#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jj1 s ASP 24 N 0.00 6.28 -0.17 -1.34 3.68 -1.26 -4.90 116.67 118.96 2jj1 s ASP 24 Ca 0.00 -0.61 0.09 0.00 2.13 0.00 0.00 52.55 54.17 2jj1 s ASP 24 Cb 0.00 -2.41 0.56 0.00 -1.45 0.00 0.00 42.92 39.62 2jj1 s ASP 24 CO 0.00 -1.23 1.36 0.18 0.13 0.00 0.00 175.17 175.61 2jj1 n LEU 25 N 7.32 4.28 -0.11 -1.34 4.77 -1.26 -2.88 117.00 127.77 2jj1 n LEU 25 Ca -0.01 -2.18 -0.16 0.00 -0.03 0.00 0.00 56.01 53.64 2jj1 n LEU 25 Cb 0.47 -0.63 -0.10 0.00 -2.33 0.00 0.00 43.42 40.82 2jj1 n LEU 25 CO 0.62 0.52 -1.24 -0.62 -1.33 0.00 0.00 177.39 175.34 2jj1 n GLU 26 N 0.39 0.56 0.00 3.23 1.02 -1.26 0.07 120.64 124.65 2jj1 n GLU 26 Ca 0.20 0.13 0.10 0.00 -0.02 0.00 0.00 57.16 57.57 2jj1 n GLU 26 Cb 0.91 -1.45 0.01 0.00 -0.02 0.00 0.00 31.44 30.90 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 -3.18 1.51 -3.92 3.49 -0.58 -1.26 -0.87 120.64 115.84 2jj1 n GLU 27 Ca -0.40 -1.10 -0.10 0.00 -0.42 0.00 0.00 57.16 55.14 2jj1 n GLU 27 Cb 0.92 -1.40 -0.11 0.00 -0.57 0.00 0.00 31.44 30.29 2jj1 n GLU 27 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 2jj1 s THR 28 N -2.16 0.09 0.18 2.62 2.01 -1.14 -1.55 115.64 115.70 2jj1 s THR 28 Ca 0.18 -0.74 -0.02 0.00 0.31 0.00 0.00 61.69 61.42 2jj1 s THR 28 Cb 0.16 -0.32 -0.04 0.00 0.01 0.00 0.00 72.50 72.32 2jj1 s THR 28 CO 0.46 -0.41 0.15 -0.83 -0.69 0.00 0.00 174.62 173.30 2jj1 s GLY 29 N -1.30 1.19 0.11 4.40 0.00 0.18 -0.93 107.32 110.97 2jj1 s GLY 29 Ca -0.14 -1.53 0.10 0.00 0.00 0.00 0.00 44.72 43.16 2jj1 s GLY 29 CO 0.00 -1.29 -0.26 1.09 0.00 0.00 0.00 173.10 172.64 2jj1 s ARG 30 N -4.11 1.55 -0.14 2.90 1.70 -0.84 0.10 118.95 120.11 2jj1 s ARG 30 Ca 0.33 -1.27 -0.29 0.00 -0.47 0.00 0.00 55.73 54.02 2jj1 s ARG 30 Cb 0.06 -1.95 -0.02 0.00 -0.57 0.00 0.00 34.95 32.47 2jj1 s ARG 30 CO 0.08 0.47 1.28 0.08 -1.08 0.00 0.00 175.30 176.14 2jj1 s VAL 31 N -1.00 4.21 -0.11 4.99 1.01 -0.27 -1.43 120.40 127.79 2jj1 s VAL 31 Ca 0.14 1.48 -0.15 0.00 0.00 0.00 0.00 61.98 63.45 2jj1 s VAL 31 Cb -0.10 -3.96 -0.13 0.00 0.00 0.00 0.00 36.38 32.19 2jj1 s VAL 31 CO 0.05 -0.11 0.42 -0.07 0.00 0.00 0.00 175.10 175.40 2jj1 h LEU 32 N 9.49 -0.02 -7.62 3.92 3.38 -0.75 0.53 115.31 124.25 2jj1 h LEU 32 Ca -0.29 -0.49 -0.12 0.00 0.09 0.00 0.00 57.88 57.08 2jj1 h LEU 32 Cb 1.12 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 41.68 2jj1 h LEU 32 CO 0.95 0.72 -0.35 -0.94 0.09 0.00 0.00 178.44 178.91 2jj1 s SER 33 N -5.85 -0.08 -0.01 -0.43 1.04 -1.09 -4.83 113.70 102.44 2jj1 s SER 33 Ca -0.10 -0.12 -0.14 0.00 0.48 0.00 0.00 55.95 56.07 2jj1 s SER 33 Cb -0.01 0.29 0.02 0.00 0.10 0.00 0.00 66.02 66.42 2jj1 s SER 33 CO 0.35 -0.48 0.29 -0.51 0.98 0.00 0.00 173.24 173.88 2jj1 s ILE 34 N -1.78 0.06 0.00 -1.02 1.10 -1.26 -0.18 121.20 118.12 2jj1 s ILE 34 Ca -0.11 -0.48 0.00 0.00 -0.51 0.00 0.00 60.65 59.55 2jj1 s ILE 34 Cb -0.04 -0.59 0.00 0.00 0.15 0.00 0.00 42.46 41.97 2jj1 s ILE 34 CO 0.01 -0.26 0.00 0.61 -2.11 0.00 0.00 174.94 173.18 2jj1 n GLY 35 N 1.33 0.77 1.45 1.50 0.00 -1.25 -4.98 105.19 104.01 2jj1 n GLY 35 Ca -0.21 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.77 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 3.53 0.00 1.61 8.00 -1.26 -4.81 116.55 123.62 2jj1 n ASP 36 Ca 0.00 -2.68 0.00 0.00 0.71 0.00 0.00 54.79 52.82 2jj1 n ASP 36 Cb 0.00 -0.64 0.00 0.00 -0.02 0.00 0.00 41.12 40.46 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 0.01 0.31 3.04 0.44 0.00 -1.26 -4.79 105.19 102.94 2jj1 n GLY 37 Ca 0.23 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.76 1.45 -0.28 -0.61 -1.09 -1.26 -3.77 121.20 113.88 2jj1 s ILE 38 Ca 0.00 -0.61 -0.14 0.00 -2.23 0.00 0.00 60.65 57.67 2jj1 s ILE 38 Cb 0.00 -1.33 -0.04 0.00 -1.58 0.00 0.00 42.46 39.51 2jj1 s ILE 38 CO 0.00 0.43 0.35 0.00 -1.23 0.00 0.00 174.94 174.49 2jj1 s ALA 39 N 1.05 3.55 -0.12 9.38 0.00 -0.86 -3.88 121.76 130.88 2jj1 s ALA 39 Ca -0.05 -0.89 -0.25 0.00 0.00 0.00 0.00 51.96 50.77 2jj1 s ALA 39 Cb -0.15 -2.69 -0.02 0.00 0.00 0.00 0.00 23.12 20.26 2jj1 s ALA 39 CO -0.02 -0.68 0.79 1.03 0.00 0.00 0.00 175.76 176.87 2jj1 s ARG 40 N 2.02 4.36 -0.19 0.00 1.81 0.74 -1.75 118.95 125.94 2jj1 s ARG 40 Ca 0.14 0.98 0.00 0.00 -1.72 0.00 0.00 55.73 55.12 2jj1 s ARG 40 Cb -0.16 -3.52 0.04 0.00 -0.45 0.00 0.00 34.95 30.86 2jj1 s ARG 40 CO 0.10 -0.17 -0.09 0.08 -0.68 0.00 0.00 175.30 174.54 2jj1 s VAL 41 N 1.61 1.47 0.41 3.52 1.01 -0.45 0.03 120.40 128.00 2jj1 s VAL 41 Ca 0.38 -0.88 -0.25 0.00 0.00 0.00 0.00 61.98 61.23 2jj1 s VAL 41 Cb -0.17 -1.57 -0.08 0.00 0.00 0.00 0.00 36.38 34.55 2jj1 s VAL 41 CO 0.15 0.16 1.25 -2.28 0.00 0.00 0.00 175.10 174.39 2jj1 s HIS 42 N 1.47 2.88 0.00 5.22 2.46 -0.52 -0.92 115.29 125.89 2jj1 s HIS 42 Ca -0.01 1.46 0.00 0.00 0.47 0.00 0.00 55.06 56.99 2jj1 s HIS 42 Cb -0.16 -3.57 0.00 0.00 -0.13 0.00 0.00 32.58 28.72 2jj1 s HIS 42 CO -0.08 -1.84 0.00 0.41 -2.47 0.00 0.00 174.74 170.76 2jj1 n GLY 43 N 0.66 0.53 3.83 1.59 0.00 -1.26 -1.99 105.19 108.54 2jj1 n GLY 43 Ca 0.04 -1.07 -0.25 0.00 0.00 0.00 0.00 46.02 44.74 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 -2.72 0.26 0.99 4.77 -0.10 -4.72 117.00 115.47 2jj1 n LEU 44 Ca 0.00 -0.85 0.12 0.00 -0.03 0.00 0.00 56.01 55.25 2jj1 n LEU 44 Cb 0.00 -2.53 0.78 0.00 -2.33 0.00 0.00 43.42 39.34 2jj1 n LEU 44 CO 0.00 0.42 1.10 0.03 -1.33 0.00 0.00 177.39 177.62 2jj1 h ARG 45 N -1.91 0.00 -0.71 3.23 2.47 -0.32 -2.27 114.38 114.87 2jj1 h ARG 45 Ca -0.61 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.11 2jj1 h ARG 45 Cb 1.37 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.69 2jj1 h ARG 45 CO 0.61 0.00 0.00 0.09 0.56 0.00 0.00 179.97 181.23 2jj1 n ASN 46 N -4.18 3.92 -4.76 7.04 3.02 -0.05 -5.00 115.26 115.25 2jj1 n ASN 46 Ca -0.02 -2.00 -0.36 0.00 -0.03 0.00 0.00 54.58 52.17 2jj1 n ASN 46 Cb 0.12 -0.47 0.03 0.00 -0.61 0.00 0.00 39.78 38.85 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 -1.05 2.66 0.37 2.41 -7.23 -0.86 -5.03 120.40 111.67 2jj1 s VAL 47 Ca 0.49 0.44 -0.05 0.00 -1.81 0.00 0.00 61.98 61.04 2jj1 s VAL 47 Cb 0.26 -3.19 -0.05 0.00 0.56 0.00 0.00 36.38 33.96 2jj1 s VAL 47 CO 0.34 -0.07 0.65 -1.10 -0.31 0.00 0.00 175.10 174.61 2jj1 s GLN 48 N -3.17 3.60 0.32 4.82 -0.21 -1.26 -5.07 119.66 118.69 2jj1 s GLN 48 Ca 0.74 0.07 -0.29 0.00 0.02 0.00 0.00 55.36 55.90 2jj1 s GLN 48 Cb -0.31 -2.53 -0.12 0.00 1.00 0.00 0.00 33.01 31.05 2jj1 s GLN 48 CO 0.35 0.05 1.45 0.00 -2.12 0.00 0.00 175.29 175.01 2jj1 n ALA 49 N -1.52 1.88 -1.44 6.09 0.00 -1.26 -3.00 120.51 121.26 2jj1 n ALA 49 Ca -0.01 0.37 -0.15 0.00 0.00 0.00 0.00 53.44 53.65 2jj1 n ALA 49 Cb 0.55 -2.36 -0.07 0.00 0.00 0.00 0.00 19.45 17.57 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 1.28 -1.17 -3.20 0.00 1.02 0.12 -4.95 120.64 113.73 2jj1 n GLU 50 Ca 0.06 1.03 -0.37 0.00 -0.02 0.00 0.00 57.16 57.86 2jj1 n GLU 50 Cb 0.36 -5.22 -0.06 0.00 -0.02 0.00 0.00 31.44 26.50 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 -3.27 4.22 0.14 3.49 2.12 -1.16 -1.89 118.70 122.35 2jj1 s GLU 51 Ca 0.00 0.78 -0.31 0.00 0.36 0.00 0.00 54.97 55.80 2jj1 s GLU 51 Cb 0.00 -3.08 -0.08 0.00 0.26 0.00 0.00 34.13 31.23 2jj1 s GLU 51 CO 0.00 0.53 1.30 1.41 -0.54 0.00 0.00 175.26 177.96 2jj1 s MET 52 N -1.52 4.39 0.39 4.30 -2.45 -0.01 -1.26 119.30 123.13 2jj1 s MET 52 Ca 0.35 1.98 0.08 0.00 -1.25 0.00 0.00 55.69 56.85 2jj1 s MET 52 Cb -0.18 -3.25 -0.05 0.00 1.25 0.00 0.00 34.83 32.59 2jj1 s MET 52 CO 0.21 -0.30 0.16 0.14 1.05 0.00 0.00 175.02 176.27 2jj1 s VAL 53 N 0.67 2.53 -0.14 10.11 -7.23 0.03 -2.77 120.40 123.60 2jj1 s VAL 53 Ca 0.60 -1.72 -0.03 0.00 -1.81 0.00 0.00 61.98 59.02 2jj1 s VAL 53 Cb -0.35 -2.97 0.05 0.00 0.56 0.00 0.00 36.38 33.68 2jj1 s VAL 53 CO 0.33 -0.07 0.03 -0.70 -0.31 0.00 0.00 175.10 174.38 2jj1 s GLU 54 N -3.87 0.52 0.56 4.82 2.12 -0.14 -0.88 118.70 121.83 2jj1 s GLU 54 Ca 0.40 -0.15 -0.15 0.00 0.36 0.00 0.00 54.97 55.43 2jj1 s GLU 54 Cb 0.02 -1.61 -0.06 0.00 0.26 0.00 0.00 34.13 32.74 2jj1 s GLU 54 CO 0.22 -0.51 1.01 -0.06 -0.54 0.00 0.00 175.26 175.38 2jj1 s PHE 55 N 1.95 3.40 0.60 5.30 0.40 0.35 -1.81 117.98 128.16 2jj1 s PHE 55 Ca 0.02 1.43 0.39 0.00 -0.60 0.00 0.00 56.93 58.17 2jj1 s PHE 55 Cb -0.15 -2.82 2.16 0.00 0.51 0.00 0.00 43.02 42.73 2jj1 s PHE 55 CO -0.07 -0.61 2.31 0.66 0.70 0.00 0.00 175.22 178.20 2jj1 h SER 56 N 0.46 0.00 -0.16 1.36 4.64 -1.33 -0.32 113.55 118.21 2jj1 h SER 56 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2jj1 h SER 56 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2jj1 h SER 56 CO 0.61 0.01 0.00 -1.54 -0.87 0.00 0.00 176.83 175.03 2jj1 n SER 57 N -3.33 1.58 0.00 4.97 3.41 -1.26 -4.93 113.62 114.06 2jj1 n SER 57 Ca -0.03 -1.69 0.00 0.00 -0.26 0.00 0.00 58.87 56.89 2jj1 n SER 57 Cb 0.10 -0.10 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2jj1 n SER 57 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jj1 n GLY 58 N 1.11 1.56 3.76 5.00 0.00 -0.13 -5.07 105.19 111.42 2jj1 n GLY 58 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 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 3.90 0.24 0.99 1.43 -1.26 -4.77 118.68 119.21 2jj1 s LEU 59 Ca 0.00 2.44 0.03 0.00 -1.03 0.00 0.00 54.13 55.56 2jj1 s LEU 59 Cb 0.00 -4.33 -0.03 0.00 0.03 0.00 0.00 46.19 41.86 2jj1 s LEU 59 CO 0.00 -1.22 0.39 -0.54 0.23 0.00 0.00 176.35 175.21 2jj1 s LYS 60 N -2.89 3.46 0.24 1.70 -0.14 -1.26 -0.50 119.74 120.35 2jj1 s LYS 60 Ca 0.69 -0.58 -0.10 0.00 -1.36 0.00 0.00 55.97 54.62 2jj1 s LYS 60 Cb -0.32 -2.85 -0.01 0.00 -1.68 0.00 0.00 37.83 32.97 2jj1 s LYS 60 CO 0.37 0.38 0.40 0.20 -0.76 0.00 0.00 175.35 175.95 2jj1 s GLY 61 N -3.74 0.73 -0.06 -3.33 0.00 -0.06 -1.64 107.32 99.22 2jj1 s GLY 61 Ca 0.36 -1.05 0.02 0.00 0.00 0.00 0.00 44.72 44.05 2jj1 s GLY 61 CO 0.30 -0.79 -0.11 -0.29 0.00 0.00 0.00 173.10 172.22 2jj1 s MET 62 N -4.05 1.51 -0.18 2.90 1.75 -0.31 -0.79 119.30 120.14 2jj1 s MET 62 Ca 0.26 -0.35 -0.29 0.00 -1.25 0.00 0.00 55.69 54.06 2jj1 s MET 62 Cb 0.01 -1.28 -0.02 0.00 2.84 0.00 0.00 34.83 36.38 2jj1 s MET 62 CO 0.10 0.00 1.46 -1.12 -0.65 0.00 0.00 175.02 174.81 2jj1 s SER 63 N 0.72 6.66 -0.07 1.11 0.01 -0.39 -1.13 113.70 120.61 2jj1 s SER 63 Ca -0.14 1.71 -0.04 0.00 1.31 0.00 0.00 55.95 58.79 2jj1 s SER 63 Cb -0.15 -2.54 -0.03 0.00 0.21 0.00 0.00 66.02 63.51 2jj1 s SER 63 CO 0.03 -1.00 -0.11 -0.11 0.41 0.00 0.00 173.24 172.46 2jj1 n LEU 64 N 7.46 0.68 -4.32 2.44 7.94 0.10 0.11 117.00 131.41 2jj1 n LEU 64 Ca 0.16 0.11 -0.41 0.00 -1.11 0.00 0.00 56.01 54.76 2jj1 n LEU 64 Cb 0.45 -0.27 -0.10 0.00 0.53 0.00 0.00 43.42 44.03 2jj1 n LEU 64 CO 0.61 0.06 -0.09 0.20 -1.11 0.00 0.00 177.39 177.07 2jj1 s ASN 65 N -5.77 5.77 -0.74 1.96 -0.87 -0.69 -4.82 114.94 109.78 2jj1 s ASN 65 Ca -0.11 -1.35 -0.18 0.00 -1.57 0.00 0.00 52.86 49.66 2jj1 s ASN 65 Cb 0.04 -2.04 0.14 0.00 -0.02 0.00 0.00 41.25 39.37 2jj1 s ASN 65 CO 0.14 -0.53 0.84 -0.76 -2.57 0.00 0.00 177.10 174.23 2jj1 s LEU 66 N 1.50 5.61 0.26 0.60 1.43 -1.26 0.02 118.68 126.84 2jj1 s LEU 66 Ca 0.03 -1.90 0.06 0.00 -1.03 0.00 0.00 54.13 51.29 2jj1 s LEU 66 Cb -0.22 -2.31 -0.03 0.00 0.03 0.00 0.00 46.19 43.66 2jj1 s LEU 66 CO 0.04 -0.98 0.29 -1.61 0.23 0.00 0.00 176.35 174.32 2jj1 s GLU 67 N 2.11 3.14 0.30 1.70 2.02 -0.58 -5.02 118.70 122.37 2jj1 s GLU 67 Ca 0.19 -0.94 0.07 0.00 0.02 0.00 0.00 54.97 54.31 2jj1 s GLU 67 Cb -0.15 -2.71 0.81 0.00 0.10 0.00 0.00 34.13 32.18 2jj1 s GLU 67 CO -0.02 0.38 1.71 -1.35 0.02 0.00 0.00 175.26 176.00 2jj1 h PRO 68 N 1.31 0.46 0.00 0.39 0.11 -2.03 -3.16 132.00 129.07 2jj1 h PRO 68 Ca -0.50 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2jj1 h PRO 68 Cb 1.24 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2jj1 h PRO 68 CO 0.60 0.30 -0.01 -0.40 -0.21 0.00 0.00 178.00 178.29 2jj1 n ASP 69 N -4.98 2.00 -3.78 -2.05 3.85 -1.26 -5.06 116.55 105.26 2jj1 n ASP 69 Ca 0.25 -2.27 -0.05 0.00 -0.71 0.00 0.00 54.79 52.01 2jj1 n ASP 69 Cb 0.71 -0.13 -0.02 0.00 -1.35 0.00 0.00 41.12 40.34 2jj1 n ASP 69 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 2jj1 s ASN 70 N -1.50 -0.21 -0.13 -1.12 2.20 -1.20 -4.66 114.94 108.33 2jj1 s ASN 70 Ca 0.09 -0.46 0.03 0.00 -0.94 0.00 0.00 52.86 51.58 2jj1 s ASN 70 Cb 0.08 0.56 0.01 0.00 -2.00 0.00 0.00 41.25 39.90 2jj1 s ASN 70 CO 0.01 -1.04 -0.22 -0.69 -2.94 0.00 0.00 177.10 172.23 2jj1 s VAL 71 N -3.48 2.15 -0.28 3.54 1.01 -0.10 -1.52 120.40 121.72 2jj1 s VAL 71 Ca 0.12 -0.96 -0.26 0.00 0.00 0.00 0.00 61.98 60.87 2jj1 s VAL 71 Cb -0.03 -1.85 0.01 0.00 0.00 0.00 0.00 36.38 34.51 2jj1 s VAL 71 CO 0.03 0.55 0.93 -0.83 0.00 0.00 0.00 175.10 175.79 2jj1 s GLY 72 N 0.67 1.67 -0.19 4.51 0.00 0.10 -1.34 107.32 112.74 2jj1 s GLY 72 Ca -0.10 -0.14 0.00 0.00 0.00 0.00 0.00 44.72 44.48 2jj1 s GLY 72 CO 0.02 2.01 -0.18 0.14 0.00 0.00 0.00 173.10 175.09 2jj1 s VAL 73 N 3.20 2.25 0.09 1.40 1.01 -0.72 0.01 120.40 127.63 2jj1 s VAL 73 Ca 0.39 -0.88 -0.30 0.00 0.00 0.00 0.00 61.98 61.19 2jj1 s VAL 73 Cb -0.14 -1.96 -0.05 0.00 0.00 0.00 0.00 36.38 34.23 2jj1 s VAL 73 CO 0.11 0.52 1.00 -0.69 0.00 0.00 0.00 175.10 176.04 2jj1 s VAL 74 N 1.31 4.49 -0.26 2.92 1.01 -0.29 -2.02 120.40 127.56 2jj1 s VAL 74 Ca 0.05 1.97 -0.10 0.00 0.00 0.00 0.00 61.98 63.90 2jj1 s VAL 74 Cb -0.13 -4.26 -0.05 0.00 0.00 0.00 0.00 36.38 31.94 2jj1 s VAL 74 CO -0.12 0.26 0.15 -0.69 0.00 0.00 0.00 175.10 174.70 2jj1 s VAL 75 N 0.31 5.13 -0.36 2.92 1.01 -1.25 -1.16 120.40 127.01 2jj1 s VAL 75 Ca 0.49 0.11 -0.04 0.00 0.00 0.00 0.00 61.98 62.54 2jj1 s VAL 75 Cb -0.24 -3.42 -0.01 0.00 0.00 0.00 0.00 36.38 32.71 2jj1 s VAL 75 CO 0.30 0.31 2.97 0.49 0.00 0.00 0.00 175.10 179.16 2jj1 n PHE 76 N 4.71 1.24 -3.78 5.22 3.01 -0.65 -4.61 117.46 122.59 2jj1 n PHE 76 Ca -0.15 -1.84 0.00 0.00 1.01 0.00 0.00 57.45 56.47 2jj1 n PHE 76 Cb 0.52 -1.43 0.00 0.00 -0.01 0.00 0.00 39.48 38.56 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 1.25 -0.77 3.58 1.37 0.00 -1.26 -4.67 105.19 104.70 2jj1 n GLY 77 Ca 0.48 -1.04 -0.42 0.00 0.00 0.00 0.00 46.02 45.03 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 6.26 0.00 1.61 2.47 -1.26 -4.77 114.94 115.25 2jj1 s ASN 78 Ca 0.00 0.42 0.07 0.00 0.42 0.00 0.00 52.86 53.76 2jj1 s ASN 78 Cb 0.00 -2.55 0.40 0.00 -1.45 0.00 0.00 41.25 37.65 2jj1 s ASN 78 CO 0.00 -1.57 1.03 -0.90 -3.72 0.00 0.00 177.10 171.94 2jj1 n ASP 79 N 9.11 0.00 0.00 -4.21 5.75 -1.26 -1.94 116.55 124.00 2jj1 n ASP 79 Ca 0.13 -1.27 0.03 0.00 -0.01 0.00 0.00 54.79 53.67 2jj1 n ASP 79 Cb 0.49 0.00 0.40 0.00 -1.03 0.00 0.00 41.12 40.98 2jj1 n ASP 79 CO 0.00 0.00 0.00 0.50 -0.11 0.00 0.00 177.20 177.59 2jj1 h LYS 80 N 0.00 0.53 0.00 0.11 3.64 -1.99 -3.01 116.57 115.85 2jj1 h LYS 80 Ca 0.00 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2jj1 h LYS 80 Cb 0.00 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.71 2jj1 h LYS 80 CO 0.00 0.39 0.00 1.28 -2.27 0.00 0.00 179.45 178.85 2jj1 n LEU 81 N -4.44 0.36 -4.72 5.20 4.77 -0.82 -4.73 117.00 112.62 2jj1 n LEU 81 Ca 0.03 0.56 -0.36 0.00 -0.03 0.00 0.00 56.01 56.21 2jj1 n LEU 81 Cb 0.09 -0.48 -0.07 0.00 -2.33 0.00 0.00 43.42 40.63 2jj1 n LEU 81 CO 0.36 -0.26 -0.06 -0.63 -1.33 0.00 0.00 177.39 175.46 2jj1 s ILE 82 N -3.11 5.33 0.25 -0.08 1.01 -1.14 -4.85 121.20 118.62 2jj1 s ILE 82 Ca 0.09 0.44 0.11 0.00 0.00 0.00 0.00 60.65 61.29 2jj1 s ILE 82 Cb 0.12 -3.59 -0.05 0.00 0.01 0.00 0.00 42.46 38.96 2jj1 s ILE 82 CO 0.43 0.40 -0.16 -0.54 0.00 0.00 0.00 174.94 175.07 2jj1 s LYS 83 N 0.49 1.80 0.10 2.79 1.02 -1.26 -4.95 119.74 119.73 2jj1 s LYS 83 Ca 0.14 -1.61 -0.31 0.00 0.02 0.00 0.00 55.97 54.21 2jj1 s LYS 83 Cb -0.12 -1.90 -0.10 0.00 -0.52 0.00 0.00 37.83 35.19 2jj1 s LYS 83 CO 0.02 0.36 1.88 -2.00 -0.92 0.00 0.00 175.35 174.69 2jj1 s GLU 84 N -3.32 4.14 0.00 1.68 2.12 -1.26 -2.28 118.70 119.78 2jj1 s GLU 84 Ca 0.28 2.61 0.00 0.00 0.36 0.00 0.00 54.97 58.22 2jj1 s GLU 84 Cb -0.06 -3.77 0.00 0.00 0.26 0.00 0.00 34.13 30.56 2jj1 s GLU 84 CO 0.15 -0.88 0.00 0.41 -0.54 0.00 0.00 175.26 174.40 2jj1 n GLY 85 N 4.34 1.10 3.75 -1.50 0.00 0.18 -4.95 105.19 108.11 2jj1 n GLY 85 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 2jj1 n GLY 85 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jj1 s ASP 86 N -1.88 5.33 -0.01 1.61 -0.00 -0.97 -4.51 116.67 116.24 2jj1 s ASP 86 Ca 0.00 2.59 -0.23 0.00 -0.00 0.00 0.00 52.55 54.91 2jj1 s ASP 86 Cb 0.00 -2.62 -0.05 0.00 -0.00 0.00 0.00 42.92 40.25 2jj1 s ASP 86 CO 0.00 -1.52 0.69 -0.63 -0.00 0.00 0.00 175.17 173.71 2jj1 s ILE 87 N -1.42 4.90 -0.07 0.77 1.09 -1.26 -1.12 121.20 124.10 2jj1 s ILE 87 Ca 0.73 1.44 0.05 0.00 -1.10 0.00 0.00 60.65 61.77 2jj1 s ILE 87 Cb -0.36 -4.03 -0.01 0.00 -1.06 0.00 0.00 42.46 37.00 2jj1 s ILE 87 CO 0.41 0.34 -0.24 -0.69 -0.10 0.00 0.00 174.94 174.66 2jj1 s VAL 88 N 0.23 2.15 -0.02 2.92 1.01 0.11 -0.87 120.40 125.93 2jj1 s VAL 88 Ca 0.36 -1.02 0.07 0.00 0.00 0.00 0.00 61.98 61.39 2jj1 s VAL 88 Cb -0.19 -1.80 -0.02 0.00 0.00 0.00 0.00 36.38 34.37 2jj1 s VAL 88 CO 0.19 0.57 -0.22 -0.54 0.00 0.00 0.00 175.10 175.10 2jj1 s LYS 89 N -0.06 2.19 0.59 2.72 1.02 -0.75 -0.65 119.74 124.81 2jj1 s LYS 89 Ca -0.07 -0.88 -0.19 0.00 0.02 0.00 0.00 55.97 54.86 2jj1 s LYS 89 Cb -0.15 -2.14 -0.05 0.00 -0.52 0.00 0.00 37.83 34.98 2jj1 s LYS 89 CO 0.05 0.57 1.00 0.54 -0.92 0.00 0.00 175.35 176.60 2jj1 n ARG 90 N 2.30 0.97 0.00 1.68 1.74 -0.59 -0.96 116.66 121.79 2jj1 n ARG 90 Ca -0.16 0.37 0.03 0.00 -0.77 0.00 0.00 57.85 57.32 2jj1 n ARG 90 Cb 0.51 -2.20 -0.03 0.00 -1.02 0.00 0.00 32.46 29.72 2jj1 n ARG 90 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2jj1 n THR 91 N -1.65 0.00 0.00 0.55 -2.24 -1.11 -4.82 114.28 105.01 2jj1 n THR 91 Ca 0.13 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 2jj1 n THR 91 Cb 0.47 1.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.72 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 1.06 2.81 3.44 3.38 0.00 -1.26 -5.00 105.19 109.62 2jj1 n GLY 92 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.65 2.72 0.50 4.61 0.00 -1.26 -5.02 121.76 120.65 2jj1 s ALA 93 Ca 0.00 -0.91 -0.23 0.00 0.00 0.00 0.00 51.96 50.82 2jj1 s ALA 93 Cb 0.00 -1.18 -0.06 0.00 0.00 0.00 0.00 23.12 21.87 2jj1 s ALA 93 CO 0.00 0.37 1.38 0.42 0.00 0.00 0.00 175.76 177.93 2jj1 s ILE 94 N -0.10 2.12 -0.29 0.00 -1.09 -1.26 -0.83 121.20 119.74 2jj1 s ILE 94 Ca -0.01 0.10 -0.39 0.00 -2.23 0.00 0.00 60.65 58.12 2jj1 s ILE 94 Cb -0.14 -3.05 -0.15 0.00 -1.58 0.00 0.00 42.46 37.55 2jj1 s ILE 94 CO 0.03 0.01 1.88 0.52 -1.23 0.00 0.00 174.94 176.15 2jj1 n VAL 95 N -0.62 0.29 -4.32 2.92 0.31 -0.79 -4.69 118.33 111.42 2jj1 n VAL 95 Ca 0.08 -0.10 -0.19 0.00 -0.01 0.00 0.00 64.34 64.11 2jj1 n VAL 95 Cb 0.44 -1.34 -0.09 0.00 -0.91 0.00 0.00 33.84 31.94 2jj1 n VAL 95 CO 0.00 0.00 0.00 1.51 -1.32 0.00 0.00 176.83 177.02 2jj1 s ASP 96 N 4.59 1.65 0.03 4.52 3.84 -1.26 -2.11 116.67 127.94 2jj1 s ASP 96 Ca 1.02 -1.67 -0.07 0.00 -0.00 0.00 0.00 52.55 51.83 2jj1 s ASP 96 Cb -1.02 0.50 -0.01 0.00 -1.38 0.00 0.00 42.92 41.02 2jj1 s ASP 96 CO 0.61 -0.99 0.13 0.68 -0.00 0.00 0.00 175.17 175.60 2jj1 s VAL 97 N -3.52 0.12 0.70 2.11 -7.23 -0.18 -4.83 120.40 107.57 2jj1 s VAL 97 Ca 0.37 -0.96 -0.16 0.00 -1.81 0.00 0.00 61.98 59.41 2jj1 s VAL 97 Cb 0.03 -0.80 0.01 0.00 0.56 0.00 0.00 36.38 36.18 2jj1 s VAL 97 CO 0.22 -0.53 1.11 -0.81 -0.31 0.00 0.00 175.10 174.78 2jj1 n PRO 98 N 0.89 0.67 -3.65 4.82 -0.04 -1.26 -1.87 135.00 134.56 2jj1 n PRO 98 Ca -0.20 0.29 -0.14 0.00 -0.04 0.00 0.00 63.50 63.41 2jj1 n PRO 98 Cb 0.58 -2.35 -0.06 0.00 -0.04 0.00 0.00 33.50 31.62 2jj1 n PRO 98 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2jj1 s VAL 99 N -1.71 0.04 -1.87 0.52 1.01 -0.97 -4.77 120.40 112.65 2jj1 s VAL 99 Ca 0.77 -0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.38 2jj1 s VAL 99 Cb -0.35 -0.91 0.00 0.00 0.00 0.00 0.00 36.38 35.12 2jj1 s VAL 99 CO 0.47 -0.20 0.00 0.61 0.00 0.00 0.00 175.10 175.98 2jj1 n GLY 100 N 0.66 0.65 0.16 4.51 0.00 -1.26 -3.84 105.19 106.07 2jj1 n GLY 100 Ca -0.19 -2.17 0.03 0.00 0.00 0.00 0.00 46.02 43.69 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 8.37 0.00 0.00 1.61 5.08 -2.00 -3.21 114.58 124.43 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 0.47 0.00 -0.85 -1.00 0.00 0.00 179.01 177.63 2jj1 n GLU 102 N -3.38 0.05 0.02 2.33 0.00 -1.26 -1.51 120.64 116.89 2jj1 n GLU 102 Ca 0.01 0.48 0.14 0.00 0.00 0.00 0.00 57.16 57.78 2jj1 n GLU 102 Cb 0.64 -1.64 0.55 0.00 0.00 0.00 0.00 31.44 30.99 2jj1 n GLU 102 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2jj1 n LEU 103 N -1.74 0.18 -4.76 -1.84 4.77 -1.21 -4.73 117.00 107.67 2jj1 n LEU 103 Ca 0.00 0.48 -0.38 0.00 -0.03 0.00 0.00 56.01 56.08 2jj1 n LEU 103 Cb 0.06 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 2jj1 n LEU 103 CO 0.06 -0.03 0.93 -0.76 -1.33 0.00 0.00 177.39 176.26 2jj1 s LEU 104 N -3.29 4.07 -0.17 2.23 1.43 -0.57 -2.43 118.68 119.94 2jj1 s LEU 104 Ca 0.13 2.57 0.00 0.00 -1.03 0.00 0.00 54.13 55.81 2jj1 s LEU 104 Cb 0.18 -4.09 0.00 0.00 0.03 0.00 0.00 46.19 42.31 2jj1 s LEU 104 CO 0.55 -1.04 0.00 0.61 0.23 0.00 0.00 176.35 176.71 2jj1 n GLY 105 N 0.61 0.41 3.55 -3.19 0.00 0.01 -4.95 105.19 101.63 2jj1 n GLY 105 Ca 0.06 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.26 2.02 -0.24 1.61 1.81 -1.02 -4.94 118.95 116.93 2jj1 s ARG 106 Ca 0.00 -1.08 -0.04 0.00 -1.72 0.00 0.00 55.73 52.89 2jj1 s ARG 106 Cb 0.00 -2.24 -0.00 0.00 -0.45 0.00 0.00 34.95 32.25 2jj1 s ARG 106 CO 0.00 0.50 -0.01 0.08 -0.68 0.00 0.00 175.30 175.18 2jj1 s VAL 107 N -1.21 3.48 0.22 3.52 1.01 -1.26 -2.05 120.40 124.11 2jj1 s VAL 107 Ca 0.20 -0.59 0.10 0.00 0.00 0.00 0.00 61.98 61.70 2jj1 s VAL 107 Cb -0.11 -2.66 -0.05 0.00 0.00 0.00 0.00 36.38 33.57 2jj1 s VAL 107 CO 0.13 0.32 -0.20 0.68 0.00 0.00 0.00 175.10 176.03 2jj1 s VAL 108 N 1.47 2.19 0.33 2.92 -7.23 -0.05 -0.43 120.40 119.59 2jj1 s VAL 108 Ca 0.04 -2.18 -0.05 0.00 -1.81 0.00 0.00 61.98 57.99 2jj1 s VAL 108 Cb -0.15 -2.12 0.08 0.00 0.56 0.00 0.00 36.38 34.75 2jj1 s VAL 108 CO -0.02 -0.34 0.45 -0.90 -0.31 0.00 0.00 175.10 173.98 2jj1 n ASP 109 N -0.16 0.08 0.22 4.85 5.75 -0.63 -0.51 116.55 126.15 2jj1 n ASP 109 Ca -0.09 -1.19 0.09 0.00 -0.01 0.00 0.00 54.79 53.59 2jj1 n ASP 109 Cb 0.58 -0.34 0.50 0.00 -1.03 0.00 0.00 41.12 40.84 2jj1 n ASP 109 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2jj1 h ALA 110 N -1.78 1.12 0.00 2.12 0.00 -1.87 -2.56 119.26 116.28 2jj1 h ALA 110 Ca -0.15 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2jj1 h ALA 110 Cb 0.41 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2jj1 h ALA 110 CO 0.11 0.30 -0.18 -0.07 0.00 0.00 0.00 179.25 179.41 2jj1 h LEU 111 N 0.00 0.00 0.00 0.00 3.38 -1.93 -3.44 115.31 113.33 2jj1 h LEU 111 Ca -0.00 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2jj1 h LEU 111 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 2jj1 h LEU 111 CO 0.03 0.02 0.00 0.61 0.09 0.00 0.00 178.44 179.19 2jj1 n GLY 112 N 1.25 2.96 3.65 0.83 0.00 -0.97 -4.55 105.19 108.36 2jj1 n GLY 112 Ca 0.04 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.60 2jj1 n GLY 112 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2jj1 n ASN 113 N 0.00 2.64 -4.75 1.61 3.02 -1.26 -4.69 115.26 111.83 2jj1 n ASN 113 Ca 0.00 1.11 -0.41 0.00 -0.03 0.00 0.00 54.58 55.25 2jj1 n ASN 113 Cb 0.00 -1.37 -0.02 0.00 -0.61 0.00 0.00 39.78 37.77 2jj1 n ASN 113 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jj1 s ALA 114 N 0.47 3.62 -0.10 5.41 0.00 -1.26 -1.61 121.76 128.28 2jj1 s ALA 114 Ca 0.76 1.33 0.01 0.00 0.00 0.00 0.00 51.96 54.07 2jj1 s ALA 114 Cb -0.73 -3.55 0.03 0.00 0.00 0.00 0.00 23.12 18.87 2jj1 s ALA 114 CO 0.44 -0.75 0.99 0.44 0.00 0.00 0.00 175.76 176.88 2jj1 n ILE 115 N 2.14 0.93 0.81 0.00 -5.35 0.43 -4.60 119.36 113.71 2jj1 n ILE 115 Ca 0.06 -0.96 0.12 0.00 -0.27 0.00 0.00 62.75 61.70 2jj1 n ILE 115 Cb 0.40 0.54 0.14 0.00 -1.74 0.00 0.00 39.64 38.98 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 -0.36 3.12 -2.97 7.28 5.68 -1.16 -4.96 116.55 123.17 2jj1 n ASP 116 Ca 0.01 -1.99 -0.22 0.00 -0.50 0.00 0.00 54.79 52.09 2jj1 n ASP 116 Cb 0.25 -0.07 0.02 0.00 -1.14 0.00 0.00 41.12 40.18 2jj1 n ASP 116 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jj1 n GLY 117 N 1.40 -0.52 1.87 6.12 0.00 -1.26 -4.88 105.19 107.92 2jj1 n GLY 117 Ca 0.16 0.11 -0.11 0.00 0.00 0.00 0.00 46.02 46.17 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 -3.84 2.80 0.00 1.61 5.02 -1.26 -5.07 118.16 117.42 2jj1 n LYS 118 Ca -0.12 -3.07 0.00 0.00 -2.02 0.00 0.00 58.31 53.11 2jj1 n LYS 118 Cb 0.62 -2.11 0.00 0.00 -0.02 0.00 0.00 35.03 33.52 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 -0.72 -1.45 3.69 0.72 0.00 -1.26 -4.95 105.19 101.23 2jj1 n GLY 119 Ca 0.46 -1.54 -0.34 0.00 0.00 0.00 0.00 46.02 44.59 2jj1 n GLY 119 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2jj1 n PRO 120 N -1.47 0.41 -2.47 1.61 -0.02 -1.26 -4.88 135.00 126.92 2jj1 n PRO 120 Ca 0.00 0.21 -0.42 0.00 -2.02 0.00 0.00 63.50 61.27 2jj1 n PRO 120 Cb 0.00 -2.44 -0.03 0.00 -0.02 0.00 0.00 33.50 31.01 2jj1 n PRO 120 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2jj1 s ILE 121 N -1.94 4.24 -0.15 4.25 -1.09 -1.26 -4.94 121.20 120.31 2jj1 s ILE 121 Ca 0.75 1.59 -0.01 0.00 -2.23 0.00 0.00 60.65 60.75 2jj1 s ILE 121 Cb -0.31 -4.02 0.05 0.00 -1.58 0.00 0.00 42.46 36.60 2jj1 s ILE 121 CO 0.48 0.05 2.27 0.61 -1.23 0.00 0.00 174.94 177.13 2jj1 n GLY 122 N 3.27 3.28 3.76 6.18 0.00 -1.26 -4.95 105.19 115.47 2jj1 n GLY 122 Ca 0.10 -0.69 -0.40 0.00 0.00 0.00 0.00 46.02 45.03 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 1.22 7.10 -0.07 1.61 0.15 -1.26 -4.96 113.70 117.50 2jj1 s SER 123 Ca 0.24 2.27 0.09 0.00 0.70 0.00 0.00 55.95 59.25 2jj1 s SER 123 Cb 0.16 -2.62 -0.13 0.00 -1.71 0.00 0.00 66.02 61.72 2jj1 s SER 123 CO -0.02 -0.26 0.09 0.29 1.20 0.00 0.00 173.24 174.54 2jj1 n LYS 124 N 0.90 1.85 -4.39 5.44 5.02 -1.26 -5.01 118.16 120.71 2jj1 n LYS 124 Ca 0.00 -0.03 -0.25 0.00 -2.02 0.00 0.00 58.31 56.01 2jj1 n LYS 124 Cb 0.45 -1.24 -0.09 0.00 -0.02 0.00 0.00 35.03 34.13 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 -2.36 3.20 0.02 7.82 0.00 -1.25 -5.08 121.76 124.10 2jj1 s ALA 125 Ca -0.04 -2.05 0.01 0.00 0.00 0.00 0.00 51.96 49.87 2jj1 s ALA 125 Cb 0.04 -0.24 -0.01 0.00 0.00 0.00 0.00 23.12 22.91 2jj1 s ALA 125 CO 0.40 0.02 -0.03 1.03 0.00 0.00 0.00 175.76 177.17 2jj1 s ARG 126 N -3.72 0.29 -0.01 0.00 0.52 -1.26 -2.29 118.95 112.48 2jj1 s ARG 126 Ca 0.35 -0.44 0.02 0.00 -0.52 0.00 0.00 55.73 55.15 2jj1 s ARG 126 Cb 0.02 -0.05 -0.01 0.00 0.52 0.00 0.00 34.95 35.43 2jj1 s ARG 126 CO 0.19 0.00 -0.08 0.50 0.02 0.00 0.00 175.30 175.93 2jj1 s ARG 127 N -0.97 0.66 0.33 3.54 3.52 -0.78 -4.93 118.95 120.33 2jj1 s ARG 127 Ca -0.09 -0.29 -0.29 0.00 -0.13 0.00 0.00 55.73 54.94 2jj1 s ARG 127 Cb -0.07 -0.64 -0.11 0.00 -1.56 0.00 0.00 34.95 32.58 2jj1 s ARG 127 CO -0.00 0.17 1.40 1.03 -0.81 0.00 0.00 175.30 177.08 2jj1 s ARG 128 N -0.17 4.25 0.36 5.12 0.52 -1.26 -1.01 118.95 126.74 2jj1 s ARG 128 Ca 0.03 2.36 0.26 0.00 -0.52 0.00 0.00 55.73 57.87 2jj1 s ARG 128 Cb -0.03 -3.04 0.86 0.00 0.52 0.00 0.00 34.95 33.26 2jj1 s ARG 128 CO -0.00 -0.36 1.77 -0.39 0.02 0.00 0.00 175.30 176.34 2jj1 h VAL 129 N 3.10 0.00 -0.33 3.52 -1.51 -1.74 -3.29 116.25 115.98 2jj1 h VAL 129 Ca -0.49 -0.56 0.00 0.00 -1.23 0.00 0.00 66.70 64.42 2jj1 h VAL 129 Cb 1.23 1.49 0.00 0.00 -2.13 0.00 0.00 31.29 31.88 2jj1 h VAL 129 CO 0.67 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.62 2jj1 n GLY 130 N 0.66 3.29 3.71 5.19 0.00 -1.26 -4.68 105.19 112.10 2jj1 n GLY 130 Ca 0.03 -0.68 -0.43 0.00 0.00 0.00 0.00 46.02 44.93 2jj1 n GLY 130 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2jj1 n LEU 131 N 0.14 3.70 -4.76 0.99 4.77 -1.24 -4.91 117.00 115.69 2jj1 n LEU 131 Ca 0.17 1.12 -0.41 0.00 -0.03 0.00 0.00 56.01 56.86 2jj1 n LEU 131 Cb 0.65 -1.51 -0.02 0.00 -2.33 0.00 0.00 43.42 40.21 2jj1 n LEU 131 CO 0.12 -0.11 1.06 -0.75 -1.33 0.00 0.00 177.39 176.38 2jj1 s LYS 132 N 0.05 4.29 0.50 3.23 2.20 -1.26 -4.96 119.74 123.78 2jj1 s LYS 132 Ca 0.70 2.29 -0.23 0.00 -0.36 0.00 0.00 55.97 58.37 2jj1 s LYS 132 Cb -0.58 -3.09 -0.07 0.00 -1.51 0.00 0.00 37.83 32.58 2jj1 s LYS 132 CO 0.44 -0.34 1.17 0.00 -0.36 0.00 0.00 175.35 176.26 2jj1 n ALA 133 N 1.65 0.91 -1.53 3.13 0.00 -1.26 -4.90 120.51 118.51 2jj1 n ALA 133 Ca 0.04 0.16 -0.56 0.00 0.00 0.00 0.00 53.44 53.08 2jj1 n ALA 133 Cb 0.41 -2.22 -0.07 0.00 0.00 0.00 0.00 19.45 17.57 2jj1 n ALA 133 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2jj1 n PRO 134 N -0.46 0.45 0.00 0.00 -0.02 -1.26 -4.99 135.00 128.72 2jj1 n PRO 134 Ca 0.10 0.16 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 2jj1 n PRO 134 Cb 0.43 -1.70 0.00 0.00 -0.02 0.00 0.00 33.50 32.21 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 1.89 -2.66 0.09 -1.23 0.00 -1.26 -4.99 105.19 97.03 2jj1 n GLY 135 Ca 0.19 -1.13 -0.15 0.00 0.00 0.00 0.00 46.02 44.93 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 -0.27 1.59 -0.34 -0.61 2.04 -1.98 -3.41 117.51 114.54 2jj1 h ILE 136 Ca 0.00 -2.04 -0.02 0.00 1.00 0.00 0.00 64.86 63.80 2jj1 h ILE 136 Cb 0.00 2.92 -0.02 0.00 -0.74 0.00 0.00 36.82 38.98 2jj1 h ILE 136 CO 0.00 0.55 0.14 0.40 0.00 0.00 0.00 178.15 179.24 2jj1 h ILE 137 N -0.61 1.18 0.00 -0.67 1.08 -2.03 -3.02 117.51 113.44 2jj1 h ILE 137 Ca -0.03 -0.54 0.00 0.00 -0.39 0.00 0.00 64.86 63.90 2jj1 h ILE 137 Cb 1.03 0.91 0.00 0.00 -3.07 0.00 0.00 36.82 35.69 2jj1 h ILE 137 CO 0.04 0.19 0.00 -2.65 -0.69 0.00 0.00 178.15 175.05 2jj1 n PRO 138 N -4.71 0.34 -3.62 2.37 -0.02 -1.26 -4.79 135.00 123.32 2jj1 n PRO 138 Ca -0.01 0.07 -0.21 0.00 -2.02 0.00 0.00 63.50 61.33 2jj1 n PRO 138 Cb 0.13 -1.50 -0.01 0.00 -0.02 0.00 0.00 33.50 32.10 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 -2.26 3.31 -0.03 -0.52 0.52 -1.14 -1.24 118.95 117.59 2jj1 s ARG 139 Ca 0.18 -0.73 -0.11 0.00 -0.52 0.00 0.00 55.73 54.55 2jj1 s ARG 139 Cb 0.10 -2.80 0.02 0.00 0.52 0.00 0.00 34.95 32.79 2jj1 s ARG 139 CO 0.19 0.20 0.24 -1.50 0.02 0.00 0.00 175.30 174.45 2jj1 s ILE 140 N -2.16 0.05 0.49 1.52 2.07 -1.03 -4.48 121.20 117.67 2jj1 s ILE 140 Ca 0.40 -0.43 -0.21 0.00 -1.41 0.00 0.00 60.65 59.00 2jj1 s ILE 140 Cb -0.09 -0.49 -0.09 0.00 0.13 0.00 0.00 42.46 41.91 2jj1 s ILE 140 CO 0.32 -0.24 0.82 -1.54 -1.91 0.00 0.00 174.94 172.39 2jj1 n SER 141 N 1.75 0.30 -4.74 4.50 3.41 -1.26 -4.53 113.62 113.05 2jj1 n SER 141 Ca -0.20 0.90 -0.34 0.00 -0.26 0.00 0.00 58.87 58.97 2jj1 n SER 141 Cb 0.56 -1.28 0.07 0.00 -0.26 0.00 0.00 64.21 63.30 2jj1 n SER 141 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2jj1 s VAL 142 N -1.46 2.51 0.00 -3.33 -7.23 -1.26 -4.93 120.40 104.71 2jj1 s VAL 142 Ca 0.67 0.26 0.00 0.00 -1.81 0.00 0.00 61.98 61.11 2jj1 s VAL 142 Cb -0.51 -2.88 0.00 0.00 0.56 0.00 0.00 36.38 33.55 2jj1 s VAL 142 CO 0.54 -0.12 0.00 -2.11 -0.31 0.00 0.00 175.10 173.10 2jj1 n ARG 143 N -2.42 0.00 -4.05 4.82 1.85 -1.26 -4.55 116.66 111.05 2jj1 n ARG 143 Ca 0.13 0.00 -0.34 0.00 -1.00 0.00 0.00 57.85 56.64 2jj1 n ARG 143 Cb 0.50 0.00 -0.10 0.00 -1.05 0.00 0.00 32.46 31.81 2jj1 n ARG 143 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 2jj1 s GLU 144 N 0.00 3.91 0.44 2.89 2.02 -1.26 -4.45 118.70 122.24 2jj1 s GLU 144 Ca 0.00 -0.36 -0.26 0.00 0.02 0.00 0.00 54.97 54.38 2jj1 s GLU 144 Cb 0.00 -3.17 -0.09 0.00 0.10 0.00 0.00 34.13 30.97 2jj1 s GLU 144 CO 0.00 0.30 1.42 -2.14 0.02 0.00 0.00 175.26 174.86 2jj1 s PRO 145 N 0.29 3.77 -0.60 0.39 0.02 -1.20 -0.62 135.00 137.05 2jj1 s PRO 145 Ca 0.03 2.40 -0.04 0.00 0.02 0.00 0.00 61.00 63.41 2jj1 s PRO 145 Cb -0.12 -2.71 0.16 0.00 0.02 0.00 0.00 34.50 31.84 2jj1 s PRO 145 CO 0.00 -0.74 0.43 1.41 -0.33 0.00 0.00 177.00 177.77 2jj1 s MET 146 N -2.38 2.57 -0.47 5.54 1.75 0.12 -4.60 119.30 121.83 2jj1 s MET 146 Ca 0.59 -2.36 -0.28 0.00 -1.25 0.00 0.00 55.69 52.39 2jj1 s MET 146 Cb -0.43 -3.79 0.01 0.00 2.84 0.00 0.00 34.83 33.46 2jj1 s MET 146 CO 0.56 -1.17 1.45 -0.65 -0.65 0.00 0.00 175.02 174.56 2jj1 s GLN 147 N 0.24 3.42 0.21 4.11 -1.52 -1.26 -4.46 119.66 120.41 2jj1 s GLN 147 Ca 0.15 0.77 -0.05 0.00 -1.95 0.00 0.00 55.36 54.28 2jj1 s GLN 147 Cb -0.20 -4.09 0.18 0.00 -0.22 0.00 0.00 33.01 28.69 2jj1 s GLN 147 CO -0.04 -1.77 1.64 1.79 -0.25 0.00 0.00 175.29 176.66 2jj1 h THR 148 N 6.47 1.27 0.00 -0.19 1.35 -1.93 -3.45 112.91 116.43 2jj1 h THR 148 Ca -0.27 -1.29 0.00 0.00 -0.55 0.00 0.00 66.41 64.29 2jj1 h THR 148 Cb 1.11 1.14 0.00 0.00 -1.73 0.00 0.00 68.15 68.67 2jj1 h THR 148 CO 1.12 0.44 0.00 0.61 -0.25 0.00 0.00 175.52 177.44 2jj1 n GLY 149 N -0.28 0.71 3.51 5.82 0.00 -1.26 -3.59 105.19 110.10 2jj1 n GLY 149 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.69 5.04 0.16 -0.61 1.01 -1.26 -0.28 121.20 122.56 2jj1 s ILE 150 Ca 0.00 -0.23 -0.21 0.00 0.00 0.00 0.00 60.65 60.21 2jj1 s ILE 150 Cb 0.00 -3.55 0.05 0.00 0.01 0.00 0.00 42.46 38.97 2jj1 s ILE 150 CO 0.00 0.06 1.64 0.11 0.00 0.00 0.00 174.94 176.74 2jj1 h LYS 151 N 8.42 -0.18 -0.98 2.79 1.57 -1.94 0.71 116.57 126.96 2jj1 h LYS 151 Ca -0.32 0.01 0.05 0.00 -1.87 0.00 0.00 60.65 58.52 2jj1 h LYS 151 Cb 1.16 0.04 -0.06 0.00 0.08 0.00 0.00 32.23 33.45 2jj1 h LYS 151 CO 0.61 -0.12 0.64 0.00 -0.57 0.00 0.00 179.45 180.01 2jj1 h ALA 152 N 0.96 1.34 0.24 3.86 0.00 -1.91 -1.61 119.26 122.13 2jj1 h ALA 152 Ca 0.16 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2jj1 h ALA 152 Cb 0.43 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2jj1 h ALA 152 CO -0.41 0.47 -0.12 0.28 0.00 0.00 0.00 179.25 179.47 2jj1 h VAL 153 N 1.19 0.24 -0.21 0.00 2.07 -1.66 -1.88 116.25 115.99 2jj1 h VAL 153 Ca 0.41 -0.87 0.02 0.00 0.82 0.00 0.00 66.70 67.08 2jj1 h VAL 153 Cb 0.10 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 2jj1 h VAL 153 CO -0.15 0.07 0.14 0.44 0.02 0.00 0.00 177.57 178.09 2jj1 h ASP 154 N -1.04 0.19 0.08 0.57 3.32 -0.86 0.19 116.42 118.86 2jj1 h ASP 154 Ca -0.03 -0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.76 2jj1 h ASP 154 Cb 0.36 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 2jj1 h ASP 154 CO 0.06 0.13 -1.35 0.77 -1.72 0.00 0.00 179.24 177.13 2jj1 h SER 155 N 0.22 0.25 0.08 6.45 4.64 -1.43 -3.37 113.55 120.40 2jj1 h SER 155 Ca 0.09 -0.78 -0.37 0.00 -0.47 0.00 0.00 61.79 60.25 2jj1 h SER 155 Cb 0.07 -0.08 -0.04 0.00 -0.31 0.00 0.00 62.40 62.03 2jj1 h SER 155 CO -0.02 1.57 -2.21 0.18 -0.87 0.00 0.00 176.83 175.49 2jj1 n LEU 156 N -4.06 2.60 -2.74 5.97 4.77 -0.71 -4.55 117.00 118.27 2jj1 n LEU 156 Ca -0.27 0.06 -0.27 0.00 -0.03 0.00 0.00 56.01 55.50 2jj1 n LEU 156 Cb 0.83 -0.91 -0.02 0.00 -2.33 0.00 0.00 43.42 40.99 2jj1 n LEU 156 CO 0.34 0.86 0.21 0.52 -1.33 0.00 0.00 177.39 177.99 2jj1 n VAL 157 N -3.34 2.83 -2.02 4.08 0.31 0.62 -4.83 118.33 115.97 2jj1 n VAL 157 Ca -0.37 -5.28 -0.38 0.00 -0.01 0.00 0.00 64.34 58.29 2jj1 n VAL 157 Cb 1.03 -1.34 0.01 0.00 -0.91 0.00 0.00 33.84 32.63 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 -3.53 3.58 0.00 5.55 0.04 -0.89 -4.65 135.00 135.10 2jj1 s PRO 158 Ca 0.48 2.06 0.08 0.00 0.04 0.00 0.00 61.00 63.66 2jj1 s PRO 158 Cb 0.34 -2.44 -0.02 0.00 0.04 0.00 0.00 34.50 32.41 2jj1 s PRO 158 CO -0.17 -0.78 -0.25 0.42 0.04 0.00 0.00 177.00 176.26 2jj1 s ILE 159 N -1.38 2.19 0.24 0.56 1.01 -1.26 -4.00 121.20 118.56 2jj1 s ILE 159 Ca 0.65 -1.19 0.08 0.00 0.00 0.00 0.00 60.65 60.19 2jj1 s ILE 159 Cb -0.36 -1.80 -0.04 0.00 0.01 0.00 0.00 42.46 40.27 2jj1 s ILE 159 CO 0.44 0.49 0.05 -0.83 0.00 0.00 0.00 174.94 175.09 2jj1 s GLY 160 N -0.88 1.61 -0.24 6.18 0.00 -1.26 0.12 107.32 112.84 2jj1 s GLY 160 Ca 0.11 -1.54 -0.29 0.00 0.00 0.00 0.00 44.72 43.00 2jj1 s GLY 160 CO 0.00 -1.59 1.46 0.50 0.00 0.00 0.00 173.10 173.48 2jj1 s ARG 161 N -3.58 3.89 0.00 2.90 0.52 0.21 -2.14 118.95 120.76 2jj1 s ARG 161 Ca 0.31 1.51 0.00 0.00 -0.52 0.00 0.00 55.73 57.03 2jj1 s ARG 161 Cb -0.07 -3.95 0.00 0.00 0.52 0.00 0.00 34.95 31.45 2jj1 s ARG 161 CO 0.21 -1.16 0.00 0.41 0.02 0.00 0.00 175.30 174.78 2jj1 n GLY 162 N 4.42 1.69 3.87 -3.53 0.00 -1.24 -4.52 105.19 105.88 2jj1 n GLY 162 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 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 0.00 3.77 -0.27 1.61 0.74 -0.91 -2.72 119.66 121.88 2jj1 s GLN 163 Ca 0.00 0.62 -0.06 0.00 0.05 0.00 0.00 55.36 55.97 2jj1 s GLN 163 Cb 0.00 -2.26 -0.00 0.00 1.10 0.00 0.00 33.01 31.84 2jj1 s GLN 163 CO 0.00 -0.22 0.05 1.03 -0.55 0.00 0.00 175.29 175.60 2jj1 s ARG 164 N -4.26 3.27 -0.17 1.67 3.00 -1.26 -1.70 118.95 119.50 2jj1 s ARG 164 Ca 0.54 -0.73 0.01 0.00 0.00 0.00 0.00 55.73 55.55 2jj1 s ARG 164 Cb -0.10 -3.27 0.02 0.00 0.00 0.00 0.00 34.95 31.59 2jj1 s ARG 164 CO 0.37 -0.33 -0.20 -2.00 0.00 0.00 0.00 175.30 173.14 2jj1 s GLU 165 N 1.51 2.90 0.18 3.54 2.56 -0.70 0.65 118.70 129.34 2jj1 s GLU 165 Ca 0.04 -0.80 -0.30 0.00 0.00 0.00 0.00 54.97 53.91 2jj1 s GLU 165 Cb -0.16 -2.47 -0.08 0.00 2.00 0.00 0.00 34.13 33.42 2jj1 s GLU 165 CO 0.01 -0.17 1.08 -1.17 -0.56 0.00 0.00 175.26 174.45 2jj1 s LEU 166 N 1.21 4.50 -0.26 2.70 2.96 -0.93 -3.49 118.68 125.38 2jj1 s LEU 166 Ca 0.02 2.07 -0.07 0.00 -0.22 0.00 0.00 54.13 55.94 2jj1 s LEU 166 Cb -0.14 -3.60 -0.01 0.00 0.50 0.00 0.00 46.19 42.94 2jj1 s LEU 166 CO -0.10 -0.19 0.06 -0.63 -1.32 0.00 0.00 176.35 174.16 2jj1 s ILE 167 N -0.32 4.02 -0.01 6.68 1.01 0.30 -0.28 121.20 132.60 2jj1 s ILE 167 Ca 0.49 -0.44 0.01 0.00 0.00 0.00 0.00 60.65 60.71 2jj1 s ILE 167 Cb -0.29 -2.95 0.01 0.00 0.01 0.00 0.00 42.46 39.24 2jj1 s ILE 167 CO 0.35 0.25 -0.03 -0.51 0.00 0.00 0.00 174.94 174.99 2jj1 s ILE 168 N 1.55 0.31 0.00 2.92 2.07 -0.50 -0.97 121.20 126.57 2jj1 s ILE 168 Ca 0.05 -0.11 0.00 0.00 -1.41 0.00 0.00 60.65 59.18 2jj1 s ILE 168 Cb -0.16 -0.31 0.00 0.00 0.13 0.00 0.00 42.46 42.13 2jj1 s ILE 168 CO 0.02 0.12 0.00 0.61 -1.91 0.00 0.00 174.94 173.78 2jj1 n GLY 169 N 3.37 1.46 3.48 1.50 0.00 -0.98 -0.24 105.19 113.78 2jj1 n GLY 169 Ca -0.18 -0.86 -0.31 0.00 0.00 0.00 0.00 46.02 44.67 2jj1 n GLY 169 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jj1 n ASP 170 N 0.00 -1.35 -4.60 1.61 9.92 -1.26 -1.48 116.55 119.39 2jj1 n ASP 170 Ca 0.00 0.10 -0.39 0.00 -0.53 0.00 0.00 54.79 53.98 2jj1 n ASP 170 Cb 0.00 -1.25 0.04 0.00 -0.64 0.00 0.00 41.12 39.27 2jj1 n ASP 170 CO 0.00 0.00 0.00 -2.11 0.13 0.00 0.00 177.20 175.22 2jj1 n ARG 171 N -3.58 1.02 -3.46 -1.24 1.85 -1.26 -3.56 116.66 106.42 2jj1 n ARG 171 Ca 0.06 0.38 -0.20 0.00 -1.00 0.00 0.00 57.85 57.09 2jj1 n ARG 171 Cb 0.55 -2.11 0.08 0.00 -1.05 0.00 0.00 32.46 29.93 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 -0.60 -7.02 0.00 2.89 1.13 -1.26 -4.92 117.38 107.60 2jj1 n GLN 172 Ca 0.12 0.80 0.02 0.00 -1.94 0.00 0.00 57.00 56.00 2jj1 n GLN 172 Cb 0.45 -5.71 0.00 0.00 0.11 0.00 0.00 30.24 25.10 2jj1 n GLN 172 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 2jj1 n THR 173 N -4.49 0.00 0.00 5.09 -2.24 -1.23 -4.99 114.28 106.42 2jj1 n THR 173 Ca -0.12 -0.46 0.00 0.00 -2.27 0.00 0.00 64.05 61.21 2jj1 n THR 173 Cb 0.60 1.07 0.00 0.00 -2.10 0.00 0.00 70.33 69.90 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 0.61 1.60 0.24 3.38 0.00 -1.26 -4.35 105.19 105.41 2jj1 n GLY 174 Ca 0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.55 -0.87 1.61 1.57 -1.94 -2.98 116.57 113.41 2jj1 h LYS 175 Ca 0.00 0.04 0.21 0.00 -1.87 0.00 0.00 60.65 59.03 2jj1 h LYS 175 Cb 0.00 0.13 -0.12 0.00 0.08 0.00 0.00 32.23 32.31 2jj1 h LYS 175 CO 0.00 -0.37 0.33 1.15 -0.57 0.00 0.00 179.45 180.00 2jj1 h THR 176 N -0.76 0.46 -0.87 -0.16 2.02 -1.98 -0.60 112.91 111.02 2jj1 h THR 176 Ca -0.06 -0.12 0.22 0.00 0.77 0.00 0.00 66.41 67.22 2jj1 h THR 176 Cb 0.44 0.08 -0.16 0.00 -1.74 0.00 0.00 68.15 66.77 2jj1 h THR 176 CO 0.10 0.06 0.01 0.28 0.37 0.00 0.00 175.52 176.34 2jj1 h SER 177 N 0.35 -0.41 -0.34 4.18 0.02 -1.98 0.20 113.55 115.57 2jj1 h SER 177 Ca 0.53 0.24 0.06 0.00 -0.84 0.00 0.00 61.79 61.77 2jj1 h SER 177 Cb 1.00 0.41 -0.05 0.00 0.14 0.00 0.00 62.40 63.90 2jj1 h SER 177 CO -0.54 -0.26 0.04 0.40 -1.14 0.00 0.00 176.83 175.33 2jj1 h ILE 178 N 0.07 0.79 -0.46 3.27 1.08 -0.95 -2.03 117.51 119.28 2jj1 h ILE 178 Ca 0.50 -0.05 -0.03 0.00 -0.39 0.00 0.00 64.86 64.89 2jj1 h ILE 178 Cb 0.95 0.63 -0.02 0.00 -3.07 0.00 0.00 36.82 35.31 2jj1 h ILE 178 CO -0.79 0.03 0.15 0.00 -0.69 0.00 0.00 178.15 176.85 2jj1 h ALA 179 N 1.28 0.60 -0.12 1.87 0.00 -0.70 -2.90 119.26 119.29 2jj1 h ALA 179 Ca 0.17 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2jj1 h ALA 179 Cb 0.20 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2jj1 h ALA 179 CO -0.24 0.24 -0.02 0.82 0.00 0.00 0.00 179.25 180.06 2jj1 h ILE 180 N 0.61 1.28 -0.83 0.00 1.08 -0.56 -1.08 117.51 118.00 2jj1 h ILE 180 Ca 0.15 -0.90 -0.03 0.00 -0.39 0.00 0.00 64.86 63.68 2jj1 h ILE 180 Cb 0.25 1.64 -0.04 0.00 -3.07 0.00 0.00 36.82 35.60 2jj1 h ILE 180 CO -0.01 0.26 0.39 0.44 -0.69 0.00 0.00 178.15 178.54 2jj1 h ASP 181 N -0.08 1.10 -0.10 1.72 5.19 -1.46 -0.58 116.42 122.21 2jj1 h ASP 181 Ca 0.03 -0.14 0.04 0.00 -0.62 0.00 0.00 57.03 56.34 2jj1 h ASP 181 Cb 0.41 -0.28 -0.06 0.00 0.18 0.00 0.00 39.33 39.58 2jj1 h ASP 181 CO 0.01 0.94 -0.31 0.74 -3.12 0.00 0.00 179.24 177.50 2jj1 h THR 182 N 1.19 0.30 -0.11 0.35 2.02 -1.28 0.97 112.91 116.35 2jj1 h THR 182 Ca 0.28 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.51 2jj1 h THR 182 Cb 0.14 0.30 -0.06 0.00 -1.74 0.00 0.00 68.15 66.80 2jj1 h THR 182 CO -0.03 0.00 -0.27 0.40 0.37 0.00 0.00 175.52 175.99 2jj1 h ILE 183 N -0.40 0.38 -0.03 3.11 2.04 -0.76 -1.64 117.51 120.21 2jj1 h ILE 183 Ca 0.09 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.95 2jj1 h ILE 183 Cb 0.54 0.38 -0.00 0.00 -0.74 0.00 0.00 36.82 37.00 2jj1 h ILE 183 CO -0.33 0.00 0.00 0.40 0.00 0.00 0.00 178.15 178.23 2jj1 h ILE 184 N -0.35 1.02 0.00 -0.67 2.04 -0.33 -2.59 117.51 116.64 2jj1 h ILE 184 Ca 0.09 -0.06 -0.04 0.00 1.00 0.00 0.00 64.86 65.85 2jj1 h ILE 184 Cb 0.49 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 2jj1 h ILE 184 CO -0.31 0.02 -0.18 -1.13 0.00 0.00 0.00 178.15 176.55 2jj1 h ASN 185 N 0.04 0.00 0.88 1.72 -1.24 0.20 -3.14 115.58 114.04 2jj1 h ASN 185 Ca 0.01 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.02 2jj1 h ASN 185 Cb 0.02 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.07 2jj1 h ASN 185 CO -0.00 0.18 0.00 0.00 -1.29 0.00 0.00 177.43 176.32 2jj1 n GLN 186 N -4.13 0.21 -0.31 6.67 1.13 -0.97 -3.13 117.38 116.84 2jj1 n GLN 186 Ca -0.02 0.38 0.13 0.00 -1.94 0.00 0.00 57.00 55.55 2jj1 n GLN 186 Cb 0.26 -1.86 0.31 0.00 0.11 0.00 0.00 30.24 29.06 2jj1 n GLN 186 CO 0.00 0.00 0.00 -0.22 -1.44 0.00 0.00 177.06 175.40 2jj1 h LYS 187 N 0.00 0.48 -0.88 -1.09 3.64 -1.74 0.66 116.57 117.64 2jj1 h LYS 187 Ca 0.00 -0.03 0.18 0.00 -1.27 0.00 0.00 60.65 59.53 2jj1 h LYS 187 Cb 0.44 -0.11 -0.07 0.00 -0.41 0.00 0.00 32.23 32.08 2jj1 h LYS 187 CO 0.00 0.32 0.58 0.07 -2.27 0.00 0.00 179.45 178.15 2jj1 h ARG 188 N 0.50 0.48 0.09 1.90 0.11 -1.82 -1.55 114.38 114.09 2jj1 h ARG 188 Ca 0.56 -0.03 -0.36 0.00 0.10 0.00 0.00 59.98 60.25 2jj1 h ARG 188 Cb 1.02 -0.11 -0.03 0.00 1.11 0.00 0.00 29.97 31.96 2jj1 h ARG 188 CO -0.48 0.32 -2.02 1.19 0.10 0.00 0.00 179.97 179.08 2jj1 n PHE 189 N -4.53 1.02 0.17 4.08 3.01 -0.36 -4.08 117.46 116.77 2jj1 n PHE 189 Ca 0.18 0.23 0.04 0.00 1.01 0.00 0.00 57.45 58.91 2jj1 n PHE 189 Cb 0.61 -1.13 0.17 0.00 -0.01 0.00 0.00 39.48 39.12 2jj1 n PHE 189 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 2jj1 n ASN 190 N -3.55 0.10 -0.89 4.37 3.02 0.08 -0.09 115.26 118.30 2jj1 n ASN 190 Ca -0.35 0.54 0.10 0.00 -0.03 0.00 0.00 54.58 54.84 2jj1 n ASN 190 Cb 1.00 -0.55 0.15 0.00 -0.61 0.00 0.00 39.78 39.77 2jj1 n ASN 190 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2jj1 n ASP 191 N -1.62 2.96 -3.37 6.41 8.00 -0.63 -4.98 116.55 123.32 2jj1 n ASP 191 Ca 0.01 -1.87 -0.18 0.00 0.71 0.00 0.00 54.79 53.46 2jj1 n ASP 191 Cb 0.06 -0.14 0.12 0.00 -0.02 0.00 0.00 41.12 41.13 2jj1 n ASP 191 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jj1 n GLY 192 N 1.14 -0.73 0.07 0.44 0.00 0.87 -5.03 105.19 101.95 2jj1 n GLY 192 Ca 0.14 -1.79 0.04 0.00 0.00 0.00 0.00 46.02 44.41 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 -2.93 0.00 -1.76 2.61 -2.24 -1.26 -4.91 114.28 103.79 2jj1 n THR 193 Ca 0.11 -0.34 -0.34 0.00 -2.27 0.00 0.00 64.05 61.21 2jj1 n THR 193 Cb 0.38 1.04 -0.04 0.00 -2.10 0.00 0.00 70.33 69.61 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 -1.60 4.72 0.27 3.42 -1.08 -1.26 -4.87 116.67 116.26 2jj1 s ASP 194 Ca 0.05 0.59 0.09 0.00 -0.52 0.00 0.00 52.55 52.75 2jj1 s ASP 194 Cb 0.07 -2.52 0.36 0.00 -1.46 0.00 0.00 42.92 39.36 2jj1 s ASP 194 CO 0.30 -2.80 1.62 -0.33 0.52 0.00 0.00 175.17 174.48 2jj1 h GLU 195 N 16.73 0.09 0.00 4.34 4.39 -1.94 -3.07 114.58 135.12 2jj1 h GLU 195 Ca -0.20 -0.06 -0.06 0.00 0.34 0.00 0.00 59.36 59.38 2jj1 h GLU 195 Cb 1.19 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.84 2jj1 h GLU 195 CO 1.17 0.64 -0.30 0.87 -1.16 0.00 0.00 179.01 180.23 2jj1 h LYS 196 N 0.06 0.00 -0.00 2.33 1.57 -1.92 -3.12 116.57 115.49 2jj1 h LYS 196 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2jj1 h LYS 196 Cb 1.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.36 2jj1 h LYS 196 CO 0.08 0.30 -0.00 1.63 -0.57 0.00 0.00 179.45 180.89 2jj1 n LYS 197 N -3.30 0.95 -2.54 3.15 4.76 -1.16 -4.92 118.16 115.11 2jj1 n LYS 197 Ca 0.01 -0.07 -0.27 0.00 -2.87 0.00 0.00 58.31 55.12 2jj1 n LYS 197 Cb 0.55 -1.50 0.02 0.00 -1.84 0.00 0.00 35.03 32.26 2jj1 n LYS 197 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2jj1 s LYS 198 N -2.09 3.19 -0.24 1.97 1.02 -1.18 -4.80 119.74 117.60 2jj1 s LYS 198 Ca 0.44 0.04 -0.03 0.00 0.02 0.00 0.00 55.97 56.44 2jj1 s LYS 198 Cb 0.22 -2.34 0.12 0.00 -0.52 0.00 0.00 37.83 35.31 2jj1 s LYS 198 CO 0.38 -0.46 0.31 -1.17 -0.92 0.00 0.00 175.35 173.49 2jj1 s LEU 199 N -4.85 -0.38 0.00 3.17 2.96 -1.26 -4.52 118.68 113.79 2jj1 s LEU 199 Ca 0.51 -0.11 -0.24 0.00 -0.22 0.00 0.00 54.13 54.06 2jj1 s LEU 199 Cb -0.10 0.74 -0.05 0.00 0.50 0.00 0.00 46.19 47.28 2jj1 s LEU 199 CO 0.44 -0.33 0.73 -0.31 -1.32 0.00 0.00 176.35 175.57 2jj1 s TYR 200 N 2.43 3.67 0.08 5.38 1.51 -0.73 -4.87 117.35 124.82 2jj1 s TYR 200 Ca 0.10 1.37 0.05 0.00 -1.01 0.00 0.00 57.07 57.58 2jj1 s TYR 200 Cb -0.15 -2.80 -0.04 0.00 -0.11 0.00 0.00 41.96 38.86 2jj1 s TYR 200 CO -0.17 0.21 -0.01 0.00 -1.11 0.00 0.00 175.55 174.47 2jj1 s ILE 202 N -1.26 0.43 -0.36 0.00 1.01 -0.06 0.60 121.20 121.55 2jj1 s ILE 202 Ca 0.24 0.08 -0.10 0.00 0.00 0.00 0.00 60.65 60.87 2jj1 s ILE 202 Cb -0.12 -0.58 0.02 0.00 0.01 0.00 0.00 42.46 41.79 2jj1 s ILE 202 CO 0.17 0.26 0.18 -0.47 0.00 0.00 0.00 174.94 175.08 2jj1 s TYR 203 N 1.95 3.23 -0.39 3.97 5.04 0.80 -0.86 117.35 131.09 2jj1 s TYR 203 Ca 0.05 -0.95 -0.17 0.00 -2.44 0.00 0.00 57.07 53.57 2jj1 s TYR 203 Cb -0.12 -2.41 0.01 0.00 0.35 0.00 0.00 41.96 39.79 2jj1 s TYR 203 CO -0.06 -0.62 0.42 0.08 -1.34 0.00 0.00 175.55 174.03 2jj1 s VAL 204 N 1.55 5.11 -0.52 3.14 1.01 0.10 -1.11 120.40 129.67 2jj1 s VAL 204 Ca 0.02 -0.18 -0.19 0.00 0.00 0.00 0.00 61.98 61.63 2jj1 s VAL 204 Cb -0.19 -3.96 0.07 0.00 0.00 0.00 0.00 36.38 32.30 2jj1 s VAL 204 CO 0.06 -0.30 0.62 0.00 0.00 0.00 0.00 175.10 175.47 2jj1 s ALA 205 N 2.11 3.42 -0.29 5.51 0.00 0.59 0.01 121.76 133.10 2jj1 s ALA 205 Ca 0.12 -1.91 -0.08 0.00 0.00 0.00 0.00 51.96 50.10 2jj1 s ALA 205 Cb -0.17 -3.36 -0.00 0.00 0.00 0.00 0.00 23.12 19.59 2jj1 s ALA 205 CO 0.13 -2.05 0.10 0.42 0.00 0.00 0.00 175.76 174.36 2jj1 s ILE 206 N 2.51 4.24 0.00 0.00 1.09 -0.38 -1.02 121.20 127.64 2jj1 s ILE 206 Ca 0.13 -0.50 0.00 0.00 -1.10 0.00 0.00 60.65 59.18 2jj1 s ILE 206 Cb -0.21 -3.13 0.00 0.00 -1.06 0.00 0.00 42.46 38.06 2jj1 s ILE 206 CO 0.10 0.13 0.00 0.61 -0.10 0.00 0.00 174.94 175.68 2jj1 n GLY 207 N 4.92 1.91 3.53 6.18 0.00 -0.46 -2.62 105.19 118.64 2jj1 n GLY 207 Ca -0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.53 -0.60 0.22 1.61 -0.21 -1.26 -3.61 119.66 115.28 2jj1 s GLN 208 Ca 0.00 0.82 -0.30 0.00 0.02 0.00 0.00 55.36 55.90 2jj1 s GLN 208 Cb 0.00 -1.59 -0.08 0.00 1.00 0.00 0.00 33.01 32.33 2jj1 s GLN 208 CO 0.00 -3.50 1.09 0.15 -2.12 0.00 0.00 175.29 170.91 2jj1 s LYS 209 N -4.56 4.62 0.18 2.91 1.02 -1.26 -1.04 119.74 121.61 2jj1 s LYS 209 Ca 0.68 1.74 -0.13 0.00 0.02 0.00 0.00 55.97 58.28 2jj1 s LYS 209 Cb -0.24 -3.25 0.12 0.00 -0.52 0.00 0.00 37.83 33.95 2jj1 s LYS 209 CO 0.63 0.14 1.81 -0.09 -0.92 0.00 0.00 175.35 176.93 2jj1 h ARG 210 N 4.61 0.60 -0.68 1.68 2.43 -1.96 -1.26 114.38 119.80 2jj1 h ARG 210 Ca -0.45 -0.04 0.13 0.00 -0.81 0.00 0.00 59.98 58.81 2jj1 h ARG 210 Cb 1.21 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 30.58 2jj1 h ARG 210 CO 0.70 0.39 0.46 0.66 -1.51 0.00 0.00 179.97 180.67 2jj1 h SER 211 N 0.61 0.37 -0.33 -3.80 4.64 -1.98 0.22 113.55 113.27 2jj1 h SER 211 Ca 0.22 0.01 -0.11 0.00 -0.47 0.00 0.00 61.79 61.44 2jj1 h SER 211 Cb 0.05 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 62.06 2jj1 h SER 211 CO -0.11 0.20 -0.18 0.74 -0.87 0.00 0.00 176.83 176.61 2jj1 h THR 212 N 0.40 1.27 -0.06 2.95 2.02 -1.64 -0.81 112.91 117.04 2jj1 h THR 212 Ca 0.32 -1.29 -0.05 0.00 0.77 0.00 0.00 66.41 66.17 2jj1 h THR 212 Cb 0.72 1.14 0.00 0.00 -1.74 0.00 0.00 68.15 68.28 2jj1 h THR 212 CO -0.09 0.44 -0.15 0.58 0.37 0.00 0.00 175.52 176.66 2jj1 h VAL 213 N 0.71 1.44 -0.65 3.16 2.07 -0.48 -2.01 116.25 120.48 2jj1 h VAL 213 Ca 0.10 -1.52 0.07 0.00 0.82 0.00 0.00 66.70 66.18 2jj1 h VAL 213 Cb 0.70 2.30 -0.06 0.00 -1.52 0.00 0.00 31.29 32.70 2jj1 h VAL 213 CO 0.05 0.42 0.33 0.00 0.02 0.00 0.00 177.57 178.39 2jj1 h ALA 214 N 0.45 0.87 -0.38 1.67 0.00 -0.55 -0.39 119.26 120.92 2jj1 h ALA 214 Ca -0.00 0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.99 2jj1 h ALA 214 Cb 0.76 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.45 2jj1 h ALA 214 CO 0.03 -0.04 0.14 1.96 0.00 0.00 0.00 179.25 181.34 2jj1 h GLN 215 N 0.59 0.30 -0.23 0.00 4.20 -1.15 -2.62 115.11 116.19 2jj1 h GLN 215 Ca 0.31 -0.02 0.04 0.00 0.06 0.00 0.00 58.65 59.04 2jj1 h GLN 215 Cb 0.27 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 27.94 2jj1 h GLN 215 CO -0.23 0.20 -0.04 1.25 -0.67 0.00 0.00 178.83 179.34 2jj1 h LEU 216 N 0.31 -0.18 -0.78 1.46 7.12 -0.33 0.17 115.31 123.08 2jj1 h LEU 216 Ca 0.17 0.06 -0.12 0.00 0.13 0.00 0.00 57.88 58.13 2jj1 h LEU 216 Cb 0.14 0.13 -0.01 0.00 -0.53 0.00 0.00 40.66 40.39 2jj1 h LEU 216 CO -0.17 -0.06 -0.39 -0.37 -0.13 0.00 0.00 178.44 177.32 2jj1 h VAL 217 N 0.02 1.30 -0.59 1.05 -1.51 -1.18 0.13 116.25 115.48 2jj1 h VAL 217 Ca 0.11 -1.53 0.10 0.00 -1.23 0.00 0.00 66.70 64.15 2jj1 h VAL 217 Cb 0.16 1.58 -0.07 0.00 -2.13 0.00 0.00 31.29 30.83 2jj1 h VAL 217 CO -0.22 0.48 0.19 0.50 -1.23 0.00 0.00 177.57 177.28 2jj1 h LYS 218 N 0.38 0.34 -0.51 5.19 1.63 -1.08 0.70 116.57 123.22 2jj1 h LYS 218 Ca 0.04 -0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 59.81 2jj1 h LYS 218 Cb 0.86 -0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 32.39 2jj1 h LYS 218 CO 0.07 0.22 0.29 -0.09 -3.45 0.00 0.00 179.45 176.50 2jj1 h ARG 219 N 0.35 0.70 -0.03 1.90 9.65 0.10 0.15 114.38 127.20 2jj1 h ARG 219 Ca 0.30 -0.07 -0.00 0.00 -1.10 0.00 0.00 59.98 59.10 2jj1 h ARG 219 Cb 0.39 -0.14 -0.00 0.00 -1.39 0.00 0.00 29.97 28.83 2jj1 h ARG 219 CO -0.33 0.52 0.00 -0.07 2.80 0.00 0.00 179.97 182.90 2jj1 h LEU 220 N 0.68 0.05 -0.39 3.80 3.38 -0.05 -2.34 115.31 120.43 2jj1 h LEU 220 Ca 0.18 -0.28 0.08 0.00 0.09 0.00 0.00 57.88 57.95 2jj1 h LEU 220 Cb 0.02 -0.01 -0.09 0.00 0.09 0.00 0.00 40.66 40.67 2jj1 h LEU 220 CO -0.03 0.32 -0.26 0.74 0.09 0.00 0.00 178.44 179.30 2jj1 h THR 221 N -0.23 0.32 -0.97 0.22 2.02 0.43 0.21 112.91 114.92 2jj1 h THR 221 Ca 0.01 0.00 0.23 0.00 0.77 0.00 0.00 66.41 67.42 2jj1 h THR 221 Cb 0.29 0.32 -0.08 0.00 -1.74 0.00 0.00 68.15 66.95 2jj1 h THR 221 CO 0.00 0.00 0.63 0.44 0.37 0.00 0.00 175.52 176.96 2jj1 h ASP 222 N -0.19 0.42 -0.14 4.18 5.19 -0.79 0.16 116.42 125.24 2jj1 h ASP 222 Ca 0.18 0.06 0.00 0.00 -0.62 0.00 0.00 57.03 56.65 2jj1 h ASP 222 Cb 0.49 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 39.98 2jj1 h ASP 222 CO -0.50 0.14 0.00 0.00 -3.12 0.00 0.00 179.24 175.75 2jj1 n ALA 223 N -2.51 2.50 -1.91 3.45 0.00 -0.42 -4.92 120.51 116.70 2jj1 n ALA 223 Ca 0.22 -0.63 -0.18 0.00 0.00 0.00 0.00 53.44 52.85 2jj1 n ALA 223 Cb 0.78 -1.01 -0.04 0.00 0.00 0.00 0.00 19.45 19.17 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 0.72 -5.22 0.01 0.00 2.03 0.57 -4.87 116.55 109.80 2jj1 n ASP 224 Ca 0.17 0.23 -0.04 0.00 0.52 0.00 0.00 54.79 55.66 2jj1 n ASP 224 Cb 0.45 -4.30 -0.11 0.00 -0.72 0.00 0.00 41.12 36.44 2jj1 n ASP 224 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jj1 h ALA 225 N 0.41 0.70 -0.20 -1.67 0.00 -1.23 -3.37 119.26 113.89 2jj1 h ALA 225 Ca -0.40 -1.13 0.06 0.00 0.00 0.00 0.00 54.91 53.45 2jj1 h ALA 225 Cb 1.24 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 19.37 2jj1 h ALA 225 CO 0.53 1.24 0.17 1.98 0.00 0.00 0.00 179.25 183.16 2jj1 h MET 226 N 0.00 0.00 0.00 0.00 1.85 -1.84 -0.80 114.93 114.14 2jj1 h MET 226 Ca -0.21 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.88 2jj1 h MET 226 Cb 1.79 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.82 2jj1 h MET 226 CO 0.07 0.00 0.00 0.36 -0.40 0.00 0.00 176.91 176.94 2jj1 n LYS 227 N -4.16 0.12 -0.19 0.39 2.85 -1.26 -1.85 118.16 114.05 2jj1 n LYS 227 Ca 0.02 0.22 0.04 0.00 -1.05 0.00 0.00 58.31 57.54 2jj1 n LYS 227 Cb 0.31 -1.50 0.06 0.00 -0.65 0.00 0.00 35.03 33.25 2jj1 n LYS 227 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 177.40 179.83 2jj1 n TYR 228 N -1.34 0.00 -4.91 5.58 0.18 -0.31 -4.41 117.16 111.95 2jj1 n TYR 228 Ca 0.04 -0.48 -0.32 0.00 1.88 0.00 0.00 57.90 59.02 2jj1 n TYR 228 Cb 0.09 -0.08 -0.13 0.00 -0.38 0.00 0.00 39.34 38.84 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 -1.31 2.93 -0.15 -3.48 2.01 -0.79 -1.23 115.64 113.63 2jj1 s THR 229 Ca 0.13 -0.81 -0.05 0.00 0.31 0.00 0.00 61.69 61.27 2jj1 s THR 229 Cb 0.11 -2.15 -0.03 0.00 0.01 0.00 0.00 72.50 70.44 2jj1 s THR 229 CO 0.01 0.56 0.02 -0.63 -0.69 0.00 0.00 174.62 173.89 2jj1 s ILE 230 N -0.74 4.43 -0.22 1.82 1.01 0.20 -0.81 121.20 126.89 2jj1 s ILE 230 Ca 0.12 -0.17 -0.05 0.00 0.00 0.00 0.00 60.65 60.54 2jj1 s ILE 230 Cb -0.11 -2.95 -0.02 0.00 0.01 0.00 0.00 42.46 39.40 2jj1 s ILE 230 CO 0.01 0.51 -0.00 -0.69 0.00 0.00 0.00 174.94 174.77 2jj1 s VAL 231 N 0.02 3.79 -0.24 2.92 1.01 -0.87 -0.14 120.40 126.89 2jj1 s VAL 231 Ca 0.04 -0.36 -0.06 0.00 0.00 0.00 0.00 61.98 61.59 2jj1 s VAL 231 Cb -0.13 -2.73 -0.02 0.00 0.00 0.00 0.00 36.38 33.50 2jj1 s VAL 231 CO 0.02 0.41 0.04 -0.69 0.00 0.00 0.00 175.10 174.88 2jj1 s VAL 232 N 1.32 4.10 -0.13 2.92 1.01 -0.27 -0.87 120.40 128.48 2jj1 s VAL 232 Ca 0.04 -0.24 0.01 0.00 0.00 0.00 0.00 61.98 61.79 2jj1 s VAL 232 Cb -0.15 -2.91 -0.00 0.00 0.00 0.00 0.00 36.38 33.32 2jj1 s VAL 232 CO 0.00 0.36 -0.17 -0.55 0.00 0.00 0.00 175.10 174.75 2jj1 s SER 233 N 1.55 3.61 -0.38 3.32 0.15 0.33 -0.30 113.70 121.98 2jj1 s SER 233 Ca 0.06 -0.45 0.02 0.00 0.70 0.00 0.00 55.95 56.27 2jj1 s SER 233 Cb -0.15 -1.54 0.15 0.00 -1.71 0.00 0.00 66.02 62.78 2jj1 s SER 233 CO 0.02 0.13 0.28 0.00 1.20 0.00 0.00 173.24 174.87 2jj1 s ALA 234 N 0.56 0.88 0.75 5.45 0.00 -0.19 -3.28 121.76 125.93 2jj1 s ALA 234 Ca -0.10 -1.94 -0.02 0.00 0.00 0.00 0.00 51.96 49.90 2jj1 s ALA 234 Cb -0.16 -1.66 0.14 0.00 0.00 0.00 0.00 23.12 21.43 2jj1 s ALA 234 CO 0.04 -2.07 1.03 0.95 0.00 0.00 0.00 175.76 175.70 2jj1 s THR 235 N 0.76 2.10 0.43 0.00 -4.23 -1.26 -1.35 115.64 112.08 2jj1 s THR 235 Ca 0.23 -0.55 0.26 0.00 -1.18 0.00 0.00 61.69 60.44 2jj1 s THR 235 Cb -0.13 -2.54 0.45 0.00 1.34 0.00 0.00 72.50 71.62 2jj1 s THR 235 CO -0.06 0.00 1.69 0.00 -0.54 0.00 0.00 174.62 175.71 2jj1 h ALA 236 N -0.63 2.55 -0.10 3.99 0.00 -1.15 0.40 119.26 124.32 2jj1 h ALA 236 Ca -0.36 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2jj1 h ALA 236 Cb 1.26 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.18 2jj1 h ALA 236 CO 0.39 -1.07 0.00 -1.13 0.00 0.00 0.00 179.25 177.45 2jj1 n SER 237 N -4.63 2.89 -4.80 0.00 3.41 -1.26 -4.92 113.62 104.31 2jj1 n SER 237 Ca 0.32 -1.94 -0.33 0.00 -0.26 0.00 0.00 58.87 56.65 2jj1 n SER 237 Cb 1.19 -0.05 -0.01 0.00 -0.26 0.00 0.00 64.21 65.08 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 -1.90 6.09 0.70 4.04 1.01 0.14 -5.00 116.67 121.75 2jj1 s ASP 238 Ca 0.31 1.89 -0.16 0.00 0.71 0.00 0.00 52.55 55.30 2jj1 s ASP 238 Cb 0.21 -2.55 0.02 0.00 1.01 0.00 0.00 42.92 41.61 2jj1 s ASP 238 CO 0.31 -0.96 1.22 0.00 0.21 0.00 0.00 175.17 175.95 2jj1 s ALA 239 N -2.18 2.21 0.15 5.23 0.00 -1.26 -4.82 121.76 121.10 2jj1 s ALA 239 Ca 0.66 0.96 -0.22 0.00 0.00 0.00 0.00 51.96 53.35 2jj1 s ALA 239 Cb -0.16 -3.49 0.04 0.00 0.00 0.00 0.00 23.12 19.51 2jj1 s ALA 239 CO 0.28 -1.75 1.62 0.00 0.00 0.00 0.00 175.76 175.91 2jj1 h ALA 240 N -0.01 -0.13 -0.92 0.00 0.00 -1.92 -2.24 119.26 114.04 2jj1 h ALA 240 Ca -0.49 0.09 0.25 0.00 0.00 0.00 0.00 54.91 54.76 2jj1 h ALA 240 Cb 1.30 0.54 -0.13 0.00 0.00 0.00 0.00 17.79 19.50 2jj1 h ALA 240 CO 0.51 -0.67 0.39 -1.35 0.00 0.00 0.00 179.25 178.13 2jj1 h PRO 241 N -0.25 0.33 -0.41 0.00 0.11 -1.86 0.15 132.00 130.07 2jj1 h PRO 241 Ca 0.15 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 66.28 2jj1 h PRO 241 Cb 0.48 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 31.47 2jj1 h PRO 241 CO -0.42 0.22 0.18 -0.07 -0.21 0.00 0.00 178.00 177.69 2jj1 h LEU 242 N 0.34 0.23 -0.63 2.35 3.38 -1.68 -0.09 115.31 119.21 2jj1 h LEU 242 Ca 0.60 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.60 2jj1 h LEU 242 Cb 1.22 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.93 2jj1 h LEU 242 CO -0.58 0.17 0.38 1.56 0.09 0.00 0.00 178.44 180.06 2jj1 h GLN 243 N 0.36 0.85 -0.52 1.13 4.20 -0.52 -1.14 115.11 119.47 2jj1 h GLN 243 Ca 0.18 -0.08 -0.08 0.00 0.06 0.00 0.00 58.65 58.74 2jj1 h GLN 243 Cb 0.13 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.71 2jj1 h GLN 243 CO -0.16 0.61 0.02 -0.92 -0.67 0.00 0.00 178.83 177.70 2jj1 h TYR 244 N 0.85 0.91 -0.20 2.96 3.20 -0.93 -3.23 116.97 120.52 2jj1 h TYR 244 Ca 0.23 -0.13 -0.17 0.00 3.14 0.00 0.00 58.73 61.79 2jj1 h TYR 244 Cb -0.03 -0.25 -0.00 0.00 1.54 0.00 0.00 36.73 37.99 2jj1 h TYR 244 CO -0.02 0.83 -0.57 1.25 -1.64 0.00 0.00 178.16 178.00 2jj1 h LEU 245 N 0.80 0.71 -0.85 2.82 5.85 -0.45 -3.38 115.31 120.81 2jj1 h LEU 245 Ca 0.16 -0.39 0.19 0.00 0.84 0.00 0.00 57.88 58.67 2jj1 h LEU 245 Cb 0.46 -0.21 -0.16 0.00 0.37 0.00 0.00 40.66 41.12 2jj1 h LEU 245 CO 0.02 1.13 -0.10 0.00 -0.34 0.00 0.00 178.44 179.16 2jj1 h ALA 246 N 0.88 0.76 -0.86 1.25 0.00 -1.25 -0.55 119.26 119.49 2jj1 h ALA 246 Ca 0.00 0.31 -0.00 0.00 0.00 0.00 0.00 54.91 55.22 2jj1 h ALA 246 Cb 1.14 0.57 -0.04 0.00 0.00 0.00 0.00 17.79 19.45 2jj1 h ALA 246 CO 0.11 -0.44 0.53 -1.35 0.00 0.00 0.00 179.25 178.10 2jj1 h PRO 247 N 0.03 1.16 -0.24 0.00 0.11 -1.78 0.29 132.00 131.58 2jj1 h PRO 247 Ca 0.45 -0.10 -0.05 0.00 0.11 0.00 0.00 66.00 66.40 2jj1 h PRO 247 Cb 0.78 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 31.63 2jj1 h PRO 247 CO -0.82 0.81 -0.06 1.88 -0.21 0.00 0.00 178.00 179.60 2jj1 h TYR 248 N 1.18 0.53 -0.46 0.65 -1.99 -1.37 0.19 116.97 115.70 2jj1 h TYR 248 Ca 0.31 -0.11 0.08 0.00 2.00 0.00 0.00 58.73 61.00 2jj1 h TYR 248 Cb -0.06 -0.13 -0.07 0.00 2.00 0.00 0.00 36.73 38.47 2jj1 h TYR 248 CO -0.00 0.70 0.08 0.77 -0.00 0.00 0.00 178.16 179.70 2jj1 h SER 249 N 0.21 -0.02 -0.71 3.88 0.02 -1.02 0.15 113.55 116.05 2jj1 h SER 249 Ca 0.06 0.08 0.09 0.00 -0.84 0.00 0.00 61.79 61.18 2jj1 h SER 249 Cb 0.53 0.12 -0.07 0.00 0.14 0.00 0.00 62.40 63.12 2jj1 h SER 249 CO 0.02 0.02 0.37 1.23 -1.14 0.00 0.00 176.83 177.33 2jj1 h GLY 250 N 0.21 1.07 1.62 -3.77 0.00 -0.12 -3.03 103.07 99.05 2jj1 h GLY 250 Ca 0.23 -0.24 -0.13 0.00 0.00 0.00 0.00 47.33 47.20 2jj1 h GLY 250 CO -0.31 0.08 -0.43 0.00 0.00 0.00 0.00 176.54 175.88 2jj1 h SER 252 N 0.35 0.53 -0.93 0.00 0.02 -1.13 -1.19 113.55 111.19 2jj1 h SER 252 Ca 0.03 -0.39 0.20 0.00 -0.84 0.00 0.00 61.79 60.79 2jj1 h SER 252 Cb 0.90 -0.15 -0.08 0.00 0.14 0.00 0.00 62.40 63.22 2jj1 h SER 252 CO 0.08 0.80 0.61 0.24 -1.14 0.00 0.00 176.83 177.41 2jj1 h MET 253 N 0.26 0.46 -0.09 3.45 2.86 -1.39 0.17 114.93 120.65 2jj1 h MET 253 Ca 0.06 -0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 57.63 2jj1 h MET 253 Cb 0.58 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 32.14 2jj1 h MET 253 CO 0.03 0.31 -0.12 0.78 1.06 0.00 0.00 176.91 178.97 2jj1 h GLY 254 N 0.48 0.26 0.80 8.32 0.00 -1.11 -3.26 103.07 108.56 2jj1 h GLY 254 Ca 0.50 -0.28 0.13 0.00 0.00 0.00 0.00 47.33 47.67 2jj1 h GLY 254 CO -0.22 0.26 0.48 0.83 0.00 0.00 0.00 176.54 177.89 2jj1 h GLU 255 N -0.20 0.43 -0.93 4.80 5.08 0.25 0.32 114.58 124.33 2jj1 h GLU 255 Ca 0.01 -0.03 0.27 0.00 -1.00 0.00 0.00 59.36 58.62 2jj1 h GLU 255 Cb 0.67 -0.10 -0.16 0.00 0.50 0.00 0.00 28.75 29.66 2jj1 h GLU 255 CO 0.03 0.29 0.25 -0.92 -1.00 0.00 0.00 179.01 177.66 2jj1 h TYR 256 N 0.45 0.36 0.24 4.33 3.20 -1.38 0.29 116.97 124.45 2jj1 h TYR 256 Ca 0.34 0.05 -0.34 0.00 3.14 0.00 0.00 58.73 61.93 2jj1 h TYR 256 Cb 0.72 -0.01 0.03 0.00 1.54 0.00 0.00 36.73 39.02 2jj1 h TYR 256 CO -0.00 -0.29 -1.52 0.74 -1.64 0.00 0.00 178.16 175.45 2jj1 h PHE 257 N 0.15 0.91 0.05 -3.82 -1.00 -0.55 -3.18 116.94 109.49 2jj1 h PHE 257 Ca 0.61 -0.66 0.02 0.00 2.81 0.00 0.00 57.97 60.76 2jj1 h PHE 257 Cb 1.32 -0.04 -0.04 0.00 3.61 0.00 0.00 35.95 40.80 2jj1 h PHE 257 CO -0.27 1.57 -0.23 -0.09 -1.61 0.00 0.00 178.31 177.68 2jj1 h ARG 258 N 0.14 -0.37 0.00 1.51 2.43 -0.97 0.12 114.38 117.24 2jj1 h ARG 258 Ca -0.27 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.93 2jj1 h ARG 258 Cb 2.15 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 31.78 2jj1 h ARG 258 CO 0.25 -0.25 0.00 -0.25 -1.51 0.00 0.00 179.97 178.22 2jj1 n ASP 259 N -5.35 0.00 -0.41 -3.80 8.00 0.01 -3.55 116.55 111.44 2jj1 n ASP 259 Ca -0.06 -0.77 0.08 0.00 0.71 0.00 0.00 54.79 54.76 2jj1 n ASP 259 Cb 0.26 -0.07 0.17 0.00 -0.02 0.00 0.00 41.12 41.46 2jj1 n ASP 259 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2jj1 n ASN 260 N -1.07 2.92 0.00 -2.24 3.02 -1.03 -4.84 115.26 112.02 2jj1 n ASN 260 Ca 0.21 -2.84 0.00 0.00 -0.03 0.00 0.00 54.58 51.92 2jj1 n ASN 260 Cb 0.14 -0.41 0.00 0.00 -0.61 0.00 0.00 39.78 38.91 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 -0.82 0.43 3.71 7.41 0.00 -1.23 -4.99 105.19 109.70 2jj1 n GLY 261 Ca 0.16 -0.78 -0.31 0.00 0.00 0.00 0.00 46.02 45.08 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 -1.43 2.11 -0.08 1.61 1.02 0.39 -4.54 119.74 118.82 2jj1 s LYS 262 Ca 0.00 -2.30 0.03 0.00 0.02 0.00 0.00 55.97 53.72 2jj1 s LYS 262 Cb 0.00 -1.51 0.01 0.00 -0.52 0.00 0.00 37.83 35.81 2jj1 s LYS 262 CO 0.00 -0.27 -0.17 -1.01 -0.92 0.00 0.00 175.35 172.98 2jj1 s HIS 263 N -2.85 1.93 0.04 3.18 3.76 -1.26 -1.40 115.29 118.69 2jj1 s HIS 263 Ca 0.15 -0.78 0.06 0.00 -0.15 0.00 0.00 55.06 54.34 2jj1 s HIS 263 Cb 0.04 -1.35 -0.02 0.00 1.11 0.00 0.00 32.58 32.36 2jj1 s HIS 263 CO 0.08 -0.36 -0.17 0.00 -0.85 0.00 0.00 174.74 173.44 2jj1 s ALA 264 N 0.61 1.43 -0.09 -1.40 0.00 -0.07 -1.77 121.76 120.47 2jj1 s ALA 264 Ca -0.15 -0.94 0.04 0.00 0.00 0.00 0.00 51.96 50.91 2jj1 s ALA 264 Cb -0.16 -0.25 -0.00 0.00 0.00 0.00 0.00 23.12 22.71 2jj1 s ALA 264 CO 0.05 0.29 -0.23 -1.17 0.00 0.00 0.00 175.76 174.70 2jj1 s LEU 265 N -1.20 2.16 -0.00 0.00 2.96 0.44 -0.23 118.68 122.80 2jj1 s LEU 265 Ca 0.04 -0.52 0.06 0.00 -0.22 0.00 0.00 54.13 53.49 2jj1 s LEU 265 Cb -0.08 -1.42 -0.02 0.00 0.50 0.00 0.00 46.19 45.17 2jj1 s LEU 265 CO 0.02 0.18 -0.19 -0.51 -1.32 0.00 0.00 176.35 174.53 2jj1 s ILE 266 N 0.21 1.51 -0.20 6.68 2.07 0.13 -0.88 121.20 130.72 2jj1 s ILE 266 Ca -0.14 -0.88 0.01 0.00 -1.41 0.00 0.00 60.65 58.23 2jj1 s ILE 266 Cb -0.17 -1.27 0.03 0.00 0.13 0.00 0.00 42.46 41.18 2jj1 s ILE 266 CO 0.07 0.37 -0.17 -0.63 -1.91 0.00 0.00 174.94 172.67 2jj1 s ILE 267 N -0.52 2.11 -0.69 2.00 1.01 -0.04 -0.63 121.20 124.45 2jj1 s ILE 267 Ca 0.07 -1.11 -0.16 0.00 0.00 0.00 0.00 60.65 59.45 2jj1 s ILE 267 Cb -0.08 -1.98 0.16 0.00 0.01 0.00 0.00 42.46 40.58 2jj1 s ILE 267 CO -0.00 0.39 0.67 -0.31 0.00 0.00 0.00 174.94 175.69 2jj1 s TYR 268 N 1.24 3.43 -0.54 3.97 1.51 -1.10 0.01 117.35 125.87 2jj1 s TYR 268 Ca 0.01 -1.55 0.02 0.00 -1.01 0.00 0.00 57.07 54.54 2jj1 s TYR 268 Cb -0.15 -3.86 0.14 0.00 -0.11 0.00 0.00 41.96 37.98 2jj1 s TYR 268 CO -0.11 -1.07 0.30 0.34 -1.11 0.00 0.00 175.55 173.91 2jj1 s ASP 269 N 3.01 4.60 0.15 2.29 3.68 0.10 -0.97 116.67 129.53 2jj1 s ASP 269 Ca 0.12 -2.94 0.03 0.00 2.13 0.00 0.00 52.55 51.90 2jj1 s ASP 269 Cb -0.20 -1.70 -0.04 0.00 -1.45 0.00 0.00 42.92 39.53 2jj1 s ASP 269 CO -0.02 -0.28 -0.07 1.51 0.13 0.00 0.00 175.17 176.44 2jj1 s ASP 270 N 0.04 1.54 0.41 -0.34 1.47 -1.08 -1.25 116.67 117.46 2jj1 s ASP 270 Ca 0.17 -1.05 0.22 0.00 1.18 0.00 0.00 52.55 53.06 2jj1 s ASP 270 Cb -0.24 0.04 0.67 0.00 -0.34 0.00 0.00 42.92 43.05 2jj1 s ASP 270 CO -0.01 -0.42 1.72 -0.07 0.68 0.00 0.00 175.17 177.07 2jj1 h LEU 271 N 2.79 0.00 -0.09 2.11 3.38 0.45 -2.98 115.31 120.97 2jj1 h LEU 271 Ca -0.36 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.65 2jj1 h LEU 271 Cb 1.19 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.88 2jj1 h LEU 271 CO 0.64 0.26 -0.28 0.28 0.09 0.00 0.00 178.44 179.43 2jj1 h SER 272 N 0.00 -0.85 -1.01 -0.43 0.02 -1.93 0.13 113.55 109.48 2jj1 h SER 272 Ca -0.00 0.12 0.02 0.00 -0.84 0.00 0.00 61.79 61.09 2jj1 h SER 272 Cb 0.92 0.36 -0.05 0.00 0.14 0.00 0.00 62.40 63.76 2jj1 h SER 272 CO 0.03 -0.33 0.67 0.11 -1.14 0.00 0.00 176.83 176.17 2jj1 h LYS 273 N -0.37 1.30 -0.50 3.45 1.57 -1.83 -2.07 116.57 118.11 2jj1 h LYS 273 Ca 0.09 -0.08 -0.05 0.00 -1.87 0.00 0.00 60.65 58.74 2jj1 h LYS 273 Cb 0.50 -0.29 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 2jj1 h LYS 273 CO -0.30 0.86 0.11 0.37 -0.57 0.00 0.00 179.45 179.92 2jj1 h GLN 274 N 1.34 0.82 -0.70 3.15 4.15 -1.30 -0.94 115.11 121.61 2jj1 h GLN 274 Ca 0.38 -0.21 0.02 0.00 0.77 0.00 0.00 58.65 59.61 2jj1 h GLN 274 Cb -0.10 -0.10 -0.04 0.00 0.21 0.00 0.00 27.48 27.45 2jj1 h GLN 274 CO -0.10 0.80 0.47 0.00 -1.93 0.00 0.00 178.83 178.06 2jj1 h ALA 275 N 0.99 1.53 -0.39 3.38 0.00 -0.62 -1.06 119.26 123.10 2jj1 h ALA 275 Ca 0.16 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 2jj1 h ALA 275 Cb 0.36 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2jj1 h ALA 275 CO 0.00 0.42 0.24 0.28 0.00 0.00 0.00 179.25 180.19 2jj1 h VAL 276 N 0.92 1.12 -0.75 0.00 2.07 -0.69 -0.02 116.25 118.90 2jj1 h VAL 276 Ca 0.27 -0.28 0.16 0.00 0.82 0.00 0.00 66.70 67.67 2jj1 h VAL 276 Cb -0.05 0.61 -0.11 0.00 -1.52 0.00 0.00 31.29 30.22 2jj1 h VAL 276 CO -0.06 0.12 0.20 0.00 0.02 0.00 0.00 177.57 177.85 2jj1 h ALA 277 N 1.11 0.99 -0.01 1.67 0.00 -0.47 -2.27 119.26 120.27 2jj1 h ALA 277 Ca 0.14 0.17 -0.21 0.00 0.00 0.00 0.00 54.91 55.00 2jj1 h ALA 277 Cb -0.01 0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2jj1 h ALA 277 CO -0.03 -0.33 -0.89 -0.92 0.00 0.00 0.00 179.25 177.08 2jj1 h TYR 278 N 0.29 0.52 -0.84 0.00 3.20 -0.30 -2.89 116.97 116.95 2jj1 h TYR 278 Ca 0.42 -0.27 -0.02 0.00 3.14 0.00 0.00 58.73 62.00 2jj1 h TYR 278 Cb 0.73 -0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.90 2jj1 h TYR 278 CO -0.25 1.08 0.45 -0.09 -1.64 0.00 0.00 178.16 177.71 2jj1 h ARG 279 N 0.21 1.18 -0.76 1.82 2.43 -0.72 -0.14 114.38 118.39 2jj1 h ARG 279 Ca -0.06 -0.15 -0.02 0.00 -0.81 0.00 0.00 59.98 58.94 2jj1 h ARG 279 Cb 1.52 -0.23 -0.04 0.00 -0.42 0.00 0.00 29.97 30.80 2jj1 h ARG 279 CO 0.15 0.88 0.41 0.37 -1.51 0.00 0.00 179.97 180.27 2jj1 h GLN 280 N 1.17 1.07 -0.41 0.20 4.15 -1.25 -0.24 115.11 119.80 2jj1 h GLN 280 Ca 0.29 -0.13 -0.06 0.00 0.77 0.00 0.00 58.65 59.53 2jj1 h GLN 280 Cb 0.05 -0.21 -0.02 0.00 0.21 0.00 0.00 27.48 27.52 2jj1 h GLN 280 CO -0.04 0.80 0.03 0.52 -1.93 0.00 0.00 178.83 178.21 2jj1 h MET 281 N 1.06 0.71 -0.29 1.69 2.86 -1.25 -2.56 114.93 117.15 2jj1 h MET 281 Ca 0.27 -0.21 -0.18 0.00 -2.06 0.00 0.00 59.70 57.52 2jj1 h MET 281 Cb 0.05 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 31.63 2jj1 h MET 281 CO -0.04 0.77 -0.51 0.77 1.06 0.00 0.00 176.91 178.96 2jj1 h SER 282 N 0.55 0.91 -0.25 1.22 0.02 -0.69 -0.24 113.55 115.07 2jj1 h SER 282 Ca 0.12 -0.47 -0.10 0.00 -0.84 0.00 0.00 61.79 60.50 2jj1 h SER 282 Cb 0.43 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.69 2jj1 h SER 282 CO 0.01 1.25 -0.17 -0.07 -1.14 0.00 0.00 176.83 176.71 2jj1 h LEU 283 N 0.64 0.68 -0.86 5.07 3.38 -1.09 0.72 115.31 123.86 2jj1 h LEU 283 Ca 0.02 -0.22 -0.12 0.00 0.09 0.00 0.00 57.88 57.66 2jj1 h LEU 283 Cb 1.10 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 2jj1 h LEU 283 CO 0.11 0.86 -0.46 -0.07 0.09 0.00 0.00 178.44 178.97 2jj1 h LEU 284 N 0.61 0.27 0.00 1.67 3.38 -1.33 -2.19 115.31 117.72 2jj1 h LEU 284 Ca 0.10 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2jj1 h LEU 284 Cb 0.64 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.31 2jj1 h LEU 284 CO 0.04 0.70 0.00 0.18 0.09 0.00 0.00 178.44 179.45 2jj1 n LEU 285 N -3.99 0.00 -1.05 1.67 4.77 -0.11 -4.89 117.00 113.40 2jj1 n LEU 285 Ca -0.02 0.13 -0.10 0.00 -0.03 0.00 0.00 56.01 55.99 2jj1 n LEU 285 Cb 0.52 -0.13 -0.02 0.00 -2.33 0.00 0.00 43.42 41.45 2jj1 n LEU 285 CO 0.43 -0.01 -0.12 0.54 -1.33 0.00 0.00 177.39 176.90 2jj1 n ARG 286 N -1.13 -0.80 -2.03 3.23 1.74 -0.25 -5.00 116.66 112.42 2jj1 n ARG 286 Ca 0.18 0.64 -0.42 0.00 -0.77 0.00 0.00 57.85 57.48 2jj1 n ARG 286 Cb 0.16 -4.67 -0.03 0.00 -1.02 0.00 0.00 32.46 26.90 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 -3.92 4.26 -0.01 5.56 1.81 0.08 -4.91 118.95 121.81 2jj1 s ARG 287 Ca 0.00 2.25 -0.34 0.00 -1.72 0.00 0.00 55.73 55.92 2jj1 s ARG 287 Cb 0.00 -3.18 -0.13 0.00 -0.45 0.00 0.00 34.95 31.19 2jj1 s ARG 287 CO 0.00 -0.53 1.77 -0.35 -0.68 0.00 0.00 175.30 175.51 2jj1 n PRO 288 N 3.83 2.11 -2.33 3.54 -0.04 -1.26 -4.60 135.00 136.25 2jj1 n PRO 288 Ca 0.12 0.77 -0.41 0.00 -0.04 0.00 0.00 63.50 63.94 2jj1 n PRO 288 Cb 0.40 -2.58 -0.03 0.00 -0.04 0.00 0.00 33.50 31.25 2jj1 n PRO 288 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 2jj1 s PRO 289 N 2.95 4.50 0.00 0.54 0.04 -1.26 -4.48 135.00 137.29 2jj1 s PRO 289 Ca 0.88 1.95 0.00 0.00 0.04 0.00 0.00 61.00 63.87 2jj1 s PRO 289 Cb -0.71 -3.18 0.00 0.00 0.04 0.00 0.00 34.50 30.65 2jj1 s PRO 289 CO 0.48 -0.03 0.00 0.41 0.04 0.00 0.00 177.00 177.90 2jj1 n GLY 290 N 1.57 4.35 3.68 0.56 0.00 -0.18 -4.87 105.19 110.30 2jj1 n GLY 290 Ca 0.02 -1.66 -0.49 0.00 0.00 0.00 0.00 46.02 43.88 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 2.10 -3.64 1.61 0.63 -1.26 -0.09 116.66 116.01 2jj1 n ARG 291 Ca 0.00 0.77 -0.24 0.00 -0.92 0.00 0.00 57.85 57.46 2jj1 n ARG 291 Cb 0.00 -2.61 0.07 0.00 0.45 0.00 0.00 32.46 30.37 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 6.57 -7.28 -0.59 -0.14 1.02 -1.26 -2.23 120.64 116.73 2jj1 n GLU 292 Ca 0.23 0.78 0.00 0.00 -0.02 0.00 0.00 57.16 58.15 2jj1 n GLU 292 Cb 0.28 -5.79 0.00 0.00 -0.02 0.00 0.00 31.44 25.91 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 -4.83 0.00 -1.77 0.62 0.00 0.87 -4.96 120.51 110.44 2jj1 n ALA 293 Ca -0.03 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.02 2jj1 n ALA 293 Cb 0.57 -0.88 -0.05 0.00 0.00 0.00 0.00 19.45 19.09 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 -0.59 3.54 0.60 0.00 1.51 -0.95 -4.34 117.35 117.11 2jj1 s TYR 294 Ca 0.00 1.72 -0.17 0.00 -1.01 0.00 0.00 57.07 57.61 2jj1 s TYR 294 Cb 0.00 -3.15 -0.03 0.00 -0.11 0.00 0.00 41.96 38.67 2jj1 s TYR 294 CO 0.00 -0.36 1.09 -1.25 -1.11 0.00 0.00 175.55 173.92 2jj1 s PRO 295 N -1.85 3.19 0.37 -1.71 0.04 -1.26 -1.01 135.00 132.76 2jj1 s PRO 295 Ca 0.49 1.36 0.20 0.00 0.04 0.00 0.00 61.00 63.09 2jj1 s PRO 295 Cb -0.26 -2.00 1.29 0.00 0.04 0.00 0.00 34.50 33.57 2jj1 s PRO 295 CO 0.33 -0.94 1.60 0.78 0.04 0.00 0.00 177.00 178.81 2jj1 h GLY 296 N 0.54 2.20 -1.56 0.56 0.00 -1.96 -1.27 103.07 101.58 2jj1 h GLY 296 Ca -0.48 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 46.68 2jj1 h GLY 296 CO 0.56 -0.72 0.00 2.09 0.00 0.00 0.00 176.54 178.47 2jj1 n ASP 297 N -5.19 2.28 -0.00 0.19 5.75 -1.26 -4.21 116.55 114.11 2jj1 n ASP 297 Ca 0.37 -2.12 0.06 0.00 -0.01 0.00 0.00 54.79 53.08 2jj1 n ASP 297 Cb 1.23 -0.33 0.46 0.00 -1.03 0.00 0.00 41.12 41.44 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 2.04 1.05 -0.11 2.12 3.04 -1.59 -0.04 116.25 122.76 2jj1 h VAL 298 Ca 0.00 -0.17 -0.02 0.00 -1.01 0.00 0.00 66.70 65.50 2jj1 h VAL 298 Cb 0.68 0.52 -0.00 0.00 -2.01 0.00 0.00 31.29 30.48 2jj1 h VAL 298 CO 0.07 0.09 -0.00 0.15 -1.01 0.00 0.00 177.57 176.86 2jj1 h PHE 299 N 0.48 0.22 -0.34 3.17 3.57 -1.84 -3.20 116.94 119.01 2jj1 h PHE 299 Ca 0.17 -0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.62 2jj1 h PHE 299 Cb 0.08 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.75 2jj1 h PHE 299 CO -0.00 0.45 0.17 -0.92 -2.23 0.00 0.00 178.31 175.79 2jj1 h TYR 300 N -0.08 0.46 -0.75 0.41 3.20 -1.67 0.28 116.97 118.82 2jj1 h TYR 300 Ca 0.03 -0.00 0.12 0.00 3.14 0.00 0.00 58.73 62.02 2jj1 h TYR 300 Cb 0.37 -0.15 -0.08 0.00 1.54 0.00 0.00 36.73 38.41 2jj1 h TYR 300 CO 0.04 0.33 0.35 1.25 -1.64 0.00 0.00 178.16 178.49 2jj1 h LEU 301 N 0.48 0.42 0.12 2.82 5.85 -1.02 -2.61 115.31 121.37 2jj1 h LEU 301 Ca 0.12 0.08 -0.36 0.00 0.84 0.00 0.00 57.88 58.56 2jj1 h LEU 301 Cb 0.04 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 2jj1 h LEU 301 CO -0.02 0.21 -1.98 1.41 -0.34 0.00 0.00 178.44 177.72 2jj1 n HIS 302 N -4.90 1.26 0.09 1.25 8.25 -0.41 -4.13 115.22 116.63 2jj1 n HIS 302 Ca 0.13 0.27 -0.12 0.00 -0.26 0.00 0.00 57.72 57.74 2jj1 n HIS 302 Cb 0.34 -1.17 -0.05 0.00 1.12 0.00 0.00 29.99 30.23 2jj1 n HIS 302 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2jj1 h SER 303 N 0.07 -0.89 -0.95 0.41 4.64 -0.41 -1.43 113.55 115.00 2jj1 h SER 303 Ca -0.42 0.11 0.03 0.00 -0.47 0.00 0.00 61.79 61.05 2jj1 h SER 303 Cb 2.04 0.35 -0.05 0.00 -0.31 0.00 0.00 62.40 64.42 2jj1 h SER 303 CO 0.09 -0.38 0.62 0.08 -0.87 0.00 0.00 176.83 176.37 2jj1 h ARG 304 N -0.49 1.16 0.45 4.77 0.11 -1.68 -0.26 114.38 118.44 2jj1 h ARG 304 Ca 0.05 -0.07 -0.01 0.00 0.10 0.00 0.00 59.98 60.04 2jj1 h ARG 304 Cb 0.55 -0.26 -0.01 0.00 1.11 0.00 0.00 29.97 31.36 2jj1 h ARG 304 CO -0.22 0.77 -0.30 1.25 0.10 0.00 0.00 179.97 181.57 2jj1 h LEU 305 N 1.19 -0.76 -0.35 0.08 5.85 -1.62 -3.14 115.31 116.57 2jj1 h LEU 305 Ca 0.37 0.05 -0.14 0.00 0.84 0.00 0.00 57.88 59.00 2jj1 h LEU 305 Cb 0.00 0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.24 2jj1 h LEU 305 CO -0.11 -0.46 -0.68 -0.07 -0.34 0.00 0.00 178.44 176.78 2jj1 h LEU 306 N -0.72 0.00 -1.56 2.25 3.38 -0.89 -2.34 115.31 115.43 2jj1 h LEU 306 Ca -0.05 0.00 0.27 0.00 0.09 0.00 0.00 57.88 58.19 2jj1 h LEU 306 Cb 0.60 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.28 2jj1 h LEU 306 CO 0.04 0.68 0.69 -0.33 0.09 0.00 0.00 178.44 179.60 2jj1 h GLU 307 N 0.00 0.28 0.00 1.13 4.39 -1.06 -0.52 114.58 118.80 2jj1 h GLU 307 Ca -0.01 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.68 2jj1 h GLU 307 Cb 1.36 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.95 2jj1 h GLU 307 CO 0.09 0.19 0.00 0.00 -1.16 0.00 0.00 179.01 178.13 2jj1 h ARG 308 N 0.29 0.00 -6.66 2.33 3.08 -1.37 -3.41 114.38 108.65 2jj1 h ARG 308 Ca 0.55 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 60.09 2jj1 h ARG 308 Cb 1.60 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.65 2jj1 h ARG 308 CO -0.20 0.00 0.45 0.00 -1.07 0.00 0.00 179.97 179.15 2jj1 s ALA 309 N -3.58 3.35 -0.05 0.04 0.00 -0.20 -4.83 121.76 116.48 2jj1 s ALA 309 Ca 0.00 0.76 -0.29 0.00 0.00 0.00 0.00 51.96 52.43 2jj1 s ALA 309 Cb 0.09 -3.33 0.11 0.00 0.00 0.00 0.00 23.12 19.99 2jj1 s ALA 309 CO 0.37 -0.14 0.91 0.00 0.00 0.00 0.00 175.76 176.90 2jj1 s ALA 310 N -0.32 -1.85 -0.16 0.00 0.00 -0.67 -4.90 121.76 113.86 2jj1 s ALA 310 Ca 0.48 1.20 -0.04 0.00 0.00 0.00 0.00 51.96 53.60 2jj1 s ALA 310 Cb -0.28 0.06 -0.03 0.00 0.00 0.00 0.00 23.12 22.88 2jj1 s ALA 310 CO 0.34 -0.56 -0.04 0.21 0.00 0.00 0.00 175.76 175.72 2jj1 s LYS 311 N -2.42 3.66 -0.12 0.00 2.47 -1.26 -0.55 119.74 121.53 2jj1 s LYS 311 Ca 0.02 -0.52 -0.06 0.00 -1.56 0.00 0.00 55.97 53.85 2jj1 s LYS 311 Cb -0.01 -2.92 -0.04 0.00 -1.46 0.00 0.00 37.83 33.40 2jj1 s LYS 311 CO -0.05 0.22 0.12 -1.64 0.16 0.00 0.00 175.35 174.17 2jj1 s MET 312 N 0.41 3.38 1.09 4.03 -1.94 0.71 -2.47 119.30 124.51 2jj1 s MET 312 Ca -0.04 -0.17 -0.14 0.00 -1.71 0.00 0.00 55.69 53.64 2jj1 s MET 312 Cb -0.14 -3.14 0.24 0.00 2.01 0.00 0.00 34.83 33.80 2jj1 s MET 312 CO 0.03 0.77 1.07 0.54 -0.01 0.00 0.00 175.02 177.42 2jj1 s ASN 313 N -1.01 1.82 0.56 3.03 2.20 -0.38 -3.47 114.94 117.69 2jj1 s ASN 313 Ca 0.15 1.16 0.29 0.00 -0.94 0.00 0.00 52.86 53.53 2jj1 s ASN 313 Cb -0.12 -1.81 1.64 0.00 -2.00 0.00 0.00 41.25 38.96 2jj1 s ASN 313 CO 0.04 -3.63 2.15 0.44 -2.94 0.00 0.00 177.10 173.16 2jj1 h ASP 314 N -2.24 0.00 0.95 3.54 3.45 -1.90 -0.55 116.42 119.67 2jj1 h ASP 314 Ca -0.56 0.00 0.00 0.00 0.43 0.00 0.00 57.03 56.90 2jj1 h ASP 314 Cb 1.33 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.10 2jj1 h ASP 314 CO 0.53 0.07 0.00 0.00 -1.57 0.00 0.00 179.24 178.27 2jj1 n ALA 315 N -2.27 2.03 -1.15 3.45 0.00 -1.26 -2.75 120.51 118.56 2jj1 n ALA 315 Ca -0.02 -0.03 0.08 0.00 0.00 0.00 0.00 53.44 53.46 2jj1 n ALA 315 Cb 0.18 -1.40 0.19 0.00 0.00 0.00 0.00 19.45 18.42 2jj1 n ALA 315 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2jj1 n PHE 316 N -1.84 0.38 0.00 0.00 3.01 -0.77 -4.97 117.46 113.27 2jj1 n PHE 316 Ca 0.05 -1.08 0.00 0.00 1.01 0.00 0.00 57.45 57.43 2jj1 n PHE 316 Cb 0.30 -0.24 0.00 0.00 -0.01 0.00 0.00 39.48 39.53 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 -1.11 1.82 2.43 1.37 0.00 -1.11 -4.54 105.19 104.05 2jj1 n GLY 317 Ca 0.20 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 0.00 0.86 3.48 -0.02 0.00 -0.29 -4.36 105.19 104.86 2jj1 n GLY 318 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2jj1 n GLY 318 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jj1 s GLY 319 N -1.89 1.51 -0.13 -0.02 0.00 -1.23 -4.56 107.32 101.00 2jj1 s GLY 319 Ca 0.00 -0.70 -0.30 0.00 0.00 0.00 0.00 44.72 43.72 2jj1 s GLY 319 CO 0.00 0.17 0.90 -1.35 0.00 0.00 0.00 173.10 172.82 2jj1 s SER 320 N -3.34 -0.46 -0.14 1.64 1.04 -0.49 -0.20 113.70 111.74 2jj1 s SER 320 Ca 0.69 0.50 0.01 0.00 0.48 0.00 0.00 55.95 57.63 2jj1 s SER 320 Cb -0.15 0.38 0.02 0.00 0.10 0.00 0.00 66.02 66.37 2jj1 s SER 320 CO 0.58 -0.43 -0.15 -0.22 0.98 0.00 0.00 173.24 174.01 2jj1 s LEU 321 N -1.14 1.71 -0.15 2.42 2.96 0.28 -0.89 118.68 123.88 2jj1 s LEU 321 Ca -0.05 -0.48 -0.13 0.00 -0.22 0.00 0.00 54.13 53.26 2jj1 s LEU 321 Cb -0.00 -1.17 -0.05 0.00 0.50 0.00 0.00 46.19 45.47 2jj1 s LEU 321 CO 0.04 -0.04 0.26 -0.89 -1.32 0.00 0.00 176.35 174.41 2jj1 s THR 322 N 1.38 5.32 -0.22 3.68 2.01 0.68 -1.67 115.64 126.82 2jj1 s THR 322 Ca 0.03 0.49 0.01 0.00 0.31 0.00 0.00 61.69 62.53 2jj1 s THR 322 Cb -0.13 -3.59 0.03 0.00 0.01 0.00 0.00 72.50 68.82 2jj1 s THR 322 CO -0.09 0.44 -0.14 0.00 -0.69 0.00 0.00 174.62 174.14 2jj1 s ALA 323 N 0.15 2.48 -0.83 7.40 0.00 -0.69 0.19 121.76 130.47 2jj1 s ALA 323 Ca 0.16 -1.44 -0.10 0.00 0.00 0.00 0.00 51.96 50.58 2jj1 s ALA 323 Cb -0.13 -1.41 0.21 0.00 0.00 0.00 0.00 23.12 21.79 2jj1 s ALA 323 CO 0.04 -0.71 0.74 -0.51 0.00 0.00 0.00 175.76 175.32 2jj1 s LEU 324 N 1.24 6.27 0.48 0.00 1.43 0.20 -1.71 118.68 126.59 2jj1 s LEU 324 Ca -0.00 -2.93 -0.19 0.00 -1.03 0.00 0.00 54.13 49.97 2jj1 s LEU 324 Cb -0.16 -2.11 -0.09 0.00 0.03 0.00 0.00 46.19 43.86 2jj1 s LEU 324 CO -0.09 -0.46 0.98 -2.16 0.23 0.00 0.00 176.35 174.86 2jj1 s PRO 325 N -0.20 4.02 -0.07 1.29 0.04 -1.23 -2.72 135.00 136.14 2jj1 s PRO 325 Ca 0.20 1.10 0.03 0.00 0.04 0.00 0.00 61.00 62.37 2jj1 s PRO 325 Cb -0.12 -2.15 -0.02 0.00 0.04 0.00 0.00 34.50 32.25 2jj1 s PRO 325 CO -0.08 -0.21 -0.15 0.08 0.04 0.00 0.00 177.00 176.69 2jj1 s VAL 326 N -2.33 3.00 -0.02 -0.36 1.01 -0.14 -0.54 120.40 121.03 2jj1 s VAL 326 Ca 0.62 -0.73 0.03 0.00 0.00 0.00 0.00 61.98 61.90 2jj1 s VAL 326 Cb -0.11 -2.20 -0.00 0.00 0.00 0.00 0.00 36.38 34.08 2jj1 s VAL 326 CO 0.22 0.57 -0.11 -0.63 0.00 0.00 0.00 175.10 175.15 2jj1 s ILE 327 N -0.40 0.90 -0.31 2.22 -1.09 -0.15 0.85 121.20 123.23 2jj1 s ILE 327 Ca 0.04 -0.44 -0.07 0.00 -2.23 0.00 0.00 60.65 57.96 2jj1 s ILE 327 Cb -0.12 -0.79 0.02 0.00 -1.58 0.00 0.00 42.46 39.99 2jj1 s ILE 327 CO 0.02 0.27 0.09 -0.70 -1.23 0.00 0.00 174.94 173.39 2jj1 s GLU 328 N 0.08 2.91 0.49 2.79 2.12 -1.26 -2.31 118.70 123.52 2jj1 s GLU 328 Ca -0.02 -0.98 -0.17 0.00 0.36 0.00 0.00 54.97 54.16 2jj1 s GLU 328 Cb -0.08 -3.39 -0.08 0.00 0.26 0.00 0.00 34.13 30.83 2jj1 s GLU 328 CO 0.01 -0.53 0.96 0.95 -0.54 0.00 0.00 175.26 176.11 2jj1 s THR 329 N 1.46 4.53 -0.41 -1.70 -4.23 -0.55 -4.93 115.64 109.81 2jj1 s THR 329 Ca 0.01 1.22 -0.14 0.00 -1.18 0.00 0.00 61.69 61.61 2jj1 s THR 329 Cb -0.18 -3.70 0.03 0.00 1.34 0.00 0.00 72.50 69.99 2jj1 s THR 329 CO 0.02 -0.61 0.28 -1.10 -0.54 0.00 0.00 174.62 172.68 2jj1 s GLN 330 N -3.89 2.90 -1.24 3.99 -1.52 -1.26 -4.03 119.66 114.61 2jj1 s GLN 330 Ca 0.59 -1.11 -0.02 0.00 -1.95 0.00 0.00 55.36 52.87 2jj1 s GLN 330 Cb -0.10 -3.91 0.00 0.00 -0.22 0.00 0.00 33.01 28.78 2jj1 s GLN 330 CO 0.28 -0.79 1.01 0.00 -0.25 0.00 0.00 175.29 175.55 2jj1 n ALA 331 N 5.10 -1.88 -2.22 6.09 0.00 -1.26 -3.13 120.51 123.21 2jj1 n ALA 331 Ca -0.11 0.02 -0.19 0.00 0.00 0.00 0.00 53.44 53.16 2jj1 n ALA 331 Cb 0.46 -2.99 -0.02 0.00 0.00 0.00 0.00 19.45 16.89 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 -1.33 0.01 3.36 0.00 0.00 -1.26 -4.92 105.19 101.05 2jj1 n GLY 332 Ca -0.23 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.33 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 -2.16 6.51 0.00 1.61 2.15 -1.18 -4.87 116.67 118.72 2jj1 s ASP 333 Ca 0.00 -2.11 0.27 0.00 0.43 0.00 0.00 52.55 51.13 2jj1 s ASP 333 Cb 0.00 -2.27 1.30 0.00 -0.30 0.00 0.00 42.92 41.65 2jj1 s ASP 333 CO 0.00 -0.85 1.90 1.33 -0.17 0.00 0.00 175.17 177.38 2jj1 n VAL 334 N 4.86 0.15 1.23 1.11 0.24 -1.26 -3.57 118.33 121.07 2jj1 n VAL 334 Ca 0.06 0.04 0.13 0.00 -2.04 0.00 0.00 64.34 62.52 2jj1 n VAL 334 Cb 0.45 -0.59 0.39 0.00 -1.47 0.00 0.00 33.84 32.62 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 -1.33 0.86 -4.74 -1.34 7.64 -1.26 -3.87 113.62 109.57 2jj1 n SER 335 Ca 0.11 -0.73 -0.30 0.00 1.01 0.00 0.00 58.87 58.96 2jj1 n SER 335 Cb 0.23 0.11 0.12 0.00 -1.01 0.00 0.00 64.21 63.67 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 -2.58 1.79 0.13 -0.43 0.00 -1.23 -4.77 121.76 114.66 2jj1 s ALA 336 Ca 0.23 -0.02 -0.30 0.00 0.00 0.00 0.00 51.96 51.87 2jj1 s ALA 336 Cb 0.19 -3.20 -0.07 0.00 0.00 0.00 0.00 23.12 20.04 2jj1 s ALA 336 CO 0.54 -2.14 1.58 -0.92 0.00 0.00 0.00 175.76 174.81 2jj1 h TYR 337 N -1.40 -1.27 -0.09 0.00 -0.00 -1.94 -2.15 116.97 110.12 2jj1 h TYR 337 Ca -0.48 0.05 -0.08 0.00 -0.00 0.00 0.00 58.73 58.22 2jj1 h TYR 337 Cb 1.27 0.57 0.00 0.00 -0.00 0.00 0.00 36.73 38.57 2jj1 h TYR 337 CO 0.46 -0.50 -0.25 0.82 -0.00 0.00 0.00 178.16 178.69 2jj1 h ILE 338 N -0.54 1.40 -0.60 1.81 1.08 -1.96 -1.66 117.51 117.04 2jj1 h ILE 338 Ca 0.06 -1.58 0.12 0.00 -0.39 0.00 0.00 64.86 63.07 2jj1 h ILE 338 Cb 0.65 2.19 -0.11 0.00 -3.07 0.00 0.00 36.82 36.48 2jj1 h ILE 338 CO -0.38 0.46 -0.15 -0.65 -0.69 0.00 0.00 178.15 176.73 2jj1 h PRO 339 N -0.13 -0.01 -0.10 2.37 0.11 -1.85 -2.48 132.00 129.91 2jj1 h PRO 339 Ca -0.01 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.96 2jj1 h PRO 339 Cb 0.86 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.96 2jj1 h PRO 339 CO 0.05 -0.00 -0.59 1.79 -0.21 0.00 0.00 178.00 179.04 2jj1 h THR 340 N -0.01 1.37 -0.02 -1.15 1.35 -1.31 -1.84 112.91 111.30 2jj1 h THR 340 Ca 0.29 -1.92 0.03 0.00 -0.55 0.00 0.00 66.41 64.26 2jj1 h THR 340 Cb 0.44 1.94 -0.05 0.00 -1.73 0.00 0.00 68.15 68.74 2jj1 h THR 340 CO -0.62 0.57 -0.36 0.78 -0.25 0.00 0.00 175.52 175.65 2jj1 h ASN 341 N 0.24 -1.09 -0.44 5.36 2.35 -1.03 -0.72 115.58 120.26 2jj1 h ASN 341 Ca -0.00 0.14 -0.10 0.00 -0.55 0.00 0.00 56.30 55.79 2jj1 h ASN 341 Cb 1.10 0.43 -0.02 0.00 0.05 0.00 0.00 38.32 39.88 2jj1 h ASN 341 CO 0.10 -0.41 -0.09 0.58 -1.65 0.00 0.00 177.43 175.95 2jj1 h VAL 342 N -0.50 1.26 -0.30 2.81 2.07 -1.32 -1.26 116.25 119.02 2jj1 h VAL 342 Ca 0.06 -1.20 0.02 0.00 0.82 0.00 0.00 66.70 66.40 2jj1 h VAL 342 Cb 0.60 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 31.33 2jj1 h VAL 342 CO -0.30 0.42 0.20 0.40 0.02 0.00 0.00 177.57 178.31 2jj1 h ILE 343 N 0.81 1.03 0.00 4.57 2.04 -1.27 -0.02 117.51 124.67 2jj1 h ILE 343 Ca 0.13 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.88 2jj1 h ILE 343 Cb 0.61 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 37.36 2jj1 h ILE 343 CO 0.04 0.06 0.00 -1.54 0.00 0.00 0.00 178.15 176.71 2jj1 n SER 344 N -4.49 0.00 -0.03 1.72 3.41 -0.28 -3.76 113.62 110.19 2jj1 n SER 344 Ca 0.02 -0.99 -0.05 0.00 -0.26 0.00 0.00 58.87 57.59 2jj1 n SER 344 Cb 0.12 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.05 2jj1 n SER 344 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2jj1 n ILE 345 N -0.87 0.29 -2.03 -1.33 5.41 -0.18 -5.05 119.36 115.59 2jj1 n ILE 345 Ca 0.14 -0.08 -0.28 0.00 1.00 0.00 0.00 62.75 63.53 2jj1 n ILE 345 Cb 0.06 -1.44 0.15 0.00 -0.71 0.00 0.00 39.64 37.70 2jj1 n ILE 345 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 2jj1 s THR 346 N -2.10 2.04 -0.81 1.39 -4.23 -0.30 -4.98 115.64 106.66 2jj1 s THR 346 Ca -0.07 -0.10 -0.01 0.00 -1.18 0.00 0.00 61.69 60.32 2jj1 s THR 346 Cb 0.03 -2.94 0.36 0.00 1.34 0.00 0.00 72.50 71.28 2jj1 s THR 346 CO 0.10 0.00 1.93 0.47 -0.54 0.00 0.00 174.62 176.57 2jj1 n ASP 347 N -3.48 7.23 0.00 3.99 8.00 0.21 -4.93 116.55 127.56 2jj1 n ASP 347 Ca 0.13 -3.83 0.00 0.00 0.71 0.00 0.00 54.79 51.80 2jj1 n ASP 347 Cb 0.60 -1.00 0.00 0.00 -0.02 0.00 0.00 41.12 40.70 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 -0.53 1.20 3.16 0.44 0.00 -1.26 -0.12 105.19 108.08 2jj1 n GLY 348 Ca 0.52 -2.16 -0.13 0.00 0.00 0.00 0.00 46.02 44.25 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 -1.42 0.37 -0.30 1.61 1.11 0.20 -2.18 119.66 119.06 2jj1 s GLN 349 Ca 0.00 0.26 -0.18 0.00 0.01 0.00 0.00 55.36 55.45 2jj1 s GLN 349 Cb 0.00 0.17 -0.02 0.00 -1.01 0.00 0.00 33.01 32.15 2jj1 s GLN 349 CO 0.00 -0.06 0.51 0.42 0.01 0.00 0.00 175.29 176.17 2jj1 s ILE 350 N -0.12 5.05 -0.20 1.08 1.01 0.61 -1.20 121.20 127.43 2jj1 s ILE 350 Ca -0.03 0.67 -0.09 0.00 0.00 0.00 0.00 60.65 61.20 2jj1 s ILE 350 Cb -0.03 -3.88 -0.05 0.00 0.01 0.00 0.00 42.46 38.52 2jj1 s ILE 350 CO 0.01 -0.03 0.11 0.12 0.00 0.00 0.00 174.94 175.15 2jj1 s PHE 351 N 2.35 3.37 -0.22 3.97 5.36 -1.26 -1.41 117.98 130.13 2jj1 s PHE 351 Ca 0.20 0.26 -0.03 0.00 -0.96 0.00 0.00 56.93 56.40 2jj1 s PHE 351 Cb -0.15 -2.15 -0.00 0.00 -0.34 0.00 0.00 43.02 40.38 2jj1 s PHE 351 CO 0.11 0.24 -0.05 -0.51 -1.46 0.00 0.00 175.22 173.55 2jj1 s LEU 352 N 0.40 2.89 -0.07 6.12 1.43 0.66 -1.00 118.68 129.11 2jj1 s LEU 352 Ca 0.07 -0.46 -0.16 0.00 -1.03 0.00 0.00 54.13 52.54 2jj1 s LEU 352 Cb -0.11 -1.72 -0.05 0.00 0.03 0.00 0.00 46.19 44.34 2jj1 s LEU 352 CO -0.01 -0.03 0.43 -1.61 0.23 0.00 0.00 176.35 175.36 2jj1 s GLU 353 N 1.45 4.18 0.20 1.70 2.02 -0.88 -4.14 118.70 123.23 2jj1 s GLU 353 Ca 0.05 0.40 -0.11 0.00 0.02 0.00 0.00 54.97 55.33 2jj1 s GLU 353 Cb -0.14 -3.35 0.13 0.00 0.10 0.00 0.00 34.13 30.87 2jj1 s GLU 353 CO -0.04 0.38 1.83 1.15 0.02 0.00 0.00 175.26 178.60 2jj1 h THR 354 N 4.31 1.21 -0.78 3.63 2.02 -1.94 -1.71 112.91 119.64 2jj1 h THR 354 Ca -0.45 -0.47 -0.01 0.00 0.77 0.00 0.00 66.41 66.24 2jj1 h THR 354 Cb 1.19 0.23 -0.04 0.00 -1.74 0.00 0.00 68.15 67.80 2jj1 h THR 354 CO 0.70 0.22 0.43 -0.08 0.37 0.00 0.00 175.52 177.16 2jj1 h GLU 355 N 0.97 1.08 -0.43 6.66 4.81 -1.98 0.11 114.58 125.80 2jj1 h GLU 355 Ca 0.25 -0.12 -0.08 0.00 -0.13 0.00 0.00 59.36 59.29 2jj1 h GLU 355 Cb -0.02 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.14 2jj1 h GLU 355 CO -0.05 0.79 -0.03 -0.07 -0.73 0.00 0.00 179.01 178.93 2jj1 h LEU 356 N 1.08 0.76 -0.72 1.64 3.38 -1.84 -2.63 115.31 116.98 2jj1 h LEU 356 Ca 0.27 -0.32 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 2jj1 h LEU 356 Cb 0.02 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 2jj1 h LEU 356 CO -0.05 0.90 0.34 0.15 0.09 0.00 0.00 178.44 179.88 2jj1 h PHE 357 N 0.61 1.04 0.56 1.13 3.57 -0.92 -1.09 116.94 121.83 2jj1 h PHE 357 Ca 0.12 -0.05 -0.02 0.00 3.53 0.00 0.00 57.97 61.55 2jj1 h PHE 357 Cb 0.53 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 38.94 2jj1 h PHE 357 CO 0.04 0.77 -0.38 -0.92 -2.23 0.00 0.00 178.31 175.59 2jj1 h TYR 358 N 1.01 -1.01 0.00 0.41 3.20 -0.68 -1.55 116.97 118.34 2jj1 h TYR 358 Ca 0.25 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.11 2jj1 h TYR 358 Cb 0.12 0.37 0.00 0.00 1.54 0.00 0.00 36.73 38.76 2jj1 h TYR 358 CO 0.01 -0.56 0.00 1.63 -1.64 0.00 0.00 178.16 177.60 2jj1 n LYS 359 N -5.51 0.01 -0.99 1.82 5.02 -1.00 -4.74 118.16 112.78 2jj1 n LYS 359 Ca -0.12 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.17 2jj1 n LYS 359 Cb 0.40 -1.25 0.00 0.00 -0.02 0.00 0.00 35.03 34.15 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 -0.74 0.82 3.61 0.72 0.00 -0.58 -4.98 105.19 104.04 2jj1 n GLY 360 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 -3.33 3.62 -0.09 -0.61 1.01 -0.43 -4.96 121.20 116.42 2jj1 s ILE 361 Ca 0.00 0.66 -0.05 0.00 0.00 0.00 0.00 60.65 61.27 2jj1 s ILE 361 Cb 0.00 -3.75 0.04 0.00 0.01 0.00 0.00 42.46 38.76 2jj1 s ILE 361 CO 0.00 -0.42 0.20 -0.13 0.00 0.00 0.00 174.94 174.60 2jj1 s ARG 362 N 5.16 0.17 0.30 2.79 0.52 -1.26 -3.05 118.95 123.57 2jj1 s ARG 362 Ca 0.74 0.44 -0.30 0.00 -0.52 0.00 0.00 55.73 56.09 2jj1 s ARG 362 Cb -0.22 -0.11 -0.11 0.00 0.52 0.00 0.00 34.95 35.03 2jj1 s ARG 362 CO 0.32 -0.15 1.49 -1.25 0.02 0.00 0.00 175.30 175.73 2jj1 s PRO 363 N 1.08 4.19 -1.25 3.54 0.04 -1.26 -0.87 135.00 140.48 2jj1 s PRO 363 Ca -0.08 2.44 -0.11 0.00 0.04 0.00 0.00 61.00 63.29 2jj1 s PRO 363 Cb -0.10 -3.05 -0.06 0.00 0.04 0.00 0.00 34.50 31.33 2jj1 s PRO 363 CO -0.06 -0.50 2.40 0.00 0.04 0.00 0.00 177.00 178.88 2jj1 n ALA 364 N 1.80 5.66 -2.61 8.56 0.00 -1.17 -4.92 120.51 127.83 2jj1 n ALA 364 Ca 0.06 -3.11 -0.41 0.00 0.00 0.00 0.00 53.44 49.97 2jj1 n ALA 364 Cb 0.39 -3.34 -0.06 0.00 0.00 0.00 0.00 19.45 16.44 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 3.18 4.95 -0.42 0.00 1.01 -1.26 -2.07 121.20 126.59 2jj1 s ILE 365 Ca 0.54 0.93 -0.29 0.00 0.00 0.00 0.00 60.65 61.83 2jj1 s ILE 365 Cb 0.14 -3.98 0.01 0.00 0.01 0.00 0.00 42.46 38.64 2jj1 s ILE 365 CO -0.03 -0.10 1.36 0.21 0.00 0.00 0.00 174.94 176.38 2jj1 s ASN 366 N 1.60 6.40 0.02 3.58 3.84 -0.17 -4.90 114.94 125.30 2jj1 s ASN 366 Ca 0.25 0.77 -0.23 0.00 0.21 0.00 0.00 52.86 53.87 2jj1 s ASN 366 Cb -0.15 -2.54 -0.17 0.00 -0.55 0.00 0.00 41.25 37.84 2jj1 s ASN 366 CO 0.11 -1.39 1.33 0.58 -2.79 0.00 0.00 177.10 174.93 2jj1 h VAL 367 N 6.41 1.35 -0.72 -5.21 2.07 -1.91 -2.80 116.25 115.44 2jj1 h VAL 367 Ca -0.27 -1.18 0.16 0.00 0.82 0.00 0.00 66.70 66.24 2jj1 h VAL 367 Cb 1.10 1.96 -0.11 0.00 -1.52 0.00 0.00 31.29 32.71 2jj1 h VAL 367 CO 1.09 0.33 0.12 1.23 0.02 0.00 0.00 177.57 180.36 2jj1 h GLY 368 N -0.22 0.94 -0.28 2.17 0.00 -1.99 -0.88 103.07 102.82 2jj1 h GLY 368 Ca 0.02 0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.36 2jj1 h GLY 368 CO 0.02 -0.22 -0.10 1.04 0.00 0.00 0.00 176.54 177.28 2jj1 n LEU 369 N -5.21 1.39 -4.81 3.11 4.77 -1.22 -4.85 117.00 110.18 2jj1 n LEU 369 Ca 0.13 -0.44 -0.37 0.00 -0.03 0.00 0.00 56.01 55.31 2jj1 n LEU 369 Cb 0.45 -0.04 -0.07 0.00 -2.33 0.00 0.00 43.42 41.43 2jj1 n LEU 369 CO 0.11 0.24 -0.09 -0.44 -1.33 0.00 0.00 177.39 175.88 2jj1 s SER 370 N -2.18 6.44 0.03 -1.43 0.01 -0.34 -4.66 113.70 111.58 2jj1 s SER 370 Ca 0.33 0.52 -0.02 0.00 1.31 0.00 0.00 55.95 58.09 2jj1 s SER 370 Cb 0.20 -2.13 -0.02 0.00 0.21 0.00 0.00 66.02 64.28 2jj1 s SER 370 CO 0.40 0.28 -0.00 0.68 0.41 0.00 0.00 173.24 175.01 2jj1 s VAL 371 N -0.43 0.15 -0.27 3.43 -7.23 -0.34 -4.92 120.40 110.78 2jj1 s VAL 371 Ca 0.16 -1.23 0.03 0.00 -1.81 0.00 0.00 61.98 59.12 2jj1 s VAL 371 Cb -0.13 -0.80 0.06 0.00 0.56 0.00 0.00 36.38 36.08 2jj1 s VAL 371 CO 0.05 -0.68 -0.09 -0.55 -0.31 0.00 0.00 175.10 173.52 2jj1 s SER 372 N -2.07 4.50 0.34 4.85 0.15 -1.26 0.62 113.70 120.83 2jj1 s SER 372 Ca -0.06 -1.49 0.26 0.00 0.70 0.00 0.00 55.95 55.36 2jj1 s SER 372 Cb -0.02 -1.56 1.17 0.00 -1.71 0.00 0.00 66.02 63.89 2jj1 s SER 372 CO -0.05 -0.22 1.78 0.03 1.20 0.00 0.00 173.24 175.99 2jj1 h ARG 373 N 7.76 0.00 0.00 5.44 3.08 -0.89 -3.33 114.38 126.44 2jj1 h ARG 373 Ca -0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.88 2jj1 h ARG 373 Cb 1.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.09 2jj1 h ARG 373 CO 0.47 0.00 0.00 1.33 -1.07 0.00 0.00 179.97 180.70 2jj1 n VAL 374 N -2.42 0.00 0.07 2.04 0.24 -1.26 -4.92 118.33 112.08 2jj1 n VAL 374 Ca 0.01 0.00 -0.04 0.00 -2.04 0.00 0.00 64.34 62.27 2jj1 n VAL 374 Cb 0.19 1.67 -0.08 0.00 -1.47 0.00 0.00 33.84 34.15 2jj1 n VAL 374 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2jj1 h GLY 375 N 0.00 0.00 -0.17 7.63 0.00 -1.69 -3.31 103.07 105.53 2jj1 h GLY 375 Ca 0.00 0.00 0.25 0.00 0.00 0.00 0.00 47.33 47.58 2jj1 h GLY 375 CO 0.00 0.00 0.60 0.23 0.00 0.00 0.00 176.54 177.37 2jj1 h SER 376 N 0.00 0.66 0.14 0.19 0.87 -1.82 0.36 113.55 113.95 2jj1 h SER 376 Ca -0.05 0.14 -0.03 0.00 -1.23 0.00 0.00 61.79 60.62 2jj1 h SER 376 Cb 1.68 0.04 -0.00 0.00 -0.44 0.00 0.00 62.40 63.67 2jj1 h SER 376 CO 0.10 0.09 -0.14 0.00 -0.53 0.00 0.00 176.83 176.35 2jj1 h ALA 377 N 1.74 1.76 -0.72 6.23 0.00 -1.89 -3.02 119.26 123.35 2jj1 h ALA 377 Ca 0.65 -0.13 -0.44 0.00 0.00 0.00 0.00 54.91 54.99 2jj1 h ALA 377 Cb 1.26 -0.02 -0.25 0.00 0.00 0.00 0.00 17.79 18.78 2jj1 h ALA 377 CO -0.48 0.17 0.20 0.00 0.00 0.00 0.00 179.25 179.14 2jj1 n ALA 378 N -2.51 5.23 -2.89 0.00 0.00 0.12 -4.80 120.51 115.67 2jj1 n ALA 378 Ca -0.03 -3.28 -0.34 0.00 0.00 0.00 0.00 53.44 49.79 2jj1 n ALA 378 Cb 0.21 -1.08 -0.11 0.00 0.00 0.00 0.00 19.45 18.46 2jj1 n ALA 378 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 2jj1 s GLN 379 N -3.46 3.66 0.53 0.00 0.74 -1.11 -3.26 119.66 116.76 2jj1 s GLN 379 Ca 0.53 -0.47 -0.21 0.00 0.05 0.00 0.00 55.36 55.27 2jj1 s GLN 379 Cb 0.45 -2.96 -0.08 0.00 1.10 0.00 0.00 33.01 31.52 2jj1 s GLN 379 CO 0.03 0.30 0.91 0.25 -0.55 0.00 0.00 175.29 176.23 2jj1 n THR 380 N 3.38 2.98 -0.34 -0.34 -2.24 -1.26 -4.77 114.28 111.70 2jj1 n THR 380 Ca -0.17 -0.50 0.02 0.00 -2.27 0.00 0.00 64.05 61.13 2jj1 n THR 380 Cb 0.52 -1.08 0.17 0.00 -2.10 0.00 0.00 70.33 67.84 2jj1 n THR 380 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 2jj1 h ARG 381 N 0.86 1.01 -0.76 -0.78 9.65 -1.92 -0.53 114.38 121.90 2jj1 h ARG 381 Ca -0.47 -0.06 0.05 0.00 -1.10 0.00 0.00 59.98 58.40 2jj1 h ARG 381 Cb 1.36 -0.23 -0.05 0.00 -1.39 0.00 0.00 29.97 29.66 2jj1 h ARG 381 CO 0.52 0.67 0.47 0.00 2.80 0.00 0.00 179.97 184.43 2jj1 h ALA 382 N 1.44 1.02 -0.15 2.80 0.00 -1.38 -0.34 119.26 122.66 2jj1 h ALA 382 Ca 0.41 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 55.18 2jj1 h ALA 382 Cb 0.22 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2jj1 h ALA 382 CO -0.19 0.22 -0.43 1.98 0.00 0.00 0.00 179.25 180.82 2jj1 h MET 383 N 0.88 0.56 -0.69 0.00 1.85 -1.74 -3.27 114.93 112.52 2jj1 h MET 383 Ca 0.32 -0.40 0.14 0.00 -0.61 0.00 0.00 59.70 59.15 2jj1 h MET 383 Cb 0.11 0.07 -0.04 0.00 0.43 0.00 0.00 31.60 32.16 2jj1 h MET 383 CO -0.15 1.02 0.47 0.87 -0.40 0.00 0.00 176.91 178.72 2jj1 h LYS 384 N 0.20 0.36 -0.02 0.39 1.57 -0.39 0.19 116.57 118.87 2jj1 h LYS 384 Ca -0.01 -0.02 -0.10 0.00 -1.87 0.00 0.00 60.65 58.65 2jj1 h LYS 384 Cb 1.05 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 33.27 2jj1 h LYS 384 CO 0.09 0.24 -0.45 1.96 -0.57 0.00 0.00 179.45 180.72 2jj1 h GLN 385 N 0.37 0.05 0.00 3.15 4.20 -1.13 -2.52 115.11 119.23 2jj1 h GLN 385 Ca 0.33 -0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.95 2jj1 h GLN 385 Cb 0.79 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.56 2jj1 h GLN 385 CO -0.09 0.49 -2.07 1.33 -0.67 0.00 0.00 178.83 177.82 2jj1 n VAL 386 N -4.00 0.27 0.03 -0.54 0.24 -0.88 -4.66 118.33 108.78 2jj1 n VAL 386 Ca -0.02 -0.57 -0.19 0.00 -2.04 0.00 0.00 64.34 61.52 2jj1 n VAL 386 Cb 0.48 -0.09 -0.14 0.00 -1.47 0.00 0.00 33.84 32.62 2jj1 n VAL 386 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2jj1 h ALA 387 N 1.81 -0.07 -0.87 2.33 0.00 -0.58 -2.90 119.26 118.99 2jj1 h ALA 387 Ca -0.10 -0.69 0.08 0.00 0.00 0.00 0.00 54.91 54.21 2jj1 h ALA 387 Cb 1.24 0.10 -0.07 0.00 0.00 0.00 0.00 17.79 19.06 2jj1 h ALA 387 CO 0.01 0.34 0.53 0.78 0.00 0.00 0.00 179.25 180.90 2jj1 h GLY 388 N -0.45 1.35 2.00 0.00 0.00 -1.68 0.22 103.07 104.51 2jj1 h GLY 388 Ca -0.13 -0.37 -0.10 0.00 0.00 0.00 0.00 47.33 46.74 2jj1 h GLY 388 CO 0.12 0.20 -0.47 -0.91 0.00 0.00 0.00 176.54 175.48 2jj1 h THR 389 N 0.91 0.97 -0.05 4.70 1.35 -1.82 -2.54 112.91 116.42 2jj1 h THR 389 Ca 0.41 -1.91 -0.06 0.00 -0.55 0.00 0.00 66.41 64.30 2jj1 h THR 389 Cb 0.30 2.16 0.00 0.00 -1.73 0.00 0.00 68.15 68.88 2jj1 h THR 389 CO -0.22 0.46 -0.20 -0.03 -0.25 0.00 0.00 175.52 175.29 2jj1 h MET 390 N 0.00 0.23 -0.64 4.72 -1.53 -1.06 -0.94 114.93 115.71 2jj1 h MET 390 Ca -0.00 -0.17 0.14 0.00 -3.44 0.00 0.00 59.70 56.22 2jj1 h MET 390 Cb 1.12 0.03 -0.11 0.00 -0.55 0.00 0.00 31.60 32.10 2jj1 h MET 390 CO 0.06 0.81 0.01 -0.22 0.14 0.00 0.00 176.91 177.71 2jj1 h LYS 391 N -0.31 0.12 -0.02 0.39 3.64 -0.64 -0.91 116.57 118.84 2jj1 h LYS 391 Ca -0.01 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2jj1 h LYS 391 Cb 0.83 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.62 2jj1 h LYS 391 CO 0.04 0.08 0.01 1.25 -2.27 0.00 0.00 179.45 178.56 2jj1 h LEU 392 N 0.13 0.03 -1.22 5.20 5.85 -1.40 0.51 115.31 124.41 2jj1 h LEU 392 Ca 0.34 -0.16 -0.08 0.00 0.84 0.00 0.00 57.88 58.82 2jj1 h LEU 392 Cb 0.56 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 2jj1 h LEU 392 CO -0.54 0.18 -0.36 -0.33 -0.34 0.00 0.00 178.44 177.05 2jj1 h GLU 393 N -0.13 0.00 0.00 1.25 5.08 -0.88 -1.59 114.58 118.31 2jj1 h GLU 393 Ca 0.01 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.25 2jj1 h GLU 393 Cb 0.16 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 2jj1 h GLU 393 CO -0.00 0.36 -0.55 -0.07 -1.00 0.00 0.00 179.01 177.75 2jj1 h LEU 394 N 0.00 0.00 -0.60 1.33 3.38 -1.08 -2.68 115.31 115.66 2jj1 h LEU 394 Ca -0.00 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 2jj1 h LEU 394 Cb 0.72 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 2jj1 h LEU 394 CO 0.05 0.55 -0.39 0.00 0.09 0.00 0.00 178.44 178.73 2jj1 h ALA 395 N 1.45 0.78 -0.21 1.53 0.00 0.02 -2.95 119.26 119.88 2jj1 h ALA 395 Ca -0.01 -0.44 -0.14 0.00 0.00 0.00 0.00 54.91 54.32 2jj1 h ALA 395 Cb 1.27 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 2jj1 h ALA 395 CO 0.07 0.65 -0.46 1.96 0.00 0.00 0.00 179.25 181.47 2jj1 h GLN 396 N 0.55 0.54 -0.03 0.00 4.20 -1.33 -3.30 115.11 115.74 2jj1 h GLN 396 Ca 0.05 -0.30 -0.22 0.00 0.06 0.00 0.00 58.65 58.24 2jj1 h GLN 396 Cb 0.92 0.02 0.01 0.00 0.30 0.00 0.00 27.48 28.72 2jj1 h GLN 396 CO 0.08 0.89 -0.90 -0.92 -0.67 0.00 0.00 178.83 177.31 2jj1 h TYR 397 N 0.43 0.72 -0.48 2.96 3.20 -1.45 -3.03 116.97 119.32 2jj1 h TYR 397 Ca 0.03 -0.37 -0.00 0.00 3.14 0.00 0.00 58.73 61.52 2jj1 h TYR 397 Cb 0.97 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 39.13 2jj1 h TYR 397 CO 0.04 1.18 0.29 0.00 -1.64 0.00 0.00 178.16 178.03 2jj1 h ARG 398 N 0.30 0.65 0.00 1.82 3.08 -1.63 -2.66 114.38 115.94 2jj1 h ARG 398 Ca -0.08 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.92 2jj1 h ARG 398 Cb 1.53 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 31.44 2jj1 h ARG 398 CO 0.16 0.46 0.00 0.93 -1.07 0.00 0.00 179.97 180.45 2jj1 h GLU 399 N 0.66 0.00 -0.91 0.04 4.39 -1.60 -3.30 114.58 113.86 2jj1 h GLU 399 Ca 0.17 0.00 -0.37 0.00 0.34 0.00 0.00 59.36 59.51 2jj1 h GLU 399 Cb -0.02 0.00 -0.40 0.00 -0.10 0.00 0.00 28.75 28.22 2jj1 h GLU 399 CO -0.03 0.00 -1.11 1.33 -1.16 0.00 0.00 179.01 178.04 2jj1 n VAL 400 N -2.85 1.29 -0.75 3.13 0.24 -1.01 -5.14 118.33 113.24 2jj1 n VAL 400 Ca -0.00 -3.29 -0.17 0.00 -2.04 0.00 0.00 64.34 58.83 2jj1 n VAL 400 Cb 0.19 0.52 -0.06 0.00 -1.47 0.00 0.00 33.84 33.03 2jj1 n VAL 400 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2jj1 n ALA 401 N -0.27 4.84 -1.22 2.33 0.00 -1.20 -4.92 120.51 120.07 2jj1 n ALA 401 Ca 0.14 -1.77 0.02 0.00 0.00 0.00 0.00 53.44 51.82 2jj1 n ALA 401 Cb 0.80 -2.73 0.03 0.00 0.00 0.00 0.00 19.45 17.55 2jj1 n ALA 401 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2jj1 n LEU 410 N 3.49 0.76 -4.92 0.00 4.77 -1.26 -5.15 117.00 114.70 2jj1 n LEU 410 Ca 0.40 -1.27 -0.22 0.00 -0.03 0.00 0.00 56.01 54.89 2jj1 n LEU 410 Cb 0.33 -0.08 -0.03 0.00 -2.33 0.00 0.00 43.42 41.31 2jj1 n LEU 410 CO 0.49 0.31 -0.09 1.51 -1.33 0.00 0.00 177.39 178.27 2jj1 s ASP 411 N -1.07 6.10 0.16 -1.43 3.84 -1.26 -5.02 116.67 117.99 2jj1 s ASP 411 Ca 0.06 0.01 -0.30 0.00 -0.00 0.00 0.00 52.55 52.32 2jj1 s ASP 411 Cb 0.05 -1.75 -0.05 0.00 -1.38 0.00 0.00 42.92 39.80 2jj1 s ASP 411 CO 0.01 -0.03 1.54 0.00 -0.00 0.00 0.00 175.17 176.69 2jj1 h ALA 412 N 1.48 -0.54 0.14 2.11 0.00 -2.07 -3.09 119.26 117.29 2jj1 h ALA 412 Ca -0.50 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 2jj1 h ALA 412 Cb 1.22 1.27 0.00 0.00 0.00 0.00 0.00 17.79 20.28 2jj1 h ALA 412 CO 0.62 -0.96 -0.07 0.00 0.00 0.00 0.00 179.25 178.85 2jj1 h ALA 413 N 0.43 -0.19 0.00 0.00 0.00 -2.01 -3.21 119.26 114.28 2jj1 h ALA 413 Ca 0.15 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2jj1 h ALA 413 Cb 0.48 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2jj1 h ALA 413 CO -0.84 -0.41 0.00 0.25 0.00 0.00 0.00 179.25 178.25 2jj1 n THR 414 N -5.00 0.66 0.03 0.00 -2.24 -1.20 -1.78 114.28 104.75 2jj1 n THR 414 Ca -0.09 0.16 -0.14 0.00 -2.27 0.00 0.00 64.05 61.72 2jj1 n THR 414 Cb 0.24 -0.84 -0.14 0.00 -2.10 0.00 0.00 70.33 67.49 2jj1 n THR 414 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 2jj1 h GLN 415 N 0.00 0.15 -0.22 -0.78 4.15 -1.61 -3.30 115.11 113.49 2jj1 h GLN 415 Ca 0.00 -0.25 -0.07 0.00 0.77 0.00 0.00 58.65 59.10 2jj1 h GLN 415 Cb 0.34 0.09 -0.01 0.00 0.21 0.00 0.00 27.48 28.11 2jj1 h GLN 415 CO 0.00 0.92 -0.15 0.37 -1.93 0.00 0.00 178.83 178.04 2jj1 h GLN 416 N 0.04 0.37 0.00 1.69 5.75 -1.35 0.13 115.11 121.74 2jj1 h GLN 416 Ca -0.26 -0.10 -0.07 0.00 -0.15 0.00 0.00 58.65 58.06 2jj1 h GLN 416 Cb 1.99 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 30.49 2jj1 h GLN 416 CO 0.12 0.52 -0.33 -0.07 -2.65 0.00 0.00 178.83 176.42 2jj1 h LEU 417 N 0.34 0.00 0.05 -2.39 3.38 -1.67 0.34 115.31 115.36 2jj1 h LEU 417 Ca 0.06 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 2jj1 h LEU 417 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 2jj1 h LEU 417 CO 0.03 0.33 -0.03 -0.07 0.09 0.00 0.00 178.44 178.79 2jj1 h LEU 418 N 0.00 -0.06 -0.30 1.67 3.38 -1.48 -1.39 115.31 117.13 2jj1 h LEU 418 Ca -0.00 -0.46 0.07 0.00 0.09 0.00 0.00 57.88 57.58 2jj1 h LEU 418 Cb 0.92 0.02 -0.07 0.00 0.09 0.00 0.00 40.66 41.61 2jj1 h LEU 418 CO 0.04 0.44 -0.21 0.28 0.09 0.00 0.00 178.44 179.08 2jj1 h SER 419 N -0.58 -0.70 -0.28 -0.43 0.02 -0.40 -2.13 113.55 109.04 2jj1 h SER 419 Ca -0.01 0.14 -0.03 0.00 -0.84 0.00 0.00 61.79 61.05 2jj1 h SER 419 Cb 0.51 0.35 -0.01 0.00 0.14 0.00 0.00 62.40 63.39 2jj1 h SER 419 CO 0.01 -0.25 0.06 -0.09 -1.14 0.00 0.00 176.83 175.42 2jj1 h ARG 420 N -0.19 0.46 0.03 3.45 9.65 -0.46 -3.31 114.38 124.01 2jj1 h ARG 420 Ca 0.16 -0.12 0.02 0.00 -1.10 0.00 0.00 59.98 58.94 2jj1 h ARG 420 Cb 0.43 -0.06 -0.03 0.00 -1.39 0.00 0.00 29.97 28.93 2jj1 h ARG 420 CO -0.41 0.55 -0.16 0.78 2.80 0.00 0.00 179.97 183.53 2jj1 h GLY 421 N 0.28 -0.23 0.75 2.80 0.00 -0.74 -1.34 103.07 104.59 2jj1 h GLY 421 Ca 0.09 0.19 0.08 0.00 0.00 0.00 0.00 47.33 47.68 2jj1 h GLY 421 CO 0.00 -0.15 0.60 -0.39 0.00 0.00 0.00 176.54 176.60 2jj1 h VAL 422 N -0.28 1.03 -0.20 4.60 -1.51 -1.54 -1.59 116.25 116.76 2jj1 h VAL 422 Ca 0.04 -0.35 -0.13 0.00 -1.23 0.00 0.00 66.70 65.03 2jj1 h VAL 422 Cb 0.33 -0.08 0.00 0.00 -2.13 0.00 0.00 31.29 29.41 2jj1 h VAL 422 CO -0.13 0.19 -0.39 0.03 -1.23 0.00 0.00 177.57 176.04 2jj1 h ARG 423 N 1.02 0.62 -0.65 5.19 3.08 -1.51 -1.16 114.38 120.97 2jj1 h ARG 423 Ca 0.42 -0.40 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 2jj1 h ARG 423 Cb 0.28 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.35 2jj1 h ARG 423 CO -0.17 1.01 0.36 -0.07 -1.07 0.00 0.00 179.97 180.02 2jj1 h LEU 424 N 0.30 0.80 -1.01 3.04 3.38 -1.12 -1.21 115.31 119.49 2jj1 h LEU 424 Ca 0.01 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 2jj1 h LEU 424 Cb 0.99 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.49 2jj1 h LEU 424 CO 0.09 0.64 0.46 0.74 0.09 0.00 0.00 178.44 180.45 2jj1 h THR 425 N 0.91 1.24 -0.14 0.22 2.02 -0.90 -1.73 112.91 114.52 2jj1 h THR 425 Ca 0.23 -0.60 -0.11 0.00 0.77 0.00 0.00 66.41 66.70 2jj1 h THR 425 Cb 0.02 0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 66.54 2jj1 h THR 425 CO -0.04 0.27 -0.39 -0.33 0.37 0.00 0.00 175.52 175.40 2jj1 h GLU 426 N 1.16 0.31 0.00 6.66 4.39 -0.59 -3.04 114.58 123.47 2jj1 h GLU 426 Ca 0.29 -0.14 -0.05 0.00 0.34 0.00 0.00 59.36 59.80 2jj1 h GLU 426 Cb 0.02 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.66 2jj1 h GLU 426 CO -0.05 0.66 -0.23 -0.07 -1.16 0.00 0.00 179.01 178.16 2jj1 h LEU 427 N 0.26 0.00 0.00 1.33 3.38 -0.38 -2.87 115.31 117.04 2jj1 h LEU 427 Ca 0.03 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 2jj1 h LEU 427 Cb 0.81 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.56 2jj1 h LEU 427 CO 0.06 0.23 -0.39 -0.07 0.09 0.00 0.00 178.44 178.36 2jj1 h LEU 428 N 0.00 0.00 -9.69 1.67 3.38 -1.29 -3.45 115.31 105.92 2jj1 h LEU 428 Ca -0.00 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.41 2jj1 h LEU 428 Cb 0.47 0.00 0.19 0.00 0.09 0.00 0.00 40.66 41.41 2jj1 h LEU 428 CO 0.03 0.13 -0.37 0.29 0.09 0.00 0.00 178.44 178.61 2jj1 n LYS 429 N -3.03 0.26 -3.65 1.13 5.02 -1.08 -4.40 118.16 112.41 2jj1 n LYS 429 Ca 0.02 0.13 -0.04 0.00 -2.02 0.00 0.00 58.31 56.40 2jj1 n LYS 429 Cb 0.59 -1.87 -0.07 0.00 -0.02 0.00 0.00 35.03 33.67 2jj1 n LYS 429 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 2jj1 s GLN 430 N -2.90 0.21 0.14 1.97 0.74 -0.05 -4.89 119.66 114.88 2jj1 s GLN 430 Ca 0.65 0.27 -0.02 0.00 0.05 0.00 0.00 55.36 56.31 2jj1 s GLN 430 Cb -0.33 0.09 0.03 0.00 1.10 0.00 0.00 33.01 33.90 2jj1 s GLN 430 CO 0.58 -0.03 0.16 0.41 -0.55 0.00 0.00 175.29 175.86 2jj1 n GLY 431 N 2.22 -1.82 3.89 2.59 0.00 -1.26 -4.03 105.19 106.77 2jj1 n GLY 431 Ca -0.13 -1.57 -0.24 0.00 0.00 0.00 0.00 46.02 44.09 2jj1 n GLY 431 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jj1 s GLN 432 N -3.35 3.19 -0.33 1.61 -0.21 -1.26 -4.55 119.66 114.75 2jj1 s GLN 432 Ca 0.10 -0.81 0.00 0.00 0.02 0.00 0.00 55.36 54.67 2jj1 s GLN 432 Cb -0.01 -2.78 0.00 0.00 1.00 0.00 0.00 33.01 31.23 2jj1 s GLN 432 CO 0.07 0.46 0.00 0.66 -2.12 0.00 0.00 175.29 174.36 2jj1 n TYR 433 N -0.84 0.00 -3.28 0.91 0.53 -1.26 -4.89 117.16 108.34 2jj1 n TYR 433 Ca -0.08 0.00 -0.25 0.00 -1.02 0.00 0.00 57.90 56.55 2jj1 n TYR 433 Cb 0.56 -1.50 -0.07 0.00 -1.03 0.00 0.00 39.34 37.30 2jj1 n TYR 433 CO 0.00 0.00 0.00 0.43 -1.02 0.00 0.00 176.86 176.27 2jj1 n SER 434 N -0.49 2.46 -4.80 7.72 7.64 -1.26 -5.11 113.62 119.78 2jj1 n SER 434 Ca -0.03 -3.19 -0.32 0.00 1.01 0.00 0.00 58.87 56.33 2jj1 n SER 434 Cb 0.34 -0.64 0.03 0.00 -1.01 0.00 0.00 64.21 62.92 2jj1 n SER 434 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 2jj1 s PRO 435 N -2.16 3.09 -0.08 1.43 0.02 -1.26 -4.93 135.00 131.11 2jj1 s PRO 435 Ca 0.39 1.17 0.03 0.00 0.02 0.00 0.00 61.00 62.61 2jj1 s PRO 435 Cb 0.18 -2.00 -0.02 0.00 0.02 0.00 0.00 34.50 32.68 2jj1 s PRO 435 CO -0.06 -0.99 -0.16 -1.64 -0.33 0.00 0.00 177.00 173.81 2jj1 s MET 436 N -4.35 2.87 0.47 5.54 -1.94 0.62 -5.00 119.30 117.51 2jj1 s MET 436 Ca 0.63 -0.74 -0.23 0.00 -1.71 0.00 0.00 55.69 53.64 2jj1 s MET 436 Cb -0.16 -2.43 -0.09 0.00 2.01 0.00 0.00 34.83 34.16 2jj1 s MET 436 CO 0.43 0.40 1.06 0.00 -0.01 0.00 0.00 175.02 176.90 2jj1 n ALA 437 N 2.94 0.44 -0.30 3.03 0.00 -1.26 -4.29 120.51 121.07 2jj1 n ALA 437 Ca -0.18 0.17 0.03 0.00 0.00 0.00 0.00 53.44 53.47 2jj1 n ALA 437 Cb 0.52 -2.13 0.23 0.00 0.00 0.00 0.00 19.45 18.07 2jj1 n ALA 437 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 2jj1 h ILE 438 N 1.37 1.09 -0.08 0.00 6.09 -1.99 -1.13 117.51 122.86 2jj1 h ILE 438 Ca -0.46 -0.36 -0.10 0.00 -1.37 0.00 0.00 64.86 62.57 2jj1 h ILE 438 Cb 1.33 -0.05 -0.01 0.00 0.47 0.00 0.00 36.82 38.56 2jj1 h ILE 438 CO 0.56 0.19 -0.39 1.05 -3.07 0.00 0.00 178.15 176.49 2jj1 h GLU 439 N 1.05 0.17 -0.33 2.19 9.09 -1.90 -2.09 114.58 122.75 2jj1 h GLU 439 Ca 0.38 -0.08 -0.15 0.00 0.05 0.00 0.00 59.36 59.56 2jj1 h GLU 439 Cb 0.15 -0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.24 2jj1 h GLU 439 CO -0.13 0.54 -0.38 0.93 0.05 0.00 0.00 179.01 180.02 2jj1 h GLU 440 N 0.15 0.84 -0.58 1.06 5.08 -1.60 -2.61 114.58 116.91 2jj1 h GLU 440 Ca 0.01 -0.46 0.01 0.00 -1.00 0.00 0.00 59.36 57.92 2jj1 h GLU 440 Cb 0.76 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.01 2jj1 h GLU 440 CO 0.06 1.10 0.39 1.96 -1.00 0.00 0.00 179.01 181.52 2jj1 h GLN 441 N 0.62 0.77 -0.31 2.33 4.20 -0.96 -2.80 115.11 118.97 2jj1 h GLN 441 Ca 0.05 -0.05 -0.18 0.00 0.06 0.00 0.00 58.65 58.53 2jj1 h GLN 441 Cb 0.97 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 28.58 2jj1 h GLN 441 CO 0.09 0.51 -0.52 -0.39 -0.67 0.00 0.00 178.83 177.85 2jj1 h VAL 442 N 0.79 1.27 -0.75 -0.54 -1.51 -1.34 -1.25 116.25 112.93 2jj1 h VAL 442 Ca 0.21 -1.70 0.06 0.00 -1.23 0.00 0.00 66.70 64.05 2jj1 h VAL 442 Cb -0.09 1.58 -0.06 0.00 -2.13 0.00 0.00 31.29 30.59 2jj1 h VAL 442 CO -0.05 0.56 0.43 0.00 -1.23 0.00 0.00 177.57 177.29 2jj1 h ALA 443 N 0.70 1.02 -0.05 5.19 0.00 -1.47 0.88 119.26 125.53 2jj1 h ALA 443 Ca 0.02 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2jj1 h ALA 443 Cb 1.13 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 2jj1 h ALA 443 CO 0.12 0.13 0.02 0.28 0.00 0.00 0.00 179.25 179.79 2jj1 h VAL 444 N 0.79 1.16 -0.17 0.00 2.07 -1.30 -2.46 116.25 116.35 2jj1 h VAL 444 Ca 0.33 -0.49 -0.07 0.00 0.82 0.00 0.00 66.70 67.29 2jj1 h VAL 444 Cb 0.20 1.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 2jj1 h VAL 444 CO -0.19 0.13 -0.22 0.40 0.02 0.00 0.00 177.57 177.71 2jj1 h ILE 445 N -0.11 1.23 0.01 4.57 2.04 -0.80 -2.94 117.51 121.51 2jj1 h ILE 445 Ca 0.02 -1.09 0.03 0.00 1.00 0.00 0.00 64.86 64.82 2jj1 h ILE 445 Cb 0.20 1.36 -0.05 0.00 -0.74 0.00 0.00 36.82 37.59 2jj1 h ILE 445 CO -0.00 0.34 -0.29 0.22 0.00 0.00 0.00 178.15 178.42 2jj1 h TYR 446 N 0.27 -0.79 -0.94 1.37 3.20 0.99 0.16 116.97 121.23 2jj1 h TYR 446 Ca 0.05 0.03 0.14 0.00 3.14 0.00 0.00 58.73 62.09 2jj1 h TYR 446 Cb 0.55 0.35 -0.15 0.00 1.54 0.00 0.00 36.73 39.02 2jj1 h TYR 446 CO 0.01 -0.38 -0.39 0.00 -1.64 0.00 0.00 178.16 175.75 2jj1 h ALA 447 N 0.33 0.10 0.85 1.82 0.00 -1.27 -0.38 119.26 120.71 2jj1 h ALA 447 Ca 0.06 0.25 -0.04 0.00 0.00 0.00 0.00 54.91 55.18 2jj1 h ALA 447 Cb 0.52 1.00 0.01 0.00 0.00 0.00 0.00 17.79 19.33 2jj1 h ALA 447 CO -0.24 -0.65 -0.41 0.78 0.00 0.00 0.00 179.25 178.73 2jj1 h GLY 448 N -0.02 -1.18 2.00 0.00 0.00 -1.19 -2.77 103.07 99.90 2jj1 h GLY 448 Ca 0.32 0.44 0.00 0.00 0.00 0.00 0.00 47.33 48.09 2jj1 h GLY 448 CO -0.95 -0.43 0.00 3.33 0.00 0.00 0.00 176.54 178.49 2jj1 n VAL 449 N -5.16 0.95 -1.02 4.60 0.24 0.47 -1.75 118.33 116.66 2jj1 n VAL 449 Ca -0.14 0.30 -0.03 0.00 -2.04 0.00 0.00 64.34 62.43 2jj1 n VAL 449 Cb 0.45 -1.20 0.33 0.00 -1.47 0.00 0.00 33.84 31.95 2jj1 n VAL 449 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2jj1 n ARG 450 N -2.02 3.99 -0.16 7.34 5.12 -0.17 -4.96 116.66 125.81 2jj1 n ARG 450 Ca 0.02 -3.12 0.00 0.00 -1.93 0.00 0.00 57.85 52.82 2jj1 n ARG 450 Cb 0.18 -2.23 0.00 0.00 -1.16 0.00 0.00 32.46 29.25 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 0.01 1.89 0.29 -0.13 0.00 -0.72 -4.84 105.19 101.69 2jj1 n GLY 451 Ca 0.38 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.59 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 0.00 1.61 -1.99 -1.69 -1.80 116.97 113.10 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 0.00 -1.03 1.28 -0.00 0.00 0.00 178.16 178.41 2jj1 n LEU 453 N -2.80 0.72 -0.33 3.88 4.77 -1.25 -4.43 117.00 117.56 2jj1 n LEU 453 Ca -0.02 0.23 0.13 0.00 -0.03 0.00 0.00 56.01 56.32 2jj1 n LEU 453 Cb 0.11 -0.08 0.35 0.00 -2.33 0.00 0.00 43.42 41.48 2jj1 n LEU 453 CO 0.16 -0.12 1.21 0.44 -1.33 0.00 0.00 177.39 177.75 2jj1 h ASP 454 N 0.00 0.72 1.44 -1.43 3.32 -1.66 -2.09 116.42 116.72 2jj1 h ASP 454 Ca 0.00 0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.13 2jj1 h ASP 454 Cb 0.92 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.41 2jj1 h ASP 454 CO 0.00 0.29 0.00 0.11 -1.72 0.00 0.00 179.24 177.92 2jj1 h LYS 455 N 0.72 0.00 -6.88 3.56 1.57 -1.78 -3.46 116.57 110.30 2jj1 h LYS 455 Ca 0.54 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 58.85 2jj1 h LYS 455 Cb 0.89 0.00 0.04 0.00 0.08 0.00 0.00 32.23 33.24 2jj1 h LYS 455 CO -0.31 0.00 0.04 -0.51 -0.57 0.00 0.00 179.45 178.09 2jj1 s LEU 456 N -6.16 3.52 0.18 2.94 1.43 -0.79 -5.08 118.68 114.72 2jj1 s LEU 456 Ca 0.04 0.58 -0.21 0.00 -1.03 0.00 0.00 54.13 53.51 2jj1 s LEU 456 Cb 0.07 -3.45 -0.08 0.00 0.03 0.00 0.00 46.19 42.76 2jj1 s LEU 456 CO 0.60 -0.78 0.70 -1.61 0.23 0.00 0.00 176.35 175.49 2jj1 s GLU 457 N -4.73 4.31 0.34 1.70 2.02 -1.26 -4.99 118.70 116.09 2jj1 s GLU 457 Ca 0.50 0.90 0.12 0.00 0.02 0.00 0.00 54.97 56.51 2jj1 s GLU 457 Cb -0.10 -3.03 0.96 0.00 0.10 0.00 0.00 34.13 32.05 2jj1 s GLU 457 CO 0.42 0.48 1.74 -1.35 0.02 0.00 0.00 175.26 176.57 2jj1 h PRO 458 N 3.82 0.50 0.00 0.39 0.11 -1.97 0.24 132.00 135.10 2jj1 h PRO 458 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2jj1 h PRO 458 Cb 1.20 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2jj1 h PRO 458 CO 0.65 0.33 0.00 -1.13 -0.21 0.00 0.00 178.00 177.64 2jj1 n SER 459 N -4.82 0.00 -0.03 -2.05 3.41 -1.26 -3.01 113.62 105.86 2jj1 n SER 459 Ca 0.27 -1.14 0.02 0.00 -0.26 0.00 0.00 58.87 57.75 2jj1 n SER 459 Cb 0.80 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.74 2jj1 n SER 459 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2jj1 n LYS 460 N -0.80 4.46 -0.02 4.33 5.02 0.07 -4.74 118.16 126.48 2jj1 n LYS 460 Ca 0.12 -0.17 -0.11 0.00 -2.02 0.00 0.00 58.31 56.14 2jj1 n LYS 460 Cb 0.05 -0.74 -0.05 0.00 -0.02 0.00 0.00 35.03 34.27 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 0.16 1.07 -0.57 -0.18 1.08 -1.55 0.20 117.51 117.71 2jj1 h ILE 461 Ca 0.00 -0.19 0.11 0.00 -0.39 0.00 0.00 64.86 64.39 2jj1 h ILE 461 Cb 0.09 0.94 -0.09 0.00 -3.07 0.00 0.00 36.82 34.69 2jj1 h ILE 461 CO 0.00 0.07 0.03 0.74 -0.69 0.00 0.00 178.15 178.29 2jj1 h THR 462 N 0.16 0.56 -0.70 -0.27 2.02 -1.84 0.16 112.91 113.00 2jj1 h THR 462 Ca 0.05 -0.05 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 2jj1 h THR 462 Cb 0.04 0.41 -0.03 0.00 -1.74 0.00 0.00 68.15 66.82 2jj1 h THR 462 CO -0.01 0.03 0.38 0.50 0.37 0.00 0.00 175.52 176.79 2jj1 h LYS 463 N 0.14 0.97 -0.51 6.66 3.64 -1.64 -2.50 116.57 123.34 2jj1 h LYS 463 Ca 0.30 -0.12 -0.09 0.00 -1.27 0.00 0.00 60.65 59.47 2jj1 h LYS 463 Cb 0.46 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 2jj1 h LYS 463 CO -0.46 0.73 -0.04 0.35 -2.27 0.00 0.00 179.45 177.75 2jj1 h PHE 464 N 0.96 0.98 -0.50 1.91 3.57 -0.01 -2.63 116.94 121.22 2jj1 h PHE 464 Ca 0.24 -0.17 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 2jj1 h PHE 464 Cb 0.04 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 38.50 2jj1 h PHE 464 CO -0.00 0.91 0.29 1.49 -2.23 0.00 0.00 178.31 178.76 2jj1 h GLU 465 N 0.82 0.68 -0.01 1.11 4.81 -0.28 0.87 114.58 122.59 2jj1 h GLU 465 Ca 0.15 -0.07 -0.26 0.00 -0.13 0.00 0.00 59.36 59.05 2jj1 h GLU 465 Cb 0.55 -0.14 0.02 0.00 0.63 0.00 0.00 28.75 29.81 2jj1 h GLU 465 CO 0.03 0.51 -0.99 -0.91 -0.73 0.00 0.00 179.01 176.92 2jj1 h ASN 466 N 0.66 0.89 -0.83 1.04 -0.26 -1.46 0.39 115.58 116.01 2jj1 h ASN 466 Ca 0.18 -0.73 -0.00 0.00 -0.56 0.00 0.00 56.30 55.18 2jj1 h ASN 466 Cb 0.02 -0.27 -0.04 0.00 -1.06 0.00 0.00 38.32 36.96 2jj1 h ASN 466 CO -0.03 1.51 0.50 0.00 -1.06 0.00 0.00 177.43 178.34 2jj1 h ALA 467 N 0.40 1.06 -0.06 -0.83 0.00 -1.42 -2.18 119.26 116.23 2jj1 h ALA 467 Ca -0.12 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.57 2jj1 h ALA 467 Cb 1.65 -0.33 0.01 0.00 0.00 0.00 0.00 17.79 19.11 2jj1 h ALA 467 CO 0.20 0.52 -0.44 0.35 0.00 0.00 0.00 179.25 179.88 2jj1 h PHE 468 N 1.14 0.56 -0.56 0.00 3.57 -0.81 -2.69 116.94 118.15 2jj1 h PHE 468 Ca 0.30 -0.26 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 2jj1 h PHE 468 Cb -0.04 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.59 2jj1 h PHE 468 CO -0.00 1.03 0.23 1.25 -2.23 0.00 0.00 178.31 178.59 2jj1 h LEU 469 N -0.07 0.77 -0.53 0.59 5.85 -0.90 -2.27 115.31 118.75 2jj1 h LEU 469 Ca -0.04 -0.17 -0.09 0.00 0.84 0.00 0.00 57.88 58.43 2jj1 h LEU 469 Cb 1.11 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.92 2jj1 h LEU 469 CO 0.09 0.73 -0.43 0.77 -0.34 0.00 0.00 178.44 179.26 2jj1 h SER 470 N 0.77 0.00 -0.17 1.25 4.64 -1.50 -2.53 113.55 116.01 2jj1 h SER 470 Ca 0.19 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.47 2jj1 h SER 470 Cb 0.20 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.28 2jj1 h SER 470 CO -0.02 0.43 -0.02 -0.74 -0.87 0.00 0.00 176.83 175.61 2jj1 h HIS 471 N 0.00 0.35 0.00 4.77 -0.00 -1.25 -2.46 115.15 116.57 2jj1 h HIS 471 Ca -0.00 -0.07 -0.11 0.00 -0.00 0.00 0.00 60.37 60.19 2jj1 h HIS 471 Cb 1.11 -0.09 -0.02 0.00 -0.00 0.00 0.00 27.41 28.42 2jj1 h HIS 471 CO 0.00 0.56 -0.51 -0.39 -0.00 0.00 0.00 177.93 177.58 2jj1 h VAL 472 N 0.04 1.24 -0.29 5.26 -1.51 -1.40 -0.85 116.25 118.74 2jj1 h VAL 472 Ca 0.05 -1.84 -0.12 0.00 -1.23 0.00 0.00 66.70 63.56 2jj1 h VAL 472 Cb 0.43 2.03 -0.01 0.00 -2.13 0.00 0.00 31.29 31.61 2jj1 h VAL 472 CO 0.01 0.50 -0.31 0.40 -1.23 0.00 0.00 177.57 176.95 2jj1 h ILE 473 N 0.00 1.28 0.00 7.19 2.04 -1.44 -0.60 117.51 125.98 2jj1 h ILE 473 Ca -0.01 -1.42 -0.18 0.00 1.00 0.00 0.00 64.86 64.26 2jj1 h ILE 473 Cb 0.99 1.40 -0.03 0.00 -0.74 0.00 0.00 36.82 38.43 2jj1 h ILE 473 CO 0.07 0.45 -1.43 -1.28 0.00 0.00 0.00 178.15 175.96 2jj1 h SER 474 N 0.51 0.00 0.00 1.72 0.87 -1.22 -3.40 113.55 112.04 2jj1 h SER 474 Ca 0.06 0.00 -0.17 0.00 -1.23 0.00 0.00 61.79 60.45 2jj1 h SER 474 Cb 0.79 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.72 2jj1 h SER 474 CO 0.06 0.63 -1.65 0.00 -0.53 0.00 0.00 176.83 175.34 2jj1 n GLN 475 N -2.92 0.79 -2.35 2.24 1.13 -0.34 -4.80 117.38 111.14 2jj1 n GLN 475 Ca -0.10 0.05 -0.29 0.00 -1.94 0.00 0.00 57.00 54.72 2jj1 n GLN 475 Cb 0.86 -1.23 0.01 0.00 0.11 0.00 0.00 30.24 29.99 2jj1 n GLN 475 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 2jj1 n HIS 476 N -2.73 3.30 -0.36 1.08 8.25 -0.24 -4.80 115.22 119.73 2jj1 n HIS 476 Ca -0.19 -2.93 -0.00 0.00 -0.26 0.00 0.00 57.72 54.33 2jj1 n HIS 476 Cb 0.74 -0.29 0.14 0.00 1.12 0.00 0.00 29.99 31.70 2jj1 n HIS 476 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 2jj1 h GLN 477 N 2.61 1.24 -0.74 -0.41 1.08 -1.76 -3.01 115.11 114.12 2jj1 h GLN 477 Ca 0.35 -0.07 0.12 0.00 -1.45 0.00 0.00 58.65 57.60 2jj1 h GLN 477 Cb 0.82 -0.28 -0.09 0.00 -0.05 0.00 0.00 27.48 27.89 2jj1 h GLN 477 CO 0.95 0.82 0.33 0.00 -0.95 0.00 0.00 178.83 179.98 2jj1 h ALA 478 N 1.41 1.05 -0.07 3.87 0.00 -1.91 -0.91 119.26 122.70 2jj1 h ALA 478 Ca 0.38 0.09 -0.14 0.00 0.00 0.00 0.00 54.91 55.24 2jj1 h ALA 478 Cb -0.05 0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.78 2jj1 h ALA 478 CO -0.11 -0.14 -0.52 1.25 0.00 0.00 0.00 179.25 179.73 2jj1 h LEU 479 N 0.52 0.58 -0.63 0.00 7.12 -1.93 -1.88 115.31 119.09 2jj1 h LEU 479 Ca 0.39 -0.68 -0.00 0.00 0.13 0.00 0.00 57.88 57.73 2jj1 h LEU 479 Cb 0.53 -0.17 -0.03 0.00 -0.53 0.00 0.00 40.66 40.46 2jj1 h LEU 479 CO -0.35 1.17 0.39 -0.07 -0.13 0.00 0.00 178.44 179.45 2jj1 h LEU 480 N 0.03 0.75 -0.10 2.25 3.38 -1.44 -0.48 115.31 119.71 2jj1 h LEU 480 Ca -0.05 -0.05 0.01 0.00 0.09 0.00 0.00 57.88 57.88 2jj1 h LEU 480 Cb 1.19 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.74 2jj1 h LEU 480 CO 0.11 0.57 0.04 -1.28 0.09 0.00 0.00 178.44 177.97 2jj1 h SER 481 N 0.86 0.06 -0.85 -0.43 0.87 -1.21 -1.15 113.55 111.70 2jj1 h SER 481 Ca 0.23 0.01 0.06 0.00 -1.23 0.00 0.00 61.79 60.85 2jj1 h SER 481 Cb -0.05 -0.01 -0.05 0.00 -0.44 0.00 0.00 62.40 61.85 2jj1 h SER 481 CO -0.05 0.05 0.55 0.50 -0.53 0.00 0.00 176.83 177.36 2jj1 h LYS 482 N 0.10 0.93 -0.27 2.24 1.63 -0.96 0.41 116.57 120.65 2jj1 h LYS 482 Ca 0.04 -0.06 -0.08 0.00 -0.85 0.00 0.00 60.65 59.71 2jj1 h LYS 482 Cb 0.01 -0.21 -0.01 0.00 -0.60 0.00 0.00 32.23 31.42 2jj1 h LYS 482 CO -0.03 0.62 -0.14 0.82 -3.45 0.00 0.00 179.45 177.27 2jj1 h ILE 483 N 0.96 1.30 -0.55 2.00 2.04 -0.88 0.17 117.51 122.55 2jj1 h ILE 483 Ca 0.36 -1.23 0.00 0.00 1.00 0.00 0.00 64.86 65.00 2jj1 h ILE 483 Cb 0.19 1.53 -0.03 0.00 -0.74 0.00 0.00 36.82 37.77 2jj1 h ILE 483 CO -0.13 0.39 0.36 -0.09 0.00 0.00 0.00 178.15 178.68 2jj1 h ARG 484 N 0.29 0.73 -0.26 2.37 2.43 -0.31 0.14 114.38 119.77 2jj1 h ARG 484 Ca 0.06 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.10 2jj1 h ARG 484 Cb 0.65 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 2jj1 h ARG 484 CO 0.04 0.49 -0.15 1.15 -1.51 0.00 0.00 179.97 179.99 2jj1 h THR 485 N 0.74 1.30 0.00 0.20 2.02 -0.15 -3.10 112.91 113.92 2jj1 h THR 485 Ca 0.20 -1.26 0.00 0.00 0.77 0.00 0.00 66.41 66.12 2jj1 h THR 485 Cb -0.07 1.56 0.00 0.00 -1.74 0.00 0.00 68.15 67.90 2jj1 h THR 485 CO -0.04 0.39 -0.07 0.47 0.37 0.00 0.00 175.52 176.64 2jj1 n ASP 486 N -4.43 0.64 -1.25 4.18 8.00 0.58 -4.92 116.55 119.35 2jj1 n ASP 486 Ca -0.04 0.50 -0.16 0.00 0.71 0.00 0.00 54.79 55.80 2jj1 n ASP 486 Cb 0.37 -0.62 -0.07 0.00 -0.02 0.00 0.00 41.12 40.78 2jj1 n ASP 486 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jj1 n GLY 487 N 1.35 1.52 3.28 0.44 0.00 0.03 -4.89 105.19 106.92 2jj1 n GLY 487 Ca 0.06 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.98 2jj1 n GLY 487 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2jj1 s LYS 488 N -3.34 1.01 -0.37 1.61 2.20 -1.20 -1.03 119.74 118.61 2jj1 s LYS 488 Ca 0.00 -0.98 -0.10 0.00 -0.36 0.00 0.00 55.97 54.53 2jj1 s LYS 488 Cb 0.00 0.38 0.03 0.00 -1.51 0.00 0.00 37.83 36.74 2jj1 s LYS 488 CO 0.00 -0.36 0.20 0.42 -0.36 0.00 0.00 175.35 175.25 2jj1 s ILE 489 N -3.89 4.43 0.73 5.43 1.01 -1.26 -4.55 121.20 123.11 2jj1 s ILE 489 Ca 0.09 -0.95 -0.11 0.00 0.00 0.00 0.00 60.65 59.67 2jj1 s ILE 489 Cb 0.04 -3.51 0.04 0.00 0.01 0.00 0.00 42.46 39.04 2jj1 s ILE 489 CO -0.07 -0.26 1.11 -0.94 0.00 0.00 0.00 174.94 174.78 2jj1 s SER 490 N 1.58 5.15 0.46 3.58 1.04 -1.26 -4.78 113.70 119.46 2jj1 s SER 490 Ca 0.01 0.98 0.19 0.00 0.48 0.00 0.00 55.95 57.61 2jj1 s SER 490 Cb -0.20 -1.69 1.10 0.00 0.10 0.00 0.00 66.02 65.33 2jj1 s SER 490 CO 0.06 -1.50 1.98 -0.08 0.98 0.00 0.00 173.24 174.68 2jj1 h GLU 491 N -0.75 0.00 0.17 4.02 4.81 -1.99 0.30 114.58 121.14 2jj1 h GLU 491 Ca -0.45 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.77 2jj1 h GLU 491 Cb 1.28 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.66 2jj1 h GLU 491 CO 0.64 0.20 -0.08 1.49 -0.73 0.00 0.00 179.01 180.53 2jj1 h GLU 492 N 0.00 -0.21 -0.77 1.92 4.81 -1.99 -2.97 114.58 115.37 2jj1 h GLU 492 Ca -0.00 0.01 0.15 0.00 -0.13 0.00 0.00 59.36 59.39 2jj1 h GLU 492 Cb 0.40 0.05 -0.10 0.00 0.63 0.00 0.00 28.75 29.73 2jj1 h GLU 492 CO 0.03 0.21 0.30 0.77 -0.73 0.00 0.00 179.01 179.59 2jj1 h SER 493 N -0.82 0.27 0.38 1.04 0.02 -1.71 0.46 113.55 113.19 2jj1 h SER 493 Ca -0.02 0.12 -0.02 0.00 -0.84 0.00 0.00 61.79 61.03 2jj1 h SER 493 Cb 0.53 0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.17 2jj1 h SER 493 CO 0.04 0.08 -0.18 -0.78 -1.14 0.00 0.00 176.83 174.85 2jj1 h ASP 494 N 0.43 -0.43 -0.40 3.07 3.58 -0.55 0.36 116.42 122.48 2jj1 h ASP 494 Ca 0.43 -0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.86 2jj1 h ASP 494 Cb 0.68 0.11 -0.02 0.00 1.72 0.00 0.00 39.33 41.82 2jj1 h ASP 494 CO -0.43 -0.28 0.22 0.00 -2.88 0.00 0.00 179.24 175.88 2jj1 h ALA 495 N 0.07 1.59 -0.30 -0.78 0.00 -1.18 0.15 119.26 118.83 2jj1 h ALA 495 Ca -0.05 -0.08 -0.17 0.00 0.00 0.00 0.00 54.91 54.61 2jj1 h ALA 495 Cb 0.41 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 2jj1 h ALA 495 CO 0.08 0.34 -0.50 -0.22 0.00 0.00 0.00 179.25 178.96 2jj1 h LYS 496 N 0.59 0.83 0.00 0.00 1.63 0.15 -2.93 116.57 116.84 2jj1 h LYS 496 Ca 0.15 -0.49 0.00 0.00 -0.85 0.00 0.00 60.65 59.46 2jj1 h LYS 496 Cb 0.03 0.04 0.00 0.00 -0.60 0.00 0.00 32.23 31.71 2jj1 h LYS 496 CO -0.02 1.13 0.00 -0.11 -3.45 0.00 0.00 179.45 176.99 2jj1 n LEU 497 N -4.01 0.66 0.05 5.20 7.94 0.13 -2.57 117.00 124.39 2jj1 n LEU 497 Ca -0.03 0.61 -0.13 0.00 -1.11 0.00 0.00 56.01 55.34 2jj1 n LEU 497 Cb 0.60 -0.46 -0.03 0.00 0.53 0.00 0.00 43.42 44.06 2jj1 n LEU 497 CO 0.49 -0.35 0.23 0.50 -1.11 0.00 0.00 177.39 177.15 2jj1 h LYS 498 N 0.00 0.46 0.45 1.96 3.64 -0.56 -3.18 116.57 119.34 2jj1 h LYS 498 Ca 0.00 -0.45 -0.02 0.00 -1.27 0.00 0.00 60.65 58.91 2jj1 h LYS 498 Cb 0.52 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.47 2jj1 h LYS 498 CO 0.00 1.09 -0.22 0.93 -2.27 0.00 0.00 179.45 178.99 2jj1 h GLU 499 N 0.28 -0.58 -0.91 1.90 4.39 -1.39 -3.03 114.58 115.23 2jj1 h GLU 499 Ca -0.07 0.04 0.16 0.00 0.34 0.00 0.00 59.36 59.83 2jj1 h GLU 499 Cb 1.49 0.13 -0.10 0.00 -0.10 0.00 0.00 28.75 30.18 2jj1 h GLU 499 CO 0.15 -0.28 0.51 0.82 -1.16 0.00 0.00 179.01 179.06 2jj1 h ILE 500 N -0.89 0.74 -0.05 3.13 2.04 -1.61 -0.38 117.51 120.48 2jj1 h ILE 500 Ca -0.06 -0.24 -0.05 0.00 1.00 0.00 0.00 64.86 65.51 2jj1 h ILE 500 Cb 0.57 -0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.63 2jj1 h ILE 500 CO 0.10 0.13 -0.16 0.58 0.00 0.00 0.00 178.15 178.80 2jj1 h VAL 501 N 0.70 1.44 -0.58 1.67 2.07 -1.64 -2.39 116.25 117.52 2jj1 h VAL 501 Ca 0.50 -1.56 -0.00 0.00 0.82 0.00 0.00 66.70 66.47 2jj1 h VAL 501 Cb 0.72 2.33 -0.03 0.00 -1.52 0.00 0.00 31.29 32.79 2jj1 h VAL 501 CO -0.36 0.43 0.36 0.74 0.02 0.00 0.00 177.57 178.76 2jj1 h THR 502 N -0.32 1.17 -0.79 2.57 2.02 -1.33 0.80 112.91 117.02 2jj1 h THR 502 Ca -0.01 -0.36 0.01 0.00 0.77 0.00 0.00 66.41 66.82 2jj1 h THR 502 Cb 0.78 0.37 -0.04 0.00 -1.74 0.00 0.00 68.15 67.52 2jj1 h THR 502 CO 0.03 0.17 0.52 0.78 0.37 0.00 0.00 175.52 177.39 2jj1 h ASN 503 N 0.78 0.91 0.09 4.18 -0.26 -1.14 -2.71 115.58 117.43 2jj1 h ASN 503 Ca 0.21 -0.03 -0.12 0.00 -0.56 0.00 0.00 56.30 55.80 2jj1 h ASN 503 Cb -0.03 -0.23 0.01 0.00 -1.06 0.00 0.00 38.32 37.01 2jj1 h ASN 503 CO -0.04 0.67 -0.53 0.15 -1.06 0.00 0.00 177.43 176.61 2jj1 h PHE 504 N 1.08 0.36 -0.76 1.19 3.57 -0.95 -3.26 116.94 118.16 2jj1 h PHE 504 Ca 0.29 -0.26 0.00 0.00 3.53 0.00 0.00 57.97 61.53 2jj1 h PHE 504 Cb -0.11 -0.02 -0.04 0.00 2.79 0.00 0.00 35.95 38.57 2jj1 h PHE 504 CO 0.00 1.20 0.48 1.25 -2.23 0.00 0.00 178.31 179.01 2jj1 h LEU 505 N -0.57 0.90 -1.34 0.59 5.85 -0.86 0.14 115.31 120.01 2jj1 h LEU 505 Ca -0.09 -0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.53 2jj1 h LEU 505 Cb 1.41 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.21 2jj1 h LEU 505 CO 0.10 0.67 -0.25 0.00 -0.34 0.00 0.00 178.44 178.62 2jj1 h ALA 506 N 1.48 1.15 -0.11 1.25 0.00 -1.62 -3.07 119.26 118.34 2jj1 h ALA 506 Ca 0.28 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2jj1 h ALA 506 Cb -0.07 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2jj1 h ALA 506 CO -0.06 0.32 0.00 0.41 0.00 0.00 0.00 179.25 179.92 2jj1 n GLY 507 N -0.18 0.90 3.69 0.00 0.00 -0.54 -4.93 105.19 104.14 2jj1 n GLY 507 Ca -0.01 -0.60 -0.42 0.00 0.00 0.00 0.00 46.02 44.99 2jj1 n GLY 507 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2jj1 s PHE 508 N -1.61 3.53 -0.88 1.61 5.36 0.38 -5.06 117.98 121.31 2jj1 s PHE 508 Ca 0.26 1.50 0.07 0.00 -0.96 0.00 0.00 56.93 57.81 2jj1 s PHE 508 Cb 0.18 -3.09 0.06 0.00 -0.34 0.00 0.00 43.02 39.83 2jj1 s PHE 508 CO 0.26 -0.14 0.72 0.39 -1.46 0.00 0.00 175.22 174.99