#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jj1 s LEU 17 N 0.00 4.42 -0.23 1.39 2.96 -1.26 -5.05 118.68 120.91 2jj1 s LEU 17 Ca 0.00 0.80 -0.29 0.00 -0.22 0.00 0.00 54.13 54.41 2jj1 s LEU 17 Cb 0.00 -2.46 -0.02 0.00 0.50 0.00 0.00 46.19 44.21 2jj1 s LEU 17 CO 0.00 0.30 1.48 -0.83 -1.32 0.00 0.00 176.35 175.97 2jj1 s GLY 18 N -0.77 1.34 0.50 7.98 0.00 -1.26 -4.98 107.32 110.14 2jj1 s GLY 18 Ca 0.21 0.38 -0.22 0.00 0.00 0.00 0.00 44.72 45.09 2jj1 s GLY 18 CO 0.10 2.81 1.15 0.00 0.00 0.00 0.00 173.10 177.16 2jj1 n ALA 19 N 7.88 0.80 -2.37 3.20 0.00 -1.26 -4.92 120.51 123.85 2jj1 n ALA 19 Ca 0.17 0.15 -0.43 0.00 0.00 0.00 0.00 53.44 53.33 2jj1 n ALA 19 Cb 0.45 -2.20 -0.02 0.00 0.00 0.00 0.00 19.45 17.68 2jj1 n ALA 19 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2jj1 s ASP 20 N -0.88 6.37 -0.01 0.00 -1.08 -1.26 -4.87 116.67 114.94 2jj1 s ASP 20 Ca 0.68 0.82 0.16 0.00 -0.52 0.00 0.00 52.55 53.69 2jj1 s ASP 20 Cb -0.47 -2.54 0.46 0.00 -1.46 0.00 0.00 42.92 38.91 2jj1 s ASP 20 CO 0.52 -1.41 1.38 0.35 0.52 0.00 0.00 175.17 176.54 2jj1 n THR 21 N 7.02 1.06 0.33 1.71 -2.24 -1.26 -4.61 114.28 116.28 2jj1 n THR 21 Ca 0.16 -1.03 0.04 0.00 -2.27 0.00 0.00 64.05 60.96 2jj1 n THR 21 Cb 0.48 0.47 0.20 0.00 -2.10 0.00 0.00 70.33 69.38 2jj1 n THR 21 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2jj1 n SER 22 N 0.95 0.00 -0.17 3.42 3.41 -1.26 -3.06 113.62 116.91 2jj1 n SER 22 Ca 0.17 0.45 0.06 0.00 -0.26 0.00 0.00 58.87 59.29 2jj1 n SER 22 Cb 0.53 -0.47 0.09 0.00 -0.26 0.00 0.00 64.21 64.10 2jj1 n SER 22 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2jj1 n VAL 23 N -1.47 1.28 -1.43 -3.33 0.31 -1.26 -4.94 118.33 107.50 2jj1 n VAL 23 Ca 0.02 -1.53 -0.39 0.00 -0.01 0.00 0.00 64.34 62.44 2jj1 n VAL 23 Cb 0.10 0.04 0.03 0.00 -0.91 0.00 0.00 33.84 33.10 2jj1 n VAL 23 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 2jj1 n ASP 24 N -0.96 -1.51 -0.01 4.52 5.75 -1.17 -4.78 116.55 118.38 2jj1 n ASP 24 Ca 0.10 0.74 0.00 0.00 -0.01 0.00 0.00 54.79 55.62 2jj1 n ASP 24 Cb 0.62 -1.11 0.00 0.00 -1.03 0.00 0.00 41.12 39.61 2jj1 n ASP 24 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2jj1 n LEU 25 N 0.96 0.03 -0.08 -2.12 4.77 -1.26 -3.06 117.00 116.23 2jj1 n LEU 25 Ca 0.11 -0.01 -0.21 0.00 -0.03 0.00 0.00 56.01 55.87 2jj1 n LEU 25 Cb 0.47 -0.01 -0.12 0.00 -2.33 0.00 0.00 43.42 41.42 2jj1 n LEU 25 CO 0.52 0.01 -1.09 -0.62 -1.33 0.00 0.00 177.39 174.88 2jj1 n GLU 26 N -0.49 0.68 0.00 3.23 1.02 -1.26 -1.54 120.64 122.28 2jj1 n GLU 26 Ca 0.00 0.24 0.09 0.00 -0.02 0.00 0.00 57.16 57.47 2jj1 n GLU 26 Cb 0.01 -1.61 0.03 0.00 -0.02 0.00 0.00 31.44 29.85 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 -3.55 1.60 -4.21 3.49 -0.58 -1.23 -0.93 120.64 115.22 2jj1 n GLU 27 Ca -0.40 -1.19 -0.17 0.00 -0.42 0.00 0.00 57.16 54.97 2jj1 n GLU 27 Cb 0.97 -1.36 -0.07 0.00 -0.57 0.00 0.00 31.44 30.42 2jj1 n GLU 27 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 2jj1 s THR 28 N -1.92 0.00 0.32 2.62 -4.23 -1.17 -2.42 115.64 108.84 2jj1 s THR 28 Ca 0.18 -1.87 -0.09 0.00 -1.18 0.00 0.00 61.69 58.74 2jj1 s THR 28 Cb 0.15 -2.54 0.04 0.00 1.34 0.00 0.00 72.50 71.49 2jj1 s THR 28 CO 0.38 0.00 0.58 0.61 -0.54 0.00 0.00 174.62 175.65 2jj1 n GLY 29 N -0.58 1.50 2.87 3.99 0.00 -0.07 -0.99 105.19 111.92 2jj1 n GLY 29 Ca 0.05 -1.34 -0.18 0.00 0.00 0.00 0.00 46.02 44.56 2jj1 n GLY 29 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jj1 s ARG 30 N -2.27 0.54 -0.19 1.61 0.52 -0.21 -1.56 118.95 117.38 2jj1 s ARG 30 Ca 0.17 -0.04 -0.31 0.00 -0.52 0.00 0.00 55.73 55.03 2jj1 s ARG 30 Cb -0.03 -0.61 -0.08 0.00 0.52 0.00 0.00 34.95 34.75 2jj1 s ARG 30 CO 0.13 -0.07 2.14 0.28 0.02 0.00 0.00 175.30 177.79 2jj1 n VAL 31 N 3.88 0.41 0.04 3.52 0.31 -0.68 -1.58 118.33 124.23 2jj1 n VAL 31 Ca -0.24 -0.33 -0.20 0.00 -0.01 0.00 0.00 64.34 63.56 2jj1 n VAL 31 Cb 0.52 -2.26 -0.13 0.00 -0.91 0.00 0.00 33.84 31.06 2jj1 n VAL 31 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2jj1 h LEU 32 N 13.13 0.62 -7.36 7.52 3.38 -1.40 0.49 115.31 131.69 2jj1 h LEU 32 Ca -0.41 -0.83 -0.11 0.00 0.09 0.00 0.00 57.88 56.62 2jj1 h LEU 32 Cb 1.26 -0.20 -0.21 0.00 0.09 0.00 0.00 40.66 41.61 2jj1 h LEU 32 CO 0.97 1.39 -0.18 -0.94 0.09 0.00 0.00 178.44 179.77 2jj1 s SER 33 N -7.02 -0.34 -0.06 -0.43 1.04 -1.17 -4.76 113.70 100.96 2jj1 s SER 33 Ca -0.12 0.40 0.00 0.00 0.48 0.00 0.00 55.95 56.71 2jj1 s SER 33 Cb 0.03 0.50 0.02 0.00 0.10 0.00 0.00 66.02 66.68 2jj1 s SER 33 CO 0.86 -0.40 -0.03 -0.51 0.98 0.00 0.00 173.24 174.14 2jj1 s ILE 34 N -0.89 0.49 -0.17 -1.02 1.10 -1.26 -1.07 121.20 118.37 2jj1 s ILE 34 Ca -0.10 -0.03 -0.16 0.00 -0.51 0.00 0.00 60.65 59.86 2jj1 s ILE 34 Cb -0.04 -0.57 0.04 0.00 0.15 0.00 0.00 42.46 42.05 2jj1 s ILE 34 CO 0.04 0.24 0.45 -0.83 -2.11 0.00 0.00 174.94 172.74 2jj1 s GLY 35 N 1.36 -0.34 -1.82 1.50 0.00 -0.71 -4.97 107.32 102.33 2jj1 s GLY 35 Ca -0.04 1.28 -0.20 0.00 0.00 0.00 0.00 44.72 45.76 2jj1 s GLY 35 CO -0.02 1.11 0.54 1.22 0.00 0.00 0.00 173.10 175.95 2jj1 n ASP 36 N 2.85 -1.62 0.00 1.64 8.00 -1.26 0.52 116.55 126.68 2jj1 n ASP 36 Ca -0.13 -1.23 0.00 0.00 0.71 0.00 0.00 54.79 54.14 2jj1 n ASP 36 Cb 0.57 -1.74 0.00 0.00 -0.02 0.00 0.00 41.12 39.93 2jj1 n ASP 36 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jj1 n GLY 37 N -1.29 1.18 3.47 0.44 0.00 -1.26 -5.00 105.19 102.73 2jj1 n GLY 37 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 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 -3.59 4.95 -0.24 -0.61 -1.09 0.18 -0.98 121.20 119.83 2jj1 s ILE 38 Ca 0.00 -0.45 -0.09 0.00 -2.23 0.00 0.00 60.65 57.88 2jj1 s ILE 38 Cb 0.00 -3.61 -0.04 0.00 -1.58 0.00 0.00 42.46 37.23 2jj1 s ILE 38 CO 0.00 -0.07 0.12 0.00 -1.23 0.00 0.00 174.94 173.76 2jj1 s ALA 39 N 1.65 3.40 -0.07 9.38 0.00 0.22 -1.74 121.76 134.61 2jj1 s ALA 39 Ca 0.05 -1.00 -0.20 0.00 0.00 0.00 0.00 51.96 50.81 2jj1 s ALA 39 Cb -0.18 -2.21 -0.05 0.00 0.00 0.00 0.00 23.12 20.69 2jj1 s ALA 39 CO 0.08 -0.31 0.56 1.03 0.00 0.00 0.00 175.76 177.12 2jj1 s ARG 40 N 1.30 4.33 -0.13 0.00 1.81 -0.24 -0.82 118.95 125.20 2jj1 s ARG 40 Ca 0.06 0.62 0.00 0.00 -1.72 0.00 0.00 55.73 54.70 2jj1 s ARG 40 Cb -0.15 -3.40 0.02 0.00 -0.45 0.00 0.00 34.95 30.98 2jj1 s ARG 40 CO 0.05 0.23 -0.13 0.08 -0.68 0.00 0.00 175.30 174.86 2jj1 s VAL 41 N 0.31 1.40 0.39 3.52 1.01 -0.37 -0.96 120.40 125.71 2jj1 s VAL 41 Ca 0.30 -0.54 -0.26 0.00 0.00 0.00 0.00 61.98 61.48 2jj1 s VAL 41 Cb -0.17 -1.33 -0.09 0.00 0.00 0.00 0.00 36.38 34.80 2jj1 s VAL 41 CO 0.14 0.43 1.22 -2.28 0.00 0.00 0.00 175.10 174.61 2jj1 s HIS 42 N 1.43 3.00 0.00 5.22 2.46 -0.62 -0.80 115.29 125.98 2jj1 s HIS 42 Ca 0.02 1.50 0.00 0.00 0.47 0.00 0.00 55.06 57.05 2jj1 s HIS 42 Cb -0.13 -3.51 0.00 0.00 -0.13 0.00 0.00 32.58 28.81 2jj1 s HIS 42 CO -0.08 -1.60 0.00 0.41 -2.47 0.00 0.00 174.74 171.01 2jj1 n GLY 43 N 0.69 0.31 3.38 1.59 0.00 -1.26 -1.05 105.19 108.85 2jj1 n GLY 43 Ca 0.04 -1.06 -0.24 0.00 0.00 0.00 0.00 46.02 44.75 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 -2.85 -0.17 0.99 4.77 -0.16 -4.74 117.00 114.83 2jj1 n LEU 44 Ca 0.00 -0.45 0.28 0.00 -0.03 0.00 0.00 56.01 55.81 2jj1 n LEU 44 Cb 0.00 -2.89 0.72 0.00 -2.33 0.00 0.00 43.42 38.93 2jj1 n LEU 44 CO 0.00 0.42 1.26 0.03 -1.33 0.00 0.00 177.39 177.77 2jj1 h ARG 45 N -1.95 0.00 -0.64 3.23 2.47 -1.26 -0.28 114.38 115.94 2jj1 h ARG 45 Ca -0.55 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.17 2jj1 h ARG 45 Cb 1.36 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.68 2jj1 h ARG 45 CO 0.58 0.00 0.00 0.09 0.56 0.00 0.00 179.97 181.20 2jj1 n ASN 46 N -4.23 4.66 -4.72 7.04 3.02 -0.11 -4.98 115.26 115.95 2jj1 n ASN 46 Ca 0.18 -2.42 -0.34 0.00 -0.03 0.00 0.00 54.58 51.97 2jj1 n ASN 46 Cb 0.95 -0.56 0.10 0.00 -0.61 0.00 0.00 39.78 39.66 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 -1.79 2.29 0.13 2.41 -7.23 -0.12 -5.03 120.40 111.05 2jj1 s VAL 47 Ca 0.50 0.14 0.03 0.00 -1.81 0.00 0.00 61.98 60.84 2jj1 s VAL 47 Cb 0.32 -2.69 -0.04 0.00 0.56 0.00 0.00 36.38 34.53 2jj1 s VAL 47 CO 0.25 -0.08 0.16 -1.10 -0.31 0.00 0.00 175.10 174.03 2jj1 s GLN 48 N -3.95 3.09 0.22 4.82 -0.21 -1.26 -5.05 119.66 117.32 2jj1 s GLN 48 Ca 0.74 -0.71 -0.31 0.00 0.02 0.00 0.00 55.36 55.10 2jj1 s GLN 48 Cb -0.29 -2.79 -0.11 0.00 1.00 0.00 0.00 33.01 30.82 2jj1 s GLN 48 CO 0.46 0.53 1.58 0.00 -2.12 0.00 0.00 175.29 175.74 2jj1 s ALA 49 N -1.63 3.77 -0.30 6.09 0.00 -1.26 -1.84 121.76 126.59 2jj1 s ALA 49 Ca 0.32 1.45 0.00 0.00 0.00 0.00 0.00 51.96 53.73 2jj1 s ALA 49 Cb -0.11 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 19.38 2jj1 s ALA 49 CO 0.25 -0.85 0.00 0.39 0.00 0.00 0.00 175.76 175.55 2jj1 n GLU 50 N 3.19 -0.66 -2.41 0.00 1.02 0.11 -4.98 120.64 116.91 2jj1 n GLU 50 Ca 0.11 0.40 -0.40 0.00 -0.02 0.00 0.00 57.16 57.25 2jj1 n GLU 50 Cb 0.38 -4.05 -0.04 0.00 -0.02 0.00 0.00 31.44 27.71 2jj1 n GLU 50 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 2jj1 s GLU 51 N -1.45 4.56 0.01 3.49 2.12 -0.76 -2.43 118.70 124.24 2jj1 s GLU 51 Ca 0.00 1.86 -0.30 0.00 0.36 0.00 0.00 54.97 56.89 2jj1 s GLU 51 Cb 0.00 -3.13 -0.03 0.00 0.26 0.00 0.00 34.13 31.22 2jj1 s GLU 51 CO 0.00 0.12 0.98 1.41 -0.54 0.00 0.00 175.26 177.23 2jj1 s MET 52 N -1.56 4.57 0.34 4.30 -2.45 0.37 -1.14 119.30 123.73 2jj1 s MET 52 Ca 0.46 1.42 0.09 0.00 -1.25 0.00 0.00 55.69 56.41 2jj1 s MET 52 Cb -0.33 -3.46 -0.06 0.00 1.25 0.00 0.00 34.83 32.24 2jj1 s MET 52 CO 0.43 -0.04 -0.05 0.14 1.05 0.00 0.00 175.02 176.55 2jj1 s VAL 53 N 0.96 2.40 -0.11 10.11 -7.23 -0.17 -1.97 120.40 124.40 2jj1 s VAL 53 Ca 0.52 -2.10 0.02 0.00 -1.81 0.00 0.00 61.98 58.61 2jj1 s VAL 53 Cb -0.21 -2.72 0.01 0.00 0.56 0.00 0.00 36.38 34.02 2jj1 s VAL 53 CO 0.28 -0.20 -0.18 -1.61 -0.31 0.00 0.00 175.10 173.08 2jj1 s GLU 54 N -3.66 2.47 0.11 4.82 2.02 0.16 -1.09 118.70 123.53 2jj1 s GLU 54 Ca 0.34 -0.66 -0.15 0.00 0.02 0.00 0.00 54.97 54.52 2jj1 s GLU 54 Cb 0.01 -2.01 -0.07 0.00 0.10 0.00 0.00 34.13 32.17 2jj1 s GLU 54 CO 0.18 0.01 0.52 -0.06 0.02 0.00 0.00 175.26 175.93 2jj1 s PHE 55 N 0.78 3.65 0.60 1.61 0.40 -0.26 0.33 117.98 125.09 2jj1 s PHE 55 Ca -0.10 1.06 0.29 0.00 -0.60 0.00 0.00 56.93 57.58 2jj1 s PHE 55 Cb -0.16 -2.36 1.37 0.00 0.51 0.00 0.00 43.02 42.38 2jj1 s PHE 55 CO 0.01 0.49 1.76 0.66 0.70 0.00 0.00 175.22 178.85 2jj1 h SER 56 N 3.86 0.00 -0.20 1.36 4.64 -1.72 -0.42 113.55 121.07 2jj1 h SER 56 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 2jj1 h SER 56 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2jj1 h SER 56 CO 0.65 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 175.07 2jj1 n SER 57 N -3.58 1.08 0.00 4.97 3.41 -1.26 -4.89 113.62 113.35 2jj1 n SER 57 Ca 0.12 -1.98 0.00 0.00 -0.26 0.00 0.00 58.87 56.75 2jj1 n SER 57 Cb 0.86 -0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.68 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 0.83 1.12 3.76 5.00 0.00 -0.17 -5.05 105.19 110.68 2jj1 n GLY 58 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 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 4.51 0.12 0.99 1.43 -1.25 -4.90 118.68 119.59 2jj1 s LEU 59 Ca 0.00 2.40 0.02 0.00 -1.03 0.00 0.00 54.13 55.52 2jj1 s LEU 59 Cb 0.00 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.55 2jj1 s LEU 59 CO 0.00 -0.26 0.24 -0.54 0.23 0.00 0.00 176.35 176.02 2jj1 s LYS 60 N -1.53 3.38 0.29 1.70 1.02 -1.26 -1.10 119.74 122.23 2jj1 s LYS 60 Ca 0.46 -0.57 0.02 0.00 0.02 0.00 0.00 55.97 55.90 2jj1 s LYS 60 Cb -0.34 -2.96 -0.03 0.00 -0.52 0.00 0.00 37.83 33.98 2jj1 s LYS 60 CO 0.45 0.55 0.27 0.20 -0.92 0.00 0.00 175.35 175.90 2jj1 s GLY 61 N -2.96 1.81 -0.04 -3.33 0.00 -0.25 -1.85 107.32 100.69 2jj1 s GLY 61 Ca 0.34 -1.80 0.01 0.00 0.00 0.00 0.00 44.72 43.28 2jj1 s GLY 61 CO 0.28 -1.32 -0.04 -0.29 0.00 0.00 0.00 173.10 171.72 2jj1 s MET 62 N -3.64 0.82 -0.36 2.90 1.75 -0.77 -1.00 119.30 118.99 2jj1 s MET 62 Ca 0.37 -0.10 -0.29 0.00 -1.25 0.00 0.00 55.69 54.42 2jj1 s MET 62 Cb 0.03 -0.83 0.02 0.00 2.84 0.00 0.00 34.83 36.89 2jj1 s MET 62 CO 0.20 -0.08 1.10 -1.12 -0.65 0.00 0.00 175.02 174.47 2jj1 s SER 63 N 0.93 6.84 -0.04 1.11 0.01 -0.29 -1.30 113.70 120.95 2jj1 s SER 63 Ca -0.11 0.90 0.04 0.00 1.31 0.00 0.00 55.95 58.09 2jj1 s SER 63 Cb -0.14 -2.55 -0.05 0.00 0.21 0.00 0.00 66.02 63.49 2jj1 s SER 63 CO 0.00 -0.99 0.02 0.18 0.41 0.00 0.00 173.24 172.86 2jj1 n LEU 64 N 7.17 0.00 -4.21 2.44 4.77 0.01 0.06 117.00 127.23 2jj1 n LEU 64 Ca 0.12 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.76 2jj1 n LEU 64 Cb 0.48 0.10 -0.14 0.00 -2.33 0.00 0.00 43.42 41.52 2jj1 n LEU 64 CO 0.63 0.10 -0.42 0.20 -1.33 0.00 0.00 177.39 176.57 2jj1 s ASN 65 N -3.49 4.19 -0.43 -1.43 -0.87 -0.73 -4.88 114.94 107.30 2jj1 s ASN 65 Ca -0.02 -0.78 -0.11 0.00 -1.57 0.00 0.00 52.86 50.38 2jj1 s ASN 65 Cb 0.01 -1.65 0.07 0.00 -0.02 0.00 0.00 41.25 39.66 2jj1 s ASN 65 CO 0.18 -0.10 0.29 -0.76 -2.57 0.00 0.00 177.10 174.14 2jj1 s LEU 66 N 1.34 5.23 0.44 0.60 1.43 -1.26 0.13 118.68 126.59 2jj1 s LEU 66 Ca 0.01 -1.44 0.07 0.00 -1.03 0.00 0.00 54.13 51.75 2jj1 s LEU 66 Cb -0.16 -2.03 -0.02 0.00 0.03 0.00 0.00 46.19 44.01 2jj1 s LEU 66 CO -0.05 -0.55 0.31 -1.61 0.23 0.00 0.00 176.35 174.68 2jj1 s GLU 67 N 1.48 2.36 0.54 1.70 2.02 -0.17 -5.02 118.70 121.60 2jj1 s GLU 67 Ca 0.03 -1.75 0.20 0.00 0.02 0.00 0.00 54.97 53.46 2jj1 s GLU 67 Cb -0.23 -2.18 1.40 0.00 0.10 0.00 0.00 34.13 33.23 2jj1 s GLU 67 CO 0.03 -0.26 2.17 -1.35 0.02 0.00 0.00 175.26 175.87 2jj1 h PRO 68 N 1.11 0.00 0.00 0.39 0.11 -2.03 -3.28 132.00 128.30 2jj1 h PRO 68 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2jj1 h PRO 68 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2jj1 h PRO 68 CO 0.62 0.00 -0.15 -0.40 -0.21 0.00 0.00 178.00 177.85 2jj1 n ASP 69 N -4.37 0.77 -4.13 -2.05 5.75 -1.26 -5.08 116.55 106.18 2jj1 n ASP 69 Ca -0.03 -0.26 -0.09 0.00 -0.01 0.00 0.00 54.79 54.40 2jj1 n ASP 69 Cb 0.11 0.68 -0.10 0.00 -1.03 0.00 0.00 41.12 40.78 2jj1 n ASP 69 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2jj1 s ASN 70 N -0.84 0.75 -0.19 -1.12 2.20 -1.24 -4.50 114.94 110.01 2jj1 s ASN 70 Ca 0.00 -1.03 -0.02 0.00 -0.94 0.00 0.00 52.86 50.87 2jj1 s ASN 70 Cb 0.00 0.17 -0.00 0.00 -2.00 0.00 0.00 41.25 39.42 2jj1 s ASN 70 CO 0.00 -0.56 -0.11 -0.69 -2.94 0.00 0.00 177.10 172.80 2jj1 s VAL 71 N -3.81 2.91 -0.65 3.54 1.01 0.02 -1.00 120.40 122.41 2jj1 s VAL 71 Ca 0.12 -0.66 -0.27 0.00 0.00 0.00 0.00 61.98 61.16 2jj1 s VAL 71 Cb 0.07 -2.28 0.03 0.00 0.00 0.00 0.00 36.38 34.20 2jj1 s VAL 71 CO -0.06 0.47 1.21 -0.83 0.00 0.00 0.00 175.10 175.89 2jj1 s GLY 72 N 1.26 1.05 -0.13 4.51 0.00 0.34 -1.24 107.32 113.12 2jj1 s GLY 72 Ca 0.03 -1.11 -0.03 0.00 0.00 0.00 0.00 44.72 43.61 2jj1 s GLY 72 CO -0.05 2.53 -0.03 0.14 0.00 0.00 0.00 173.10 175.69 2jj1 s VAL 73 N 5.20 3.99 -0.19 1.40 1.01 -0.00 -0.81 120.40 130.99 2jj1 s VAL 73 Ca 0.38 -0.34 -0.10 0.00 0.00 0.00 0.00 61.98 61.93 2jj1 s VAL 73 Cb -0.08 -2.72 -0.05 0.00 0.00 0.00 0.00 36.38 33.53 2jj1 s VAL 73 CO 0.20 0.52 0.13 -0.69 0.00 0.00 0.00 175.10 175.27 2jj1 s VAL 74 N -0.00 5.42 -0.35 2.92 1.01 -0.42 -0.61 120.40 128.37 2jj1 s VAL 74 Ca 0.01 0.19 -0.19 0.00 0.00 0.00 0.00 61.98 61.99 2jj1 s VAL 74 Cb -0.13 -3.46 -0.00 0.00 0.00 0.00 0.00 36.38 32.79 2jj1 s VAL 74 CO 0.02 0.47 0.58 -0.69 0.00 0.00 0.00 175.10 175.48 2jj1 s VAL 75 N 0.14 4.95 0.00 2.92 1.01 -0.15 -1.85 120.40 127.42 2jj1 s VAL 75 Ca 0.09 0.48 -0.01 0.00 0.00 0.00 0.00 61.98 62.54 2jj1 s VAL 75 Cb -0.11 -4.02 -0.05 0.00 0.00 0.00 0.00 36.38 32.20 2jj1 s VAL 75 CO -0.01 -0.26 1.97 0.49 0.00 0.00 0.00 175.10 177.29 2jj1 n PHE 76 N 5.90 0.00 -3.23 5.22 0.99 -0.77 -4.65 117.46 120.91 2jj1 n PHE 76 Ca -0.03 -0.92 0.00 0.00 -0.00 0.00 0.00 57.45 56.50 2jj1 n PHE 76 Cb 0.49 -0.67 0.00 0.00 -1.00 0.00 0.00 39.48 38.30 2jj1 n PHE 76 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2jj1 n GLY 77 N 1.82 -0.72 3.71 1.37 0.00 -1.26 -4.72 105.19 105.39 2jj1 n GLY 77 Ca 0.08 -0.76 -0.42 0.00 0.00 0.00 0.00 46.02 44.92 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 6.70 0.02 1.61 3.84 -1.26 -4.77 114.94 117.08 2jj1 s ASN 78 Ca 0.00 2.44 0.28 0.00 0.21 0.00 0.00 52.86 55.79 2jj1 s ASN 78 Cb 0.00 -2.58 0.99 0.00 -0.55 0.00 0.00 41.25 39.10 2jj1 s ASN 78 CO 0.00 -0.76 1.77 -0.90 -2.79 0.00 0.00 177.10 174.42 2jj1 n ASP 79 N 4.33 0.22 0.11 -4.21 3.85 -1.26 -4.30 116.55 115.29 2jj1 n ASP 79 Ca 0.13 0.31 0.13 0.00 -0.71 0.00 0.00 54.79 54.65 2jj1 n ASP 79 Cb 0.41 -0.31 0.63 0.00 -1.35 0.00 0.00 41.12 40.49 2jj1 n ASP 79 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 177.20 176.26 2jj1 h LYS 80 N 0.00 0.08 0.00 0.11 2.10 -2.01 -1.67 116.57 115.18 2jj1 h LYS 80 Ca 0.00 -0.00 -0.14 0.00 -2.00 0.00 0.00 60.65 58.50 2jj1 h LYS 80 Cb 0.53 -0.02 -0.02 0.00 -0.90 0.00 0.00 32.23 31.82 2jj1 h LYS 80 CO 0.00 0.05 -0.67 -0.07 -2.00 0.00 0.00 179.45 176.76 2jj1 h LEU 81 N 0.08 0.00 -9.71 7.07 4.07 -2.01 -3.44 115.31 111.36 2jj1 h LEU 81 Ca 0.14 0.00 -0.52 0.00 0.08 0.00 0.00 57.88 57.58 2jj1 h LEU 81 Cb 0.44 0.00 0.02 0.00 1.08 0.00 0.00 40.66 42.20 2jj1 h LEU 81 CO -0.01 0.67 0.56 -0.63 -1.08 0.00 0.00 178.44 177.95 2jj1 s ILE 82 N -3.20 3.44 0.13 1.22 1.01 -0.63 -4.99 121.20 118.18 2jj1 s ILE 82 Ca 0.01 1.27 0.03 0.00 0.00 0.00 0.00 60.65 61.96 2jj1 s ILE 82 Cb 0.11 -3.81 -0.04 0.00 0.01 0.00 0.00 42.46 38.72 2jj1 s ILE 82 CO 0.76 0.23 -0.09 -0.54 0.00 0.00 0.00 174.94 175.31 2jj1 s LYS 83 N -0.61 0.97 0.19 2.79 1.02 -1.26 -4.95 119.74 117.88 2jj1 s LYS 83 Ca 0.51 -1.40 -0.33 0.00 0.02 0.00 0.00 55.97 54.77 2jj1 s LYS 83 Cb -0.34 -0.45 -0.15 0.00 -0.52 0.00 0.00 37.83 36.38 2jj1 s LYS 83 CO 0.39 0.04 1.36 -1.91 -0.92 0.00 0.00 175.35 174.31 2jj1 n GLU 84 N -0.13 1.70 -0.17 1.68 2.13 -1.26 -2.04 120.64 122.54 2jj1 n GLU 84 Ca -0.11 0.61 0.00 0.00 0.66 0.00 0.00 57.16 58.32 2jj1 n GLU 84 Cb 0.61 -2.24 0.00 0.00 0.27 0.00 0.00 31.44 30.08 2jj1 n GLU 84 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2jj1 n GLY 85 N 2.41 1.56 3.73 8.31 0.00 0.17 -4.95 105.19 116.41 2jj1 n GLY 85 Ca 0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 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 -3.17 4.48 0.14 1.61 -0.00 -0.86 -4.54 116.67 114.33 2jj1 s ASP 86 Ca 0.00 2.56 -0.24 0.00 -0.00 0.00 0.00 52.55 54.86 2jj1 s ASP 86 Cb 0.00 -2.61 -0.08 0.00 -0.00 0.00 0.00 42.92 40.23 2jj1 s ASP 86 CO 0.00 -2.08 0.74 -0.63 -0.00 0.00 0.00 175.17 173.20 2jj1 s ILE 87 N -1.55 4.46 -0.12 0.77 1.01 -1.26 -1.69 121.20 122.81 2jj1 s ILE 87 Ca 0.80 1.62 0.03 0.00 0.00 0.00 0.00 60.65 63.11 2jj1 s ILE 87 Cb -0.35 -4.10 0.01 0.00 0.01 0.00 0.00 42.46 38.02 2jj1 s ILE 87 CO 0.41 0.51 -0.21 -0.69 0.00 0.00 0.00 174.94 174.96 2jj1 s VAL 88 N -1.03 1.96 0.03 2.92 1.01 -0.60 -2.03 120.40 122.66 2jj1 s VAL 88 Ca 0.35 -0.93 0.04 0.00 0.00 0.00 0.00 61.98 61.43 2jj1 s VAL 88 Cb -0.22 -1.73 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 2jj1 s VAL 88 CO 0.25 0.53 -0.05 -0.54 0.00 0.00 0.00 175.10 175.29 2jj1 s LYS 89 N 0.69 2.55 0.29 2.72 1.02 0.15 -0.89 119.74 126.28 2jj1 s LYS 89 Ca -0.11 -0.75 -0.28 0.00 0.02 0.00 0.00 55.97 54.86 2jj1 s LYS 89 Cb -0.16 -2.52 -0.10 0.00 -0.52 0.00 0.00 37.83 34.54 2jj1 s LYS 89 CO 0.01 0.59 0.95 1.03 -0.92 0.00 0.00 175.35 177.01 2jj1 s ARG 90 N -1.66 4.68 0.00 1.68 0.52 -1.02 0.36 118.95 123.51 2jj1 s ARG 90 Ca 0.19 1.40 0.22 0.00 -0.52 0.00 0.00 55.73 57.02 2jj1 s ARG 90 Cb -0.11 -2.99 -0.10 0.00 0.52 0.00 0.00 34.95 32.27 2jj1 s ARG 90 CO 0.10 0.36 1.00 0.25 0.02 0.00 0.00 175.30 177.04 2jj1 n THR 91 N 0.91 0.00 -0.44 0.02 -2.24 -0.83 -4.86 114.28 106.84 2jj1 n THR 91 Ca 0.00 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 2jj1 n THR 91 Cb 0.49 1.05 0.00 0.00 -2.10 0.00 0.00 70.33 69.77 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 1.47 1.29 3.33 3.38 0.00 -1.26 -4.98 105.19 108.42 2jj1 n GLY 92 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.68 2.64 0.48 4.61 0.00 -1.26 -5.00 121.76 120.54 2jj1 s ALA 93 Ca 0.00 -0.99 -0.23 0.00 0.00 0.00 0.00 51.96 50.74 2jj1 s ALA 93 Cb 0.00 -1.34 -0.09 0.00 0.00 0.00 0.00 23.12 21.70 2jj1 s ALA 93 CO 0.00 0.02 1.03 -0.89 0.00 0.00 0.00 175.76 175.92 2jj1 n ILE 94 N 3.96 2.83 -1.70 0.00 2.08 -1.26 -0.48 119.36 124.78 2jj1 n ILE 94 Ca -0.18 -0.50 -0.43 0.00 0.56 0.00 0.00 62.75 62.19 2jj1 n ILE 94 Cb 0.52 -1.22 -0.03 0.00 -0.75 0.00 0.00 39.64 38.16 2jj1 n ILE 94 CO 0.00 0.00 0.00 0.52 0.56 0.00 0.00 176.55 177.63 2jj1 n VAL 95 N -0.83 0.19 -4.30 1.39 0.31 -1.02 -4.76 118.33 109.31 2jj1 n VAL 95 Ca 0.10 -0.05 -0.16 0.00 -0.01 0.00 0.00 64.34 64.22 2jj1 n VAL 95 Cb 0.42 -1.82 -0.10 0.00 -0.91 0.00 0.00 33.84 31.42 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 0.95 1.22 0.04 4.52 1.47 -1.26 -2.47 116.67 121.15 2jj1 s ASP 96 Ca 0.74 -1.34 0.02 0.00 1.18 0.00 0.00 52.55 53.15 2jj1 s ASP 96 Cb -0.56 0.15 -0.02 0.00 -0.34 0.00 0.00 42.92 42.14 2jj1 s ASP 96 CO 0.37 -0.69 -0.07 0.68 0.68 0.00 0.00 175.17 176.14 2jj1 s VAL 97 N -3.72 0.48 0.65 2.11 -7.23 0.12 -4.88 120.40 107.92 2jj1 s VAL 97 Ca 0.35 -1.09 -0.18 0.00 -1.81 0.00 0.00 61.98 59.25 2jj1 s VAL 97 Cb 0.07 -0.60 -0.01 0.00 0.56 0.00 0.00 36.38 36.40 2jj1 s VAL 97 CO 0.12 -0.42 1.29 -2.16 -0.31 0.00 0.00 175.10 173.61 2jj1 s PRO 98 N -1.66 2.55 0.01 4.82 0.04 -1.26 -1.74 135.00 137.76 2jj1 s PRO 98 Ca -0.10 2.04 -0.15 0.00 0.04 0.00 0.00 61.00 62.83 2jj1 s PRO 98 Cb -0.09 -1.85 0.02 0.00 0.04 0.00 0.00 34.50 32.62 2jj1 s PRO 98 CO -0.00 -1.59 0.31 0.08 0.04 0.00 0.00 177.00 175.84 2jj1 s VAL 99 N -1.43 0.07 -3.81 -0.36 1.01 -0.34 -4.78 120.40 110.75 2jj1 s VAL 99 Ca 0.82 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 62.25 2jj1 s VAL 99 Cb -0.37 -0.74 0.00 0.00 0.00 0.00 0.00 36.38 35.28 2jj1 s VAL 99 CO 0.40 -0.30 0.00 0.61 0.00 0.00 0.00 175.10 175.80 2jj1 n GLY 100 N 1.02 0.91 0.09 4.51 0.00 -1.26 -3.70 105.19 106.75 2jj1 n GLY 100 Ca -0.20 -2.02 0.13 0.00 0.00 0.00 0.00 46.02 43.92 2jj1 n GLY 100 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jj1 n GLU 101 N -0.91 0.22 0.28 1.61 1.02 -1.26 -3.11 120.64 118.49 2jj1 n GLU 101 Ca 0.00 0.20 0.19 0.00 -0.02 0.00 0.00 57.16 57.53 2jj1 n GLU 101 Cb 0.00 -1.77 0.99 0.00 -0.02 0.00 0.00 31.44 30.65 2jj1 n GLU 101 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2jj1 h GLU 102 N 0.00 0.00 0.00 3.49 3.07 -1.93 -2.40 114.58 116.82 2jj1 h GLU 102 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2jj1 h GLU 102 Cb 0.67 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.58 2jj1 h GLU 102 CO 0.00 0.00 0.00 -0.07 -1.40 0.00 0.00 179.01 177.54 2jj1 h LEU 103 N 0.00 0.00 -9.50 1.33 3.38 -1.92 -3.44 115.31 105.16 2jj1 h LEU 103 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 2jj1 h LEU 103 Cb 0.06 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.84 2jj1 h LEU 103 CO 0.00 0.00 0.96 -0.76 0.09 0.00 0.00 178.44 178.73 2jj1 s LEU 104 N -5.45 4.37 0.00 1.67 1.43 -0.90 -1.59 118.68 118.21 2jj1 s LEU 104 Ca 0.09 2.52 0.00 0.00 -1.03 0.00 0.00 54.13 55.71 2jj1 s LEU 104 Cb 0.08 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.73 2jj1 s LEU 104 CO 0.63 -0.86 0.00 0.61 0.23 0.00 0.00 176.35 176.96 2jj1 n GLY 105 N 3.91 1.18 3.97 -3.19 0.00 0.34 -4.87 105.19 106.52 2jj1 n GLY 105 Ca 0.15 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.96 2jj1 n GLY 105 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jj1 s ARG 106 N -0.24 3.34 -0.15 1.61 1.81 -0.62 -4.86 118.95 119.84 2jj1 s ARG 106 Ca 0.00 -0.69 0.01 0.00 -1.72 0.00 0.00 55.73 53.33 2jj1 s ARG 106 Cb 0.00 -2.79 0.02 0.00 -0.45 0.00 0.00 34.95 31.73 2jj1 s ARG 106 CO 0.00 0.21 -0.16 0.08 -0.68 0.00 0.00 175.30 174.75 2jj1 s VAL 107 N -2.16 1.69 0.28 3.52 1.01 -1.26 -1.99 120.40 121.49 2jj1 s VAL 107 Ca 0.39 -0.71 0.09 0.00 0.00 0.00 0.00 61.98 61.75 2jj1 s VAL 107 Cb -0.09 -1.56 -0.06 0.00 0.00 0.00 0.00 36.38 34.67 2jj1 s VAL 107 CO 0.32 0.48 -0.12 0.68 0.00 0.00 0.00 175.10 176.46 2jj1 s VAL 108 N 1.36 2.00 0.47 2.92 -7.23 -0.31 -0.50 120.40 119.11 2jj1 s VAL 108 Ca 0.03 -2.23 -0.06 0.00 -1.81 0.00 0.00 61.98 57.92 2jj1 s VAL 108 Cb -0.13 -2.39 0.10 0.00 0.56 0.00 0.00 36.38 34.52 2jj1 s VAL 108 CO -0.10 -0.35 0.63 -0.90 -0.31 0.00 0.00 175.10 174.08 2jj1 n ASP 109 N -0.61 0.27 0.26 4.85 3.85 -0.05 -1.06 116.55 124.05 2jj1 n ASP 109 Ca -0.06 -1.36 0.13 0.00 -0.71 0.00 0.00 54.79 52.79 2jj1 n ASP 109 Cb 0.62 -0.46 0.79 0.00 -1.35 0.00 0.00 41.12 40.71 2jj1 n ASP 109 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2jj1 h ALA 110 N -1.45 1.79 -0.01 2.12 0.00 -1.87 -1.09 119.26 118.76 2jj1 h ALA 110 Ca -0.21 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2jj1 h ALA 110 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2jj1 h ALA 110 CO 0.17 -0.06 -0.12 1.28 0.00 0.00 0.00 179.25 180.51 2jj1 n LEU 111 N -4.15 1.13 0.00 0.00 4.77 -1.26 -4.73 117.00 112.76 2jj1 n LEU 111 Ca -0.02 -0.32 0.00 0.00 -0.03 0.00 0.00 56.01 55.64 2jj1 n LEU 111 Cb 0.14 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 2jj1 n LEU 111 CO 0.31 0.20 0.00 0.61 -1.33 0.00 0.00 177.39 177.17 2jj1 n GLY 112 N 1.25 0.78 3.79 -0.72 0.00 -0.41 -4.48 105.19 105.41 2jj1 n GLY 112 Ca 0.16 -0.25 -0.38 0.00 0.00 0.00 0.00 46.02 45.55 2jj1 n GLY 112 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2jj1 s ASN 113 N -2.22 6.94 0.24 1.61 0.01 -1.26 -4.79 114.94 115.47 2jj1 s ASN 113 Ca 0.00 1.12 -0.31 0.00 -0.71 0.00 0.00 52.86 52.96 2jj1 s ASN 113 Cb 0.00 -2.33 -0.14 0.00 0.41 0.00 0.00 41.25 39.19 2jj1 s ASN 113 CO 0.00 0.20 1.36 0.00 -1.51 0.00 0.00 177.10 177.15 2jj1 n ALA 114 N 2.27 0.85 -0.69 0.60 0.00 -1.26 -0.87 120.51 121.40 2jj1 n ALA 114 Ca -0.10 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.76 2jj1 n ALA 114 Cb 0.51 -2.23 0.01 0.00 0.00 0.00 0.00 19.45 17.73 2jj1 n ALA 114 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2jj1 n ILE 115 N 1.71 0.44 1.25 0.00 -5.35 0.34 -4.79 119.36 112.96 2jj1 n ILE 115 Ca 0.12 -0.46 0.13 0.00 -0.27 0.00 0.00 62.75 62.27 2jj1 n ILE 115 Cb 0.31 0.74 0.31 0.00 -1.74 0.00 0.00 39.64 39.25 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 -0.24 2.09 -1.15 7.28 5.68 -1.19 -4.95 116.55 124.07 2jj1 n ASP 116 Ca 0.01 -1.65 -0.08 0.00 -0.50 0.00 0.00 54.79 52.57 2jj1 n ASP 116 Cb 0.42 0.04 0.01 0.00 -1.14 0.00 0.00 41.12 40.46 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 1.27 0.21 0.32 6.12 0.00 -1.26 -4.95 105.19 106.90 2jj1 n GLY 117 Ca 0.16 -0.48 0.08 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.87 1.39 0.00 1.61 5.02 -1.26 -5.12 118.16 117.93 2jj1 n LYS 118 Ca -0.05 -2.88 0.00 0.00 -2.02 0.00 0.00 58.31 53.36 2jj1 n LYS 118 Cb 0.55 -1.53 0.00 0.00 -0.02 0.00 0.00 35.03 34.03 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 -1.27 -2.29 3.64 0.72 0.00 -1.26 -4.93 105.19 99.79 2jj1 n GLY 119 Ca 0.17 -1.54 -0.37 0.00 0.00 0.00 0.00 46.02 44.28 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 -0.79 0.81 -2.91 1.61 -0.02 -1.26 -4.75 135.00 127.68 2jj1 n PRO 120 Ca 0.00 0.33 -0.40 0.00 -2.02 0.00 0.00 63.50 61.40 2jj1 n PRO 120 Cb 0.00 -2.25 -0.05 0.00 -0.02 0.00 0.00 33.50 31.18 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 -1.58 4.72 -0.20 4.25 -1.09 -1.26 -4.97 121.20 121.06 2jj1 s ILE 121 Ca 0.77 1.74 0.02 0.00 -2.23 0.00 0.00 60.65 60.95 2jj1 s ILE 121 Cb -0.39 -4.17 0.26 0.00 -1.58 0.00 0.00 42.46 36.58 2jj1 s ILE 121 CO 0.46 0.33 1.32 0.61 -1.23 0.00 0.00 174.94 176.43 2jj1 n GLY 122 N 2.45 2.88 3.75 6.18 0.00 -1.26 -4.96 105.19 114.23 2jj1 n GLY 122 Ca -0.01 -0.40 -0.41 0.00 0.00 0.00 0.00 46.02 45.19 2jj1 n GLY 122 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jj1 s SER 123 N 0.11 6.35 0.00 1.61 1.04 -1.26 -4.88 113.70 116.67 2jj1 s SER 123 Ca 0.21 2.97 0.23 0.00 0.48 0.00 0.00 55.95 59.84 2jj1 s SER 123 Cb 0.18 -2.64 0.29 0.00 0.10 0.00 0.00 66.02 63.95 2jj1 s SER 123 CO 0.04 -0.93 1.30 0.29 0.98 0.00 0.00 173.24 174.92 2jj1 n LYS 124 N 2.16 2.33 -4.06 4.02 5.02 -1.26 -4.97 118.16 121.39 2jj1 n LYS 124 Ca 0.08 -2.06 -0.10 0.00 -2.02 0.00 0.00 58.31 54.21 2jj1 n LYS 124 Cb 0.37 -1.47 -0.11 0.00 -0.02 0.00 0.00 35.03 33.80 2jj1 n LYS 124 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2jj1 s ALA 125 N -1.70 0.49 0.24 7.82 0.00 -1.24 -5.08 121.76 122.30 2jj1 s ALA 125 Ca 0.32 -0.88 0.07 0.00 0.00 0.00 0.00 51.96 51.47 2jj1 s ALA 125 Cb 0.21 0.13 -0.05 0.00 0.00 0.00 0.00 23.12 23.40 2jj1 s ALA 125 CO 0.30 -0.15 -0.10 1.03 0.00 0.00 0.00 175.76 176.83 2jj1 s ARG 126 N -2.28 1.44 -0.25 0.00 0.52 -1.26 -1.20 118.95 115.92 2jj1 s ARG 126 Ca -0.06 -1.68 -0.15 0.00 -0.52 0.00 0.00 55.73 53.32 2jj1 s ARG 126 Cb -0.05 -1.14 0.07 0.00 0.52 0.00 0.00 34.95 34.36 2jj1 s ARG 126 CO -0.02 0.11 0.61 0.50 0.02 0.00 0.00 175.30 176.52 2jj1 s ARG 127 N -3.68 0.63 0.36 3.54 3.52 -0.71 -4.89 118.95 117.72 2jj1 s ARG 127 Ca 0.26 1.07 -0.28 0.00 -0.13 0.00 0.00 55.73 56.65 2jj1 s ARG 127 Cb 0.01 0.12 -0.10 0.00 -1.56 0.00 0.00 34.95 33.42 2jj1 s ARG 127 CO 0.09 -0.14 1.36 1.03 -0.81 0.00 0.00 175.30 176.83 2jj1 s ARG 128 N 1.42 4.18 0.35 5.12 0.52 -1.26 -0.70 118.95 128.58 2jj1 s ARG 128 Ca -0.09 2.32 0.25 0.00 -0.52 0.00 0.00 55.73 57.69 2jj1 s ARG 128 Cb -0.06 -2.96 0.60 0.00 0.52 0.00 0.00 34.95 33.05 2jj1 s ARG 128 CO -0.16 -0.37 1.70 -0.39 0.02 0.00 0.00 175.30 176.10 2jj1 h VAL 129 N 2.88 0.00 -0.64 3.52 -1.51 -1.76 -3.31 116.25 115.42 2jj1 h VAL 129 Ca -0.50 -0.74 0.00 0.00 -1.23 0.00 0.00 66.70 64.23 2jj1 h VAL 129 Cb 1.24 1.73 0.00 0.00 -2.13 0.00 0.00 31.29 32.13 2jj1 h VAL 129 CO 0.64 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.59 2jj1 n GLY 130 N 1.10 2.77 3.76 5.19 0.00 -1.26 -4.84 105.19 111.91 2jj1 n GLY 130 Ca 0.04 -0.84 -0.41 0.00 0.00 0.00 0.00 46.02 44.81 2jj1 n GLY 130 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jj1 s LEU 131 N -1.74 4.36 0.44 0.99 1.43 -1.25 -4.95 118.68 117.96 2jj1 s LEU 131 Ca 0.50 2.89 -0.22 0.00 -1.03 0.00 0.00 54.13 56.27 2jj1 s LEU 131 Cb 0.31 -3.65 -0.09 0.00 0.03 0.00 0.00 46.19 42.80 2jj1 s LEU 131 CO 0.25 -0.81 1.06 -0.75 0.23 0.00 0.00 176.35 176.33 2jj1 s LYS 132 N -1.20 3.96 0.55 1.70 2.20 -1.26 -5.00 119.74 120.69 2jj1 s LYS 132 Ca 0.57 1.48 -0.21 0.00 -0.36 0.00 0.00 55.97 57.44 2jj1 s LYS 132 Cb -0.45 -2.34 -0.05 0.00 -1.51 0.00 0.00 37.83 33.48 2jj1 s LYS 132 CO 0.53 -0.31 1.30 0.00 -0.36 0.00 0.00 175.35 176.51 2jj1 n ALA 133 N -0.49 1.35 -1.74 3.13 0.00 -1.26 -4.96 120.51 116.54 2jj1 n ALA 133 Ca 0.07 0.11 -0.39 0.00 0.00 0.00 0.00 53.44 53.23 2jj1 n ALA 133 Cb 0.51 -2.32 0.03 0.00 0.00 0.00 0.00 19.45 17.67 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 -1.00 1.85 0.00 0.00 -0.02 -1.26 -5.00 135.00 129.57 2jj1 n PRO 134 Ca 0.11 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 2jj1 n PRO 134 Cb 0.45 -2.56 0.00 0.00 -0.02 0.00 0.00 33.50 31.37 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 0.73 0.46 0.14 -1.23 0.00 -1.26 -4.97 105.19 99.05 2jj1 n GLY 135 Ca 0.09 -1.39 -0.23 0.00 0.00 0.00 0.00 46.02 44.49 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 0.00 1.35 -0.16 -0.61 2.04 -1.97 -3.39 117.51 114.77 2jj1 h ILE 136 Ca 0.00 -2.61 -0.02 0.00 1.00 0.00 0.00 64.86 63.23 2jj1 h ILE 136 Cb 0.00 3.03 -0.01 0.00 -0.74 0.00 0.00 36.82 39.11 2jj1 h ILE 136 CO 0.00 0.77 0.02 0.40 0.00 0.00 0.00 178.15 179.34 2jj1 h ILE 137 N 0.02 1.23 0.00 -0.67 1.08 -2.03 -3.20 117.51 113.93 2jj1 h ILE 137 Ca -0.21 -0.73 0.00 0.00 -0.39 0.00 0.00 64.86 63.52 2jj1 h ILE 137 Cb 1.97 1.40 0.00 0.00 -3.07 0.00 0.00 36.82 37.13 2jj1 h ILE 137 CO 0.24 0.22 0.00 -2.65 -0.69 0.00 0.00 178.15 175.27 2jj1 n PRO 138 N -4.78 0.04 -3.31 2.37 -0.02 -1.26 -4.74 135.00 123.29 2jj1 n PRO 138 Ca -0.05 0.45 -0.19 0.00 -2.02 0.00 0.00 63.50 61.68 2jj1 n PRO 138 Cb 0.19 -1.60 0.00 0.00 -0.02 0.00 0.00 33.50 32.07 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 -3.10 3.05 0.05 -0.52 0.52 -1.21 -0.07 118.95 117.67 2jj1 s ARG 139 Ca 0.02 -0.95 -0.07 0.00 -0.52 0.00 0.00 55.73 54.20 2jj1 s ARG 139 Cb 0.04 -2.76 -0.01 0.00 0.52 0.00 0.00 34.95 32.74 2jj1 s ARG 139 CO 0.13 -0.06 0.14 -1.50 0.02 0.00 0.00 175.30 174.04 2jj1 s ILE 140 N -2.28 0.13 0.21 1.52 2.07 -1.06 -4.40 121.20 117.40 2jj1 s ILE 140 Ca 0.47 -1.09 -0.29 0.00 -1.41 0.00 0.00 60.65 58.33 2jj1 s ILE 140 Cb -0.10 -1.04 -0.16 0.00 0.13 0.00 0.00 42.46 41.29 2jj1 s ILE 140 CO 0.33 -0.60 0.76 -1.20 -1.91 0.00 0.00 174.94 172.32 2jj1 n SER 141 N 0.51 -0.15 -4.68 4.50 7.64 -1.26 -4.68 113.62 115.50 2jj1 n SER 141 Ca -0.18 1.15 -0.42 0.00 1.01 0.00 0.00 58.87 60.43 2jj1 n SER 141 Cb 0.60 -1.08 -0.03 0.00 -1.01 0.00 0.00 64.21 62.69 2jj1 n SER 141 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2jj1 s VAL 142 N -0.89 2.91 0.00 0.44 1.01 -1.26 -4.80 120.40 117.81 2jj1 s VAL 142 Ca 0.65 0.27 0.00 0.00 0.00 0.00 0.00 61.98 62.90 2jj1 s VAL 142 Cb -0.87 -3.17 0.00 0.00 0.00 0.00 0.00 36.38 32.33 2jj1 s VAL 142 CO 0.57 -0.01 0.00 0.54 0.00 0.00 0.00 175.10 176.20 2jj1 n ARG 143 N 6.14 1.30 -3.36 2.72 1.74 -1.26 -4.66 116.66 119.27 2jj1 n ARG 143 Ca 0.17 0.00 -0.38 0.00 -0.77 0.00 0.00 57.85 56.87 2jj1 n ARG 143 Cb 0.40 -0.63 -0.06 0.00 -1.02 0.00 0.00 32.46 31.15 2jj1 n ARG 143 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2jj1 s GLU 144 N -1.20 4.16 0.50 5.56 2.02 -1.26 -4.51 118.70 123.97 2jj1 s GLU 144 Ca 0.00 0.54 -0.22 0.00 0.02 0.00 0.00 54.97 55.31 2jj1 s GLU 144 Cb 0.00 -3.30 -0.06 0.00 0.10 0.00 0.00 34.13 30.87 2jj1 s GLU 144 CO 0.00 0.48 1.23 -2.14 0.02 0.00 0.00 175.26 174.85 2jj1 s PRO 145 N -0.48 3.46 -0.48 0.39 0.02 -1.24 0.35 135.00 137.02 2jj1 s PRO 145 Ca 0.27 1.92 0.03 0.00 0.02 0.00 0.00 61.00 63.24 2jj1 s PRO 145 Cb -0.17 -2.29 0.14 0.00 0.02 0.00 0.00 34.50 32.20 2jj1 s PRO 145 CO 0.14 -0.84 0.29 1.41 -0.33 0.00 0.00 177.00 177.67 2jj1 s MET 146 N -2.86 1.45 0.06 5.54 1.75 -0.16 -4.41 119.30 120.67 2jj1 s MET 146 Ca 0.68 -2.24 -0.30 0.00 -1.25 0.00 0.00 55.69 52.58 2jj1 s MET 146 Cb -0.32 -2.44 -0.05 0.00 2.84 0.00 0.00 34.83 34.85 2jj1 s MET 146 CO 0.38 -1.20 1.15 -0.65 -0.65 0.00 0.00 175.02 174.06 2jj1 s GLN 147 N 0.03 4.46 0.04 4.11 -1.52 -1.26 -4.54 119.66 120.98 2jj1 s GLN 147 Ca 0.20 1.70 0.16 0.00 -1.95 0.00 0.00 55.36 55.47 2jj1 s GLN 147 Cb -0.18 -3.36 -0.16 0.00 -0.22 0.00 0.00 33.01 29.09 2jj1 s GLN 147 CO -0.04 -0.20 0.79 0.25 -0.25 0.00 0.00 175.29 175.84 2jj1 n THR 148 N 3.83 1.29 -0.95 -0.19 -2.24 -1.26 -4.79 114.28 109.96 2jj1 n THR 148 Ca 0.08 -0.72 0.00 0.00 -2.27 0.00 0.00 64.05 61.14 2jj1 n THR 148 Cb 0.47 -0.82 0.00 0.00 -2.10 0.00 0.00 70.33 67.89 2jj1 n THR 148 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jj1 n GLY 149 N 1.43 0.65 3.45 3.38 0.00 -1.26 -4.08 105.19 108.76 2jj1 n GLY 149 Ca -0.11 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.47 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 -2.76 5.03 0.22 -0.61 1.01 -1.26 -0.68 121.20 122.16 2jj1 s ILE 150 Ca 0.00 -0.54 -0.18 0.00 0.00 0.00 0.00 60.65 59.93 2jj1 s ILE 150 Cb 0.00 -4.16 0.21 0.00 0.01 0.00 0.00 42.46 38.52 2jj1 s ILE 150 CO 0.00 -0.60 1.52 0.29 0.00 0.00 0.00 174.94 176.15 2jj1 n LYS 151 N 5.74 -0.25 0.14 2.79 5.02 -1.26 -0.68 118.16 129.67 2jj1 n LYS 151 Ca -0.08 1.51 0.03 0.00 -2.02 0.00 0.00 58.31 57.74 2jj1 n LYS 151 Cb 0.46 -2.24 0.39 0.00 -0.02 0.00 0.00 35.03 33.62 2jj1 n LYS 151 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2jj1 h ALA 152 N 1.28 1.49 0.25 7.82 0.00 -1.93 -1.96 119.26 126.21 2jj1 h ALA 152 Ca 0.33 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2jj1 h ALA 152 Cb 0.57 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2jj1 h ALA 152 CO -0.97 0.36 -0.12 0.28 0.00 0.00 0.00 179.25 178.80 2jj1 h VAL 153 N 0.16 0.00 0.00 0.00 2.07 -1.23 -2.44 116.25 114.82 2jj1 h VAL 153 Ca 0.03 -0.56 0.00 0.00 0.82 0.00 0.00 66.70 66.99 2jj1 h VAL 153 Cb 0.43 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.20 2jj1 h VAL 153 CO 0.03 0.00 0.00 0.44 0.02 0.00 0.00 177.57 178.06 2jj1 h ASP 154 N -0.89 0.00 0.00 0.57 3.32 -1.13 -1.37 116.42 116.93 2jj1 h ASP 154 Ca -0.03 0.00 -0.31 0.00 0.02 0.00 0.00 57.03 56.71 2jj1 h ASP 154 Cb 0.26 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.75 2jj1 h ASP 154 CO 0.06 0.00 -2.14 -1.54 -1.72 0.00 0.00 179.24 173.90 2jj1 n SER 155 N -2.29 2.31 -0.03 6.45 3.41 -0.75 -4.56 113.62 118.17 2jj1 n SER 155 Ca -0.02 -0.05 -0.17 0.00 -0.26 0.00 0.00 58.87 58.38 2jj1 n SER 155 Cb 0.04 -0.36 -0.14 0.00 -0.26 0.00 0.00 64.21 63.49 2jj1 n SER 155 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2jj1 n LEU 156 N -3.22 2.04 -3.28 1.04 4.77 -0.92 -4.63 117.00 112.81 2jj1 n LEU 156 Ca -0.36 0.21 -0.25 0.00 -0.03 0.00 0.00 56.01 55.58 2jj1 n LEU 156 Cb 0.86 -0.64 -0.08 0.00 -2.33 0.00 0.00 43.42 41.23 2jj1 n LEU 156 CO 0.17 0.72 -0.25 1.33 -1.33 0.00 0.00 177.39 178.03 2jj1 n VAL 157 N -3.29 -0.39 -2.55 4.08 0.24 -0.55 -4.63 118.33 111.24 2jj1 n VAL 157 Ca -0.30 -4.06 -0.34 0.00 -2.04 0.00 0.00 64.34 57.61 2jj1 n VAL 157 Cb 1.05 -1.92 -0.04 0.00 -1.47 0.00 0.00 33.84 31.46 2jj1 n VAL 157 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2jj1 s PRO 158 N -1.09 3.83 -0.12 7.34 0.04 -1.15 -4.58 135.00 139.28 2jj1 s PRO 158 Ca 0.35 1.36 -0.00 0.00 0.04 0.00 0.00 61.00 62.75 2jj1 s PRO 158 Cb 0.14 -2.12 -0.02 0.00 0.04 0.00 0.00 34.50 32.53 2jj1 s PRO 158 CO -0.12 -0.41 -0.11 0.42 0.04 0.00 0.00 177.00 176.83 2jj1 s ILE 159 N -1.97 3.29 0.30 0.56 1.01 -1.26 -4.53 121.20 118.60 2jj1 s ILE 159 Ca 0.67 -0.59 0.08 0.00 0.00 0.00 0.00 60.65 60.80 2jj1 s ILE 159 Cb -0.16 -2.38 -0.03 0.00 0.01 0.00 0.00 42.46 39.89 2jj1 s ILE 159 CO 0.20 0.54 0.21 -0.83 0.00 0.00 0.00 174.94 175.05 2jj1 s GLY 160 N 0.07 1.67 -0.34 6.18 0.00 -1.26 -0.98 107.32 112.66 2jj1 s GLY 160 Ca -0.04 -1.60 -0.28 0.00 0.00 0.00 0.00 44.72 42.79 2jj1 s GLY 160 CO 0.04 -1.58 1.74 0.50 0.00 0.00 0.00 173.10 173.80 2jj1 s ARG 161 N -3.89 3.38 0.00 2.90 0.52 0.16 -1.80 118.95 120.22 2jj1 s ARG 161 Ca 0.37 1.36 0.00 0.00 -0.52 0.00 0.00 55.73 56.94 2jj1 s ARG 161 Cb -0.06 -4.17 0.00 0.00 0.52 0.00 0.00 34.95 31.24 2jj1 s ARG 161 CO 0.25 -1.80 0.00 0.41 0.02 0.00 0.00 175.30 174.18 2jj1 n GLY 162 N 5.37 0.85 3.87 -3.53 0.00 -1.25 -4.61 105.19 105.89 2jj1 n GLY 162 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.31 3.82 -0.11 1.61 0.74 -0.75 -3.31 119.66 121.34 2jj1 s GLN 163 Ca 0.00 0.38 -0.03 0.00 0.05 0.00 0.00 55.36 55.76 2jj1 s GLN 163 Cb 0.00 -2.53 -0.03 0.00 1.10 0.00 0.00 33.01 31.55 2jj1 s GLN 163 CO 0.00 0.17 0.02 1.03 -0.55 0.00 0.00 175.29 175.96 2jj1 s ARG 164 N -3.23 3.26 -0.21 1.67 3.00 -1.26 -1.73 118.95 120.45 2jj1 s ARG 164 Ca 0.50 -0.38 -0.04 0.00 0.00 0.00 0.00 55.73 55.80 2jj1 s ARG 164 Cb -0.11 -2.91 0.11 0.00 0.00 0.00 0.00 34.95 32.04 2jj1 s ARG 164 CO 0.24 0.59 0.36 -2.00 0.00 0.00 0.00 175.30 174.49 2jj1 s GLU 165 N -0.56 0.30 0.04 3.54 2.56 -0.52 0.09 118.70 124.16 2jj1 s GLU 165 Ca 0.10 0.69 -0.29 0.00 0.00 0.00 0.00 54.97 55.46 2jj1 s GLU 165 Cb -0.12 -0.24 -0.04 0.00 2.00 0.00 0.00 34.13 35.73 2jj1 s GLU 165 CO 0.02 -0.48 0.92 -1.17 -0.56 0.00 0.00 175.26 173.99 2jj1 s LEU 166 N 2.53 4.42 -0.29 2.70 2.96 -0.97 -3.77 118.68 126.27 2jj1 s LEU 166 Ca 0.07 1.65 -0.14 0.00 -0.22 0.00 0.00 54.13 55.48 2jj1 s LEU 166 Cb -0.14 -3.50 -0.04 0.00 0.50 0.00 0.00 46.19 43.02 2jj1 s LEU 166 CO -0.14 -0.14 0.32 -0.63 -1.32 0.00 0.00 176.35 174.44 2jj1 s ILE 167 N 0.49 5.21 -0.01 6.68 1.01 -0.41 0.18 121.20 134.35 2jj1 s ILE 167 Ca 0.47 0.34 0.00 0.00 0.00 0.00 0.00 60.65 61.47 2jj1 s ILE 167 Cb -0.22 -3.68 0.01 0.00 0.01 0.00 0.00 42.46 38.58 2jj1 s ILE 167 CO 0.27 0.13 -0.00 -0.51 0.00 0.00 0.00 174.94 174.83 2jj1 s ILE 168 N 1.97 0.06 0.00 2.92 2.07 0.57 -1.96 121.20 126.83 2jj1 s ILE 168 Ca 0.12 0.03 0.00 0.00 -1.41 0.00 0.00 60.65 59.39 2jj1 s ILE 168 Cb -0.16 -0.09 0.00 0.00 0.13 0.00 0.00 42.46 42.34 2jj1 s ILE 168 CO 0.11 0.05 0.00 0.61 -1.91 0.00 0.00 174.94 173.79 2jj1 n GLY 169 N 3.39 0.86 3.34 1.50 0.00 -1.07 0.04 105.19 113.25 2jj1 n GLY 169 Ca -0.17 -1.10 -0.30 0.00 0.00 0.00 0.00 46.02 44.45 2jj1 n GLY 169 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jj1 s ASP 170 N 0.00 -0.72 0.42 1.61 -0.00 -1.26 -1.80 116.67 114.92 2jj1 s ASP 170 Ca 0.00 0.89 -0.25 0.00 -0.00 0.00 0.00 52.55 53.19 2jj1 s ASP 170 Cb 0.00 -1.28 -0.08 0.00 -0.00 0.00 0.00 42.92 41.56 2jj1 s ASP 170 CO 0.00 -5.16 1.27 0.00 -0.00 0.00 0.00 175.17 171.28 2jj1 s ARG 171 N -5.05 3.88 -1.47 8.23 1.70 -1.26 -3.32 118.95 121.66 2jj1 s ARG 171 Ca 0.69 2.07 -0.06 0.00 -0.47 0.00 0.00 55.73 57.96 2jj1 s ARG 171 Cb -0.14 -2.66 0.05 0.00 -0.57 0.00 0.00 34.95 31.63 2jj1 s ARG 171 CO 0.58 -0.54 0.64 1.04 -1.08 0.00 0.00 175.30 175.95 2jj1 n GLN 172 N -0.06 -3.96 -0.01 3.89 1.13 -1.26 -4.88 117.38 112.24 2jj1 n GLN 172 Ca 0.05 0.47 0.10 0.00 -1.94 0.00 0.00 57.00 55.68 2jj1 n GLN 172 Cb 0.45 -4.93 -0.15 0.00 0.11 0.00 0.00 30.24 25.72 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 -4.43 0.00 0.00 5.09 -2.24 -1.21 -4.96 114.28 106.54 2jj1 n THR 173 Ca -0.17 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.30 2jj1 n THR 173 Cb 0.62 0.38 0.00 0.00 -2.10 0.00 0.00 70.33 69.23 2jj1 n THR 173 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jj1 n GLY 174 N 1.37 1.76 0.29 3.38 0.00 -1.26 -4.58 105.19 106.15 2jj1 n GLY 174 Ca -0.01 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.58 -0.89 1.61 1.57 -1.94 -2.86 116.57 113.49 2jj1 h LYS 175 Ca 0.00 0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 2jj1 h LYS 175 Cb 0.00 0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.40 2jj1 h LYS 175 CO 0.00 -0.38 0.52 1.15 -0.57 0.00 0.00 179.45 180.17 2jj1 h THR 176 N -0.60 1.25 -0.67 -0.16 2.02 -1.97 -2.32 112.91 110.46 2jj1 h THR 176 Ca -0.03 -0.56 0.11 0.00 0.77 0.00 0.00 66.41 66.70 2jj1 h THR 176 Cb 0.51 0.02 -0.04 0.00 -1.74 0.00 0.00 68.15 66.89 2jj1 h THR 176 CO 0.01 0.27 0.45 0.28 0.37 0.00 0.00 175.52 176.90 2jj1 h SER 177 N 1.23 0.42 -0.82 4.18 0.02 -1.94 0.19 113.55 116.83 2jj1 h SER 177 Ca 0.32 0.01 0.02 0.00 -0.84 0.00 0.00 61.79 61.31 2jj1 h SER 177 Cb -0.03 -0.07 -0.05 0.00 0.14 0.00 0.00 62.40 62.39 2jj1 h SER 177 CO -0.06 0.24 0.53 0.40 -1.14 0.00 0.00 176.83 176.80 2jj1 h ILE 178 N 0.46 1.15 0.10 3.27 1.08 -1.23 -1.48 117.51 120.86 2jj1 h ILE 178 Ca 0.32 -0.36 -0.28 0.00 -0.39 0.00 0.00 64.86 64.14 2jj1 h ILE 178 Cb 0.62 0.01 0.02 0.00 -3.07 0.00 0.00 36.82 34.40 2jj1 h ILE 178 CO -0.10 0.19 -1.19 0.00 -0.69 0.00 0.00 178.15 176.36 2jj1 h ALA 179 N 1.33 0.07 -0.09 1.87 0.00 -1.09 -2.93 119.26 118.43 2jj1 h ALA 179 Ca 0.32 -0.78 0.01 0.00 0.00 0.00 0.00 54.91 54.47 2jj1 h ALA 179 Cb -0.03 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2jj1 h ALA 179 CO -0.10 0.75 0.00 0.82 0.00 0.00 0.00 179.25 180.72 2jj1 h ILE 180 N 0.25 0.94 -0.87 0.00 1.08 -0.50 -2.15 117.51 116.27 2jj1 h ILE 180 Ca -0.16 -0.01 -0.01 0.00 -0.39 0.00 0.00 64.86 64.29 2jj1 h ILE 180 Cb 1.86 0.91 -0.04 0.00 -3.07 0.00 0.00 36.82 36.48 2jj1 h ILE 180 CO 0.22 0.01 0.51 0.44 -0.69 0.00 0.00 178.15 178.64 2jj1 h ASP 181 N 0.03 1.05 -0.76 1.72 5.19 -1.38 -1.48 116.42 120.79 2jj1 h ASP 181 Ca 0.04 -0.07 -0.04 0.00 -0.62 0.00 0.00 57.03 56.34 2jj1 h ASP 181 Cb 0.04 -0.27 -0.03 0.00 0.18 0.00 0.00 39.33 39.25 2jj1 h ASP 181 CO -0.06 0.82 0.30 0.74 -3.12 0.00 0.00 179.24 177.91 2jj1 h THR 182 N 1.20 1.26 -0.21 0.35 2.02 -1.30 0.23 112.91 116.47 2jj1 h THR 182 Ca 0.31 -0.81 -0.06 0.00 0.77 0.00 0.00 66.41 66.62 2jj1 h THR 182 Cb -0.03 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 66.74 2jj1 h THR 182 CO -0.06 0.33 -0.11 0.40 0.37 0.00 0.00 175.52 176.45 2jj1 h ILE 183 N 1.10 1.31 -0.11 3.11 2.04 -1.13 -2.93 117.51 120.91 2jj1 h ILE 183 Ca 0.25 -1.19 0.04 0.00 1.00 0.00 0.00 64.86 64.97 2jj1 h ILE 183 Cb 0.22 1.65 -0.06 0.00 -0.74 0.00 0.00 36.82 37.89 2jj1 h ILE 183 CO -0.02 0.36 -0.30 0.40 0.00 0.00 0.00 178.15 178.59 2jj1 h ILE 184 N 0.13 0.32 -1.30 -0.67 2.04 -1.10 -2.62 117.51 114.31 2jj1 h ILE 184 Ca 0.04 0.00 0.42 0.00 1.00 0.00 0.00 64.86 66.32 2jj1 h ILE 184 Cb 0.61 0.32 -0.12 0.00 -0.74 0.00 0.00 36.82 36.89 2jj1 h ILE 184 CO 0.03 0.00 0.84 -1.13 0.00 0.00 0.00 178.15 177.89 2jj1 h ASN 185 N -0.39 0.26 0.33 1.72 -1.24 -0.34 -0.53 115.58 115.39 2jj1 h ASN 185 Ca 0.09 0.13 0.00 0.00 0.71 0.00 0.00 56.30 57.23 2jj1 h ASN 185 Cb 0.53 0.11 0.00 0.00 0.73 0.00 0.00 38.32 39.69 2jj1 h ASN 185 CO -0.33 -0.15 0.00 0.00 -1.29 0.00 0.00 177.43 175.66 2jj1 n GLN 186 N -4.67 0.05 -0.15 6.67 1.13 -0.99 -3.41 117.38 116.01 2jj1 n GLN 186 Ca 0.36 0.40 0.12 0.00 -1.94 0.00 0.00 57.00 55.93 2jj1 n GLN 186 Cb 1.38 -1.61 0.45 0.00 0.11 0.00 0.00 30.24 30.57 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 0.51 -0.09 -1.09 3.64 -1.27 -0.53 116.57 117.75 2jj1 h LYS 187 Ca 0.00 -0.03 -0.13 0.00 -1.27 0.00 0.00 60.65 59.22 2jj1 h LYS 187 Cb 0.17 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 2jj1 h LYS 187 CO 0.00 0.34 -0.51 0.07 -2.27 0.00 0.00 179.45 177.08 2jj1 h ARG 188 N 0.52 0.23 0.25 1.90 0.11 -1.82 -1.81 114.38 113.76 2jj1 h ARG 188 Ca 0.33 -0.13 -0.33 0.00 0.10 0.00 0.00 59.98 59.95 2jj1 h ARG 188 Cb 0.59 0.01 0.04 0.00 1.11 0.00 0.00 29.97 31.71 2jj1 h ARG 188 CO -0.11 0.69 -1.44 0.74 0.10 0.00 0.00 179.97 179.95 2jj1 h PHE 189 N 0.18 0.96 0.00 4.08 -1.00 -1.50 -2.79 116.94 116.87 2jj1 h PHE 189 Ca 0.01 -0.70 0.00 0.00 2.81 0.00 0.00 57.97 60.08 2jj1 h PHE 189 Cb 0.96 -0.04 0.00 0.00 3.61 0.00 0.00 35.95 40.48 2jj1 h PHE 189 CO 0.02 1.55 0.00 -0.91 -1.61 0.00 0.00 178.31 177.36 2jj1 h ASN 190 N 0.11 0.00 -0.00 2.17 2.35 -1.08 -1.51 115.58 117.61 2jj1 h ASN 190 Ca -0.25 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.50 2jj1 h ASN 190 Cb 2.14 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.51 2jj1 h ASN 190 CO 0.27 0.00 -0.87 0.47 -1.65 0.00 0.00 177.43 175.65 2jj1 n ASP 191 N -2.47 1.17 -2.18 5.81 9.92 -0.69 -4.98 116.55 123.13 2jj1 n ASP 191 Ca 0.03 -1.09 0.00 0.00 -0.53 0.00 0.00 54.79 53.20 2jj1 n ASP 191 Cb 0.32 0.90 0.00 0.00 -0.64 0.00 0.00 41.12 41.70 2jj1 n ASP 191 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2jj1 n GLY 192 N 1.47 -0.33 0.00 0.44 0.00 -0.57 -5.06 105.19 101.14 2jj1 n GLY 192 Ca 0.05 -1.74 0.01 0.00 0.00 0.00 0.00 46.02 44.34 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 -0.90 0.00 -2.22 2.61 -2.24 -1.26 -4.92 114.28 105.35 2jj1 n THR 193 Ca 0.00 -0.09 -0.43 0.00 -2.27 0.00 0.00 64.05 61.26 2jj1 n THR 193 Cb 0.00 0.50 -0.02 0.00 -2.10 0.00 0.00 70.33 68.71 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 -2.16 6.33 0.19 3.42 -1.08 -1.26 -4.90 116.67 117.22 2jj1 s ASP 194 Ca -0.01 1.23 -0.04 0.00 -0.52 0.00 0.00 52.55 53.22 2jj1 s ASP 194 Cb 0.01 -2.53 0.13 0.00 -1.46 0.00 0.00 42.92 39.06 2jj1 s ASP 194 CO 0.09 -1.36 1.53 -0.08 0.52 0.00 0.00 175.17 175.87 2jj1 h GLU 195 N 10.85 0.62 0.00 4.34 4.57 -1.93 -3.03 114.58 130.01 2jj1 h GLU 195 Ca -0.30 -0.35 0.00 0.00 -1.18 0.00 0.00 59.36 57.52 2jj1 h GLU 195 Cb 1.13 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.74 2jj1 h GLU 195 CO 1.04 0.96 0.00 1.63 -1.18 0.00 0.00 179.01 181.46 2jj1 n LYS 196 N -4.00 0.14 0.02 1.92 5.02 -1.26 -2.36 118.16 117.64 2jj1 n LYS 196 Ca -0.02 0.42 0.11 0.00 -2.02 0.00 0.00 58.31 56.80 2jj1 n LYS 196 Cb 0.56 -1.80 -0.02 0.00 -0.02 0.00 0.00 35.03 33.76 2jj1 n LYS 196 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2jj1 n LYS 197 N -2.06 0.28 -1.72 1.97 5.02 -1.15 -4.93 118.16 115.58 2jj1 n LYS 197 Ca 0.02 -0.03 -0.39 0.00 -2.02 0.00 0.00 58.31 55.89 2jj1 n LYS 197 Cb 0.18 -1.57 0.04 0.00 -0.02 0.00 0.00 35.03 33.66 2jj1 n LYS 197 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2jj1 n LYS 198 N -1.92 1.63 -3.59 1.97 5.02 -0.99 -4.80 118.16 115.47 2jj1 n LYS 198 Ca 0.02 0.60 -0.25 0.00 -2.02 0.00 0.00 58.31 56.65 2jj1 n LYS 198 Cb 0.43 -2.47 -0.16 0.00 -0.02 0.00 0.00 35.03 32.81 2jj1 n LYS 198 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2jj1 s LEU 199 N -2.85 0.29 0.08 -0.35 2.96 -1.26 -4.32 118.68 113.23 2jj1 s LEU 199 Ca 0.70 -0.58 -0.18 0.00 -0.22 0.00 0.00 54.13 53.85 2jj1 s LEU 199 Cb -0.44 -0.16 -0.07 0.00 0.50 0.00 0.00 46.19 46.03 2jj1 s LEU 199 CO 0.51 -0.35 0.56 -0.31 -1.32 0.00 0.00 176.35 175.43 2jj1 s TYR 200 N 2.16 3.77 0.14 5.38 1.51 -0.58 -4.90 117.35 124.83 2jj1 s TYR 200 Ca 0.03 1.23 0.07 0.00 -1.01 0.00 0.00 57.07 57.39 2jj1 s TYR 200 Cb -0.16 -2.47 -0.04 0.00 -0.11 0.00 0.00 41.96 39.18 2jj1 s TYR 200 CO -0.10 0.57 -0.06 0.00 -1.11 0.00 0.00 175.55 174.85 2jj1 s ILE 202 N -1.48 0.35 -0.25 0.00 1.01 0.21 -0.77 121.20 120.28 2jj1 s ILE 202 Ca 0.24 -0.01 -0.03 0.00 0.00 0.00 0.00 60.65 60.86 2jj1 s ILE 202 Cb -0.10 -0.42 0.02 0.00 0.01 0.00 0.00 42.46 41.97 2jj1 s ILE 202 CO 0.16 0.19 -0.05 -0.47 0.00 0.00 0.00 174.94 174.77 2jj1 s TYR 203 N 1.01 3.04 -0.25 3.97 5.04 -0.12 -0.70 117.35 129.34 2jj1 s TYR 203 Ca -0.10 -1.37 -0.10 0.00 -2.44 0.00 0.00 57.07 53.06 2jj1 s TYR 203 Cb -0.14 -2.08 -0.05 0.00 0.35 0.00 0.00 41.96 40.04 2jj1 s TYR 203 CO -0.01 -0.68 0.16 0.08 -1.34 0.00 0.00 175.55 173.76 2jj1 s VAL 204 N 1.37 5.22 -0.26 3.14 1.01 0.66 -0.77 120.40 130.76 2jj1 s VAL 204 Ca 0.02 0.13 -0.10 0.00 0.00 0.00 0.00 61.98 62.03 2jj1 s VAL 204 Cb -0.16 -3.45 -0.05 0.00 0.00 0.00 0.00 36.38 32.73 2jj1 s VAL 204 CO -0.04 0.32 0.16 0.00 0.00 0.00 0.00 175.10 175.54 2jj1 s ALA 205 N 1.31 3.48 -0.18 5.51 0.00 0.31 -0.35 121.76 131.84 2jj1 s ALA 205 Ca 0.07 -1.05 0.01 0.00 0.00 0.00 0.00 51.96 50.99 2jj1 s ALA 205 Cb -0.14 -2.37 0.02 0.00 0.00 0.00 0.00 23.12 20.62 2jj1 s ALA 205 CO 0.06 -0.45 -0.19 0.42 0.00 0.00 0.00 175.76 175.61 2jj1 s ILE 206 N 1.56 2.16 0.00 0.00 1.09 0.86 -1.52 121.20 125.36 2jj1 s ILE 206 Ca 0.07 -0.91 0.00 0.00 -1.10 0.00 0.00 60.65 58.70 2jj1 s ILE 206 Cb -0.15 -1.92 0.00 0.00 -1.06 0.00 0.00 42.46 39.33 2jj1 s ILE 206 CO 0.08 0.52 0.00 0.61 -0.10 0.00 0.00 174.94 176.06 2jj1 n GLY 207 N 4.63 1.23 3.84 6.18 0.00 -0.52 -3.12 105.19 117.44 2jj1 n GLY 207 Ca -0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.26 2.42 0.44 1.61 -0.21 -1.26 -3.76 119.66 118.64 2jj1 s GLN 208 Ca 0.00 0.59 -0.23 0.00 0.02 0.00 0.00 55.36 55.74 2jj1 s GLN 208 Cb 0.00 -1.96 -0.08 0.00 1.00 0.00 0.00 33.01 31.96 2jj1 s GLN 208 CO 0.00 -1.37 1.07 -1.59 -2.12 0.00 0.00 175.29 171.27 2jj1 s LYS 209 N -5.23 3.98 0.24 2.91 -2.85 -1.26 -0.16 119.74 117.37 2jj1 s LYS 209 Ca 0.60 1.51 -0.06 0.00 -1.00 0.00 0.00 55.97 57.02 2jj1 s LYS 209 Cb -0.13 -2.38 0.29 0.00 -2.06 0.00 0.00 37.83 33.56 2jj1 s LYS 209 CO 0.53 -0.31 1.87 0.00 0.10 0.00 0.00 175.35 177.55 2jj1 h ARG 210 N 2.12 1.04 -0.80 1.78 3.08 -1.98 -2.34 114.38 117.28 2jj1 h ARG 210 Ca -0.49 -0.06 0.08 0.00 0.07 0.00 0.00 59.98 59.58 2jj1 h ARG 210 Cb 1.22 -0.23 -0.07 0.00 0.08 0.00 0.00 29.97 30.97 2jj1 h ARG 210 CO 0.61 0.69 0.47 0.66 -1.07 0.00 0.00 179.97 181.32 2jj1 h SER 211 N 1.07 0.69 -0.71 7.04 4.64 -1.99 -1.94 113.55 122.35 2jj1 h SER 211 Ca 0.36 0.04 0.06 0.00 -0.47 0.00 0.00 61.79 61.78 2jj1 h SER 211 Cb 0.06 -0.10 -0.06 0.00 -0.31 0.00 0.00 62.40 61.99 2jj1 h SER 211 CO -0.14 0.41 0.41 0.74 -0.87 0.00 0.00 176.83 177.39 2jj1 h THR 212 N 0.81 0.99 0.00 2.95 2.02 -1.82 -0.95 112.91 116.91 2jj1 h THR 212 Ca 0.37 -0.26 -0.06 0.00 0.77 0.00 0.00 66.41 67.24 2jj1 h THR 212 Cb 0.29 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 66.86 2jj1 h THR 212 CO -0.22 0.14 -0.29 0.58 0.37 0.00 0.00 175.52 176.09 2jj1 h VAL 213 N 0.75 0.89 0.11 3.16 2.07 -1.28 -1.58 116.25 120.37 2jj1 h VAL 213 Ca 0.32 -1.14 -0.29 0.00 0.82 0.00 0.00 66.70 66.41 2jj1 h VAL 213 Cb 0.18 1.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.63 2jj1 h VAL 213 CO -0.18 0.29 -1.39 0.00 0.02 0.00 0.00 177.57 176.31 2jj1 h ALA 214 N 1.71 0.23 -0.64 1.67 0.00 -0.69 -2.51 119.26 119.03 2jj1 h ALA 214 Ca -0.00 -1.02 0.00 0.00 0.00 0.00 0.00 54.91 53.89 2jj1 h ALA 214 Cb 0.66 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 2jj1 h ALA 214 CO 0.04 1.10 0.40 1.96 0.00 0.00 0.00 179.25 182.75 2jj1 h GLN 215 N 0.06 0.85 -0.04 0.00 1.08 -0.91 -2.05 115.11 114.10 2jj1 h GLN 215 Ca -0.19 -0.07 0.04 0.00 -1.45 0.00 0.00 58.65 56.98 2jj1 h GLN 215 Cb 1.98 -0.18 -0.05 0.00 -0.05 0.00 0.00 27.48 29.18 2jj1 h GLN 215 CO 0.17 0.59 -0.27 1.25 -0.95 0.00 0.00 178.83 179.63 2jj1 h LEU 216 N 0.86 -0.80 -1.07 1.46 7.12 -1.21 -0.10 115.31 121.56 2jj1 h LEU 216 Ca 0.23 0.11 -0.10 0.00 0.13 0.00 0.00 57.88 58.26 2jj1 h LEU 216 Cb -0.05 0.34 -0.01 0.00 -0.53 0.00 0.00 40.66 40.40 2jj1 h LEU 216 CO -0.05 -0.33 -0.45 -0.37 -0.13 0.00 0.00 178.44 177.11 2jj1 h VAL 217 N -0.39 1.33 -0.44 1.05 -1.51 -1.42 0.60 116.25 115.47 2jj1 h VAL 217 Ca 0.07 -1.56 -0.08 0.00 -1.23 0.00 0.00 66.70 63.91 2jj1 h VAL 217 Cb 0.49 1.82 -0.02 0.00 -2.13 0.00 0.00 31.29 31.46 2jj1 h VAL 217 CO -0.26 0.45 -0.05 0.50 -1.23 0.00 0.00 177.57 176.98 2jj1 h LYS 218 N 0.02 0.74 -0.09 5.19 1.63 -0.89 0.61 116.57 123.78 2jj1 h LYS 218 Ca -0.00 -0.21 -0.19 0.00 -0.85 0.00 0.00 60.65 59.39 2jj1 h LYS 218 Cb 0.81 -0.08 -0.00 0.00 -0.60 0.00 0.00 32.23 32.36 2jj1 h LYS 218 CO 0.06 0.78 -0.74 -0.09 -3.45 0.00 0.00 179.45 176.01 2jj1 h ARG 219 N 0.68 0.47 -0.17 1.90 9.65 -0.46 -0.47 114.38 125.99 2jj1 h ARG 219 Ca 0.13 -0.39 -0.19 0.00 -1.10 0.00 0.00 59.98 58.43 2jj1 h ARG 219 Cb 0.49 0.08 0.00 0.00 -1.39 0.00 0.00 29.97 29.15 2jj1 h ARG 219 CO 0.03 1.02 -0.67 -0.07 2.80 0.00 0.00 179.97 183.08 2jj1 h LEU 220 N 0.32 0.75 0.15 3.80 3.38 -0.15 -2.58 115.31 120.98 2jj1 h LEU 220 Ca -0.03 -0.45 -0.01 0.00 0.09 0.00 0.00 57.88 57.48 2jj1 h LEU 220 Cb 1.33 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.86 2jj1 h LEU 220 CO 0.13 1.21 -0.07 0.74 0.09 0.00 0.00 178.44 180.55 2jj1 h THR 221 N 0.47 1.00 -0.74 0.22 2.02 0.21 0.22 112.91 116.30 2jj1 h THR 221 Ca -0.02 -0.73 0.17 0.00 0.77 0.00 0.00 66.41 66.60 2jj1 h THR 221 Cb 1.26 1.44 -0.04 0.00 -1.74 0.00 0.00 68.15 69.06 2jj1 h THR 221 CO 0.13 0.17 0.50 0.44 0.37 0.00 0.00 175.52 177.13 2jj1 h ASP 222 N -0.56 0.24 -0.04 4.18 5.19 -1.12 0.13 116.42 124.45 2jj1 h ASP 222 Ca -0.02 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2jj1 h ASP 222 Cb 0.43 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 39.91 2jj1 h ASP 222 CO 0.03 0.12 0.00 0.00 -3.12 0.00 0.00 179.24 176.27 2jj1 n ALA 223 N -2.58 2.54 -2.84 3.45 0.00 -0.97 -4.95 120.51 115.16 2jj1 n ALA 223 Ca 0.14 -0.53 -0.14 0.00 0.00 0.00 0.00 53.44 52.91 2jj1 n ALA 223 Cb 0.63 -1.06 0.03 0.00 0.00 0.00 0.00 19.45 19.05 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 0.54 -4.41 -0.06 0.00 2.03 0.47 -4.94 116.55 110.17 2jj1 n ASP 224 Ca 0.17 -0.22 0.08 0.00 0.52 0.00 0.00 54.79 55.34 2jj1 n ASP 224 Cb 0.43 -3.20 -0.07 0.00 -0.72 0.00 0.00 41.12 37.55 2jj1 n ASP 224 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jj1 n ALA 225 N -3.19 3.91 -0.14 -1.67 0.00 0.69 -4.57 120.51 115.54 2jj1 n ALA 225 Ca -0.05 -0.46 -0.08 0.00 0.00 0.00 0.00 53.44 52.85 2jj1 n ALA 225 Cb 0.56 -0.57 0.06 0.00 0.00 0.00 0.00 19.45 19.50 2jj1 n ALA 225 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 2jj1 h MET 226 N 0.31 0.92 -0.11 0.00 2.86 -1.84 -3.02 114.93 114.05 2jj1 h MET 226 Ca 0.00 -0.33 0.03 0.00 -2.06 0.00 0.00 59.70 57.34 2jj1 h MET 226 Cb 0.40 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.00 2jj1 h MET 226 CO 0.00 0.98 0.31 1.57 1.06 0.00 0.00 176.91 180.83 2jj1 h LYS 227 N 0.82 0.00 -0.17 1.72 2.10 -1.89 0.47 116.57 119.61 2jj1 h LYS 227 Ca 0.13 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.78 2jj1 h LYS 227 Cb 0.65 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.98 2jj1 h LYS 227 CO 0.05 0.00 0.00 2.48 -2.00 0.00 0.00 179.45 179.98 2jj1 n TYR 228 N -3.19 0.43 -5.21 0.07 0.18 -1.15 -4.11 117.16 104.17 2jj1 n TYR 228 Ca 0.00 -0.74 -0.30 0.00 1.88 0.00 0.00 57.90 58.75 2jj1 n TYR 228 Cb 0.40 -0.15 -0.16 0.00 -0.38 0.00 0.00 39.34 39.04 2jj1 n TYR 228 CO 0.00 0.00 0.00 0.99 -2.08 0.00 0.00 176.86 175.77 2jj1 s THR 229 N -2.02 1.93 -0.17 -3.48 2.01 0.16 -0.99 115.64 113.08 2jj1 s THR 229 Ca 0.27 -1.03 -0.07 0.00 0.31 0.00 0.00 61.69 61.17 2jj1 s THR 229 Cb 0.21 -1.61 -0.04 0.00 0.01 0.00 0.00 72.50 71.07 2jj1 s THR 229 CO 0.08 0.54 0.06 -0.63 -0.69 0.00 0.00 174.62 173.98 2jj1 s ILE 230 N -0.46 4.81 -0.28 1.82 1.01 0.05 0.13 121.20 128.28 2jj1 s ILE 230 Ca 0.06 -0.03 -0.04 0.00 0.00 0.00 0.00 60.65 60.64 2jj1 s ILE 230 Cb -0.10 -3.15 0.02 0.00 0.01 0.00 0.00 42.46 39.24 2jj1 s ILE 230 CO 0.00 0.48 0.01 -0.69 0.00 0.00 0.00 174.94 174.75 2jj1 s VAL 231 N 0.18 3.38 -0.27 2.92 1.01 -0.84 -0.94 120.40 125.84 2jj1 s VAL 231 Ca 0.05 -0.94 -0.11 0.00 0.00 0.00 0.00 61.98 60.98 2jj1 s VAL 231 Cb -0.12 -2.77 -0.05 0.00 0.00 0.00 0.00 36.38 33.44 2jj1 s VAL 231 CO 0.00 0.09 0.18 -0.69 0.00 0.00 0.00 175.10 174.69 2jj1 s VAL 232 N 1.39 5.32 -0.25 2.92 1.01 0.05 -1.16 120.40 129.67 2jj1 s VAL 232 Ca 0.00 0.17 0.02 0.00 0.00 0.00 0.00 61.98 62.18 2jj1 s VAL 232 Cb -0.17 -3.52 0.06 0.00 0.00 0.00 0.00 36.38 32.75 2jj1 s VAL 232 CO -0.01 0.28 -0.09 -0.55 0.00 0.00 0.00 175.10 174.73 2jj1 s SER 233 N 1.56 4.24 -0.30 3.32 0.15 -0.23 -0.53 113.70 121.92 2jj1 s SER 233 Ca 0.07 -1.32 -0.01 0.00 0.70 0.00 0.00 55.95 55.39 2jj1 s SER 233 Cb -0.15 -1.43 0.05 0.00 -1.71 0.00 0.00 66.02 62.78 2jj1 s SER 233 CO 0.09 -0.20 -0.01 0.00 1.20 0.00 0.00 173.24 174.32 2jj1 s ALA 234 N 1.20 2.79 0.05 5.45 0.00 -0.57 -3.79 121.76 126.88 2jj1 s ALA 234 Ca -0.08 -1.78 0.01 0.00 0.00 0.00 0.00 51.96 50.11 2jj1 s ALA 234 Cb -0.20 -1.90 0.01 0.00 0.00 0.00 0.00 23.12 21.03 2jj1 s ALA 234 CO -0.05 -1.27 0.05 0.25 0.00 0.00 0.00 175.76 174.74 2jj1 n THR 235 N 4.60 0.00 -0.31 0.00 -2.24 -1.26 -1.43 114.28 113.63 2jj1 n THR 235 Ca -0.13 -0.18 0.12 0.00 -2.27 0.00 0.00 64.05 61.59 2jj1 n THR 235 Cb 0.43 -0.75 0.35 0.00 -2.10 0.00 0.00 70.33 68.26 2jj1 n THR 235 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jj1 h ALA 236 N 0.58 1.77 0.00 6.98 0.00 -0.64 -1.69 119.26 126.27 2jj1 h ALA 236 Ca -0.03 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2jj1 h ALA 236 Cb 0.11 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2jj1 h ALA 236 CO 0.04 -0.05 -0.34 -1.13 0.00 0.00 0.00 179.25 177.77 2jj1 n SER 237 N -4.61 0.35 -4.77 0.00 3.41 -1.26 -4.91 113.62 101.82 2jj1 n SER 237 Ca 0.19 0.01 -0.38 0.00 -0.26 0.00 0.00 58.87 58.43 2jj1 n SER 237 Cb 0.50 -0.01 -0.05 0.00 -0.26 0.00 0.00 64.21 64.39 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 -3.06 7.11 0.47 4.04 1.01 -0.64 -5.01 116.67 120.61 2jj1 s ASP 238 Ca 0.12 2.08 -0.22 0.00 0.71 0.00 0.00 52.55 55.24 2jj1 s ASP 238 Cb 0.18 -2.60 -0.10 0.00 1.01 0.00 0.00 42.92 41.41 2jj1 s ASP 238 CO 0.64 -0.24 0.90 0.00 0.21 0.00 0.00 175.17 176.68 2jj1 n ALA 239 N 0.63 -0.15 -0.24 5.23 0.00 -1.26 -4.72 120.51 120.00 2jj1 n ALA 239 Ca 0.02 0.15 0.04 0.00 0.00 0.00 0.00 53.44 53.65 2jj1 n ALA 239 Cb 0.48 -2.02 0.15 0.00 0.00 0.00 0.00 19.45 18.05 2jj1 n ALA 239 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jj1 h ALA 240 N 1.12 0.78 -0.80 0.00 0.00 -1.89 0.06 119.26 118.53 2jj1 h ALA 240 Ca -0.45 0.20 0.14 0.00 0.00 0.00 0.00 54.91 54.81 2jj1 h ALA 240 Cb 1.36 0.33 -0.06 0.00 0.00 0.00 0.00 17.79 19.42 2jj1 h ALA 240 CO 0.54 -0.39 0.53 -1.35 0.00 0.00 0.00 179.25 178.58 2jj1 h PRO 241 N 0.16 0.50 -0.29 0.00 0.11 -1.84 0.19 132.00 130.83 2jj1 h PRO 241 Ca 0.38 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 66.33 2jj1 h PRO 241 Cb 0.66 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 31.65 2jj1 h PRO 241 CO -0.57 0.33 -0.34 -0.07 -0.21 0.00 0.00 178.00 177.14 2jj1 h LEU 242 N 0.52 0.81 -0.79 2.35 3.38 -1.30 0.23 115.31 120.51 2jj1 h LEU 242 Ca 0.39 -0.49 -0.06 0.00 0.09 0.00 0.00 57.88 57.82 2jj1 h LEU 242 Cb 0.79 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 2jj1 h LEU 242 CO -0.15 1.13 0.21 1.56 0.09 0.00 0.00 178.44 181.29 2jj1 h GLN 243 N 0.50 1.12 -0.11 1.13 4.20 -1.14 0.34 115.11 121.16 2jj1 h GLN 243 Ca 0.04 -0.24 0.01 0.00 0.06 0.00 0.00 58.65 58.52 2jj1 h GLN 243 Cb 0.93 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.53 2jj1 h GLN 243 CO 0.08 0.96 0.01 -0.92 -0.67 0.00 0.00 178.83 178.29 2jj1 h TYR 244 N 1.07 0.02 -0.02 2.96 3.20 -0.54 -3.26 116.97 120.40 2jj1 h TYR 244 Ca 0.23 0.01 -0.16 0.00 3.14 0.00 0.00 58.73 61.94 2jj1 h TYR 244 Cb 0.32 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 2jj1 h TYR 244 CO 0.03 0.00 -0.73 1.25 -1.64 0.00 0.00 178.16 177.07 2jj1 h LEU 245 N 0.05 0.17 -0.71 2.82 5.85 -0.18 -3.38 115.31 119.93 2jj1 h LEU 245 Ca 0.05 -0.12 0.13 0.00 0.84 0.00 0.00 57.88 58.78 2jj1 h LEU 245 Cb 0.05 -0.05 -0.09 0.00 0.37 0.00 0.00 40.66 40.94 2jj1 h LEU 245 CO -0.07 0.84 0.27 0.00 -0.34 0.00 0.00 178.44 179.14 2jj1 h ALA 246 N 1.16 0.98 -0.76 1.25 0.00 -0.98 0.03 119.26 120.94 2jj1 h ALA 246 Ca -0.02 0.11 0.06 0.00 0.00 0.00 0.00 54.91 55.06 2jj1 h ALA 246 Cb 1.28 0.09 -0.06 0.00 0.00 0.00 0.00 17.79 19.11 2jj1 h ALA 246 CO 0.11 -0.21 0.45 -1.35 0.00 0.00 0.00 179.25 178.25 2jj1 h PRO 247 N 0.42 0.81 -0.01 0.00 0.11 -1.78 -0.45 132.00 131.10 2jj1 h PRO 247 Ca 0.38 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 66.35 2jj1 h PRO 247 Cb 0.56 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.47 2jj1 h PRO 247 CO -0.38 0.53 -0.45 1.88 -0.21 0.00 0.00 178.00 179.36 2jj1 h TYR 248 N 0.83 0.03 -0.16 0.65 -1.99 -1.27 -0.06 116.97 115.00 2jj1 h TYR 248 Ca 0.33 -0.01 -0.14 0.00 2.00 0.00 0.00 58.73 60.92 2jj1 h TYR 248 Cb 0.17 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 38.89 2jj1 h TYR 248 CO -0.05 0.48 -0.44 0.77 -0.00 0.00 0.00 178.16 178.91 2jj1 h SER 249 N 0.02 0.66 -0.41 3.88 0.02 -0.84 -2.58 113.55 114.30 2jj1 h SER 249 Ca -0.00 -0.59 0.03 0.00 -0.84 0.00 0.00 61.79 60.39 2jj1 h SER 249 Cb 0.81 -0.19 -0.04 0.00 0.14 0.00 0.00 62.40 63.13 2jj1 h SER 249 CO 0.06 1.13 0.20 1.23 -1.14 0.00 0.00 176.83 178.31 2jj1 h GLY 250 N 0.22 0.56 0.25 -3.77 0.00 -0.95 -2.73 103.07 96.64 2jj1 h GLY 250 Ca -0.01 -0.14 0.11 0.00 0.00 0.00 0.00 47.33 47.29 2jj1 h GLY 250 CO 0.09 0.10 0.17 0.00 0.00 0.00 0.00 176.54 176.90 2jj1 h SER 252 N 0.31 0.57 -0.74 0.00 0.02 -1.30 0.40 113.55 112.82 2jj1 h SER 252 Ca 0.32 -0.05 0.06 0.00 -0.84 0.00 0.00 61.79 61.28 2jj1 h SER 252 Cb 0.45 -0.14 -0.06 0.00 0.14 0.00 0.00 62.40 62.79 2jj1 h SER 252 CO -0.37 0.45 0.44 0.24 -1.14 0.00 0.00 176.83 176.44 2jj1 h MET 253 N 0.64 0.78 -0.63 3.45 2.86 -1.11 -1.53 114.93 119.38 2jj1 h MET 253 Ca 0.17 -0.05 -0.06 0.00 -2.06 0.00 0.00 59.70 57.71 2jj1 h MET 253 Cb -0.02 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 31.43 2jj1 h MET 253 CO -0.03 0.51 0.16 0.78 1.06 0.00 0.00 176.91 179.39 2jj1 h GLY 254 N 0.80 1.07 2.00 8.32 0.00 -0.32 -3.15 103.07 111.79 2jj1 h GLY 254 Ca 0.33 -0.64 -0.01 0.00 0.00 0.00 0.00 47.33 47.01 2jj1 h GLY 254 CO -0.17 0.60 -0.03 0.83 0.00 0.00 0.00 176.54 177.76 2jj1 h GLU 255 N 0.95 0.00 0.20 4.80 5.08 0.80 -2.92 114.58 123.50 2jj1 h GLU 255 Ca 0.20 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 2jj1 h GLU 255 Cb 0.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.58 2jj1 h GLU 255 CO -0.00 0.03 -0.10 -0.92 -1.00 0.00 0.00 179.01 177.03 2jj1 h TYR 256 N 0.00 -0.25 -0.66 4.33 3.20 -1.41 -1.73 116.97 120.45 2jj1 h TYR 256 Ca -0.00 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 61.94 2jj1 h TYR 256 Cb 0.38 0.08 -0.06 0.00 1.54 0.00 0.00 36.73 38.67 2jj1 h TYR 256 CO 0.00 0.02 0.34 0.74 -1.64 0.00 0.00 178.16 177.62 2jj1 h PHE 257 N -0.51 0.61 -0.97 -3.82 -1.00 -1.69 -2.95 116.94 106.62 2jj1 h PHE 257 Ca -0.03 0.03 0.07 0.00 2.81 0.00 0.00 57.97 60.85 2jj1 h PHE 257 Cb 0.39 -0.18 -0.07 0.00 3.61 0.00 0.00 35.95 39.70 2jj1 h PHE 257 CO 0.00 0.26 0.62 -0.09 -1.61 0.00 0.00 178.31 177.49 2jj1 h ARG 258 N 0.61 1.09 -0.14 1.51 2.43 -1.29 -0.45 114.38 118.15 2jj1 h ARG 258 Ca 0.31 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.41 2jj1 h ARG 258 Cb 0.26 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 2jj1 h ARG 258 CO -0.22 0.72 0.00 -0.25 -1.51 0.00 0.00 179.97 178.71 2jj1 n ASP 259 N -4.54 2.67 -2.16 -3.80 8.00 -0.68 -3.72 116.55 112.32 2jj1 n ASP 259 Ca 0.15 -1.87 -0.22 0.00 0.71 0.00 0.00 54.79 53.56 2jj1 n ASP 259 Cb 0.19 -0.08 0.02 0.00 -0.02 0.00 0.00 41.12 41.23 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 1.03 4.60 -1.94 -2.24 3.02 -0.96 -4.85 115.26 113.92 2jj1 n ASN 260 Ca 0.17 -3.60 -0.19 0.00 -0.03 0.00 0.00 54.58 50.92 2jj1 n ASN 260 Cb 0.52 -0.37 -0.05 0.00 -0.61 0.00 0.00 39.78 39.27 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 -0.66 0.78 3.63 7.41 0.00 -1.23 -4.96 105.19 110.17 2jj1 n GLY 261 Ca 0.40 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.16 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 -4.27 2.02 -0.06 1.61 1.02 -0.22 -4.52 119.74 115.32 2jj1 s LYS 262 Ca 0.00 -1.90 0.06 0.00 0.02 0.00 0.00 55.97 54.14 2jj1 s LYS 262 Cb 0.00 -1.81 -0.01 0.00 -0.52 0.00 0.00 37.83 35.48 2jj1 s LYS 262 CO 0.00 0.04 -0.24 -1.01 -0.92 0.00 0.00 175.35 173.22 2jj1 s HIS 263 N -2.60 2.46 0.10 3.18 3.76 -1.26 -1.63 115.29 119.30 2jj1 s HIS 263 Ca 0.36 -0.72 0.04 0.00 -0.15 0.00 0.00 55.06 54.59 2jj1 s HIS 263 Cb 0.04 -1.61 -0.04 0.00 1.11 0.00 0.00 32.58 32.08 2jj1 s HIS 263 CO 0.19 -0.21 -0.10 0.00 -0.85 0.00 0.00 174.74 173.76 2jj1 s ALA 264 N -0.14 1.17 -0.07 -1.40 0.00 -1.09 -1.53 121.76 118.71 2jj1 s ALA 264 Ca -0.04 -1.24 0.02 0.00 0.00 0.00 0.00 51.96 50.70 2jj1 s ALA 264 Cb -0.14 0.03 0.02 0.00 0.00 0.00 0.00 23.12 23.03 2jj1 s ALA 264 CO 0.04 -0.04 -0.10 -1.17 0.00 0.00 0.00 175.76 174.49 2jj1 s LEU 265 N -2.56 1.53 -0.08 0.00 2.96 0.88 -0.71 118.68 120.70 2jj1 s LEU 265 Ca 0.07 -0.26 0.03 0.00 -0.22 0.00 0.00 54.13 53.75 2jj1 s LEU 265 Cb -0.02 -0.74 0.01 0.00 0.50 0.00 0.00 46.19 45.93 2jj1 s LEU 265 CO 0.00 -0.00 -0.17 -0.51 -1.32 0.00 0.00 176.35 174.35 2jj1 s ILE 266 N 0.83 1.50 -0.13 6.68 2.07 0.38 0.64 121.20 133.16 2jj1 s ILE 266 Ca -0.12 -0.68 -0.03 0.00 -1.41 0.00 0.00 60.65 58.41 2jj1 s ILE 266 Cb -0.15 -1.34 -0.03 0.00 0.13 0.00 0.00 42.46 41.07 2jj1 s ILE 266 CO 0.02 0.44 -0.02 -0.63 -1.91 0.00 0.00 174.94 172.83 2jj1 s ILE 267 N 0.62 4.08 -0.47 2.00 1.09 0.13 -1.00 121.20 127.64 2jj1 s ILE 267 Ca -0.15 -0.31 -0.03 0.00 -1.10 0.00 0.00 60.65 59.06 2jj1 s ILE 267 Cb -0.16 -2.76 0.12 0.00 -1.06 0.00 0.00 42.46 38.60 2jj1 s ILE 267 CO 0.05 0.53 0.28 -0.31 -0.10 0.00 0.00 174.94 175.39 2jj1 s TYR 268 N -0.10 3.53 -0.43 3.97 1.51 -1.09 -0.25 117.35 124.49 2jj1 s TYR 268 Ca 0.03 -2.46 0.03 0.00 -1.01 0.00 0.00 57.07 53.66 2jj1 s TYR 268 Cb -0.13 -3.24 0.12 0.00 -0.11 0.00 0.00 41.96 38.60 2jj1 s TYR 268 CO 0.02 -0.94 0.17 0.34 -1.11 0.00 0.00 175.55 174.03 2jj1 s ASP 269 N 1.59 4.67 0.18 2.29 -1.08 0.52 -1.22 116.67 123.63 2jj1 s ASP 269 Ca 0.10 -2.52 0.03 0.00 -0.52 0.00 0.00 52.55 49.64 2jj1 s ASP 269 Cb -0.22 -1.67 -0.05 0.00 -1.46 0.00 0.00 42.92 39.52 2jj1 s ASP 269 CO -0.04 -0.34 -0.03 1.51 0.52 0.00 0.00 175.17 176.79 2jj1 s ASP 270 N 0.51 1.60 0.01 -0.34 1.47 -1.18 -0.10 116.67 118.64 2jj1 s ASP 270 Ca 0.13 -1.13 0.27 0.00 1.18 0.00 0.00 52.55 53.01 2jj1 s ASP 270 Cb -0.22 0.04 0.92 0.00 -0.34 0.00 0.00 42.92 43.32 2jj1 s ASP 270 CO -0.04 -0.47 1.71 0.18 0.68 0.00 0.00 175.17 177.23 2jj1 n LEU 271 N -0.28 0.23 0.07 2.11 4.77 0.51 -2.92 117.00 121.49 2jj1 n LEU 271 Ca -0.07 0.30 -0.13 0.00 -0.03 0.00 0.00 56.01 56.08 2jj1 n LEU 271 Cb 0.63 -0.39 -0.08 0.00 -2.33 0.00 0.00 43.42 41.25 2jj1 n LEU 271 CO 0.34 0.04 0.81 0.28 -1.33 0.00 0.00 177.39 177.53 2jj1 h SER 272 N 0.00 -0.08 0.31 -1.43 0.02 -1.93 -1.45 113.55 108.99 2jj1 h SER 272 Ca 0.00 -0.07 -0.11 0.00 -0.84 0.00 0.00 61.79 60.78 2jj1 h SER 272 Cb 0.51 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.06 2jj1 h SER 272 CO 0.00 0.02 -0.44 0.11 -1.14 0.00 0.00 176.83 175.38 2jj1 h LYS 273 N -0.17 0.16 -0.27 3.45 1.57 -1.85 -1.50 116.57 117.96 2jj1 h LYS 273 Ca -0.01 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 2jj1 h LYS 273 Cb 0.14 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 2jj1 h LYS 273 CO 0.02 0.57 0.14 0.37 -0.57 0.00 0.00 179.45 179.98 2jj1 h GLN 274 N 0.14 0.38 -0.84 3.15 4.15 -1.47 -2.24 115.11 118.38 2jj1 h GLN 274 Ca 0.01 -0.05 0.03 0.00 0.77 0.00 0.00 58.65 59.41 2jj1 h GLN 274 Cb 0.83 -0.07 -0.05 0.00 0.21 0.00 0.00 27.48 28.40 2jj1 h GLN 274 CO 0.06 0.35 0.54 0.00 -1.93 0.00 0.00 178.83 177.86 2jj1 h ALA 275 N 1.01 1.10 -0.97 3.38 0.00 -0.46 0.04 119.26 123.36 2jj1 h ALA 275 Ca 0.09 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.00 2jj1 h ALA 275 Cb 0.08 -0.30 -0.06 0.00 0.00 0.00 0.00 17.79 17.52 2jj1 h ALA 275 CO -0.01 0.39 0.64 0.28 0.00 0.00 0.00 179.25 180.54 2jj1 h VAL 276 N 1.07 1.17 -0.09 0.00 2.07 -1.13 0.53 116.25 119.87 2jj1 h VAL 276 Ca 0.33 -0.42 -0.16 0.00 0.82 0.00 0.00 66.70 67.27 2jj1 h VAL 276 Cb -0.01 -0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 29.58 2jj1 h VAL 276 CO -0.11 0.23 -0.65 0.00 0.02 0.00 0.00 177.57 177.06 2jj1 h ALA 277 N 1.43 0.73 -0.05 1.67 0.00 -0.61 -1.78 119.26 120.65 2jj1 h ALA 277 Ca 0.39 -0.57 -0.23 0.00 0.00 0.00 0.00 54.91 54.50 2jj1 h ALA 277 Cb -0.00 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 17.73 2jj1 h ALA 277 CO -0.12 0.74 -0.87 -0.92 0.00 0.00 0.00 179.25 178.08 2jj1 h TYR 278 N 0.24 0.98 -0.75 0.00 3.20 -0.60 -1.92 116.97 118.12 2jj1 h TYR 278 Ca -0.01 -0.50 0.11 0.00 3.14 0.00 0.00 58.73 61.47 2jj1 h TYR 278 Cb 1.19 -0.13 -0.08 0.00 1.54 0.00 0.00 36.73 39.25 2jj1 h TYR 278 CO 0.03 1.33 0.37 -0.09 -1.64 0.00 0.00 178.16 178.16 2jj1 h ARG 279 N 0.35 0.58 0.73 1.82 2.43 -0.88 0.28 114.38 119.70 2jj1 h ARG 279 Ca -0.09 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.01 2jj1 h ARG 279 Cb 1.53 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.95 2jj1 h ARG 279 CO 0.17 0.39 -0.41 0.37 -1.51 0.00 0.00 179.97 178.98 2jj1 h GLN 280 N 0.60 -1.02 -0.75 0.20 4.15 -1.24 -2.00 115.11 115.04 2jj1 h GLN 280 Ca 0.38 0.07 0.15 0.00 0.77 0.00 0.00 58.65 60.02 2jj1 h GLN 280 Cb 0.46 0.23 -0.10 0.00 0.21 0.00 0.00 27.48 28.28 2jj1 h GLN 280 CO -0.30 -0.68 0.27 1.98 -1.93 0.00 0.00 178.83 178.17 2jj1 h MET 281 N -1.06 0.38 -0.61 1.69 4.05 -1.11 -2.18 114.93 116.08 2jj1 h MET 281 Ca -0.10 -0.02 -0.07 0.00 -0.28 0.00 0.00 59.70 59.22 2jj1 h MET 281 Cb 0.84 -0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 31.53 2jj1 h MET 281 CO 0.12 0.25 0.09 1.03 0.23 0.00 0.00 176.91 178.64 2jj1 h SER 282 N 0.40 0.98 0.07 1.39 0.87 -0.40 -2.68 113.55 114.19 2jj1 h SER 282 Ca 0.42 -0.26 -0.16 0.00 -1.23 0.00 0.00 61.79 60.56 2jj1 h SER 282 Cb 0.67 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.36 2jj1 h SER 282 CO -0.44 1.00 -0.55 -0.07 -0.53 0.00 0.00 176.83 176.24 2jj1 h LEU 283 N 0.93 0.56 -0.80 2.23 3.38 -0.75 -1.80 115.31 119.05 2jj1 h LEU 283 Ca 0.19 -0.30 -0.05 0.00 0.09 0.00 0.00 57.88 57.81 2jj1 h LEU 283 Cb 0.43 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 2jj1 h LEU 283 CO 0.01 1.00 -0.23 -0.07 0.09 0.00 0.00 178.44 179.24 2jj1 h LEU 284 N 0.39 0.00 -0.00 1.67 3.38 -1.43 -1.64 115.31 117.68 2jj1 h LEU 284 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2jj1 h LEU 284 Cb 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 2jj1 h LEU 284 CO 0.10 0.23 0.00 0.18 0.09 0.00 0.00 178.44 179.04 2jj1 n LEU 285 N -3.29 0.00 -1.67 1.67 4.77 -1.01 -4.89 117.00 112.57 2jj1 n LEU 285 Ca 0.01 -0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.81 2jj1 n LEU 285 Cb 0.49 -0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.53 2jj1 n LEU 285 CO 0.34 0.00 -0.20 0.54 -1.33 0.00 0.00 177.39 176.74 2jj1 n ARG 286 N -0.50 -1.32 -2.81 3.23 5.12 -0.62 -4.99 116.66 114.77 2jj1 n ARG 286 Ca 0.00 1.01 -0.42 0.00 -1.93 0.00 0.00 57.85 56.50 2jj1 n ARG 286 Cb 0.00 -5.37 -0.04 0.00 -1.16 0.00 0.00 32.46 25.89 2jj1 n ARG 286 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 2jj1 s ARG 287 N -4.15 3.90 0.13 5.56 0.52 -0.69 -4.99 118.95 119.24 2jj1 s ARG 287 Ca 0.00 0.66 -0.35 0.00 -0.52 0.00 0.00 55.73 55.52 2jj1 s ARG 287 Cb 0.00 -3.78 -0.15 0.00 0.52 0.00 0.00 34.95 31.54 2jj1 s ARG 287 CO 0.00 -0.89 1.44 -2.30 0.02 0.00 0.00 175.30 173.57 2jj1 n PRO 288 N 6.68 1.65 -1.28 3.54 -0.02 -1.26 -4.39 135.00 139.92 2jj1 n PRO 288 Ca 0.07 0.60 -0.33 0.00 -2.02 0.00 0.00 63.50 61.81 2jj1 n PRO 288 Cb 0.48 -2.29 0.11 0.00 -0.02 0.00 0.00 33.50 31.78 2jj1 n PRO 288 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2jj1 s PRO 289 N 0.57 1.92 0.00 0.52 0.04 -1.26 -4.70 135.00 132.08 2jj1 s PRO 289 Ca 0.80 1.68 0.00 0.00 0.04 0.00 0.00 61.00 63.53 2jj1 s PRO 289 Cb -0.81 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 31.92 2jj1 s PRO 289 CO 0.43 -1.98 0.00 0.41 0.04 0.00 0.00 177.00 175.90 2jj1 n GLY 290 N 0.26 5.64 3.60 0.56 0.00 0.20 -4.90 105.19 110.55 2jj1 n GLY 290 Ca 0.13 -1.67 -0.48 0.00 0.00 0.00 0.00 46.02 44.00 2jj1 n GLY 290 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2jj1 n ARG 291 N 0.00 1.40 -2.41 1.61 0.63 -1.25 -0.24 116.66 116.40 2jj1 n ARG 291 Ca 0.00 0.50 -0.08 0.00 -0.92 0.00 0.00 57.85 57.34 2jj1 n ARG 291 Cb 0.00 -2.04 -0.01 0.00 0.45 0.00 0.00 32.46 30.87 2jj1 n ARG 291 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 2jj1 n GLU 292 N 1.81 -2.42 0.00 -0.14 1.02 -1.26 -2.13 120.64 117.52 2jj1 n GLU 292 Ca 0.14 0.41 0.00 0.00 -0.02 0.00 0.00 57.16 57.69 2jj1 n GLU 292 Cb 0.27 -4.96 0.00 0.00 -0.02 0.00 0.00 31.44 26.72 2jj1 n GLU 292 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2jj1 n ALA 293 N -2.22 0.00 -1.22 0.62 0.00 0.66 -5.00 120.51 113.35 2jj1 n ALA 293 Ca -0.10 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.04 2jj1 n ALA 293 Cb 0.56 0.00 0.11 0.00 0.00 0.00 0.00 19.45 20.13 2jj1 n ALA 293 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2jj1 s TYR 294 N -2.03 2.45 0.80 0.00 1.51 -0.91 -4.11 117.35 115.06 2jj1 s TYR 294 Ca 0.00 1.44 -0.11 0.00 -1.01 0.00 0.00 57.07 57.39 2jj1 s TYR 294 Cb 0.00 -3.10 0.07 0.00 -0.11 0.00 0.00 41.96 38.82 2jj1 s TYR 294 CO 0.00 -2.07 1.09 -2.14 -1.11 0.00 0.00 175.55 171.32 2jj1 s PRO 295 N -4.91 2.06 0.35 -1.71 0.02 -1.26 0.58 135.00 130.13 2jj1 s PRO 295 Ca 0.62 0.77 0.25 0.00 0.02 0.00 0.00 61.00 62.66 2jj1 s PRO 295 Cb -0.18 -1.91 1.26 0.00 0.02 0.00 0.00 34.50 33.70 2jj1 s PRO 295 CO 0.56 -1.67 1.76 0.78 -0.33 0.00 0.00 177.00 178.11 2jj1 h GLY 296 N -1.13 0.00 -1.47 0.52 0.00 -1.91 -2.44 103.07 96.64 2jj1 h GLY 296 Ca -0.47 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 46.80 2jj1 h GLY 296 CO 0.57 0.00 -0.04 2.09 0.00 0.00 0.00 176.54 179.16 2jj1 n ASP 297 N -2.37 3.10 -0.15 0.19 3.85 -1.26 -4.65 116.55 115.25 2jj1 n ASP 297 Ca -0.01 -3.31 0.27 0.00 -0.71 0.00 0.00 54.79 51.03 2jj1 n ASP 297 Cb 0.10 -0.56 0.71 0.00 -1.35 0.00 0.00 41.12 40.02 2jj1 n ASP 297 CO 0.00 0.00 0.00 1.62 -1.01 0.00 0.00 177.20 177.81 2jj1 h VAL 298 N 1.22 0.59 0.12 2.12 3.04 -1.80 -1.59 116.25 119.95 2jj1 h VAL 298 Ca 0.08 -0.01 -0.01 0.00 -1.01 0.00 0.00 66.70 65.75 2jj1 h VAL 298 Cb 1.44 0.56 0.00 0.00 -2.01 0.00 0.00 31.29 31.28 2jj1 h VAL 298 CO 0.24 0.00 -0.06 0.15 -1.01 0.00 0.00 177.57 176.89 2jj1 h PHE 299 N 0.02 -0.15 -0.55 3.17 3.57 -1.87 -2.89 116.94 118.23 2jj1 h PHE 299 Ca 0.40 -0.00 0.15 0.00 3.53 0.00 0.00 57.97 62.04 2jj1 h PHE 299 Cb 1.57 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 40.33 2jj1 h PHE 299 CO -0.00 0.16 0.39 -0.92 -2.23 0.00 0.00 178.31 175.72 2jj1 h TYR 300 N -0.48 0.10 -0.27 0.41 3.20 -1.71 0.46 116.97 118.68 2jj1 h TYR 300 Ca -0.02 0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.87 2jj1 h TYR 300 Cb 0.39 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.61 2jj1 h TYR 300 CO 0.03 0.04 0.14 1.25 -1.64 0.00 0.00 178.16 177.98 2jj1 h LEU 301 N 0.09 0.21 0.00 2.82 5.85 -1.10 -2.42 115.31 120.75 2jj1 h LEU 301 Ca 0.26 0.01 -0.18 0.00 0.84 0.00 0.00 57.88 58.82 2jj1 h LEU 301 Cb 0.94 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.91 2jj1 h LEU 301 CO -0.02 0.16 -1.11 0.45 -0.34 0.00 0.00 178.44 177.58 2jj1 h HIS 302 N 0.29 0.00 -0.35 1.25 3.86 -1.19 -3.34 115.15 115.67 2jj1 h HIS 302 Ca 0.11 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.31 2jj1 h HIS 302 Cb 0.02 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.48 2jj1 h HIS 302 CO -0.09 0.71 0.19 0.66 0.86 0.00 0.00 177.93 180.26 2jj1 h SER 303 N 0.00 0.44 0.38 2.45 4.64 0.14 -2.24 113.55 119.35 2jj1 h SER 303 Ca -0.10 -0.09 -0.19 0.00 -0.47 0.00 0.00 61.79 60.94 2jj1 h SER 303 Cb 1.63 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 63.61 2jj1 h SER 303 CO 0.07 0.40 -0.77 0.08 -0.87 0.00 0.00 176.83 175.74 2jj1 h ARG 304 N 0.44 0.32 -0.19 4.77 0.11 -1.61 -1.93 114.38 116.28 2jj1 h ARG 304 Ca 0.12 -0.28 0.03 0.00 0.10 0.00 0.00 59.98 59.95 2jj1 h ARG 304 Cb 0.06 0.07 -0.03 0.00 1.11 0.00 0.00 29.97 31.18 2jj1 h ARG 304 CO -0.02 0.95 0.01 1.25 0.10 0.00 0.00 179.97 182.26 2jj1 h LEU 305 N 0.21 -0.05 0.00 0.08 5.85 -1.66 -3.31 115.31 116.43 2jj1 h LEU 305 Ca -0.04 0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.61 2jj1 h LEU 305 Cb 1.36 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.43 2jj1 h LEU 305 CO 0.13 0.00 -1.01 -0.07 -0.34 0.00 0.00 178.44 177.15 2jj1 h LEU 306 N 0.08 0.00 -2.56 2.25 3.38 -1.27 -3.17 115.31 114.02 2jj1 h LEU 306 Ca 0.09 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 2jj1 h LEU 306 Cb 0.10 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 2jj1 h LEU 306 CO -0.14 0.43 -0.01 -0.33 0.09 0.00 0.00 178.44 178.48 2jj1 h GLU 307 N 0.00 0.00 0.00 1.13 4.39 -1.43 -1.71 114.58 116.96 2jj1 h GLU 307 Ca -0.08 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.62 2jj1 h GLU 307 Cb 1.40 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.05 2jj1 h GLU 307 CO 0.04 0.01 0.00 0.54 -1.16 0.00 0.00 179.01 178.44 2jj1 n ARG 308 N -3.20 0.19 -2.93 2.33 1.74 -1.20 -4.52 116.66 109.07 2jj1 n ARG 308 Ca -0.02 0.01 -0.41 0.00 -0.77 0.00 0.00 57.85 56.66 2jj1 n ARG 308 Cb 0.13 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.03 2jj1 n ARG 308 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2jj1 s ALA 309 N -2.80 3.49 -0.00 7.54 0.00 -0.64 -4.86 121.76 124.48 2jj1 s ALA 309 Ca 0.20 0.02 -0.28 0.00 0.00 0.00 0.00 51.96 51.90 2jj1 s ALA 309 Cb 0.19 -3.17 0.09 0.00 0.00 0.00 0.00 23.12 20.23 2jj1 s ALA 309 CO 0.48 -0.57 0.81 0.00 0.00 0.00 0.00 175.76 176.49 2jj1 s ALA 310 N 1.94 -1.78 -0.22 0.00 0.00 -0.76 -4.83 121.76 116.11 2jj1 s ALA 310 Ca 0.37 1.05 -0.04 0.00 0.00 0.00 0.00 51.96 53.35 2jj1 s ALA 310 Cb -0.17 0.25 -0.01 0.00 0.00 0.00 0.00 23.12 23.19 2jj1 s ALA 310 CO 0.13 -0.58 -0.04 0.21 0.00 0.00 0.00 175.76 175.47 2jj1 s LYS 311 N -2.58 3.38 0.19 0.00 2.47 -1.26 -0.90 119.74 121.04 2jj1 s LYS 311 Ca 0.00 -0.62 -0.09 0.00 -1.56 0.00 0.00 55.97 53.70 2jj1 s LYS 311 Cb -0.01 -3.01 -0.07 0.00 -1.46 0.00 0.00 37.83 33.29 2jj1 s LYS 311 CO -0.05 -0.19 0.49 -1.64 0.16 0.00 0.00 175.35 174.12 2jj1 s MET 312 N 1.47 3.76 0.87 4.03 -1.94 -0.32 -2.55 119.30 124.63 2jj1 s MET 312 Ca 0.06 0.18 -0.12 0.00 -1.71 0.00 0.00 55.69 54.10 2jj1 s MET 312 Cb -0.14 -2.75 0.16 0.00 2.01 0.00 0.00 34.83 34.11 2jj1 s MET 312 CO -0.03 0.39 1.22 0.54 -0.01 0.00 0.00 175.02 177.12 2jj1 s ASN 313 N -2.30 3.69 0.20 3.03 2.20 0.90 -3.87 114.94 118.80 2jj1 s ASN 313 Ca 0.44 0.25 -0.11 0.00 -0.94 0.00 0.00 52.86 52.49 2jj1 s ASN 313 Cb -0.12 -0.47 0.13 0.00 -2.00 0.00 0.00 41.25 38.79 2jj1 s ASN 313 CO 0.22 -2.36 1.86 0.44 -2.94 0.00 0.00 177.10 174.32 2jj1 h ASP 314 N -1.26 0.79 -0.14 3.54 3.32 -1.90 -0.52 116.42 120.24 2jj1 h ASP 314 Ca -0.43 -0.03 0.04 0.00 0.02 0.00 0.00 57.03 56.63 2jj1 h ASP 314 Cb 1.26 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.61 2jj1 h ASP 314 CO 0.44 0.59 0.19 0.00 -1.72 0.00 0.00 179.24 178.74 2jj1 h ALA 315 N 1.24 1.68 -0.02 3.45 0.00 -1.94 -1.28 119.26 122.40 2jj1 h ALA 315 Ca 0.25 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2jj1 h ALA 315 Cb -0.09 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2jj1 h ALA 315 CO -0.05 -0.26 -0.08 1.19 0.00 0.00 0.00 179.25 180.05 2jj1 n PHE 316 N -3.66 0.00 0.00 0.00 3.01 -0.45 -4.99 117.46 111.36 2jj1 n PHE 316 Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.47 2jj1 n PHE 316 Cb 0.30 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.77 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 0.92 1.66 2.37 1.37 0.00 -0.33 -4.73 105.19 106.44 2jj1 n GLY 317 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 1.28 3.79 -0.02 0.00 -0.71 -3.96 105.19 105.58 2jj1 n GLY 318 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.84 1.60 0.16 -0.02 0.00 -1.24 -4.71 107.32 101.27 2jj1 s GLY 319 Ca 0.00 -0.33 -0.11 0.00 0.00 0.00 0.00 44.72 44.28 2jj1 s GLY 319 CO 0.00 0.16 0.33 -1.35 0.00 0.00 0.00 173.10 172.25 2jj1 s SER 320 N -3.90 -0.03 -0.04 1.64 1.04 -0.65 -1.17 113.70 110.59 2jj1 s SER 320 Ca 0.62 -0.74 -0.00 0.00 0.48 0.00 0.00 55.95 56.31 2jj1 s SER 320 Cb -0.15 0.46 0.03 0.00 0.10 0.00 0.00 66.02 66.46 2jj1 s SER 320 CO 0.54 -0.91 -0.00 -0.22 0.98 0.00 0.00 173.24 173.63 2jj1 s LEU 321 N -2.93 1.00 -0.13 2.42 2.96 -0.08 -2.66 118.68 119.26 2jj1 s LEU 321 Ca 0.14 -0.04 -0.01 0.00 -0.22 0.00 0.00 54.13 54.00 2jj1 s LEU 321 Cb 0.02 -0.29 -0.02 0.00 0.50 0.00 0.00 46.19 46.41 2jj1 s LEU 321 CO -0.02 -0.12 -0.11 -0.89 -1.32 0.00 0.00 176.35 173.89 2jj1 s THR 322 N 1.27 3.27 0.05 3.68 2.01 0.11 -1.82 115.64 124.21 2jj1 s THR 322 Ca -0.06 -0.59 0.05 0.00 0.31 0.00 0.00 61.69 61.40 2jj1 s THR 322 Cb -0.13 -2.38 -0.04 0.00 0.01 0.00 0.00 72.50 69.96 2jj1 s THR 322 CO -0.02 0.52 -0.08 0.00 -0.69 0.00 0.00 174.62 174.35 2jj1 s ALA 323 N 0.29 2.98 -0.50 7.40 0.00 -0.70 -0.47 121.76 130.75 2jj1 s ALA 323 Ca -0.08 -1.13 0.04 0.00 0.00 0.00 0.00 51.96 50.79 2jj1 s ALA 323 Cb -0.15 -1.01 0.16 0.00 0.00 0.00 0.00 23.12 22.12 2jj1 s ALA 323 CO 0.05 0.63 0.36 -0.51 0.00 0.00 0.00 175.76 176.29 2jj1 s LEU 324 N -1.78 2.61 0.64 0.00 1.43 -0.17 -1.43 118.68 119.97 2jj1 s LEU 324 Ca 0.19 -3.18 -0.18 0.00 -1.03 0.00 0.00 54.13 49.93 2jj1 s LEU 324 Cb -0.11 -0.89 -0.01 0.00 0.03 0.00 0.00 46.19 45.21 2jj1 s LEU 324 CO 0.11 -0.17 1.25 -2.16 0.23 0.00 0.00 176.35 175.61 2jj1 s PRO 325 N -0.29 2.65 -0.11 1.29 0.04 -1.25 -2.65 135.00 134.68 2jj1 s PRO 325 Ca 0.27 1.93 0.02 0.00 0.04 0.00 0.00 61.00 63.25 2jj1 s PRO 325 Cb -0.05 -1.88 -0.01 0.00 0.04 0.00 0.00 34.50 32.60 2jj1 s PRO 325 CO -0.14 -1.48 -0.17 0.08 0.04 0.00 0.00 177.00 175.33 2jj1 s VAL 326 N -1.56 2.74 -0.06 -0.36 1.01 -0.35 -1.28 120.40 120.54 2jj1 s VAL 326 Ca 0.79 -0.78 0.04 0.00 0.00 0.00 0.00 61.98 62.03 2jj1 s VAL 326 Cb -0.34 -2.12 0.00 0.00 0.00 0.00 0.00 36.38 33.93 2jj1 s VAL 326 CO 0.38 0.54 -0.17 -0.63 0.00 0.00 0.00 175.10 175.22 2jj1 s ILE 327 N 0.25 1.42 -0.11 2.22 -1.09 -0.83 -0.37 121.20 122.70 2jj1 s ILE 327 Ca -0.11 -0.68 -0.17 0.00 -2.23 0.00 0.00 60.65 57.45 2jj1 s ILE 327 Cb -0.16 -1.24 -0.04 0.00 -1.58 0.00 0.00 42.46 39.43 2jj1 s ILE 327 CO 0.06 0.41 0.45 -0.70 -1.23 0.00 0.00 174.94 173.94 2jj1 s GLU 328 N 0.27 4.30 0.51 2.79 2.12 -1.26 -2.61 118.70 124.81 2jj1 s GLU 328 Ca -0.09 0.41 0.04 0.00 0.36 0.00 0.00 54.97 55.69 2jj1 s GLU 328 Cb -0.14 -3.42 0.03 0.00 0.26 0.00 0.00 34.13 30.87 2jj1 s GLU 328 CO 0.04 0.22 0.71 0.95 -0.54 0.00 0.00 175.26 176.63 2jj1 s THR 329 N 0.45 2.75 -0.31 -1.70 -4.23 -0.75 -4.92 115.64 106.92 2jj1 s THR 329 Ca 0.25 -0.81 -0.03 0.00 -1.18 0.00 0.00 61.69 59.93 2jj1 s THR 329 Cb -0.15 -2.94 0.05 0.00 1.34 0.00 0.00 72.50 70.80 2jj1 s THR 329 CO 0.10 0.00 0.02 -1.10 -0.54 0.00 0.00 174.62 173.10 2jj1 s GLN 330 N -4.62 2.45 -1.17 3.99 -1.52 -1.26 -4.50 119.66 113.04 2jj1 s GLN 330 Ca 0.57 -1.26 -0.04 0.00 -1.95 0.00 0.00 55.36 52.68 2jj1 s GLN 330 Cb -0.10 -3.24 -0.02 0.00 -0.22 0.00 0.00 33.01 29.43 2jj1 s GLN 330 CO 0.37 -0.64 0.89 0.00 -0.25 0.00 0.00 175.29 175.66 2jj1 n ALA 331 N 4.65 -2.24 -1.15 6.09 0.00 -1.26 -3.45 120.51 123.15 2jj1 n ALA 331 Ca -0.13 -0.03 -0.05 0.00 0.00 0.00 0.00 53.44 53.22 2jj1 n ALA 331 Cb 0.44 -3.66 -0.02 0.00 0.00 0.00 0.00 19.45 16.20 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 -1.32 0.68 3.22 0.00 0.00 -1.26 -4.94 105.19 101.56 2jj1 n GLY 332 Ca -0.20 -0.18 -0.44 0.00 0.00 0.00 0.00 46.02 45.21 2jj1 n GLY 332 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2jj1 n ASP 333 N -0.39 5.32 0.05 1.61 4.64 -1.22 -4.80 116.55 121.75 2jj1 n ASP 333 Ca -0.05 -3.07 0.03 0.00 -1.38 0.00 0.00 54.79 50.32 2jj1 n ASP 333 Cb 0.35 -1.49 0.16 0.00 -1.04 0.00 0.00 41.12 39.10 2jj1 n ASP 333 CO 0.00 0.00 0.00 1.33 -0.82 0.00 0.00 177.20 177.71 2jj1 n VAL 334 N 3.69 1.53 0.87 5.18 0.24 -1.26 -2.35 118.33 126.22 2jj1 n VAL 334 Ca 0.35 0.57 0.12 0.00 -2.04 0.00 0.00 64.34 63.35 2jj1 n VAL 334 Cb 0.39 -1.57 0.21 0.00 -1.47 0.00 0.00 33.84 31.40 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 -1.67 2.87 -4.78 -1.34 7.64 -1.26 -4.09 113.62 110.98 2jj1 n SER 335 Ca -0.00 -1.92 -0.32 0.00 1.01 0.00 0.00 58.87 57.64 2jj1 n SER 335 Cb 0.07 -0.08 0.06 0.00 -1.01 0.00 0.00 64.21 63.24 2jj1 n SER 335 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jj1 s ALA 336 N -1.83 2.46 0.05 -0.43 0.00 -0.99 -4.73 121.76 116.29 2jj1 s ALA 336 Ca 0.33 0.35 -0.10 0.00 0.00 0.00 0.00 51.96 52.54 2jj1 s ALA 336 Cb 0.21 -3.27 -0.02 0.00 0.00 0.00 0.00 23.12 20.04 2jj1 s ALA 336 CO 0.31 -1.38 0.95 0.98 0.00 0.00 0.00 175.76 176.62 2jj1 n TYR 337 N -2.87 -0.14 0.41 0.00 9.36 -1.26 -1.15 117.16 121.51 2jj1 n TYR 337 Ca 0.09 0.41 -0.18 0.00 3.32 0.00 0.00 57.90 61.54 2jj1 n TYR 337 Cb 0.53 -0.46 -0.09 0.00 -0.63 0.00 0.00 39.34 38.69 2jj1 n TYR 337 CO 0.00 0.00 0.00 0.82 0.22 0.00 0.00 176.86 177.90 2jj1 h ILE 338 N 0.00 0.18 -0.79 2.97 5.03 -1.98 -1.44 117.51 121.47 2jj1 h ILE 338 Ca 0.05 -0.12 0.14 0.00 -0.12 0.00 0.00 64.86 64.82 2jj1 h ILE 338 Cb 0.13 0.20 -0.14 0.00 -3.03 0.00 0.00 36.82 33.98 2jj1 h ILE 338 CO -0.31 0.01 -0.31 -0.65 -0.68 0.00 0.00 178.15 176.21 2jj1 h PRO 339 N -1.13 -0.06 -0.59 2.37 0.11 -1.84 -0.36 132.00 130.50 2jj1 h PRO 339 Ca -0.11 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.00 2jj1 h PRO 339 Cb 0.81 0.01 -0.03 0.00 0.11 0.00 0.00 31.00 31.91 2jj1 h PRO 339 CO 0.17 -0.04 0.33 1.79 -0.21 0.00 0.00 178.00 180.05 2jj1 h THR 340 N -0.06 1.17 -0.28 -1.15 1.35 -1.01 -0.87 112.91 112.06 2jj1 h THR 340 Ca 0.32 -0.41 0.06 0.00 -0.55 0.00 0.00 66.41 65.83 2jj1 h THR 340 Cb 0.58 0.37 -0.08 0.00 -1.73 0.00 0.00 68.15 67.29 2jj1 h THR 340 CO -0.83 0.19 -0.35 0.78 -0.25 0.00 0.00 175.52 175.06 2jj1 h ASN 341 N 0.81 -1.12 -0.28 5.36 4.21 0.06 -0.60 115.58 124.02 2jj1 h ASN 341 Ca 0.21 0.18 -0.06 0.00 1.21 0.00 0.00 56.30 57.84 2jj1 h ASN 341 Cb -0.00 0.50 -0.01 0.00 -1.12 0.00 0.00 38.32 37.69 2jj1 h ASN 341 CO -0.04 -0.35 -0.04 0.58 -1.29 0.00 0.00 177.43 176.29 2jj1 h VAL 342 N -0.33 1.27 -0.85 2.81 2.07 -1.02 -1.94 116.25 118.26 2jj1 h VAL 342 Ca 0.13 -1.04 0.19 0.00 0.82 0.00 0.00 66.70 66.80 2jj1 h VAL 342 Cb 0.56 1.39 -0.06 0.00 -1.52 0.00 0.00 31.29 31.66 2jj1 h VAL 342 CO -0.47 0.33 0.57 0.40 0.02 0.00 0.00 177.57 178.42 2jj1 h ILE 343 N 0.28 0.71 0.00 4.57 2.04 -1.02 0.37 117.51 124.46 2jj1 h ILE 343 Ca 0.07 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.80 2jj1 h ILE 343 Cb 0.51 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 36.88 2jj1 h ILE 343 CO 0.02 0.07 0.00 -1.54 0.00 0.00 0.00 178.15 176.70 2jj1 n SER 344 N -4.49 0.00 -0.11 1.72 3.41 -0.24 -3.35 113.62 110.56 2jj1 n SER 344 Ca 0.17 0.08 -0.24 0.00 -0.26 0.00 0.00 58.87 58.63 2jj1 n SER 344 Cb 0.66 -0.36 -0.11 0.00 -0.26 0.00 0.00 64.21 64.14 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 -1.36 1.54 -1.67 -1.33 5.41 0.12 -5.05 119.36 117.03 2jj1 n ILE 345 Ca 0.12 -0.17 -0.29 0.00 1.00 0.00 0.00 62.75 63.40 2jj1 n ILE 345 Cb 0.27 -1.97 0.10 0.00 -0.71 0.00 0.00 39.64 37.33 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 -2.42 2.56 -0.46 1.39 -4.23 -0.68 -4.95 115.64 106.84 2jj1 s THR 346 Ca -0.32 0.18 -0.03 0.00 -1.18 0.00 0.00 61.69 60.35 2jj1 s THR 346 Cb 0.09 -3.02 0.16 0.00 1.34 0.00 0.00 72.50 71.07 2jj1 s THR 346 CO 0.57 -0.24 2.43 0.47 -0.54 0.00 0.00 174.62 177.32 2jj1 n ASP 347 N -3.46 6.66 0.00 3.99 8.00 0.11 -4.94 116.55 126.92 2jj1 n ASP 347 Ca 0.07 -3.27 0.00 0.00 0.71 0.00 0.00 54.79 52.30 2jj1 n ASP 347 Cb 0.58 -1.15 0.00 0.00 -0.02 0.00 0.00 41.12 40.54 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 0.46 1.75 3.40 0.44 0.00 -1.25 -0.75 105.19 109.24 2jj1 n GLY 348 Ca 0.45 -2.09 -0.15 0.00 0.00 0.00 0.00 46.02 44.23 2jj1 n GLY 348 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2jj1 s GLN 349 N -1.43 0.97 -0.33 1.61 0.00 -0.77 -2.28 119.66 117.43 2jj1 s GLN 349 Ca 0.00 -0.06 -0.04 0.00 -0.00 0.00 0.00 55.36 55.25 2jj1 s GLN 349 Cb 0.00 0.45 0.05 0.00 0.00 0.00 0.00 33.01 33.50 2jj1 s GLN 349 CO 0.00 -0.32 0.07 0.42 0.00 0.00 0.00 175.29 175.46 2jj1 s ILE 350 N -1.80 3.46 -0.24 3.63 1.01 0.47 -1.89 121.20 125.83 2jj1 s ILE 350 Ca -0.09 -1.29 -0.16 0.00 0.00 0.00 0.00 60.65 59.12 2jj1 s ILE 350 Cb -0.01 -3.00 -0.04 0.00 0.01 0.00 0.00 42.46 39.42 2jj1 s ILE 350 CO 0.03 -0.19 0.40 0.12 0.00 0.00 0.00 174.94 175.31 2jj1 s PHE 351 N 1.33 3.29 0.03 3.97 5.36 -1.25 -0.31 117.98 130.40 2jj1 s PHE 351 Ca -0.02 0.51 -0.01 0.00 -0.96 0.00 0.00 56.93 56.45 2jj1 s PHE 351 Cb -0.20 -2.57 -0.04 0.00 -0.34 0.00 0.00 43.02 39.87 2jj1 s PHE 351 CO 0.01 -0.16 0.18 -0.51 -1.46 0.00 0.00 175.22 173.28 2jj1 s LEU 352 N 1.83 4.27 0.02 6.12 1.43 0.11 -1.29 118.68 131.17 2jj1 s LEU 352 Ca 0.17 0.26 0.02 0.00 -1.03 0.00 0.00 54.13 53.56 2jj1 s LEU 352 Cb -0.15 -2.72 -0.01 0.00 0.03 0.00 0.00 46.19 43.34 2jj1 s LEU 352 CO 0.09 0.22 -0.07 -1.61 0.23 0.00 0.00 176.35 175.20 2jj1 s GLU 353 N -2.20 0.53 0.10 1.70 2.02 -0.74 -4.14 118.70 115.97 2jj1 s GLU 353 Ca 0.30 -0.47 -0.15 0.00 0.02 0.00 0.00 54.97 54.67 2jj1 s GLU 353 Cb -0.13 -0.43 -0.08 0.00 0.10 0.00 0.00 34.13 33.60 2jj1 s GLU 353 CO 0.23 0.10 1.44 1.79 0.02 0.00 0.00 175.26 178.84 2jj1 h THR 354 N 4.76 1.30 -0.50 3.63 1.35 -1.92 -0.89 112.91 120.64 2jj1 h THR 354 Ca -0.32 -1.36 0.08 0.00 -0.55 0.00 0.00 66.41 64.26 2jj1 h THR 354 Cb 1.19 1.52 -0.06 0.00 -1.73 0.00 0.00 68.15 69.07 2jj1 h THR 354 CO 0.46 0.44 0.15 -0.08 -0.25 0.00 0.00 175.52 176.23 2jj1 h GLU 355 N 0.42 0.30 0.22 4.72 4.81 -1.98 0.29 114.58 123.36 2jj1 h GLU 355 Ca 0.06 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 2jj1 h GLU 355 Cb 0.77 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.08 2jj1 h GLU 355 CO 0.06 0.20 -0.10 -0.07 -0.73 0.00 0.00 179.01 178.36 2jj1 h LEU 356 N 0.31 -0.25 -0.73 1.64 3.38 -1.86 -0.80 115.31 117.00 2jj1 h LEU 356 Ca 0.25 -0.10 0.15 0.00 0.09 0.00 0.00 57.88 58.26 2jj1 h LEU 356 Cb 0.30 0.06 -0.14 0.00 0.09 0.00 0.00 40.66 40.97 2jj1 h LEU 356 CO -0.28 -0.05 -0.16 0.15 0.09 0.00 0.00 178.44 178.19 2jj1 h PHE 357 N -0.44 -0.35 0.00 1.13 3.57 -0.17 -0.45 116.94 120.23 2jj1 h PHE 357 Ca -0.03 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.53 2jj1 h PHE 357 Cb 0.34 0.27 0.00 0.00 2.79 0.00 0.00 35.95 39.34 2jj1 h PHE 357 CO -0.02 -0.31 -0.38 1.88 -2.23 0.00 0.00 178.31 177.26 2jj1 h TYR 358 N 0.01 0.00 0.00 0.41 -1.99 -0.46 -2.99 116.97 111.96 2jj1 h TYR 358 Ca 0.36 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.09 2jj1 h TYR 358 Cb 0.55 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.28 2jj1 h TYR 358 CO -0.56 0.00 0.00 1.63 -0.00 0.00 0.00 178.16 179.23 2jj1 n LYS 359 N -2.44 0.20 0.00 4.88 5.02 -0.26 -4.86 118.16 120.69 2jj1 n LYS 359 Ca 0.04 0.38 0.00 0.00 -2.02 0.00 0.00 58.31 56.71 2jj1 n LYS 359 Cb 0.47 -1.84 0.00 0.00 -0.02 0.00 0.00 35.03 33.64 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 0.21 0.86 3.56 0.72 0.00 -0.93 -5.04 105.19 104.59 2jj1 n GLY 360 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 2jj1 n GLY 360 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jj1 s ILE 361 N -2.00 3.98 -0.11 -0.61 -1.09 -0.72 -4.93 121.20 115.73 2jj1 s ILE 361 Ca 0.00 -1.10 0.01 0.00 -2.23 0.00 0.00 60.65 57.33 2jj1 s ILE 361 Cb 0.00 -5.10 0.02 0.00 -1.58 0.00 0.00 42.46 35.80 2jj1 s ILE 361 CO 0.00 -1.96 -0.14 -0.13 -1.23 0.00 0.00 174.94 171.48 2jj1 s ARG 362 N 4.75 2.14 0.24 2.79 0.52 -1.26 -2.51 118.95 125.61 2jj1 s ARG 362 Ca 0.48 -0.52 -0.31 0.00 -0.52 0.00 0.00 55.73 54.86 2jj1 s ARG 362 Cb 0.01 -1.87 -0.12 0.00 0.52 0.00 0.00 34.95 33.49 2jj1 s ARG 362 CO -0.05 -0.11 1.66 -0.35 0.02 0.00 0.00 175.30 176.47 2jj1 n PRO 363 N 4.34 2.69 -0.86 3.54 -0.04 -1.25 -1.58 135.00 141.85 2jj1 n PRO 363 Ca -0.18 0.96 -0.10 0.00 -0.04 0.00 0.00 63.50 64.14 2jj1 n PRO 363 Cb 0.51 -2.78 -0.14 0.00 -0.04 0.00 0.00 33.50 31.06 2jj1 n PRO 363 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jj1 n ALA 364 N 3.14 5.64 -2.52 0.55 0.00 -1.05 -4.88 120.51 121.40 2jj1 n ALA 364 Ca 0.13 -1.49 -0.42 0.00 0.00 0.00 0.00 53.44 51.66 2jj1 n ALA 364 Cb 0.35 -2.19 -0.03 0.00 0.00 0.00 0.00 19.45 17.58 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 1.10 4.40 -0.44 0.00 1.01 -1.26 -1.79 121.20 124.23 2jj1 s ILE 365 Ca 0.54 1.70 -0.23 0.00 0.00 0.00 0.00 60.65 62.67 2jj1 s ILE 365 Cb 0.26 -4.10 0.02 0.00 0.01 0.00 0.00 42.46 38.66 2jj1 s ILE 365 CO 0.00 -0.03 0.78 0.21 0.00 0.00 0.00 174.94 175.90 2jj1 s ASN 366 N 1.44 6.43 0.11 3.58 3.84 -0.41 -4.97 114.94 124.96 2jj1 s ASN 366 Ca 0.53 -0.04 -0.18 0.00 0.21 0.00 0.00 52.86 53.38 2jj1 s ASN 366 Cb -0.22 -2.38 -0.05 0.00 -0.55 0.00 0.00 41.25 38.05 2jj1 s ASN 366 CO 0.19 -0.88 1.64 0.58 -2.79 0.00 0.00 177.10 175.84 2jj1 h VAL 367 N 5.94 1.19 -0.91 -5.21 2.07 -1.92 -2.46 116.25 114.95 2jj1 h VAL 367 Ca -0.25 -0.60 0.15 0.00 0.82 0.00 0.00 66.70 66.82 2jj1 h VAL 367 Cb 1.09 1.02 -0.07 0.00 -1.52 0.00 0.00 31.29 31.80 2jj1 h VAL 367 CO 0.95 0.20 0.58 1.23 0.02 0.00 0.00 177.57 180.56 2jj1 h GLY 368 N 0.33 1.25 0.00 2.17 0.00 -1.93 -3.10 103.07 101.80 2jj1 h GLY 368 Ca 0.10 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.13 2jj1 h GLY 368 CO -0.01 0.07 -1.84 1.04 0.00 0.00 0.00 176.54 175.80 2jj1 n LEU 369 N -4.58 0.15 -4.86 3.11 4.77 -1.17 -4.90 117.00 109.52 2jj1 n LEU 369 Ca 0.18 -0.08 -0.31 0.00 -0.03 0.00 0.00 56.01 55.77 2jj1 n LEU 369 Cb 0.49 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.57 2jj1 n LEU 369 CO 0.29 0.04 0.65 -0.44 -1.33 0.00 0.00 177.39 176.59 2jj1 s SER 370 N -4.28 6.44 0.25 -1.43 0.01 -0.94 -4.81 113.70 108.94 2jj1 s SER 370 Ca -0.06 1.41 -0.18 0.00 1.31 0.00 0.00 55.95 58.43 2jj1 s SER 370 Cb 0.14 -2.45 0.02 0.00 0.21 0.00 0.00 66.02 63.94 2jj1 s SER 370 CO 0.90 -0.66 0.61 0.68 0.41 0.00 0.00 173.24 175.17 2jj1 s VAL 371 N -2.80 0.01 -0.07 3.43 -7.23 -0.79 -4.94 120.40 108.00 2jj1 s VAL 371 Ca 0.56 -1.01 0.03 0.00 -1.81 0.00 0.00 61.98 59.74 2jj1 s VAL 371 Cb -0.10 -1.92 0.01 0.00 0.56 0.00 0.00 36.38 34.93 2jj1 s VAL 371 CO 0.41 -0.03 -0.14 -0.55 -0.31 0.00 0.00 175.10 174.48 2jj1 s SER 372 N -2.93 1.94 0.00 4.85 0.15 -1.26 -1.85 113.70 114.60 2jj1 s SER 372 Ca 0.13 -0.33 0.28 0.00 0.70 0.00 0.00 55.95 56.74 2jj1 s SER 372 Cb -0.03 -0.85 1.15 0.00 -1.71 0.00 0.00 66.02 64.58 2jj1 s SER 372 CO 0.05 0.06 1.84 0.54 1.20 0.00 0.00 173.24 176.93 2jj1 n ARG 373 N 3.69 0.23 -0.04 5.44 1.74 0.07 -3.58 116.66 124.20 2jj1 n ARG 373 Ca -0.22 -0.05 -0.01 0.00 -0.77 0.00 0.00 57.85 56.80 2jj1 n ARG 373 Cb 0.52 -1.50 -0.15 0.00 -1.02 0.00 0.00 32.46 30.31 2jj1 n ARG 373 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2jj1 n VAL 374 N -1.34 0.87 -2.67 1.55 0.31 -1.26 -5.04 118.33 110.74 2jj1 n VAL 374 Ca 0.10 -0.70 0.00 0.00 -0.01 0.00 0.00 64.34 63.72 2jj1 n VAL 374 Cb 0.31 -0.35 0.00 0.00 -0.91 0.00 0.00 33.84 32.88 2jj1 n VAL 374 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2jj1 n GLY 375 N 1.51 1.34 0.10 2.92 0.00 -1.23 -3.39 105.19 106.43 2jj1 n GLY 375 Ca -0.19 -0.51 0.07 0.00 0.00 0.00 0.00 46.02 45.39 2jj1 n GLY 375 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jj1 n SER 376 N -2.51 0.36 0.29 1.61 3.41 -1.26 -1.01 113.62 114.51 2jj1 n SER 376 Ca 0.00 0.66 0.15 0.00 -0.26 0.00 0.00 58.87 59.42 2jj1 n SER 376 Cb 0.00 -0.71 0.87 0.00 -0.26 0.00 0.00 64.21 64.11 2jj1 n SER 376 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jj1 h ALA 377 N 2.02 1.32 -0.04 7.33 0.00 -1.90 -2.16 119.26 125.83 2jj1 h ALA 377 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2jj1 h ALA 377 Cb 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2jj1 h ALA 377 CO 0.00 0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.31 2jj1 n ALA 378 N -2.26 2.54 -2.83 0.00 0.00 -0.18 -4.42 120.51 113.36 2jj1 n ALA 378 Ca -0.02 -0.52 -0.28 0.00 0.00 0.00 0.00 53.44 52.62 2jj1 n ALA 378 Cb 0.16 -1.07 -0.05 0.00 0.00 0.00 0.00 19.45 18.48 2jj1 n ALA 378 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2jj1 s GLN 379 N -1.97 3.05 0.72 0.00 -0.21 -0.81 -3.67 119.66 116.77 2jj1 s GLN 379 Ca 0.35 -0.71 -0.14 0.00 0.02 0.00 0.00 55.36 54.88 2jj1 s GLN 379 Cb 0.21 -2.77 0.04 0.00 1.00 0.00 0.00 33.01 31.48 2jj1 s GLN 379 CO 0.32 0.53 1.14 0.95 -2.12 0.00 0.00 175.29 176.11 2jj1 s THR 380 N -1.60 2.88 0.29 -0.19 -4.23 -1.26 -4.84 115.64 106.69 2jj1 s THR 380 Ca 0.31 0.38 0.04 0.00 -1.18 0.00 0.00 61.69 61.24 2jj1 s THR 380 Cb -0.11 -2.86 0.29 0.00 1.34 0.00 0.00 72.50 71.16 2jj1 s THR 380 CO 0.24 -0.28 1.79 -0.09 -0.54 0.00 0.00 174.62 175.74 2jj1 h ARG 381 N -0.45 0.80 -0.49 3.99 9.65 -1.89 -1.30 114.38 124.69 2jj1 h ARG 381 Ca -0.46 -0.05 0.05 0.00 -1.10 0.00 0.00 59.98 58.42 2jj1 h ARG 381 Cb 1.26 -0.18 -0.05 0.00 -1.39 0.00 0.00 29.97 29.61 2jj1 h ARG 381 CO 0.51 0.53 0.23 0.00 2.80 0.00 0.00 179.97 184.03 2jj1 h ALA 382 N 1.61 0.61 -0.01 2.80 0.00 -1.16 0.14 119.26 123.26 2jj1 h ALA 382 Ca 0.55 0.03 -0.19 0.00 0.00 0.00 0.00 54.91 55.30 2jj1 h ALA 382 Cb 0.76 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2jj1 h ALA 382 CO -0.35 -0.14 -0.82 1.98 0.00 0.00 0.00 179.25 179.92 2jj1 h MET 383 N 0.44 0.20 -0.22 0.00 1.85 -1.73 -3.14 114.93 112.34 2jj1 h MET 383 Ca 0.22 -0.20 0.00 0.00 -0.61 0.00 0.00 59.70 59.11 2jj1 h MET 383 Cb 0.16 0.05 -0.01 0.00 0.43 0.00 0.00 31.60 32.23 2jj1 h MET 383 CO -0.17 0.91 0.15 -0.22 -0.40 0.00 0.00 176.91 177.17 2jj1 h LYS 384 N 0.12 0.29 -1.02 0.39 3.64 -0.83 0.54 116.57 119.70 2jj1 h LYS 384 Ca -0.04 -0.02 0.25 0.00 -1.27 0.00 0.00 60.65 59.57 2jj1 h LYS 384 Cb 1.43 -0.07 -0.11 0.00 -0.41 0.00 0.00 32.23 33.07 2jj1 h LYS 384 CO 0.13 0.20 0.62 1.96 -2.27 0.00 0.00 179.45 180.09 2jj1 h GLN 385 N 0.30 0.53 0.00 1.90 4.20 -0.68 -0.37 115.11 120.99 2jj1 h GLN 385 Ca 0.08 -0.03 -0.33 0.00 0.06 0.00 0.00 58.65 58.43 2jj1 h GLN 385 Cb -0.03 -0.12 -0.06 0.00 0.30 0.00 0.00 27.48 27.57 2jj1 h GLN 385 CO -0.02 0.35 -2.05 1.33 -0.67 0.00 0.00 178.83 177.77 2jj1 n VAL 386 N -4.79 1.48 0.67 -0.54 0.24 -1.07 -4.59 118.33 109.73 2jj1 n VAL 386 Ca 0.26 -0.83 0.07 0.00 -2.04 0.00 0.00 64.34 61.81 2jj1 n VAL 386 Cb 0.77 -0.73 -0.01 0.00 -1.47 0.00 0.00 33.84 32.40 2jj1 n VAL 386 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2jj1 n ALA 387 N -2.65 3.16 -0.46 2.33 0.00 0.16 -4.74 120.51 118.31 2jj1 n ALA 387 Ca -0.25 -0.51 0.38 0.00 0.00 0.00 0.00 53.44 53.05 2jj1 n ALA 387 Cb 1.10 -0.53 0.67 0.00 0.00 0.00 0.00 19.45 20.70 2jj1 n ALA 387 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2jj1 h GLY 388 N 3.24 0.94 0.00 0.00 0.00 -1.27 -1.91 103.07 104.07 2jj1 h GLY 388 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.24 2jj1 h GLY 388 CO 0.00 -0.26 0.00 -1.30 0.00 0.00 0.00 176.54 174.98 2jj1 n THR 389 N -4.51 0.09 -0.19 4.70 -2.24 -1.26 -4.80 114.28 106.07 2jj1 n THR 389 Ca 0.36 -0.46 -0.04 0.00 -2.27 0.00 0.00 64.05 61.64 2jj1 n THR 389 Cb 1.44 1.11 0.06 0.00 -2.10 0.00 0.00 70.33 70.83 2jj1 n THR 389 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 2jj1 h MET 390 N 0.00 0.58 0.19 -0.78 -1.53 -1.63 -2.21 114.93 109.54 2jj1 h MET 390 Ca 0.00 -0.03 -0.00 0.00 -3.44 0.00 0.00 59.70 56.22 2jj1 h MET 390 Cb 0.14 -0.13 -0.00 0.00 -0.55 0.00 0.00 31.60 31.05 2jj1 h MET 390 CO 0.00 0.38 -0.12 -0.22 0.14 0.00 0.00 176.91 177.10 2jj1 h LYS 391 N 0.60 -0.29 -0.31 0.39 3.64 -1.87 0.97 116.57 119.70 2jj1 h LYS 391 Ca 0.24 0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.57 2jj1 h LYS 391 Cb 0.10 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.97 2jj1 h LYS 391 CO -0.14 -0.19 -0.07 -0.07 -2.27 0.00 0.00 179.45 176.71 2jj1 h LEU 392 N -0.30 0.48 -0.40 5.20 3.38 -1.92 -2.24 115.31 119.51 2jj1 h LEU 392 Ca -0.02 -0.11 0.02 0.00 0.09 0.00 0.00 57.88 57.87 2jj1 h LEU 392 Cb 0.25 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 2jj1 h LEU 392 CO 0.01 0.60 0.22 -0.08 0.09 0.00 0.00 178.44 179.29 2jj1 h GLU 393 N 0.47 0.44 -0.29 1.13 4.81 -0.85 -0.90 114.58 119.39 2jj1 h GLU 393 Ca 0.09 -0.03 -0.14 0.00 -0.13 0.00 0.00 59.36 59.15 2jj1 h GLU 393 Cb 0.42 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 2jj1 h GLU 393 CO 0.02 0.29 -0.40 -0.07 -0.73 0.00 0.00 179.01 178.12 2jj1 h LEU 394 N 0.46 0.76 -0.56 1.64 3.38 -0.55 0.39 115.31 120.83 2jj1 h LEU 394 Ca 0.16 -0.34 -0.11 0.00 0.09 0.00 0.00 57.88 57.68 2jj1 h LEU 394 Cb 0.03 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 2jj1 h LEU 394 CO -0.09 1.07 -0.09 0.00 0.09 0.00 0.00 178.44 179.42 2jj1 h ALA 395 N 0.97 0.77 -0.47 1.53 0.00 -1.28 -0.38 119.26 120.39 2jj1 h ALA 395 Ca 0.05 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 2jj1 h ALA 395 Cb 0.94 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 2jj1 h ALA 395 CO 0.09 0.68 0.20 1.96 0.00 0.00 0.00 179.25 182.17 2jj1 h GLN 396 N 0.94 0.70 -0.43 0.00 1.08 -1.04 -2.92 115.11 113.44 2jj1 h GLN 396 Ca 0.15 -0.12 0.07 0.00 -1.45 0.00 0.00 58.65 57.29 2jj1 h GLN 396 Cb 0.67 -0.12 -0.06 0.00 -0.05 0.00 0.00 27.48 27.92 2jj1 h GLN 396 CO 0.05 0.63 0.09 -0.92 -0.95 0.00 0.00 178.83 177.72 2jj1 h TYR 397 N 0.62 0.14 0.00 2.96 3.20 0.35 -1.97 116.97 122.27 2jj1 h TYR 397 Ca 0.16 0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.96 2jj1 h TYR 397 Cb 0.18 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.44 2jj1 h TYR 397 CO 0.00 0.01 -0.45 0.00 -1.64 0.00 0.00 178.16 176.08 2jj1 h ARG 398 N 0.22 0.00 -0.10 1.82 3.08 -1.06 -1.11 114.38 117.22 2jj1 h ARG 398 Ca 0.21 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 60.06 2jj1 h ARG 398 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 2jj1 h ARG 398 CO -0.28 0.45 -0.74 1.49 -1.07 0.00 0.00 179.97 179.82 2jj1 h GLU 399 N 0.00 0.54 -0.08 0.04 4.22 -1.29 -3.00 114.58 115.01 2jj1 h GLU 399 Ca -0.00 -0.44 -0.20 0.00 0.08 0.00 0.00 59.36 58.80 2jj1 h GLU 399 Cb 0.91 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.25 2jj1 h GLU 399 CO 0.06 1.07 -0.78 0.28 -2.18 0.00 0.00 179.01 177.46 2jj1 h VAL 400 N 0.37 1.36 -0.18 0.32 2.07 -0.68 -1.80 116.25 117.71 2jj1 h VAL 400 Ca -0.04 -2.16 0.04 0.00 0.82 0.00 0.00 66.70 65.36 2jj1 h VAL 400 Cb 1.34 2.14 -0.04 0.00 -1.52 0.00 0.00 31.29 33.21 2jj1 h VAL 400 CO 0.14 0.65 -0.05 0.00 0.02 0.00 0.00 177.57 178.33 2jj1 h ALA 401 N 0.83 0.11 -0.51 1.67 0.00 -1.27 0.29 119.26 120.37 2jj1 h ALA 401 Ca -0.04 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2jj1 h ALA 401 Cb 1.37 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 19.29 2jj1 h ALA 401 CO 0.14 -0.49 0.33 0.00 0.00 0.00 0.00 179.25 179.24 2jj1 h ALA 402 N 1.16 0.65 0.00 0.00 0.00 -1.50 -2.34 119.26 117.23 2jj1 h ALA 402 Ca 0.09 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 2jj1 h ALA 402 Cb 0.15 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2jj1 h ALA 402 CO -0.19 0.10 -0.41 0.35 0.00 0.00 0.00 179.25 179.10 2jj1 h PHE 403 N 0.69 0.00 -0.42 0.00 3.57 -1.02 -2.63 116.94 117.13 2jj1 h PHE 403 Ca 0.19 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.69 2jj1 h PHE 403 Cb -0.07 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.67 2jj1 h PHE 403 CO -0.04 0.41 0.00 0.00 -2.23 0.00 0.00 178.31 176.45 2jj1 n ALA 404 N -2.30 3.38 -0.05 2.41 0.00 0.99 -4.42 120.51 120.52 2jj1 n ALA 404 Ca -0.00 -1.31 -0.11 0.00 0.00 0.00 0.00 53.44 52.02 2jj1 n ALA 404 Cb 0.54 -1.08 0.03 0.00 0.00 0.00 0.00 19.45 18.94 2jj1 n ALA 404 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 2jj1 h GLN 405 N 2.84 0.73 -5.20 0.00 4.15 -1.03 -3.31 115.11 113.30 2jj1 h GLN 405 Ca 0.00 -0.42 -0.63 0.00 0.77 0.00 0.00 58.65 58.38 2jj1 h GLN 405 Cb 1.47 0.03 -0.05 0.00 0.21 0.00 0.00 27.48 29.14 2jj1 h GLN 405 CO 0.32 1.04 2.26 1.97 -1.93 0.00 0.00 178.83 182.48 2jj1 n PHE 406 N -4.01 3.79 -1.70 3.99 1.16 -1.26 -4.92 117.46 114.50 2jj1 n PHE 406 Ca -0.03 -2.54 -0.29 0.00 -1.87 0.00 0.00 57.45 52.72 2jj1 n PHE 406 Cb 0.57 -2.53 -0.04 0.00 -1.61 0.00 0.00 39.48 35.87 2jj1 n PHE 406 CO 0.00 0.00 0.00 0.20 -1.87 0.00 0.00 176.76 175.09 2jj1 s GLY 407 N 4.43 -0.37 0.10 4.97 0.00 -1.25 -4.97 107.32 110.23 2jj1 s GLY 407 Ca 0.55 -0.51 0.03 0.00 0.00 0.00 0.00 44.72 44.80 2jj1 s GLY 407 CO 0.05 3.97 -0.10 -1.35 0.00 0.00 0.00 173.10 175.68 2jj1 s SER 408 N 10.65 1.41 -0.06 1.64 1.04 -1.26 -5.10 113.70 122.01 2jj1 s SER 408 Ca 0.88 -0.84 -0.13 0.00 0.48 0.00 0.00 55.95 56.33 2jj1 s SER 408 Cb -0.14 0.02 -0.06 0.00 0.10 0.00 0.00 66.02 65.94 2jj1 s SER 408 CO 0.17 -0.29 0.40 -0.90 0.98 0.00 0.00 173.24 173.60 2jj1 n ASP 409 N 0.46 0.14 -4.38 7.02 3.85 -1.26 -4.98 116.55 117.41 2jj1 n ASP 409 Ca -0.15 0.37 -0.24 0.00 -0.71 0.00 0.00 54.79 54.06 2jj1 n ASP 409 Cb 0.58 -0.28 -0.11 0.00 -1.35 0.00 0.00 41.12 39.95 2jj1 n ASP 409 CO 0.00 0.00 0.00 -0.76 -1.01 0.00 0.00 177.20 175.43 2jj1 s LEU 410 N 0.35 2.45 1.12 -2.12 1.43 -1.26 -5.15 118.68 115.50 2jj1 s LEU 410 Ca 0.30 -0.88 -0.15 0.00 -1.03 0.00 0.00 54.13 52.37 2jj1 s LEU 410 Cb -0.43 -0.98 0.25 0.00 0.03 0.00 0.00 46.19 45.06 2jj1 s LEU 410 CO 0.21 0.03 1.08 1.51 0.23 0.00 0.00 176.35 179.41 2jj1 s ASP 411 N -2.73 1.60 0.27 2.29 3.84 -1.26 -4.87 116.67 115.81 2jj1 s ASP 411 Ca 0.19 1.01 0.09 0.00 -0.00 0.00 0.00 52.55 53.84 2jj1 s ASP 411 Cb -0.06 -1.54 0.34 0.00 -1.38 0.00 0.00 42.92 40.27 2jj1 s ASP 411 CO 0.08 -3.75 1.60 0.00 -0.00 0.00 0.00 175.17 173.11 2jj1 h ALA 412 N -2.32 0.96 0.75 2.11 0.00 -2.01 -2.76 119.26 115.99 2jj1 h ALA 412 Ca -0.52 -0.55 -0.03 0.00 0.00 0.00 0.00 54.91 53.80 2jj1 h ALA 412 Cb 1.32 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2jj1 h ALA 412 CO 0.48 0.75 -0.42 0.00 0.00 0.00 0.00 179.25 180.06 2jj1 h ALA 413 N 1.34 -1.11 0.00 0.00 0.00 -2.00 -2.42 119.26 115.07 2jj1 h ALA 413 Ca -0.01 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.56 2jj1 h ALA 413 Cb 1.09 0.50 -0.02 0.00 0.00 0.00 0.00 17.79 19.36 2jj1 h ALA 413 CO 0.08 -1.13 -0.57 1.79 0.00 0.00 0.00 179.25 179.42 2jj1 h THR 414 N -1.09 1.30 -0.58 0.00 1.35 -1.95 -2.65 112.91 109.29 2jj1 h THR 414 Ca -0.10 -2.03 -0.03 0.00 -0.55 0.00 0.00 66.41 63.70 2jj1 h THR 414 Cb 0.86 2.13 -0.03 0.00 -1.73 0.00 0.00 68.15 69.38 2jj1 h THR 414 CO 0.13 0.56 0.23 -0.61 -0.25 0.00 0.00 175.52 175.58 2jj1 h GLN 415 N 0.00 0.84 -0.19 4.72 4.15 -1.51 -2.53 115.11 120.59 2jj1 h GLN 415 Ca -0.01 -0.13 -0.13 0.00 0.77 0.00 0.00 58.65 59.15 2jj1 h GLN 415 Cb 1.08 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 28.63 2jj1 h GLN 415 CO 0.07 0.69 -0.40 0.37 -1.93 0.00 0.00 178.83 177.64 2jj1 h GLN 416 N 0.83 0.60 -0.30 1.69 5.75 -1.20 -1.77 115.11 120.72 2jj1 h GLN 416 Ca 0.20 -0.40 -0.00 0.00 -0.15 0.00 0.00 58.65 58.30 2jj1 h GLN 416 Cb 0.17 0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.75 2jj1 h GLN 416 CO -0.02 1.01 0.19 1.25 -2.65 0.00 0.00 178.83 178.61 2jj1 h LEU 417 N 0.27 0.35 -0.15 -2.39 5.85 -1.42 -0.13 115.31 117.70 2jj1 h LEU 417 Ca 0.00 -0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.69 2jj1 h LEU 417 Cb 1.00 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.93 2jj1 h LEU 417 CO 0.09 0.29 0.07 -0.07 -0.34 0.00 0.00 178.44 178.47 2jj1 h LEU 418 N 0.39 0.11 -0.97 2.25 3.38 -1.50 0.19 115.31 119.15 2jj1 h LEU 418 Ca 0.11 0.01 0.10 0.00 0.09 0.00 0.00 57.88 58.19 2jj1 h LEU 418 Cb -0.01 -0.01 -0.08 0.00 0.09 0.00 0.00 40.66 40.65 2jj1 h LEU 418 CO -0.02 0.08 0.61 0.28 0.09 0.00 0.00 178.44 179.48 2jj1 h SER 419 N 0.15 0.91 0.15 -0.43 0.02 -1.05 -1.25 113.55 112.05 2jj1 h SER 419 Ca 0.06 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.04 2jj1 h SER 419 Cb 0.01 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.41 2jj1 h SER 419 CO -0.04 0.51 -0.07 -0.09 -1.14 0.00 0.00 176.83 176.00 2jj1 h ARG 420 N 1.00 -0.20 0.17 3.45 9.65 -0.65 -3.20 114.38 124.61 2jj1 h ARG 420 Ca 0.46 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.36 2jj1 h ARG 420 Cb 0.39 0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 29.00 2jj1 h ARG 420 CO -0.24 0.16 -0.14 0.78 2.80 0.00 0.00 179.97 183.33 2jj1 h GLY 421 N -0.58 -0.32 0.95 2.80 0.00 -0.11 0.31 103.07 106.11 2jj1 h GLY 421 Ca -0.02 0.16 0.15 0.00 0.00 0.00 0.00 47.33 47.62 2jj1 h GLY 421 CO 0.03 -0.14 0.38 -2.08 0.00 0.00 0.00 176.54 174.73 2jj1 h VAL 422 N -0.33 0.74 0.10 4.60 2.07 -1.38 0.14 116.25 122.21 2jj1 h VAL 422 Ca -0.00 -0.00 -0.28 0.00 0.82 0.00 0.00 66.70 67.23 2jj1 h VAL 422 Cb 0.30 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 2jj1 h VAL 422 CO -0.02 0.00 -1.46 0.03 0.02 0.00 0.00 177.57 176.14 2jj1 h ARG 423 N 0.01 0.22 -0.92 1.57 3.08 -1.29 -3.19 114.38 113.86 2jj1 h ARG 423 Ca 0.25 -0.38 0.11 0.00 0.07 0.00 0.00 59.98 60.03 2jj1 h ARG 423 Cb 1.00 0.14 -0.07 0.00 0.08 0.00 0.00 29.97 31.12 2jj1 h ARG 423 CO -0.00 1.18 0.59 -0.07 -1.07 0.00 0.00 179.97 180.59 2jj1 h LEU 424 N -0.32 0.81 -0.74 3.04 3.38 0.06 -1.97 115.31 119.57 2jj1 h LEU 424 Ca -0.32 0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.59 2jj1 h LEU 424 Cb 1.75 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 42.34 2jj1 h LEU 424 CO 0.04 0.46 0.03 0.74 0.09 0.00 0.00 178.44 179.80 2jj1 h THR 425 N 0.89 1.26 -0.11 0.22 2.02 -0.83 -1.32 112.91 115.03 2jj1 h THR 425 Ca 0.43 -1.08 -0.10 0.00 0.77 0.00 0.00 66.41 66.43 2jj1 h THR 425 Cb 0.46 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 67.63 2jj1 h THR 425 CO -0.20 0.39 -0.39 -0.33 0.37 0.00 0.00 175.52 175.37 2jj1 h GLU 426 N 0.92 0.24 0.00 6.66 4.39 -1.37 -2.82 114.58 122.60 2jj1 h GLU 426 Ca 0.17 -0.11 -0.04 0.00 0.34 0.00 0.00 59.36 59.73 2jj1 h GLU 426 Cb 0.49 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 2jj1 h GLU 426 CO 0.02 0.60 -0.17 -0.07 -1.16 0.00 0.00 179.01 178.23 2jj1 h LEU 427 N 0.20 0.00 -0.60 1.33 3.38 -0.55 -2.53 115.31 116.53 2jj1 h LEU 427 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2jj1 h LEU 427 Cb 0.78 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.53 2jj1 h LEU 427 CO 0.06 0.17 -0.13 0.18 0.09 0.00 0.00 178.44 178.81 2jj1 n LEU 428 N -4.30 1.07 -4.77 1.67 4.77 -0.90 -4.84 117.00 109.70 2jj1 n LEU 428 Ca -0.02 -0.30 -0.39 0.00 -0.03 0.00 0.00 56.01 55.27 2jj1 n LEU 428 Cb 0.24 -0.08 -0.01 0.00 -2.33 0.00 0.00 43.42 41.23 2jj1 n LEU 428 CO 0.36 0.19 0.91 -0.54 -1.33 0.00 0.00 177.39 176.97 2jj1 s LYS 429 N -2.30 4.03 -0.21 3.23 1.02 -0.96 -4.35 119.74 120.21 2jj1 s LYS 429 Ca 0.31 2.02 -0.23 0.00 0.02 0.00 0.00 55.97 58.08 2jj1 s LYS 429 Cb 0.20 -2.74 0.06 0.00 -0.52 0.00 0.00 37.83 34.83 2jj1 s LYS 429 CO 0.44 -0.40 0.64 -1.14 -0.92 0.00 0.00 175.35 173.97 2jj1 s GLN 430 N -2.23 0.80 0.00 1.68 0.74 -0.61 -4.95 119.66 115.09 2jj1 s GLN 430 Ca 0.56 0.76 0.00 0.00 0.05 0.00 0.00 55.36 56.74 2jj1 s GLN 430 Cb -0.35 0.39 0.00 0.00 1.10 0.00 0.00 33.01 34.15 2jj1 s GLN 430 CO 0.44 -0.13 0.00 0.41 -0.55 0.00 0.00 175.29 175.47 2jj1 n GLY 431 N 2.41 -1.89 3.83 2.59 0.00 -1.26 -3.79 105.19 107.08 2jj1 n GLY 431 Ca -0.15 -1.51 -0.22 0.00 0.00 0.00 0.00 46.02 44.15 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 -1.99 2.61 -0.29 1.61 -0.21 -1.26 -4.71 119.66 115.42 2jj1 s GLN 432 Ca 0.00 -1.40 0.00 0.00 0.02 0.00 0.00 55.36 53.98 2jj1 s GLN 432 Cb 0.00 -2.38 0.00 0.00 1.00 0.00 0.00 33.01 31.63 2jj1 s GLN 432 CO 0.00 0.05 0.00 0.66 -2.12 0.00 0.00 175.29 173.88 2jj1 n TYR 433 N -1.35 -0.04 -3.22 0.91 0.53 -1.26 -4.81 117.16 107.92 2jj1 n TYR 433 Ca -0.01 0.00 -0.25 0.00 -1.02 0.00 0.00 57.90 56.62 2jj1 n TYR 433 Cb 0.60 -1.84 -0.06 0.00 -1.03 0.00 0.00 39.34 37.02 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 -0.13 2.60 -4.75 7.72 7.64 -1.26 -5.09 113.62 120.34 2jj1 n SER 434 Ca -0.03 -3.25 -0.39 0.00 1.01 0.00 0.00 58.87 56.22 2jj1 n SER 434 Cb 0.40 -0.63 0.03 0.00 -1.01 0.00 0.00 64.21 63.00 2jj1 n SER 434 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2jj1 s PRO 435 N -2.38 3.29 -0.02 1.43 0.04 -1.26 -4.96 135.00 131.14 2jj1 s PRO 435 Ca 0.41 2.24 -0.10 0.00 0.04 0.00 0.00 61.00 63.60 2jj1 s PRO 435 Cb 0.22 -2.35 -0.05 0.00 0.04 0.00 0.00 34.50 32.35 2jj1 s PRO 435 CO -0.08 -1.07 0.29 -1.64 0.04 0.00 0.00 177.00 174.55 2jj1 s MET 436 N -2.80 3.67 0.60 4.56 -1.94 0.15 -4.96 119.30 118.57 2jj1 s MET 436 Ca 0.69 0.09 -0.19 0.00 -1.71 0.00 0.00 55.69 54.57 2jj1 s MET 436 Cb -0.40 -3.14 -0.03 0.00 2.01 0.00 0.00 34.83 33.26 2jj1 s MET 436 CO 0.49 0.69 1.28 0.00 -0.01 0.00 0.00 175.02 177.46 2jj1 s ALA 437 N -1.17 2.56 0.14 3.03 0.00 -1.26 -4.25 121.76 120.80 2jj1 s ALA 437 Ca 0.24 1.17 -0.19 0.00 0.00 0.00 0.00 51.96 53.17 2jj1 s ALA 437 Cb -0.14 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.46 2jj1 s ALA 437 CO 0.12 -1.37 1.70 0.97 0.00 0.00 0.00 175.76 177.18 2jj1 h ILE 438 N 0.92 0.75 -0.73 0.00 6.09 -1.98 -2.00 117.51 120.57 2jj1 h ILE 438 Ca -0.51 0.00 0.16 0.00 -1.37 0.00 0.00 64.86 63.14 2jj1 h ILE 438 Cb 1.31 0.75 -0.11 0.00 0.47 0.00 0.00 36.82 39.24 2jj1 h ILE 438 CO 0.55 0.00 0.13 1.05 -3.07 0.00 0.00 178.15 176.81 2jj1 h GLU 439 N -0.00 0.21 -0.19 2.19 9.09 -1.92 0.36 114.58 124.32 2jj1 h GLU 439 Ca 0.12 -0.01 -0.12 0.00 0.05 0.00 0.00 59.36 59.39 2jj1 h GLU 439 Cb 0.18 -0.05 -0.01 0.00 -1.65 0.00 0.00 28.75 27.22 2jj1 h GLU 439 CO -0.26 0.14 -0.41 0.93 0.05 0.00 0.00 179.01 179.47 2jj1 h GLU 440 N 0.22 0.44 -0.39 1.06 5.08 -1.83 -1.70 114.58 117.47 2jj1 h GLU 440 Ca 0.41 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 2jj1 h GLU 440 Cb 0.70 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.94 2jj1 h GLU 440 CO -0.54 0.78 0.25 1.96 -1.00 0.00 0.00 179.01 180.45 2jj1 h GLN 441 N 0.36 0.52 -0.62 2.33 4.20 -0.36 -2.66 115.11 118.88 2jj1 h GLN 441 Ca 0.03 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 2jj1 h GLN 441 Cb 0.88 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 28.52 2jj1 h GLN 441 CO 0.07 0.36 0.33 0.28 -0.67 0.00 0.00 178.83 179.20 2jj1 h VAL 442 N 0.52 1.20 -0.02 -0.54 2.07 -0.55 -2.12 116.25 116.82 2jj1 h VAL 442 Ca 0.14 -0.54 0.01 0.00 0.82 0.00 0.00 66.70 67.13 2jj1 h VAL 442 Cb -0.03 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.15 2jj1 h VAL 442 CO -0.03 0.23 -0.04 0.00 0.02 0.00 0.00 177.57 177.75 2jj1 h ALA 443 N 1.15 -0.02 0.65 1.67 0.00 -1.18 0.84 119.26 122.37 2jj1 h ALA 443 Ca 0.22 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 2jj1 h ALA 443 Cb 0.07 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2jj1 h ALA 443 CO -0.03 -0.53 -0.40 0.28 0.00 0.00 0.00 179.25 178.57 2jj1 h VAL 444 N -0.05 0.18 -0.59 0.00 2.07 -1.25 -2.13 116.25 114.48 2jj1 h VAL 444 Ca 0.02 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.64 2jj1 h VAL 444 Cb 0.09 0.18 -0.07 0.00 -1.52 0.00 0.00 31.29 29.97 2jj1 h VAL 444 CO -0.05 0.00 0.19 0.40 0.02 0.00 0.00 177.57 178.13 2jj1 h ILE 445 N -0.99 0.74 -0.66 4.57 2.04 -1.34 -1.41 117.51 120.45 2jj1 h ILE 445 Ca -0.08 -0.12 0.11 0.00 1.00 0.00 0.00 64.86 65.77 2jj1 h ILE 445 Cb 0.81 0.36 -0.12 0.00 -0.74 0.00 0.00 36.82 37.12 2jj1 h ILE 445 CO 0.08 0.07 -0.34 0.22 0.00 0.00 0.00 178.15 178.17 2jj1 h TYR 446 N 0.36 -0.95 -0.85 1.37 3.20 -0.66 0.28 116.97 119.71 2jj1 h TYR 446 Ca 0.30 0.08 0.10 0.00 3.14 0.00 0.00 58.73 62.34 2jj1 h TYR 446 Cb 0.39 0.51 -0.06 0.00 1.54 0.00 0.00 36.73 39.11 2jj1 h TYR 446 CO -0.19 -0.39 0.55 0.00 -1.64 0.00 0.00 178.16 176.50 2jj1 h ALA 447 N 1.06 1.69 0.20 1.82 0.00 -0.57 -1.90 119.26 121.57 2jj1 h ALA 447 Ca 0.25 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 2jj1 h ALA 447 Cb 0.56 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2jj1 h ALA 447 CO -0.73 0.14 -0.10 0.78 0.00 0.00 0.00 179.25 179.34 2jj1 h GLY 448 N 0.82 -0.29 1.94 0.00 0.00 -0.69 -2.54 103.07 102.32 2jj1 h GLY 448 Ca 0.39 0.11 -0.05 0.00 0.00 0.00 0.00 47.33 47.78 2jj1 h GLY 448 CO -0.16 -0.10 -0.20 -0.39 0.00 0.00 0.00 176.54 175.69 2jj1 h VAL 449 N -0.92 1.17 0.00 4.60 -1.51 -0.42 -1.35 116.25 117.82 2jj1 h VAL 449 Ca -0.03 -0.79 0.00 0.00 -1.23 0.00 0.00 66.70 64.65 2jj1 h VAL 449 Cb 0.49 1.36 0.00 0.00 -2.13 0.00 0.00 31.29 31.01 2jj1 h VAL 449 CO 0.05 0.23 0.00 0.54 -1.23 0.00 0.00 177.57 177.16 2jj1 n ARG 450 N -4.27 0.25 -0.47 5.19 5.12 -0.73 -4.91 116.66 116.84 2jj1 n ARG 450 Ca -0.02 0.01 0.00 0.00 -1.93 0.00 0.00 57.85 55.91 2jj1 n ARG 450 Cb 0.28 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.08 2jj1 n ARG 450 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2jj1 n GLY 451 N 1.33 0.74 0.26 -0.13 0.00 -0.51 -4.96 105.19 101.92 2jj1 n GLY 451 Ca 0.11 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.31 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 -0.53 1.61 0.99 -1.65 -0.11 116.97 117.27 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 1.00 0.00 0.00 36.73 37.73 2jj1 h TYR 452 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 178.16 179.44 2jj1 n LEU 453 N -2.73 3.42 0.13 3.88 4.77 -1.22 -4.65 117.00 120.61 2jj1 n LEU 453 Ca -0.02 -1.98 0.14 0.00 -0.03 0.00 0.00 56.01 54.12 2jj1 n LEU 453 Cb 0.09 -0.35 0.66 0.00 -2.33 0.00 0.00 43.42 41.49 2jj1 n LEU 453 CO 0.17 0.85 1.13 0.44 -1.33 0.00 0.00 177.39 178.65 2jj1 h ASP 454 N 3.15 0.00 -0.06 -1.43 3.45 -1.34 -1.62 116.42 118.58 2jj1 h ASP 454 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 2jj1 h ASP 454 Cb 0.86 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.63 2jj1 h ASP 454 CO 0.00 0.00 0.00 0.29 -1.57 0.00 0.00 179.24 177.96 2jj1 n LYS 455 N -4.46 1.81 -2.96 3.56 5.02 -1.26 -4.93 118.16 114.94 2jj1 n LYS 455 Ca 0.03 -1.72 -0.40 0.00 -2.02 0.00 0.00 58.31 54.20 2jj1 n LYS 455 Cb 0.34 -1.39 -0.05 0.00 -0.02 0.00 0.00 35.03 33.91 2jj1 n LYS 455 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2jj1 s LEU 456 N -1.62 4.53 0.17 -0.35 2.96 -0.61 -5.01 118.68 118.75 2jj1 s LEU 456 Ca 0.24 1.58 -0.33 0.00 -0.22 0.00 0.00 54.13 55.39 2jj1 s LEU 456 Cb 0.17 -3.30 -0.14 0.00 0.50 0.00 0.00 46.19 43.42 2jj1 s LEU 456 CO 0.25 0.10 1.53 1.21 -1.32 0.00 0.00 176.35 178.12 2jj1 n GLU 457 N 2.22 2.08 -0.10 1.98 2.13 -1.26 -4.89 120.64 122.80 2jj1 n GLU 457 Ca -0.04 0.75 0.09 0.00 0.66 0.00 0.00 57.16 58.62 2jj1 n GLU 457 Cb 0.49 -2.48 0.45 0.00 0.27 0.00 0.00 31.44 30.16 2jj1 n GLU 457 CO 0.00 0.00 0.00 -1.35 -0.41 0.00 0.00 177.13 175.37 2jj1 h PRO 458 N 5.48 0.51 0.00 5.31 0.11 -1.94 -2.00 132.00 139.47 2jj1 h PRO 458 Ca -0.45 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2jj1 h PRO 458 Cb 1.26 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2jj1 h PRO 458 CO 0.85 0.34 0.00 -1.13 -0.21 0.00 0.00 178.00 177.85 2jj1 n SER 459 N -4.48 0.00 -0.13 -2.05 3.41 -1.26 -2.54 113.62 106.57 2jj1 n SER 459 Ca 0.09 -0.27 0.08 0.00 -0.26 0.00 0.00 58.87 58.51 2jj1 n SER 459 Cb 0.29 -0.20 -0.06 0.00 -0.26 0.00 0.00 64.21 63.98 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 -1.20 1.60 -0.11 4.33 5.02 -0.75 -4.58 118.16 122.47 2jj1 n LYS 460 Ca 0.13 -0.29 -0.05 0.00 -2.02 0.00 0.00 58.31 56.08 2jj1 n LYS 460 Cb 0.15 -1.29 0.01 0.00 -0.02 0.00 0.00 35.03 33.89 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 0.66 0.50 -0.21 -0.18 1.08 -1.53 0.20 117.51 118.04 2jj1 h ILE 461 Ca 0.00 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.51 2jj1 h ILE 461 Cb 0.46 0.50 -0.04 0.00 -3.07 0.00 0.00 36.82 34.66 2jj1 h ILE 461 CO 0.00 0.00 -0.07 0.74 -0.69 0.00 0.00 178.15 178.13 2jj1 h THR 462 N -0.07 0.74 -0.62 -0.27 2.02 -1.81 -0.46 112.91 112.44 2jj1 h THR 462 Ca 0.19 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.36 2jj1 h THR 462 Cb 0.37 0.74 -0.03 0.00 -1.74 0.00 0.00 68.15 67.49 2jj1 h THR 462 CO -0.44 0.00 0.35 0.50 0.37 0.00 0.00 175.52 176.30 2jj1 h LYS 463 N -0.03 0.85 -0.50 6.66 3.64 -1.63 -2.61 116.57 122.95 2jj1 h LYS 463 Ca 0.11 -0.08 -0.05 0.00 -1.27 0.00 0.00 60.65 59.35 2jj1 h LYS 463 Cb 0.19 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.82 2jj1 h LYS 463 CO -0.23 0.61 0.11 0.35 -2.27 0.00 0.00 179.45 178.02 2jj1 h PHE 464 N 0.86 0.85 -0.45 1.91 3.57 0.25 -2.81 116.94 121.12 2jj1 h PHE 464 Ca 0.22 -0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.62 2jj1 h PHE 464 Cb 0.00 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 38.48 2jj1 h PHE 464 CO 0.00 0.76 0.29 1.49 -2.23 0.00 0.00 178.31 178.63 2jj1 h GLU 465 N 0.69 0.60 -0.47 1.11 4.81 -0.73 0.15 114.58 120.74 2jj1 h GLU 465 Ca 0.15 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.24 2jj1 h GLU 465 Cb 0.35 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 2jj1 h GLU 465 CO 0.00 0.41 -0.12 -0.91 -0.73 0.00 0.00 179.01 177.66 2jj1 h ASN 466 N 0.61 0.85 0.46 1.04 2.35 -1.55 0.26 115.58 119.61 2jj1 h ASN 466 Ca 0.16 -0.27 -0.02 0.00 -0.55 0.00 0.00 56.30 55.62 2jj1 h ASN 466 Cb -0.05 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.09 2jj1 h ASN 466 CO -0.03 0.99 -0.22 0.00 -1.65 0.00 0.00 177.43 176.51 2jj1 h ALA 467 N 1.09 -0.62 -0.44 -0.83 0.00 -1.22 -1.78 119.26 115.46 2jj1 h ALA 467 Ca 0.12 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 54.92 2jj1 h ALA 467 Cb 0.63 0.24 -0.06 0.00 0.00 0.00 0.00 17.79 18.60 2jj1 h ALA 467 CO 0.04 -0.74 0.08 0.35 0.00 0.00 0.00 179.25 178.99 2jj1 h PHE 468 N -0.84 0.14 0.80 0.00 3.57 -0.56 -0.92 116.94 119.13 2jj1 h PHE 468 Ca -0.06 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.43 2jj1 h PHE 468 Cb 0.57 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.31 2jj1 h PHE 468 CO -0.00 0.00 -0.48 1.25 -2.23 0.00 0.00 178.31 176.86 2jj1 h LEU 469 N 0.22 -1.20 -2.36 0.59 5.85 -0.51 -2.06 115.31 115.83 2jj1 h LEU 469 Ca 0.21 0.06 0.00 0.00 0.84 0.00 0.00 57.88 59.00 2jj1 h LEU 469 Cb 0.27 0.35 -0.00 0.00 0.37 0.00 0.00 40.66 41.64 2jj1 h LEU 469 CO -0.28 -0.74 0.21 0.77 -0.34 0.00 0.00 178.44 178.06 2jj1 h SER 470 N -1.19 0.00 0.31 1.25 4.64 -1.13 -1.63 113.55 115.79 2jj1 h SER 470 Ca -0.11 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.20 2jj1 h SER 470 Cb 0.95 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 2jj1 h SER 470 CO 0.12 0.00 -0.15 -0.74 -0.87 0.00 0.00 176.83 175.19 2jj1 h HIS 471 N 0.00 -0.38 0.00 4.77 -0.00 -0.56 -3.32 115.15 115.66 2jj1 h HIS 471 Ca 0.01 -0.01 -0.02 0.00 -0.00 0.00 0.00 60.37 60.35 2jj1 h HIS 471 Cb 0.43 0.13 -0.00 0.00 -0.00 0.00 0.00 27.41 27.97 2jj1 h HIS 471 CO 0.00 -0.24 -0.09 -0.39 -0.00 0.00 0.00 177.93 177.21 2jj1 h VAL 472 N -0.86 0.90 -0.67 5.26 -1.51 -0.70 -0.48 116.25 118.20 2jj1 h VAL 472 Ca -0.04 -0.32 -0.00 0.00 -1.23 0.00 0.00 66.70 65.11 2jj1 h VAL 472 Cb 0.32 1.18 -0.03 0.00 -2.13 0.00 0.00 31.29 30.62 2jj1 h VAL 472 CO 0.07 0.09 0.41 0.40 -1.23 0.00 0.00 177.57 177.31 2jj1 h ILE 473 N 0.00 1.18 0.00 7.19 2.04 -1.46 -0.24 117.51 126.23 2jj1 h ILE 473 Ca -0.00 -0.39 -0.42 0.00 1.00 0.00 0.00 64.86 65.06 2jj1 h ILE 473 Cb 0.17 0.23 -0.06 0.00 -0.74 0.00 0.00 36.82 36.42 2jj1 h ILE 473 CO 0.01 0.19 -2.28 -1.54 0.00 0.00 0.00 178.15 174.53 2jj1 n SER 474 N -4.41 1.94 0.11 1.72 3.41 -0.89 -4.34 113.62 111.17 2jj1 n SER 474 Ca 0.07 0.33 -0.04 0.00 -0.26 0.00 0.00 58.87 58.97 2jj1 n SER 474 Cb 0.06 -0.83 0.12 0.00 -0.26 0.00 0.00 64.21 63.30 2jj1 n SER 474 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 2jj1 h GLN 475 N -0.93 0.10 -1.50 4.33 5.75 -1.19 -3.37 115.11 118.29 2jj1 h GLN 475 Ca -0.63 -0.07 -0.47 0.00 -0.15 0.00 0.00 58.65 57.33 2jj1 h GLN 475 Cb 1.58 0.01 -0.41 0.00 1.07 0.00 0.00 27.48 29.73 2jj1 h GLN 475 CO -0.36 0.72 -1.03 0.72 -2.65 0.00 0.00 178.83 176.24 2jj1 n HIS 476 N -3.78 1.78 0.28 3.99 8.25 -0.11 -4.81 115.22 120.82 2jj1 n HIS 476 Ca -0.02 -3.24 0.17 0.00 -0.26 0.00 0.00 57.72 54.37 2jj1 n HIS 476 Cb 0.66 -0.34 0.79 0.00 1.12 0.00 0.00 29.99 32.22 2jj1 n HIS 476 CO 0.00 0.00 0.00 0.37 0.64 0.00 0.00 176.34 177.35 2jj1 h GLN 477 N 2.90 0.00 -0.22 -0.41 5.75 -1.72 -2.66 115.11 118.75 2jj1 h GLN 477 Ca 0.06 0.00 -0.09 0.00 -0.15 0.00 0.00 58.65 58.47 2jj1 h GLN 477 Cb 0.99 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.54 2jj1 h GLN 477 CO 0.62 0.04 -0.21 0.00 -2.65 0.00 0.00 178.83 176.63 2jj1 h ALA 478 N 1.96 0.33 0.33 3.38 0.00 -1.89 0.16 119.26 123.52 2jj1 h ALA 478 Ca -0.00 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 2jj1 h ALA 478 Cb 0.39 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2jj1 h ALA 478 CO 0.01 0.27 -0.16 1.25 0.00 0.00 0.00 179.25 180.62 2jj1 h LEU 479 N 0.23 -0.38 -0.74 0.00 6.46 -1.89 -1.16 115.31 117.83 2jj1 h LEU 479 Ca 0.04 -0.09 0.11 0.00 -0.12 0.00 0.00 57.88 57.82 2jj1 h LEU 479 Cb 0.76 0.10 -0.08 0.00 -0.73 0.00 0.00 40.66 40.71 2jj1 h LEU 479 CO 0.05 -0.14 0.35 -0.07 -0.62 0.00 0.00 178.44 178.02 2jj1 h LEU 480 N -0.60 0.42 -1.10 2.25 3.38 -1.51 -0.58 115.31 117.57 2jj1 h LEU 480 Ca -0.05 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2jj1 h LEU 480 Cb 0.44 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.17 2jj1 h LEU 480 CO 0.07 0.22 0.42 -1.28 0.09 0.00 0.00 178.44 177.96 2jj1 h SER 481 N 0.57 0.93 -0.14 -0.43 0.87 -0.58 -2.23 113.55 112.54 2jj1 h SER 481 Ca 0.38 -0.07 -0.22 0.00 -1.23 0.00 0.00 61.79 60.65 2jj1 h SER 481 Cb 0.47 -0.24 0.01 0.00 -0.44 0.00 0.00 62.40 62.21 2jj1 h SER 481 CO -0.32 0.75 -0.78 0.50 -0.53 0.00 0.00 176.83 176.44 2jj1 h LYS 482 N 1.05 0.79 -0.58 2.24 1.63 0.14 -1.98 116.57 119.86 2jj1 h LYS 482 Ca 0.27 -0.65 -0.06 0.00 -0.85 0.00 0.00 60.65 59.36 2jj1 h LYS 482 Cb 0.02 0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 31.76 2jj1 h LYS 482 CO -0.04 1.25 0.14 0.82 -3.45 0.00 0.00 179.45 178.17 2jj1 h ILE 483 N 0.54 1.25 -0.45 2.00 2.04 -1.07 -0.06 117.51 121.76 2jj1 h ILE 483 Ca -0.05 -0.89 -0.14 0.00 1.00 0.00 0.00 64.86 64.77 2jj1 h ILE 483 Cb 1.41 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 38.20 2jj1 h ILE 483 CO 0.16 0.33 -0.27 -0.09 0.00 0.00 0.00 178.15 178.29 2jj1 h ARG 484 N 0.83 0.97 -0.01 2.37 2.43 -1.38 0.10 114.38 119.69 2jj1 h ARG 484 Ca 0.18 -0.44 -0.07 0.00 -0.81 0.00 0.00 59.98 58.84 2jj1 h ARG 484 Cb 0.35 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 2jj1 h ARG 484 CO 0.00 1.11 -0.25 1.15 -1.51 0.00 0.00 179.97 180.47 2jj1 h THR 485 N 0.81 1.53 -0.18 0.20 2.02 -1.29 -3.26 112.91 112.74 2jj1 h THR 485 Ca 0.09 -1.92 -0.08 0.00 0.77 0.00 0.00 66.41 65.28 2jj1 h THR 485 Cb 0.85 2.72 -0.01 0.00 -1.74 0.00 0.00 68.15 69.97 2jj1 h THR 485 CO 0.08 0.53 -0.24 0.44 0.37 0.00 0.00 175.52 176.69 2jj1 h ASP 486 N -0.47 0.33 -1.23 4.18 5.19 -1.08 -3.47 116.42 119.88 2jj1 h ASP 486 Ca -0.03 -0.10 -0.24 0.00 -0.62 0.00 0.00 57.03 56.04 2jj1 h ASP 486 Cb 1.00 -0.09 -0.05 0.00 0.18 0.00 0.00 39.33 40.37 2jj1 h ASP 486 CO 0.05 0.58 -0.27 0.61 -3.12 0.00 0.00 179.24 177.09 2jj1 n GLY 487 N -0.51 0.47 3.55 2.75 0.00 0.35 -5.00 105.19 106.81 2jj1 n GLY 487 Ca -0.01 -0.42 -0.09 0.00 0.00 0.00 0.00 46.02 45.50 2jj1 n GLY 487 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jj1 s LYS 488 N -3.93 1.42 -0.67 1.61 -2.85 -1.15 -0.56 119.74 113.62 2jj1 s LYS 488 Ca 0.00 -0.88 -0.10 0.00 -1.00 0.00 0.00 55.97 53.99 2jj1 s LYS 488 Cb 0.00 0.53 0.17 0.00 -2.06 0.00 0.00 37.83 36.47 2jj1 s LYS 488 CO 0.00 -0.61 0.56 0.42 0.10 0.00 0.00 175.35 175.82 2jj1 s ILE 489 N -3.88 4.71 0.94 3.79 1.01 -1.26 -4.43 121.20 122.08 2jj1 s ILE 489 Ca 0.10 -2.40 -0.11 0.00 0.00 0.00 0.00 60.65 58.24 2jj1 s ILE 489 Cb -0.01 -4.00 0.16 0.00 0.01 0.00 0.00 42.46 38.62 2jj1 s ILE 489 CO -0.02 -0.92 1.09 -0.94 0.00 0.00 0.00 174.94 174.16 2jj1 s SER 490 N 1.95 2.95 0.56 3.58 1.04 -1.26 -4.61 113.70 117.90 2jj1 s SER 490 Ca 0.14 1.66 0.29 0.00 0.48 0.00 0.00 55.95 58.52 2jj1 s SER 490 Cb -0.18 -2.30 1.46 0.00 0.10 0.00 0.00 66.02 65.10 2jj1 s SER 490 CO -0.05 -2.99 1.93 -0.33 0.98 0.00 0.00 173.24 172.78 2jj1 h GLU 491 N -1.79 0.00 0.16 4.02 5.08 -1.99 0.10 114.58 120.16 2jj1 h GLU 491 Ca -0.50 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.85 2jj1 h GLU 491 Cb 1.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 2jj1 h GLU 491 CO 0.51 0.00 -0.08 1.49 -1.00 0.00 0.00 179.01 179.93 2jj1 h GLU 492 N 0.00 -0.21 -0.57 2.33 4.81 -2.00 -2.84 114.58 116.11 2jj1 h GLU 492 Ca 0.29 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.56 2jj1 h GLU 492 Cb 1.29 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 30.68 2jj1 h GLU 492 CO -0.00 0.23 0.34 0.77 -0.73 0.00 0.00 179.01 179.61 2jj1 h SER 493 N -0.78 0.55 -0.79 1.04 0.02 -1.60 -1.87 113.55 110.12 2jj1 h SER 493 Ca -0.02 0.00 0.16 0.00 -0.84 0.00 0.00 61.79 61.09 2jj1 h SER 493 Cb 0.53 -0.11 -0.10 0.00 0.14 0.00 0.00 62.40 62.85 2jj1 h SER 493 CO 0.04 0.39 0.31 -0.78 -1.14 0.00 0.00 176.83 175.65 2jj1 h ASP 494 N 0.68 0.27 -0.27 3.07 1.82 -0.92 0.30 116.42 121.37 2jj1 h ASP 494 Ca 0.23 0.12 -0.04 0.00 -0.39 0.00 0.00 57.03 56.95 2jj1 h ASP 494 Cb 0.03 0.11 -0.01 0.00 0.68 0.00 0.00 39.33 40.13 2jj1 h ASP 494 CO -0.10 0.07 -0.00 0.00 -1.61 0.00 0.00 179.24 177.60 2jj1 h ALA 495 N 1.59 0.36 -0.23 -0.78 0.00 -1.13 -2.23 119.26 116.83 2jj1 h ALA 495 Ca 0.45 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 2jj1 h ALA 495 Cb 0.73 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2jj1 h ALA 495 CO -0.44 0.09 -0.25 0.87 0.00 0.00 0.00 179.25 179.52 2jj1 h LYS 496 N 0.25 0.44 -0.05 0.00 1.57 -0.51 -2.50 116.57 115.77 2jj1 h LYS 496 Ca 0.08 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 2jj1 h LYS 496 Cb 0.42 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.70 2jj1 h LYS 496 CO 0.01 0.66 0.00 -0.07 -0.57 0.00 0.00 179.45 179.48 2jj1 h LEU 497 N 0.39 0.08 -0.13 2.94 3.38 -0.44 -2.44 115.31 119.09 2jj1 h LEU 497 Ca 0.06 -0.29 0.05 0.00 0.09 0.00 0.00 57.88 57.79 2jj1 h LEU 497 Cb 0.65 -0.02 -0.06 0.00 0.09 0.00 0.00 40.66 41.31 2jj1 h LEU 497 CO 0.05 0.35 -0.29 0.50 0.09 0.00 0.00 178.44 179.13 2jj1 h LYS 498 N -0.19 -0.35 -0.67 1.13 3.64 -1.35 -1.58 116.57 117.21 2jj1 h LYS 498 Ca 0.01 0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.49 2jj1 h LYS 498 Cb 0.31 0.08 -0.06 0.00 -0.41 0.00 0.00 32.23 32.15 2jj1 h LYS 498 CO 0.00 -0.24 0.35 1.49 -2.27 0.00 0.00 179.45 178.79 2jj1 h GLU 499 N -0.37 0.62 0.22 1.90 4.81 -1.48 -2.14 114.58 118.15 2jj1 h GLU 499 Ca 0.10 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 2jj1 h GLU 499 Cb 0.52 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.76 2jj1 h GLU 499 CO -0.34 0.41 -0.10 0.82 -0.73 0.00 0.00 179.01 179.07 2jj1 h ILE 500 N 0.64 0.85 -0.32 2.32 2.04 -1.03 -3.09 117.51 118.92 2jj1 h ILE 500 Ca 0.31 -0.40 -0.13 0.00 1.00 0.00 0.00 64.86 65.64 2jj1 h ILE 500 Cb 0.24 1.09 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 2jj1 h ILE 500 CO -0.21 0.09 -0.33 -0.37 0.00 0.00 0.00 178.15 177.33 2jj1 h VAL 501 N -0.49 1.28 0.88 1.67 -1.51 -1.09 -0.78 116.25 116.21 2jj1 h VAL 501 Ca -0.03 -1.47 -0.04 0.00 -1.23 0.00 0.00 66.70 63.93 2jj1 h VAL 501 Cb 0.37 1.39 0.01 0.00 -2.13 0.00 0.00 31.29 30.93 2jj1 h VAL 501 CO 0.05 0.48 -0.44 0.71 -1.23 0.00 0.00 177.57 177.14 2jj1 h THR 502 N 0.59 0.00 0.00 7.19 1.35 -1.48 -1.39 112.91 119.17 2jj1 h THR 502 Ca 0.06 0.00 -0.03 0.00 -0.55 0.00 0.00 66.41 65.89 2jj1 h THR 502 Cb 0.84 0.00 -0.00 0.00 -1.73 0.00 0.00 68.15 67.26 2jj1 h THR 502 CO 0.07 0.00 -0.16 0.78 -0.25 0.00 0.00 175.52 175.96 2jj1 h ASN 503 N -1.20 0.00 0.01 5.36 2.35 -1.52 -2.34 115.58 118.25 2jj1 h ASN 503 Ca -0.12 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.63 2jj1 h ASN 503 Cb 0.92 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.29 2jj1 h ASN 503 CO 0.19 0.16 -0.01 0.15 -1.65 0.00 0.00 177.43 176.28 2jj1 h PHE 504 N 0.00 -0.01 -0.59 1.19 3.57 -1.13 -2.87 116.94 117.10 2jj1 h PHE 504 Ca -0.00 -0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.60 2jj1 h PHE 504 Cb 0.50 0.00 -0.08 0.00 2.79 0.00 0.00 35.95 39.16 2jj1 h PHE 504 CO 0.00 0.64 0.15 1.25 -2.23 0.00 0.00 178.31 178.13 2jj1 h LEU 505 N -0.69 0.06 -0.03 0.59 6.46 -1.04 0.28 115.31 120.94 2jj1 h LEU 505 Ca -0.00 0.10 0.01 0.00 -0.12 0.00 0.00 57.88 57.87 2jj1 h LEU 505 Cb 0.66 0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 40.71 2jj1 h LEU 505 CO 0.00 0.04 -0.03 0.00 -0.62 0.00 0.00 178.44 177.84 2jj1 h ALA 506 N 1.45 -0.00 -0.75 1.25 0.00 -1.51 0.17 119.26 119.87 2jj1 h ALA 506 Ca 0.30 0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.31 2jj1 h ALA 506 Cb 0.43 0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.21 2jj1 h ALA 506 CO -0.37 -0.51 0.41 0.78 0.00 0.00 0.00 179.25 179.56 2jj1 h GLY 507 N -0.04 1.13 1.09 0.00 0.00 -1.14 -1.66 103.07 102.45 2jj1 h GLY 507 Ca 0.02 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.09 2jj1 h GLY 507 CO -0.05 0.12 0.59 -2.75 0.00 0.00 0.00 176.54 174.45 2jj1 h PHE 508 N 0.70 1.17 -0.32 5.60 3.57 0.47 -2.97 116.94 125.16 2jj1 h PHE 508 Ca 0.36 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.87 2jj1 h PHE 508 Cb 0.31 -0.39 0.00 0.00 2.79 0.00 0.00 35.95 38.66 2jj1 h PHE 508 CO -0.08 0.75 0.00 0.39 -2.23 0.00 0.00 178.31 177.14 2jj1 n GLU 509 N -4.38 2.84 0.00 1.11 1.02 0.52 -5.08 120.64 116.67 2jj1 n GLU 509 Ca 0.10 -1.62 0.07 0.00 -0.02 0.00 0.00 57.16 55.69 2jj1 n GLU 509 Cb 0.03 -1.79 0.42 0.00 -0.02 0.00 0.00 31.44 30.08 2jj1 n GLU 509 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31