#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 5.74 0.00 6.43 0.01 -1.26 -4.79 113.70 119.83 2jtn s SER 2 Ca 0.00 -0.59 0.00 0.00 1.31 0.00 0.00 55.95 56.67 2jtn s SER 2 Cb 0.00 -2.05 0.00 0.00 0.21 0.00 0.00 66.02 64.18 2jtn s SER 2 CO 0.00 -0.25 0.00 1.67 0.41 0.00 0.00 173.24 175.07 2jtn n GLN 3 N 5.03 0.00 -3.58 12.44 -0.06 -1.26 -4.62 117.38 125.33 2jtn n GLN 3 Ca -0.13 0.00 -0.17 0.00 -2.00 0.00 0.00 57.00 54.70 2jtn n GLN 3 Cb 0.49 0.00 -0.07 0.00 -4.06 0.00 0.00 30.24 26.60 2jtn n GLN 3 CO 0.00 0.00 0.00 0.14 -0.20 0.00 0.00 177.06 177.00 2jtn s VAL 4 N 0.00 0.01 0.04 1.69 -7.23 -1.26 -5.07 120.40 108.58 2jtn s VAL 4 Ca 0.00 -0.10 -0.20 0.00 -1.81 0.00 0.00 61.98 59.88 2jtn s VAL 4 Cb 0.00 -0.91 -0.14 0.00 0.56 0.00 0.00 36.38 35.88 2jtn s VAL 4 CO 0.00 -0.05 1.32 1.55 -0.31 0.00 0.00 175.10 177.61 2jtn h PRO 5 N 3.32 0.41 -0.62 4.82 0.13 -1.96 -3.44 132.00 134.66 2jtn h PRO 5 Ca -0.28 -0.24 -0.05 0.00 -0.87 0.00 0.00 66.00 64.57 2jtn h PRO 5 Cb 1.15 0.02 -0.16 0.00 0.13 0.00 0.00 31.00 32.14 2jtn h PRO 5 CO 0.37 0.82 -0.31 -0.51 -0.23 0.00 0.00 178.00 178.14 2jtn s ASP 6 N -6.25 -0.91 0.29 1.44 1.01 -1.26 -5.10 116.67 105.89 2jtn s ASP 6 Ca -0.14 -0.94 0.01 0.00 0.71 0.00 0.00 52.55 52.19 2jtn s ASP 6 Cb 0.05 1.19 -0.04 0.00 1.01 0.00 0.00 42.92 45.14 2jtn s ASP 6 CO 0.77 -0.05 0.48 0.54 0.21 0.00 0.00 175.17 177.12 2jtn s VAL 7 N 1.15 5.15 0.27 -1.27 0.11 -1.26 -4.49 120.40 120.05 2jtn s VAL 7 Ca 0.24 -0.51 -0.07 0.00 -2.93 0.00 0.00 61.98 58.71 2jtn s VAL 7 Cb 0.05 -3.83 0.03 0.00 -1.53 0.00 0.00 36.38 31.09 2jtn s VAL 7 CO -0.08 -0.43 0.48 0.23 -3.33 0.00 0.00 175.10 171.97 2jtn n MET 8 N -1.45 0.69 -3.73 1.54 0.00 -1.21 -5.07 117.12 107.89 2jtn n MET 8 Ca -0.05 -1.74 -0.14 0.00 0.00 0.00 0.00 57.70 55.77 2jtn n MET 8 Cb 0.56 1.95 -0.08 0.00 0.00 0.00 0.00 33.22 35.65 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 0.05 0.49 2.03 0.11 -1.26 -2.55 120.40 116.77 2jtn s VAL 9 Ca 0.15 -0.45 -0.22 0.00 -2.93 0.00 0.00 61.98 58.53 2jtn s VAL 9 Cb -0.02 -0.69 -0.07 0.00 -1.53 0.00 0.00 36.38 34.07 2jtn s VAL 9 CO 0.11 -0.24 1.22 -0.69 -3.33 0.00 0.00 175.10 172.17 2jtn s VAL 10 N -1.47 2.79 0.39 2.04 1.01 0.24 -4.84 120.40 120.55 2jtn s VAL 10 Ca -0.12 0.59 0.05 0.00 0.00 0.00 0.00 61.98 62.50 2jtn s VAL 10 Cb -0.04 -3.30 -0.02 0.00 0.00 0.00 0.00 36.38 33.02 2jtn s VAL 10 CO 0.04 -0.01 0.19 0.61 0.00 0.00 0.00 175.10 175.93 2jtn n GLY 11 N 0.53 3.12 3.73 4.51 0.00 -1.26 0.11 105.19 115.93 2jtn n GLY 11 Ca 0.08 -2.04 -0.42 0.00 0.00 0.00 0.00 46.02 43.64 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 -0.83 2.36 -2.06 1.61 -0.58 -1.26 -4.23 120.64 115.65 2jtn n GLU 12 Ca -0.01 0.83 -0.40 0.00 -0.42 0.00 0.00 57.16 57.15 2jtn n GLU 12 Cb 0.61 -2.48 -0.02 0.00 -0.57 0.00 0.00 31.44 28.98 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 -1.79 4.25 -0.23 3.49 0.02 -1.26 -4.84 135.00 134.63 2jtn s PRO 13 Ca 0.56 2.25 -0.27 0.00 0.02 0.00 0.00 61.00 63.56 2jtn s PRO 13 Cb -0.53 -3.00 0.11 0.00 0.02 0.00 0.00 34.50 31.10 2jtn s PRO 13 CO 0.61 -0.29 0.94 -0.08 -0.33 0.00 0.00 177.00 177.86 2jtn s THR 14 N -1.16 0.00 0.46 0.99 -1.32 0.41 -4.56 115.64 110.45 2jtn s THR 14 Ca 0.51 0.00 0.06 0.00 -1.21 0.00 0.00 61.69 61.05 2jtn s THR 14 Cb -0.40 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.56 2jtn s THR 14 CO 0.54 0.00 0.17 -0.76 -2.21 0.00 0.00 174.62 172.36 2jtn s LEU 15 N -0.15 2.86 0.36 9.08 1.43 -1.24 -4.33 118.68 126.69 2jtn s LEU 15 Ca 0.00 -1.25 0.05 0.00 -1.03 0.00 0.00 54.13 51.90 2jtn s LEU 15 Cb -0.04 -1.20 0.68 0.00 0.03 0.00 0.00 46.19 45.66 2jtn s LEU 15 CO -0.02 -0.70 1.93 0.00 0.23 0.00 0.00 176.35 177.79 2jtn h MET 16 N 1.32 0.53 -5.54 1.70 -0.00 -1.90 -3.48 114.93 107.56 2jtn h MET 16 Ca -0.42 -0.09 -0.16 0.00 -0.00 0.00 0.00 59.70 59.03 2jtn h MET 16 Cb 1.27 -0.09 0.09 0.00 -0.00 0.00 0.00 31.60 32.87 2jtn h MET 16 CO 0.69 0.50 -0.47 0.41 -0.00 0.00 0.00 176.91 178.04 2jtn n GLY 17 N -1.06 -1.20 2.71 -3.00 0.00 0.32 -4.96 105.19 98.01 2jtn n GLY 17 Ca 0.02 0.52 -0.11 0.00 0.00 0.00 0.00 46.02 46.46 2jtn n GLY 17 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jtn s GLY 18 N -3.19 -0.50 0.00 -0.02 0.00 -1.03 -4.84 107.32 97.73 2jtn s GLY 18 Ca 0.22 -0.93 0.17 0.00 0.00 0.00 0.00 44.72 44.18 2jtn s GLY 18 CO 0.76 3.17 1.57 -2.21 0.00 0.00 0.00 173.10 176.39 2jtn n GLU 19 N 3.22 1.32 0.00 2.90 2.13 -1.26 -4.92 120.64 124.03 2jtn n GLU 19 Ca 0.20 -0.49 0.00 0.00 0.66 0.00 0.00 57.16 57.53 2jtn n GLU 19 Cb 0.53 -1.30 0.00 0.00 0.27 0.00 0.00 31.44 30.93 2jtn n GLU 19 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 2jtn n PHE 20 N -0.27 0.00 0.00 4.31 3.72 -1.26 -4.68 117.46 119.28 2jtn n PHE 20 Ca 0.13 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.53 2jtn n PHE 20 Cb 0.17 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.71 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 0.00 4.04 0.07 1.37 0.00 -1.26 -4.91 105.19 104.50 2jtn n GLY 21 Ca 0.00 -1.20 -0.08 0.00 0.00 0.00 0.00 46.02 44.74 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 0.03 -0.02 1.61 3.32 -1.93 -3.31 116.42 116.12 2jtn h ASP 22 Ca 0.00 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 56.99 2jtn h ASP 22 Cb 0.00 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 2jtn h ASP 22 CO 0.00 1.03 -0.03 -0.08 -1.72 0.00 0.00 179.24 178.44 2jtn h GLU 23 N 0.00 0.15 0.00 3.56 4.81 -2.00 -3.26 114.58 117.84 2jtn h GLU 23 Ca -0.13 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 2jtn h GLU 23 Cb 1.88 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 31.23 2jtn h GLU 23 CO 0.11 0.19 0.00 -0.25 -0.73 0.00 0.00 179.01 178.33 2jtn n ASP 24 N -4.42 0.00 -4.55 1.04 9.92 -1.24 -4.76 116.55 112.53 2jtn n ASP 24 Ca -0.01 0.75 -0.29 0.00 -0.53 0.00 0.00 54.79 54.70 2jtn n ASP 24 Cb 0.16 -0.25 0.22 0.00 -0.64 0.00 0.00 41.12 40.62 2jtn n ASP 24 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 2jtn s GLU 25 N -1.98 -0.24 -0.69 -1.24 2.56 -1.23 -4.87 118.70 111.01 2jtn s GLU 25 Ca 0.00 1.17 -0.27 0.00 0.00 0.00 0.00 54.97 55.87 2jtn s GLU 25 Cb 0.00 -1.61 0.01 0.00 2.00 0.00 0.00 34.13 34.53 2jtn s GLU 25 CO 0.00 -3.37 1.51 1.03 -0.56 0.00 0.00 175.26 173.88 2jtn s ARG 26 N -4.50 2.96 0.60 4.30 1.81 -1.26 -4.96 118.95 117.90 2jtn s ARG 26 Ca 0.68 0.09 -0.06 0.00 -1.72 0.00 0.00 55.73 54.72 2jtn s ARG 26 Cb -0.25 -4.27 0.01 0.00 -0.45 0.00 0.00 34.95 30.00 2jtn s ARG 26 CO 0.62 -2.39 0.91 -1.17 -0.68 0.00 0.00 175.30 172.60 2jtn s LEU 27 N 7.08 3.20 0.62 2.53 2.96 -1.26 -4.37 118.68 129.43 2jtn s LEU 27 Ca 0.48 0.72 -0.19 0.00 -0.22 0.00 0.00 54.13 54.92 2jtn s LEU 27 Cb -0.10 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 43.03 2jtn s LEU 27 CO 0.17 -1.10 1.25 0.27 -1.32 0.00 0.00 176.35 175.62 2jtn s ILE 28 N -3.02 2.35 -0.27 6.68 -4.36 -1.26 -4.65 121.20 116.67 2jtn s ILE 28 Ca 0.54 0.22 0.02 0.00 -0.26 0.00 0.00 60.65 61.18 2jtn s ILE 28 Cb -0.11 -3.09 0.07 0.00 1.25 0.00 0.00 42.46 40.59 2jtn s ILE 28 CO 0.45 -0.05 -0.04 -0.89 0.24 0.00 0.00 174.94 174.66 2jtn s THR 29 N -1.50 1.91 -0.69 8.37 2.01 0.38 -4.90 115.64 121.23 2jtn s THR 29 Ca 0.80 -1.67 -0.27 0.00 0.31 0.00 0.00 61.69 60.86 2jtn s THR 29 Cb -0.34 -2.19 0.03 0.00 0.01 0.00 0.00 72.50 70.02 2jtn s THR 29 CO 0.36 -0.24 1.23 -0.13 -0.69 0.00 0.00 174.62 175.16 2jtn s ARG 30 N 1.18 3.27 0.17 4.92 3.00 -1.26 -0.82 118.95 129.41 2jtn s ARG 30 Ca -0.02 -0.15 -0.07 0.00 0.00 0.00 0.00 55.73 55.49 2jtn s ARG 30 Cb -0.19 -4.14 -0.02 0.00 0.00 0.00 0.00 34.95 30.61 2jtn s ARG 30 CO -0.07 -1.99 0.25 -0.48 0.00 0.00 0.00 175.30 173.01 2jtn s LEU 31 N 5.40 1.04 0.54 2.53 0.05 -0.56 -4.98 118.68 122.70 2jtn s LEU 31 Ca 0.36 -0.97 -0.13 0.00 0.05 0.00 0.00 54.13 53.45 2jtn s LEU 31 Cb -0.08 1.04 -0.06 0.00 -2.05 0.00 0.00 46.19 45.04 2jtn s LEU 31 CO 0.18 -0.88 0.96 -1.61 -0.55 0.00 0.00 176.35 174.44 2jtn s GLU 32 N -4.00 3.76 0.50 1.48 2.02 -1.26 -0.08 118.70 121.12 2jtn s GLU 32 Ca 0.20 0.76 0.08 0.00 0.02 0.00 0.00 54.97 56.04 2jtn s GLU 32 Cb 0.04 -2.16 0.04 0.00 0.10 0.00 0.00 34.13 32.14 2jtn s GLU 32 CO 0.02 -0.35 0.59 -0.80 0.02 0.00 0.00 175.26 174.74 2jtn s ASN 33 N -3.59 5.18 -0.53 -0.19 -0.87 0.86 -4.82 114.94 110.99 2jtn s ASN 33 Ca 0.56 -0.77 0.02 0.00 -1.57 0.00 0.00 52.86 51.10 2jtn s ASN 33 Cb -0.10 -0.12 0.53 0.00 -0.02 0.00 0.00 41.25 41.53 2jtn s ASN 33 CO 0.41 -1.01 1.87 0.35 -2.57 0.00 0.00 177.10 176.15 2jtn n THR 34 N -1.93 3.31 -4.33 1.60 -2.24 -1.26 -4.96 114.28 104.47 2jtn n THR 34 Ca 0.09 -2.71 -0.18 0.00 -2.27 0.00 0.00 64.05 58.98 2jtn n THR 34 Cb 0.61 -0.86 -0.10 0.00 -2.10 0.00 0.00 70.33 67.88 2jtn n THR 34 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2jtn s GLN 35 N -3.59 1.30 0.00 -0.78 -0.21 -1.26 -5.02 119.66 110.10 2jtn s GLN 35 Ca 0.59 -1.60 0.00 0.00 0.02 0.00 0.00 55.36 54.37 2jtn s GLN 35 Cb 0.48 -0.92 0.00 0.00 1.00 0.00 0.00 33.01 33.57 2jtn s GLN 35 CO 0.03 0.09 0.00 0.34 -2.12 0.00 0.00 175.29 173.63 2jtn n PHE 36 N -0.38 -0.67 -3.06 0.91 7.35 -1.26 -4.73 117.46 115.63 2jtn n PHE 36 Ca -0.08 0.00 -0.15 0.00 -0.76 0.00 0.00 57.45 56.47 2jtn n PHE 36 Cb 0.61 0.13 -0.04 0.00 0.35 0.00 0.00 39.48 40.54 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 -1.39 -0.10 -0.02 -2.13 1.01 -1.26 -4.08 116.67 108.71 2jtn s ASP 37 Ca 0.00 -2.34 -0.02 0.00 0.71 0.00 0.00 52.55 50.90 2jtn s ASP 37 Cb 0.00 0.81 -0.01 0.00 1.01 0.00 0.00 42.92 44.73 2jtn s ASP 37 CO 0.00 -0.11 -0.03 0.00 0.21 0.00 0.00 175.17 175.24 2jtn n ALA 38 N 2.92 0.35 -3.61 5.23 0.00 -1.26 -4.99 120.51 119.15 2jtn n ALA 38 Ca 0.23 -0.28 -0.15 0.00 0.00 0.00 0.00 53.44 53.24 2jtn n ALA 38 Cb 0.52 0.01 -0.13 0.00 0.00 0.00 0.00 19.45 19.84 2jtn n ALA 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jtn s ALA 39 N -2.90 -0.45 -1.68 0.00 0.00 -1.26 -4.86 121.76 110.60 2jtn s ALA 39 Ca -0.03 0.71 -0.01 0.00 0.00 0.00 0.00 51.96 52.63 2jtn s ALA 39 Cb 0.00 -1.09 0.00 0.00 0.00 0.00 0.00 23.12 22.03 2jtn s ALA 39 CO 0.04 -0.80 0.17 -1.71 0.00 0.00 0.00 175.76 173.47 2jtn n ASN 40 N 5.34 -5.88 0.00 0.00 4.05 -1.26 -4.96 115.26 112.55 2jtn n ASN 40 Ca -0.06 -0.09 0.00 0.00 0.45 0.00 0.00 54.58 54.88 2jtn n ASN 40 Cb 0.50 -4.84 0.00 0.00 1.23 0.00 0.00 39.78 36.67 2jtn n ASN 40 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2jtn n GLY 41 N -1.16 1.62 3.66 8.20 0.00 -1.26 -4.90 105.19 111.35 2jtn n GLY 41 Ca -0.20 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.35 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 0.06 -1.47 -0.61 0.13 -1.26 -4.62 119.36 111.60 2jtn n ILE 42 Ca 0.00 -0.01 0.15 0.00 -1.10 0.00 0.00 62.75 61.79 2jtn n ILE 42 Cb 0.00 -1.51 -0.08 0.00 -0.84 0.00 0.00 39.64 37.21 2jtn n ILE 42 CO 0.00 0.00 0.00 -0.67 2.80 0.00 0.00 176.55 178.68 2jtn n ASP 43 N 3.69 -7.95 -4.86 9.51 -0.08 -1.26 -4.89 116.55 110.71 2jtn n ASP 43 Ca 0.18 1.53 -0.36 0.00 -1.51 0.00 0.00 54.79 54.63 2jtn n ASP 43 Cb 0.28 -5.01 -0.06 0.00 2.34 0.00 0.00 41.12 38.66 2jtn n ASP 43 CO 0.00 0.00 0.00 -1.81 0.12 0.00 0.00 177.20 175.51 2jtn s ASP 44 N -7.02 6.22 0.25 1.67 1.11 -1.26 -4.91 116.67 112.73 2jtn s ASP 44 Ca 0.00 0.39 0.05 0.00 0.18 0.00 0.00 52.55 53.17 2jtn s ASP 44 Cb 0.00 -1.97 0.29 0.00 1.07 0.00 0.00 42.92 42.31 2jtn s ASP 44 CO 0.00 0.37 1.59 -0.08 1.18 0.00 0.00 175.17 178.23 2jtn h GLU 45 N 4.72 0.25 0.00 8.23 4.57 -1.93 -3.49 114.58 126.92 2jtn h GLU 45 Ca -0.53 -0.16 0.00 0.00 -1.18 0.00 0.00 59.36 57.49 2jtn h GLU 45 Cb 1.21 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.82 2jtn h GLU 45 CO 0.60 0.74 0.00 0.41 -1.18 0.00 0.00 179.01 179.58 2jtn n GLY 46 N 0.17 -0.12 2.93 1.92 0.00 -1.26 -4.46 105.19 104.37 2jtn n GLY 46 Ca -0.02 -1.32 -0.40 0.00 0.00 0.00 0.00 46.02 44.28 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 4.99 3.54 -0.02 0.00 -1.26 -5.00 105.19 107.44 2jtn n GLY 47 Ca 0.00 -2.68 -0.41 0.00 0.00 0.00 0.00 46.02 42.93 2jtn n GLY 47 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jtn s SER 48 N -1.60 6.26 -0.95 1.61 0.01 -1.26 -5.02 113.70 112.75 2jtn s SER 48 Ca 0.32 -0.19 -0.13 0.00 1.31 0.00 0.00 55.95 57.26 2jtn s SER 48 Cb 0.05 -2.24 0.22 0.00 0.21 0.00 0.00 66.02 64.25 2jtn s SER 48 CO 0.06 -0.47 0.97 -0.83 0.41 0.00 0.00 173.24 173.38 2jtn s GLY 49 N 1.77 2.69 0.00 3.44 0.00 -1.26 -4.93 107.32 109.03 2jtn s GLY 49 Ca 0.16 -3.39 0.00 0.00 0.00 0.00 0.00 44.72 41.49 2jtn s GLY 49 CO 0.13 1.45 0.00 0.61 0.00 0.00 0.00 173.10 175.29 2jtn n GLY 50 N 3.87 0.91 2.75 0.20 0.00 -1.26 -5.04 105.19 106.63 2jtn n GLY 50 Ca 0.20 -1.83 -0.21 0.00 0.00 0.00 0.00 46.02 44.17 2jtn n GLY 50 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2jtn n HIS 51 N 9.00 -1.55 -2.82 1.61 -0.00 -1.26 -3.64 115.22 116.56 2jtn n HIS 51 Ca 0.00 0.31 -0.08 0.00 -0.00 0.00 0.00 57.72 57.95 2jtn n HIS 51 Cb 0.00 -4.23 0.01 0.00 -0.00 0.00 0.00 29.99 25.77 2jtn n HIS 51 CO 0.00 0.00 0.00 -0.12 -0.00 0.00 0.00 176.34 176.22 2jtn n MET 52 N -3.57 -2.36 -0.05 -0.41 0.00 -1.26 -4.97 117.12 104.50 2jtn n MET 52 Ca -0.16 2.11 -0.06 0.00 -0.00 0.00 0.00 57.70 59.58 2jtn n MET 52 Cb 0.65 -5.60 -0.14 0.00 0.00 0.00 0.00 33.22 28.12 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 -0.29 -1.03 3.61 -5.12 0.00 -1.24 -4.97 105.19 96.16 2jtn n GLY 53 Ca 0.12 -0.23 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 2jtn n GLY 53 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jtn s SER 54 N -5.64 2.28 0.00 1.61 0.01 -1.26 -4.75 113.70 105.96 2jtn s SER 54 Ca -0.07 2.01 0.00 0.00 1.31 0.00 0.00 55.95 59.20 2jtn s SER 54 Cb 0.08 -2.50 0.00 0.00 0.21 0.00 0.00 66.02 63.80 2jtn s SER 54 CO 0.83 -3.48 0.00 0.61 0.41 0.00 0.00 173.24 171.62 2jtn n GLY 55 N 0.44 0.83 0.00 3.44 0.00 -1.26 -5.11 105.19 103.53 2jtn n GLY 55 Ca 0.09 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.47 2jtn n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jtn n GLY 56 N 0.00 1.04 3.20 -0.02 0.00 -1.26 -4.99 105.19 103.16 2jtn n GLY 56 Ca 0.00 -2.02 -0.40 0.00 0.00 0.00 0.00 46.02 43.60 2jtn n GLY 56 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jtn s THR 57 N -1.02 4.92 1.00 2.61 -4.23 -1.26 -5.07 115.64 112.60 2jtn s THR 57 Ca 0.00 -3.43 -0.12 0.00 -1.18 0.00 0.00 61.69 56.96 2jtn s THR 57 Cb 0.00 -4.03 0.19 0.00 1.34 0.00 0.00 72.50 70.00 2jtn s THR 57 CO 0.00 -1.08 1.09 -2.16 -0.54 0.00 0.00 174.62 171.93 2jtn s PRO 58 N -0.95 0.38 -1.61 3.99 0.04 -1.26 -3.73 135.00 131.85 2jtn s PRO 58 Ca 0.26 0.58 0.00 0.00 0.04 0.00 0.00 61.00 61.87 2jtn s PRO 58 Cb -0.10 -1.73 0.00 0.00 0.04 0.00 0.00 34.50 32.71 2jtn s PRO 58 CO -0.09 -2.78 0.00 0.39 0.04 0.00 0.00 177.00 174.55 2jtn n GLU 59 N -4.22 -1.82 -3.74 4.56 -0.58 -1.26 -4.96 120.64 108.62 2jtn n GLU 59 Ca 0.05 0.91 -0.36 0.00 -0.42 0.00 0.00 57.16 57.34 2jtn n GLU 59 Cb 0.57 -5.56 -0.07 0.00 -0.57 0.00 0.00 31.44 25.81 2jtn n GLU 59 CO 0.00 0.00 0.00 -1.50 -0.48 0.00 0.00 177.13 175.15 2jtn s ILE 60 N -2.93 5.40 0.14 -3.67 1.10 -1.24 -5.05 121.20 114.93 2jtn s ILE 60 Ca 0.00 0.32 -0.31 0.00 -0.51 0.00 0.00 60.65 60.15 2jtn s ILE 60 Cb 0.00 -3.49 -0.11 0.00 0.15 0.00 0.00 42.46 39.01 2jtn s ILE 60 CO 0.00 0.52 1.82 -2.16 -2.11 0.00 0.00 174.94 173.01 2jtn s PRO 61 N -0.35 4.13 0.09 3.50 0.04 -1.26 -4.97 135.00 136.19 2jtn s PRO 61 Ca 0.14 2.60 0.02 0.00 0.04 0.00 0.00 61.00 63.80 2jtn s PRO 61 Cb -0.12 -3.52 -0.04 0.00 0.04 0.00 0.00 34.50 30.85 2jtn s PRO 61 CO 0.03 -0.83 0.16 -1.64 0.04 0.00 0.00 177.00 174.76 2jtn s MET 62 N 2.53 3.17 0.32 4.56 -1.94 -1.26 -4.02 119.30 122.66 2jtn s MET 62 Ca 0.80 -0.60 -0.29 0.00 -1.71 0.00 0.00 55.69 53.89 2jtn s MET 62 Cb -0.47 -2.87 -0.12 0.00 2.01 0.00 0.00 34.83 33.39 2jtn s MET 62 CO 0.36 0.57 1.47 0.00 -0.01 0.00 0.00 175.02 177.41 2jtn s ALA 64 N -0.61 3.15 0.00 0.00 0.00 -0.95 -1.17 121.76 122.17 2jtn s ALA 64 Ca 0.59 0.89 0.00 0.00 0.00 0.00 0.00 51.96 53.44 2jtn s ALA 64 Cb -0.53 -3.94 0.00 0.00 0.00 0.00 0.00 23.12 18.65 2jtn s ALA 64 CO 0.57 -2.18 0.00 0.41 0.00 0.00 0.00 175.76 174.56 2jtn n GLY 65 N 5.08 0.68 3.15 0.00 0.00 -1.26 -4.44 105.19 108.39 2jtn n GLY 65 Ca 0.24 -0.73 -0.24 0.00 0.00 0.00 0.00 46.02 45.28 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 -1.54 3.20 -1.74 0.00 5.75 -1.26 -4.82 116.55 116.13 2jtn n ASP 67 Ca -0.06 -0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.72 2jtn n ASP 67 Cb 0.57 0.62 0.00 0.00 -1.03 0.00 0.00 41.12 41.28 2jtn n ASP 67 CO 0.00 0.00 0.00 1.67 -0.11 0.00 0.00 177.20 178.76 2jtn n GLN 68 N -2.31 1.31 -3.21 0.11 7.27 -1.26 -4.98 117.38 114.31 2jtn n GLN 68 Ca -0.12 0.00 -0.19 0.00 0.07 0.00 0.00 57.00 56.76 2jtn n GLN 68 Cb 0.73 0.00 0.01 0.00 2.41 0.00 0.00 30.24 33.39 2jtn n GLN 68 CO 0.00 0.00 0.00 -3.38 0.07 0.00 0.00 177.06 173.75 2jtn s HIS 69 N 1.04 2.40 0.17 3.69 -3.43 -1.26 -2.67 115.29 115.23 2jtn s HIS 69 Ca 0.00 -0.52 0.00 0.00 -0.80 0.00 0.00 55.06 53.74 2jtn s HIS 69 Cb 0.00 -2.26 -0.04 0.00 -1.43 0.00 0.00 32.58 28.85 2jtn s HIS 69 CO 0.00 -0.51 0.34 0.42 -2.00 0.00 0.00 174.74 172.99 2jtn s ILE 70 N -2.48 5.26 -0.05 -5.38 -1.09 -1.26 -4.73 121.20 111.48 2jtn s ILE 70 Ca 0.53 -0.46 0.02 0.00 -2.23 0.00 0.00 60.65 58.52 2jtn s ILE 70 Cb -0.07 -3.72 0.05 0.00 -1.58 0.00 0.00 42.46 37.14 2jtn s ILE 70 CO 0.32 -0.11 0.76 0.00 -1.23 0.00 0.00 174.94 174.68 2jtn n LEU 71 N -0.52 -0.71 0.00 2.97 -0.00 -1.26 -5.03 117.00 112.45 2jtn n LEU 71 Ca -0.05 -1.53 -0.18 0.00 -0.00 0.00 0.00 56.01 54.24 2jtn n LEU 71 Cb 0.54 0.08 0.07 0.00 -0.00 0.00 0.00 43.42 44.11 2jtn n LEU 71 CO 0.49 1.21 0.36 0.47 -0.00 0.00 0.00 177.39 179.93 2jtn n ASP 72 N -0.21 1.90 -0.02 1.45 8.00 -1.26 -4.48 116.55 121.93 2jtn n ASP 72 Ca -0.17 -2.40 -0.01 0.00 0.71 0.00 0.00 54.79 52.93 2jtn n ASP 72 Cb 0.58 -0.42 -0.00 0.00 -0.02 0.00 0.00 41.12 41.26 2jtn n ASP 72 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 2jtn h ARG 73 N 0.00 0.00 -6.11 -1.24 1.12 -1.94 -3.41 114.38 102.80 2jtn h ARG 73 Ca -0.26 0.00 -0.56 0.00 -1.11 0.00 0.00 59.98 58.05 2jtn h ARG 73 Cb 1.17 0.00 -0.05 0.00 -0.01 0.00 0.00 29.97 31.07 2jtn h ARG 73 CO 0.36 0.00 0.04 -0.06 -3.11 0.00 0.00 179.97 177.20 2jtn s PHE 74 N -1.24 3.67 0.03 2.20 0.40 -1.26 -0.09 117.98 121.68 2jtn s PHE 74 Ca -0.02 1.26 0.00 0.00 -0.60 0.00 0.00 56.93 57.57 2jtn s PHE 74 Cb 0.00 -2.70 -0.02 0.00 0.51 0.00 0.00 43.02 40.81 2jtn s PHE 74 CO 0.03 0.27 -0.04 0.42 0.70 0.00 0.00 175.22 176.60 2jtn s ILE 75 N 0.08 0.25 -0.41 0.64 -1.09 0.88 -4.92 121.20 116.63 2jtn s ILE 75 Ca 0.34 -1.08 -0.11 0.00 -2.23 0.00 0.00 60.65 57.57 2jtn s ILE 75 Cb -0.19 -0.53 0.06 0.00 -1.58 0.00 0.00 42.46 40.23 2jtn s ILE 75 CO 0.18 -0.54 0.25 -0.76 -1.23 0.00 0.00 174.94 172.85 2jtn s LEU 76 N -1.70 5.04 -0.35 2.97 1.02 -1.24 -1.50 118.68 122.93 2jtn s LEU 76 Ca -0.11 -1.29 -0.20 0.00 0.02 0.00 0.00 54.13 52.55 2jtn s LEU 76 Cb -0.08 -2.02 0.00 0.00 0.02 0.00 0.00 46.19 44.11 2jtn s LEU 76 CO -0.02 -0.49 0.63 -0.75 0.02 0.00 0.00 176.35 175.74 2jtn s LYS 77 N 1.50 3.70 0.09 1.70 2.20 0.00 0.80 119.74 129.73 2jtn s LYS 77 Ca 0.03 0.07 -0.10 0.00 -0.36 0.00 0.00 55.97 55.61 2jtn s LYS 77 Cb -0.22 -3.80 0.00 0.00 -1.51 0.00 0.00 37.83 32.31 2jtn s LYS 77 CO 0.04 -0.71 0.22 0.00 -0.36 0.00 0.00 175.35 174.54 2jtn s ALA 78 N 2.67 -0.33 -1.42 3.13 0.00 0.30 -0.47 121.76 125.64 2jtn s ALA 78 Ca 0.24 -0.51 -0.08 0.00 0.00 0.00 0.00 51.96 51.61 2jtn s ALA 78 Cb -0.15 0.49 0.05 0.00 0.00 0.00 0.00 23.12 23.51 2jtn s ALA 78 CO 0.14 -0.51 0.62 1.28 0.00 0.00 0.00 175.76 177.30 2jtn n LEU 79 N 0.01 -2.18 -3.17 0.00 4.77 -1.26 -1.07 117.00 114.09 2jtn n LEU 79 Ca -0.16 -0.40 -0.21 0.00 -0.03 0.00 0.00 56.01 55.21 2jtn n LEU 79 Cb 0.62 -2.54 0.07 0.00 -2.33 0.00 0.00 43.42 39.24 2jtn n LEU 79 CO 0.22 0.24 0.20 0.47 -1.33 0.00 0.00 177.39 177.19 2jtn n ASP 80 N -2.48 -5.84 -3.60 -1.43 9.92 -1.26 -4.97 116.55 106.89 2jtn n ASP 80 Ca -0.04 -0.45 -0.03 0.00 -0.53 0.00 0.00 54.79 53.73 2jtn n ASP 80 Cb 0.57 -4.48 -0.02 0.00 -0.64 0.00 0.00 41.12 36.56 2jtn n ASP 80 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2jtn s ARG 81 N -6.11 0.43 -0.29 -1.24 1.70 -0.24 -5.13 118.95 108.07 2jtn s ARG 81 Ca 0.50 -0.19 -0.23 0.00 -0.47 0.00 0.00 55.73 55.34 2jtn s ARG 81 Cb -0.22 0.18 -0.00 0.00 -0.57 0.00 0.00 34.95 34.34 2jtn s ARG 81 CO 0.61 -0.19 0.77 -3.38 -1.08 0.00 0.00 175.30 172.04 2jtn s HIS 82 N -2.54 3.23 -0.20 5.89 -3.43 -1.26 0.11 115.29 117.08 2jtn s HIS 82 Ca 0.10 0.85 -0.05 0.00 -0.80 0.00 0.00 55.06 55.16 2jtn s HIS 82 Cb 0.00 -3.15 -0.03 0.00 -1.43 0.00 0.00 32.58 27.98 2jtn s HIS 82 CO -0.05 -0.51 0.01 -1.58 -2.00 0.00 0.00 174.74 170.61 2jtn s TRP 83 N 2.88 3.05 1.23 0.38 0.52 0.24 -2.23 118.94 125.01 2jtn s TRP 83 Ca 0.32 -0.43 -0.18 0.00 0.02 0.00 0.00 56.10 55.83 2jtn s TRP 83 Cb -0.14 -2.09 0.26 0.00 -1.15 0.00 0.00 33.47 30.34 2jtn s TRP 83 CO 0.11 -0.23 0.60 0.72 0.02 0.00 0.00 176.95 178.17 2jtn n HIS 84 N 4.26 -2.29 0.13 -1.98 8.25 -1.26 -3.60 115.22 118.73 2jtn n HIS 84 Ca -0.17 -0.26 -0.22 0.00 -0.26 0.00 0.00 57.72 56.81 2jtn n HIS 84 Cb 0.52 -1.50 -0.15 0.00 1.12 0.00 0.00 29.99 29.98 2jtn n HIS 84 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2jtn h SER 85 N -2.85 0.72 0.79 0.41 0.87 -1.95 -3.21 113.55 108.32 2jtn h SER 85 Ca -0.47 -0.77 -0.06 0.00 -1.23 0.00 0.00 61.79 59.25 2jtn h SER 85 Cb 1.23 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.95 2jtn h SER 85 CO 0.33 1.60 -1.26 1.17 -0.53 0.00 0.00 176.83 178.14 2jtn n LYS 86 N -3.66 0.62 -0.87 2.24 4.81 -1.26 -3.97 118.16 116.06 2jtn n LYS 86 Ca -0.14 0.13 -0.11 0.00 -0.87 0.00 0.00 58.31 57.31 2jtn n LYS 86 Cb 1.08 -1.79 0.20 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 1.17 0.00 0.00 177.40 178.57 2jtn s LEU 88 N -2.43 2.72 0.17 0.00 2.96 -1.21 -4.46 118.68 116.42 2jtn s LEU 88 Ca 0.44 -2.72 -0.21 0.00 -0.22 0.00 0.00 54.13 51.42 2jtn s LEU 88 Cb 0.36 -1.02 0.05 0.00 0.50 0.00 0.00 46.19 46.08 2jtn s LEU 88 CO 0.10 -0.25 0.57 -1.59 -1.32 0.00 0.00 176.35 173.85 2jtn s LYS 89 N 0.24 1.30 0.56 1.98 0.00 -1.26 -1.14 119.74 121.42 2jtn s LYS 89 Ca 0.19 -0.61 -0.21 0.00 0.00 0.00 0.00 55.97 55.34 2jtn s LYS 89 Cb -0.21 0.56 -0.05 0.00 0.00 0.00 0.00 37.83 38.13 2jtn s LYS 89 CO -0.02 -0.56 1.30 0.00 0.00 0.00 0.00 175.35 176.06 2jtn h SER 91 N 1.21 0.10 0.00 0.00 0.02 -1.96 -1.81 113.55 111.11 2jtn h SER 91 Ca -0.50 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.37 2jtn h SER 91 Cb 1.32 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.83 2jtn h SER 91 CO 0.56 0.86 -0.74 -0.67 -1.14 0.00 0.00 176.83 175.70 2jtn n ASP 92 N -3.64 1.77 -0.05 3.07 -0.08 -1.26 -4.49 116.55 111.87 2jtn n ASP 92 Ca -0.02 0.44 0.03 0.00 -1.51 0.00 0.00 54.79 53.73 2jtn n ASP 92 Cb 0.77 -0.78 0.38 0.00 2.34 0.00 0.00 41.12 43.82 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 -4.45 -1.28 -3.66 0.00 -0.00 -0.68 -4.95 115.22 100.19 2jtn n HIS 94 Ca 0.04 0.11 -0.36 0.00 0.46 0.00 0.00 57.72 57.97 2jtn n HIS 94 Cb 0.06 -3.85 -0.07 0.00 -0.12 0.00 0.00 29.99 26.02 2jtn n HIS 94 CO 0.00 0.00 0.00 0.08 0.46 0.00 0.00 176.34 176.88 2jtn s VAL 95 N -3.00 5.35 -0.32 3.57 1.01 -1.26 -4.83 120.40 120.92 2jtn s VAL 95 Ca 0.07 0.40 -0.41 0.00 0.00 0.00 0.00 61.98 62.04 2jtn s VAL 95 Cb -0.03 -3.54 -0.16 0.00 0.00 0.00 0.00 36.38 32.65 2jtn s VAL 95 CO 0.09 0.47 1.78 -2.65 0.00 0.00 0.00 175.10 174.79 2jtn n PRO 96 N 3.07 0.99 -3.30 2.72 -0.02 -1.26 -3.57 135.00 133.62 2jtn n PRO 96 Ca -0.15 0.36 -0.43 0.00 -2.02 0.00 0.00 63.50 61.26 2jtn n PRO 96 Cb 0.53 -2.05 -0.01 0.00 -0.02 0.00 0.00 33.50 31.95 2jtn n PRO 96 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2jtn n LEU 97 N 5.65 5.53 -2.06 2.45 4.32 -0.29 -4.82 117.00 127.77 2jtn n LEU 97 Ca 0.29 -5.10 -0.26 0.00 -0.02 0.00 0.00 56.01 50.91 2jtn n LEU 97 Cb 0.11 -1.36 0.08 0.00 -1.62 0.00 0.00 43.42 40.63 2jtn n LEU 97 CO 0.82 1.48 0.89 0.00 -1.22 0.00 0.00 177.39 179.35 2jtn n ALA 98 N 2.26 5.57 0.08 -1.18 0.00 -1.26 -4.70 120.51 121.28 2jtn n ALA 98 Ca 0.24 -3.52 0.00 0.00 0.00 0.00 0.00 53.44 50.16 2jtn n ALA 98 Cb 0.37 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.73 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 -0.88 0.00 -4.75 0.00 1.02 -1.26 -5.13 120.64 109.64 2jtn n GLU 99 Ca 0.52 0.00 -0.25 0.00 -0.02 0.00 0.00 57.16 57.41 2jtn n GLU 99 Cb 0.88 0.00 -0.16 0.00 -0.02 0.00 0.00 31.44 32.14 2jtn n GLU 99 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 2jtn s ARG 100 N -1.37 1.73 -0.10 3.49 1.04 -1.26 -4.52 118.95 117.96 2jtn s ARG 100 Ca 0.00 -0.54 0.03 0.00 -1.04 0.00 0.00 55.73 54.18 2jtn s ARG 100 Cb 0.00 -1.48 0.01 0.00 -2.04 0.00 0.00 34.95 31.44 2jtn s ARG 100 CO 0.00 0.17 -0.19 0.00 -0.04 0.00 0.00 175.30 175.25 2jtn s PHE 102 N 0.65 2.76 -0.15 0.00 2.19 0.29 -4.21 117.98 119.51 2jtn s PHE 102 Ca -0.13 -0.17 -0.00 0.00 0.33 0.00 0.00 56.93 56.96 2jtn s PHE 102 Cb -0.16 -1.36 0.03 0.00 -1.31 0.00 0.00 43.02 40.22 2jtn s PHE 102 CO 0.03 0.50 -0.09 0.45 1.83 0.00 0.00 175.22 177.95 2jtn s SER 103 N -2.76 2.67 -0.16 6.13 0.15 -1.26 0.10 113.70 118.57 2jtn s SER 103 Ca 0.25 -0.54 -0.07 0.00 0.70 0.00 0.00 55.95 56.30 2jtn s SER 103 Cb -0.09 -1.00 0.07 0.00 -1.71 0.00 0.00 66.02 63.28 2jtn s SER 103 CO 0.17 -0.13 0.35 -0.13 1.20 0.00 0.00 173.24 174.70 2jtn s ARG 104 N 1.59 0.27 -0.75 5.44 1.81 -1.15 -4.89 118.95 121.27 2jtn s ARG 104 Ca 0.03 0.82 -0.00 0.00 -1.72 0.00 0.00 55.73 54.86 2jtn s ARG 104 Cb -0.14 0.08 -0.00 0.00 -0.45 0.00 0.00 34.95 34.44 2jtn s ARG 104 CO -0.09 -0.22 0.63 0.41 -0.68 0.00 0.00 175.30 175.34 2jtn n GLY 105 N 4.93 -0.07 5.00 -3.53 0.00 -1.26 -3.96 105.19 106.30 2jtn n GLY 105 Ca -0.14 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.77 2jtn n GLY 105 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jtn n GLU 106 N -2.95 0.00 -1.57 1.61 -0.58 -1.26 -4.86 120.64 111.03 2jtn n GLU 106 Ca -0.18 0.00 -0.36 0.00 -0.42 0.00 0.00 57.16 56.20 2jtn n GLU 106 Cb 0.61 0.00 0.08 0.00 -0.57 0.00 0.00 31.44 31.55 2jtn n GLU 106 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 2jtn n SER 107 N 1.78 1.43 -4.73 1.62 7.64 -1.25 -4.95 113.62 115.16 2jtn n SER 107 Ca 0.00 0.77 -0.41 0.00 1.01 0.00 0.00 58.87 60.24 2jtn n SER 107 Cb 0.00 -1.49 -0.04 0.00 -1.01 0.00 0.00 64.21 61.66 2jtn n SER 107 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2jtn s VAL 108 N -1.57 4.25 0.20 0.44 0.11 -1.26 -2.93 120.40 119.63 2jtn s VAL 108 Ca 0.79 1.87 0.10 0.00 -2.93 0.00 0.00 61.98 61.81 2jtn s VAL 108 Cb -0.37 -4.20 -0.04 0.00 -1.53 0.00 0.00 36.38 30.24 2jtn s VAL 108 CO 0.44 0.29 -0.20 -0.31 -3.33 0.00 0.00 175.10 172.00 2jtn s TYR 109 N -0.02 2.02 -0.09 1.54 1.51 0.29 -3.43 117.35 119.17 2jtn s TYR 109 Ca 0.48 -0.43 0.01 0.00 -1.01 0.00 0.00 57.07 56.13 2jtn s TYR 109 Cb -0.26 -0.97 -0.02 0.00 -0.11 0.00 0.00 41.96 40.60 2jtn s TYR 109 CO 0.32 0.45 -0.11 0.00 -1.11 0.00 0.00 175.55 175.10 2jtn h LYS 111 N 5.87 0.44 -0.77 0.00 3.64 -1.93 -1.59 116.57 122.23 2jtn h LYS 111 Ca -0.39 -0.03 0.17 0.00 -1.27 0.00 0.00 60.65 59.13 2jtn h LYS 111 Cb 1.18 -0.10 -0.14 0.00 -0.41 0.00 0.00 32.23 32.76 2jtn h LYS 111 CO 0.54 0.29 -0.10 0.22 -2.27 0.00 0.00 179.45 178.13 2jtn h ASP 112 N 0.46 -0.55 1.59 4.20 3.58 -1.94 0.41 116.42 124.16 2jtn h ASP 112 Ca 0.48 0.22 -0.02 0.00 0.42 0.00 0.00 57.03 58.13 2jtn h ASP 112 Cb 1.13 0.42 -0.00 0.00 1.72 0.00 0.00 39.33 42.60 2jtn h ASP 112 CO -0.20 -0.23 -0.42 -2.24 -2.88 0.00 0.00 179.24 173.27 2jtn h ASP 113 N 0.04 0.00 -0.27 2.28 3.04 -1.74 -3.30 116.42 116.48 2jtn h ASP 113 Ca 0.40 0.00 -0.05 0.00 -3.24 0.00 0.00 57.03 54.14 2jtn h ASP 113 Cb 0.66 0.00 -0.02 0.00 -1.04 0.00 0.00 39.33 38.93 2jtn h ASP 113 CO -0.75 0.08 0.01 0.15 -2.04 0.00 0.00 179.24 176.69 2jtn h PHE 114 N 0.00 0.60 -0.62 4.15 3.04 0.32 0.12 116.94 124.54 2jtn h PHE 114 Ca -0.01 -0.06 -0.07 0.00 3.98 0.00 0.00 57.97 61.81 2jtn h PHE 114 Cb 1.07 -0.17 -0.02 0.00 2.56 0.00 0.00 35.95 39.38 2jtn h PHE 114 CO 0.00 0.58 0.11 0.74 -2.02 0.00 0.00 178.31 177.72 2jtn h PHE 115 N 0.55 1.09 0.17 0.41 0.04 -1.28 0.96 116.94 118.89 2jtn h PHE 115 Ca 0.12 -0.15 -0.01 0.00 2.80 0.00 0.00 57.97 60.73 2jtn h PHE 115 Cb 0.34 -0.30 0.00 0.00 2.20 0.00 0.00 35.95 38.20 2jtn h PHE 115 CO 0.01 0.93 -0.08 0.87 -0.60 0.00 0.00 178.31 179.44 2jtn h LYS 116 N 0.93 -0.22 0.06 1.51 1.57 -1.60 0.20 116.57 119.03 2jtn h LYS 116 Ca 0.19 0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.98 2jtn h LYS 116 Cb 0.42 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.78 2jtn h LYS 116 CO 0.01 0.11 -0.03 0.00 -0.57 0.00 0.00 179.45 178.97 2jtn h ARG 117 N -0.97 -0.08 -1.05 3.15 3.08 -1.05 -3.31 114.38 114.15 2jtn h ARG 117 Ca -0.02 0.01 -0.59 0.00 0.07 0.00 0.00 59.98 59.45 2jtn h ARG 117 Cb 0.44 0.02 -0.27 0.00 0.08 0.00 0.00 29.97 30.23 2jtn h ARG 117 CO 0.04 0.49 0.75 1.19 -1.07 0.00 0.00 179.97 181.37 2jtn n PHE 118 N -4.83 2.96 -0.50 3.04 3.01 0.33 -4.93 117.46 116.54 2jtn n PHE 118 Ca -0.08 -2.55 0.00 0.00 1.01 0.00 0.00 57.45 55.83 2jtn n PHE 118 Cb 0.30 -1.24 0.00 0.00 -0.01 0.00 0.00 39.48 38.53 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 -0.83 2.66 3.87 1.37 0.00 -0.66 -4.61 105.19 106.99 2jtn n GLY 119 Ca 0.58 -0.18 -0.26 0.00 0.00 0.00 0.00 46.02 46.15 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 -0.15 4.87 0.09 2.61 2.01 0.62 -4.75 115.64 120.95 2jtn s THR 120 Ca 0.00 -0.90 -0.14 0.00 0.31 0.00 0.00 61.69 60.95 2jtn s THR 120 Cb 0.00 -3.50 0.03 0.00 0.01 0.00 0.00 72.50 69.04 2jtn s THR 120 CO 0.00 -0.10 0.34 -0.75 -0.69 0.00 0.00 174.62 173.42 2jtn s LYS 121 N -3.17 0.96 0.21 4.92 2.20 -1.26 -3.95 119.74 119.65 2jtn s LYS 121 Ca 0.33 -0.68 -0.30 0.00 -0.36 0.00 0.00 55.97 54.96 2jtn s LYS 121 Cb -0.10 0.42 -0.08 0.00 -1.51 0.00 0.00 37.83 36.55 2jtn s LYS 121 CO 0.26 -0.35 1.13 0.00 -0.36 0.00 0.00 175.35 176.03 2jtn n ALA 123 N 2.07 5.23 0.06 0.00 0.00 -1.24 -3.26 120.51 123.38 2jtn n ALA 123 Ca 0.02 -2.54 0.00 0.00 0.00 0.00 0.00 53.44 50.92 2jtn n ALA 123 Cb 0.45 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.50 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 -0.93 3.00 -0.85 0.00 0.00 -1.26 -4.85 120.51 115.62 2jtn n ALA 124 Ca 0.52 0.00 0.08 0.00 0.00 0.00 0.00 53.44 54.04 2jtn n ALA 124 Cb 1.51 0.22 0.25 0.00 0.00 0.00 0.00 19.45 21.43 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 -0.26 -1.93 -3.86 0.00 1.13 -1.20 -4.94 117.38 106.31 2jtn n GLN 126 Ca 0.20 0.76 -0.36 0.00 -1.94 0.00 0.00 57.00 55.66 2jtn n GLN 126 Cb 0.83 -5.33 -0.07 0.00 0.11 0.00 0.00 30.24 25.78 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 -5.47 4.20 -0.34 1.08 2.96 -1.25 -4.84 118.68 115.02 2jtn s LEU 127 Ca 0.00 0.31 -0.29 0.00 -0.22 0.00 0.00 54.13 53.93 2jtn s LEU 127 Cb 0.00 -2.05 -0.01 0.00 0.50 0.00 0.00 46.19 44.63 2jtn s LEU 127 CO 0.00 0.29 1.62 -0.83 -1.32 0.00 0.00 176.35 176.10 2jtn s GLY 128 N -0.29 0.99 0.35 7.98 0.00 -1.26 0.11 107.32 115.19 2jtn s GLY 128 Ca 0.11 0.14 -0.29 0.00 0.00 0.00 0.00 44.72 44.68 2jtn s GLY 128 CO 0.01 3.03 1.41 -0.42 0.00 0.00 0.00 173.10 177.12 2jtn s ILE 129 N 6.02 2.39 0.98 0.90 1.01 -1.26 -4.85 121.20 126.39 2jtn s ILE 129 Ca 0.71 0.39 -0.20 0.00 0.00 0.00 0.00 60.65 61.54 2jtn s ILE 129 Cb -0.19 -3.25 -0.04 0.00 0.01 0.00 0.00 42.46 38.98 2jtn s ILE 129 CO 0.32 0.09 -0.72 -2.65 0.00 0.00 0.00 174.94 171.99 2jtn n PRO 130 N 0.77 -0.74 -0.00 2.79 -0.02 -1.26 -4.80 135.00 131.74 2jtn n PRO 130 Ca 0.01 -0.21 -0.08 0.00 -2.02 0.00 0.00 63.50 61.20 2jtn n PRO 130 Cb 0.40 -1.25 -0.06 0.00 -0.02 0.00 0.00 33.50 32.57 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 -1.63 -0.11 0.00 0.52 0.11 -1.93 -3.42 132.00 125.54 2jtn h PRO 131 Ca -0.37 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.74 2jtn h PRO 131 Cb 1.15 0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 2jtn h PRO 131 CO 0.23 0.29 -0.23 2.41 -0.21 0.00 0.00 178.00 180.49 2jtn n THR 132 N -4.81 1.32 -0.05 -1.15 -1.04 -1.26 0.12 114.28 107.41 2jtn n THR 132 Ca -0.06 -1.69 0.00 0.00 -2.04 0.00 0.00 64.05 60.27 2jtn n THR 132 Cb 0.22 0.02 0.00 0.00 -1.82 0.00 0.00 70.33 68.75 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 -0.93 -1.46 -4.05 -2.82 1.13 -1.26 -4.77 117.38 103.22 2jtn n GLN 133 Ca 0.11 0.00 -0.33 0.00 -1.94 0.00 0.00 57.00 54.85 2jtn n GLN 133 Cb 0.68 0.00 -0.15 0.00 0.11 0.00 0.00 30.24 30.88 2jtn n GLN 133 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2jtn s VAL 134 N -0.86 2.33 0.16 5.09 1.01 -1.26 -3.63 120.40 123.25 2jtn s VAL 134 Ca 0.00 -1.43 -0.20 0.00 0.00 0.00 0.00 61.98 60.36 2jtn s VAL 134 Cb 0.00 -2.29 0.05 0.00 0.00 0.00 0.00 36.38 34.14 2jtn s VAL 134 CO 0.00 0.08 0.52 0.54 0.00 0.00 0.00 175.10 176.24 2jtn s VAL 135 N 1.17 0.03 -0.11 2.92 0.11 -1.26 -4.83 120.40 118.43 2jtn s VAL 135 Ca -0.05 -0.39 -0.13 0.00 -2.93 0.00 0.00 61.98 58.48 2jtn s VAL 135 Cb -0.18 -1.22 -0.05 0.00 -1.53 0.00 0.00 36.38 33.40 2jtn s VAL 135 CO -0.06 -0.13 0.29 0.00 -3.33 0.00 0.00 175.10 171.88 2jtn s ARG 136 N -3.80 3.99 -0.08 1.54 3.03 -1.26 0.15 118.95 122.52 2jtn s ARG 136 Ca 0.04 0.13 0.02 0.00 2.03 0.00 0.00 55.73 57.95 2jtn s ARG 136 Cb -0.00 -3.32 -0.02 0.00 -1.03 0.00 0.00 34.95 30.58 2jtn s ARG 136 CO -0.10 0.48 -0.13 -0.98 -1.13 0.00 0.00 175.30 173.44 2jtn s ARG 137 N -0.28 2.82 -0.75 3.89 1.04 -1.26 -3.54 118.95 120.86 2jtn s ARG 137 Ca 0.18 -0.68 -0.26 0.00 -1.04 0.00 0.00 55.73 53.93 2jtn s ARG 137 Cb -0.14 -2.48 -0.01 0.00 -2.04 0.00 0.00 34.95 30.29 2jtn s ARG 137 CO 0.06 0.49 1.74 0.00 -0.04 0.00 0.00 175.30 177.55 2jtn s ALA 138 N -0.37 2.20 0.00 7.88 0.00 0.39 -4.81 121.76 127.05 2jtn s ALA 138 Ca 0.04 -1.18 0.00 0.00 0.00 0.00 0.00 51.96 50.82 2jtn s ALA 138 Cb -0.12 -4.39 0.00 0.00 0.00 0.00 0.00 23.12 18.61 2jtn s ALA 138 CO 0.02 -4.00 0.00 1.04 0.00 0.00 0.00 175.76 172.82 2jtn n GLN 139 N 9.10 0.00 0.12 0.00 3.00 -1.26 0.10 117.38 128.45 2jtn n GLN 139 Ca 0.24 0.00 -0.21 0.00 -0.01 0.00 0.00 57.00 57.02 2jtn n GLN 139 Cb 0.50 0.00 -0.14 0.00 0.00 0.00 0.00 30.24 30.60 2jtn n GLN 139 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.06 176.62 2jtn h ASP 140 N 0.00 0.74 -1.63 1.08 5.19 -2.05 -3.47 116.42 116.28 2jtn h ASP 140 Ca 0.00 -0.75 -0.49 0.00 -0.62 0.00 0.00 57.03 55.18 2jtn h ASP 140 Cb 0.00 -0.24 -0.03 0.00 0.18 0.00 0.00 39.33 39.24 2jtn h ASP 140 CO 0.00 1.57 -0.39 -0.36 -3.12 0.00 0.00 179.24 176.94 2jtn s PHE 141 N -2.78 2.80 0.09 4.55 0.40 0.29 -5.14 117.98 118.19 2jtn s PHE 141 Ca -0.08 -0.41 0.09 0.00 -0.60 0.00 0.00 56.93 55.93 2jtn s PHE 141 Cb 0.06 -2.06 -0.03 0.00 0.51 0.00 0.00 43.02 41.49 2jtn s PHE 141 CO 0.92 -0.04 -0.24 0.08 0.70 0.00 0.00 175.22 176.65 2jtn s VAL 142 N -2.40 1.95 0.27 -0.44 1.01 -1.26 0.15 120.40 119.68 2jtn s VAL 142 Ca 0.46 -1.52 0.02 0.00 0.00 0.00 0.00 61.98 60.94 2jtn s VAL 142 Cb -0.05 -1.72 -0.05 0.00 0.00 0.00 0.00 36.38 34.56 2jtn s VAL 142 CO 0.28 0.11 0.09 -0.31 0.00 0.00 0.00 175.10 175.27 2jtn s TYR 143 N -1.00 1.60 1.06 5.22 1.51 -1.23 -3.60 117.35 120.91 2jtn s TYR 143 Ca 0.10 -1.16 -0.12 0.00 -1.01 0.00 0.00 57.07 54.88 2jtn s TYR 143 Cb -0.10 -0.95 0.22 0.00 -0.11 0.00 0.00 41.96 41.02 2jtn s TYR 143 CO 0.04 -0.29 1.07 -1.01 -1.11 0.00 0.00 175.55 174.24 2jtn s HIS 144 N -3.68 1.78 0.10 2.71 3.76 -1.26 -4.55 115.29 114.14 2jtn s HIS 144 Ca 0.38 1.12 0.08 0.00 -0.15 0.00 0.00 55.06 56.48 2jtn s HIS 144 Cb 0.08 -3.19 -0.21 0.00 1.11 0.00 0.00 32.58 30.37 2jtn s HIS 144 CO 0.14 -3.28 1.22 -0.07 -0.85 0.00 0.00 174.74 171.89 2jtn h LEU 145 N -2.19 0.00 0.01 0.89 4.07 -1.92 -3.10 115.31 113.07 2jtn h LEU 145 Ca -0.57 0.00 -0.28 0.00 0.08 0.00 0.00 57.88 57.12 2jtn h LEU 145 Cb 1.33 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 43.03 2jtn h LEU 145 CO 0.54 1.00 -1.50 1.41 -1.08 0.00 0.00 178.44 178.80 2jtn n HIS 146 N -3.32 0.88 -0.15 1.13 8.25 -1.26 -4.26 115.22 116.49 2jtn n HIS 146 Ca -0.02 0.36 0.18 0.00 -0.26 0.00 0.00 57.72 57.99 2jtn n HIS 146 Cb 0.95 -1.09 0.56 0.00 1.12 0.00 0.00 29.99 31.53 2jtn n HIS 146 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2jtn n PHE 148 N -4.45 2.09 -3.85 0.00 7.35 -1.17 -4.87 117.46 112.57 2jtn n PHE 148 Ca 0.15 -0.06 -0.00 0.00 -0.76 0.00 0.00 57.45 56.77 2jtn n PHE 148 Cb 0.61 -2.69 0.01 0.00 0.35 0.00 0.00 39.48 37.77 2jtn n PHE 148 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2jtn n ALA 149 N 9.22 -2.19 -2.79 3.13 0.00 -1.26 -3.74 120.51 122.88 2jtn n ALA 149 Ca 0.28 -0.66 -0.31 0.00 0.00 0.00 0.00 53.44 52.75 2jtn n ALA 149 Cb 0.36 0.28 -0.04 0.00 0.00 0.00 0.00 19.45 20.04 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 2.05 0.78 0.00 0.00 -1.51 -1.83 0.27 116.25 116.01 2jtn h VAL 151 Ca -0.46 -0.86 -0.13 0.00 -1.23 0.00 0.00 66.70 64.02 2jtn h VAL 151 Cb 1.16 1.52 -0.02 0.00 -2.13 0.00 0.00 31.29 31.83 2jtn h VAL 151 CO 0.74 0.21 -1.26 0.52 -1.23 0.00 0.00 177.57 176.55 2jtn n VAL 152 N -3.75 1.27 0.22 7.19 0.31 -1.26 -4.61 118.33 117.70 2jtn n VAL 152 Ca -0.01 0.02 0.07 0.00 -0.01 0.00 0.00 64.34 64.40 2jtn n VAL 152 Cb 0.32 -1.97 0.51 0.00 -0.91 0.00 0.00 33.84 31.79 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 -3.99 -2.70 -4.62 0.00 5.02 0.08 -4.86 118.16 107.10 2jtn n LYS 154 Ca -0.02 0.73 -0.28 0.00 -2.02 0.00 0.00 58.31 56.73 2jtn n LYS 154 Cb 0.31 -5.41 -0.14 0.00 -0.02 0.00 0.00 35.03 29.78 2jtn n LYS 154 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2jtn s ARG 155 N -5.29 1.51 0.73 1.97 6.06 -1.26 -4.71 118.95 117.96 2jtn s ARG 155 Ca 0.11 -1.15 -0.15 0.00 -2.50 0.00 0.00 55.73 52.04 2jtn s ARG 155 Cb -0.05 -1.77 0.04 0.00 0.06 0.00 0.00 34.95 33.22 2jtn s ARG 155 CO 0.13 0.44 1.21 -0.65 -2.50 0.00 0.00 175.30 173.93 2jtn s GLN 156 N -1.55 2.11 -0.19 5.12 1.11 -1.25 -2.47 119.66 122.54 2jtn s GLN 156 Ca 0.11 1.77 -0.03 0.00 0.01 0.00 0.00 55.36 57.22 2jtn s GLN 156 Cb -0.10 -1.83 -0.01 0.00 -1.01 0.00 0.00 33.01 30.06 2jtn s GLN 156 CO 0.03 -1.86 -0.06 -0.51 0.01 0.00 0.00 175.29 172.90 2jtn s LEU 157 N -5.17 2.89 0.22 2.90 2.01 -1.26 -4.94 118.68 115.33 2jtn s LEU 157 Ca 0.74 -0.35 0.03 0.00 0.01 0.00 0.00 54.13 54.56 2jtn s LEU 157 Cb -0.29 -1.71 -0.03 0.00 0.01 0.00 0.00 46.19 44.16 2jtn s LEU 157 CO 0.46 0.04 0.36 0.00 1.01 0.00 0.00 176.35 178.22 2jtn s ALA 158 N 1.11 3.90 0.12 4.21 0.00 -1.26 -4.95 121.76 124.89 2jtn s ALA 158 Ca 0.01 -1.07 -0.35 0.00 0.00 0.00 0.00 51.96 50.55 2jtn s ALA 158 Cb -0.15 -1.83 -0.17 0.00 0.00 0.00 0.00 23.12 20.97 2jtn s ALA 158 CO -0.01 0.33 1.06 -2.37 0.00 0.00 0.00 175.76 174.77 2jtn n THR 159 N -1.08 0.70 0.00 0.00 5.66 -1.26 -1.66 114.28 116.64 2jtn n THR 159 Ca -0.07 -0.18 0.00 0.00 -3.05 0.00 0.00 64.05 60.75 2jtn n THR 159 Cb 0.56 -0.47 0.00 0.00 -1.55 0.00 0.00 70.33 68.87 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 1.93 2.55 3.72 1.09 0.00 0.12 -4.89 105.19 109.71 2jtn n GLY 160 Ca 0.17 -0.28 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 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 0.33 6.73 -0.37 1.61 2.15 -0.67 -4.62 116.67 121.84 2jtn s ASP 161 Ca 0.00 2.47 -0.23 0.00 0.43 0.00 0.00 52.55 55.22 2jtn s ASP 161 Cb 0.00 -2.60 0.01 0.00 -0.30 0.00 0.00 42.92 40.03 2jtn s ASP 161 CO 0.00 -0.70 0.76 -1.61 -0.17 0.00 0.00 175.17 173.45 2jtn s GLU 162 N 0.81 3.70 0.13 4.34 2.02 -1.26 0.81 118.70 129.25 2jtn s GLU 162 Ca 0.65 0.22 0.08 0.00 0.02 0.00 0.00 54.97 55.93 2jtn s GLU 162 Cb -0.40 -3.83 -0.04 0.00 0.10 0.00 0.00 34.13 29.97 2jtn s GLU 162 CO 0.33 -0.87 -0.18 -0.59 0.02 0.00 0.00 175.26 173.98 2jtn s PHE 163 N 3.07 1.67 0.30 1.61 -0.71 -1.06 -4.03 117.98 118.83 2jtn s PHE 163 Ca 0.30 -0.47 0.06 0.00 -1.04 0.00 0.00 56.93 55.78 2jtn s PHE 163 Cb -0.13 -0.87 -0.02 0.00 -1.21 0.00 0.00 43.02 40.79 2jtn s PHE 163 CO 0.17 0.23 0.37 0.71 -1.34 0.00 0.00 175.22 175.36 2jtn s TYR 164 N -1.77 3.15 -0.24 3.49 2.02 0.27 -3.32 117.35 120.95 2jtn s TYR 164 Ca 0.10 -0.18 0.02 0.00 -0.37 0.00 0.00 57.07 56.65 2jtn s TYR 164 Cb -0.07 -1.77 0.05 0.00 -0.40 0.00 0.00 41.96 39.77 2jtn s TYR 164 CO 0.05 0.21 -0.12 -1.17 -1.57 0.00 0.00 175.55 172.95 2jtn s LEU 165 N -4.04 3.07 1.14 -1.29 2.96 -1.26 -2.38 118.68 116.87 2jtn s LEU 165 Ca 0.40 -1.21 -0.12 0.00 -0.22 0.00 0.00 54.13 52.97 2jtn s LEU 165 Cb -0.08 -1.49 0.27 0.00 0.50 0.00 0.00 46.19 45.39 2jtn s LEU 165 CO 0.29 -0.16 1.04 -0.04 -1.32 0.00 0.00 176.35 176.16 2jtn s MET 166 N 1.18 -0.78 0.53 1.98 -1.94 -1.12 -4.87 119.30 114.27 2jtn s MET 166 Ca -0.06 0.98 0.18 0.00 -1.71 0.00 0.00 55.69 55.09 2jtn s MET 166 Cb -0.18 -1.56 1.32 0.00 2.01 0.00 0.00 34.83 36.42 2jtn s MET 166 CO -0.07 -3.68 2.14 0.93 -0.01 0.00 0.00 175.02 174.34 2jtn h GLU 167 N -2.60 0.00 0.00 2.03 4.39 -1.99 -3.34 114.58 113.07 2jtn h GLU 167 Ca -0.59 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.11 2jtn h GLU 167 Cb 1.32 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.97 2jtn h GLU 167 CO 0.48 0.00 0.00 -0.25 -1.16 0.00 0.00 179.01 178.08 2jtn n ASP 168 N -4.47 0.00 0.00 1.42 9.92 -1.26 -5.02 116.55 117.14 2jtn n ASP 168 Ca -0.02 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.25 2jtn n ASP 168 Cb 0.15 -0.01 0.00 0.00 -0.64 0.00 0.00 41.12 40.62 2jtn n ASP 168 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 2jtn n SER 169 N -1.00 0.00 -4.43 -2.24 3.41 -1.25 -5.13 113.62 102.97 2jtn n SER 169 Ca 0.00 0.00 -0.37 0.00 -0.26 0.00 0.00 58.87 58.24 2jtn n SER 169 Cb 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 63.83 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 0.00 3.46 0.06 4.33 3.00 -1.26 -4.93 118.95 123.60 2jtn s ARG 170 Ca 0.00 -0.62 -0.31 0.00 0.00 0.00 0.00 55.73 54.81 2jtn s ARG 170 Cb 0.00 -3.44 -0.07 0.00 0.00 0.00 0.00 34.95 31.45 2jtn s ARG 170 CO 0.00 -0.31 1.42 -0.51 0.00 0.00 0.00 175.30 175.90 2jtn s LEU 171 N 1.60 4.35 -0.09 2.53 1.02 -1.26 -2.77 118.68 124.05 2jtn s LEU 171 Ca 0.05 2.24 -0.04 0.00 0.02 0.00 0.00 54.13 56.40 2jtn s LEU 171 Cb -0.16 -3.57 0.05 0.00 0.02 0.00 0.00 46.19 42.52 2jtn s LEU 171 CO 0.05 -0.71 0.20 0.54 0.02 0.00 0.00 176.35 176.45 2jtn s VAL 172 N 1.87 -0.14 0.10 -1.59 0.11 -1.00 -2.28 120.40 117.46 2jtn s VAL 172 Ca 0.65 0.22 -0.02 0.00 -2.93 0.00 0.00 61.98 59.90 2jtn s VAL 172 Cb -0.35 -0.33 0.02 0.00 -1.53 0.00 0.00 36.38 34.20 2jtn s VAL 172 CO 0.29 0.09 0.06 0.00 -3.33 0.00 0.00 175.10 172.20 2jtn h LYS 174 N 0.00 -0.25 -0.55 0.00 1.57 -1.94 -2.86 116.57 112.54 2jtn h LYS 174 Ca -0.03 0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 2jtn h LYS 174 Cb 0.08 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.43 2jtn h LYS 174 CO 0.02 0.11 0.30 0.00 -0.57 0.00 0.00 179.45 179.30 2jtn h ALA 175 N -0.52 0.70 -0.04 3.86 0.00 -1.94 -1.95 119.26 119.37 2jtn h ALA 175 Ca -0.03 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.79 2jtn h ALA 175 Cb 0.48 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2jtn h ALA 175 CO 0.04 0.23 0.04 -0.44 0.00 0.00 0.00 179.25 179.12 2jtn h ASP 176 N 0.74 0.00 0.23 0.00 3.32 -1.92 -2.96 116.42 115.84 2jtn h ASP 176 Ca 0.19 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.23 2jtn h ASP 176 Cb 0.06 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 2jtn h ASP 176 CO -0.03 0.00 -0.20 0.22 -1.72 0.00 0.00 179.24 177.51 2jtn h TYR 177 N 0.00 -0.55 -0.29 4.55 5.03 -1.10 0.84 116.97 125.45 2jtn h TYR 177 Ca 0.02 0.00 0.08 0.00 2.58 0.00 0.00 58.73 61.41 2jtn h TYR 177 Cb 0.10 0.21 -0.01 0.00 1.55 0.00 0.00 36.73 38.57 2jtn h TYR 177 CO 0.00 -0.28 0.24 0.93 -1.32 0.00 0.00 178.16 177.74 2jtn h GLU 178 N -0.42 0.00 0.01 1.82 4.39 -1.62 0.92 114.58 119.67 2jtn h GLU 178 Ca -0.03 0.00 -0.21 0.00 0.34 0.00 0.00 59.36 59.46 2jtn h GLU 178 Cb 0.36 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.98 2jtn h GLU 178 CO -0.01 0.00 -0.98 1.15 -1.16 0.00 0.00 179.01 178.01 2jtn h THR 179 N 0.00 1.67 0.00 1.13 2.02 -1.28 -3.30 112.91 113.15 2jtn h THR 179 Ca 0.14 -3.26 -0.27 0.00 0.77 0.00 0.00 66.41 63.78 2jtn h THR 179 Cb 0.62 2.79 -0.05 0.00 -1.74 0.00 0.00 68.15 69.77 2jtn h THR 179 CO -0.00 0.93 -1.67 0.00 0.37 0.00 0.00 175.52 175.15 2jtn n ALA 180 N -2.37 1.58 -1.34 6.16 0.00 0.29 -5.08 120.51 119.75 2jtn n ALA 180 Ca -0.01 -0.74 0.18 0.00 0.00 0.00 0.00 53.44 52.87 2jtn n ALA 180 Cb 0.92 -0.86 -0.06 0.00 0.00 0.00 0.00 19.45 19.45 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 -3.01 -2.81 0.00 0.00 4.76 0.30 -5.07 118.16 112.34 2jtn n LYS 181 Ca -0.16 1.99 0.09 0.00 -2.87 0.00 0.00 58.31 57.36 2jtn n LYS 181 Cb 1.01 -3.38 0.07 0.00 -1.84 0.00 0.00 35.03 30.90 2jtn n LYS 181 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07