#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jtn s SER 2 N 0.00 7.07 1.30 -3.46 0.15 -1.26 -5.03 113.70 112.47 2jtn s SER 2 Ca 0.00 1.33 -0.17 0.00 0.70 0.00 0.00 55.95 57.81 2jtn s SER 2 Cb 0.00 -2.51 0.33 0.00 -1.71 0.00 0.00 66.02 62.13 2jtn s SER 2 CO 0.00 -0.53 0.97 0.00 1.20 0.00 0.00 173.24 174.88 2jtn s GLN 3 N 2.61 -1.99 -0.44 5.44 -2.07 -1.26 -5.05 119.66 116.90 2jtn s GLN 3 Ca 0.43 0.53 0.07 0.00 -1.82 0.00 0.00 55.36 54.57 2jtn s GLN 3 Cb -0.16 -1.45 0.18 0.00 -1.09 0.00 0.00 33.01 30.49 2jtn s GLN 3 CO 0.11 -4.35 0.64 0.14 -1.32 0.00 0.00 175.29 170.50 2jtn s VAL 4 N -2.33 -0.93 0.40 3.63 -7.23 -1.26 -5.15 120.40 107.52 2jtn s VAL 4 Ca 0.69 -0.39 -0.25 0.00 -1.81 0.00 0.00 61.98 60.21 2jtn s VAL 4 Cb -0.20 -0.06 -0.08 0.00 0.56 0.00 0.00 36.38 36.59 2jtn s VAL 4 CO 0.62 -0.06 1.19 -2.16 -0.31 0.00 0.00 175.10 174.38 2jtn s PRO 5 N 1.51 4.06 -0.00 4.82 0.04 -1.26 -5.00 135.00 139.17 2jtn s PRO 5 Ca 0.20 1.88 -0.05 0.00 0.04 0.00 0.00 61.00 63.08 2jtn s PRO 5 Cb -0.03 -2.70 0.01 0.00 0.04 0.00 0.00 34.50 31.82 2jtn s PRO 5 CO -0.06 -0.32 0.21 -0.40 0.04 0.00 0.00 177.00 176.46 2jtn n ASP 6 N 0.12 -0.20 -4.73 6.66 5.75 -1.26 -5.03 116.55 117.84 2jtn n ASP 6 Ca 0.04 -1.05 -0.40 0.00 -0.01 0.00 0.00 54.79 53.36 2jtn n ASP 6 Cb 0.46 0.32 0.01 0.00 -1.03 0.00 0.00 41.12 40.88 2jtn n ASP 6 CO 0.00 0.00 0.00 0.55 -0.11 0.00 0.00 177.20 177.64 2jtn n VAL 7 N -0.15 2.66 -3.54 2.12 3.14 -1.26 -4.26 118.33 117.04 2jtn n VAL 7 Ca 0.01 -0.50 -0.06 0.00 -2.96 0.00 0.00 64.34 60.83 2jtn n VAL 7 Cb 0.09 -1.72 0.01 0.00 -1.06 0.00 0.00 33.84 31.17 2jtn n VAL 7 CO 0.00 0.00 0.00 0.23 -6.46 0.00 0.00 176.83 170.60 2jtn n MET 8 N -0.07 0.63 -3.68 1.45 0.00 -1.13 -5.05 117.12 109.28 2jtn n MET 8 Ca 0.06 -1.39 -0.10 0.00 0.00 0.00 0.00 57.70 56.27 2jtn n MET 8 Cb 0.40 1.65 -0.09 0.00 0.00 0.00 0.00 33.22 35.18 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 -2.50 -0.01 0.52 2.03 0.11 -1.26 -2.33 120.40 116.95 2jtn s VAL 9 Ca 0.11 0.04 -0.22 0.00 -2.93 0.00 0.00 61.98 58.99 2jtn s VAL 9 Cb -0.03 -0.77 -0.07 0.00 -1.53 0.00 0.00 36.38 33.99 2jtn s VAL 9 CO 0.08 0.02 1.10 0.52 -3.33 0.00 0.00 175.10 173.49 2jtn n VAL 10 N 4.01 3.21 -3.14 2.04 0.31 0.33 -4.78 118.33 120.32 2jtn n VAL 10 Ca -0.20 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.63 2jtn n VAL 10 Cb 0.57 -1.32 0.00 0.00 -0.91 0.00 0.00 33.84 32.17 2jtn n VAL 10 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2jtn n GLY 11 N 1.08 6.47 3.77 2.92 0.00 -1.26 0.10 105.19 118.28 2jtn n GLY 11 Ca 0.11 -1.83 -0.41 0.00 0.00 0.00 0.00 46.02 43.89 2jtn n GLY 11 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jtn s GLU 12 N 0.57 4.15 0.09 1.61 0.41 -1.26 -3.73 118.70 120.54 2jtn s GLU 12 Ca 0.00 2.51 -0.30 0.00 -0.41 0.00 0.00 54.97 56.77 2jtn s GLU 12 Cb 0.00 -2.99 -0.05 0.00 -1.78 0.00 0.00 34.13 29.30 2jtn s GLU 12 CO 0.00 -0.48 1.05 -2.14 -0.49 0.00 0.00 175.26 173.20 2jtn s PRO 13 N -1.87 4.58 0.07 0.39 0.02 -1.26 -4.73 135.00 132.20 2jtn s PRO 13 Ca 0.53 1.57 -0.26 0.00 0.02 0.00 0.00 61.00 62.86 2jtn s PRO 13 Cb -0.45 -3.37 0.07 0.00 0.02 0.00 0.00 34.50 30.77 2jtn s PRO 13 CO 0.60 0.01 0.63 -0.08 -0.33 0.00 0.00 177.00 177.83 2jtn s THR 14 N 0.44 0.00 0.33 0.99 -1.32 0.29 -4.34 115.64 112.03 2jtn s THR 14 Ca 0.51 0.00 0.03 0.00 -1.21 0.00 0.00 61.69 61.03 2jtn s THR 14 Cb -0.25 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.69 2jtn s THR 14 CO 0.30 0.00 0.11 -0.76 -2.21 0.00 0.00 174.62 172.06 2jtn s LEU 15 N -2.08 1.91 0.42 9.08 1.43 -1.25 -4.06 118.68 124.12 2jtn s LEU 15 Ca -0.04 -1.51 0.10 0.00 -1.03 0.00 0.00 54.13 51.65 2jtn s LEU 15 Cb -0.01 -0.09 0.89 0.00 0.03 0.00 0.00 46.19 47.01 2jtn s LEU 15 CO -0.03 -0.80 1.99 0.00 0.23 0.00 0.00 176.35 177.74 2jtn h MET 16 N 2.08 0.26 -5.74 1.70 -0.00 -1.90 -3.47 114.93 107.87 2jtn h MET 16 Ca -0.37 -0.04 -0.32 0.00 -0.00 0.00 0.00 59.70 58.97 2jtn h MET 16 Cb 1.26 -0.05 0.15 0.00 -0.00 0.00 0.00 31.60 32.96 2jtn h MET 16 CO 0.60 0.31 -0.88 0.41 -0.00 0.00 0.00 176.91 177.35 2jtn n GLY 17 N -1.12 -1.00 0.00 -3.00 0.00 0.25 -4.96 105.19 95.36 2jtn n GLY 17 Ca -0.00 0.48 0.00 0.00 0.00 0.00 0.00 46.02 46.50 2jtn n GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jtn n GLY 18 N -1.38 0.03 2.52 -0.02 0.00 -1.04 -4.81 105.19 100.49 2jtn n GLY 18 Ca -0.11 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.87 2jtn n GLY 18 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2jtn n GLU 19 N -1.64 -1.51 -0.00 1.61 0.00 -1.26 -4.98 120.64 112.86 2jtn n GLU 19 Ca 0.00 1.55 -0.00 0.00 0.00 0.00 0.00 57.16 58.70 2jtn n GLU 19 Cb 0.00 -4.54 0.00 0.00 0.00 0.00 0.00 31.44 26.90 2jtn n GLU 19 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 2jtn n PHE 20 N -0.70 -1.81 -3.32 4.31 3.72 -1.26 -5.05 117.46 113.36 2jtn n PHE 20 Ca 0.06 -0.01 0.00 0.00 -0.05 0.00 0.00 57.45 57.45 2jtn n PHE 20 Cb 0.38 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.90 2jtn n PHE 20 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2jtn n GLY 21 N -0.06 -0.78 0.08 1.37 0.00 -1.26 -5.00 105.19 99.54 2jtn n GLY 21 Ca 0.00 -0.82 -0.11 0.00 0.00 0.00 0.00 46.02 45.10 2jtn n GLY 21 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2jtn h ASP 22 N 0.00 0.13 -0.03 1.61 5.19 -1.97 -3.30 116.42 118.05 2jtn h ASP 22 Ca 0.00 -0.17 0.01 0.00 -0.62 0.00 0.00 57.03 56.25 2jtn h ASP 22 Cb 0.00 -0.04 -0.00 0.00 0.18 0.00 0.00 39.33 39.47 2jtn h ASP 22 CO 0.00 1.14 0.03 1.05 -3.12 0.00 0.00 179.24 178.34 2jtn h GLU 23 N 0.02 0.00 0.00 3.56 4.11 -2.01 -3.22 114.58 117.05 2jtn h GLU 23 Ca -0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.27 2jtn h GLU 23 Cb 1.91 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.16 2jtn h GLU 23 CO 0.13 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 178.96 2jtn n ASP 24 N -4.05 0.00 -4.97 3.06 8.00 -1.24 -4.86 116.55 112.48 2jtn n ASP 24 Ca -0.02 0.70 -0.21 0.00 0.71 0.00 0.00 54.79 55.97 2jtn n ASP 24 Cb 0.12 -0.20 0.02 0.00 -0.02 0.00 0.00 41.12 41.04 2jtn n ASP 24 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2jtn s GLU 25 N -1.80 2.44 0.05 -1.24 0.41 -1.22 -5.09 118.70 112.26 2jtn s GLU 25 Ca 0.00 -1.62 -0.26 0.00 -0.41 0.00 0.00 54.97 52.69 2jtn s GLU 25 Cb 0.00 -2.51 -0.05 0.00 -1.78 0.00 0.00 34.13 29.79 2jtn s GLU 25 CO 0.00 -0.57 0.79 -0.98 -0.49 0.00 0.00 175.26 174.01 2jtn s ARG 26 N -4.42 4.52 0.42 1.61 1.70 -1.26 -4.84 118.95 116.67 2jtn s ARG 26 Ca 0.52 1.11 0.02 0.00 -0.47 0.00 0.00 55.73 56.92 2jtn s ARG 26 Cb -0.05 -3.37 -0.00 0.00 -0.57 0.00 0.00 34.95 30.95 2jtn s ARG 26 CO 0.32 0.26 0.61 -0.51 -1.08 0.00 0.00 175.30 174.90 2jtn s LEU 27 N 0.00 3.73 0.27 -1.89 2.01 -1.26 -4.54 118.68 117.00 2jtn s LEU 27 Ca 0.40 0.12 -0.30 0.00 0.01 0.00 0.00 54.13 54.35 2jtn s LEU 27 Cb -0.21 -3.01 -0.11 0.00 0.01 0.00 0.00 46.19 42.87 2jtn s LEU 27 CO 0.24 -0.64 1.52 0.27 1.01 0.00 0.00 176.35 178.75 2jtn s ILE 28 N -2.44 2.36 -0.48 -0.59 -4.36 -1.26 -4.82 121.20 109.61 2jtn s ILE 28 Ca 0.48 0.30 -0.18 0.00 -0.26 0.00 0.00 60.65 60.98 2jtn s ILE 28 Cb -0.10 -3.19 0.05 0.00 1.25 0.00 0.00 42.46 40.47 2jtn s ILE 28 CO 0.36 0.05 0.56 -0.89 0.24 0.00 0.00 174.94 175.26 2jtn s THR 29 N 0.03 4.96 -0.66 8.37 2.01 0.17 -4.87 115.64 125.64 2jtn s THR 29 Ca 0.62 -0.46 -0.27 0.00 0.31 0.00 0.00 61.69 61.88 2jtn s THR 29 Cb -0.45 -4.21 0.02 0.00 0.01 0.00 0.00 72.50 67.86 2jtn s THR 29 CO 0.45 -0.68 1.41 -0.60 -0.69 0.00 0.00 174.62 174.52 2jtn s ARG 30 N 2.43 3.14 0.03 4.92 3.52 -1.26 -1.93 118.95 129.80 2jtn s ARG 30 Ca 0.14 0.13 -0.05 0.00 -0.13 0.00 0.00 55.73 55.82 2jtn s ARG 30 Cb -0.19 -4.19 -0.01 0.00 -1.56 0.00 0.00 34.95 29.00 2jtn s ARG 30 CO 0.12 -2.17 0.07 -0.48 -0.81 0.00 0.00 175.30 172.04 2jtn s LEU 31 N 6.37 1.89 0.58 -0.88 0.05 -0.90 -5.01 118.68 120.77 2jtn s LEU 31 Ca 0.46 -0.54 -0.14 0.00 0.05 0.00 0.00 54.13 53.96 2jtn s LEU 31 Cb -0.09 0.51 -0.05 0.00 -2.05 0.00 0.00 46.19 44.51 2jtn s LEU 31 CO 0.19 -0.48 1.02 -1.61 -0.55 0.00 0.00 176.35 174.92 2jtn s GLU 32 N -2.46 3.67 -0.23 1.48 2.02 -1.26 -0.92 118.70 121.00 2jtn s GLU 32 Ca -0.06 0.90 -0.02 0.00 0.02 0.00 0.00 54.97 55.81 2jtn s GLU 32 Cb -0.02 -2.09 0.02 0.00 0.10 0.00 0.00 34.13 32.14 2jtn s GLU 32 CO -0.04 -0.50 -0.08 -0.80 0.02 0.00 0.00 175.26 173.86 2jtn s ASN 33 N -3.51 4.16 -0.98 -0.19 -0.87 0.29 -4.82 114.94 109.03 2jtn s ASN 33 Ca 0.58 -0.76 -0.24 0.00 -1.57 0.00 0.00 52.86 50.87 2jtn s ASN 33 Cb -0.11 -1.65 0.00 0.00 -0.02 0.00 0.00 41.25 39.47 2jtn s ASN 33 CO 0.42 -0.09 1.69 0.28 -2.57 0.00 0.00 177.10 176.83 2jtn s THR 34 N 1.35 3.71 0.00 1.60 -1.32 -1.26 -4.38 115.64 115.33 2jtn s THR 34 Ca 0.02 -0.62 0.00 0.00 -1.21 0.00 0.00 61.69 59.88 2jtn s THR 34 Cb -0.16 -4.58 0.00 0.00 -1.51 0.00 0.00 72.50 66.25 2jtn s THR 34 CO -0.05 -1.48 0.00 0.00 -2.21 0.00 0.00 174.62 170.88 2jtn n GLN 35 N 8.85 0.00 0.00 7.08 3.00 -1.26 -5.04 117.38 130.00 2jtn n GLN 35 Ca 0.37 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.36 2jtn n GLN 35 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.73 2jtn n GLN 35 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 2jtn n PHE 36 N -1.99 0.00 -2.20 1.08 7.35 -1.26 -4.76 117.46 115.68 2jtn n PHE 36 Ca 0.00 0.00 -0.42 0.00 -0.76 0.00 0.00 57.45 56.27 2jtn n PHE 36 Cb 0.00 0.00 -0.03 0.00 0.35 0.00 0.00 39.48 39.80 2jtn n PHE 36 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 2jtn s ASP 37 N 0.00 6.01 -0.33 -2.13 1.11 -1.26 -4.87 116.67 115.20 2jtn s ASP 37 Ca 0.00 0.81 -0.07 0.00 0.18 0.00 0.00 52.55 53.47 2jtn s ASP 37 Cb 0.00 -2.54 0.19 0.00 1.07 0.00 0.00 42.92 41.64 2jtn s ASP 37 CO 0.00 -1.71 0.97 0.00 1.18 0.00 0.00 175.17 175.62 2jtn s ALA 38 N 6.52 -3.98 0.04 5.23 0.00 -1.26 -5.15 121.76 123.16 2jtn s ALA 38 Ca 0.66 1.16 0.00 0.00 0.00 0.00 0.00 51.96 53.78 2jtn s ALA 38 Cb -0.16 -2.91 0.00 0.00 0.00 0.00 0.00 23.12 20.05 2jtn s ALA 38 CO 0.30 -2.33 0.00 0.00 0.00 0.00 0.00 175.76 173.73 2jtn n ALA 39 N 4.24 -0.48 -1.58 0.00 0.00 -1.26 -4.31 120.51 117.11 2jtn n ALA 39 Ca 0.07 0.06 -0.24 0.00 0.00 0.00 0.00 53.44 53.33 2jtn n ALA 39 Cb 0.61 -0.17 -0.05 0.00 0.00 0.00 0.00 19.45 19.84 2jtn n ALA 39 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2jtn s ASN 40 N -4.41 4.17 0.00 0.00 0.02 -1.26 -4.78 114.94 108.67 2jtn s ASN 40 Ca 0.00 0.53 0.00 0.00 -1.02 0.00 0.00 52.86 52.37 2jtn s ASN 40 Cb 0.00 -2.53 0.00 0.00 0.02 0.00 0.00 41.25 38.74 2jtn s ASN 40 CO 0.00 -3.39 0.00 0.61 0.02 0.00 0.00 177.10 174.34 2jtn n GLY 41 N 6.42 0.13 3.65 0.66 0.00 -1.26 -5.03 105.19 109.76 2jtn n GLY 41 Ca 0.42 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.03 2jtn n GLY 41 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2jtn n ILE 42 N 0.00 2.66 -2.18 -0.61 0.13 -1.26 -4.88 119.36 113.23 2jtn n ILE 42 Ca 0.00 -0.50 -0.43 0.00 -1.10 0.00 0.00 62.75 60.72 2jtn n ILE 42 Cb 0.00 -1.31 -0.02 0.00 -0.84 0.00 0.00 39.64 37.46 2jtn n ILE 42 CO 0.00 0.00 0.00 -1.81 2.80 0.00 0.00 176.55 177.54 2jtn s ASP 43 N -0.73 6.63 0.00 9.51 1.01 -1.26 -4.68 116.67 127.15 2jtn s ASP 43 Ca 0.64 1.80 0.00 0.00 0.71 0.00 0.00 52.55 55.70 2jtn s ASP 43 Cb -0.52 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 40.87 2jtn s ASP 43 CO 0.56 -1.02 0.00 -0.90 0.21 0.00 0.00 175.17 174.02 2jtn n ASP 44 N 7.54 0.00 -4.70 0.27 5.75 -1.26 -5.09 116.55 119.06 2jtn n ASP 44 Ca 0.17 0.00 -0.42 0.00 -0.01 0.00 0.00 54.79 54.53 2jtn n ASP 44 Cb 0.44 0.16 -0.03 0.00 -1.03 0.00 0.00 41.12 40.67 2jtn n ASP 44 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 2jtn s GLU 45 N -1.72 4.45 -0.94 0.11 2.56 -1.26 -4.96 118.70 116.93 2jtn s GLU 45 Ca 0.00 1.55 -0.01 0.00 0.00 0.00 0.00 54.97 56.51 2jtn s GLU 45 Cb 0.00 -3.48 0.33 0.00 2.00 0.00 0.00 34.13 32.98 2jtn s GLU 45 CO 0.00 -0.26 1.82 0.41 -0.56 0.00 0.00 175.26 176.68 2jtn n GLY 46 N 3.13 5.94 0.00 -1.50 0.00 -1.26 -5.00 105.19 106.50 2jtn n GLY 46 Ca 0.09 -2.57 0.00 0.00 0.00 0.00 0.00 46.02 43.54 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 -0.21 0.94 3.38 -0.02 0.00 -1.26 -5.02 105.19 103.00 2jtn n GLY 47 Ca 0.48 -1.58 -0.11 0.00 0.00 0.00 0.00 46.02 44.81 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 -4.00 -0.34 0.00 1.61 1.04 -1.26 -5.08 113.70 105.67 2jtn s SER 48 Ca 0.00 -0.24 0.00 0.00 0.48 0.00 0.00 55.95 56.19 2jtn s SER 48 Cb 0.00 0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.65 2jtn s SER 48 CO 0.00 -0.92 0.00 0.61 0.98 0.00 0.00 173.24 173.91 2jtn n GLY 49 N -0.29 -0.36 2.53 7.32 0.00 -1.26 -5.07 105.19 108.06 2jtn n GLY 49 Ca -0.15 0.01 -0.26 0.00 0.00 0.00 0.00 46.02 45.61 2jtn n GLY 49 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jtn s GLY 50 N -2.08 0.64 -0.30 -0.02 0.00 -1.26 -5.07 107.32 99.23 2jtn s GLY 50 Ca 0.00 -1.66 0.03 0.00 0.00 0.00 0.00 44.72 43.09 2jtn s GLY 50 CO 0.00 2.26 0.44 0.30 0.00 0.00 0.00 173.10 176.09 2jtn s HIS 51 N 1.13 -1.08 -0.47 1.90 4.02 -1.26 -5.01 115.29 114.51 2jtn s HIS 51 Ca 0.18 0.31 0.03 0.00 1.02 0.00 0.00 55.06 56.61 2jtn s HIS 51 Cb -0.20 -0.10 0.64 0.00 -1.02 0.00 0.00 32.58 31.89 2jtn s HIS 51 CO -0.00 -1.01 1.92 -0.12 1.02 0.00 0.00 174.74 176.55 2jtn n MET 52 N 5.23 2.30 -3.15 1.40 1.56 -1.26 -4.82 117.12 118.38 2jtn n MET 52 Ca 0.02 -3.06 0.05 0.00 -0.27 0.00 0.00 57.70 54.44 2jtn n MET 52 Cb 0.50 -2.18 -0.01 0.00 2.15 0.00 0.00 33.22 33.67 2jtn n MET 52 CO 0.00 0.00 0.00 0.20 -0.73 0.00 0.00 175.97 175.44 2jtn s GLY 53 N -1.42 -0.69 0.08 -5.12 0.00 -1.26 -5.17 107.32 93.74 2jtn s GLY 53 Ca 0.58 2.28 -0.23 0.00 0.00 0.00 0.00 44.72 47.35 2jtn s GLY 53 CO 0.09 3.59 0.55 -1.35 0.00 0.00 0.00 173.10 175.98 2jtn s SER 54 N 2.90 -0.49 -0.30 1.64 1.04 -1.26 -5.16 113.70 112.08 2jtn s SER 54 Ca 0.11 0.13 -0.14 0.00 0.48 0.00 0.00 55.95 56.53 2jtn s SER 54 Cb -0.13 0.53 0.18 0.00 0.10 0.00 0.00 66.02 66.70 2jtn s SER 54 CO -0.16 -0.80 1.03 -0.83 0.98 0.00 0.00 173.24 173.46 2jtn s GLY 55 N -2.21 -0.25 0.00 7.32 0.00 -1.26 -5.17 107.32 105.75 2jtn s GLY 55 Ca -0.03 2.93 0.00 0.00 0.00 0.00 0.00 44.72 47.62 2jtn s GLY 55 CO -0.05 3.53 0.00 0.61 0.00 0.00 0.00 173.10 177.19 2jtn n GLY 56 N 5.18 -3.43 3.26 0.20 0.00 -1.26 -4.91 105.19 104.22 2jtn n GLY 56 Ca -0.07 -1.16 -0.44 0.00 0.00 0.00 0.00 46.02 44.35 2jtn n GLY 56 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jtn s THR 57 N -0.07 5.04 0.94 2.61 2.01 -1.26 -5.07 115.64 119.84 2jtn s THR 57 Ca 0.00 -2.70 -0.12 0.00 0.31 0.00 0.00 61.69 59.18 2jtn s THR 57 Cb 0.00 -4.15 0.16 0.00 0.01 0.00 0.00 72.50 68.52 2jtn s THR 57 CO 0.00 -0.99 1.09 -2.16 -0.69 0.00 0.00 174.62 171.86 2jtn s PRO 58 N -0.01 0.88 -1.68 4.92 0.04 -1.26 -3.56 135.00 134.32 2jtn s PRO 58 Ca 0.18 0.91 -0.00 0.00 0.04 0.00 0.00 61.00 62.13 2jtn s PRO 58 Cb -0.13 -1.76 0.00 0.00 0.04 0.00 0.00 34.50 32.65 2jtn s PRO 58 CO -0.07 -2.53 0.00 -1.91 0.04 0.00 0.00 177.00 172.53 2jtn n GLU 59 N -4.09 -1.79 -4.07 4.56 0.00 -1.26 -4.97 120.64 109.02 2jtn n GLU 59 Ca 0.07 0.95 -0.35 0.00 0.00 0.00 0.00 57.16 57.83 2jtn n GLU 59 Cb 0.55 -5.61 -0.09 0.00 0.00 0.00 0.00 31.44 26.29 2jtn n GLU 59 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.13 175.63 2jtn s ILE 60 N -2.98 4.85 0.13 6.31 1.10 -1.23 -5.06 121.20 124.32 2jtn s ILE 60 Ca 0.00 -0.03 -0.31 0.00 -0.51 0.00 0.00 60.65 59.81 2jtn s ILE 60 Cb -0.00 -3.13 -0.10 0.00 0.15 0.00 0.00 42.46 39.38 2jtn s ILE 60 CO 0.00 0.54 1.79 -2.16 -2.11 0.00 0.00 174.94 173.01 2jtn s PRO 61 N -0.34 4.14 0.65 3.50 0.04 -1.26 -4.86 135.00 136.87 2jtn s PRO 61 Ca 0.09 2.57 -0.10 0.00 0.04 0.00 0.00 61.00 63.60 2jtn s PRO 61 Cb -0.12 -3.52 0.00 0.00 0.04 0.00 0.00 34.50 30.91 2jtn s PRO 61 CO 0.02 -0.82 1.02 -1.64 0.04 0.00 0.00 177.00 175.62 2jtn s MET 62 N 2.49 3.04 0.60 4.56 -1.94 -1.26 -4.16 119.30 122.63 2jtn s MET 62 Ca 0.79 0.38 -0.16 0.00 -1.71 0.00 0.00 55.69 54.99 2jtn s MET 62 Cb -0.46 -2.11 -0.03 0.00 2.01 0.00 0.00 34.83 34.23 2jtn s MET 62 CO 0.35 -0.82 1.06 0.00 -0.01 0.00 0.00 175.02 175.60 2jtn s ALA 64 N -2.44 3.41 0.00 0.00 0.00 -1.26 -3.84 121.76 117.63 2jtn s ALA 64 Ca 0.64 -0.33 0.00 0.00 0.00 0.00 0.00 51.96 52.27 2jtn s ALA 64 Cb -0.16 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.35 2jtn s ALA 64 CO 0.37 -1.62 0.00 0.41 0.00 0.00 0.00 175.76 174.92 2jtn n GLY 65 N 4.27 3.36 3.54 0.00 0.00 -1.26 -4.34 105.19 110.76 2jtn n GLY 65 Ca 0.09 -0.95 -0.23 0.00 0.00 0.00 0.00 46.02 44.93 2jtn n GLY 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jtn n ASP 67 N -1.91 4.91 -3.65 0.00 5.75 -1.26 -4.35 116.55 116.04 2jtn n ASP 67 Ca 0.00 -3.25 0.01 0.00 -0.01 0.00 0.00 54.79 51.54 2jtn n ASP 67 Cb 0.58 -1.09 -0.06 0.00 -1.03 0.00 0.00 41.12 39.52 2jtn n ASP 67 CO 0.00 0.00 0.00 -1.58 -0.11 0.00 0.00 177.20 175.51 2jtn s GLN 68 N -1.95 0.03 0.26 0.11 0.74 -1.26 -4.97 119.66 112.61 2jtn s GLN 68 Ca 0.31 0.04 -0.30 0.00 0.05 0.00 0.00 55.36 55.47 2jtn s GLN 68 Cb -0.00 0.01 -0.10 0.00 1.10 0.00 0.00 33.01 34.01 2jtn s GLN 68 CO -0.04 -0.01 1.49 -3.38 -0.55 0.00 0.00 175.29 172.81 2jtn s HIS 69 N 0.77 2.94 0.69 1.67 0.00 -1.26 0.08 115.29 120.18 2jtn s HIS 69 Ca -0.04 0.93 -0.17 0.00 -3.00 0.00 0.00 55.06 52.79 2jtn s HIS 69 Cb -0.03 -3.90 0.01 0.00 -4.00 0.00 0.00 32.58 24.66 2jtn s HIS 69 CO -0.11 -2.98 1.25 -0.89 -1.00 0.00 0.00 174.74 171.01 2jtn n ILE 70 N 2.36 4.15 -2.19 -5.38 2.08 -1.26 -4.75 119.36 114.38 2jtn n ILE 70 Ca 0.07 -0.42 -0.01 0.00 0.56 0.00 0.00 62.75 62.95 2jtn n ILE 70 Cb 0.39 -1.40 0.01 0.00 -0.75 0.00 0.00 39.64 37.90 2jtn n ILE 70 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2jtn n LEU 71 N -2.20 -0.35 -4.78 1.39 -0.00 -1.26 -5.02 117.00 104.78 2jtn n LEU 71 Ca 0.15 -1.18 -0.24 0.00 -0.00 0.00 0.00 56.01 54.75 2jtn n LEU 71 Cb 0.49 0.45 -0.05 0.00 -0.00 0.00 0.00 43.42 44.31 2jtn n LEU 71 CO 0.47 1.03 -0.22 -1.81 -0.00 0.00 0.00 177.39 176.87 2jtn s ASP 72 N -0.29 5.33 0.00 1.45 1.01 -1.26 -4.63 116.67 118.28 2jtn s ASP 72 Ca 0.01 -0.28 0.00 0.00 0.71 0.00 0.00 52.55 52.99 2jtn s ASP 72 Cb 0.07 -1.31 0.00 0.00 1.01 0.00 0.00 42.92 42.70 2jtn s ASP 72 CO -0.02 0.01 0.79 -1.14 0.21 0.00 0.00 175.17 175.02 2jtn n ARG 73 N -0.84 0.00 -2.60 8.23 3.00 -1.26 -4.27 116.66 118.92 2jtn n ARG 73 Ca -0.08 0.30 -0.43 0.00 -0.00 0.00 0.00 57.85 57.64 2jtn n ARG 73 Cb 0.57 -1.30 -0.02 0.00 0.00 0.00 0.00 32.46 31.71 2jtn n ARG 73 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 2jtn s PHE 74 N -2.19 3.24 0.12 -0.14 0.40 -1.26 0.11 117.98 118.26 2jtn s PHE 74 Ca 0.00 1.36 0.08 0.00 -0.60 0.00 0.00 56.93 57.78 2jtn s PHE 74 Cb 0.00 -3.32 -0.04 0.00 0.51 0.00 0.00 43.02 40.17 2jtn s PHE 74 CO 0.00 -0.78 -0.20 0.42 0.70 0.00 0.00 175.22 175.36 2jtn s ILE 75 N 3.03 1.77 -0.37 0.64 -1.09 -0.10 -4.93 121.20 120.14 2jtn s ILE 75 Ca 0.48 -1.66 -0.06 0.00 -2.23 0.00 0.00 60.65 57.18 2jtn s ILE 75 Cb -0.18 -1.66 0.06 0.00 -1.58 0.00 0.00 42.46 39.11 2jtn s ILE 75 CO 0.11 -0.13 0.15 -0.76 -1.23 0.00 0.00 174.94 173.09 2jtn s LEU 76 N -2.13 4.66 -0.19 2.97 1.02 -1.23 -2.12 118.68 121.66 2jtn s LEU 76 Ca 0.09 -1.39 -0.19 0.00 0.02 0.00 0.00 54.13 52.66 2jtn s LEU 76 Cb -0.09 -1.88 -0.03 0.00 0.02 0.00 0.00 46.19 44.21 2jtn s LEU 76 CO 0.05 -0.41 0.56 -0.75 0.02 0.00 0.00 176.35 175.81 2jtn s LYS 77 N 1.36 4.21 0.15 1.70 2.20 -0.82 0.79 119.74 129.33 2jtn s LYS 77 Ca 0.01 0.49 -0.22 0.00 -0.36 0.00 0.00 55.97 55.89 2jtn s LYS 77 Cb -0.21 -3.56 0.06 0.00 -1.51 0.00 0.00 37.83 32.62 2jtn s LYS 77 CO 0.01 -0.16 0.57 0.00 -0.36 0.00 0.00 175.35 175.41 2jtn s ALA 78 N 1.65 -1.50 -1.49 3.13 0.00 0.30 0.42 121.76 124.27 2jtn s ALA 78 Ca 0.26 0.42 -0.07 0.00 0.00 0.00 0.00 51.96 52.57 2jtn s ALA 78 Cb -0.16 0.85 0.02 0.00 0.00 0.00 0.00 23.12 23.84 2jtn s ALA 78 CO 0.10 -0.75 0.73 1.28 0.00 0.00 0.00 175.76 177.13 2jtn n LEU 79 N -0.34 -2.69 -2.41 0.00 4.77 -1.26 -1.36 117.00 113.71 2jtn n LEU 79 Ca -0.17 -0.38 -0.19 0.00 -0.03 0.00 0.00 56.01 55.24 2jtn n LEU 79 Cb 0.65 -2.87 0.01 0.00 -2.33 0.00 0.00 43.42 38.88 2jtn n LEU 79 CO 0.13 0.32 -0.11 0.47 -1.33 0.00 0.00 177.39 176.87 2jtn n ASP 80 N -2.62 -5.49 -3.70 -1.43 9.92 -1.26 -4.95 116.55 107.01 2jtn n ASP 80 Ca -0.07 -0.14 -0.02 0.00 -0.53 0.00 0.00 54.79 54.03 2jtn n ASP 80 Cb 0.59 -4.43 -0.01 0.00 -0.64 0.00 0.00 41.12 36.63 2jtn n ASP 80 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 2jtn s ARG 81 N -5.26 0.89 -0.11 -1.24 0.52 -0.46 -5.14 118.95 108.15 2jtn s ARG 81 Ca 0.14 -0.49 -0.23 0.00 -0.52 0.00 0.00 55.73 54.62 2jtn s ARG 81 Cb -0.06 0.30 -0.03 0.00 0.52 0.00 0.00 34.95 35.68 2jtn s ARG 81 CO 0.17 -0.41 0.72 -3.38 0.02 0.00 0.00 175.30 172.43 2jtn s HIS 82 N -2.96 3.51 -0.15 -0.53 -3.43 -1.26 0.11 115.29 110.58 2jtn s HIS 82 Ca 0.13 1.20 0.02 0.00 -0.80 0.00 0.00 55.06 55.61 2jtn s HIS 82 Cb 0.01 -2.86 0.01 0.00 -1.43 0.00 0.00 32.58 28.32 2jtn s HIS 82 CO -0.00 -0.03 -0.21 -1.58 -2.00 0.00 0.00 174.74 170.91 2jtn s TRP 83 N 1.30 2.70 1.18 0.38 0.52 0.24 -4.24 118.94 121.03 2jtn s TRP 83 Ca 0.36 -1.41 -0.17 0.00 0.02 0.00 0.00 56.10 54.90 2jtn s TRP 83 Cb -0.17 -1.85 0.21 0.00 -1.15 0.00 0.00 33.47 30.51 2jtn s TRP 83 CO 0.16 -0.66 0.43 1.58 0.02 0.00 0.00 176.95 178.48 2jtn n HIS 84 N 4.21 -1.95 -0.03 -1.98 -0.00 -1.26 -3.47 115.22 110.75 2jtn n HIS 84 Ca -0.20 -0.12 -0.15 0.00 0.46 0.00 0.00 57.72 57.71 2jtn n HIS 84 Cb 0.51 -1.52 -0.12 0.00 -0.12 0.00 0.00 29.99 28.74 2jtn n HIS 84 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 2jtn h SER 85 N -2.60 0.20 1.00 0.26 0.87 -1.93 -2.73 113.55 108.62 2jtn h SER 85 Ca -0.49 -0.84 -0.15 0.00 -1.23 0.00 0.00 61.79 59.08 2jtn h SER 85 Cb 1.25 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 63.12 2jtn h SER 85 CO 0.35 1.02 -1.07 0.50 -0.53 0.00 0.00 176.83 177.10 2jtn h LYS 86 N -0.60 0.00 0.00 2.24 3.64 -1.97 -3.31 116.57 116.57 2jtn h LYS 86 Ca -0.04 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.22 2jtn h LYS 86 Cb 1.07 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.88 2jtn h LYS 86 CO 0.05 0.41 -0.57 0.00 -2.27 0.00 0.00 179.45 177.07 2jtn s LEU 88 N -7.21 3.62 0.04 0.00 2.96 -1.03 -4.82 118.68 112.24 2jtn s LEU 88 Ca -0.00 -1.48 -0.05 0.00 -0.22 0.00 0.00 54.13 52.37 2jtn s LEU 88 Cb 0.11 -2.56 -0.01 0.00 0.50 0.00 0.00 46.19 44.24 2jtn s LEU 88 CO 0.74 -1.48 0.09 -0.54 -1.32 0.00 0.00 176.35 173.85 2jtn s LYS 89 N 4.80 0.59 0.57 1.98 1.02 -1.26 -1.85 119.74 125.58 2jtn s LYS 89 Ca 0.45 -0.75 -0.21 0.00 0.02 0.00 0.00 55.97 55.47 2jtn s LYS 89 Cb -0.01 0.23 -0.04 0.00 -0.52 0.00 0.00 37.83 37.49 2jtn s LYS 89 CO -0.10 -0.15 1.35 0.00 -0.92 0.00 0.00 175.35 175.54 2jtn h SER 91 N 1.24 0.00 0.00 0.00 0.02 -1.91 -2.12 113.55 110.78 2jtn h SER 91 Ca -0.51 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.44 2jtn h SER 91 Cb 1.31 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.85 2jtn h SER 91 CO 0.56 0.59 -0.65 -0.67 -1.14 0.00 0.00 176.83 175.53 2jtn n ASP 92 N -3.66 1.31 0.25 3.07 -0.08 -1.26 -4.57 116.55 111.61 2jtn n ASP 92 Ca -0.01 0.22 0.09 0.00 -1.51 0.00 0.00 54.79 53.58 2jtn n ASP 92 Cb 0.63 -0.64 0.65 0.00 2.34 0.00 0.00 41.12 44.11 2jtn n ASP 92 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2jtn n HIS 94 N -4.51 -0.39 -2.63 0.00 -0.00 -0.80 -4.94 115.22 101.97 2jtn n HIS 94 Ca -0.03 0.00 -0.30 0.00 0.46 0.00 0.00 57.72 57.85 2jtn n HIS 94 Cb 0.11 -3.33 -0.02 0.00 -0.12 0.00 0.00 29.99 26.63 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 -2.67 4.77 -0.14 3.57 -7.23 -1.26 -4.74 120.40 112.70 2jtn s VAL 95 Ca 0.00 0.64 -0.29 0.00 -1.81 0.00 0.00 61.98 60.52 2jtn s VAL 95 Cb 0.00 -3.78 -0.03 0.00 0.56 0.00 0.00 36.38 33.14 2jtn s VAL 95 CO 0.00 -0.69 1.45 -2.16 -0.31 0.00 0.00 175.10 173.39 2jtn s PRO 96 N -4.23 4.13 -0.93 4.82 0.04 -1.26 -2.97 135.00 134.61 2jtn s PRO 96 Ca 0.52 1.81 0.00 0.00 0.04 0.00 0.00 61.00 63.37 2jtn s PRO 96 Cb -0.10 -3.89 0.32 0.00 0.04 0.00 0.00 34.50 30.87 2jtn s PRO 96 CO 0.37 -0.86 1.56 1.28 0.04 0.00 0.00 177.00 179.39 2jtn n LEU 97 N 7.11 6.52 -2.21 -3.56 4.32 -0.77 -4.80 117.00 123.60 2jtn n LEU 97 Ca 0.16 -5.43 -0.29 0.00 -0.02 0.00 0.00 56.01 50.43 2jtn n LEU 97 Cb 0.44 -1.04 0.06 0.00 -1.62 0.00 0.00 43.42 41.27 2jtn n LEU 97 CO 0.60 2.07 1.38 0.00 -1.22 0.00 0.00 177.39 180.22 2jtn n ALA 98 N 0.12 5.95 0.00 -1.18 0.00 -1.26 -4.26 120.51 119.88 2jtn n ALA 98 Ca 0.40 -2.88 0.00 0.00 0.00 0.00 0.00 53.44 50.96 2jtn n ALA 98 Cb 0.30 -1.66 0.00 0.00 0.00 0.00 0.00 19.45 18.09 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 -0.45 0.00 -3.78 0.00 -0.58 -1.26 -5.14 120.64 109.44 2jtn n GLU 99 Ca 0.51 0.00 -0.13 0.00 -0.42 0.00 0.00 57.16 57.13 2jtn n GLU 99 Cb 0.62 -0.07 -0.10 0.00 -0.57 0.00 0.00 31.44 31.32 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 -1.69 0.44 0.22 3.49 0.52 -1.26 -4.57 118.95 116.11 2jtn s ARG 100 Ca 0.00 0.17 0.11 0.00 -0.52 0.00 0.00 55.73 55.49 2jtn s ARG 100 Cb 0.00 0.21 -0.05 0.00 0.52 0.00 0.00 34.95 35.63 2jtn s ARG 100 CO 0.00 -0.09 -0.21 0.00 0.02 0.00 0.00 175.30 175.03 2jtn s PHE 102 N -1.93 -0.99 0.31 0.00 2.19 -1.26 -4.35 117.98 111.95 2jtn s PHE 102 Ca 0.24 1.80 0.03 0.00 0.33 0.00 0.00 56.93 59.33 2jtn s PHE 102 Cb -0.07 0.48 -0.03 0.00 -1.31 0.00 0.00 43.02 42.09 2jtn s PHE 102 CO 0.12 -0.55 0.48 0.45 1.83 0.00 0.00 175.22 177.56 2jtn s SER 103 N 2.71 6.26 -0.29 6.13 0.15 -1.26 -1.16 113.70 126.24 2jtn s SER 103 Ca -0.03 0.26 -0.14 0.00 0.70 0.00 0.00 55.95 56.74 2jtn s SER 103 Cb -0.12 -1.90 0.13 0.00 -1.71 0.00 0.00 66.02 62.43 2jtn s SER 103 CO -0.15 -0.24 0.82 -0.60 1.20 0.00 0.00 173.24 174.27 2jtn s ARG 104 N -4.20 0.48 7.44 5.44 3.00 0.21 -4.61 118.95 126.72 2jtn s ARG 104 Ca 0.38 1.05 0.00 0.00 -1.00 0.00 0.00 55.73 56.16 2jtn s ARG 104 Cb -0.09 0.45 0.00 0.00 0.00 0.00 0.00 34.95 35.30 2jtn s ARG 104 CO 0.33 -0.14 0.00 0.41 0.00 0.00 0.00 175.30 175.90 2jtn n GLY 105 N 4.74 3.48 2.18 8.12 0.00 -1.26 -1.84 105.19 120.62 2jtn n GLY 105 Ca -0.14 -0.15 -0.24 0.00 0.00 0.00 0.00 46.02 45.49 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 14.00 2.25 -3.82 1.61 2.13 -1.26 -4.94 120.64 130.61 2jtn n GLU 106 Ca 0.00 -2.88 -0.06 0.00 0.66 0.00 0.00 57.16 54.88 2jtn n GLU 106 Cb 0.00 -2.13 -0.00 0.00 0.27 0.00 0.00 31.44 29.58 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 -1.24 -0.13 -0.32 4.31 0.01 -0.76 -5.14 113.70 110.43 2jtn s SER 107 Ca 0.55 -0.73 -0.11 0.00 1.31 0.00 0.00 55.95 56.97 2jtn s SER 107 Cb 0.46 0.68 -0.01 0.00 0.21 0.00 0.00 66.02 67.35 2jtn s SER 107 CO 0.09 -1.30 0.19 0.54 0.41 0.00 0.00 173.24 173.17 2jtn s VAL 108 N -3.07 4.95 -0.16 3.43 0.11 -1.26 -0.62 120.40 123.77 2jtn s VAL 108 Ca 0.14 -0.29 0.01 0.00 -2.93 0.00 0.00 61.98 58.91 2jtn s VAL 108 Cb -0.04 -3.52 0.02 0.00 -1.53 0.00 0.00 36.38 31.31 2jtn s VAL 108 CO 0.07 0.05 -0.19 -0.31 -3.33 0.00 0.00 175.10 171.39 2jtn s TYR 109 N 1.67 2.58 1.28 1.54 1.51 -0.31 -2.72 117.35 122.91 2jtn s TYR 109 Ca 0.05 -1.47 -0.16 0.00 -1.01 0.00 0.00 57.07 54.48 2jtn s TYR 109 Cb -0.17 -1.80 0.33 0.00 -0.11 0.00 0.00 41.96 40.20 2jtn s TYR 109 CO 0.08 -0.73 0.98 0.00 -1.11 0.00 0.00 175.55 174.77 2jtn h LYS 111 N -3.02 0.14 0.07 0.00 3.64 -1.93 -2.97 116.57 112.49 2jtn h LYS 111 Ca -0.57 -0.19 0.02 0.00 -1.27 0.00 0.00 60.65 58.64 2jtn h LYS 111 Cb 1.34 0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 33.17 2jtn h LYS 111 CO 0.43 1.01 -0.45 0.22 -2.27 0.00 0.00 179.45 178.40 2jtn h ASP 112 N 0.06 -1.34 1.37 4.20 3.58 -2.02 -1.57 116.42 120.70 2jtn h ASP 112 Ca -0.05 0.15 -0.01 0.00 0.42 0.00 0.00 57.03 57.54 2jtn h ASP 112 Cb 1.68 0.51 -0.00 0.00 1.72 0.00 0.00 39.33 43.24 2jtn h ASP 112 CO 0.15 -0.49 -0.05 -2.24 -2.88 0.00 0.00 179.24 173.73 2jtn h ASP 113 N -0.64 0.00 0.15 2.28 3.04 -1.95 -3.04 116.42 116.25 2jtn h ASP 113 Ca 0.03 0.00 -0.01 0.00 -3.24 0.00 0.00 57.03 53.80 2jtn h ASP 113 Cb 0.69 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 38.98 2jtn h ASP 113 CO -0.29 0.05 -0.07 0.15 -2.04 0.00 0.00 179.24 177.04 2jtn h PHE 114 N 0.00 0.00 0.19 4.15 3.04 -1.12 0.91 116.94 124.11 2jtn h PHE 114 Ca -0.00 0.00 -0.32 0.00 3.98 0.00 0.00 57.97 61.63 2jtn h PHE 114 Cb 0.74 0.00 0.03 0.00 2.56 0.00 0.00 35.95 39.29 2jtn h PHE 114 CO 0.00 0.07 -1.36 0.74 -2.02 0.00 0.00 178.31 175.74 2jtn h PHE 115 N 0.00 0.97 0.00 0.41 0.04 -1.35 -1.60 116.94 115.41 2jtn h PHE 115 Ca -0.00 -0.66 -0.11 0.00 2.80 0.00 0.00 57.97 60.00 2jtn h PHE 115 Cb 0.16 -0.06 -0.02 0.00 2.20 0.00 0.00 35.95 38.24 2jtn h PHE 115 CO 0.00 1.51 -0.61 -0.22 -0.60 0.00 0.00 178.31 178.39 2jtn h LYS 116 N 0.20 0.00 0.05 1.51 1.63 -1.54 -2.68 116.57 115.73 2jtn h LYS 116 Ca -0.22 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.58 2jtn h LYS 116 Cb 2.04 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.67 2jtn h LYS 116 CO 0.26 0.90 -0.02 0.00 -3.45 0.00 0.00 179.45 177.13 2jtn h ARG 117 N -1.00 -0.06 -0.93 1.90 2.47 0.65 -3.31 114.38 114.10 2jtn h ARG 117 Ca -0.16 0.00 -0.60 0.00 -1.26 0.00 0.00 59.98 57.97 2jtn h ARG 117 Cb 1.06 0.01 -0.30 0.00 -1.65 0.00 0.00 29.97 29.10 2jtn h ARG 117 CO -0.10 0.54 0.60 1.19 0.56 0.00 0.00 179.97 182.76 2jtn n PHE 118 N -4.81 3.02 -3.59 3.04 3.01 -0.65 -4.96 117.46 112.52 2jtn n PHE 118 Ca -0.09 -2.59 -0.10 0.00 1.01 0.00 0.00 57.45 55.68 2jtn n PHE 118 Cb 0.31 -1.17 -0.03 0.00 -0.01 0.00 0.00 39.48 38.58 2jtn n PHE 118 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2jtn s GLY 119 N -1.93 -0.38 0.70 1.37 0.00 -0.93 -4.63 107.32 101.52 2jtn s GLY 119 Ca 0.60 0.14 -0.16 0.00 0.00 0.00 0.00 44.72 45.31 2jtn s GLY 119 CO 0.02 -0.01 1.17 2.41 0.00 0.00 0.00 173.10 176.69 2jtn n THR 120 N -0.38 3.68 -3.59 0.90 -1.04 -1.24 -4.48 114.28 108.12 2jtn n THR 120 Ca -0.13 -0.40 -0.10 0.00 -2.04 0.00 0.00 64.05 61.38 2jtn n THR 120 Cb 0.63 -1.31 -0.06 0.00 -1.82 0.00 0.00 70.33 67.78 2jtn n THR 120 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 2jtn s LYS 121 N -3.50 0.56 0.17 -2.82 2.36 -1.26 -4.43 119.74 110.81 2jtn s LYS 121 Ca 0.78 0.23 -0.31 0.00 -2.55 0.00 0.00 55.97 54.12 2jtn s LYS 121 Cb -0.35 0.26 -0.10 0.00 -1.05 0.00 0.00 37.83 36.60 2jtn s LYS 121 CO 0.45 -0.15 1.51 0.00 1.55 0.00 0.00 175.35 178.71 2jtn n ALA 123 N 3.69 4.06 0.00 0.00 0.00 -1.26 -2.50 120.51 124.51 2jtn n ALA 123 Ca 0.12 -1.77 0.00 0.00 0.00 0.00 0.00 53.44 51.79 2jtn n ALA 123 Cb 0.40 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.66 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 0.05 2.16 0.46 0.00 0.00 -1.26 -4.82 120.51 117.10 2jtn n ALA 124 Ca 0.31 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.81 2jtn n ALA 124 Cb 1.15 0.37 -0.09 0.00 0.00 0.00 0.00 19.45 20.88 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 -1.52 -1.49 -4.32 0.00 3.00 -1.04 -4.99 117.38 107.02 2jtn n GLN 126 Ca 0.01 0.81 -0.35 0.00 -0.01 0.00 0.00 57.00 57.47 2jtn n GLN 126 Cb 0.26 -5.26 -0.10 0.00 0.00 0.00 0.00 30.24 25.15 2jtn n GLN 126 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.06 175.89 2jtn s LEU 127 N -4.89 3.59 -0.52 1.08 2.96 -1.26 -4.95 118.68 114.69 2jtn s LEU 127 Ca 0.01 0.11 -0.27 0.00 -0.22 0.00 0.00 54.13 53.77 2jtn s LEU 127 Cb -0.01 -1.84 -0.03 0.00 0.50 0.00 0.00 46.19 44.82 2jtn s LEU 127 CO 0.02 0.33 1.95 -0.83 -1.32 0.00 0.00 176.35 176.49 2jtn s GLY 128 N -0.60 0.22 0.39 7.98 0.00 -1.26 -2.94 107.32 111.11 2jtn s GLY 128 Ca 0.10 -0.32 -0.28 0.00 0.00 0.00 0.00 44.72 44.22 2jtn s GLY 128 CO 0.02 3.52 1.49 -0.42 0.00 0.00 0.00 173.10 177.70 2jtn s ILE 129 N 9.14 2.03 1.01 0.90 1.01 -1.26 -4.96 121.20 129.06 2jtn s ILE 129 Ca 0.76 0.03 -0.18 0.00 0.00 0.00 0.00 60.65 61.25 2jtn s ILE 129 Cb -0.16 -3.02 0.04 0.00 0.01 0.00 0.00 42.46 39.33 2jtn s ILE 129 CO 0.25 0.01 -0.31 -2.65 0.00 0.00 0.00 174.94 172.23 2jtn n PRO 130 N 0.35 -1.27 -0.01 2.79 -0.02 -1.26 -4.93 135.00 130.64 2jtn n PRO 130 Ca 0.02 -0.37 -0.08 0.00 -2.02 0.00 0.00 63.50 61.04 2jtn n PRO 130 Cb 0.39 -1.40 -0.07 0.00 -0.02 0.00 0.00 33.50 32.41 2jtn n PRO 130 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2jtn h PRO 131 N -1.97 -0.09 0.00 0.52 0.13 -1.97 -3.40 132.00 125.22 2jtn h PRO 131 Ca -0.37 0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2jtn h PRO 131 Cb 1.09 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 2jtn h PRO 131 CO 0.24 0.38 -0.13 2.41 -0.23 0.00 0.00 178.00 180.67 2jtn n THR 132 N -4.78 1.76 -1.76 1.56 -1.04 -1.26 0.84 114.28 109.59 2jtn n THR 132 Ca -0.06 -2.21 -0.41 0.00 -2.04 0.00 0.00 64.05 59.32 2jtn n THR 132 Cb 0.25 -0.16 -0.00 0.00 -1.82 0.00 0.00 70.33 68.59 2jtn n THR 132 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jtn n GLN 133 N -1.25 2.58 -2.60 -2.82 10.64 -1.26 -4.70 117.38 117.96 2jtn n GLN 133 Ca 0.15 0.90 -0.43 0.00 -1.83 0.00 0.00 57.00 55.80 2jtn n GLN 133 Cb 0.66 -2.61 -0.02 0.00 -0.86 0.00 0.00 30.24 27.41 2jtn n GLN 133 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 2jtn s VAL 134 N -1.11 4.15 0.11 -0.39 1.01 -1.26 -3.74 120.40 119.16 2jtn s VAL 134 Ca 0.54 1.11 -0.18 0.00 0.00 0.00 0.00 61.98 63.44 2jtn s VAL 134 Cb -0.49 -4.64 0.04 0.00 0.00 0.00 0.00 36.38 31.28 2jtn s VAL 134 CO 0.64 -1.12 0.44 0.54 0.00 0.00 0.00 175.10 175.59 2jtn s VAL 135 N 4.61 0.06 -0.09 2.92 0.11 -1.26 -4.76 120.40 121.99 2jtn s VAL 135 Ca 0.46 -0.46 -0.11 0.00 -2.93 0.00 0.00 61.98 58.94 2jtn s VAL 135 Cb -0.07 -1.10 -0.05 0.00 -1.53 0.00 0.00 36.38 33.63 2jtn s VAL 135 CO 0.30 -0.25 0.26 0.00 -3.33 0.00 0.00 175.10 172.08 2jtn s ARG 136 N -3.52 3.78 -0.15 1.54 1.70 -1.26 0.10 118.95 121.14 2jtn s ARG 136 Ca 0.01 0.10 -0.04 0.00 -0.47 0.00 0.00 55.73 55.33 2jtn s ARG 136 Cb 0.01 -3.25 -0.03 0.00 -0.57 0.00 0.00 34.95 31.11 2jtn s ARG 136 CO -0.10 0.64 -0.02 1.03 -1.08 0.00 0.00 175.30 175.77 2jtn s ARG 137 N -0.75 3.65 -0.60 3.89 3.00 -1.26 -4.25 118.95 122.64 2jtn s ARG 137 Ca 0.18 -0.48 -0.26 0.00 0.00 0.00 0.00 55.73 55.18 2jtn s ARG 137 Cb -0.14 -2.95 -0.10 0.00 0.00 0.00 0.00 34.95 31.76 2jtn s ARG 137 CO 0.07 0.30 2.42 0.00 0.00 0.00 0.00 175.30 178.09 2jtn n ALA 138 N 3.37 0.62 -0.70 2.13 0.00 0.23 -4.55 120.51 121.62 2jtn n ALA 138 Ca -0.17 -1.10 0.00 0.00 0.00 0.00 0.00 53.44 52.17 2jtn n ALA 138 Cb 0.53 -3.23 0.00 0.00 0.00 0.00 0.00 19.45 16.74 2jtn n ALA 138 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2jtn n GLN 139 N 8.93 0.00 -0.14 0.00 6.02 -1.26 -1.15 117.38 129.78 2jtn n GLN 139 Ca 0.41 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 57.12 2jtn n GLN 139 Cb 0.50 0.00 -0.10 0.00 1.02 0.00 0.00 30.24 31.66 2jtn n GLN 139 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 2jtn n ASP 140 N 1.80 1.96 -4.89 1.08 9.92 -1.26 -5.01 116.55 120.15 2jtn n ASP 140 Ca 0.00 0.27 -0.29 0.00 -0.53 0.00 0.00 54.79 54.24 2jtn n ASP 140 Cb 0.00 -0.77 0.06 0.00 -0.64 0.00 0.00 41.12 39.77 2jtn n ASP 140 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 2jtn s PHE 141 N -2.50 3.18 0.17 1.24 0.08 -0.30 -5.03 117.98 114.81 2jtn s PHE 141 Ca -0.38 0.90 0.07 0.00 0.12 0.00 0.00 56.93 57.64 2jtn s PHE 141 Cb 0.14 -3.20 -0.04 0.00 -0.57 0.00 0.00 43.02 39.34 2jtn s PHE 141 CO 0.51 -1.37 -0.15 0.54 -0.10 0.00 0.00 175.22 174.65 2jtn s VAL 142 N -3.41 1.62 0.15 -0.44 0.11 -1.26 0.75 120.40 117.92 2jtn s VAL 142 Ca 0.59 -1.99 -0.16 0.00 -2.93 0.00 0.00 61.98 57.49 2jtn s VAL 142 Cb -0.11 -1.84 0.03 0.00 -1.53 0.00 0.00 36.38 32.93 2jtn s VAL 142 CO 0.50 -0.48 0.42 -0.31 -3.33 0.00 0.00 175.10 171.90 2jtn s TYR 143 N -2.51 -0.12 0.52 1.54 1.51 -1.26 -4.08 117.35 112.94 2jtn s TYR 143 Ca 0.17 -0.21 -0.23 0.00 -1.01 0.00 0.00 57.07 55.79 2jtn s TYR 143 Cb -0.03 0.26 -0.06 0.00 -0.11 0.00 0.00 41.96 42.03 2jtn s TYR 143 CO 0.05 -0.76 1.38 -1.01 -1.11 0.00 0.00 175.55 174.10 2jtn s HIS 144 N -3.84 2.33 0.03 2.71 3.76 -1.26 -4.76 115.29 114.26 2jtn s HIS 144 Ca 0.06 1.34 0.32 0.00 -0.15 0.00 0.00 55.06 56.63 2jtn s HIS 144 Cb 0.01 -3.84 1.47 0.00 1.11 0.00 0.00 32.58 31.33 2jtn s HIS 144 CO -0.08 -2.92 1.95 -0.07 -0.85 0.00 0.00 174.74 172.77 2jtn h LEU 145 N 1.69 0.00 0.02 0.89 4.07 -1.92 0.84 115.31 120.91 2jtn h LEU 145 Ca -0.51 0.00 -0.08 0.00 0.08 0.00 0.00 57.88 57.38 2jtn h LEU 145 Cb 1.29 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 43.03 2jtn h LEU 145 CO 0.58 0.00 -0.38 0.45 -1.08 0.00 0.00 178.44 178.01 2jtn h HIS 146 N 0.00 0.09 0.00 1.13 3.86 -2.02 -3.37 115.15 114.84 2jtn h HIS 146 Ca 0.00 -0.06 -0.22 0.00 -1.16 0.00 0.00 60.37 58.93 2jtn h HIS 146 Cb 0.30 -0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.74 2jtn h HIS 146 CO 0.00 1.15 -1.06 0.00 0.86 0.00 0.00 177.93 178.88 2jtn s PHE 148 N -2.71 1.26 0.30 0.00 2.19 0.29 -4.85 117.98 114.46 2jtn s PHE 148 Ca 0.00 1.36 -0.19 0.00 0.33 0.00 0.00 56.93 58.43 2jtn s PHE 148 Cb 0.10 -3.72 0.05 0.00 -1.31 0.00 0.00 43.02 38.13 2jtn s PHE 148 CO 0.82 -2.38 0.83 0.00 1.83 0.00 0.00 175.22 176.31 2jtn s ALA 149 N 11.49 -1.11 0.45 11.12 0.00 -1.26 -3.94 121.76 138.51 2jtn s ALA 149 Ca 0.88 -0.46 -0.21 0.00 0.00 0.00 0.00 51.96 52.17 2jtn s ALA 149 Cb -0.15 0.73 -0.10 0.00 0.00 0.00 0.00 23.12 23.60 2jtn s ALA 149 CO 0.23 -1.02 0.97 0.00 0.00 0.00 0.00 175.76 175.94 2jtn h VAL 151 N 1.77 1.28 0.00 0.00 -1.51 -1.54 -0.20 116.25 116.05 2jtn h VAL 151 Ca -0.49 -1.84 -0.02 0.00 -1.23 0.00 0.00 66.70 63.12 2jtn h VAL 151 Cb 1.19 1.79 -0.00 0.00 -2.13 0.00 0.00 31.29 32.13 2jtn h VAL 151 CO 0.60 0.59 -0.25 0.58 -1.23 0.00 0.00 177.57 177.87 2jtn h VAL 152 N 0.61 0.41 0.00 7.19 2.07 -1.94 -3.36 116.25 121.23 2jtn h VAL 152 Ca -0.02 -1.36 -0.05 0.00 0.82 0.00 0.00 66.70 66.10 2jtn h VAL 152 Cb 1.27 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.86 2jtn h VAL 152 CO 0.14 0.14 -0.24 0.00 0.02 0.00 0.00 177.57 177.63 2jtn n LYS 154 N -3.98 -4.31 -4.22 0.00 4.76 -0.09 -4.94 118.16 105.39 2jtn n LYS 154 Ca -0.02 0.89 -0.20 0.00 -2.87 0.00 0.00 58.31 56.12 2jtn n LYS 154 Cb 0.31 -5.71 -0.12 0.00 -1.84 0.00 0.00 35.03 27.67 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 -5.62 0.95 0.49 1.97 0.52 -1.25 -4.82 118.95 111.18 2jtn s ARG 155 Ca 0.26 -1.09 -0.20 0.00 -0.52 0.00 0.00 55.73 54.18 2jtn s ARG 155 Cb -0.12 -0.98 -0.08 0.00 0.52 0.00 0.00 34.95 34.29 2jtn s ARG 155 CO 0.33 0.21 1.03 -0.65 0.02 0.00 0.00 175.30 176.23 2jtn s GLN 156 N -2.06 3.83 0.45 3.54 -0.21 -1.26 -1.04 119.66 122.90 2jtn s GLN 156 Ca 0.03 1.31 0.08 0.00 0.02 0.00 0.00 55.36 56.80 2jtn s GLN 156 Cb -0.08 -2.10 0.02 0.00 1.00 0.00 0.00 33.01 31.84 2jtn s GLN 156 CO 0.03 -0.40 0.58 -0.51 -2.12 0.00 0.00 175.29 172.87 2jtn s LEU 157 N -3.52 3.53 0.18 2.90 2.01 -1.25 -4.94 118.68 117.59 2jtn s LEU 157 Ca 0.66 -0.54 -0.07 0.00 0.01 0.00 0.00 54.13 54.19 2jtn s LEU 157 Cb -0.15 -2.41 -0.02 0.00 0.01 0.00 0.00 46.19 43.62 2jtn s LEU 157 CO 0.20 -0.85 0.27 0.00 1.01 0.00 0.00 176.35 176.98 2jtn s ALA 158 N -2.42 0.29 -0.00 4.21 0.00 -1.26 -5.06 121.76 117.51 2jtn s ALA 158 Ca 0.55 -1.12 -0.39 0.00 0.00 0.00 0.00 51.96 51.00 2jtn s ALA 158 Cb -0.08 1.01 -0.19 0.00 0.00 0.00 0.00 23.12 23.86 2jtn s ALA 158 CO 0.33 -0.66 1.22 2.41 0.00 0.00 0.00 175.76 179.06 2jtn n THR 159 N -0.25 0.01 0.00 0.00 -1.04 -1.24 -0.19 114.28 111.57 2jtn n THR 159 Ca -0.04 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 2jtn n THR 159 Cb 0.63 -0.37 0.00 0.00 -1.82 0.00 0.00 70.33 68.78 2jtn n THR 159 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2jtn n GLY 160 N 2.10 3.21 3.71 3.41 0.00 0.29 -4.90 105.19 113.00 2jtn n GLY 160 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 2jtn n GLY 160 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jtn s ASP 161 N -0.50 6.76 -0.19 1.61 -1.08 0.73 -4.69 116.67 119.31 2jtn s ASP 161 Ca 0.00 2.37 -0.22 0.00 -0.52 0.00 0.00 52.55 54.19 2jtn s ASP 161 Cb 0.00 -2.58 -0.02 0.00 -1.46 0.00 0.00 42.92 38.85 2jtn s ASP 161 CO 0.00 -0.71 0.68 -1.61 0.52 0.00 0.00 175.17 174.04 2jtn s GLU 162 N 1.39 4.24 0.09 4.34 2.02 -1.26 0.12 118.70 129.64 2jtn s GLU 162 Ca 0.66 0.71 -0.03 0.00 0.02 0.00 0.00 54.97 56.34 2jtn s GLU 162 Cb -0.38 -3.57 -0.03 0.00 0.10 0.00 0.00 34.13 30.24 2jtn s GLU 162 CO 0.30 -0.25 0.05 -0.59 0.02 0.00 0.00 175.26 174.79 2jtn s PHE 163 N 1.94 0.59 0.43 1.61 -0.71 -0.99 -4.21 117.98 116.65 2jtn s PHE 163 Ca 0.31 -1.05 0.07 0.00 -1.04 0.00 0.00 56.93 55.22 2jtn s PHE 163 Cb -0.16 -0.36 -0.03 0.00 -1.21 0.00 0.00 43.02 41.26 2jtn s PHE 163 CO 0.11 -0.48 0.28 0.71 -1.34 0.00 0.00 175.22 174.50 2jtn s TYR 164 N -3.96 2.53 -0.20 3.49 2.02 0.31 -2.84 117.35 118.70 2jtn s TYR 164 Ca 0.14 -0.58 -0.02 0.00 -0.37 0.00 0.00 57.07 56.24 2jtn s TYR 164 Cb 0.07 -2.03 0.06 0.00 -0.40 0.00 0.00 41.96 39.66 2jtn s TYR 164 CO -0.05 0.00 0.00 -1.17 -1.57 0.00 0.00 175.55 172.76 2jtn s LEU 165 N -4.03 1.55 0.00 -1.29 2.96 -1.26 -2.84 118.68 113.78 2jtn s LEU 165 Ca 0.42 -0.87 0.00 0.00 -0.22 0.00 0.00 54.13 53.47 2jtn s LEU 165 Cb 0.01 -0.77 0.00 0.00 0.50 0.00 0.00 46.19 45.93 2jtn s LEU 165 CO 0.24 -0.27 0.01 0.23 -1.32 0.00 0.00 176.35 175.24 2jtn n MET 166 N 4.94 0.00 -0.07 1.98 2.81 -1.06 -4.52 117.12 121.21 2jtn n MET 166 Ca -0.10 0.00 -0.17 0.00 -1.81 0.00 0.00 57.70 55.62 2jtn n MET 166 Cb 0.46 -0.18 -0.13 0.00 -0.71 0.00 0.00 33.22 32.67 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 -1.98 -3.47 114.58 113.58 2jtn h GLU 167 Ca 0.00 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.64 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 -0.25 -1.16 0.00 0.00 179.01 178.63 2jtn n ASP 168 N -4.48 -1.29 0.03 1.42 8.00 -1.26 -4.95 116.55 114.02 2jtn n ASP 168 Ca -0.18 0.60 0.05 0.00 0.71 0.00 0.00 54.79 55.98 2jtn n ASP 168 Cb 0.59 1.52 -0.08 0.00 -0.02 0.00 0.00 41.12 43.13 2jtn n ASP 168 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2jtn n SER 169 N -3.09 0.58 -4.54 -2.24 2.88 -1.26 -4.86 113.62 101.09 2jtn n SER 169 Ca 0.00 0.24 -0.39 0.00 -1.33 0.00 0.00 58.87 57.39 2jtn n SER 169 Cb 0.00 0.75 -0.05 0.00 -0.75 0.00 0.00 64.21 64.16 2jtn n SER 169 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2jtn n ARG 170 N -2.66 1.03 -3.25 -1.46 5.12 -1.26 -4.92 116.66 109.26 2jtn n ARG 170 Ca -0.07 0.10 -0.39 0.00 -1.93 0.00 0.00 57.85 55.55 2jtn n ARG 170 Cb 0.71 -3.07 -0.06 0.00 -1.16 0.00 0.00 32.46 28.88 2jtn n ARG 170 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2jtn s LEU 171 N 10.81 4.18 -0.10 0.55 1.02 -1.26 -2.56 118.68 131.33 2jtn s LEU 171 Ca 1.05 0.73 -0.04 0.00 0.02 0.00 0.00 54.13 55.89 2jtn s LEU 171 Cb -0.41 -2.72 0.05 0.00 0.02 0.00 0.00 46.19 43.13 2jtn s LEU 171 CO 0.33 -0.14 0.20 0.54 0.02 0.00 0.00 176.35 177.30 2jtn s VAL 172 N 1.37 -0.24 0.32 -1.59 0.11 -1.13 -1.25 120.40 118.00 2jtn s VAL 172 Ca 0.25 0.27 -0.05 0.00 -2.93 0.00 0.00 61.98 59.51 2jtn s VAL 172 Cb -0.15 -0.35 0.08 0.00 -1.53 0.00 0.00 36.38 34.43 2jtn s VAL 172 CO 0.10 0.11 0.25 0.00 -3.33 0.00 0.00 175.10 172.24 2jtn h LYS 174 N 0.00 0.23 0.15 0.00 1.57 -1.94 -2.91 116.57 113.67 2jtn h LYS 174 Ca -0.10 -0.39 -0.01 0.00 -1.87 0.00 0.00 60.65 58.28 2jtn h LYS 174 Cb 0.32 0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.77 2jtn h LYS 174 CO 0.06 1.07 -0.07 0.00 -0.57 0.00 0.00 179.45 179.94 2jtn h ALA 175 N 0.46 -0.20 -0.08 3.86 0.00 -1.93 -2.51 119.26 118.86 2jtn h ALA 175 Ca -0.28 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2jtn h ALA 175 Cb 2.02 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.89 2jtn h ALA 175 CO 0.14 -0.57 0.00 -0.40 0.00 0.00 0.00 179.25 178.42 2jtn n ASP 176 N -5.14 0.86 0.19 0.00 5.75 -1.26 -4.24 116.55 112.72 2jtn n ASP 176 Ca -0.09 -1.56 -0.08 0.00 -0.01 0.00 0.00 54.79 53.06 2jtn n ASP 176 Cb 0.14 -0.05 -0.04 0.00 -1.03 0.00 0.00 41.12 40.14 2jtn n ASP 176 CO 0.00 0.00 0.00 0.22 -0.11 0.00 0.00 177.20 177.31 2jtn h TYR 177 N 1.16 -0.46 -1.12 2.11 3.20 -1.23 -2.10 116.97 118.53 2jtn h TYR 177 Ca 0.00 -0.01 0.32 0.00 3.14 0.00 0.00 58.73 62.18 2jtn h TYR 177 Cb 0.25 0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.63 2jtn h TYR 177 CO 0.05 -0.29 0.90 0.93 -1.64 0.00 0.00 178.16 178.11 2jtn h GLU 178 N -0.54 0.00 0.00 1.82 4.39 -1.74 1.20 114.58 119.71 2jtn h GLU 178 Ca -0.05 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.47 2jtn h GLU 178 Cb 0.38 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.01 2jtn h GLU 178 CO 0.08 0.00 -0.83 1.79 -1.16 0.00 0.00 179.01 178.89 2jtn h THR 179 N 0.00 1.57 0.00 1.13 1.35 -1.75 -3.26 112.91 111.95 2jtn h THR 179 Ca 0.53 -2.76 -0.03 0.00 -0.55 0.00 0.00 66.41 63.61 2jtn h THR 179 Cb 2.32 2.50 -0.01 0.00 -1.73 0.00 0.00 68.15 71.23 2jtn h THR 179 CO -0.01 0.79 -1.74 0.00 -0.25 0.00 0.00 175.52 174.31 2jtn n ALA 180 N -2.40 2.63 -1.25 6.62 0.00 0.33 -5.09 120.51 121.35 2jtn n ALA 180 Ca -0.01 -0.49 0.16 0.00 0.00 0.00 0.00 53.44 53.09 2jtn n ALA 180 Cb 0.79 -0.82 -0.04 0.00 0.00 0.00 0.00 19.45 19.38 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 -2.42 -2.32 0.00 0.00 4.01 0.31 -5.08 118.16 112.66 2jtn n LYS 181 Ca -0.05 1.53 0.00 0.00 -0.51 0.00 0.00 58.31 59.28 2jtn n LYS 181 Cb 0.61 -2.83 0.00 0.00 -0.51 0.00 0.00 35.03 32.30 2jtn n LYS 181 CO 0.00 0.00 0.00 0.94 -1.11 0.00 0.00 177.40 177.23