#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jtn n SER 2 N 0.00 -0.18 -4.77 6.43 2.88 -1.26 -5.15 113.62 111.56 2jtn n SER 2 Ca 0.00 -1.08 -0.37 0.00 -1.33 0.00 0.00 58.87 56.09 2jtn n SER 2 Cb 0.00 0.30 -0.02 0.00 -0.75 0.00 0.00 64.21 63.74 2jtn n SER 2 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 2jtn s GLN 3 N -2.00 3.88 0.07 -1.46 2.00 -1.26 -5.04 119.66 115.85 2jtn s GLN 3 Ca 0.03 1.69 0.01 0.00 -2.00 0.00 0.00 55.36 55.09 2jtn s GLN 3 Cb -0.00 -2.44 -0.04 0.00 0.80 0.00 0.00 33.01 31.32 2jtn s GLN 3 CO 0.00 -0.43 0.17 0.14 -0.50 0.00 0.00 175.29 174.68 2jtn s VAL 4 N -1.58 5.10 0.57 1.34 -7.23 -1.26 -4.99 120.40 112.35 2jtn s VAL 4 Ca 0.62 -0.53 0.29 0.00 -1.81 0.00 0.00 61.98 60.55 2jtn s VAL 4 Cb -0.26 -3.49 0.41 0.00 0.56 0.00 0.00 36.38 33.60 2jtn s VAL 4 CO 0.32 0.12 1.88 -0.65 -0.31 0.00 0.00 175.10 176.47 2jtn h PRO 5 N 3.09 0.00 -4.82 4.82 0.11 -1.98 -3.47 132.00 129.75 2jtn h PRO 5 Ca -0.46 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.66 2jtn h PRO 5 Cb 1.16 0.00 -0.11 0.00 0.11 0.00 0.00 31.00 32.17 2jtn h PRO 5 CO 0.72 0.00 -1.42 -0.25 -0.21 0.00 0.00 178.00 176.84 2jtn n ASP 6 N -3.91 -2.04 -4.93 -2.05 9.92 -1.26 -4.63 116.55 107.65 2jtn n ASP 6 Ca 0.12 1.37 -0.26 0.00 -0.53 0.00 0.00 54.79 55.49 2jtn n ASP 6 Cb 0.78 -5.05 -0.03 0.00 -0.64 0.00 0.00 41.12 36.18 2jtn n ASP 6 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2jtn s VAL 7 N -0.62 5.20 0.12 2.53 0.11 -1.26 -4.42 120.40 122.07 2jtn s VAL 7 Ca -0.23 -0.44 -0.03 0.00 -2.93 0.00 0.00 61.98 58.36 2jtn s VAL 7 Cb 0.02 -3.76 0.01 0.00 -1.53 0.00 0.00 36.38 31.12 2jtn s VAL 7 CO 0.61 -0.23 0.21 0.23 -3.33 0.00 0.00 175.10 172.59 2jtn n MET 8 N -0.85 0.30 -3.66 1.54 0.00 -1.18 -5.08 117.12 108.19 2jtn n MET 8 Ca -0.05 -0.79 -0.15 0.00 0.00 0.00 0.00 57.70 56.71 2jtn n MET 8 Cb 0.54 0.88 -0.08 0.00 0.00 0.00 0.00 33.22 34.56 2jtn n MET 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 2jtn s VAL 9 N -2.65 0.01 0.47 2.03 0.11 -1.26 -2.86 120.40 116.26 2jtn s VAL 9 Ca 0.07 -0.11 -0.23 0.00 -2.93 0.00 0.00 61.98 58.78 2jtn s VAL 9 Cb -0.01 -0.78 -0.07 0.00 -1.53 0.00 0.00 36.38 33.99 2jtn s VAL 9 CO 0.05 -0.06 1.21 -0.69 -3.33 0.00 0.00 175.10 172.28 2jtn s VAL 10 N -0.45 2.88 0.27 2.04 1.01 0.25 -4.84 120.40 121.55 2jtn s VAL 10 Ca -0.06 0.67 0.02 0.00 0.00 0.00 0.00 61.98 62.62 2jtn s VAL 10 Cb -0.03 -3.34 -0.01 0.00 0.00 0.00 0.00 36.38 33.00 2jtn s VAL 10 CO 0.04 -0.00 0.09 0.61 0.00 0.00 0.00 175.10 175.83 2jtn n GLY 11 N 0.51 3.56 3.74 4.51 0.00 -1.26 0.98 105.19 117.23 2jtn n GLY 11 Ca 0.08 -2.06 -0.38 0.00 0.00 0.00 0.00 46.02 43.66 2jtn n GLY 11 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jtn n GLU 12 N -0.61 1.40 -2.64 1.61 -0.58 -1.26 -4.02 120.64 114.54 2jtn n GLU 12 Ca -0.04 0.53 -0.41 0.00 -0.42 0.00 0.00 57.16 56.82 2jtn n GLU 12 Cb 0.40 -2.56 -0.05 0.00 -0.57 0.00 0.00 31.44 28.67 2jtn n GLU 12 CO 0.00 0.00 0.00 -2.14 -0.48 0.00 0.00 177.13 174.51 2jtn s PRO 13 N -3.14 4.70 -0.24 3.49 0.02 -1.26 -4.71 135.00 133.87 2jtn s PRO 13 Ca 0.77 1.59 -0.27 0.00 0.02 0.00 0.00 61.00 63.12 2jtn s PRO 13 Cb -0.40 -3.30 0.11 0.00 0.02 0.00 0.00 34.50 30.93 2jtn s PRO 13 CO 0.44 0.25 0.94 -0.08 -0.33 0.00 0.00 177.00 178.22 2jtn s THR 14 N -0.52 0.00 0.45 0.99 -1.32 0.51 -4.52 115.64 111.23 2jtn s THR 14 Ca 0.46 0.00 0.04 0.00 -1.21 0.00 0.00 61.69 60.98 2jtn s THR 14 Cb -0.27 -1.00 -0.05 0.00 -1.51 0.00 0.00 72.50 69.67 2jtn s THR 14 CO 0.33 0.00 0.01 -0.76 -2.21 0.00 0.00 174.62 171.99 2jtn s LEU 15 N -0.13 2.60 0.32 9.08 1.43 -1.25 -4.36 118.68 126.37 2jtn s LEU 15 Ca 0.00 -1.49 0.13 0.00 -1.03 0.00 0.00 54.13 51.75 2jtn s LEU 15 Cb -0.04 -0.79 0.54 0.00 0.03 0.00 0.00 46.19 45.93 2jtn s LEU 15 CO -0.02 -0.63 1.70 0.00 0.23 0.00 0.00 176.35 177.63 2jtn h MET 16 N 1.61 0.00 -5.62 1.70 -0.00 -1.90 -3.48 114.93 107.24 2jtn h MET 16 Ca -0.44 0.00 -0.30 0.00 -0.00 0.00 0.00 59.70 58.96 2jtn h MET 16 Cb 1.27 0.00 0.17 0.00 -0.00 0.00 0.00 31.60 33.04 2jtn h MET 16 CO 0.77 0.49 -0.84 0.41 -0.00 0.00 0.00 176.91 177.75 2jtn n GLY 17 N 0.08 -0.85 0.06 -3.00 0.00 0.19 -4.92 105.19 96.74 2jtn n GLY 17 Ca -0.01 0.40 -0.12 0.00 0.00 0.00 0.00 46.02 46.29 2jtn n GLY 17 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2jtn h GLY 18 N -1.45 -0.01 0.00 -0.02 0.00 -1.86 -3.45 103.07 96.29 2jtn h GLY 18 Ca -0.61 0.02 0.00 0.00 0.00 0.00 0.00 47.33 46.74 2jtn h GLY 18 CO 0.47 -0.02 0.00 1.18 0.00 0.00 0.00 176.54 178.17 2jtn n GLU 19 N -5.11 0.00 -1.27 4.80 1.02 -1.26 -4.89 120.64 113.92 2jtn n GLU 19 Ca -0.07 0.00 0.16 0.00 -0.02 0.00 0.00 57.16 57.23 2jtn n GLU 19 Cb 0.05 0.00 -0.08 0.00 -0.02 0.00 0.00 31.44 31.39 2jtn n GLU 19 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2jtn n PHE 20 N 0.00 -3.39 -3.01 -0.32 -0.00 -1.26 -5.06 117.46 104.41 2jtn n PHE 20 Ca 0.00 1.85 0.00 0.00 -0.00 0.00 0.00 57.45 59.30 2jtn n PHE 20 Cb 0.00 -3.09 0.00 0.00 -0.00 0.00 0.00 39.48 36.39 2jtn n PHE 20 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2jtn n GLY 21 N -4.08 -1.33 0.29 7.13 0.00 -1.26 -4.97 105.19 100.96 2jtn n GLY 21 Ca -0.07 -0.96 0.12 0.00 0.00 0.00 0.00 46.02 45.11 2jtn n GLY 21 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2jtn h ASP 22 N 0.00 0.00 -0.32 1.61 2.03 -1.99 -1.28 116.42 116.47 2jtn h ASP 22 Ca 0.00 0.00 0.09 0.00 -0.73 0.00 0.00 57.03 56.39 2jtn h ASP 22 Cb 0.00 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.49 2jtn h ASP 22 CO 0.00 0.00 0.24 -0.33 -1.03 0.00 0.00 179.24 178.12 2jtn h GLU 23 N 0.00 0.00 0.00 4.15 5.08 -2.01 -3.18 114.58 118.63 2jtn h GLU 23 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2jtn h GLU 23 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 2jtn h GLU 23 CO -0.00 0.00 0.00 -0.25 -1.00 0.00 0.00 179.01 177.76 2jtn n ASP 24 N -4.36 0.00 -4.78 1.42 9.92 -0.48 -4.95 116.55 113.31 2jtn n ASP 24 Ca 0.05 0.52 -0.26 0.00 -0.53 0.00 0.00 54.79 54.57 2jtn n ASP 24 Cb 0.41 -0.24 -0.06 0.00 -0.64 0.00 0.00 41.12 40.59 2jtn n ASP 24 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2jtn s GLU 25 N -1.32 2.24 0.36 -1.24 0.41 -1.20 -5.10 118.70 112.85 2jtn s GLU 25 Ca 0.00 -1.94 -0.25 0.00 -0.41 0.00 0.00 54.97 52.36 2jtn s GLU 25 Cb 0.00 -1.96 -0.09 0.00 -1.78 0.00 0.00 34.13 30.29 2jtn s GLU 25 CO 0.00 -0.25 1.04 -0.98 -0.49 0.00 0.00 175.26 174.57 2jtn s ARG 26 N -3.99 4.34 0.32 1.61 1.70 -1.26 -4.63 118.95 117.04 2jtn s ARG 26 Ca 0.35 1.53 0.09 0.00 -0.47 0.00 0.00 55.73 57.23 2jtn s ARG 26 Cb 0.02 -2.72 -0.04 0.00 -0.57 0.00 0.00 34.95 31.64 2jtn s ARG 26 CO 0.20 0.01 0.10 -1.17 -1.08 0.00 0.00 175.30 173.37 2jtn s LEU 27 N -2.29 3.25 0.93 -1.89 2.96 -1.26 -4.44 118.68 115.94 2jtn s LEU 27 Ca 0.54 -0.74 -0.11 0.00 -0.22 0.00 0.00 54.13 53.60 2jtn s LEU 27 Cb -0.23 -1.73 0.15 0.00 0.50 0.00 0.00 46.19 44.88 2jtn s LEU 27 CO 0.29 -0.21 1.11 0.27 -1.32 0.00 0.00 176.35 176.49 2jtn s ILE 28 N -2.40 2.32 -0.24 6.68 -4.36 -1.26 -4.69 121.20 117.25 2jtn s ILE 28 Ca 0.36 0.11 -0.01 0.00 -0.26 0.00 0.00 60.65 60.84 2jtn s ILE 28 Cb -0.03 -2.25 0.07 0.00 1.25 0.00 0.00 42.46 41.50 2jtn s ILE 28 CO 0.22 -0.14 0.03 -0.89 0.24 0.00 0.00 174.94 174.40 2jtn s THR 29 N -2.69 0.97 -0.67 8.37 2.01 0.28 -4.88 115.64 119.03 2jtn s THR 29 Ca 0.66 -1.05 -0.27 0.00 0.31 0.00 0.00 61.69 61.34 2jtn s THR 29 Cb -0.22 -1.49 0.02 0.00 0.01 0.00 0.00 72.50 70.83 2jtn s THR 29 CO 0.59 -0.32 1.35 -0.13 -0.69 0.00 0.00 174.62 175.41 2jtn s ARG 30 N 1.63 3.20 0.01 4.92 3.00 -1.26 -1.58 118.95 128.87 2jtn s ARG 30 Ca 0.01 0.04 -0.04 0.00 0.00 0.00 0.00 55.73 55.74 2jtn s ARG 30 Cb -0.18 -4.17 -0.01 0.00 0.00 0.00 0.00 34.95 30.60 2jtn s ARG 30 CO -0.12 -2.11 0.06 -0.48 0.00 0.00 0.00 175.30 172.65 2jtn s LEU 31 N 6.03 1.87 0.72 2.53 0.05 -0.85 -4.98 118.68 124.05 2jtn s LEU 31 Ca 0.43 -0.36 -0.13 0.00 0.05 0.00 0.00 54.13 54.12 2jtn s LEU 31 Cb -0.09 0.42 0.03 0.00 -2.05 0.00 0.00 46.19 44.51 2jtn s LEU 31 CO 0.19 -0.35 1.11 -1.61 -0.55 0.00 0.00 176.35 175.14 2jtn s GLU 32 N -1.51 2.42 -0.10 1.48 2.02 -1.26 -1.15 118.70 120.60 2jtn s GLU 32 Ca -0.15 1.35 0.15 0.00 0.02 0.00 0.00 54.97 56.35 2jtn s GLU 32 Cb -0.08 -1.91 0.22 0.00 0.10 0.00 0.00 34.13 32.47 2jtn s GLU 32 CO 0.00 -1.54 1.11 0.09 0.02 0.00 0.00 175.26 174.94 2jtn n ASN 33 N -2.96 1.90 -2.71 -0.19 4.13 0.28 -4.80 115.26 110.91 2jtn n ASN 33 Ca 0.10 -2.83 -0.08 0.00 1.68 0.00 0.00 54.58 53.44 2jtn n ASN 33 Cb 0.52 -0.37 -0.01 0.00 -1.54 0.00 0.00 39.78 38.39 2jtn n ASN 33 CO 0.00 0.00 0.00 1.07 0.28 0.00 0.00 177.26 178.61 2jtn n THR 34 N -1.14 -0.25 -4.50 3.41 5.66 -1.26 -4.90 114.28 111.31 2jtn n THR 34 Ca 0.12 0.00 -0.25 0.00 -3.05 0.00 0.00 64.05 60.88 2jtn n THR 34 Cb 0.63 -0.66 -0.10 0.00 -1.55 0.00 0.00 70.33 68.65 2jtn n THR 34 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 2jtn s GLN 35 N -5.26 1.73 0.00 1.09 1.11 -1.26 -4.98 119.66 112.09 2jtn s GLN 35 Ca 0.10 -1.84 0.00 0.00 0.01 0.00 0.00 55.36 53.62 2jtn s GLN 35 Cb -0.05 -1.72 0.00 0.00 -1.01 0.00 0.00 33.01 30.23 2jtn s GLN 35 CO 0.12 0.24 0.00 0.34 0.01 0.00 0.00 175.29 175.99 2jtn n PHE 36 N -0.69 -0.00 -3.87 0.91 -0.00 -1.17 -2.51 117.46 110.12 2jtn n PHE 36 Ca -0.05 0.00 -0.35 0.00 -0.00 0.00 0.00 57.45 57.05 2jtn n PHE 36 Cb 0.62 0.00 -0.13 0.00 -0.00 0.00 0.00 39.48 39.97 2jtn n PHE 36 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 2jtn s ASP 37 N -1.01 5.01 -0.30 -2.13 1.11 -1.26 -4.67 116.67 113.42 2jtn s ASP 37 Ca 0.00 -1.47 -0.15 0.00 0.18 0.00 0.00 52.55 51.12 2jtn s ASP 37 Cb 0.00 -1.75 0.16 0.00 1.07 0.00 0.00 42.92 42.40 2jtn s ASP 37 CO 0.00 -0.34 0.97 0.00 1.18 0.00 0.00 175.17 176.98 2jtn s ALA 38 N 1.23 -2.65 -1.60 5.23 0.00 -1.26 -4.93 121.76 117.78 2jtn s ALA 38 Ca -0.01 2.08 0.00 0.00 0.00 0.00 0.00 51.96 54.02 2jtn s ALA 38 Cb -0.20 -2.02 0.00 0.00 0.00 0.00 0.00 23.12 20.89 2jtn s ALA 38 CO -0.02 -0.93 0.00 0.00 0.00 0.00 0.00 175.76 174.82 2jtn n ALA 39 N 4.95 -0.23 -2.72 0.00 0.00 -1.26 -3.64 120.51 117.61 2jtn n ALA 39 Ca -0.10 0.24 -0.06 0.00 0.00 0.00 0.00 53.44 53.53 2jtn n ALA 39 Cb 0.52 -1.76 0.01 0.00 0.00 0.00 0.00 19.45 18.22 2jtn n ALA 39 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2jtn n ASN 40 N -0.91 -7.50 0.00 0.00 5.03 -1.26 -5.00 115.26 105.63 2jtn n ASN 40 Ca -0.15 0.62 0.00 0.00 0.87 0.00 0.00 54.58 55.92 2jtn n ASN 40 Cb 0.57 -5.04 0.00 0.00 -1.02 0.00 0.00 39.78 34.28 2jtn n ASN 40 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2jtn n GLY 41 N -0.17 -2.79 0.07 7.41 0.00 -1.24 -4.61 105.19 103.86 2jtn n GLY 41 Ca 0.09 0.01 -0.08 0.00 0.00 0.00 0.00 46.02 46.04 2jtn n GLY 41 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2jtn h ILE 42 N 0.00 0.60 -1.06 -0.61 5.03 -1.94 -3.48 117.51 116.05 2jtn h ILE 42 Ca 0.00 -1.54 -0.52 0.00 -0.12 0.00 0.00 64.86 62.68 2jtn h ILE 42 Cb 0.00 1.23 -0.02 0.00 -3.03 0.00 0.00 36.82 34.99 2jtn h ILE 42 CO 0.00 0.20 -0.29 -0.62 -0.68 0.00 0.00 178.15 176.77 2jtn s ASP 43 N -5.99 4.96 -0.08 1.72 2.15 -1.26 -5.13 116.67 113.04 2jtn s ASP 43 Ca -0.13 -0.91 -0.00 0.00 0.43 0.00 0.00 52.55 51.93 2jtn s ASP 43 Cb 0.01 -0.08 0.02 0.00 -0.30 0.00 0.00 42.92 42.57 2jtn s ASP 43 CO 0.33 -0.95 -0.04 -1.81 -0.17 0.00 0.00 175.17 172.53 2jtn s ASP 44 N -4.30 1.65 -0.44 -0.34 1.11 -1.26 -4.51 116.67 108.58 2jtn s ASP 44 Ca 0.47 -0.17 -0.12 0.00 0.18 0.00 0.00 52.55 52.91 2jtn s ASP 44 Cb -0.04 -0.59 0.07 0.00 1.07 0.00 0.00 42.92 43.44 2jtn s ASP 44 CO 0.28 -0.13 0.32 -0.70 1.18 0.00 0.00 175.17 176.12 2jtn s GLU 45 N 1.60 2.77 0.00 8.23 2.12 -1.26 -4.63 118.70 127.53 2jtn s GLU 45 Ca 0.01 -1.40 0.00 0.00 0.36 0.00 0.00 54.97 53.94 2jtn s GLU 45 Cb -0.13 -3.93 0.00 0.00 0.26 0.00 0.00 34.13 30.33 2jtn s GLU 45 CO -0.05 -0.98 0.00 0.41 -0.54 0.00 0.00 175.26 174.11 2jtn n GLY 46 N 5.04 -0.69 0.40 -1.50 0.00 -1.26 -5.00 105.19 102.19 2jtn n GLY 46 Ca -0.11 0.38 0.00 0.00 0.00 0.00 0.00 46.02 46.28 2jtn n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jtn n GLY 47 N 0.00 1.56 3.76 -0.02 0.00 -1.26 -5.07 105.19 104.16 2jtn n GLY 47 Ca 0.00 -0.18 -0.40 0.00 0.00 0.00 0.00 46.02 45.44 2jtn n GLY 47 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jtn s SER 48 N -2.20 7.17 -0.56 1.61 1.04 -1.26 -5.01 113.70 114.49 2jtn s SER 48 Ca 0.00 2.23 -0.11 0.00 0.48 0.00 0.00 55.95 58.56 2jtn s SER 48 Cb 0.00 -2.62 0.14 0.00 0.10 0.00 0.00 66.02 63.64 2jtn s SER 48 CO 0.00 -0.21 0.46 -0.83 0.98 0.00 0.00 173.24 173.64 2jtn s GLY 49 N -1.00 2.20 0.00 7.32 0.00 -1.26 -4.38 107.32 110.20 2jtn s GLY 49 Ca 0.47 -2.74 0.00 0.00 0.00 0.00 0.00 44.72 42.45 2jtn s GLY 49 CO 0.39 1.15 0.00 0.61 0.00 0.00 0.00 173.10 175.25 2jtn n GLY 50 N 4.68 1.90 3.57 0.20 0.00 -1.26 -5.02 105.19 109.26 2jtn n GLY 50 Ca -0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.65 2jtn n GLY 50 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2jtn s HIS 51 N -2.00 2.18 -0.14 1.61 -0.00 -1.26 -4.58 115.29 111.09 2jtn s HIS 51 Ca 0.00 -0.13 0.23 0.00 -0.00 0.00 0.00 55.06 55.15 2jtn s HIS 51 Cb 0.00 -4.29 0.47 0.00 -0.00 0.00 0.00 32.58 28.76 2jtn s HIS 51 CO 0.00 -1.61 1.15 -1.33 -0.00 0.00 0.00 174.74 172.94 2jtn n MET 52 N 8.58 1.07 0.00 -0.38 0.00 -1.26 -4.89 117.12 120.24 2jtn n MET 52 Ca 0.42 -2.87 0.00 0.00 0.00 0.00 0.00 57.70 55.25 2jtn n MET 52 Cb 0.47 -0.94 0.00 0.00 0.00 0.00 0.00 33.22 32.75 2jtn n MET 52 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2jtn n GLY 53 N -0.15 0.45 0.00 3.03 0.00 -1.26 -5.04 105.19 102.21 2jtn n GLY 53 Ca 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2jtn n GLY 53 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jtn n SER 54 N 0.00 0.00 -4.69 1.61 7.64 -1.26 -4.62 113.62 112.30 2jtn n SER 54 Ca 0.00 0.96 -0.40 0.00 1.01 0.00 0.00 58.87 60.44 2jtn n SER 54 Cb 0.00 -0.47 -0.05 0.00 -1.01 0.00 0.00 64.21 62.68 2jtn n SER 54 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2jtn s GLY 55 N -0.95 2.36 -0.15 0.23 0.00 -1.26 -5.02 107.32 102.52 2jtn s GLY 55 Ca 0.00 0.02 -0.34 0.00 0.00 0.00 0.00 44.72 44.40 2jtn s GLY 55 CO 0.00 1.34 1.18 -0.32 0.00 0.00 0.00 173.10 175.30 2jtn s GLY 56 N 0.98 -0.32 -0.82 0.20 0.00 -1.26 -4.90 107.32 101.20 2jtn s GLY 56 Ca 0.36 1.44 -0.08 0.00 0.00 0.00 0.00 44.72 46.44 2jtn s GLY 56 CO 0.15 0.47 0.72 -0.51 0.00 0.00 0.00 173.10 173.92 2jtn s THR 57 N -2.50 4.84 0.81 0.90 -4.23 -1.26 -5.07 115.64 109.13 2jtn s THR 57 Ca 0.09 -3.03 -0.11 0.00 -1.18 0.00 0.00 61.69 57.47 2jtn s THR 57 Cb -0.00 -4.02 0.08 0.00 1.34 0.00 0.00 72.50 69.90 2jtn s THR 57 CO -0.05 -1.02 1.09 -2.16 -0.54 0.00 0.00 174.62 171.95 2jtn s PRO 58 N -0.40 1.93 -1.62 3.99 0.04 -1.26 -3.67 135.00 134.02 2jtn s PRO 58 Ca 0.21 1.09 -0.03 0.00 0.04 0.00 0.00 61.00 62.31 2jtn s PRO 58 Cb -0.13 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.55 2jtn s PRO 58 CO -0.08 -1.85 0.45 0.39 0.04 0.00 0.00 177.00 175.96 2jtn n GLU 59 N -3.65 -4.07 -4.45 4.56 1.02 -1.26 -4.99 120.64 107.80 2jtn n GLU 59 Ca 0.09 0.94 -0.34 0.00 -0.02 0.00 0.00 57.16 57.82 2jtn n GLU 59 Cb 0.54 -5.74 -0.11 0.00 -0.02 0.00 0.00 31.44 26.10 2jtn n GLU 59 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 2jtn s ILE 60 N -3.15 3.94 0.14 -3.67 1.10 -1.24 -5.08 121.20 113.24 2jtn s ILE 60 Ca 0.22 -0.36 -0.31 0.00 -0.51 0.00 0.00 60.65 59.69 2jtn s ILE 60 Cb -0.10 -2.68 -0.11 0.00 0.15 0.00 0.00 42.46 39.72 2jtn s ILE 60 CO 0.28 0.54 1.82 -2.16 -2.11 0.00 0.00 174.94 173.31 2jtn s PRO 61 N -0.20 4.13 0.15 3.50 0.04 -1.26 -4.82 135.00 136.54 2jtn s PRO 61 Ca 0.04 2.61 -0.23 0.00 0.04 0.00 0.00 61.00 63.46 2jtn s PRO 61 Cb -0.13 -3.51 -0.08 0.00 0.04 0.00 0.00 34.50 30.82 2jtn s PRO 61 CO 0.02 -0.84 0.73 -1.64 0.04 0.00 0.00 177.00 175.31 2jtn s MET 62 N 2.50 4.45 1.04 4.56 -1.94 -1.26 -3.96 119.30 124.69 2jtn s MET 62 Ca 0.80 1.04 -0.12 0.00 -1.71 0.00 0.00 55.69 55.70 2jtn s MET 62 Cb -0.47 -3.21 0.18 0.00 2.01 0.00 0.00 34.83 33.34 2jtn s MET 62 CO 0.36 0.57 0.88 0.00 -0.01 0.00 0.00 175.02 176.81 2jtn s ALA 64 N -2.48 3.43 0.00 0.00 0.00 -1.23 -4.31 121.76 117.17 2jtn s ALA 64 Ca 0.65 -0.58 0.00 0.00 0.00 0.00 0.00 51.96 52.03 2jtn s ALA 64 Cb -0.22 -3.40 0.00 0.00 0.00 0.00 0.00 23.12 19.49 2jtn s ALA 64 CO 0.63 -1.49 0.00 0.41 0.00 0.00 0.00 175.76 175.30 2jtn n GLY 65 N 4.46 2.23 3.80 0.00 0.00 -1.26 -4.07 105.19 110.36 2jtn n GLY 65 Ca 0.04 -0.71 -0.27 0.00 0.00 0.00 0.00 46.02 45.07 2jtn n GLY 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jtn s ASP 67 N -2.94 5.80 -0.30 0.00 1.11 -1.26 -4.23 116.67 114.85 2jtn s ASP 67 Ca 0.31 -1.33 -0.19 0.00 0.18 0.00 0.00 52.55 51.52 2jtn s ASP 67 Cb -0.11 -2.57 0.21 0.00 1.07 0.00 0.00 42.92 41.52 2jtn s ASP 67 CO 0.23 -2.18 1.34 -1.58 1.18 0.00 0.00 175.17 174.17 2jtn s GLN 68 N 5.88 0.03 0.38 8.23 0.74 -1.26 -5.01 119.66 128.65 2jtn s GLN 68 Ca 0.60 0.04 -0.26 0.00 0.05 0.00 0.00 55.36 55.79 2jtn s GLN 68 Cb -0.02 0.01 -0.09 0.00 1.10 0.00 0.00 33.01 34.01 2jtn s GLN 68 CO -0.00 -0.01 1.13 -3.38 -0.55 0.00 0.00 175.29 172.49 2jtn s HIS 69 N 0.68 3.20 0.58 1.67 0.00 -1.26 0.97 115.29 121.13 2jtn s HIS 69 Ca -0.03 1.60 -0.18 0.00 -3.00 0.00 0.00 55.06 53.45 2jtn s HIS 69 Cb -0.03 -3.33 -0.04 0.00 -4.00 0.00 0.00 32.58 25.18 2jtn s HIS 69 CO -0.12 -1.05 1.11 0.42 -1.00 0.00 0.00 174.74 174.10 2jtn s ILE 70 N -1.41 3.32 -0.06 -5.38 -1.09 -1.25 -4.72 121.20 110.60 2jtn s ILE 70 Ca 0.55 0.73 0.02 0.00 -2.23 0.00 0.00 60.65 59.72 2jtn s ILE 70 Cb -0.29 -3.26 0.07 0.00 -1.58 0.00 0.00 42.46 37.40 2jtn s ILE 70 CO 0.37 -0.27 0.60 0.00 -1.23 0.00 0.00 174.94 174.41 2jtn n LEU 71 N -1.69 -0.37 -4.80 2.97 -0.00 -1.26 -5.02 117.00 106.82 2jtn n LEU 71 Ca 0.11 -1.21 -0.22 0.00 -0.00 0.00 0.00 56.01 54.69 2jtn n LEU 71 Cb 0.52 0.44 -0.05 0.00 -0.00 0.00 0.00 43.42 44.33 2jtn n LEU 71 CO 0.44 1.04 -0.15 -1.81 -0.00 0.00 0.00 177.39 176.91 2jtn s ASP 72 N -0.31 5.21 0.00 1.45 1.01 -1.26 -3.05 116.67 119.71 2jtn s ASP 72 Ca 0.02 -0.47 0.00 0.00 0.71 0.00 0.00 52.55 52.81 2jtn s ASP 72 Cb 0.08 -1.07 0.00 0.00 1.01 0.00 0.00 42.92 42.94 2jtn s ASP 72 CO -0.02 -0.20 0.80 -1.14 0.21 0.00 0.00 175.17 174.81 2jtn n ARG 73 N -1.23 0.00 -2.80 8.23 0.63 -1.05 -4.10 116.66 116.35 2jtn n ARG 73 Ca -0.04 0.31 -0.42 0.00 -0.92 0.00 0.00 57.85 56.77 2jtn n ARG 73 Cb 0.59 -1.30 -0.03 0.00 0.45 0.00 0.00 32.46 32.17 2jtn n ARG 73 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 2jtn s PHE 74 N -2.19 3.35 0.07 -0.14 0.40 -1.26 0.10 117.98 118.30 2jtn s PHE 74 Ca 0.00 1.29 0.08 0.00 -0.60 0.00 0.00 56.93 57.71 2jtn s PHE 74 Cb 0.00 -3.13 -0.03 0.00 0.51 0.00 0.00 43.02 40.37 2jtn s PHE 74 CO 0.00 -0.39 -0.23 0.42 0.70 0.00 0.00 175.22 175.72 2jtn s ILE 75 N 2.81 1.84 -0.43 0.64 -1.09 -0.30 -4.95 121.20 119.72 2jtn s ILE 75 Ca 0.39 -1.39 -0.13 0.00 -2.23 0.00 0.00 60.65 57.30 2jtn s ILE 75 Cb -0.16 -1.61 0.06 0.00 -1.58 0.00 0.00 42.46 39.17 2jtn s ILE 75 CO 0.08 0.16 0.31 -0.76 -1.23 0.00 0.00 174.94 173.50 2jtn s LEU 76 N -1.48 5.26 -0.15 2.97 1.02 -1.24 -2.01 118.68 123.05 2jtn s LEU 76 Ca 0.09 -1.26 -0.19 0.00 0.02 0.00 0.00 54.13 52.79 2jtn s LEU 76 Cb -0.09 -2.10 -0.04 0.00 0.02 0.00 0.00 46.19 43.98 2jtn s LEU 76 CO 0.03 -0.54 0.51 -0.75 0.02 0.00 0.00 176.35 175.61 2jtn s LYS 77 N 1.57 4.28 0.08 1.70 2.20 -0.61 -0.50 119.74 128.46 2jtn s LYS 77 Ca 0.03 0.46 -0.27 0.00 -0.36 0.00 0.00 55.97 55.84 2jtn s LYS 77 Cb -0.22 -3.49 0.08 0.00 -1.51 0.00 0.00 37.83 32.69 2jtn s LYS 77 CO 0.06 0.03 0.92 0.00 -0.36 0.00 0.00 175.35 175.99 2jtn s ALA 78 N 1.05 -1.73 -1.48 3.13 0.00 0.29 0.10 121.76 123.12 2jtn s ALA 78 Ca 0.26 0.53 -0.07 0.00 0.00 0.00 0.00 51.96 52.68 2jtn s ALA 78 Cb -0.15 0.55 0.01 0.00 0.00 0.00 0.00 23.12 23.53 2jtn s ALA 78 CO 0.10 -0.88 0.85 1.28 0.00 0.00 0.00 175.76 177.11 2jtn n LEU 79 N -0.37 -2.92 -2.15 0.00 4.77 -1.26 -1.37 117.00 113.70 2jtn n LEU 79 Ca -0.08 -0.41 -0.19 0.00 -0.03 0.00 0.00 56.01 55.30 2jtn n LEU 79 Cb 0.61 -2.96 -0.01 0.00 -2.33 0.00 0.00 43.42 38.73 2jtn n LEU 79 CO 0.12 0.40 -0.24 0.47 -1.33 0.00 0.00 177.39 176.82 2jtn n ASP 80 N -2.72 -5.50 -3.21 -1.43 8.00 -1.26 -4.92 116.55 105.51 2jtn n ASP 80 Ca -0.06 0.01 -0.02 0.00 0.71 0.00 0.00 54.79 55.43 2jtn n ASP 80 Cb 0.59 -4.55 0.02 0.00 -0.02 0.00 0.00 41.12 37.16 2jtn n ASP 80 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2jtn n ARG 81 N -2.82 0.53 -3.52 -1.24 1.74 -0.47 -5.14 116.66 105.74 2jtn n ARG 81 Ca -0.23 -1.27 -0.37 0.00 -0.77 0.00 0.00 57.85 55.21 2jtn n ARG 81 Cb 0.67 1.75 -0.09 0.00 -1.02 0.00 0.00 32.46 33.78 2jtn n ARG 81 CO 0.00 0.00 0.00 -3.38 -1.52 0.00 0.00 177.63 172.73 2jtn s HIS 82 N -2.34 3.33 -0.12 -1.55 -3.43 -1.26 0.10 115.29 110.03 2jtn s HIS 82 Ca 0.22 0.41 0.01 0.00 -0.80 0.00 0.00 55.06 54.90 2jtn s HIS 82 Cb -0.02 -2.41 -0.01 0.00 -1.43 0.00 0.00 32.58 28.71 2jtn s HIS 82 CO 0.04 0.00 -0.16 -1.58 -2.00 0.00 0.00 174.74 171.04 2jtn s TRP 83 N 1.26 2.73 1.17 0.38 0.52 0.34 -3.53 118.94 121.81 2jtn s TRP 83 Ca 0.13 -0.73 -0.17 0.00 0.02 0.00 0.00 56.10 55.35 2jtn s TRP 83 Cb -0.14 -1.79 0.19 0.00 -1.15 0.00 0.00 33.47 30.58 2jtn s TRP 83 CO 0.07 -0.25 0.39 1.58 0.02 0.00 0.00 176.95 178.76 2jtn n HIS 84 N 3.45 -1.60 0.15 -1.98 -0.00 -1.26 -3.65 115.22 110.33 2jtn n HIS 84 Ca -0.18 -0.04 -0.25 0.00 0.46 0.00 0.00 57.72 57.71 2jtn n HIS 84 Cb 0.53 -1.57 -0.16 0.00 -0.12 0.00 0.00 29.99 28.66 2jtn n HIS 84 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 2jtn h SER 85 N -2.43 0.85 0.62 0.26 4.64 -1.93 -3.05 113.55 112.51 2jtn h SER 85 Ca -0.55 -0.92 -0.20 0.00 -0.47 0.00 0.00 61.79 59.65 2jtn h SER 85 Cb 1.32 -0.28 -0.04 0.00 -0.31 0.00 0.00 62.40 63.10 2jtn h SER 85 CO 0.40 1.71 -1.52 0.29 -0.87 0.00 0.00 176.83 176.85 2jtn n LYS 86 N -3.73 0.63 0.14 4.77 5.02 -1.26 -4.02 118.16 119.71 2jtn n LYS 86 Ca -0.17 0.23 -0.01 0.00 -2.02 0.00 0.00 58.31 56.34 2jtn n LYS 86 Cb 1.11 -1.79 0.21 0.00 -0.02 0.00 0.00 35.03 34.54 2jtn n LYS 86 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2jtn s LEU 88 N -7.79 3.57 0.06 0.00 2.96 -1.15 -4.85 118.68 111.48 2jtn s LEU 88 Ca -0.02 -2.17 0.02 0.00 -0.22 0.00 0.00 54.13 51.74 2jtn s LEU 88 Cb 0.13 -2.58 -0.03 0.00 0.50 0.00 0.00 46.19 44.21 2jtn s LEU 88 CO 0.76 -1.81 -0.07 -0.54 -1.32 0.00 0.00 176.35 173.36 2jtn s LYS 89 N 4.99 0.63 0.21 1.98 -0.14 -1.26 -2.97 119.74 123.18 2jtn s LYS 89 Ca 0.59 -0.94 -0.30 0.00 -1.36 0.00 0.00 55.97 53.96 2jtn s LYS 89 Cb 0.02 -0.26 -0.09 0.00 -1.68 0.00 0.00 37.83 35.82 2jtn s LYS 89 CO 0.09 0.03 1.26 0.00 -0.76 0.00 0.00 175.35 175.97 2jtn h SER 91 N 5.05 0.00 0.00 0.00 0.87 -1.98 0.22 113.55 117.71 2jtn h SER 91 Ca -0.45 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.11 2jtn h SER 91 Cb 1.22 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.18 2jtn h SER 91 CO 0.75 0.00 -0.59 -0.67 -0.53 0.00 0.00 176.83 175.78 2jtn n ASP 92 N -4.42 1.28 -0.10 6.23 2.03 -1.26 -4.62 116.55 115.69 2jtn n ASP 92 Ca -0.03 0.21 0.06 0.00 0.52 0.00 0.00 54.79 55.56 2jtn n ASP 92 Cb 0.09 -0.60 0.40 0.00 -0.72 0.00 0.00 41.12 40.29 2jtn n ASP 92 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jtn n HIS 94 N -4.47 -0.61 -2.73 0.00 -0.00 0.79 -4.91 115.22 103.29 2jtn n HIS 94 Ca 0.08 0.00 -0.30 0.00 0.46 0.00 0.00 57.72 57.96 2jtn n HIS 94 Cb 0.19 -3.06 -0.02 0.00 -0.12 0.00 0.00 29.99 26.98 2jtn n HIS 94 CO 0.00 0.00 0.00 0.14 0.46 0.00 0.00 176.34 176.94 2jtn s VAL 95 N -2.53 4.81 -0.14 3.57 -7.23 -1.26 -4.75 120.40 112.87 2jtn s VAL 95 Ca 0.00 0.54 -0.29 0.00 -1.81 0.00 0.00 61.98 60.42 2jtn s VAL 95 Cb 0.00 -3.77 -0.03 0.00 0.56 0.00 0.00 36.38 33.14 2jtn s VAL 95 CO 0.00 -0.64 1.45 -2.16 -0.31 0.00 0.00 175.10 173.44 2jtn s PRO 96 N -4.15 4.13 -0.97 4.82 0.04 -1.26 -3.76 135.00 133.85 2jtn s PRO 96 Ca 0.51 1.82 -0.01 0.00 0.04 0.00 0.00 61.00 63.36 2jtn s PRO 96 Cb -0.10 -3.89 0.31 0.00 0.04 0.00 0.00 34.50 30.86 2jtn s PRO 96 CO 0.36 -0.87 1.47 1.28 0.04 0.00 0.00 177.00 179.29 2jtn n LEU 97 N 7.12 6.28 -2.11 -3.56 4.32 -1.16 -4.77 117.00 123.13 2jtn n LEU 97 Ca 0.16 -5.34 -0.22 0.00 -0.02 0.00 0.00 56.01 50.59 2jtn n LEU 97 Cb 0.44 -1.11 0.16 0.00 -1.62 0.00 0.00 43.42 41.30 2jtn n LEU 97 CO 0.60 1.92 1.22 0.00 -1.22 0.00 0.00 177.39 179.90 2jtn n ALA 98 N 0.66 5.33 0.03 -1.18 0.00 -1.26 -4.38 120.51 119.70 2jtn n ALA 98 Ca 0.34 -2.63 0.00 0.00 0.00 0.00 0.00 53.44 51.15 2jtn n ALA 98 Cb 0.32 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.36 2jtn n ALA 98 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2jtn n GLU 99 N -0.98 0.00 -4.42 0.00 -0.58 -1.26 -5.12 120.64 108.28 2jtn n GLU 99 Ca 0.54 0.00 -0.21 0.00 -0.42 0.00 0.00 57.16 57.07 2jtn n GLU 99 Cb 1.54 0.00 -0.09 0.00 -0.57 0.00 0.00 31.44 32.32 2jtn n GLU 99 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 2jtn s ARG 100 N -2.00 1.70 -0.20 3.49 3.00 -1.26 -4.61 118.95 119.07 2jtn s ARG 100 Ca 0.00 -1.99 -0.22 0.00 0.00 0.00 0.00 55.73 53.52 2jtn s ARG 100 Cb 0.00 -0.43 0.06 0.00 0.00 0.00 0.00 34.95 34.58 2jtn s ARG 100 CO 0.00 -0.40 0.61 0.00 0.00 0.00 0.00 175.30 175.51 2jtn s PHE 102 N 0.07 1.61 0.05 0.00 0.40 -0.65 -4.22 117.98 115.24 2jtn s PHE 102 Ca -0.02 -1.23 -0.11 0.00 -0.60 0.00 0.00 56.93 54.97 2jtn s PHE 102 Cb -0.04 -0.94 0.01 0.00 0.51 0.00 0.00 43.02 42.56 2jtn s PHE 102 CO 0.02 -0.36 0.22 0.45 0.70 0.00 0.00 175.22 176.25 2jtn s SER 103 N -3.37 -0.00 -0.30 1.36 0.15 -1.26 -2.48 113.70 107.80 2jtn s SER 103 Ca 0.36 -0.34 -0.15 0.00 0.70 0.00 0.00 55.95 56.51 2jtn s SER 103 Cb 0.07 0.31 0.16 0.00 -1.71 0.00 0.00 66.02 64.85 2jtn s SER 103 CO 0.15 -0.59 1.00 -0.60 1.20 0.00 0.00 173.24 174.40 2jtn s ARG 104 N -2.67 0.31 2.12 5.44 6.06 -1.03 -4.84 118.95 124.34 2jtn s ARG 104 Ca -0.04 0.66 0.00 0.00 -2.50 0.00 0.00 55.73 53.85 2jtn s ARG 104 Cb -0.01 0.28 0.00 0.00 0.06 0.00 0.00 34.95 35.29 2jtn s ARG 104 CO -0.04 -0.09 0.00 0.41 -2.50 0.00 0.00 175.30 173.08 2jtn n GLY 105 N 4.43 1.24 2.11 8.12 0.00 -1.26 -2.61 105.19 117.22 2jtn n GLY 105 Ca -0.13 0.32 -0.02 0.00 0.00 0.00 0.00 46.02 46.19 2jtn n GLY 105 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2jtn n GLU 106 N 0.00 0.91 -3.67 1.61 2.13 -1.26 -5.12 120.64 115.24 2jtn n GLU 106 Ca 0.00 -1.68 -0.14 0.00 0.66 0.00 0.00 57.16 56.01 2jtn n GLU 106 Cb 0.00 0.02 -0.07 0.00 0.27 0.00 0.00 31.44 31.66 2jtn n GLU 106 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 2jtn s SER 107 N -1.70 -0.31 -0.33 4.31 0.01 -1.07 -5.13 113.70 109.47 2jtn s SER 107 Ca 0.13 0.11 -0.24 0.00 1.31 0.00 0.00 55.95 57.25 2jtn s SER 107 Cb 0.30 0.41 0.01 0.00 0.21 0.00 0.00 66.02 66.95 2jtn s SER 107 CO -0.08 -0.61 0.84 0.54 0.41 0.00 0.00 173.24 174.34 2jtn s VAL 108 N -2.06 4.72 0.27 3.43 0.11 -1.26 -2.47 120.40 123.14 2jtn s VAL 108 Ca -0.08 1.17 0.11 0.00 -2.93 0.00 0.00 61.98 60.25 2jtn s VAL 108 Cb -0.02 -4.22 -0.05 0.00 -1.53 0.00 0.00 36.38 30.57 2jtn s VAL 108 CO 0.01 -0.36 -0.09 -0.31 -3.33 0.00 0.00 175.10 171.02 2jtn s TYR 109 N 3.14 2.52 0.48 1.54 1.51 -1.03 -3.90 117.35 121.61 2jtn s TYR 109 Ca 0.34 -0.28 0.06 0.00 -1.01 0.00 0.00 57.07 56.19 2jtn s TYR 109 Cb -0.13 -1.12 0.03 0.00 -0.11 0.00 0.00 41.96 40.63 2jtn s TYR 109 CO 0.15 0.66 0.66 0.00 -1.11 0.00 0.00 175.55 175.91 2jtn h LYS 111 N 0.40 0.18 0.14 0.00 1.57 -1.95 -3.01 116.57 113.90 2jtn h LYS 111 Ca -0.39 -0.25 0.02 0.00 -1.87 0.00 0.00 60.65 58.15 2jtn h LYS 111 Cb 1.28 0.08 -0.04 0.00 0.08 0.00 0.00 32.23 33.63 2jtn h LYS 111 CO 0.46 1.05 -0.44 0.22 -0.57 0.00 0.00 179.45 180.17 2jtn h ASP 112 N 0.08 -1.31 1.24 0.86 1.82 -2.01 -1.73 116.42 115.36 2jtn h ASP 112 Ca -0.07 0.14 -0.01 0.00 -0.39 0.00 0.00 57.03 56.71 2jtn h ASP 112 Cb 1.71 0.49 -0.00 0.00 0.68 0.00 0.00 39.33 42.21 2jtn h ASP 112 CO 0.16 -0.51 -0.05 -2.24 -1.61 0.00 0.00 179.24 174.98 2jtn h ASP 113 N -0.69 0.00 -0.12 2.28 3.04 -2.00 -3.05 116.42 115.88 2jtn h ASP 113 Ca 0.01 0.00 -0.05 0.00 -3.24 0.00 0.00 57.03 53.75 2jtn h ASP 113 Cb 0.71 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.98 2jtn h ASP 113 CO -0.24 0.05 -0.07 0.15 -2.04 0.00 0.00 179.24 177.09 2jtn h PHE 114 N 0.00 0.43 0.11 4.15 3.04 -1.19 0.98 116.94 124.46 2jtn h PHE 114 Ca -0.00 -0.05 -0.27 0.00 3.98 0.00 0.00 57.97 61.63 2jtn h PHE 114 Cb 0.69 -0.12 0.01 0.00 2.56 0.00 0.00 35.95 39.08 2jtn h PHE 114 CO 0.00 0.48 -1.19 0.74 -2.02 0.00 0.00 178.31 176.33 2jtn h PHE 115 N 0.39 0.53 0.00 0.41 0.04 -1.32 -1.71 116.94 115.29 2jtn h PHE 115 Ca 0.08 -0.37 -0.01 0.00 2.80 0.00 0.00 57.97 60.47 2jtn h PHE 115 Cb 0.37 -0.03 -0.00 0.00 2.20 0.00 0.00 35.95 38.49 2jtn h PHE 115 CO 0.01 1.26 -0.28 -0.22 -0.60 0.00 0.00 178.31 178.48 2jtn h LYS 116 N 0.11 0.00 -0.07 1.51 3.64 -1.50 -3.06 116.57 117.19 2jtn h LYS 116 Ca -0.13 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.20 2jtn h LYS 116 Cb 1.90 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.72 2jtn h LYS 116 CO 0.20 0.09 -0.15 0.00 -2.27 0.00 0.00 179.45 177.32 2jtn h ARG 117 N -1.00 0.23 -1.07 1.90 3.08 0.80 -3.24 114.38 115.09 2jtn h ARG 117 Ca -0.02 -0.15 -0.57 0.00 0.07 0.00 0.00 59.98 59.31 2jtn h ARG 117 Cb 0.33 0.02 -0.27 0.00 0.08 0.00 0.00 29.97 30.14 2jtn h ARG 117 CO -0.01 0.74 0.74 1.19 -1.07 0.00 0.00 179.97 181.56 2jtn n PHE 118 N -4.60 2.88 -4.01 3.04 3.01 -0.67 -4.94 117.46 112.18 2jtn n PHE 118 Ca -0.08 -2.51 -0.13 0.00 1.01 0.00 0.00 57.45 55.74 2jtn n PHE 118 Cb 0.38 -1.22 -0.03 0.00 -0.01 0.00 0.00 39.48 38.60 2jtn n PHE 118 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2jtn n GLY 119 N -0.78 2.13 3.71 1.37 0.00 -1.07 -4.60 105.19 105.95 2jtn n GLY 119 Ca 0.56 -1.58 -0.35 0.00 0.00 0.00 0.00 46.02 44.65 2jtn n GLY 119 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jtn s THR 120 N -2.76 2.01 0.28 2.61 2.01 -1.26 -4.82 115.64 113.71 2jtn s THR 120 Ca 0.27 0.01 -0.02 0.00 0.31 0.00 0.00 61.69 62.25 2jtn s THR 120 Cb -0.01 -2.65 -0.02 0.00 0.01 0.00 0.00 72.50 69.83 2jtn s THR 120 CO 0.19 -0.00 0.32 -0.75 -0.69 0.00 0.00 174.62 173.69 2jtn s LYS 121 N -3.83 1.58 -0.12 4.92 2.20 -1.26 -4.56 119.74 118.67 2jtn s LYS 121 Ca 0.77 -1.68 -0.16 0.00 -0.36 0.00 0.00 55.97 54.54 2jtn s LYS 121 Cb -0.33 0.37 -0.04 0.00 -1.51 0.00 0.00 37.83 36.32 2jtn s LYS 121 CO 0.46 -0.60 0.41 0.00 -0.36 0.00 0.00 175.35 175.26 2jtn n ALA 123 N 3.51 5.20 0.02 0.00 0.00 -1.16 -2.74 120.51 125.34 2jtn n ALA 123 Ca -0.09 -2.54 0.00 0.00 0.00 0.00 0.00 53.44 50.81 2jtn n ALA 123 Cb 0.52 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.58 2jtn n ALA 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jtn n ALA 124 N -0.90 3.00 0.44 0.00 0.00 -1.26 -4.51 120.51 117.28 2jtn n ALA 124 Ca 0.52 0.00 0.05 0.00 0.00 0.00 0.00 53.44 54.01 2jtn n ALA 124 Cb 1.53 0.31 -0.04 0.00 0.00 0.00 0.00 19.45 21.26 2jtn n ALA 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jtn n GLN 126 N -0.92 -1.44 -4.38 0.00 1.13 -1.11 -5.06 117.38 105.61 2jtn n GLN 126 Ca 0.02 0.98 -0.21 0.00 -1.94 0.00 0.00 57.00 55.86 2jtn n GLN 126 Cb 0.16 -4.93 -0.09 0.00 0.11 0.00 0.00 30.24 25.49 2jtn n GLN 126 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 2jtn s LEU 127 N -4.28 1.78 -0.57 1.08 2.96 -1.26 -4.96 118.68 113.43 2jtn s LEU 127 Ca 0.19 -1.61 -0.16 0.00 -0.22 0.00 0.00 54.13 52.33 2jtn s LEU 127 Cb -0.03 0.15 0.13 0.00 0.50 0.00 0.00 46.19 46.95 2jtn s LEU 127 CO 0.59 -0.91 0.56 -0.83 -1.32 0.00 0.00 176.35 174.44 2jtn s GLY 128 N -3.44 2.09 0.24 7.98 0.00 -1.26 -2.49 107.32 110.44 2jtn s GLY 128 Ca 0.33 -2.56 -0.30 0.00 0.00 0.00 0.00 44.72 42.20 2jtn s GLY 128 CO 0.18 1.27 1.11 -0.42 0.00 0.00 0.00 173.10 175.24 2jtn s ILE 129 N 1.66 3.60 0.94 0.90 1.09 -1.26 -5.01 121.20 123.12 2jtn s ILE 129 Ca 0.06 1.51 -0.19 0.00 -1.10 0.00 0.00 60.65 60.93 2jtn s ILE 129 Cb -0.27 -3.96 -0.03 0.00 -1.06 0.00 0.00 42.46 37.13 2jtn s ILE 129 CO 0.02 0.32 -0.62 -2.65 -0.10 0.00 0.00 174.94 171.91 2jtn n PRO 130 N 1.70 -0.76 -0.00 2.79 -0.02 -1.26 -4.95 135.00 132.51 2jtn n PRO 130 Ca 0.01 -0.22 -0.08 0.00 -2.02 0.00 0.00 63.50 61.18 2jtn n PRO 130 Cb 0.45 -1.24 -0.07 0.00 -0.02 0.00 0.00 33.50 32.63 2jtn n PRO 130 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2jtn h PRO 131 N -1.71 -0.11 0.00 0.52 0.11 -1.97 -3.40 132.00 125.44 2jtn h PRO 131 Ca -0.33 0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.79 2jtn h PRO 131 Cb 1.04 0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 2jtn h PRO 131 CO 0.20 0.33 -0.09 2.41 -0.21 0.00 0.00 178.00 180.65 2jtn n THR 132 N -4.81 1.92 -2.15 -1.15 -1.04 -1.26 0.52 114.28 106.31 2jtn n THR 132 Ca -0.06 -2.41 -0.41 0.00 -2.04 0.00 0.00 64.05 59.13 2jtn n THR 132 Cb 0.24 -0.23 -0.03 0.00 -1.82 0.00 0.00 70.33 68.50 2jtn n THR 132 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jtn s GLN 133 N -2.91 4.37 -0.44 -2.82 1.03 -1.26 -4.77 119.66 112.87 2jtn s GLN 133 Ca 0.33 2.15 -0.28 0.00 0.04 0.00 0.00 55.36 57.60 2jtn s GLN 133 Cb 0.29 -3.12 0.01 0.00 0.03 0.00 0.00 33.01 30.22 2jtn s GLN 133 CO 0.01 -0.22 1.48 0.08 -2.54 0.00 0.00 175.29 174.11 2jtn s VAL 134 N -0.59 3.81 0.06 3.63 1.01 -1.26 -3.97 120.40 123.08 2jtn s VAL 134 Ca 0.53 0.79 -0.04 0.00 0.00 0.00 0.00 61.98 63.25 2jtn s VAL 134 Cb -0.39 -4.17 -0.02 0.00 0.00 0.00 0.00 36.38 31.81 2jtn s VAL 134 CO 0.46 -0.79 0.07 0.54 0.00 0.00 0.00 175.10 175.38 2jtn s VAL 135 N 5.87 0.17 -0.11 2.92 0.11 -1.26 -4.79 120.40 123.31 2jtn s VAL 135 Ca 0.62 -1.40 -0.12 0.00 -2.93 0.00 0.00 61.98 58.15 2jtn s VAL 135 Cb -0.14 -1.26 -0.05 0.00 -1.53 0.00 0.00 36.38 33.40 2jtn s VAL 135 CO 0.31 -0.77 0.28 0.00 -3.33 0.00 0.00 175.10 171.59 2jtn s ARG 136 N -3.47 3.99 -0.34 1.54 1.70 -1.26 0.19 118.95 121.30 2jtn s ARG 136 Ca 0.02 0.12 -0.10 0.00 -0.47 0.00 0.00 55.73 55.30 2jtn s ARG 136 Cb 0.04 -3.32 0.01 0.00 -0.57 0.00 0.00 34.95 31.11 2jtn s ARG 136 CO -0.09 0.48 0.17 1.03 -1.08 0.00 0.00 175.30 175.81 2jtn s ARG 137 N -0.26 3.06 0.37 3.89 0.52 -1.26 -3.25 118.95 122.02 2jtn s ARG 137 Ca 0.18 -0.91 -0.24 0.00 -0.52 0.00 0.00 55.73 54.24 2jtn s ARG 137 Cb -0.14 -3.62 -0.10 0.00 0.52 0.00 0.00 34.95 31.61 2jtn s ARG 137 CO 0.06 -0.55 0.95 0.00 0.02 0.00 0.00 175.30 175.78 2jtn s ALA 138 N 1.57 3.13 0.00 2.13 0.00 -0.75 -4.81 121.76 123.02 2jtn s ALA 138 Ca 0.03 0.48 0.00 0.00 0.00 0.00 0.00 51.96 52.47 2jtn s ALA 138 Cb -0.18 -3.17 0.00 0.00 0.00 0.00 0.00 23.12 19.77 2jtn s ALA 138 CO 0.06 0.14 0.00 0.00 0.00 0.00 0.00 175.76 175.96 2jtn n GLN 139 N 0.01 0.00 -0.76 0.00 0.00 -1.26 -1.27 117.38 114.10 2jtn n GLN 139 Ca 0.04 0.00 -0.14 0.00 0.00 0.00 0.00 57.00 56.90 2jtn n GLN 139 Cb 0.52 0.00 0.06 0.00 0.00 0.00 0.00 30.24 30.82 2jtn n GLN 139 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 2jtn n ASP 140 N -2.12 5.01 -3.98 2.61 2.03 -1.26 -4.88 116.55 113.97 2jtn n ASP 140 Ca 0.00 -2.94 -0.09 0.00 0.52 0.00 0.00 54.79 52.28 2jtn n ASP 140 Cb 0.00 -0.87 -0.05 0.00 -0.72 0.00 0.00 41.12 39.47 2jtn n ASP 140 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 2jtn s PHE 141 N -1.74 0.34 0.05 -0.67 0.08 -0.40 -5.10 117.98 110.55 2jtn s PHE 141 Ca 0.30 -0.70 0.01 0.00 0.12 0.00 0.00 56.93 56.66 2jtn s PHE 141 Cb 0.24 0.16 -0.04 0.00 -0.57 0.00 0.00 43.02 42.82 2jtn s PHE 141 CO 0.02 -0.95 0.12 0.54 -0.10 0.00 0.00 175.22 174.85 2jtn s VAL 142 N -4.00 4.84 0.40 -0.44 0.11 -1.26 -1.82 120.40 118.23 2jtn s VAL 142 Ca 0.21 -0.55 0.03 0.00 -2.93 0.00 0.00 61.98 58.74 2jtn s VAL 142 Cb -0.00 -3.31 -0.04 0.00 -1.53 0.00 0.00 36.38 31.50 2jtn s VAL 142 CO 0.07 0.20 0.08 -0.31 -3.33 0.00 0.00 175.10 171.80 2jtn s TYR 143 N -1.37 1.91 -0.12 1.54 1.51 -1.20 -2.99 117.35 116.62 2jtn s TYR 143 Ca 0.29 -1.08 -0.04 0.00 -1.01 0.00 0.00 57.07 55.22 2jtn s TYR 143 Cb -0.12 -1.32 -0.04 0.00 -0.11 0.00 0.00 41.96 40.37 2jtn s TYR 143 CO 0.21 -0.06 0.04 -1.01 -1.11 0.00 0.00 175.55 173.63 2jtn s HIS 144 N -3.14 3.26 0.63 2.71 3.76 -1.26 -4.60 115.29 116.65 2jtn s HIS 144 Ca 0.25 0.19 0.33 0.00 -0.15 0.00 0.00 55.06 55.68 2jtn s HIS 144 Cb 0.05 -1.90 1.80 0.00 1.11 0.00 0.00 32.58 33.63 2jtn s HIS 144 CO 0.13 0.41 2.07 -0.07 -0.85 0.00 0.00 174.74 176.43 2jtn h LEU 145 N 5.60 0.00 0.07 0.89 4.07 -1.93 1.20 115.31 125.22 2jtn h LEU 145 Ca -0.47 0.00 -0.34 0.00 0.08 0.00 0.00 57.88 57.15 2jtn h LEU 145 Cb 1.19 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.90 2jtn h LEU 145 CO 0.60 0.00 -1.95 1.41 -1.08 0.00 0.00 178.44 177.42 2jtn n HIS 146 N -3.31 1.03 0.95 1.13 8.25 -1.26 -4.25 115.22 117.77 2jtn n HIS 146 Ca -0.00 0.27 0.12 0.00 -0.26 0.00 0.00 57.72 57.85 2jtn n HIS 146 Cb 0.32 -1.15 0.23 0.00 1.12 0.00 0.00 29.99 30.51 2jtn n HIS 146 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2jtn s PHE 148 N -1.86 3.15 0.07 0.00 2.19 0.40 -4.75 117.98 117.18 2jtn s PHE 148 Ca 0.33 0.75 -0.17 0.00 0.33 0.00 0.00 56.93 58.17 2jtn s PHE 148 Cb 0.21 -3.37 0.06 0.00 -1.31 0.00 0.00 43.02 38.60 2jtn s PHE 148 CO 0.31 -0.67 0.80 0.00 1.83 0.00 0.00 175.22 177.49 2jtn n ALA 149 N 6.40 -2.16 -2.73 11.12 0.00 -1.26 -3.58 120.51 128.29 2jtn n ALA 149 Ca 0.05 -0.66 -0.31 0.00 0.00 0.00 0.00 53.44 52.52 2jtn n ALA 149 Cb 0.48 0.28 -0.04 0.00 0.00 0.00 0.00 19.45 20.17 2jtn n ALA 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jtn h VAL 151 N 2.03 0.92 0.00 0.00 -1.51 -0.83 0.16 116.25 117.02 2jtn h VAL 151 Ca -0.46 -1.03 -0.16 0.00 -1.23 0.00 0.00 66.70 63.82 2jtn h VAL 151 Cb 1.16 1.60 -0.02 0.00 -2.13 0.00 0.00 31.29 31.90 2jtn h VAL 151 CO 0.73 0.27 -1.42 0.52 -1.23 0.00 0.00 177.57 176.44 2jtn n VAL 152 N -3.82 1.35 0.22 7.19 0.31 -1.26 -4.58 118.33 117.73 2jtn n VAL 152 Ca -0.01 -0.02 0.07 0.00 -0.01 0.00 0.00 64.34 64.36 2jtn n VAL 152 Cb 0.36 -2.03 0.51 0.00 -0.91 0.00 0.00 33.84 31.78 2jtn n VAL 152 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2jtn n LYS 154 N -3.97 -1.78 -4.54 0.00 4.76 0.04 -4.87 118.16 107.80 2jtn n LYS 154 Ca -0.02 0.92 -0.28 0.00 -2.87 0.00 0.00 58.31 56.07 2jtn n LYS 154 Cb 0.32 -5.53 -0.14 0.00 -1.84 0.00 0.00 35.03 27.84 2jtn n LYS 154 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2jtn s ARG 155 N -4.82 1.45 0.66 1.97 0.52 -1.26 -4.71 118.95 112.76 2jtn s ARG 155 Ca 0.00 -1.19 -0.16 0.00 -0.52 0.00 0.00 55.73 53.86 2jtn s ARG 155 Cb 0.00 -1.76 0.00 0.00 0.52 0.00 0.00 34.95 33.71 2jtn s ARG 155 CO 0.00 0.43 1.16 -0.65 0.02 0.00 0.00 175.30 176.26 2jtn s GLN 156 N -1.68 2.68 -0.04 3.54 -0.21 -1.24 -1.91 119.66 120.80 2jtn s GLN 156 Ca 0.11 1.60 0.05 0.00 0.02 0.00 0.00 55.36 57.13 2jtn s GLN 156 Cb -0.10 -1.92 -0.02 0.00 1.00 0.00 0.00 33.01 31.97 2jtn s GLN 156 CO 0.04 -1.39 -0.18 -0.51 -2.12 0.00 0.00 175.29 171.14 2jtn s LEU 157 N -4.72 2.53 0.37 2.90 2.01 -1.26 -4.93 118.68 115.57 2jtn s LEU 157 Ca 0.71 -0.28 0.08 0.00 0.01 0.00 0.00 54.13 54.65 2jtn s LEU 157 Cb -0.25 -1.49 -0.03 0.00 0.01 0.00 0.00 46.19 44.43 2jtn s LEU 157 CO 0.40 0.34 0.30 0.00 1.01 0.00 0.00 176.35 178.39 2jtn s ALA 158 N -0.69 3.87 0.23 4.21 0.00 -1.26 -4.99 121.76 123.13 2jtn s ALA 158 Ca 0.11 -1.78 -0.29 0.00 0.00 0.00 0.00 51.96 50.00 2jtn s ALA 158 Cb -0.10 -1.03 -0.15 0.00 0.00 0.00 0.00 23.12 21.83 2jtn s ALA 158 CO 0.00 -0.08 0.92 -2.37 0.00 0.00 0.00 175.76 174.23 2jtn n THR 159 N -1.40 1.71 0.00 0.00 5.66 -1.26 -1.60 114.28 117.38 2jtn n THR 159 Ca -0.00 -0.43 0.00 0.00 -3.05 0.00 0.00 64.05 60.57 2jtn n THR 159 Cb 0.61 -0.68 0.00 0.00 -1.55 0.00 0.00 70.33 68.71 2jtn n THR 159 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2jtn n GLY 160 N 1.59 2.95 3.71 1.09 0.00 0.28 -4.88 105.19 109.93 2jtn n GLY 160 Ca 0.13 -0.21 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 2jtn n GLY 160 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jtn s ASP 161 N 0.68 6.56 -0.33 1.61 1.01 -0.63 -4.66 116.67 120.91 2jtn s ASP 161 Ca 0.00 2.63 -0.18 0.00 0.71 0.00 0.00 52.55 55.71 2jtn s ASP 161 Cb 0.00 -2.59 -0.01 0.00 1.01 0.00 0.00 42.92 41.33 2jtn s ASP 161 CO 0.00 -0.86 0.50 -1.61 0.21 0.00 0.00 175.17 173.41 2jtn s GLU 162 N 1.48 3.73 0.29 8.23 2.02 -1.26 0.84 118.70 134.02 2jtn s GLU 162 Ca 0.72 -0.07 0.05 0.00 0.02 0.00 0.00 54.97 55.69 2jtn s GLU 162 Cb -0.44 -3.77 -0.06 0.00 0.10 0.00 0.00 34.13 29.96 2jtn s GLU 162 CO 0.32 -0.56 -0.02 -0.59 0.02 0.00 0.00 175.26 174.42 2jtn s PHE 163 N 2.35 1.91 0.43 1.61 -0.71 -1.14 -3.81 117.98 118.62 2jtn s PHE 163 Ca 0.19 -0.79 0.06 0.00 -1.04 0.00 0.00 56.93 55.35 2jtn s PHE 163 Cb -0.16 -1.14 -0.06 0.00 -1.21 0.00 0.00 43.02 40.45 2jtn s PHE 163 CO 0.12 0.17 0.09 0.71 -1.34 0.00 0.00 175.22 174.97 2jtn s TYR 164 N -3.13 2.45 -0.23 3.49 2.02 0.31 -3.12 117.35 119.14 2jtn s TYR 164 Ca 0.31 -0.67 0.01 0.00 -0.37 0.00 0.00 57.07 56.35 2jtn s TYR 164 Cb 0.05 -1.84 0.06 0.00 -0.40 0.00 0.00 41.96 39.83 2jtn s TYR 164 CO 0.12 0.29 -0.07 -1.17 -1.57 0.00 0.00 175.55 173.15 2jtn s LEU 165 N -3.82 2.66 0.00 -1.29 2.96 -1.26 -1.94 118.68 115.99 2jtn s LEU 165 Ca 0.34 -1.15 0.00 0.00 -0.22 0.00 0.00 54.13 53.10 2jtn s LEU 165 Cb 0.06 -1.26 0.00 0.00 0.50 0.00 0.00 46.19 45.50 2jtn s LEU 165 CO 0.18 -0.21 0.00 0.23 -1.32 0.00 0.00 176.35 175.24 2jtn n MET 166 N 4.63 0.00 -0.07 1.98 2.81 -1.14 -4.64 117.12 120.69 2jtn n MET 166 Ca -0.13 0.00 -0.17 0.00 -1.81 0.00 0.00 57.70 55.59 2jtn n MET 166 Cb 0.44 -0.48 -0.13 0.00 -0.71 0.00 0.00 33.22 32.35 2jtn n MET 166 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 2jtn h GLU 167 N 0.00 0.04 0.00 0.03 4.39 -1.97 -3.49 114.58 113.58 2jtn h GLU 167 Ca 0.00 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.63 2jtn h GLU 167 Cb 0.00 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.67 2jtn h GLU 167 CO 0.00 1.03 0.00 -3.47 -1.16 0.00 0.00 179.01 175.41 2jtn n ASP 168 N -4.48 0.00 -1.06 1.42 -0.08 -1.26 -4.96 116.55 106.13 2jtn n ASP 168 Ca -0.18 0.00 -0.03 0.00 -1.51 0.00 0.00 54.79 53.08 2jtn n ASP 168 Cb 0.59 0.00 0.19 0.00 2.34 0.00 0.00 41.12 44.24 2jtn n ASP 168 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 2jtn n SER 169 N 0.00 2.44 -4.23 1.67 3.41 -1.26 -4.99 113.62 110.66 2jtn n SER 169 Ca 0.00 -3.83 -0.31 0.00 -0.26 0.00 0.00 58.87 54.46 2jtn n SER 169 Cb 0.00 -0.59 -0.17 0.00 -0.26 0.00 0.00 64.21 63.19 2jtn n SER 169 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2jtn s ARG 170 N -3.28 2.77 -0.23 4.33 0.52 -1.26 -4.83 118.95 116.97 2jtn s ARG 170 Ca 0.43 -0.87 -0.08 0.00 -0.52 0.00 0.00 55.73 54.70 2jtn s ARG 170 Cb 0.40 -2.19 -0.04 0.00 0.52 0.00 0.00 34.95 33.64 2jtn s ARG 170 CO -0.02 0.25 0.09 -0.51 0.02 0.00 0.00 175.30 175.13 2jtn s LEU 171 N 0.15 3.71 -0.12 2.53 1.43 -1.26 -2.91 118.68 122.21 2jtn s LEU 171 Ca -0.12 -0.06 -0.04 0.00 -1.03 0.00 0.00 54.13 52.88 2jtn s LEU 171 Cb -0.16 -1.98 0.06 0.00 0.03 0.00 0.00 46.19 44.14 2jtn s LEU 171 CO 0.07 0.04 0.21 0.54 0.23 0.00 0.00 176.35 177.44 2jtn s VAL 172 N 1.18 -0.33 0.86 -1.59 0.11 -0.82 -0.03 120.40 119.78 2jtn s VAL 172 Ca 0.05 0.27 -0.13 0.00 -2.93 0.00 0.00 61.98 59.25 2jtn s VAL 172 Cb -0.14 -0.40 0.20 0.00 -1.53 0.00 0.00 36.38 34.51 2jtn s VAL 172 CO 0.04 0.10 0.46 0.00 -3.33 0.00 0.00 175.10 172.37 2jtn h LYS 174 N 0.00 0.10 -0.32 0.00 1.57 -1.92 -2.40 116.57 113.60 2jtn h LYS 174 Ca -0.21 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.48 2jtn h LYS 174 Cb 0.70 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.00 2jtn h LYS 174 CO 0.12 0.53 0.03 0.00 -0.57 0.00 0.00 179.45 179.57 2jtn h ALA 175 N 0.56 0.42 -0.03 3.86 0.00 -1.93 -2.59 119.26 119.55 2jtn h ALA 175 Ca 0.01 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.71 2jtn h ALA 175 Cb 0.51 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 2jtn h ALA 175 CO 0.01 0.14 0.03 -0.44 0.00 0.00 0.00 179.25 178.99 2jtn h ASP 176 N 0.35 0.00 0.22 0.00 3.32 -1.90 -3.01 116.42 115.40 2jtn h ASP 176 Ca 0.09 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 2jtn h ASP 176 Cb 0.38 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.92 2jtn h ASP 176 CO 0.01 0.00 -0.24 0.22 -1.72 0.00 0.00 179.24 177.51 2jtn h TYR 177 N 0.00 -0.68 -0.20 4.55 3.20 -1.01 0.62 116.97 123.45 2jtn h TYR 177 Ca 0.02 0.01 0.06 0.00 3.14 0.00 0.00 58.73 61.95 2jtn h TYR 177 Cb 0.08 0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 2jtn h TYR 177 CO 0.00 -0.32 0.34 0.93 -1.64 0.00 0.00 178.16 177.47 2jtn h GLU 178 N -0.47 0.00 0.00 1.82 4.39 -1.62 1.05 114.58 119.75 2jtn h GLU 178 Ca -0.03 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.49 2jtn h GLU 178 Cb 0.41 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.03 2jtn h GLU 178 CO -0.04 0.00 -1.24 1.15 -1.16 0.00 0.00 179.01 177.72 2jtn h THR 179 N 0.00 0.75 0.00 1.13 2.02 -1.28 -3.39 112.91 112.13 2jtn h THR 179 Ca 0.10 -2.30 -0.32 0.00 0.77 0.00 0.00 66.41 64.66 2jtn h THR 179 Cb 0.77 2.26 -0.05 0.00 -1.74 0.00 0.00 68.15 69.39 2jtn h THR 179 CO -0.00 0.43 -1.90 0.00 0.37 0.00 0.00 175.52 174.41 2jtn n ALA 180 N -2.38 1.01 -1.12 6.16 0.00 0.21 -5.09 120.51 119.30 2jtn n ALA 180 Ca -0.08 -0.88 0.14 0.00 0.00 0.00 0.00 53.44 52.63 2jtn n ALA 180 Cb 0.86 -0.05 -0.05 0.00 0.00 0.00 0.00 19.45 20.22 2jtn n ALA 180 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2jtn n LYS 181 N -4.35 -2.40 0.00 0.00 4.76 0.33 -5.07 118.16 111.43 2jtn n LYS 181 Ca -0.41 1.76 0.12 0.00 -2.87 0.00 0.00 58.31 56.92 2jtn n LYS 181 Cb 0.75 -2.87 0.17 0.00 -1.84 0.00 0.00 35.03 31.24 2jtn n LYS 181 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07