 N -3.67 -0.12 0.02 -0.35 2.96 -1.26 -4.44 118.68 111.82 2jj1 s LEU 199 Ca 0.78 0.06 -0.21 0.00 -0.22 0.00 0.00 54.13 54.54 2jj1 s LEU 199 Cb -0.40 0.39 -0.06 0.00 0.50 0.00 0.00 46.19 46.62 2jj1 s LEU 199 CO 0.44 -0.29 0.60 -0.31 -1.32 0.00 0.00 176.35 175.48 2jj1 s TYR 200 N 2.33 3.71 0.06 5.38 1.51 -0.15 -4.90 117.35 125.29 2jj1 s TYR 200 Ca 0.05 1.23 0.05 0.00 -1.01 0.00 0.00 57.07 57.38 2jj1 s TYR 200 Cb -0.14 -2.60 -0.04 0.00 -0.11 0.00 0.00 41.96 39.07 2jj1 s TYR 200 CO -0.10 0.40 -0.05 0.00 -1.11 0.00 0.00 175.55 174.69 2jj1 s ILE 202 N -1.16 0.74 -0.42 0.00 1.09 0.38 -0.94 121.20 120.88 2jj1 s ILE 202 Ca 0.21 -0.66 -0.17 0.00 -1.10 0.00 0.00 60.65 58.93 2jj1 s ILE 202 Cb -0.11 -1.17 0.03 0.00 -1.06 0.00 0.00 42.46 40.14 2jj1 s ILE 202 CO 0.13 -0.15 0.41 -0.47 -0.10 0.00 0.00 174.94 174.76 2jj1 s TYR 203 N 1.76 3.18 -0.43 3.97 5.04 0.22 -1.02 117.35 130.08 2jj1 s TYR 203 Ca -0.02 -0.46 -0.19 0.00 -2.44 0.00 0.00 57.07 53.97 2jj1 s TYR 203 Cb -0.17 -2.87 0.02 0.00 0.35 0.00 0.00 41.96 39.29 2jj1 s TYR 203 CO -0.07 -0.70 0.55 0.08 -1.34 0.00 0.00 175.55 174.07 2jj1 s VAL 204 N 2.03 4.95 -0.38 3.14 1.01 -0.25 -1.11 120.40 129.79 2jj1 s VAL 204 Ca 0.10 -0.12 -0.15 0.00 0.00 0.00 0.00 61.98 61.82 2jj1 s VAL 204 Cb -0.18 -4.13 0.01 0.00 0.00 0.00 0.00 36.38 32.07 2jj1 s VAL 204 CO 0.12 -0.52 0.31 0.00 0.00 0.00 0.00 175.10 175.01 2jj1 s ALA 205 N 2.50 3.48 -0.25 5.51 0.00 -0.44 -0.05 121.76 132.51 2jj1 s ALA 205 Ca 0.17 -1.54 -0.06 0.00 0.00 0.00 0.00 51.96 50.53 2jj1 s ALA 205 Cb -0.16 -2.84 -0.02 0.00 0.00 0.00 0.00 23.12 20.11 2jj1 s ALA 205 CO 0.16 -1.29 0.04 0.42 0.00 0.00 0.00 175.76 175.09 2jj1 s ILE 206 N 1.78 4.02 0.00 0.00 1.09 0.13 -0.57 121.20 127.65 2jj1 s ILE 206 Ca 0.07 -0.33 0.00 0.00 -1.10 0.00 0.00 60.65 59.29 2jj1 s ILE 206 Cb -0.18 -2.90 0.00 0.00 -1.06 0.00 0.00 42.46 38.32 2jj1 s ILE 206 CO 0.11 0.32 0.00 0.61 -0.10 0.00 0.00 174.94 175.88 2jj1 n GLY 207 N 4.88 0.94 3.78 6.18 0.00 -0.44 -3.21 105.19 117.32 2jj1 n GLY 207 Ca -0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.57 2jj1 n GLY 207 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jj1 s GLN 208 N -0.01 0.83 0.20 1.61 -0.21 -1.26 -4.12 119.66 116.70 2jj1 s GLN 208 Ca 0.00 0.20 -0.09 0.00 0.02 0.00 0.00 55.36 55.48 2jj1 s GLN 208 Cb 0.00 -1.81 -0.07 0.00 1.00 0.00 0.00 33.01 32.13 2jj1 s GLN 208 CO 0.00 -2.39 0.51 -1.59 -2.12 0.00 0.00 175.29 169.70 2jj1 s LYS 209 N -5.34 3.78 0.26 2.91 -2.85 -1.26 -0.69 119.74 116.55 2jj1 s LYS 209 Ca 0.65 0.22 -0.03 0.00 -1.00 0.00 0.00 55.97 55.82 2jj1 s LYS 209 Cb -0.13 -2.73 0.41 0.00 -2.06 0.00 0.00 37.83 33.31 2jj1 s LYS 209 CO 0.54 0.37 1.85 0.00 0.10 0.00 0.00 175.35 178.21 2jj1 h ARG 210 N 2.76 0.98 0.00 1.78 3.08 -1.98 -1.39 114.38 119.61 2jj1 h ARG 210 Ca -0.47 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 59.48 2jj1 h ARG 210 Cb 1.17 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.99 2jj1 h ARG 210 CO 0.69 0.65 -0.22 0.66 -1.07 0.00 0.00 179.97 180.68 2jj1 h SER 211 N 1.01 0.00 -0.12 7.04 4.64 -1.99 0.21 113.55 124.34 2jj1 h SER 211 Ca 0.42 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.64 2jj1 h SER 211 Cb 0.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 2jj1 h SER 211 CO -0.20 0.22 -0.32 0.74 -0.87 0.00 0.00 176.83 176.40 2jj1 h THR 212 N 0.00 1.38 -0.99 2.95 2.02 -1.69 -2.80 112.91 113.78 2jj1 h THR 212 Ca -0.00 -1.62 0.04 0.00 0.77 0.00 0.00 66.41 65.59 2jj1 h THR 212 Cb 0.54 2.11 -0.06 0.00 -1.74 0.00 0.00 68.15 69.00 2jj1 h THR 212 CO 0.03 0.48 0.65 0.58 0.37 0.00 0.00 175.52 177.63 2jj1 h VAL 213 N 0.01 1.17 -0.28 3.16 2.07 -0.90 -2.28 116.25 119.21 2jj1 h VAL 213 Ca -0.01 -0.43 -0.00 0.00 0.82 0.00 0.00 66.70 67.08 2jj1 h VAL 213 Cb 0.93 -0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 2jj1 h VAL 213 CO 0.07 0.23 0.15 0.00 0.02 0.00 0.00 177.57 178.04 2jj1 h ALA 214 N 1.40 0.35 -0.90 1.67 0.00 -0.95 -0.58 119.26 120.25 2jj1 h ALA 214 Ca 0.39 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2jj1 h ALA 214 Cb -0.00 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 2jj1 h ALA 214 CO -0.12 -0.12 0.57 1.96 0.00 0.00 0.00 179.25 181.54 2jj1 h GLN 215 N 0.33 1.19 0.23 0.00 1.08 -1.41 -1.13 115.11 115.41 2jj1 h GLN 215 Ca 0.10 -0.09 0.00 0.00 -1.45 0.00 0.00 58.65 57.22 2jj1 h GLN 215 Cb 0.05 -0.26 -0.04 0.00 -0.05 0.00 0.00 27.48 27.18 2jj1 h GLN 215 CO -0.02 0.81 -0.50 1.25 -0.95 0.00 0.00 178.83 179.43 2jj1 h LEU 216 N 1.22 -1.45 -1.44 1.46 7.12 -0.76 -1.25 115.31 120.21 2jj1 h LEU 216 Ca 0.33 0.14 0.00 0.00 0.13 0.00 0.00 57.88 58.48 2jj1 h LEU 216 Cb -0.11 0.52 0.00 0.00 -0.53 0.00 0.00 40.66 40.54 2jj1 h LEU 216 CO -0.07 -0.56 0.00 -0.37 -0.13 0.00 0.00 178.44 177.31 2jj1 h VAL 217 N -0.79 0.00 -0.36 1.05 -1.51 -0.78 -1.76 116.25 112.10 2jj1 h VAL 217 Ca -0.02 -0.48 -0.08 0.00 -1.23 0.00 0.00 66.70 64.89 2jj1 h VAL 217 Cb 0.75 1.46 -0.01 0.00 -2.13 0.00 0.00 31.29 31.36 2jj1 h VAL 217 CO -0.21 0.00 -0.08 0.50 -1.23 0.00 0.00 177.57 176.55 2jj1 h LYS 218 N 0.00 0.68 -0.54 5.19 1.63 -0.93 -0.74 116.57 121.87 2jj1 h LYS 218 Ca 0.00 -0.26 -0.03 0.00 -0.85 0.00 0.00 60.65 59.51 2jj1 h LYS 218 Cb 0.49 -0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 32.06 2jj1 h LYS 218 CO 0.00 0.84 0.20 -0.09 -3.45 0.00 0.00 179.45 176.95 2jj1 h ARG 219 N 0.48 0.81 -0.02 1.90 9.65 -0.39 0.11 114.38 126.91 2jj1 h ARG 219 Ca 0.09 -0.15 -0.11 0.00 -1.10 0.00 0.00 59.98 58.71 2jj1 h ARG 219 Cb 0.59 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 29.02 2jj1 h ARG 219 CO 0.03 0.72 -0.49 -0.07 2.80 0.00 0.00 179.97 182.97 2jj1 h LEU 220 N 0.73 0.05 -0.13 3.80 3.38 -1.37 -2.12 115.31 119.65 2jj1 h LEU 220 Ca 0.18 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 58.04 2jj1 h LEU 220 Cb 0.22 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2jj1 h LEU 220 CO -0.01 0.53 -0.27 0.74 0.09 0.00 0.00 178.44 179.52 2jj1 h THR 221 N 0.04 1.37 -0.99 0.22 2.02 -0.80 0.48 112.91 115.25 2jj1 h THR 221 Ca -0.00 -1.54 0.06 0.00 0.77 0.00 0.00 66.41 65.70 2jj1 h THR 221 Cb 0.87 2.04 -0.06 0.00 -1.74 0.00 0.00 68.15 69.26 2jj1 h THR 221 CO 0.07 0.45 0.64 0.44 0.37 0.00 0.00 175.52 177.49 2jj1 h ASP 222 N 0.00 1.03 -0.28 4.18 3.32 -0.67 -0.06 116.42 123.94 2jj1 h ASP 222 Ca 0.00 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.06 2jj1 h ASP 222 Cb 0.86 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.19 2jj1 h ASP 222 CO 0.06 0.67 0.00 0.00 -1.72 0.00 0.00 179.24 178.25 2jj1 n ALA 223 N -2.36 2.71 -4.09 3.45 0.00 -0.81 -4.90 120.51 114.50 2jj1 n ALA 223 Ca 0.15 -0.65 -0.33 0.00 0.00 0.00 0.00 53.44 52.60 2jj1 n ALA 223 Cb 0.16 -1.01 -0.01 0.00 0.00 0.00 0.00 19.45 18.60 2jj1 n ALA 223 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2jj1 n ASP 224 N 0.35 -3.59 -0.00 0.00 2.03 -0.04 -4.84 116.55 110.46 2jj1 n ASP 224 Ca 0.11 -0.93 0.09 0.00 0.52 0.00 0.00 54.79 54.58 2jj1 n ASP 224 Cb 0.42 -3.18 -0.13 0.00 -0.72 0.00 0.00 41.12 37.51 2jj1 n ASP 224 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jj1 n ALA 225 N -4.49 3.58 0.25 -1.67 0.00 0.16 -4.52 120.51 113.82 2jj1 n ALA 225 Ca 0.03 -0.50 0.09 0.00 0.00 0.00 0.00 53.44 53.06 2jj1 n ALA 225 Cb 0.52 -0.68 0.64 0.00 0.00 0.00 0.00 19.45 19.93 2jj1 n ALA 225 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 2jj1 h MET 226 N 0.00 0.00 0.00 0.00 2.86 -1.73 -3.10 114.93 112.97 2jj1 h MET 226 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2jj1 h MET 226 Cb 0.68 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.34 2jj1 h MET 226 CO 0.00 0.13 0.00 1.57 1.06 0.00 0.00 176.91 179.67 2jj1 h LYS 227 N 0.00 0.00 0.00 1.72 2.10 -1.89 -1.54 116.57 116.96 2jj1 h LYS 227 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2jj1 h LYS 227 Cb 0.26 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.59 2jj1 h LYS 227 CO 0.02 0.00 -0.04 2.48 -2.00 0.00 0.00 179.45 179.90 2jj1 n TYR 228 N -3.04 0.00 -5.01 0.07 0.18 -1.17 -4.09 117.16 104.09 2jj1 n TYR 228 Ca -0.02 -0.87 -0.29 0.00 1.88 0.00 0.00 57.90 58.61 2jj1 n TYR 228 Cb 0.16 -0.13 -0.16 0.00 -0.38 0.00 0.00 39.34 38.83 2jj1 n TYR 228 CO 0.00 0.00 0.00 0.99 -2.08 0.00 0.00 176.86 175.77 2jj1 s THR 229 N -2.46 1.70 -0.22 -3.48 2.01 -0.62 -1.29 115.64 111.29 2jj1 s THR 229 Ca 0.26 -0.86 -0.07 0.00 0.31 0.00 0.00 61.69 61.34 2jj1 s THR 229 Cb 0.23 -1.46 -0.03 0.00 0.01 0.00 0.00 72.50 71.25 2jj1 s THR 229 CO 0.02 0.48 0.06 -0.63 -0.69 0.00 0.00 174.62 173.86 2jj1 s ILE 230 N 0.06 4.44 -0.30 1.82 1.01 -0.12 -1.96 121.20 126.16 2jj1 s ILE 230 Ca -0.07 -0.14 -0.11 0.00 0.00 0.00 0.00 60.65 60.33 2jj1 s ILE 230 Cb -0.13 -3.04 -0.04 0.00 0.01 0.00 0.00 42.46 39.26 2jj1 s ILE 230 CO 0.04 0.40 0.20 -0.69 0.00 0.00 0.00 174.94 174.89 2jj1 s VAL 231 N 1.04 5.24 -0.40 2.92 1.01 -0.82 -0.61 120.40 128.79 2jj1 s VAL 231 Ca 0.04 -0.00 -0.06 0.00 0.00 0.00 0.00 61.98 61.96 2jj1 s VAL 231 Cb -0.14 -3.57 0.09 0.00 0.00 0.00 0.00 36.38 32.76 2jj1 s VAL 231 CO 0.03 0.16 0.20 -0.69 0.00 0.00 0.00 175.10 174.79 2jj1 s VAL 232 N 1.74 3.69 -0.27 2.92 1.01 -0.27 -1.27 120.40 127.95 2jj1 s VAL 232 Ca 0.07 -1.63 0.01 0.00 0.00 0.00 0.00 61.98 60.43 2jj1 s VAL 232 Cb -0.16 -3.33 0.06 0.00 0.00 0.00 0.00 36.38 32.94 2jj1 s VAL 232 CO 0.10 -0.51 -0.07 -0.55 0.00 0.00 0.00 175.10 174.07 2jj1 s SER 233 N 1.89 4.60 -0.40 3.32 0.15 -0.22 -1.33 113.70 121.71 2jj1 s SER 233 Ca 0.03 -1.36 -0.02 0.00 0.70 0.00 0.00 55.95 55.30 2jj1 s SER 233 Cb -0.22 -1.61 0.11 0.00 -1.71 0.00 0.00 66.02 62.59 2jj1 s SER 233 CO -0.01 -0.22 0.18 0.00 1.20 0.00 0.00 173.24 174.40 2jj1 s ALA 234 N 1.15 3.12 0.54 5.45 0.00 0.26 -4.22 121.76 128.07 2jj1 s ALA 234 Ca -0.08 -2.53 0.03 0.00 0.00 0.00 0.00 51.96 49.39 2jj1 s ALA 234 Cb -0.20 -2.35 0.09 0.00 0.00 0.00 0.00 23.12 20.66 2jj1 s ALA 234 CO -0.04 -1.78 0.66 0.25 0.00 0.00 0.00 175.76 174.85 2jj1 n THR 235 N 4.55 0.00 0.30 0.00 -2.24 -1.26 -1.33 114.28 114.29 2jj1 n THR 235 Ca -0.02 -1.27 0.15 0.00 -2.27 0.00 0.00 64.05 60.64 2jj1 n THR 235 Cb 0.41 -0.85 0.90 0.00 -2.10 0.00 0.00 70.33 68.70 2jj1 n THR 235 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jj1 h ALA 236 N -0.19 1.56 -0.56 6.98 0.00 -1.06 0.21 119.26 126.19 2jj1 h ALA 236 Ca -0.22 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2jj1 h ALA 236 Cb 0.90 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2jj1 h ALA 236 CO 0.27 -0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.39 2jj1 n SER 237 N -3.89 3.63 -4.73 0.00 3.41 -1.26 -4.90 113.62 105.88 2jj1 n SER 237 Ca -0.03 -1.98 -0.41 0.00 -0.26 0.00 0.00 58.87 56.19 2jj1 n SER 237 Cb 0.08 -0.37 -0.04 0.00 -0.26 0.00 0.00 64.21 63.62 2jj1 n SER 237 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2jj1 s ASP 238 N -1.14 7.27 0.67 4.04 1.11 0.74 -5.01 116.67 124.35 2jj1 s ASP 238 Ca 0.42 1.53 -0.17 0.00 0.18 0.00 0.00 52.55 54.50 2jj1 s ASP 238 Cb 0.22 -2.51 -0.08 0.00 1.07 0.00 0.00 42.92 41.62 2jj1 s ASP 238 CO 0.30 -0.11 0.27 0.00 1.18 0.00 0.00 175.17 176.81 2jj1 n ALA 239 N 3.32 -2.11 -0.22 5.23 0.00 -1.26 -4.69 120.51 120.79 2jj1 n ALA 239 Ca 0.01 -0.19 -0.07 0.00 0.00 0.00 0.00 53.44 53.19 2jj1 n ALA 239 Cb 0.50 -1.69 -0.02 0.00 0.00 0.00 0.00 19.45 18.25 2jj1 n ALA 239 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jj1 h ALA 240 N -0.22 -0.20 0.00 0.00 0.00 -1.91 -1.81 119.26 115.12 2jj1 h ALA 240 Ca -0.44 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 2jj1 h ALA 240 Cb 1.38 0.91 -0.00 0.00 0.00 0.00 0.00 17.79 20.08 2jj1 h ALA 240 CO 0.42 -0.77 -0.00 -1.00 0.00 0.00 0.00 179.25 177.90 2jj1 h PRO 241 N -0.19 0.00 0.00 0.00 0.13 -1.87 -1.32 132.00 128.75 2jj1 h PRO 241 Ca 0.21 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.34 2jj1 h PRO 241 Cb 0.56 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.69 2jj1 h PRO 241 CO -0.71 0.00 -0.00 -0.07 -0.23 0.00 0.00 178.00 176.99 2jj1 h LEU 242 N 0.00 -0.00 -1.66 1.56 3.38 -1.66 -2.24 115.31 114.69 2jj1 h LEU 242 Ca -0.00 -0.67 0.15 0.00 0.09 0.00 0.00 57.88 57.45 2jj1 h LEU 242 Cb 0.16 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 2jj1 h LEU 242 CO 0.00 0.67 0.48 1.56 0.09 0.00 0.00 178.44 181.24 2jj1 h GLN 243 N -0.67 0.33 0.09 1.13 4.20 -1.15 -0.38 115.11 118.65 2jj1 h GLN 243 Ca -0.00 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.69 2jj1 h GLN 243 Cb 0.67 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.38 2jj1 h GLN 243 CO 0.00 0.22 -0.04 -0.92 -0.67 0.00 0.00 178.83 177.42 2jj1 h TYR 244 N 0.34 -0.11 0.04 2.96 3.20 -1.20 -3.30 116.97 118.90 2jj1 h TYR 244 Ca 0.35 -0.00 -0.24 0.00 3.14 0.00 0.00 58.73 61.97 2jj1 h TYR 244 Cb 0.87 0.04 0.01 0.00 1.54 0.00 0.00 36.73 39.18 2jj1 h TYR 244 CO -0.00 0.13 -1.04 -0.07 -1.64 0.00 0.00 178.16 175.54 2jj1 h LEU 245 N -0.34 0.55 -0.54 2.82 3.38 -0.69 -3.38 115.31 117.11 2jj1 h LEU 245 Ca -0.01 -0.47 0.06 0.00 0.09 0.00 0.00 57.88 57.55 2jj1 h LEU 245 Cb 0.29 -0.17 -0.07 0.00 0.09 0.00 0.00 40.66 40.80 2jj1 h LEU 245 CO 0.02 1.29 -0.27 0.00 0.09 0.00 0.00 178.44 179.57 2jj1 n ALA 246 N -2.55 -0.23 -0.32 1.53 0.00 -0.24 0.31 120.51 119.00 2jj1 n ALA 246 Ca -0.08 0.49 0.02 0.00 0.00 0.00 0.00 53.44 53.87 2jj1 n ALA 246 Cb 0.89 -0.14 0.16 0.00 0.00 0.00 0.00 19.45 20.36 2jj1 n ALA 246 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2jj1 h PRO 247 N 0.00 0.94 -0.22 0.00 0.11 -1.77 -0.17 132.00 130.89 2jj1 h PRO 247 Ca 0.13 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 66.16 2jj1 h PRO 247 Cb 0.26 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.15 2jj1 h PRO 247 CO -0.52 0.62 0.06 1.88 -0.21 0.00 0.00 178.00 179.83 2jj1 h TYR 248 N 0.97 0.37 -0.40 0.65 -1.99 -0.40 0.18 116.97 116.35 2jj1 h TYR 248 Ca 0.41 -0.04 0.08 0.00 2.00 0.00 0.00 58.73 61.17 2jj1 h TYR 248 Cb 0.25 -0.10 -0.08 0.00 2.00 0.00 0.00 36.73 38.80 2jj1 h TYR 248 CO -0.03 0.45 -0.10 0.77 -0.00 0.00 0.00 178.16 179.25 2jj1 h SER 249 N 0.18 -0.38 -0.60 3.88 0.02 -0.19 0.20 113.55 116.66 2jj1 h SER 249 Ca 0.07 0.12 -0.09 0.00 -0.84 0.00 0.00 61.79 61.05 2jj1 h SER 249 Cb 0.27 0.25 -0.02 0.00 0.14 0.00 0.00 62.40 63.04 2jj1 h SER 249 CO 0.00 -0.14 0.03 1.23 -1.14 0.00 0.00 176.83 176.82 2jj1 h GLY 250 N -0.01 1.13 0.93 -3.77 0.00 -0.91 -2.23 103.07 98.21 2jj1 h GLY 250 Ca 0.19 -0.79 0.01 0.00 0.00 0.00 0.00 47.33 46.74 2jj1 h GLY 250 CO -0.41 0.73 0.15 0.00 0.00 0.00 0.00 176.54 177.01 2jj1 h SER 252 N 0.32 1.10 -0.59 0.00 0.02 -0.46 -1.80 113.55 112.13 2jj1 h SER 252 Ca 0.11 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.03 2jj1 h SER 252 Cb 0.01 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.26 2jj1 h SER 252 CO -0.06 0.76 0.32 0.24 -1.14 0.00 0.00 176.83 176.96 2jj1 h MET 253 N 1.28 0.86 0.00 3.45 2.86 -0.82 -1.53 114.93 121.02 2jj1 h MET 253 Ca 0.39 -0.09 0.00 0.00 -2.06 0.00 0.00 59.70 57.94 2jj1 h MET 253 Cb -0.02 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 31.47 2jj1 h MET 253 CO -0.12 0.64 0.00 0.41 1.06 0.00 0.00 176.91 178.90 2jj1 n GLY 254 N -1.22 -1.49 0.07 8.32 0.00 -0.61 -3.46 105.19 106.81 2jj1 n GLY 254 Ca 0.06 -0.05 -0.06 0.00 0.00 0.00 0.00 46.02 45.97 2jj1 n GLY 254 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2jj1 h GLU 255 N 0.00 0.00 -0.78 1.61 5.08 -0.43 -2.88 114.58 117.18 2jj1 h GLU 255 Ca 0.00 0.00 0.16 0.00 -1.00 0.00 0.00 59.36 58.52 2jj1 h GLU 255 Cb 0.54 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.69 2jj1 h GLU 255 CO 0.00 0.81 0.30 -0.92 -1.00 0.00 0.00 179.01 178.20 2jj1 h TYR 256 N 0.00 0.50 0.33 4.33 3.20 -1.54 0.69 116.97 124.47 2jj1 h TYR 256 Ca -0.08 0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.81 2jj1 h TYR 256 Cb 1.79 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 39.96 2jj1 h TYR 256 CO 0.00 0.03 -0.16 0.74 -1.64 0.00 0.00 178.16 177.13 2jj1 h PHE 257 N 0.42 -0.41 -0.81 -3.82 -1.00 -1.72 -2.40 116.94 107.19 2jj1 h PHE 257 Ca 0.44 -0.01 0.19 0.00 2.81 0.00 0.00 57.97 61.40 2jj1 h PHE 257 Cb 0.70 0.13 -0.13 0.00 3.61 0.00 0.00 35.95 40.27 2jj1 h PHE 257 CO -0.18 -0.07 0.20 -0.09 -1.61 0.00 0.00 178.31 176.57 2jj1 h ARG 258 N -0.83 0.24 0.00 1.51 2.43 -1.21 0.96 114.38 117.47 2jj1 h ARG 258 Ca -0.04 -0.01 -0.20 0.00 -0.81 0.00 0.00 59.98 58.91 2jj1 h ARG 258 Cb 0.52 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.99 2jj1 h ARG 258 CO 0.07 0.16 -0.96 -0.44 -1.51 0.00 0.00 179.97 177.29 2jj1 h ASP 259 N 0.25 0.00 -1.70 -3.80 3.32 -0.94 -3.29 116.42 110.26 2jj1 h ASP 259 Ca 0.48 0.00 -0.72 0.00 0.02 0.00 0.00 57.03 56.81 2jj1 h ASP 259 Cb 0.89 0.00 -0.26 0.00 0.22 0.00 0.00 39.33 40.18 2jj1 h ASP 259 CO -0.58 0.96 0.97 0.59 -1.72 0.00 0.00 179.24 179.46 2jj1 n ASN 260 N -3.38 7.48 0.00 6.45 3.02 -0.91 -4.74 115.26 123.19 2jj1 n ASN 260 Ca -0.00 -3.77 0.00 0.00 -0.03 0.00 0.00 54.58 50.78 2jj1 n ASN 260 Cb 0.91 -1.06 0.00 0.00 -0.61 0.00 0.00 39.78 39.02 2jj1 n ASN 260 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jj1 n GLY 261 N -0.50 0.31 3.75 7.41 0.00 -1.19 -4.92 105.19 110.05 2jj1 n GLY 261 Ca 0.55 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.32 2jj1 n GLY 261 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jj1 s LYS 262 N -0.86 2.22 -0.11 1.61 1.02 0.29 -4.30 119.74 119.60 2jj1 s LYS 262 Ca 0.00 -1.88 0.01 0.00 0.02 0.00 0.00 55.97 54.12 2jj1 s LYS 262 Cb 0.00 -1.96 -0.01 0.00 -0.52 0.00 0.00 37.83 35.34 2jj1 s LYS 262 CO 0.00 -0.15 -0.15 -1.01 -0.92 0.00 0.00 175.35 173.11 2jj1 s HIS 263 N -2.62 2.74 0.07 3.18 3.76 -1.26 -1.43 115.29 119.73 2jj1 s HIS 263 Ca 0.39 -0.66 0.06 0.00 -0.15 0.00 0.00 55.06 54.70 2jj1 s HIS 263 Cb 0.04 -1.79 -0.03 0.00 1.11 0.00 0.00 32.58 31.91 2jj1 s HIS 263 CO 0.22 -0.21 -0.17 0.00 -0.85 0.00 0.00 174.74 173.73 2jj1 s ALA 264 N 0.22 1.39 -0.03 -1.40 0.00 -0.32 -0.98 121.76 120.64 2jj1 s ALA 264 Ca -0.10 -1.05 0.07 0.00 0.00 0.00 0.00 51.96 50.88 2jj1 s ALA 264 Cb -0.16 -0.17 -0.01 0.00 0.00 0.00 0.00 23.12 22.78 2jj1 s ALA 264 CO 0.06 0.25 -0.24 -1.17 0.00 0.00 0.00 175.76 174.66 2jj1 s LEU 265 N -1.67 2.04 -0.06 0.00 2.96 0.14 -0.73 118.68 121.35 2jj1 s LEU 265 Ca 0.02 -0.45 0.01 0.00 -0.22 0.00 0.00 54.13 53.49 2jj1 s LEU 265 Cb -0.10 -1.25 0.02 0.00 0.50 0.00 0.00 46.19 45.36 2jj1 s LEU 265 CO 0.03 0.27 -0.07 -0.51 -1.32 0.00 0.00 176.35 174.74 2jj1 s ILE 266 N -0.38 0.79 -0.21 6.68 2.07 0.18 -0.47 121.20 129.86 2jj1 s ILE 266 Ca 0.04 -0.25 -0.05 0.00 -1.41 0.00 0.00 60.65 58.99 2jj1 s ILE 266 Cb -0.11 -0.78 -0.02 0.00 0.13 0.00 0.00 42.46 41.68 2jj1 s ILE 266 CO 0.01 0.29 -0.01 -0.63 -1.91 0.00 0.00 174.94 172.69 2jj1 s ILE 267 N 1.01 3.81 -0.40 2.00 1.09 -0.19 0.40 121.20 128.91 2jj1 s ILE 267 Ca -0.09 -0.36 -0.15 0.00 -1.10 0.00 0.00 60.65 58.95 2jj1 s ILE 267 Cb -0.14 -2.73 0.02 0.00 -1.06 0.00 0.00 42.46 38.55 2jj1 s ILE 267 CO -0.00 0.42 0.30 -0.31 -0.10 0.00 0.00 174.94 175.25 2jj1 s TYR 268 N 1.17 3.23 -0.45 3.97 1.51 -0.99 -1.09 117.35 124.71 2jj1 s TYR 268 Ca 0.03 -0.54 0.02 0.00 -1.01 0.00 0.00 57.07 55.57 2jj1 s TYR 268 Cb -0.14 -2.60 0.14 0.00 -0.11 0.00 0.00 41.96 39.24 2jj1 s TYR 268 CO 0.01 -0.58 0.24 0.34 -1.11 0.00 0.00 175.55 174.45 2jj1 s ASP 269 N 1.69 3.70 0.30 2.29 -1.08 0.93 -0.05 116.67 124.46 2jj1 s ASP 269 Ca 0.06 -2.66 0.03 0.00 -0.52 0.00 0.00 52.55 49.46 2jj1 s ASP 269 Cb -0.19 -1.09 -0.04 0.00 -1.46 0.00 0.00 42.92 40.15 2jj1 s ASP 269 CO 0.10 -0.26 0.16 1.51 0.52 0.00 0.00 175.17 177.20 2jj1 s ASP 270 N 0.29 1.54 0.12 -0.34 1.47 -1.20 -0.69 116.67 117.86 2jj1 s ASP 270 Ca 0.18 -1.56 0.14 0.00 1.18 0.00 0.00 52.55 52.49 2jj1 s ASP 270 Cb -0.24 0.39 -0.10 0.00 -0.34 0.00 0.00 42.92 42.62 2jj1 s ASP 270 CO 0.00 -0.89 1.04 -0.07 0.68 0.00 0.00 175.17 175.93 2jj1 h LEU 271 N 2.21 0.00 -0.28 2.11 3.38 -0.75 -3.13 115.31 118.86 2jj1 h LEU 271 Ca -0.33 0.00 0.06 0.00 0.09 0.00 0.00 57.88 57.70 2jj1 h LEU 271 Cb 1.25 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.92 2jj1 h LEU 271 CO 0.52 0.67 -0.34 0.28 0.09 0.00 0.00 178.44 179.66 2jj1 h SER 272 N 0.00 -1.10 -0.39 -0.43 0.02 -1.92 0.22 113.55 109.95 2jj1 h SER 272 Ca -0.11 0.17 -0.05 0.00 -0.84 0.00 0.00 61.79 60.96 2jj1 h SER 272 Cb 1.61 0.49 -0.02 0.00 0.14 0.00 0.00 62.40 64.62 2jj1 h SER 272 CO 0.07 -0.35 0.09 0.11 -1.14 0.00 0.00 176.83 175.61 2jj1 h LYS 273 N -0.33 0.70 -0.51 3.45 1.57 -1.89 -1.11 116.57 118.46 2jj1 h LYS 273 Ca 0.13 -0.14 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 2jj1 h LYS 273 Cb 0.55 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.73 2jj1 h LYS 273 CO -0.46 0.66 0.19 0.37 -0.57 0.00 0.00 179.45 179.64 2jj1 h GLN 274 N 0.68 0.77 -0.56 3.15 4.15 -1.32 -1.33 115.11 120.65 2jj1 h GLN 274 Ca 0.15 -0.15 0.03 0.00 0.77 0.00 0.00 58.65 59.45 2jj1 h GLN 274 Cb 0.29 -0.12 -0.04 0.00 0.21 0.00 0.00 27.48 27.82 2jj1 h GLN 274 CO 0.00 0.69 0.33 0.00 -1.93 0.00 0.00 178.83 177.92 2jj1 h ALA 275 N 1.04 0.73 -0.83 3.38 0.00 -0.09 -1.96 119.26 121.53 2jj1 h ALA 275 Ca 0.17 -0.00 0.08 0.00 0.00 0.00 0.00 54.91 55.15 2jj1 h ALA 275 Cb 0.22 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 17.80 2jj1 h ALA 275 CO -0.01 0.04 0.49 0.28 0.00 0.00 0.00 179.25 180.04 2jj1 h VAL 276 N 0.65 0.96 -0.27 0.00 2.07 -0.82 0.27 116.25 119.11 2jj1 h VAL 276 Ca 0.23 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 2jj1 h VAL 276 Cb 0.06 0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 29.85 2jj1 h VAL 276 CO -0.12 0.16 0.12 0.00 0.02 0.00 0.00 177.57 177.75 2jj1 h ALA 277 N 1.43 0.36 -0.38 1.67 0.00 -0.79 -1.33 119.26 120.21 2jj1 h ALA 277 Ca 0.38 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 55.11 2jj1 h ALA 277 Cb 0.28 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2jj1 h ALA 277 CO -0.21 -0.06 -0.03 -0.92 0.00 0.00 0.00 179.25 178.02 2jj1 h TYR 278 N 0.30 0.77 -0.71 0.00 3.20 -0.62 -2.41 116.97 117.50 2jj1 h TYR 278 Ca 0.09 -0.14 0.10 0.00 3.14 0.00 0.00 58.73 61.92 2jj1 h TYR 278 Cb 0.16 -0.20 -0.08 0.00 1.54 0.00 0.00 36.73 38.15 2jj1 h TYR 278 CO -0.01 0.80 0.33 -0.09 -1.64 0.00 0.00 178.16 177.55 2jj1 h ARG 279 N 0.51 0.53 0.14 1.82 2.43 -0.40 0.17 114.38 119.59 2jj1 h ARG 279 Ca 0.10 -0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.26 2jj1 h ARG 279 Cb 0.52 -0.12 -0.05 0.00 -0.42 0.00 0.00 29.97 29.90 2jj1 h ARG 279 CO 0.03 0.35 -0.47 0.37 -1.51 0.00 0.00 179.97 178.74 2jj1 h GLN 280 N 0.55 -0.69 -0.60 0.20 4.15 -0.99 0.09 115.11 117.82 2jj1 h GLN 280 Ca 0.36 0.05 0.08 0.00 0.77 0.00 0.00 58.65 59.90 2jj1 h GLN 280 Cb 0.43 0.16 -0.06 0.00 0.21 0.00 0.00 27.48 28.21 2jj1 h GLN 280 CO -0.30 -0.46 0.26 0.52 -1.93 0.00 0.00 178.83 176.92 2jj1 h MET 281 N -0.72 0.47 -0.09 1.69 2.86 -0.82 -1.11 114.93 117.22 2jj1 h MET 281 Ca 0.01 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 2jj1 h MET 281 Cb 0.73 -0.11 -0.00 0.00 0.06 0.00 0.00 31.60 32.28 2jj1 h MET 281 CO -0.25 0.31 0.01 0.77 1.06 0.00 0.00 176.91 178.81 2jj1 h SER 282 N 0.48 0.15 -0.90 1.22 0.02 -0.29 0.24 113.55 114.47 2jj1 h SER 282 Ca 0.29 -0.27 0.03 0.00 -0.84 0.00 0.00 61.79 61.01 2jj1 h SER 282 Cb 0.30 -0.04 -0.05 0.00 0.14 0.00 0.00 62.40 62.75 2jj1 h SER 282 CO -0.25 0.38 0.59 -0.07 -1.14 0.00 0.00 176.83 176.34 2jj1 h LEU 283 N -0.09 0.97 -0.19 5.07 3.38 -0.65 -0.99 115.31 122.80 2jj1 h LEU 283 Ca 0.03 -0.01 -0.19 0.00 0.09 0.00 0.00 57.88 57.79 2jj1 h LEU 283 Cb 0.30 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 2jj1 h LEU 283 CO 0.00 0.67 -0.91 -0.07 0.09 0.00 0.00 178.44 178.22 2jj1 h LEU 284 N 1.13 0.04 0.00 1.67 3.38 -0.95 -1.03 115.31 119.55 2jj1 h LEU 284 Ca 0.36 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.29 2jj1 h LEU 284 Cb 0.02 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2jj1 h LEU 284 CO -0.11 0.93 0.00 0.18 0.09 0.00 0.00 178.44 179.53 2jj1 n LEU 285 N -3.49 0.00 -2.14 1.67 4.77 0.82 -4.89 117.00 113.75 2jj1 n LEU 285 Ca -0.01 0.25 -0.19 0.00 -0.03 0.00 0.00 56.01 56.03 2jj1 n LEU 285 Cb 0.86 -0.25 -0.01 0.00 -2.33 0.00 0.00 43.42 41.69 2jj1 n LEU 285 CO 0.46 -0.16 -0.24 0.54 -1.33 0.00 0.00 177.39 176.66 2jj1 n ARG 286 N -1.25 -1.50 -2.04 3.23 1.74 -0.39 -5.01 116.66 111.44 2jj1 n ARG 286 Ca 0.06 0.92 -0.32 0.00 -0.77 0.00 0.00 57.85 57.74 2jj1 n ARG 286 Cb 0.08 -5.46 0.00 0.00 -1.02 0.00 0.00 32.46 26.06 2jj1 n ARG 286 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2jj1 s ARG 287 N -4.92 3.48 0.07 5.56 0.52 -0.48 -4.98 118.95 118.21 2jj1 s ARG 287 Ca 0.00 1.01 -0.31 0.00 -0.52 0.00 0.00 55.73 55.92 2jj1 s ARG 287 Cb 0.00 -2.06 -0.07 0.00 0.52 0.00 0.00 34.95 33.34 2jj1 s ARG 287 CO 0.00 -0.66 1.35 -2.14 0.02 0.00 0.00 175.30 173.87 2jj1 s PRO 288 N -4.41 4.34 0.18 3.54 0.02 -1.26 -4.53 135.00 132.87 2jj1 s PRO 288 Ca 0.60 1.98 -0.30 0.00 0.02 0.00 0.00 61.00 63.29 2jj1 s PRO 288 Cb -0.13 -3.35 -0.08 0.00 0.02 0.00 0.00 34.50 30.96 2jj1 s PRO 288 CO 0.41 -0.43 1.26 -1.25 -0.33 0.00 0.00 177.00 176.66 2jj1 s PRO 289 N 1.41 4.43 0.00 5.54 0.04 -1.26 -4.42 135.00 140.74 2jj1 s PRO 289 Ca 0.63 1.96 0.00 0.00 0.04 0.00 0.00 61.00 63.63 2jj1 s PRO 289 Cb -0.34 -3.22 0.00 0.00 0.04 0.00 0.00 34.50 30.98 2jj1 s PRO 289 CO 0.29 -0.19 0.00 0.41 0.04 0.00 0.00 177.00 177.55 2jj1 n GLY 290 N 2.38 4.66 3.64 0.56 0.00 0.13 -4.92 105.19 111.64 2jj1 n GLY 290 Ca 0.06 -1.77 -0.45 0.00 0.00 0.00 0.00 46.02 43.86 2jj1 n GLY 290 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2jj1 n ARG 291 N 0.00 1.71 -3.06 1.61 0.63 -1.26 -0.31 116.66 115.99 2jj1 n ARG 291 Ca 0.00 0.60 -0.15 0.00 -0.92 0.00 0.00 57.85 57.38 2jj1 n ARG 291 Cb 0.00 -2.13 -0.01 0.00 0.45 0.00 0.00 32.46 30.77 2jj1 n ARG 291 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 2jj1 n GLU 292 N 1.21 -2.61 -1.51 -0.14 1.02 -1.26 -0.66 120.64 116.69 2jj1 n GLU 292 Ca 0.10 0.26 -0.18 0.00 -0.02 0.00 0.00 57.16 57.32 2jj1 n GLU 292 Cb 0.32 -4.85 -0.08 0.00 -0.02 0.00 0.00 31.44 26.81 2jj1 n GLU 292 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2jj1 n ALA 293 N -2.98 -0.27 -1.98 0.62 0.00 0.58 -5.00 120.51 111.48 2jj1 n ALA 293 Ca -0.01 0.29 -0.32 0.00 0.00 0.00 0.00 53.44 53.40 2jj1 n ALA 293 Cb 0.52 -1.95 -0.04 0.00 0.00 0.00 0.00 19.45 17.98 2jj1 n ALA 293 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2jj1 s TYR 294 N -2.50 3.42 0.71 0.00 1.51 0.16 -4.39 117.35 116.25 2jj1 s TYR 294 Ca 0.00 1.33 -0.07 0.00 -1.01 0.00 0.00 57.07 57.32 2jj1 s TYR 294 Cb 0.00 -2.66 0.06 0.00 -0.11 0.00 0.00 41.96 39.25 2jj1 s TYR 294 CO 0.00 -0.18 1.02 -1.25 -1.11 0.00 0.00 175.55 174.03 2jj1 s PRO 295 N -3.69 2.18 0.15 -1.71 0.04 -1.26 0.22 135.00 130.92 2jj1 s PRO 295 Ca 0.56 -0.27 0.19 0.00 0.04 0.00 0.00 61.00 61.53 2jj1 s PRO 295 Cb -0.10 -2.17 0.81 0.00 0.04 0.00 0.00 34.50 33.08 2jj1 s PRO 295 CO 0.26 -1.25 1.59 0.41 0.04 0.00 0.00 177.00 178.05 2jj1 n GLY 296 N -2.93 -1.14 1.69 0.56 0.00 -1.26 -2.65 105.19 99.47 2jj1 n GLY 296 Ca 0.08 0.03 0.08 0.00 0.00 0.00 0.00 46.02 46.21 2jj1 n GLY 296 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2jj1 n ASP 297 N -1.91 5.30 -0.12 1.61 5.75 -1.26 -4.61 116.55 121.31 2jj1 n ASP 297 Ca 0.03 -2.85 -0.12 0.00 -0.01 0.00 0.00 54.79 51.83 2jj1 n ASP 297 Cb 0.20 -0.64 -0.03 0.00 -1.03 0.00 0.00 41.12 39.61 2jj1 n ASP 297 CO 0.00 0.00 0.00 1.62 -0.11 0.00 0.00 177.20 178.71 2jj1 h VAL 298 N 3.69 1.29 -0.81 2.12 3.04 -1.89 0.49 116.25 124.18 2jj1 h VAL 298 Ca 0.00 -1.28 0.09 0.00 -1.01 0.00 0.00 66.70 64.50 2jj1 h VAL 298 Cb 1.81 1.38 -0.07 0.00 -2.01 0.00 0.00 31.29 32.40 2jj1 h VAL 298 CO 0.41 0.42 0.47 0.15 -1.01 0.00 0.00 177.57 178.00 2jj1 h PHE 299 N 0.49 0.85 -0.83 3.17 3.57 -1.85 -2.56 116.94 119.77 2jj1 h PHE 299 Ca 0.08 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.57 2jj1 h PHE 299 Cb 0.70 -0.26 -0.04 0.00 2.79 0.00 0.00 35.95 39.14 2jj1 h PHE 299 CO 0.06 0.36 0.39 -0.92 -2.23 0.00 0.00 178.31 175.97 2jj1 h TYR 300 N 0.80 1.21 0.10 0.41 3.20 -1.79 0.31 116.97 121.20 2jj1 h TYR 300 Ca 0.38 -0.06 0.01 0.00 3.14 0.00 0.00 58.73 62.20 2jj1 h TYR 300 Cb 0.32 -0.37 -0.04 0.00 1.54 0.00 0.00 36.73 38.17 2jj1 h TYR 300 CO -0.06 0.88 -0.48 1.25 -1.64 0.00 0.00 178.16 178.10 2jj1 h LEU 301 N 1.19 -1.46 -0.32 2.82 5.85 -0.50 -2.40 115.31 120.48 2jj1 h LEU 301 Ca 0.28 0.15 -0.20 0.00 0.84 0.00 0.00 57.88 58.96 2jj1 h LEU 301 Cb 0.13 0.54 -0.00 0.00 0.37 0.00 0.00 40.66 41.70 2jj1 h LEU 301 CO -0.03 -0.51 -0.78 0.45 -0.34 0.00 0.00 178.44 177.23 2jj1 h HIS 302 N -0.68 0.65 -0.26 1.25 3.86 -1.24 -2.90 115.15 115.83 2jj1 h HIS 302 Ca -0.00 -0.30 -0.10 0.00 -1.16 0.00 0.00 60.37 58.81 2jj1 h HIS 302 Cb 0.69 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 29.05 2jj1 h HIS 302 CO -0.45 1.08 -0.25 0.66 0.86 0.00 0.00 177.93 179.83 2jj1 h SER 303 N 0.31 0.52 0.97 2.45 4.64 -0.38 -1.06 113.55 121.00 2jj1 h SER 303 Ca -0.04 -0.18 -0.14 0.00 -0.47 0.00 0.00 61.79 60.96 2jj1 h SER 303 Cb 1.37 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 63.30 2jj1 h SER 303 CO 0.14 0.76 -0.68 0.08 -0.87 0.00 0.00 176.83 176.26 2jj1 h ARG 304 N 0.45 0.00 0.66 4.77 0.11 -1.39 -1.35 114.38 117.63 2jj1 h ARG 304 Ca 0.06 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.11 2jj1 h ARG 304 Cb 0.68 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.77 2jj1 h ARG 304 CO 0.05 0.68 -0.32 1.25 0.10 0.00 0.00 179.97 181.73 2jj1 h LEU 305 N 0.00 -0.75 -0.77 0.08 5.85 -1.28 -3.36 115.31 115.08 2jj1 h LEU 305 Ca -0.01 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.70 2jj1 h LEU 305 Cb 1.35 0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.57 2jj1 h LEU 305 CO 0.09 -0.44 0.00 -0.07 -0.34 0.00 0.00 178.44 177.68 2jj1 h LEU 306 N -1.04 0.00 -1.58 2.25 3.38 -1.10 -2.77 115.31 114.45 2jj1 h LEU 306 Ca -0.09 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 2jj1 h LEU 306 Cb 0.71 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 2jj1 h LEU 306 CO 0.15 0.00 -0.14 -0.33 0.09 0.00 0.00 178.44 178.21 2jj1 h GLU 307 N 0.00 0.00 0.00 1.13 4.39 -1.39 -2.99 114.58 115.72 2jj1 h GLU 307 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2jj1 h GLU 307 Cb 0.74 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.39 2jj1 h GLU 307 CO 0.00 0.14 0.00 0.54 -1.16 0.00 0.00 179.01 178.53 2jj1 n ARG 308 N -3.41 0.04 -2.72 2.33 1.74 -1.05 -4.46 116.66 109.13 2jj1 n ARG 308 Ca -0.01 0.28 -0.41 0.00 -0.77 0.00 0.00 57.85 56.94 2jj1 n ARG 308 Cb 0.32 -1.57 -0.05 0.00 -1.02 0.00 0.00 32.46 30.14 2jj1 n ARG 308 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2jj1 s ALA 309 N -3.06 3.27 -0.19 7.54 0.00 -1.13 -4.84 121.76 123.35 2jj1 s ALA 309 Ca 0.07 0.60 -0.30 0.00 0.00 0.00 0.00 51.96 52.33 2jj1 s ALA 309 Cb 0.10 -3.27 0.14 0.00 0.00 0.00 0.00 23.12 20.09 2jj1 s ALA 309 CO 0.30 0.02 1.09 0.00 0.00 0.00 0.00 175.76 177.17 2jj1 s ALA 310 N -0.30 -1.98 -0.35 0.00 0.00 -0.75 -4.92 121.76 113.46 2jj1 s ALA 310 Ca 0.46 1.65 -0.11 0.00 0.00 0.00 0.00 51.96 53.96 2jj1 s ALA 310 Cb -0.24 -0.87 0.01 0.00 0.00 0.00 0.00 23.12 22.01 2jj1 s ALA 310 CO 0.31 -0.31 0.20 0.21 0.00 0.00 0.00 175.76 176.17 2jj1 s LYS 311 N -1.17 3.11 0.26 0.00 2.47 -1.26 -1.69 119.74 121.46 2jj1 s LYS 311 Ca 0.01 -0.89 -0.24 0.00 -1.56 0.00 0.00 55.97 53.30 2jj1 s LYS 311 Cb -0.01 -3.70 -0.09 0.00 -1.46 0.00 0.00 37.83 32.57 2jj1 s LYS 311 CO -0.01 -0.57 0.84 -1.64 0.16 0.00 0.00 175.35 174.13 2jj1 s MET 312 N 1.61 4.47 1.05 4.03 -1.94 -0.49 -2.31 119.30 125.72 2jj1 s MET 312 Ca 0.04 1.14 -0.17 0.00 -1.71 0.00 0.00 55.69 54.99 2jj1 s MET 312 Cb -0.18 -2.91 0.22 0.00 2.01 0.00 0.00 34.83 33.97 2jj1 s MET 312 CO 0.07 0.37 1.21 0.54 -0.01 0.00 0.00 175.02 177.20 2jj1 s ASN 313 N -1.55 2.28 0.23 3.03 2.20 -0.92 -3.99 114.94 116.22 2jj1 s ASN 313 Ca 0.45 0.53 -0.03 0.00 -0.94 0.00 0.00 52.86 52.87 2jj1 s ASN 313 Cb -0.19 -0.74 0.23 0.00 -2.00 0.00 0.00 41.25 38.55 2jj1 s ASN 313 CO 0.23 -3.27 1.64 0.44 -2.94 0.00 0.00 177.10 173.21 2jj1 h ASP 314 N -2.00 0.73 -1.01 3.54 3.32 -1.91 0.38 116.42 119.46 2jj1 h ASP 314 Ca -0.46 -0.26 0.29 0.00 0.02 0.00 0.00 57.03 56.63 2jj1 h ASP 314 Cb 1.27 -0.20 -0.14 0.00 0.22 0.00 0.00 39.33 40.49 2jj1 h ASP 314 CO 0.40 0.94 0.59 0.00 -1.72 0.00 0.00 179.24 179.45 2jj1 h ALA 315 N 1.12 1.92 -0.69 3.45 0.00 -1.96 -2.21 119.26 120.89 2jj1 h ALA 315 Ca 0.09 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2jj1 h ALA 315 Cb 0.72 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2jj1 h ALA 315 CO 0.06 -0.48 0.00 1.19 0.00 0.00 0.00 179.25 180.02 2jj1 n PHE 316 N -4.97 0.92 0.00 0.00 3.01 -0.95 -4.94 117.46 110.54 2jj1 n PHE 316 Ca 0.30 -0.46 0.00 0.00 1.01 0.00 0.00 57.45 58.30 2jj1 n PHE 316 Cb 0.90 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.37 2jj1 n PHE 316 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2jj1 n GLY 317 N 1.63 2.08 2.89 1.37 0.00 -0.83 -4.70 105.19 107.62 2jj1 n GLY 317 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 2jj1 n GLY 317 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jj1 n GLY 318 N -0.31 0.69 2.23 -0.02 0.00 0.08 -4.26 105.19 103.60 2jj1 n GLY 318 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 2jj1 n GLY 318 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jj1 n GLY 319 N -2.08 -1.72 3.48 -0.02 0.00 -1.24 -4.62 105.19 98.99 2jj1 n GLY 319 Ca 0.00 -1.63 -0.12 0.00 0.00 0.00 0.00 46.02 44.27 2jj1 n GLY 319 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jj1 s SER 320 N -3.72 -0.52 -0.15 1.61 1.04 -0.51 -1.40 113.70 110.06 2jj1 s SER 320 Ca 0.44 0.20 -0.01 0.00 0.48 0.00 0.00 55.95 57.07 2jj1 s SER 320 Cb -0.02 0.50 0.04 0.00 0.10 0.00 0.00 66.02 66.64 2jj1 s SER 320 CO 0.32 -0.73 -0.05 -0.22 0.98 0.00 0.00 173.24 173.54 2jj1 s LEU 321 N -2.16 1.40 -0.18 2.42 2.96 -0.68 -1.17 118.68 121.27 2jj1 s LEU 321 Ca -0.01 -0.55 -0.08 0.00 -0.22 0.00 0.00 54.13 53.27 2jj1 s LEU 321 Cb -0.01 -0.83 -0.04 0.00 0.50 0.00 0.00 46.19 45.81 2jj1 s LEU 321 CO -0.05 -0.18 0.08 -0.89 -1.32 0.00 0.00 176.35 173.99 2jj1 s THR 322 N 1.69 4.99 -0.13 3.68 2.01 0.09 -1.81 115.64 126.17 2jj1 s THR 322 Ca 0.02 0.04 -0.01 0.00 0.31 0.00 0.00 61.69 62.04 2jj1 s THR 322 Cb -0.15 -3.25 -0.02 0.00 0.01 0.00 0.00 72.50 69.09 2jj1 s THR 322 CO -0.08 0.47 -0.09 0.00 -0.69 0.00 0.00 174.62 174.23 2jj1 s ALA 323 N 0.25 2.82 -0.66 7.40 0.00 -0.96 0.50 121.76 131.11 2jj1 s ALA 323 Ca 0.05 -0.87 0.02 0.00 0.00 0.00 0.00 51.96 51.17 2jj1 s ALA 323 Cb -0.12 -1.33 0.16 0.00 0.00 0.00 0.00 23.12 21.84 2jj1 s ALA 323 CO -0.00 0.30 0.45 -0.51 0.00 0.00 0.00 175.76 176.00 2jj1 s LEU 324 N 0.12 4.84 0.42 0.00 1.43 0.16 -1.63 118.68 124.02 2jj1 s LEU 324 Ca -0.04 -3.42 -0.24 0.00 -1.03 0.00 0.00 54.13 49.40 2jj1 s LEU 324 Cb -0.14 -1.71 -0.08 0.00 0.03 0.00 0.00 46.19 44.28 2jj1 s LEU 324 CO 0.04 -0.19 1.14 -2.16 0.23 0.00 0.00 176.35 175.41 2jj1 s PRO 325 N -0.87 3.98 -0.08 1.29 0.04 -1.25 -2.34 135.00 135.77 2jj1 s PRO 325 Ca 0.22 1.74 0.02 0.00 0.04 0.00 0.00 61.00 63.02 2jj1 s PRO 325 Cb -0.14 -2.55 -0.02 0.00 0.04 0.00 0.00 34.50 31.82 2jj1 s PRO 325 CO -0.09 -0.36 -0.12 0.08 0.04 0.00 0.00 177.00 176.56 2jj1 s VAL 326 N -1.51 3.26 -0.04 -0.36 1.01 0.93 -1.70 120.40 121.98 2jj1 s VAL 326 Ca 0.59 -0.63 0.02 0.00 0.00 0.00 0.00 61.98 61.96 2jj1 s VAL 326 Cb -0.28 -2.32 0.01 0.00 0.00 0.00 0.00 36.38 33.79 2jj1 s VAL 326 CO 0.35 0.57 -0.08 -0.63 0.00 0.00 0.00 175.10 175.31 2jj1 s ILE 327 N -0.45 0.80 -0.17 2.22 -1.09 -0.76 -0.19 121.20 121.56 2jj1 s ILE 327 Ca 0.06 -0.32 -0.16 0.00 -2.23 0.00 0.00 60.65 58.00 2jj1 s ILE 327 Cb -0.12 -0.75 -0.04 0.00 -1.58 0.00 0.00 42.46 39.97 2jj1 s ILE 327 CO 0.02 0.27 0.40 -0.70 -1.23 0.00 0.00 174.94 173.70 2jj1 s GLU 328 N 0.56 4.23 0.52 2.79 2.12 -1.26 -3.04 118.70 124.63 2jj1 s GLU 328 Ca -0.09 0.25 -0.03 0.00 0.36 0.00 0.00 54.97 55.45 2jj1 s GLU 328 Cb -0.13 -3.49 0.00 0.00 0.26 0.00 0.00 34.13 30.77 2jj1 s GLU 328 CO 0.01 0.06 0.80 0.95 -0.54 0.00 0.00 175.26 176.54 2jj1 s THR 329 N 0.99 3.88 -0.27 -1.70 -4.23 -0.75 -4.86 115.64 108.70 2jj1 s THR 329 Ca 0.20 -0.20 0.00 0.00 -1.18 0.00 0.00 61.69 60.52 2jj1 s THR 329 Cb -0.14 -3.49 0.05 0.00 1.34 0.00 0.00 72.50 70.25 2jj1 s THR 329 CO 0.08 -0.44 -0.06 -1.10 -0.54 0.00 0.00 174.62 172.56 2jj1 s GLN 330 N -4.79 2.42 -1.30 3.99 -1.52 -1.26 -4.26 119.66 112.94 2jj1 s GLN 330 Ca 0.51 -1.25 -0.01 0.00 -1.95 0.00 0.00 55.36 52.66 2jj1 s GLN 330 Cb -0.10 -3.01 -0.00 0.00 -0.22 0.00 0.00 33.01 29.67 2jj1 s GLN 330 CO 0.42 -0.56 0.69 0.00 -0.25 0.00 0.00 175.29 175.59 2jj1 n ALA 331 N 4.55 -2.05 -3.45 6.09 0.00 -1.26 -3.55 120.51 120.84 2jj1 n ALA 331 Ca -0.14 -0.17 -0.25 0.00 0.00 0.00 0.00 53.44 52.88 2jj1 n ALA 331 Cb 0.43 -2.07 0.05 0.00 0.00 0.00 0.00 19.45 17.86 2jj1 n ALA 331 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jj1 n GLY 332 N -1.59 -0.52 3.33 0.00 0.00 -1.26 -4.93 105.19 100.21 2jj1 n GLY 332 Ca -0.29 0.19 -0.46 0.00 0.00 0.00 0.00 46.02 45.45 2jj1 n GLY 332 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jj1 s ASP 333 N -3.05 6.91 0.00 1.61 2.15 -1.23 -4.85 116.67 118.21 2jj1 s ASP 333 Ca 0.49 -2.96 0.27 0.00 0.43 0.00 0.00 52.55 50.78 2jj1 s ASP 333 Cb -0.23 -2.20 1.50 0.00 -0.30 0.00 0.00 42.92 41.69 2jj1 s ASP 333 CO 0.61 -0.48 1.94 1.33 -0.17 0.00 0.00 175.17 178.40 2jj1 n VAL 334 N 3.59 0.07 -0.31 1.11 0.24 -1.26 -2.66 118.33 119.10 2jj1 n VAL 334 Ca 0.17 0.02 0.12 0.00 -2.04 0.00 0.00 64.34 62.60 2jj1 n VAL 334 Cb 0.45 -0.59 0.31 0.00 -1.47 0.00 0.00 33.84 32.54 2jj1 n VAL 334 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2jj1 n SER 335 N -1.12 3.88 -4.83 -1.34 7.64 -1.26 -3.69 113.62 112.90 2jj1 n SER 335 Ca 0.17 -2.00 -0.32 0.00 1.01 0.00 0.00 58.87 57.74 2jj1 n SER 335 Cb 0.14 -0.46 0.02 0.00 -1.01 0.00 0.00 64.21 62.90 2jj1 n SER 335 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jj1 s ALA 336 N -1.04 2.85 0.12 -0.43 0.00 -1.09 -4.80 121.76 117.38 2jj1 s ALA 336 Ca 0.47 0.14 -0.26 0.00 0.00 0.00 0.00 51.96 52.31 2jj1 s ALA 336 Cb 0.25 -3.16 -0.06 0.00 0.00 0.00 0.00 23.12 20.15 2jj1 s ALA 336 CO 0.33 -0.83 1.64 -0.92 0.00 0.00 0.00 175.76 175.97 2jj1 h TYR 337 N -0.06 -0.69 -0.13 0.00 -0.00 -1.92 0.43 116.97 114.60 2jj1 h TYR 337 Ca -0.45 0.02 -0.06 0.00 -0.00 0.00 0.00 58.73 58.24 2jj1 h TYR 337 Cb 1.20 0.30 -0.00 0.00 -0.00 0.00 0.00 36.73 38.23 2jj1 h TYR 337 CO 0.62 -0.35 -0.14 0.82 -0.00 0.00 0.00 178.16 179.11 2jj1 h ILE 338 N -0.41 1.35 -0.56 1.81 1.08 -1.97 -1.09 117.51 117.72 2jj1 h ILE 338 Ca 0.05 -1.32 0.11 0.00 -0.39 0.00 0.00 64.86 63.31 2jj1 h ILE 338 Cb 0.48 1.92 -0.09 0.00 -3.07 0.00 0.00 36.82 36.07 2jj1 h ILE 338 CO -0.21 0.38 0.07 -0.65 -0.69 0.00 0.00 178.15 177.05 2jj1 h PRO 339 N -0.06 0.18 -0.56 2.37 0.11 -1.84 -1.93 132.00 130.27 2jj1 h PRO 339 Ca 0.02 -0.01 0.10 0.00 0.11 0.00 0.00 66.00 66.22 2jj1 h PRO 339 Cb 0.68 -0.04 -0.08 0.00 0.11 0.00 0.00 31.00 31.67 2jj1 h PRO 339 CO 0.03 0.12 0.13 1.15 -0.21 0.00 0.00 178.00 179.22 2jj1 h THR 340 N 0.19 0.69 0.62 -1.15 2.02 0.14 -0.69 112.91 114.72 2jj1 h THR 340 Ca 0.29 -0.09 -0.02 0.00 0.77 0.00 0.00 66.41 67.35 2jj1 h THR 340 Cb 0.43 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 67.23 2jj1 h THR 340 CO -0.42 0.05 -0.39 0.78 0.37 0.00 0.00 175.52 175.92 2jj1 h ASN 341 N 0.27 -0.97 -0.22 4.18 4.21 -0.73 -2.29 115.58 120.02 2jj1 h ASN 341 Ca 0.29 0.06 -0.13 0.00 1.21 0.00 0.00 56.30 57.73 2jj1 h ASN 341 Cb 0.41 0.29 -0.01 0.00 -1.12 0.00 0.00 38.32 37.88 2jj1 h ASN 341 CO -0.36 -0.60 -0.32 0.58 -1.29 0.00 0.00 177.43 175.44 2jj1 h VAL 342 N -0.95 1.28 -0.62 2.81 2.07 -1.06 -1.20 116.25 118.58 2jj1 h VAL 342 Ca -0.08 -1.46 0.08 0.00 0.82 0.00 0.00 66.70 66.07 2jj1 h VAL 342 Cb 0.77 1.36 -0.06 0.00 -1.52 0.00 0.00 31.29 31.84 2jj1 h VAL 342 CO 0.07 0.48 0.28 0.40 0.02 0.00 0.00 177.57 178.82 2jj1 h ILE 343 N 0.62 0.84 -0.70 4.57 2.04 -1.20 -0.06 117.51 123.62 2jj1 h ILE 343 Ca 0.07 -0.17 -0.04 0.00 1.00 0.00 0.00 64.86 65.71 2jj1 h ILE 343 Cb 0.84 0.30 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 2jj1 h ILE 343 CO 0.07 0.09 0.26 -1.28 0.00 0.00 0.00 178.15 177.29 2jj1 h SER 344 N 0.50 0.96 0.02 1.72 0.87 -0.79 -3.18 113.55 113.65 2jj1 h SER 344 Ca 0.30 -0.15 -0.21 0.00 -1.23 0.00 0.00 61.79 60.50 2jj1 h SER 344 Cb 0.31 -0.25 0.02 0.00 -0.44 0.00 0.00 62.40 62.04 2jj1 h SER 344 CO -0.26 0.87 -0.83 0.40 -0.53 0.00 0.00 176.83 176.48 2jj1 h ILE 345 N 1.02 1.37 -3.92 2.23 2.04 -0.42 -3.47 117.51 116.35 2jj1 h ILE 345 Ca 0.23 -2.21 -0.46 0.00 1.00 0.00 0.00 64.86 63.43 2jj1 h ILE 345 Cb 0.22 2.59 0.16 0.00 -0.74 0.00 0.00 36.82 39.05 2jj1 h ILE 345 CO -0.02 0.66 0.21 0.42 0.00 0.00 0.00 178.15 179.42 2jj1 s THR 346 N -3.16 2.17 -2.40 -0.27 -4.23 -0.11 -4.97 115.64 102.67 2jj1 s THR 346 Ca -0.12 0.06 0.22 0.00 -1.18 0.00 0.00 61.69 60.67 2jj1 s THR 346 Cb 0.05 -2.55 0.43 0.00 1.34 0.00 0.00 72.50 71.76 2jj1 s THR 346 CO 0.87 -0.07 1.48 0.47 -0.54 0.00 0.00 174.62 176.83 2jj1 n ASP 347 N -4.12 2.39 0.00 3.99 8.00 0.13 -4.97 116.55 121.96 2jj1 n ASP 347 Ca 0.06 -1.83 0.00 0.00 0.71 0.00 0.00 54.79 53.73 2jj1 n ASP 347 Cb 0.57 -0.15 0.00 0.00 -0.02 0.00 0.00 41.12 41.52 2jj1 n ASP 347 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jj1 n GLY 348 N 1.28 1.34 2.86 0.44 0.00 -1.24 -0.77 105.19 109.11 2jj1 n GLY 348 Ca 0.17 -1.09 -0.15 0.00 0.00 0.00 0.00 46.02 44.96 2jj1 n GLY 348 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jj1 s GLN 349 N -2.00 0.19 -0.49 1.61 1.11 -0.51 -1.20 119.66 118.36 2jj1 s GLN 349 Ca 0.00 0.00 -0.16 0.00 0.01 0.00 0.00 55.36 55.21 2jj1 s GLN 349 Cb 0.00 -0.27 0.08 0.00 -1.01 0.00 0.00 33.01 31.81 2jj1 s GLN 349 CO 0.00 -0.03 0.43 0.42 0.01 0.00 0.00 175.29 176.11 2jj1 s ILE 350 N 0.41 5.22 -0.05 1.08 1.01 0.29 -0.83 121.20 128.32 2jj1 s ILE 350 Ca -0.04 -1.14 -0.20 0.00 0.00 0.00 0.00 60.65 59.28 2jj1 s ILE 350 Cb -0.06 -4.18 -0.05 0.00 0.01 0.00 0.00 42.46 38.18 2jj1 s ILE 350 CO -0.01 -0.65 0.56 -0.36 0.00 0.00 0.00 174.94 174.49 2jj1 s PHE 351 N 1.67 3.61 -0.01 3.97 0.40 -1.25 -0.49 117.98 125.87 2jj1 s PHE 351 Ca 0.04 1.09 0.06 0.00 -0.60 0.00 0.00 56.93 57.53 2jj1 s PHE 351 Cb -0.25 -2.60 -0.03 0.00 0.51 0.00 0.00 43.02 40.65 2jj1 s PHE 351 CO 0.06 0.26 -0.20 -0.51 0.70 0.00 0.00 175.22 175.53 2jj1 s LEU 352 N 0.20 2.42 0.08 -0.37 1.43 0.24 -1.30 118.68 121.37 2jj1 s LEU 352 Ca 0.30 -0.37 0.09 0.00 -1.03 0.00 0.00 54.13 53.12 2jj1 s LEU 352 Cb -0.17 -1.45 -0.03 0.00 0.03 0.00 0.00 46.19 44.57 2jj1 s LEU 352 CO 0.15 0.31 -0.25 -1.61 0.23 0.00 0.00 176.35 175.18 2jj1 s GLU 353 N -0.88 1.51 0.26 1.70 2.02 -0.56 -4.19 118.70 118.57 2jj1 s GLU 353 Ca 0.12 -1.15 0.04 0.00 0.02 0.00 0.00 54.97 54.00 2jj1 s GLU 353 Cb -0.10 -1.78 0.35 0.00 0.10 0.00 0.00 34.13 32.70 2jj1 s GLU 353 CO 0.01 0.44 1.64 1.15 0.02 0.00 0.00 175.26 178.52 2jj1 h THR 354 N 4.13 1.33 0.58 3.63 2.02 -1.91 -2.69 112.91 119.99 2jj1 h THR 354 Ca -0.47 -1.68 -0.03 0.00 0.77 0.00 0.00 66.41 65.01 2jj1 h THR 354 Cb 1.16 1.77 0.01 0.00 -1.74 0.00 0.00 68.15 69.34 2jj1 h THR 354 CO 0.42 0.50 -0.28 -0.08 0.37 0.00 0.00 175.52 176.45 2jj1 h GLU 355 N 0.24 -0.74 -0.54 6.66 4.81 -1.96 -2.62 114.58 120.41 2jj1 h GLU 355 Ca 0.01 0.05 0.05 0.00 -0.13 0.00 0.00 59.36 59.34 2jj1 h GLU 355 Cb 0.93 0.17 -0.05 0.00 0.63 0.00 0.00 28.75 30.43 2jj1 h GLU 355 CO 0.08 -0.48 0.27 -0.07 -0.73 0.00 0.00 179.01 178.08 2jj1 h LEU 356 N -0.82 0.39 -0.96 1.64 3.38 -1.89 -2.15 115.31 114.90 2jj1 h LEU 356 Ca -0.08 0.03 0.12 0.00 0.09 0.00 0.00 57.88 58.04 2jj1 h LEU 356 Cb 0.61 -0.04 -0.14 0.00 0.09 0.00 0.00 40.66 41.19 2jj1 h LEU 356 CO 0.13 0.26 -0.50 0.15 0.09 0.00 0.00 178.44 178.58 2jj1 h PHE 357 N 0.52 -1.52 0.00 1.13 3.57 -1.27 -0.88 116.94 118.49 2jj1 h PHE 357 Ca 0.24 0.12 0.00 0.00 3.53 0.00 0.00 57.97 61.86 2jj1 h PHE 357 Cb 0.16 0.80 0.00 0.00 2.79 0.00 0.00 35.95 39.69 2jj1 h PHE 357 CO -0.10 -0.39 0.00 1.88 -2.23 0.00 0.00 178.31 177.47 2jj1 h TYR 358 N -0.02 0.00 0.00 0.41 -1.99 -1.04 -2.08 116.97 112.24 2jj1 h TYR 358 Ca 0.24 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.97 2jj1 h TYR 358 Cb 0.50 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.23 2jj1 h TYR 358 CO -0.94 0.00 0.00 1.63 -0.00 0.00 0.00 178.16 178.85 2jj1 n LYS 359 N -2.41 0.14 -0.01 4.88 5.02 -0.40 -4.83 118.16 120.54 2jj1 n LYS 359 Ca 0.05 0.52 0.00 0.00 -2.02 0.00 0.00 58.31 56.86 2jj1 n LYS 359 Cb 0.42 -1.86 0.00 0.00 -0.02 0.00 0.00 35.03 33.57 2jj1 n LYS 359 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jj1 n GLY 360 N -0.76 0.49 3.56 0.72 0.00 -0.78 -5.03 105.19 103.39 2jj1 n GLY 360 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 2jj1 n GLY 360 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jj1 s ILE 361 N -2.02 3.65 -0.08 -0.61 -1.09 -0.81 -4.95 121.20 115.29 2jj1 s ILE 361 Ca 0.00 -0.33 0.01 0.00 -2.23 0.00 0.00 60.65 58.10 2jj1 s ILE 361 Cb 0.00 -4.53 0.02 0.00 -1.58 0.00 0.00 42.46 36.37 2jj1 s ILE 361 CO 0.00 -1.45 -0.08 -0.13 -1.23 0.00 0.00 174.94 172.05 2jj1 s ARG 362 N 6.06 1.41 0.61 2.79 0.52 -1.26 -2.92 118.95 126.15 2jj1 s ARG 362 Ca 0.55 -0.26 -0.18 0.00 -0.52 0.00 0.00 55.73 55.32 2jj1 s ARG 362 Cb -0.05 -1.36 -0.03 0.00 0.52 0.00 0.00 34.95 34.03 2jj1 s ARG 362 CO 0.01 -0.13 1.22 -1.25 0.02 0.00 0.00 175.30 175.16 2jj1 s PRO 363 N 1.22 2.89 -0.04 3.54 0.04 -1.26 -0.96 135.00 140.43 2jj1 s PRO 363 Ca -0.05 1.84 -0.00 0.00 0.04 0.00 0.00 61.00 62.84 2jj1 s PRO 363 Cb -0.14 -1.92 0.03 0.00 0.04 0.00 0.00 34.50 32.52 2jj1 s PRO 363 CO -0.02 -1.27 1.82 0.00 0.04 0.00 0.00 177.00 177.56 2jj1 n ALA 364 N -1.68 3.87 -2.27 8.56 0.00 -1.15 -4.90 120.51 122.94 2jj1 n ALA 364 Ca 0.14 -0.22 -0.42 0.00 0.00 0.00 0.00 53.44 52.93 2jj1 n ALA 364 Cb 0.49 -1.05 -0.03 0.00 0.00 0.00 0.00 19.45 18.87 2jj1 n ALA 364 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2jj1 s ILE 365 N -0.30 3.81 -0.47 0.00 1.01 -1.26 -1.49 121.20 122.50 2jj1 s ILE 365 Ca 0.04 1.18 -0.29 0.00 0.00 0.00 0.00 60.65 61.59 2jj1 s ILE 365 Cb 0.03 -3.76 0.01 0.00 0.01 0.00 0.00 42.46 38.76 2jj1 s ILE 365 CO 0.00 -0.00 1.36 0.21 0.00 0.00 0.00 174.94 176.51 2jj1 s ASN 366 N 1.81 6.34 0.26 3.58 3.84 -0.42 -4.92 114.94 125.43 2jj1 s ASN 366 Ca 0.62 0.61 0.01 0.00 0.21 0.00 0.00 52.86 54.31 2jj1 s ASN 366 Cb -0.30 -2.54 0.34 0.00 -0.55 0.00 0.00 41.25 38.19 2jj1 s ASN 366 CO 0.26 -1.47 1.68 0.58 -2.79 0.00 0.00 177.10 175.35 2jj1 h VAL 367 N 6.40 1.28 -0.21 -5.21 2.07 -1.92 -1.78 116.25 116.88 2jj1 h VAL 367 Ca -0.26 -1.36 -0.15 0.00 0.82 0.00 0.00 66.70 65.75 2jj1 h VAL 367 Cb 1.09 1.39 -0.01 0.00 -1.52 0.00 0.00 31.29 32.24 2jj1 h VAL 367 CO 1.12 0.43 -0.49 1.23 0.02 0.00 0.00 177.57 179.88 2jj1 h GLY 368 N 1.03 0.60 0.44 2.17 0.00 -1.99 -3.35 103.07 101.98 2jj1 h GLY 368 Ca 0.06 -0.66 -0.36 0.00 0.00 0.00 0.00 47.33 46.38 2jj1 h GLY 368 CO 0.06 0.59 -1.98 1.04 0.00 0.00 0.00 176.54 176.24 2jj1 n LEU 369 N -3.99 2.57 -4.68 3.11 4.77 -1.19 -4.91 117.00 112.68 2jj1 n LEU 369 Ca -0.02 0.20 -0.40 0.00 -0.03 0.00 0.00 56.01 55.75 2jj1 n LEU 369 Cb 0.57 -1.07 0.03 0.00 -2.33 0.00 0.00 43.42 40.61 2jj1 n LEU 369 CO 0.46 0.79 0.81 -1.20 -1.33 0.00 0.00 177.39 176.92 2jj1 n SER 370 N -3.59 2.10 -3.89 -1.43 7.64 -0.68 -4.93 113.62 108.85 2jj1 n SER 370 Ca -0.34 1.01 -0.09 0.00 1.01 0.00 0.00 58.87 60.46 2jj1 n SER 370 Cb 0.99 -1.48 -0.05 0.00 -1.01 0.00 0.00 64.21 62.66 2jj1 n SER 370 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2jj1 s VAL 371 N -1.29 0.03 -0.21 0.44 0.11 -0.01 -4.94 120.40 114.55 2jj1 s VAL 371 Ca 0.66 -1.17 -0.04 0.00 -2.93 0.00 0.00 61.98 58.51 2jj1 s VAL 371 Cb -0.48 -1.84 0.11 0.00 -1.53 0.00 0.00 36.38 32.64 2jj1 s VAL 371 CO 0.54 -0.16 0.32 -0.55 -3.33 0.00 0.00 175.10 171.93 2jj1 s SER 372 N -2.95 0.47 0.12 3.54 0.15 -1.26 -1.43 113.70 112.34 2jj1 s SER 372 Ca 0.15 0.29 0.26 0.00 0.70 0.00 0.00 55.95 57.36 2jj1 s SER 372 Cb 0.01 0.89 0.98 0.00 -1.71 0.00 0.00 66.02 66.19 2jj1 s SER 372 CO 0.01 -0.29 1.81 0.54 1.20 0.00 0.00 173.24 176.52 2jj1 n ARG 373 N 5.35 0.14 -0.05 5.44 1.74 0.05 -2.41 116.66 126.93 2jj1 n ARG 373 Ca -0.05 0.15 -0.13 0.00 -0.77 0.00 0.00 57.85 57.05 2jj1 n ARG 373 Cb 0.50 -1.68 -0.07 0.00 -1.02 0.00 0.00 32.46 30.19 2jj1 n ARG 373 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2jj1 h VAL 374 N 0.00 1.35 0.00 1.55 2.07 -1.89 -3.48 116.25 115.84 2jj1 h VAL 374 Ca 0.00 -1.27 0.00 0.00 0.82 0.00 0.00 66.70 66.25 2jj1 h VAL 374 Cb 0.58 1.88 0.00 0.00 -1.52 0.00 0.00 31.29 32.24 2jj1 h VAL 374 CO 0.00 0.37 0.00 0.61 0.02 0.00 0.00 177.57 178.57 2jj1 n GLY 375 N 0.18 1.16 0.58 2.17 0.00 -1.01 -3.09 105.19 105.18 2jj1 n GLY 375 Ca -0.06 -0.68 0.44 0.00 0.00 0.00 0.00 46.02 45.72 2jj1 n GLY 375 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2jj1 h SER 376 N 9.04 0.10 0.01 1.61 0.02 -1.91 0.42 113.55 122.84 2jj1 h SER 376 Ca 0.00 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 2jj1 h SER 376 Cb 0.00 0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.60 2jj1 h SER 376 CO 0.00 -0.08 0.00 0.00 -1.14 0.00 0.00 176.83 175.61 2jj1 n ALA 377 N -2.73 1.07 -0.66 3.77 0.00 -1.18 -1.48 120.51 119.30 2jj1 n ALA 377 Ca 0.39 -0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.89 2jj1 n ALA 377 Cb 1.67 -1.01 0.10 0.00 0.00 0.00 0.00 19.45 20.22 2jj1 n ALA 377 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jj1 n ALA 378 N -1.45 2.21 -2.58 0.00 0.00 0.14 -4.30 120.51 114.54 2jj1 n ALA 378 Ca 0.00 -1.99 -0.31 0.00 0.00 0.00 0.00 53.44 51.14 2jj1 n ALA 378 Cb 0.00 -0.27 -0.10 0.00 0.00 0.00 0.00 19.45 19.08 2jj1 n ALA 378 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2jj1 s GLN 379 N -2.15 2.32 0.71 0.00 -0.21 -0.55 -4.02 119.66 115.76 2jj1 s GLN 379 Ca 0.21 -0.89 -0.13 0.00 0.02 0.00 0.00 55.36 54.57 2jj1 s GLN 379 Cb 0.18 -2.39 0.03 0.00 1.00 0.00 0.00 33.01 31.83 2jj1 s GLN 379 CO 0.03 0.55 1.10 0.95 -2.12 0.00 0.00 175.29 175.80 2jj1 s THR 380 N -1.11 3.26 0.51 -0.19 -4.23 -1.26 -4.83 115.64 107.79 2jj1 s THR 380 Ca 0.19 0.50 0.16 0.00 -1.18 0.00 0.00 61.69 61.36 2jj1 s THR 380 Cb -0.11 -3.00 0.28 0.00 1.34 0.00 0.00 72.50 71.00 2jj1 s THR 380 CO 0.11 -0.44 2.14 0.03 -0.54 0.00 0.00 174.62 175.91 2jj1 h ARG 381 N -0.52 0.04 0.09 3.99 3.08 -1.97 -0.46 114.38 118.64 2jj1 h ARG 381 Ca -0.45 -0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.59 2jj1 h ARG 381 Cb 1.24 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.28 2jj1 h ARG 381 CO 0.53 0.02 -0.04 0.00 -1.07 0.00 0.00 179.97 179.41 2jj1 h ALA 382 N 1.97 -0.12 0.14 0.04 0.00 0.58 -2.94 119.26 118.93 2jj1 h ALA 382 Ca 0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2jj1 h ALA 382 Cb 0.04 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2jj1 h ALA 382 CO -0.00 -0.36 -0.07 1.98 0.00 0.00 0.00 179.25 180.80 2jj1 h MET 383 N -0.53 -0.18 -0.95 0.00 1.85 -1.76 -3.08 114.93 110.28 2jj1 h MET 383 Ca -0.01 0.01 0.29 0.00 -0.61 0.00 0.00 59.70 59.38 2jj1 h MET 383 Cb 0.44 0.04 -0.15 0.00 0.43 0.00 0.00 31.60 32.36 2jj1 h MET 383 CO 0.02 0.05 0.39 -0.22 -0.40 0.00 0.00 176.91 176.75 2jj1 h LYS 384 N -0.39 0.23 0.36 0.39 3.64 -1.16 0.78 116.57 120.41 2jj1 h LYS 384 Ca -0.02 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.33 2jj1 h LYS 384 Cb 0.31 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 2jj1 h LYS 384 CO 0.03 0.15 -0.17 0.37 -2.27 0.00 0.00 179.45 177.56 2jj1 h GLN 385 N 0.24 -0.46 -0.46 1.90 4.15 -1.43 -2.38 115.11 116.67 2jj1 h GLN 385 Ca 0.66 0.03 -0.04 0.00 0.77 0.00 0.00 58.65 60.07 2jj1 h GLN 385 Cb 1.44 0.11 -0.02 0.00 0.21 0.00 0.00 27.48 29.22 2jj1 h GLN 385 CO -0.66 -0.31 0.11 -0.39 -1.93 0.00 0.00 178.83 175.65 2jj1 h VAL 386 N -0.57 1.20 -0.31 2.39 -1.51 -1.46 -3.06 116.25 112.92 2jj1 h VAL 386 Ca -0.05 -0.72 0.02 0.00 -1.23 0.00 0.00 66.70 64.72 2jj1 h VAL 386 Cb 0.37 0.74 -0.03 0.00 -2.13 0.00 0.00 31.29 30.24 2jj1 h VAL 386 CO 0.08 0.27 0.15 0.00 -1.23 0.00 0.00 177.57 176.84 2jj1 h ALA 387 N 1.45 0.38 -0.02 5.19 0.00 -0.90 -2.03 119.26 123.33 2jj1 h ALA 387 Ca 0.15 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.08 2jj1 h ALA 387 Cb 0.26 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2jj1 h ALA 387 CO -0.00 -0.23 0.02 0.78 0.00 0.00 0.00 179.25 179.82 2jj1 h GLY 388 N 0.32 0.00 0.08 0.00 0.00 -1.32 0.21 103.07 102.36 2jj1 h GLY 388 Ca 0.13 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.46 2jj1 h GLY 388 CO -0.09 0.00 -0.03 -0.84 0.00 0.00 0.00 176.54 175.58 2jj1 h THR 389 N 0.00 0.36 -0.75 4.70 2.02 -1.51 -2.98 112.91 114.74 2jj1 h THR 389 Ca 0.01 -1.18 0.17 0.00 0.77 0.00 0.00 66.41 66.18 2jj1 h THR 389 Cb 0.05 0.66 -0.13 0.00 -1.74 0.00 0.00 68.15 66.99 2jj1 h THR 389 CO -0.00 0.12 0.00 -0.03 0.37 0.00 0.00 175.52 175.98 2jj1 h MET 390 N -1.01 0.10 -0.29 6.66 -1.53 -0.95 0.63 114.93 118.55 2jj1 h MET 390 Ca -0.01 -0.01 0.06 0.00 -3.44 0.00 0.00 59.70 56.31 2jj1 h MET 390 Cb 0.25 -0.02 -0.06 0.00 -0.55 0.00 0.00 31.60 31.22 2jj1 h MET 390 CO 0.01 0.06 -0.13 -0.22 0.14 0.00 0.00 176.91 176.78 2jj1 h LYS 391 N 0.10 -0.08 -0.45 0.39 3.64 -0.72 0.15 116.57 119.60 2jj1 h LYS 391 Ca 0.41 0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.72 2jj1 h LYS 391 Cb 0.72 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.54 2jj1 h LYS 391 CO -0.66 -0.05 -0.01 1.25 -2.27 0.00 0.00 179.45 177.70 2jj1 h LEU 392 N -0.08 0.80 -0.61 5.20 5.85 -0.97 -2.28 115.31 123.21 2jj1 h LEU 392 Ca 0.15 -0.31 -0.13 0.00 0.84 0.00 0.00 57.88 58.42 2jj1 h LEU 392 Cb 0.31 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 2jj1 h LEU 392 CO -0.34 0.92 -0.34 -0.33 -0.34 0.00 0.00 178.44 178.01 2jj1 h GLU 393 N 0.66 0.72 0.00 1.25 5.08 0.61 -2.23 114.58 120.67 2jj1 h GLU 393 Ca 0.13 -0.34 -0.07 0.00 -1.00 0.00 0.00 59.36 58.08 2jj1 h GLU 393 Cb 0.52 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 2jj1 h GLU 393 CO 0.03 0.95 -0.31 -0.07 -1.00 0.00 0.00 179.01 178.61 2jj1 h LEU 394 N 0.61 0.00 -0.19 1.33 3.38 -0.73 -2.49 115.31 117.21 2jj1 h LEU 394 Ca 0.06 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 2jj1 h LEU 394 Cb 0.87 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.61 2jj1 h LEU 394 CO 0.08 0.31 -0.15 0.00 0.09 0.00 0.00 178.44 178.77 2jj1 h ALA 395 N 1.69 0.28 0.00 1.53 0.00 -0.84 -0.07 119.26 121.86 2jj1 h ALA 395 Ca -0.00 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.54 2jj1 h ALA 395 Cb 0.86 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 2jj1 h ALA 395 CO 0.04 0.16 -0.21 1.96 0.00 0.00 0.00 179.25 181.20 2jj1 h GLN 396 N 0.11 0.00 0.06 0.00 4.20 -1.45 -1.63 115.11 116.40 2jj1 h GLN 396 Ca 0.04 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.74 2jj1 h GLN 396 Cb 0.67 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.45 2jj1 h GLN 396 CO 0.04 0.21 -0.03 -0.92 -0.67 0.00 0.00 178.83 177.47 2jj1 h TYR 397 N 0.00 -0.07 -0.08 2.96 3.20 -1.20 -3.07 116.97 118.71 2jj1 h TYR 397 Ca -0.00 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2jj1 h TYR 397 Cb 0.62 0.02 -0.00 0.00 1.54 0.00 0.00 36.73 38.90 2jj1 h TYR 397 CO 0.00 0.34 0.05 0.00 -1.64 0.00 0.00 178.16 176.91 2jj1 h ARG 398 N -0.50 0.11 0.00 1.82 3.08 -0.56 1.19 114.38 119.51 2jj1 h ARG 398 Ca -0.01 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 2jj1 h ARG 398 Cb 0.44 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.47 2jj1 h ARG 398 CO 0.01 0.07 -0.07 0.93 -1.07 0.00 0.00 179.97 179.84 2jj1 h GLU 399 N 0.11 0.00 0.00 0.04 5.08 -1.30 -3.31 114.58 115.21 2jj1 h GLU 399 Ca 0.03 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.21 2jj1 h GLU 399 Cb -0.01 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 2jj1 h GLU 399 CO -0.01 0.07 -1.81 0.28 -1.00 0.00 0.00 179.01 176.55 2jj1 n VAL 400 N -4.21 0.67 0.00 3.13 0.31 0.14 -4.77 118.33 113.61 2jj1 n VAL 400 Ca -0.03 -0.48 0.00 0.00 -0.01 0.00 0.00 64.34 63.82 2jj1 n VAL 400 Cb 0.15 -0.48 0.00 0.00 -0.91 0.00 0.00 33.84 32.60 2jj1 n VAL 400 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2jj1 n ALA 401 N -2.36 0.32 0.06 3.52 0.00 0.36 0.50 120.51 122.91 2jj1 n ALA 401 Ca -0.16 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.36 2jj1 n ALA 401 Cb 0.79 -0.31 -0.06 0.00 0.00 0.00 0.00 19.45 19.86 2jj1 n ALA 401 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jj1 n ALA 402 N -1.12 2.41 0.96 0.00 0.00 -1.26 -3.68 120.51 117.82 2jj1 n ALA 402 Ca 0.00 -0.40 0.02 0.00 0.00 0.00 0.00 53.44 53.05 2jj1 n ALA 402 Cb 0.32 -0.96 0.07 0.00 0.00 0.00 0.00 19.45 18.87 2jj1 n ALA 402 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2jj1 n PHE 403 N -2.64 0.31 0.08 0.00 0.99 0.18 -4.34 117.46 112.03 2jj1 n PHE 403 Ca -0.04 -0.12 -0.04 0.00 -0.00 0.00 0.00 57.45 57.25 2jj1 n PHE 403 Cb 0.64 -0.12 -0.02 0.00 -1.00 0.00 0.00 39.48 38.99 2jj1 n PHE 403 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2jj1 h ALA 404 N 2.65 -0.32 -0.02 4.37 0.00 -1.69 -3.03 119.26 121.22 2jj1 h ALA 404 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2jj1 h ALA 404 Cb 0.57 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.47 2jj1 h ALA 404 CO 0.06 -0.30 -0.02 1.04 0.00 0.00 0.00 179.25 180.03 2jj1 n GLN 405 N -4.34 1.68 -0.50 0.00 6.02 -1.26 -3.59 117.38 115.38 2jj1 n GLN 405 Ca -0.03 -1.02 0.06 0.00 -0.01 0.00 0.00 57.00 56.00 2jj1 n GLN 405 Cb 0.11 -1.48 0.12 0.00 1.02 0.00 0.00 30.24 30.01 2jj1 n GLN 405 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 2jj1 n PHE 406 N 0.23 0.00 -3.90 1.08 3.01 -1.26 -4.98 117.46 111.64 2jj1 n PHE 406 Ca 0.18 -0.94 -0.33 0.00 1.01 0.00 0.00 57.45 57.38 2jj1 n PHE 406 Cb 0.38 -0.17 -0.13 0.00 -0.01 0.00 0.00 39.48 39.55 2jj1 n PHE 406 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2jj1 s GLY 407 N -2.58 2.14 -0.19 1.37 0.00 -1.14 -4.87 107.32 102.04 2jj1 s GLY 407 Ca 0.29 -2.79 0.14 0.00 0.00 0.00 0.00 44.72 42.36 2jj1 s GLY 407 CO -0.03 1.00 0.02 1.44 0.00 0.00 0.00 173.10 175.52 2jj1 n SER 408 N 3.99 0.76 -2.46 1.64 7.64 -1.26 -4.68 113.62 119.25 2jj1 n SER 408 Ca 0.03 -0.02 -0.29 0.00 1.01 0.00 0.00 58.87 59.60 2jj1 n SER 408 Cb 0.39 0.74 0.01 0.00 -1.01 0.00 0.00 64.21 64.34 2jj1 n SER 408 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2jj1 n ASP 409 N -2.76 5.31 -4.87 6.43 9.92 -1.26 -5.05 116.55 124.27 2jj1 n ASP 409 Ca -0.32 -3.75 -0.31 0.00 -0.53 0.00 0.00 54.79 49.88 2jj1 n ASP 409 Cb 1.07 -0.56 -0.05 0.00 -0.64 0.00 0.00 41.12 40.95 2jj1 n ASP 409 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2jj1 s LEU 410 N -3.65 4.05 0.72 0.64 1.02 -1.26 -5.08 118.68 115.12 2jj1 s LEU 410 Ca 0.50 1.08 -0.11 0.00 0.02 0.00 0.00 54.13 55.62 2jj1 s LEU 410 Cb 0.41 -3.89 0.02 0.00 0.02 0.00 0.00 46.19 42.76 2jj1 s LEU 410 CO -0.18 -0.20 1.07 1.51 0.02 0.00 0.00 176.35 178.57 2jj1 s ASP 411 N -2.58 5.08 0.50 2.29 -4.77 -1.26 -4.86 116.67 111.07 2jj1 s ASP 411 Ca 0.50 1.69 0.15 0.00 -3.30 0.00 0.00 52.55 51.59 2jj1 s ASP 411 Cb -0.11 -2.50 1.20 0.00 -1.09 0.00 0.00 42.92 40.42 2jj1 s ASP 411 CO 0.23 -1.65 2.12 0.00 0.70 0.00 0.00 175.17 176.57 2jj1 h ALA 412 N -0.85 1.97 0.10 2.11 0.00 -1.97 -1.60 119.26 119.01 2jj1 h ALA 412 Ca -0.44 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.46 2jj1 h ALA 412 Cb 1.22 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2jj1 h ALA 412 CO 0.55 0.01 -0.05 0.00 0.00 0.00 0.00 179.25 179.77 2jj1 h ALA 413 N 1.93 -0.13 0.00 0.00 0.00 -1.99 -1.64 119.26 117.43 2jj1 h ALA 413 Ca 0.05 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2jj1 h ALA 413 Cb 0.05 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2jj1 h ALA 413 CO -0.01 -0.34 0.00 1.79 0.00 0.00 0.00 179.25 180.69 2jj1 h THR 414 N -0.59 0.00 0.00 0.00 1.35 -1.90 -1.71 112.91 110.06 2jj1 h THR 414 Ca -0.01 -0.38 -0.15 0.00 -0.55 0.00 0.00 66.41 65.31 2jj1 h THR 414 Cb 0.48 1.26 -0.02 0.00 -1.73 0.00 0.00 68.15 68.13 2jj1 h THR 414 CO 0.02 0.00 -0.74 1.56 -0.25 0.00 0.00 175.52 176.11 2jj1 h GLN 415 N 0.00 0.00 0.00 4.72 4.20 -1.22 -3.04 115.11 119.78 2jj1 h GLN 415 Ca 0.00 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.49 2jj1 h GLN 415 Cb 0.45 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.20 2jj1 h GLN 415 CO 0.00 0.68 -1.11 0.37 -0.67 0.00 0.00 178.83 178.10 2jj1 h GLN 416 N 0.00 0.01 -0.19 1.46 5.75 -0.69 -2.79 115.11 118.66 2jj1 h GLN 416 Ca -0.02 -0.01 -0.11 0.00 -0.15 0.00 0.00 58.65 58.37 2jj1 h GLN 416 Cb 1.55 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 30.09 2jj1 h GLN 416 CO 0.09 0.93 -0.35 -0.07 -2.65 0.00 0.00 178.83 176.78 2jj1 h LEU 417 N 0.00 0.40 -0.08 -2.39 3.38 -1.40 -1.32 115.31 113.91 2jj1 h LEU 417 Ca -0.05 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 2jj1 h LEU 417 Cb 1.81 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 42.45 2jj1 h LEU 417 CO 0.12 0.73 -0.03 -0.07 0.09 0.00 0.00 178.44 179.28 2jj1 h LEU 418 N 0.33 0.16 0.47 1.67 3.38 -1.58 -0.79 115.31 118.96 2jj1 h LEU 418 Ca 0.04 -0.41 -0.02 0.00 0.09 0.00 0.00 57.88 57.58 2jj1 h LEU 418 Cb 0.77 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.48 2jj1 h LEU 418 CO 0.06 0.53 -0.23 0.28 0.09 0.00 0.00 178.44 179.17 2jj1 h SER 419 N -0.21 -0.54 -0.39 -0.43 0.02 -1.42 0.48 113.55 111.07 2jj1 h SER 419 Ca 0.02 -0.04 0.06 0.00 -0.84 0.00 0.00 61.79 60.99 2jj1 h SER 419 Cb 0.47 0.14 -0.06 0.00 0.14 0.00 0.00 62.40 63.09 2jj1 h SER 419 CO 0.01 -0.29 0.05 -0.09 -1.14 0.00 0.00 176.83 175.37 2jj1 h ARG 420 N -0.77 0.16 -0.17 3.45 9.65 -1.36 -1.64 114.38 123.70 2jj1 h ARG 420 Ca -0.07 -0.01 0.05 0.00 -1.10 0.00 0.00 59.98 58.86 2jj1 h ARG 420 Cb 0.55 -0.04 -0.07 0.00 -1.39 0.00 0.00 29.97 29.03 2jj1 h ARG 420 CO 0.11 0.11 -0.36 0.78 2.80 0.00 0.00 179.97 183.40 2jj1 h GLY 421 N 0.16 -0.52 2.00 2.80 0.00 -0.76 0.12 103.07 106.86 2jj1 h GLY 421 Ca 0.19 0.45 -0.04 0.00 0.00 0.00 0.00 47.33 47.94 2jj1 h GLY 421 CO -0.28 -0.22 -0.17 -0.39 0.00 0.00 0.00 176.54 175.49 2jj1 h VAL 422 N -0.41 0.85 0.18 4.60 -1.51 0.33 -1.89 116.25 118.39 2jj1 h VAL 422 Ca 0.10 -0.64 -0.31 0.00 -1.23 0.00 0.00 66.70 64.62 2jj1 h VAL 422 Cb 0.58 1.38 0.01 0.00 -2.13 0.00 0.00 31.29 31.13 2jj1 h VAL 422 CO -0.40 0.17 -1.50 0.03 -1.23 0.00 0.00 177.57 174.63 2jj1 h ARG 423 N 0.00 0.37 -0.75 5.19 3.08 -0.76 -2.92 114.38 118.59 2jj1 h ARG 423 Ca -0.00 -0.63 0.01 0.00 0.07 0.00 0.00 59.98 59.42 2jj1 h ARG 423 Cb 0.36 0.24 -0.04 0.00 0.08 0.00 0.00 29.97 30.61 2jj1 h ARG 423 CO 0.02 1.30 0.49 -0.07 -1.07 0.00 0.00 179.97 180.65 2jj1 h LEU 424 N -0.06 0.86 -1.03 3.04 3.38 -0.72 -1.24 115.31 119.54 2jj1 h LEU 424 Ca -0.29 -0.03 0.03 0.00 0.09 0.00 0.00 57.88 57.68 2jj1 h LEU 424 Cb 1.97 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 42.44 2jj1 h LEU 424 CO 0.16 0.63 0.65 0.74 0.09 0.00 0.00 178.44 180.71 2jj1 h THR 425 N 1.02 1.19 -0.25 0.22 2.02 -1.42 -1.53 112.91 114.16 2jj1 h THR 425 Ca 0.27 -0.44 -0.10 0.00 0.77 0.00 0.00 66.41 66.92 2jj1 h THR 425 Cb -0.11 -0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 66.10 2jj1 h THR 425 CO -0.06 0.23 -0.28 -0.33 0.37 0.00 0.00 175.52 175.45 2jj1 h GLU 426 N 1.27 0.49 0.00 6.66 4.39 -1.16 -2.81 114.58 123.42 2jj1 h GLU 426 Ca 0.39 -0.20 0.00 0.00 0.34 0.00 0.00 59.36 59.89 2jj1 h GLU 426 Cb -0.03 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.59 2jj1 h GLU 426 CO -0.11 0.72 0.00 1.28 -1.16 0.00 0.00 179.01 179.74 2jj1 n LEU 427 N -4.10 0.49 0.01 1.33 4.77 -0.54 -1.93 117.00 117.03 2jj1 n LEU 427 Ca -0.01 0.61 0.11 0.00 -0.03 0.00 0.00 56.01 56.70 2jj1 n LEU 427 Cb 0.43 -0.54 0.10 0.00 -2.33 0.00 0.00 43.42 41.08 2jj1 n LEU 427 CO 0.42 -0.44 0.21 0.18 -1.33 0.00 0.00 177.39 176.43 2jj1 n LEU 428 N -2.03 0.65 -4.77 2.23 4.77 -0.85 -4.89 117.00 112.12 2jj1 n LEU 428 Ca 0.03 -0.11 -0.37 0.00 -0.03 0.00 0.00 56.01 55.52 2jj1 n LEU 428 Cb 0.23 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 2jj1 n LEU 428 CO 0.19 0.12 0.87 -0.54 -1.33 0.00 0.00 177.39 176.70 2jj1 s LYS 429 N -3.06 3.61 -0.14 3.23 1.02 -0.81 -4.43 119.74 119.15 2jj1 s LYS 429 Ca 0.08 1.89 -0.17 0.00 0.02 0.00 0.00 55.97 57.79 2jj1 s LYS 429 Cb 0.16 -2.37 0.04 0.00 -0.52 0.00 0.00 37.83 35.15 2jj1 s LYS 429 CO 0.77 -0.71 0.46 -1.14 -0.92 0.00 0.00 175.35 173.81 2jj1 s GLN 430 N -2.75 0.60 0.52 1.68 0.74 -0.14 -4.95 119.66 115.36 2jj1 s GLN 430 Ca 0.66 0.50 -0.18 0.00 0.05 0.00 0.00 55.36 56.38 2jj1 s GLN 430 Cb -0.31 0.29 -0.07 0.00 1.10 0.00 0.00 33.01 34.01 2jj1 s GLN 430 CO 0.38 -0.10 1.02 0.20 -0.55 0.00 0.00 175.29 176.24 2jj1 s GLY 431 N -0.09 2.30 0.69 2.59 0.00 -1.26 -4.22 107.32 107.33 2jj1 s GLY 431 Ca -0.03 0.45 -0.11 0.00 0.00 0.00 0.00 44.72 45.03 2jj1 s GLY 431 CO 0.02 0.75 1.06 1.62 0.00 0.00 0.00 173.10 176.55 2jj1 s GLN 432 N -3.63 3.00 -1.63 2.90 0.74 -1.26 -3.96 119.66 115.82 2jj1 s GLN 432 Ca 0.64 0.77 0.00 0.00 0.05 0.00 0.00 55.36 56.82 2jj1 s GLN 432 Cb -0.14 -2.01 0.00 0.00 1.10 0.00 0.00 33.01 31.96 2jj1 s GLN 432 CO 0.26 -1.01 0.00 0.66 -0.55 0.00 0.00 175.29 174.66 2jj1 n TYR 433 N -3.04 -0.53 -3.22 1.67 4.02 -1.26 -4.88 117.16 109.92 2jj1 n TYR 433 Ca 0.07 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.73 2jj1 n TYR 433 Cb 0.55 -3.07 -0.07 0.00 -0.02 0.00 0.00 39.34 36.73 2jj1 n TYR 433 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 2jj1 n SER 434 N -1.18 -0.50 -4.75 7.72 3.41 -1.25 -5.12 113.62 111.94 2jj1 n SER 434 Ca -0.17 -2.62 -0.33 0.00 -0.26 0.00 0.00 58.87 55.49 2jj1 n SER 434 Cb 0.57 -0.30 0.08 0.00 -0.26 0.00 0.00 64.21 64.29 2jj1 n SER 434 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 2jj1 s PRO 435 N -0.45 2.39 0.12 4.33 0.04 -1.26 -4.82 135.00 135.35 2jj1 s PRO 435 Ca 0.34 1.50 0.07 0.00 0.04 0.00 0.00 61.00 62.95 2jj1 s PRO 435 Cb 0.11 -1.89 -0.04 0.00 0.04 0.00 0.00 34.50 32.72 2jj1 s PRO 435 CO -0.15 -1.59 -0.10 -1.64 0.04 0.00 0.00 177.00 173.56 2jj1 s MET 436 N -4.15 2.11 0.57 4.56 -1.94 0.15 -5.02 119.30 115.58 2jj1 s MET 436 Ca 0.69 -1.07 -0.19 0.00 -1.71 0.00 0.00 55.69 53.41 2jj1 s MET 436 Cb -0.23 -2.28 -0.05 0.00 2.01 0.00 0.00 34.83 34.29 2jj1 s MET 436 CO 0.45 0.49 1.15 0.00 -0.01 0.00 0.00 175.02 177.10 2jj1 s ALA 437 N -1.30 2.62 0.13 3.03 0.00 -1.26 -4.29 121.76 120.69 2jj1 s ALA 437 Ca 0.22 0.84 -0.19 0.00 0.00 0.00 0.00 51.96 52.83 2jj1 s ALA 437 Cb -0.11 -3.38 -0.06 0.00 0.00 0.00 0.00 23.12 19.58 2jj1 s ALA 437 CO 0.14 -0.94 1.78 0.97 0.00 0.00 0.00 175.76 177.71 2jj1 h ILE 438 N 0.97 1.06 -0.89 0.00 6.09 -1.99 -1.82 117.51 120.93 2jj1 h ILE 438 Ca -0.50 -0.11 0.12 0.00 -1.37 0.00 0.00 64.86 63.01 2jj1 h ILE 438 Cb 1.27 0.72 -0.07 0.00 0.47 0.00 0.00 36.82 39.21 2jj1 h ILE 438 CO 0.56 0.06 0.57 1.05 -3.07 0.00 0.00 178.15 177.32 2jj1 h GLU 439 N 0.31 0.77 -0.57 2.19 9.09 -1.93 -0.86 114.58 123.58 2jj1 h GLU 439 Ca 0.08 -0.05 -0.02 0.00 0.05 0.00 0.00 59.36 59.43 2jj1 h GLU 439 Cb -0.03 -0.17 -0.03 0.00 -1.65 0.00 0.00 28.75 26.87 2jj1 h GLU 439 CO -0.02 0.51 0.28 0.93 0.05 0.00 0.00 179.01 180.76 2jj1 h GLU 440 N 0.79 0.81 0.10 1.06 5.08 -1.74 -1.79 114.58 118.89 2jj1 h GLU 440 Ca 0.43 -0.11 -0.00 0.00 -1.00 0.00 0.00 59.36 58.68 2jj1 h GLU 440 Cb 0.55 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.65 2jj1 h GLU 440 CO -0.19 0.65 -0.07 1.96 -1.00 0.00 0.00 179.01 180.35 2jj1 h GLN 441 N 0.77 -0.17 -0.94 2.33 4.20 -0.46 -2.57 115.11 118.26 2jj1 h GLN 441 Ca 0.20 0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.95 2jj1 h GLN 441 Cb 0.10 0.04 -0.05 0.00 0.30 0.00 0.00 27.48 27.86 2jj1 h GLN 441 CO -0.03 -0.11 0.62 -0.39 -0.67 0.00 0.00 178.83 178.25 2jj1 h VAL 442 N -0.18 1.19 -0.35 -0.54 -1.51 -1.07 -0.53 116.25 113.27 2jj1 h VAL 442 Ca -0.00 -0.42 -0.01 0.00 -1.23 0.00 0.00 66.70 65.04 2jj1 h VAL 442 Cb 0.16 -0.13 -0.02 0.00 -2.13 0.00 0.00 31.29 29.17 2jj1 h VAL 442 CO -0.01 0.22 0.18 0.00 -1.23 0.00 0.00 177.57 176.74 2jj1 h ALA 443 N 1.44 0.45 -0.23 5.19 0.00 -1.21 0.18 119.26 125.08 2jj1 h ALA 443 Ca 0.36 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 55.08 2jj1 h ALA 443 Cb -0.04 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2jj1 h ALA 443 CO -0.10 -0.01 -0.31 0.28 0.00 0.00 0.00 179.25 179.11 2jj1 h VAL 444 N 0.43 1.28 -0.21 0.00 2.07 -1.03 -2.25 116.25 116.54 2jj1 h VAL 444 Ca 0.12 -1.38 -0.21 0.00 0.82 0.00 0.00 66.70 66.05 2jj1 h VAL 444 Cb 0.09 1.44 0.01 0.00 -1.52 0.00 0.00 31.29 31.31 2jj1 h VAL 444 CO -0.02 0.43 -0.67 0.40 0.02 0.00 0.00 177.57 177.73 2jj1 h ILE 445 N 0.41 1.28 -0.79 4.57 2.04 -0.87 -2.98 117.51 121.17 2jj1 h ILE 445 Ca 0.05 -1.87 0.17 0.00 1.00 0.00 0.00 64.86 64.22 2jj1 h ILE 445 Cb 0.75 1.82 -0.11 0.00 -0.74 0.00 0.00 36.82 38.54 2jj1 h ILE 445 CO 0.06 0.60 0.25 0.22 0.00 0.00 0.00 178.15 179.28 2jj1 h TYR 446 N 0.59 0.41 -0.66 1.37 3.20 -0.41 0.19 116.97 121.67 2jj1 h TYR 446 Ca -0.02 0.04 0.14 0.00 3.14 0.00 0.00 58.73 62.03 2jj1 h TYR 446 Cb 1.29 -0.06 -0.11 0.00 1.54 0.00 0.00 36.73 39.39 2jj1 h TYR 446 CO 0.08 -0.05 0.05 0.00 -1.64 0.00 0.00 178.16 176.60 2jj1 h ALA 447 N 1.63 0.71 0.11 1.82 0.00 -1.25 -1.66 119.26 120.62 2jj1 h ALA 447 Ca 0.46 0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.55 2jj1 h ALA 447 Cb 0.79 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2jj1 h ALA 447 CO -0.50 -0.38 -0.05 0.78 0.00 0.00 0.00 179.25 179.10 2jj1 h GLY 448 N 0.16 -0.15 2.00 0.00 0.00 -0.98 -2.63 103.07 101.47 2jj1 h GLY 448 Ca 0.35 0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.74 2jj1 h GLY 448 CO -0.53 -0.05 0.00 -0.39 0.00 0.00 0.00 176.54 175.57 2jj1 h VAL 449 N -0.94 0.00 -0.01 4.60 -1.51 -0.66 -0.25 116.25 117.47 2jj1 h VAL 449 Ca -0.01 -0.31 0.00 0.00 -1.23 0.00 0.00 66.70 65.14 2jj1 h VAL 449 Cb 0.49 1.21 0.00 0.00 -2.13 0.00 0.00 31.29 30.87 2jj1 h VAL 449 CO 0.02 0.00 -0.14 0.54 -1.23 0.00 0.00 177.57 176.76 2jj1 n ARG 450 N -2.84 1.41 -0.72 5.19 5.12 -0.63 -4.96 116.66 119.23 2jj1 n ARG 450 Ca 0.00 -0.92 0.00 0.00 -1.93 0.00 0.00 57.85 55.00 2jj1 n ARG 450 Cb 0.22 -1.48 0.00 0.00 -1.16 0.00 0.00 32.46 30.04 2jj1 n ARG 450 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2jj1 n GLY 451 N 1.28 0.71 0.24 -0.13 0.00 -0.11 -4.93 105.19 102.26 2jj1 n GLY 451 Ca 0.15 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.26 2jj1 n GLY 451 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2jj1 h TYR 452 N 0.00 0.00 -0.02 1.61 -1.99 -1.67 -2.92 116.97 111.98 2jj1 h TYR 452 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2jj1 h TYR 452 Cb 0.00 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.73 2jj1 h TYR 452 CO 0.00 0.18 -0.17 1.28 -0.00 0.00 0.00 178.16 179.45 2jj1 n LEU 453 N -3.81 1.79 -0.16 3.88 4.77 -1.23 -4.46 117.00 117.78 2jj1 n LEU 453 Ca -0.02 -0.59 0.22 0.00 -0.03 0.00 0.00 56.01 55.59 2jj1 n LEU 453 Cb 0.28 -0.03 0.62 0.00 -2.33 0.00 0.00 43.42 41.95 2jj1 n LEU 453 CO 0.33 0.31 1.23 0.44 -1.33 0.00 0.00 177.39 178.37 2jj1 h ASP 454 N 2.54 0.19 -0.51 -1.43 3.32 -1.85 -1.06 116.42 117.62 2jj1 h ASP 454 Ca 0.00 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2jj1 h ASP 454 Cb 0.66 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.19 2jj1 h ASP 454 CO 0.00 0.08 0.00 0.29 -1.72 0.00 0.00 179.24 177.89 2jj1 n LYS 455 N -4.40 3.45 -4.47 3.56 5.02 -1.26 -4.94 118.16 115.13 2jj1 n LYS 455 Ca 0.16 -2.73 -0.34 0.00 -2.02 0.00 0.00 58.31 53.38 2jj1 n LYS 455 Cb 0.74 -1.78 -0.10 0.00 -0.02 0.00 0.00 35.03 33.87 2jj1 n LYS 455 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2jj1 s LEU 456 N -1.91 3.40 0.25 -0.35 2.96 -0.40 -5.08 118.68 117.55 2jj1 s LEU 456 Ca 0.44 0.05 -0.31 0.00 -0.22 0.00 0.00 54.13 54.10 2jj1 s LEU 456 Cb 0.29 -1.79 -0.11 0.00 0.50 0.00 0.00 46.19 45.08 2jj1 s LEU 456 CO 0.20 0.36 1.62 -1.61 -1.32 0.00 0.00 176.35 175.59 2jj1 s GLU 457 N -0.95 4.14 0.22 1.98 2.02 -1.26 -4.92 118.70 119.93 2jj1 s GLU 457 Ca 0.14 2.55 -0.08 0.00 0.02 0.00 0.00 54.97 57.59 2jj1 s GLU 457 Cb -0.11 -3.06 0.34 0.00 0.10 0.00 0.00 34.13 31.40 2jj1 s GLU 457 CO 0.03 -0.65 1.71 -1.35 0.02 0.00 0.00 175.26 175.02 2jj1 h PRO 458 N 5.61 0.29 -0.26 0.39 0.11 -1.94 0.92 132.00 137.13 2jj1 h PRO 458 Ca -0.45 -0.02 0.08 0.00 0.11 0.00 0.00 66.00 65.71 2jj1 h PRO 458 Cb 1.21 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 2jj1 h PRO 458 CO 0.85 0.20 0.22 0.66 -0.21 0.00 0.00 178.00 179.72 2jj1 h SER 459 N 0.30 0.00 1.25 -2.05 4.64 -1.98 -2.16 113.55 113.56 2jj1 h SER 459 Ca 0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 2jj1 h SER 459 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 2jj1 h SER 459 CO -0.41 0.00 -0.21 0.29 -0.87 0.00 0.00 176.83 175.63 2jj1 n LYS 460 N -4.12 0.26 -0.25 4.77 5.02 0.31 -4.37 118.16 119.77 2jj1 n LYS 460 Ca 0.03 0.16 -0.05 0.00 -2.02 0.00 0.00 58.31 56.44 2jj1 n LYS 460 Cb 0.37 -1.75 0.06 0.00 -0.02 0.00 0.00 35.03 33.69 2jj1 n LYS 460 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2jj1 h ILE 461 N 0.00 1.18 -0.55 -0.18 1.08 -1.27 -1.42 117.51 116.35 2jj1 h ILE 461 Ca 0.00 -0.33 -0.10 0.00 -0.39 0.00 0.00 64.86 64.04 2jj1 h ILE 461 Cb 0.73 0.14 -0.02 0.00 -3.07 0.00 0.00 36.82 34.60 2jj1 h ILE 461 CO 0.00 0.17 -0.04 0.71 -0.69 0.00 0.00 178.15 178.31 2jj1 h THR 462 N 0.96 1.27 -0.75 -0.27 1.35 -1.79 0.64 112.91 114.32 2jj1 h THR 462 Ca 0.26 -1.17 -0.01 0.00 -0.55 0.00 0.00 66.41 64.94 2jj1 h THR 462 Cb -0.11 0.92 -0.04 0.00 -1.73 0.00 0.00 68.15 67.19 2jj1 h THR 462 CO -0.06 0.42 0.42 0.50 -0.25 0.00 0.00 175.52 176.55 2jj1 h LYS 463 N 0.87 1.04 0.12 4.72 3.64 -1.79 -2.29 116.57 122.89 2jj1 h LYS 463 Ca 0.15 -0.12 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 2jj1 h LYS 463 Cb 0.59 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 2jj1 h LYS 463 CO 0.04 0.77 -0.06 0.35 -2.27 0.00 0.00 179.45 178.28 2jj1 h PHE 464 N 1.03 -0.15 -0.27 1.91 3.57 -0.69 -2.61 116.94 119.74 2jj1 h PHE 464 Ca 0.26 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.80 2jj1 h PHE 464 Cb 0.02 0.05 -0.04 0.00 2.79 0.00 0.00 35.95 38.77 2jj1 h PHE 464 CO -0.00 -0.07 0.02 1.49 -2.23 0.00 0.00 178.31 177.52 2jj1 h GLU 465 N -0.18 0.10 -0.44 1.11 4.81 -0.76 0.49 114.58 119.71 2jj1 h GLU 465 Ca -0.02 -0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.29 2jj1 h GLU 465 Cb 0.14 -0.02 -0.07 0.00 0.63 0.00 0.00 28.75 29.43 2jj1 h GLU 465 CO 0.03 0.07 0.04 -0.97 -0.73 0.00 0.00 179.01 177.44 2jj1 h ASN 466 N 0.11 -0.10 -0.19 1.04 -1.24 -1.29 0.39 115.58 114.29 2jj1 h ASN 466 Ca 0.13 0.09 -0.15 0.00 0.71 0.00 0.00 56.30 57.08 2jj1 h ASN 466 Cb 0.15 0.15 0.00 0.00 0.73 0.00 0.00 38.32 39.35 2jj1 h ASN 466 CO -0.20 -0.02 -0.47 0.00 -1.29 0.00 0.00 177.43 175.46 2jj1 h ALA 467 N 1.37 0.32 -0.24 1.57 0.00 -1.17 -2.17 119.26 118.93 2jj1 h ALA 467 Ca 0.22 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2jj1 h ALA 467 Cb 0.30 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2jj1 h ALA 467 CO -0.33 0.47 0.16 0.35 0.00 0.00 0.00 179.25 179.90 2jj1 h PHE 468 N 0.35 0.31 -0.55 0.00 3.57 0.64 -1.51 116.94 119.74 2jj1 h PHE 468 Ca -0.00 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.44 2jj1 h PHE 468 Cb 1.08 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 39.69 2jj1 h PHE 468 CO 0.09 0.21 0.10 1.25 -2.23 0.00 0.00 178.31 177.73 2jj1 h LEU 469 N 0.32 0.86 -0.45 0.59 5.85 -0.33 -2.26 115.31 119.90 2jj1 h LEU 469 Ca 0.09 -0.25 0.07 0.00 0.84 0.00 0.00 57.88 58.62 2jj1 h LEU 469 Cb -0.02 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 40.72 2jj1 h LEU 469 CO -0.02 0.89 0.11 0.28 -0.34 0.00 0.00 178.44 179.37 2jj1 h SER 470 N 0.79 0.06 0.52 1.25 0.02 -1.09 -0.62 113.55 114.48 2jj1 h SER 470 Ca 0.17 0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 61.17 2jj1 h SER 470 Cb 0.39 0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.99 2jj1 h SER 470 CO 0.01 0.07 -0.48 -0.74 -1.14 0.00 0.00 176.83 174.54 2jj1 h HIS 471 N 0.26 -1.33 -0.18 3.45 -0.00 -1.12 0.36 115.15 116.58 2jj1 h HIS 471 Ca 0.22 0.01 -0.02 0.00 -0.00 0.00 0.00 60.37 60.58 2jj1 h HIS 471 Cb 0.26 0.51 -0.01 0.00 -0.00 0.00 0.00 27.41 28.17 2jj1 h HIS 471 CO -0.19 -0.66 0.04 -0.39 -0.00 0.00 0.00 177.93 176.73 2jj1 h VAL 472 N -0.99 1.10 -0.04 5.26 -1.51 -1.16 0.48 116.25 119.38 2jj1 h VAL 472 Ca -0.06 -0.34 -0.19 0.00 -1.23 0.00 0.00 66.70 64.87 2jj1 h VAL 472 Cb 0.86 0.92 -0.00 0.00 -2.13 0.00 0.00 31.29 30.93 2jj1 h VAL 472 CO -0.04 0.12 -0.80 0.40 -1.23 0.00 0.00 177.57 176.02 2jj1 h ILE 473 N 0.26 1.41 0.02 7.19 2.04 -0.94 -2.28 117.51 125.20 2jj1 h ILE 473 Ca 0.06 -2.29 -0.00 0.00 1.00 0.00 0.00 64.86 63.63 2jj1 h ILE 473 Cb 0.11 2.24 0.00 0.00 -0.74 0.00 0.00 36.82 38.44 2jj1 h ILE 473 CO -0.00 0.68 -0.01 -1.28 0.00 0.00 0.00 178.15 177.54 2jj1 h SER 474 N 0.22 -0.02 0.10 1.72 0.87 0.20 -3.40 113.55 113.25 2jj1 h SER 474 Ca -0.04 -0.75 -0.37 0.00 -1.23 0.00 0.00 61.79 59.40 2jj1 h SER 474 Cb 1.39 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 63.31 2jj1 h SER 474 CO 0.13 0.82 -2.17 0.00 -0.53 0.00 0.00 176.83 175.09 2jj1 n GLN 475 N -4.69 0.71 -2.32 2.24 6.02 0.16 -4.58 117.38 114.91 2jj1 n GLN 475 Ca -0.08 0.21 -0.31 0.00 -0.01 0.00 0.00 57.00 56.81 2jj1 n GLN 475 Cb 0.37 -1.64 0.01 0.00 1.02 0.00 0.00 30.24 30.00 2jj1 n GLN 475 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 2jj1 n HIS 476 N -3.34 3.30 -0.19 1.08 8.25 -0.87 -4.70 115.22 118.75 2jj1 n HIS 476 Ca -0.36 -2.90 0.01 0.00 -0.26 0.00 0.00 57.72 54.22 2jj1 n HIS 476 Cb 1.03 -0.40 0.27 0.00 1.12 0.00 0.00 29.99 32.01 2jj1 n HIS 476 CO 0.00 0.00 0.00 0.37 0.64 0.00 0.00 176.34 177.35 2jj1 h GLN 477 N 2.70 0.94 -0.80 -0.41 5.75 -1.74 -0.51 115.11 121.04 2jj1 h GLN 477 Ca 0.38 -0.06 -0.00 0.00 -0.15 0.00 0.00 58.65 58.82 2jj1 h GLN 477 Cb 0.66 -0.21 -0.04 0.00 1.07 0.00 0.00 27.48 28.96 2jj1 h GLN 477 CO 1.02 0.62 0.48 0.00 -2.65 0.00 0.00 178.83 178.30 2jj1 h ALA 478 N 1.55 1.02 -0.49 3.38 0.00 -1.90 0.72 119.26 123.55 2jj1 h ALA 478 Ca 0.26 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.95 2jj1 h ALA 478 Cb -0.10 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.35 2jj1 h ALA 478 CO -0.06 0.48 -0.21 1.25 0.00 0.00 0.00 179.25 180.71 2jj1 h LEU 479 N 1.09 1.03 -1.04 0.00 7.12 -1.77 -0.89 115.31 120.86 2jj1 h LEU 479 Ca 0.29 -0.39 -0.02 0.00 0.13 0.00 0.00 57.88 57.88 2jj1 h LEU 479 Cb -0.04 -0.28 -0.04 0.00 -0.53 0.00 0.00 40.66 39.77 2jj1 h LEU 479 CO -0.05 1.20 0.41 -0.07 -0.13 0.00 0.00 178.44 179.79 2jj1 h LEU 480 N 0.87 0.97 -1.96 2.25 3.38 -0.59 -1.81 115.31 118.41 2jj1 h LEU 480 Ca 0.11 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2jj1 h LEU 480 Cb 0.79 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 2jj1 h LEU 480 CO 0.07 0.79 0.02 -1.28 0.09 0.00 0.00 178.44 178.13 2jj1 h SER 481 N 1.08 0.04 0.96 -0.43 0.87 0.10 -3.10 113.55 113.08 2jj1 h SER 481 Ca 0.27 -0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.81 2jj1 h SER 481 Cb 0.05 -0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 61.99 2jj1 h SER 481 CO -0.04 0.03 -1.05 0.29 -0.53 0.00 0.00 176.83 175.53 2jj1 n LYS 482 N -4.53 0.61 0.07 2.24 5.02 -0.39 -2.87 118.16 118.30 2jj1 n LYS 482 Ca -0.02 0.14 -0.05 0.00 -2.02 0.00 0.00 58.31 56.35 2jj1 n LYS 482 Cb 0.09 -1.83 0.13 0.00 -0.02 0.00 0.00 35.03 33.40 2jj1 n LYS 482 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2jj1 h ILE 483 N 0.00 1.36 0.03 -0.18 2.04 -1.33 -2.58 117.51 116.85 2jj1 h ILE 483 Ca -0.02 -1.87 -0.00 0.00 1.00 0.00 0.00 64.86 63.97 2jj1 h ILE 483 Cb 1.07 1.90 0.00 0.00 -0.74 0.00 0.00 36.82 39.06 2jj1 h ILE 483 CO 0.01 0.56 -0.01 -0.09 0.00 0.00 0.00 178.15 178.61 2jj1 h ARG 484 N 0.23 -0.04 -0.62 2.37 2.43 -1.67 -3.31 114.38 113.78 2jj1 h ARG 484 Ca 0.00 0.00 0.06 0.00 -0.81 0.00 0.00 59.98 59.23 2jj1 h ARG 484 Cb 1.05 0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 30.54 2jj1 h ARG 484 CO 0.09 -0.02 -0.36 2.41 -1.51 0.00 0.00 179.97 180.57 2jj1 n THR 485 N -2.25 -0.42 0.25 0.20 -1.04 -1.14 -0.71 114.28 109.17 2jj1 n THR 485 Ca -0.00 1.69 0.18 0.00 -2.04 0.00 0.00 64.05 63.87 2jj1 n THR 485 Cb 0.02 -2.10 0.89 0.00 -1.82 0.00 0.00 70.33 67.31 2jj1 n THR 485 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 2jj1 h ASP 486 N 0.00 0.00 0.00 8.00 5.19 -1.63 -3.46 116.42 124.52 2jj1 h ASP 486 Ca 0.10 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.51 2jj1 h ASP 486 Cb 0.25 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.76 2jj1 h ASP 486 CO -0.58 0.00 0.00 0.61 -3.12 0.00 0.00 179.24 176.15 2jj1 n GLY 487 N -1.32 2.10 0.00 2.75 0.00 0.11 -4.89 105.19 103.94 2jj1 n GLY 487 Ca 0.01 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.70 2jj1 n GLY 487 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2jj1 n LYS 488 N 0.00 2.85 -3.55 1.61 2.85 -1.26 0.12 118.16 120.78 2jj1 n LYS 488 Ca 0.00 0.00 -0.41 0.00 -1.05 0.00 0.00 58.31 56.85 2jj1 n LYS 488 Cb 0.00 0.00 -0.11 0.00 -0.65 0.00 0.00 35.03 34.27 2jj1 n LYS 488 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 2jj1 s ILE 489 N 1.01 4.79 0.88 0.58 1.01 -1.26 -4.72 121.20 123.49 2jj1 s ILE 489 Ca 0.00 -0.84 -0.11 0.00 0.00 0.00 0.00 60.65 59.69 2jj1 s ILE 489 Cb 0.00 -3.70 0.12 0.00 0.01 0.00 0.00 42.46 38.89 2jj1 s ILE 489 CO 0.00 -0.29 1.09 -0.94 0.00 0.00 0.00 174.94 174.80 2jj1 s SER 490 N 1.66 3.60 0.49 3.58 1.04 -1.26 -4.74 113.70 118.07 2jj1 s SER 490 Ca 0.03 1.52 0.18 0.00 0.48 0.00 0.00 55.95 58.16 2jj1 s SER 490 Cb -0.20 -2.20 1.20 0.00 0.10 0.00 0.00 66.02 64.92 2jj1 s SER 490 CO 0.07 -2.56 2.03 -0.33 0.98 0.00 0.00 173.24 173.43 2jj1 h GLU 491 N -1.50 0.18 -0.12 4.02 5.08 -1.98 0.27 114.58 120.53 2jj1 h GLU 491 Ca -0.49 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 57.85 2jj1 h GLU 491 Cb 1.28 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.48 2jj1 h GLU 491 CO 0.54 0.12 0.01 1.49 -1.00 0.00 0.00 179.01 180.17 2jj1 h GLU 492 N 0.18 0.20 -0.32 2.33 4.81 -1.99 -0.44 114.58 119.36 2jj1 h GLU 492 Ca 0.20 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.30 2jj1 h GLU 492 Cb 0.54 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.88 2jj1 h GLU 492 CO -0.03 0.42 -0.09 0.77 -0.73 0.00 0.00 179.01 179.34 2jj1 h SER 493 N -0.04 0.51 0.36 1.04 0.02 -1.58 -1.48 113.55 112.38 2jj1 h SER 493 Ca 0.04 -0.13 -0.07 0.00 -0.84 0.00 0.00 61.79 60.79 2jj1 h SER 493 Cb 0.32 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 2jj1 h SER 493 CO 0.00 0.65 -0.31 -0.78 -1.14 0.00 0.00 176.83 175.25 2jj1 h ASP 494 N 0.50 0.00 0.12 3.07 -0.00 -0.36 -1.71 116.42 118.03 2jj1 h ASP 494 Ca 0.09 0.00 -0.01 0.00 -0.00 0.00 0.00 57.03 57.12 2jj1 h ASP 494 Cb 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.80 2jj1 h ASP 494 CO 0.03 0.31 -0.06 0.00 -0.00 0.00 0.00 179.24 179.52 2jj1 h ALA 495 N 1.69 -0.16 -0.45 -0.78 0.00 -0.42 -2.97 119.26 116.17 2jj1 h ALA 495 Ca -0.00 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 54.70 2jj1 h ALA 495 Cb 0.58 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 2jj1 h ALA 495 CO 0.04 -0.22 0.21 0.87 0.00 0.00 0.00 179.25 180.14 2jj1 h LYS 496 N -0.88 0.40 -0.59 0.00 1.57 -1.19 -1.83 116.57 114.05 2jj1 h LYS 496 Ca -0.02 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 2jj1 h LYS 496 Cb 0.54 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.74 2jj1 h LYS 496 CO 0.03 0.27 0.29 -0.07 -0.57 0.00 0.00 179.45 179.39 2jj1 h LEU 497 N 0.41 0.76 -0.91 2.94 3.38 -1.47 0.23 115.31 120.65 2jj1 h LEU 497 Ca 0.20 -0.12 0.13 0.00 0.09 0.00 0.00 57.88 58.18 2jj1 h LEU 497 Cb 0.13 -0.20 -0.09 0.00 0.09 0.00 0.00 40.66 40.60 2jj1 h LEU 497 CO -0.16 0.67 0.53 0.50 0.09 0.00 0.00 178.44 180.07 2jj1 h LYS 498 N 0.80 0.78 0.03 1.13 3.64 -1.18 -0.55 116.57 121.22 2jj1 h LYS 498 Ca 0.20 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.49 2jj1 h LYS 498 Cb 0.10 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 2jj1 h LYS 498 CO -0.03 0.51 -0.22 0.93 -2.27 0.00 0.00 179.45 178.37 2jj1 h GLU 499 N 0.80 0.06 -0.60 1.90 4.39 -0.96 -2.97 114.58 117.20 2jj1 h GLU 499 Ca 0.47 -0.11 0.12 0.00 0.34 0.00 0.00 59.36 60.19 2jj1 h GLU 499 Cb 0.56 0.04 -0.10 0.00 -0.10 0.00 0.00 28.75 29.15 2jj1 h GLU 499 CO -0.31 1.05 -0.00 0.82 -1.16 0.00 0.00 179.01 179.41 2jj1 h ILE 500 N -0.86 0.50 0.20 3.13 2.04 -0.84 -2.46 117.51 119.22 2jj1 h ILE 500 Ca -0.04 -0.04 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 2jj1 h ILE 500 Cb 1.15 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 37.61 2jj1 h ILE 500 CO 0.03 0.02 -0.09 0.58 0.00 0.00 0.00 178.15 178.68 2jj1 h VAL 501 N 0.11 0.90 -0.68 1.67 2.07 -1.23 -1.39 116.25 117.70 2jj1 h VAL 501 Ca 0.31 -0.77 0.13 0.00 0.82 0.00 0.00 66.70 67.19 2jj1 h VAL 501 Cb 0.50 1.33 -0.09 0.00 -1.52 0.00 0.00 31.29 31.51 2jj1 h VAL 501 CO -0.52 0.17 0.22 0.71 0.02 0.00 0.00 177.57 178.17 2jj1 h THR 502 N -0.66 0.65 0.01 2.57 1.35 -1.35 0.18 112.91 115.66 2jj1 h THR 502 Ca -0.03 -0.12 -0.00 0.00 -0.55 0.00 0.00 66.41 65.71 2jj1 h THR 502 Cb 0.47 0.26 0.00 0.00 -1.73 0.00 0.00 68.15 67.15 2jj1 h THR 502 CO 0.04 0.07 -0.00 0.78 -0.25 0.00 0.00 175.52 176.16 2jj1 h ASN 503 N 0.36 -0.01 -0.70 5.36 2.35 -1.52 -2.79 115.58 118.64 2jj1 h ASN 503 Ca 0.37 -0.75 0.12 0.00 -0.55 0.00 0.00 56.30 55.49 2jj1 h ASN 503 Cb 0.55 0.00 -0.13 0.00 0.05 0.00 0.00 38.32 38.79 2jj1 h ASN 503 CO -0.40 0.75 -0.36 0.15 -1.65 0.00 0.00 177.43 175.92 2jj1 h PHE 504 N -0.77 -1.01 -0.57 1.19 3.57 -0.78 -0.51 116.94 118.06 2jj1 h PHE 504 Ca -0.00 0.08 0.04 0.00 3.53 0.00 0.00 57.97 61.62 2jj1 h PHE 504 Cb 0.75 0.54 -0.04 0.00 2.79 0.00 0.00 35.95 40.00 2jj1 h PHE 504 CO 0.19 -0.39 0.33 1.25 -2.23 0.00 0.00 178.31 177.46 2jj1 h LEU 505 N -0.13 0.52 -1.04 0.59 5.85 -0.72 -1.00 115.31 119.39 2jj1 h LEU 505 Ca 0.26 0.01 0.04 0.00 0.84 0.00 0.00 57.88 59.03 2jj1 h LEU 505 Cb 0.56 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.44 2jj1 h LEU 505 CO -0.76 0.36 0.64 0.00 -0.34 0.00 0.00 178.44 178.34 2jj1 h ALA 506 N 1.27 1.37 -0.73 1.25 0.00 -1.00 -1.34 119.26 120.08 2jj1 h ALA 506 Ca 0.24 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 2jj1 h ALA 506 Cb 0.07 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 2jj1 h ALA 506 CO -0.12 0.53 0.24 0.78 0.00 0.00 0.00 179.25 180.68 2jj1 h GLY 507 N 1.24 1.20 0.83 0.00 0.00 -0.08 -1.66 103.07 104.61 2jj1 h GLY 507 Ca 0.39 -0.69 -0.01 0.00 0.00 0.00 0.00 47.33 47.02 2jj1 h GLY 507 CO -0.12 0.65 0.03 -2.75 0.00 0.00 0.00 176.54 174.35 2jj1 h PHE 508 N 1.08 0.18 0.00 5.60 3.57 -0.29 -3.11 116.94 123.97 2jj1 h PHE 508 Ca 0.24 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.72 2jj1 h PHE 508 Cb 0.28 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 38.97 2jj1 h PHE 508 CO 0.02 0.32 -0.12 0.39 -2.23 0.00 0.00 178.31 176.69 2jj1 n GLU 509 N -4.88 0.14 0.00 1.11 1.02 -0.60 -5.11 120.64 112.33 2jj1 n GLU 509 Ca -0.06 0.10 0.05 0.00 -0.02 0.00 0.00 57.16 57.23 2jj1 n GLU 509 Cb 0.14 -1.65 0.30 0.00 -0.02 0.00 0.00 31.44 30.21 2jj1 n GLU 509 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31