#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 -0.28 -0.30 6.43 0.15 -1.26 -5.16 113.70 113.28 2jtn s SER 2 Ca 0.00 -0.34 -0.17 0.00 0.70 0.00 0.00 55.95 56.14 2jtn s SER 2 Cb 0.00 0.52 0.18 0.00 -1.71 0.00 0.00 66.02 65.01 2jtn s SER 2 CO 0.00 -0.93 1.16 0.00 1.20 0.00 0.00 173.24 174.66 2jtn s GLN 3 N -3.82 0.13 0.07 5.44 -2.07 -1.26 -5.18 119.66 112.96 2jtn s GLN 3 Ca 0.05 0.28 0.05 0.00 -1.82 0.00 0.00 55.36 53.91 2jtn s GLN 3 Cb 0.01 0.16 -0.03 0.00 -1.09 0.00 0.00 33.01 32.06 2jtn s GLN 3 CO -0.09 -0.08 -0.13 0.14 -1.32 0.00 0.00 175.29 173.81 2jtn s VAL 4 N 2.53 1.00 0.00 3.63 -7.23 -1.26 -5.16 120.40 113.91 2jtn s VAL 4 Ca -0.02 -1.29 0.00 0.00 -1.81 0.00 0.00 61.98 58.86 2jtn s VAL 4 Cb -0.06 -1.00 0.00 0.00 0.56 0.00 0.00 36.38 35.88 2jtn s VAL 4 CO -0.13 -0.27 0.00 -0.81 -0.31 0.00 0.00 175.10 173.57 2jtn n PRO 5 N 1.27 -0.59 -3.98 4.82 -0.04 -1.26 -5.05 135.00 130.17 2jtn n PRO 5 Ca -0.21 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 62.94 2jtn n PRO 5 Cb 0.54 0.00 -0.16 0.00 -0.04 0.00 0.00 33.50 33.85 2jtn n PRO 5 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2jtn s ASP 6 N -1.51 3.64 0.19 3.54 1.01 -1.26 -5.12 116.67 117.17 2jtn s ASP 6 Ca 0.00 -1.03 0.08 0.00 0.71 0.00 0.00 52.55 52.31 2jtn s ASP 6 Cb 0.00 -1.23 -0.05 0.00 1.01 0.00 0.00 42.92 42.65 2jtn s ASP 6 CO 0.00 -0.18 -0.16 0.54 0.21 0.00 0.00 175.17 175.58 2jtn s VAL 7 N 1.37 1.77 0.26 -1.27 0.11 -1.26 -4.88 120.40 116.50 2jtn s VAL 7 Ca -0.04 -2.13 0.06 0.00 -2.93 0.00 0.00 61.98 56.95 2jtn s VAL 7 Cb -0.17 -1.98 -0.02 0.00 -1.53 0.00 0.00 36.38 32.67 2jtn s VAL 7 CO -0.07 -0.51 0.21 0.23 -3.33 0.00 0.00 175.10 171.63 2jtn n MET 8 N -0.19 0.33 -3.68 1.54 0.00 -1.07 -5.07 117.12 108.98 2jtn n MET 8 Ca -0.09 -2.54 -0.12 0.00 0.00 0.00 0.00 57.70 54.95 2jtn n MET 8 Cb 0.59 2.05 -0.09 0.00 0.00 0.00 0.00 33.22 35.77 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 -3.01 -0.01 0.54 2.03 0.11 -1.26 -2.29 120.40 116.51 2jtn s VAL 9 Ca 0.30 0.02 -0.22 0.00 -2.93 0.00 0.00 61.98 59.15 2jtn s VAL 9 Cb 0.01 -0.76 -0.05 0.00 -1.53 0.00 0.00 36.38 34.05 2jtn s VAL 9 CO 0.21 0.01 1.31 0.52 -3.33 0.00 0.00 175.10 173.82 2jtn n VAL 10 N 3.43 3.68 -2.32 2.04 0.31 0.31 -4.80 118.33 120.98 2jtn n VAL 10 Ca -0.17 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.66 2jtn n VAL 10 Cb 0.56 -1.60 0.00 0.00 -0.91 0.00 0.00 33.84 31.90 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 0.82 5.85 3.77 2.92 0.00 -1.26 0.58 105.19 117.87 2jtn n GLY 11 Ca 0.10 -1.78 -0.40 0.00 0.00 0.00 0.00 46.02 43.94 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 1.68 4.20 -0.03 1.61 2.02 -1.26 -3.43 118.70 123.49 2jtn s GLU 12 Ca 0.00 2.10 -0.27 0.00 0.02 0.00 0.00 54.97 56.82 2jtn s GLU 12 Cb 0.00 -2.91 -0.03 0.00 0.10 0.00 0.00 34.13 31.28 2jtn s GLU 12 CO 0.00 -0.28 0.85 -1.25 0.02 0.00 0.00 175.26 174.60 2jtn s PRO 13 N -1.99 4.50 0.05 0.39 0.05 -1.26 -4.62 135.00 132.12 2jtn s PRO 13 Ca 0.52 1.17 -0.22 0.00 0.05 0.00 0.00 61.00 62.52 2jtn s PRO 13 Cb -0.37 -3.46 0.05 0.00 0.05 0.00 0.00 34.50 30.78 2jtn s PRO 13 CO 0.48 -0.00 0.52 -0.08 0.05 0.00 0.00 177.00 177.97 2jtn s THR 14 N 0.93 0.03 0.29 1.26 -1.32 0.52 -4.31 115.64 113.04 2jtn s THR 14 Ca 0.45 -0.25 0.03 0.00 -1.21 0.00 0.00 61.69 60.71 2jtn s THR 14 Cb -0.19 -0.98 -0.04 0.00 -1.51 0.00 0.00 72.50 69.77 2jtn s THR 14 CO 0.23 -0.14 0.15 -0.76 -2.21 0.00 0.00 174.62 171.90 2jtn s LEU 15 N -2.04 1.61 0.19 9.08 1.43 -1.24 -4.17 118.68 123.54 2jtn s LEU 15 Ca -0.05 -1.52 -0.16 0.00 -1.03 0.00 0.00 54.13 51.38 2jtn s LEU 15 Cb -0.01 0.21 0.17 0.00 0.03 0.00 0.00 46.19 46.60 2jtn s LEU 15 CO -0.03 -0.86 1.63 0.24 0.23 0.00 0.00 176.35 177.56 2jtn h MET 16 N 2.29 -0.04 -4.82 1.70 2.86 -1.89 -3.48 114.93 111.55 2jtn h MET 16 Ca -0.34 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.30 2jtn h MET 16 Cb 1.25 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.92 2jtn h MET 16 CO 0.53 -0.03 -0.78 0.41 1.06 0.00 0.00 176.91 178.11 2jtn n GLY 17 N -1.40 -3.65 0.06 8.32 0.00 0.39 -4.97 105.19 103.94 2jtn n GLY 17 Ca 0.05 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.54 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 0.45 0.05 2.46 -0.02 0.00 -1.19 -4.91 105.19 102.03 2jtn n GLY 18 Ca 0.02 -0.04 -0.19 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.92 -1.54 -0.36 1.61 0.00 -1.26 -4.70 120.64 113.47 2jtn n GLU 19 Ca 0.00 1.07 0.05 0.00 0.00 0.00 0.00 57.16 58.28 2jtn n GLU 19 Cb 0.00 -5.53 -0.01 0.00 0.00 0.00 0.00 31.44 25.90 2jtn n GLU 19 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 2jtn n PHE 20 N -2.81 -2.31 -3.82 4.31 7.35 -1.26 -4.90 117.46 114.03 2jtn n PHE 20 Ca -0.21 0.45 -0.13 0.00 -0.76 0.00 0.00 57.45 56.81 2jtn n PHE 20 Cb 0.65 -0.66 -0.14 0.00 0.35 0.00 0.00 39.48 39.68 2jtn n PHE 20 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 2jtn s GLY 21 N -5.43 -0.03 0.21 7.13 0.00 -1.26 -5.03 107.32 102.90 2jtn s GLY 21 Ca 0.00 0.32 0.06 0.00 0.00 0.00 0.00 44.72 45.11 2jtn s GLY 21 CO 0.00 0.42 1.47 -0.55 0.00 0.00 0.00 173.10 174.44 2jtn h ASP 22 N 6.43 0.12 0.86 1.64 3.32 -1.92 -3.13 116.42 123.72 2jtn h ASP 22 Ca -0.31 -0.09 -0.12 0.00 0.02 0.00 0.00 57.03 56.54 2jtn h ASP 22 Cb 1.18 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.68 2jtn h ASP 22 CO 0.46 0.84 -0.56 -0.08 -1.72 0.00 0.00 179.24 178.17 2jtn h GLU 23 N 0.06 0.00 -0.44 3.56 4.81 -1.97 -3.11 114.58 117.48 2jtn h GLU 23 Ca -0.02 0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.32 2jtn h GLU 23 Cb 1.35 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.71 2jtn h GLU 23 CO 0.11 0.56 0.31 0.22 -0.73 0.00 0.00 179.01 179.48 2jtn h ASP 24 N 0.00 0.12 -1.05 1.04 1.82 -1.96 -3.43 116.42 112.96 2jtn h ASP 24 Ca -0.01 0.00 -0.58 0.00 -0.39 0.00 0.00 57.03 56.05 2jtn h ASP 24 Cb 1.14 -0.02 -0.08 0.00 0.68 0.00 0.00 39.33 41.05 2jtn h ASP 24 CO 0.07 0.07 -0.43 -1.61 -1.61 0.00 0.00 179.24 175.74 2jtn s GLU 25 N -5.15 2.25 -0.14 0.28 0.41 -1.18 -5.09 118.70 110.09 2jtn s GLU 25 Ca -0.06 -1.97 -0.29 0.00 -0.41 0.00 0.00 54.97 52.24 2jtn s GLU 25 Cb 0.19 -1.98 -0.02 0.00 -1.78 0.00 0.00 34.13 30.55 2jtn s GLU 25 CO 0.72 -0.33 1.21 -0.98 -0.49 0.00 0.00 175.26 175.40 2jtn s ARG 26 N -4.04 4.27 0.31 1.61 1.70 -1.26 -4.96 118.95 116.58 2jtn s ARG 26 Ca 0.34 1.62 0.07 0.00 -0.47 0.00 0.00 55.73 57.29 2jtn s ARG 26 Cb 0.01 -3.69 -0.03 0.00 -0.57 0.00 0.00 34.95 30.68 2jtn s ARG 26 CO 0.19 -0.62 0.29 -1.17 -1.08 0.00 0.00 175.30 172.92 2jtn s LEU 27 N 3.07 3.72 0.52 -1.89 2.96 -1.26 -4.26 118.68 121.54 2jtn s LEU 27 Ca 0.54 -0.38 -0.22 0.00 -0.22 0.00 0.00 54.13 53.85 2jtn s LEU 27 Cb -0.22 -2.33 -0.06 0.00 0.50 0.00 0.00 46.19 44.08 2jtn s LEU 27 CO 0.16 -0.28 1.31 0.27 -1.32 0.00 0.00 176.35 176.49 2jtn s ILE 28 N -2.24 2.35 -0.34 6.68 -4.36 -1.26 -4.72 121.20 117.31 2jtn s ILE 28 Ca 0.39 0.26 -0.03 0.00 -0.26 0.00 0.00 60.65 61.01 2jtn s ILE 28 Cb -0.07 -3.13 0.07 0.00 1.25 0.00 0.00 42.46 40.58 2jtn s ILE 28 CO 0.27 -0.00 0.08 -0.89 0.24 0.00 0.00 174.94 174.63 2jtn s THR 29 N -1.36 3.20 -0.66 8.37 2.01 0.17 -4.88 115.64 122.49 2jtn s THR 29 Ca 0.69 -1.56 -0.27 0.00 0.31 0.00 0.00 61.69 60.86 2jtn s THR 29 Cb -0.37 -2.95 0.02 0.00 0.01 0.00 0.00 72.50 69.20 2jtn s THR 29 CO 0.44 -0.30 1.42 -0.60 -0.69 0.00 0.00 174.62 174.89 2jtn s ARG 30 N 1.24 3.13 0.05 4.92 6.06 -1.26 -1.51 118.95 131.58 2jtn s ARG 30 Ca -0.00 0.14 -0.10 0.00 -2.50 0.00 0.00 55.73 53.27 2jtn s ARG 30 Cb -0.21 -4.19 0.00 0.00 0.06 0.00 0.00 34.95 30.61 2jtn s ARG 30 CO -0.01 -2.17 0.20 -0.48 -2.50 0.00 0.00 175.30 170.33 2jtn s LEU 31 N 6.41 1.33 0.50 -0.88 0.05 -0.55 -4.98 118.68 120.56 2jtn s LEU 31 Ca 0.46 -0.41 -0.18 0.00 0.05 0.00 0.00 54.13 54.05 2jtn s LEU 31 Cb -0.10 1.01 -0.08 0.00 -2.05 0.00 0.00 46.19 44.97 2jtn s LEU 31 CO 0.19 -0.60 1.00 -0.70 -0.55 0.00 0.00 176.35 175.70 2jtn s GLU 32 N -2.84 3.86 -0.14 1.48 2.12 -1.26 0.03 118.70 121.95 2jtn s GLU 32 Ca -0.03 1.14 0.19 0.00 0.36 0.00 0.00 54.97 56.63 2jtn s GLU 32 Cb 0.00 -2.12 -0.26 0.00 0.26 0.00 0.00 34.13 32.01 2jtn s GLU 32 CO -0.05 -0.35 0.22 0.09 -0.54 0.00 0.00 175.26 174.62 2jtn n ASN 33 N -1.29 0.07 -2.81 -1.70 4.13 0.28 -4.82 115.26 109.11 2jtn n ASN 33 Ca 0.08 0.03 -0.19 0.00 1.68 0.00 0.00 54.58 56.17 2jtn n ASN 33 Cb 0.53 1.16 0.05 0.00 -1.54 0.00 0.00 39.78 39.98 2jtn n ASN 33 CO 0.00 0.00 0.00 0.41 0.28 0.00 0.00 177.26 177.95 2jtn n THR 34 N -2.65 -2.09 -3.51 3.41 -1.04 -1.26 -4.96 114.28 102.18 2jtn n THR 34 Ca -0.25 0.00 -0.27 0.00 -2.04 0.00 0.00 64.05 61.49 2jtn n THR 34 Cb 1.01 -3.34 -0.09 0.00 -1.82 0.00 0.00 70.33 66.09 2jtn n THR 34 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jtn n GLN 35 N -3.87 1.91 -0.06 -2.82 6.02 -1.26 -4.91 117.38 112.38 2jtn n GLN 35 Ca -0.04 -4.30 -0.14 0.00 -0.01 0.00 0.00 57.00 52.50 2jtn n GLN 35 Cb 0.58 -2.07 -0.06 0.00 1.02 0.00 0.00 30.24 29.70 2jtn n GLN 35 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 2jtn h PHE 36 N 4.57 0.63 -2.87 1.08 3.04 -1.84 -3.34 116.94 118.21 2jtn h PHE 36 Ca 0.17 -0.21 -0.67 0.00 3.98 0.00 0.00 57.97 61.25 2jtn h PHE 36 Cb 0.73 -0.13 -0.09 0.00 2.56 0.00 0.00 35.95 39.03 2jtn h PHE 36 CO 0.63 0.91 -0.52 -0.51 -2.02 0.00 0.00 178.31 176.79 2jtn s ASP 37 N -6.39 6.05 0.00 0.41 1.11 -1.26 -4.72 116.67 111.87 2jtn s ASP 37 Ca -0.13 0.35 0.00 0.00 0.18 0.00 0.00 52.55 52.94 2jtn s ASP 37 Cb 0.06 -1.88 0.00 0.00 1.07 0.00 0.00 42.92 42.18 2jtn s ASP 37 CO 0.79 0.37 0.00 0.00 1.18 0.00 0.00 175.17 177.52 2jtn n ALA 38 N 1.81 0.00 -3.15 5.23 0.00 -1.26 -5.04 120.51 118.09 2jtn n ALA 38 Ca -0.18 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.31 2jtn n ALA 38 Cb 0.54 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.98 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 -1.08 -2.88 -1.54 0.00 0.00 -1.26 -4.94 121.76 110.07 2jtn s ALA 39 Ca 0.00 1.52 -0.05 0.00 0.00 0.00 0.00 51.96 53.43 2jtn s ALA 39 Cb 0.00 -2.42 0.01 0.00 0.00 0.00 0.00 23.12 20.71 2jtn s ALA 39 CO 0.00 -1.55 0.62 -1.71 0.00 0.00 0.00 175.76 173.12 2jtn n ASN 40 N 5.40 -6.12 -0.06 0.00 4.05 -1.26 -4.89 115.26 112.38 2jtn n ASN 40 Ca -0.01 -0.29 -0.08 0.00 0.45 0.00 0.00 54.58 54.66 2jtn n ASN 40 Cb 0.53 -4.92 -0.15 0.00 1.23 0.00 0.00 39.78 36.47 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 -1.54 -1.01 0.00 8.20 0.00 -1.26 -4.71 105.19 104.87 2jtn n GLY 41 Ca -0.11 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.66 2jtn n GLY 41 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2jtn n ILE 42 N -2.81 0.00 -1.13 -0.61 -0.00 -1.26 -4.95 119.36 108.60 2jtn n ILE 42 Ca -0.25 0.38 -0.22 0.00 -0.00 0.00 0.00 62.75 62.67 2jtn n ILE 42 Cb 1.07 -1.20 0.17 0.00 -0.00 0.00 0.00 39.64 39.69 2jtn n ILE 42 CO 0.00 0.00 0.00 0.47 -0.00 0.00 0.00 176.55 177.02 2jtn n ASP 43 N -1.78 -1.24 -3.88 4.38 9.92 -1.26 -5.08 116.55 117.61 2jtn n ASP 43 Ca 0.00 -1.09 -0.23 0.00 -0.53 0.00 0.00 54.79 52.94 2jtn n ASP 43 Cb 0.00 -0.73 -0.17 0.00 -0.64 0.00 0.00 41.12 39.58 2jtn n ASP 43 CO 0.00 0.00 0.00 1.51 0.13 0.00 0.00 177.20 178.84 2jtn s ASP 44 N -3.92 1.48 0.99 -2.24 -4.77 -1.26 -4.90 116.67 102.05 2jtn s ASP 44 Ca 0.53 -0.18 -0.11 0.00 -3.30 0.00 0.00 52.55 49.49 2jtn s ASP 44 Cb -0.04 -0.58 0.19 0.00 -1.09 0.00 0.00 42.92 41.39 2jtn s ASP 44 CO 0.39 -0.09 1.11 -0.70 0.70 0.00 0.00 175.17 176.59 2jtn s GLU 45 N 1.30 0.43 -0.40 2.11 2.12 -1.26 -5.00 118.70 118.01 2jtn s GLU 45 Ca -0.04 1.37 0.11 0.00 0.36 0.00 0.00 54.97 56.76 2jtn s GLU 45 Cb -0.14 -1.67 0.36 0.00 0.26 0.00 0.00 34.13 32.94 2jtn s GLU 45 CO -0.02 -2.97 0.78 0.41 -0.54 0.00 0.00 175.26 172.92 2jtn n GLY 46 N 0.42 3.77 3.56 -1.50 0.00 -1.26 -5.09 105.19 105.10 2jtn n GLY 46 Ca 0.09 -1.83 -0.16 0.00 0.00 0.00 0.00 46.02 44.12 2jtn n GLY 46 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jtn s GLY 47 N -2.65 -0.52 0.00 -0.02 0.00 -1.26 -5.07 107.32 97.81 2jtn s GLY 47 Ca 0.40 1.65 0.00 0.00 0.00 0.00 0.00 44.72 46.78 2jtn s GLY 47 CO -0.08 1.22 0.00 1.44 0.00 0.00 0.00 173.10 175.68 2jtn n SER 48 N 1.44 0.59 0.00 1.64 7.64 -1.26 -5.02 113.62 118.65 2jtn n SER 48 Ca -0.16 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.72 2jtn n SER 48 Cb 0.56 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.76 2jtn n SER 48 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jtn n GLY 49 N 2.19 -1.98 0.00 0.23 0.00 -1.26 -4.91 105.19 99.47 2jtn n GLY 49 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2jtn n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jtn n GLY 50 N 0.17 -2.35 3.01 -0.02 0.00 -1.26 -5.07 105.19 99.67 2jtn n GLY 50 Ca 0.00 -1.39 -0.04 0.00 0.00 0.00 0.00 46.02 44.60 2jtn n GLY 50 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2jtn s HIS 51 N -0.22 -1.36 -0.11 1.61 2.46 -1.26 -5.01 115.29 111.40 2jtn s HIS 51 Ca 0.00 0.68 -0.04 0.00 0.47 0.00 0.00 55.06 56.17 2jtn s HIS 51 Cb 0.00 0.06 0.05 0.00 -0.13 0.00 0.00 32.58 32.56 2jtn s HIS 51 CO 0.00 -1.02 0.18 -1.64 -2.47 0.00 0.00 174.74 169.80 2jtn s MET 52 N 2.66 0.07 0.00 2.88 -1.94 -1.26 -5.05 119.30 116.67 2jtn s MET 52 Ca 0.10 0.54 0.00 0.00 -1.71 0.00 0.00 55.69 54.62 2jtn s MET 52 Cb -0.12 -0.37 0.00 0.00 2.01 0.00 0.00 34.83 36.36 2jtn s MET 52 CO -0.28 -0.35 0.00 0.41 -0.01 0.00 0.00 175.02 174.79 2jtn n GLY 53 N 5.33 -1.34 1.44 -0.03 0.00 -1.26 -5.13 105.19 104.19 2jtn n GLY 53 Ca -0.05 0.59 0.19 0.00 0.00 0.00 0.00 46.02 46.75 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 -8.62 0.00 1.61 7.64 -1.26 -4.99 113.62 108.00 2jtn n SER 54 Ca 0.00 0.94 0.00 0.00 1.01 0.00 0.00 58.87 60.82 2jtn n SER 54 Cb 0.00 -4.59 0.00 0.00 -1.01 0.00 0.00 64.21 58.61 2jtn n SER 54 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jtn n GLY 55 N -4.29 2.93 0.00 0.23 0.00 -1.26 -5.15 105.19 97.66 2jtn n GLY 55 Ca -0.03 -2.00 0.00 0.00 0.00 0.00 0.00 46.02 43.99 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 5.00 0.73 3.05 -0.02 0.00 -1.26 -5.05 105.19 107.63 2jtn n GLY 56 Ca 0.00 -1.87 -0.34 0.00 0.00 0.00 0.00 46.02 43.81 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 1.03 3.51 1.05 2.61 2.01 -1.26 -5.10 115.64 119.50 2jtn s THR 57 Ca 0.00 -3.34 -0.16 0.00 0.31 0.00 0.00 61.69 58.50 2jtn s THR 57 Cb 0.00 -3.29 0.08 0.00 0.01 0.00 0.00 72.50 69.30 2jtn s THR 57 CO 0.00 -0.91 0.21 -2.65 -0.69 0.00 0.00 174.62 170.57 2jtn n PRO 58 N 3.04 -1.07 -2.54 4.92 -0.02 -1.26 -3.24 135.00 134.83 2jtn n PRO 58 Ca 0.11 -0.28 -0.21 0.00 -2.02 0.00 0.00 63.50 61.09 2jtn n PRO 58 Cb 0.36 -1.78 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 2jtn n PRO 58 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2jtn n GLU 59 N -2.00 -2.42 -4.26 -0.52 4.07 -1.26 -4.98 120.64 109.26 2jtn n GLU 59 Ca 0.03 0.98 -0.35 0.00 -0.06 0.00 0.00 57.16 57.77 2jtn n GLU 59 Cb 0.58 -5.70 -0.10 0.00 -0.06 0.00 0.00 31.44 26.17 2jtn n GLU 59 CO 0.00 0.00 0.00 -1.50 -0.06 0.00 0.00 177.13 175.57 2jtn s ILE 60 N -3.07 4.39 0.14 6.31 1.10 -1.20 -5.07 121.20 123.80 2jtn s ILE 60 Ca 0.07 -0.20 -0.31 0.00 -0.51 0.00 0.00 60.65 59.70 2jtn s ILE 60 Cb -0.03 -2.90 -0.11 0.00 0.15 0.00 0.00 42.46 39.57 2jtn s ILE 60 CO 0.09 0.54 1.83 -2.16 -2.11 0.00 0.00 174.94 173.12 2jtn s PRO 61 N -0.26 4.13 -0.14 3.50 0.04 -1.26 -4.88 135.00 136.12 2jtn s PRO 61 Ca 0.06 2.62 -0.09 0.00 0.04 0.00 0.00 61.00 63.63 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 0.02 -0.84 0.17 -1.64 0.04 0.00 0.00 177.00 174.75 2jtn s MET 62 N 2.53 3.78 0.57 4.56 -1.94 -1.26 -3.49 119.30 124.05 2jtn s MET 62 Ca 0.81 -0.10 -0.20 0.00 -1.71 0.00 0.00 55.69 54.48 2jtn s MET 62 Cb -0.47 -3.29 -0.05 0.00 2.01 0.00 0.00 34.83 33.04 2jtn s MET 62 CO 0.36 0.57 1.22 0.00 -0.01 0.00 0.00 175.02 177.16 2jtn s ALA 64 N -1.36 3.16 0.00 0.00 0.00 -0.96 -0.80 121.76 121.80 2jtn s ALA 64 Ca 0.74 0.92 0.00 0.00 0.00 0.00 0.00 51.96 53.62 2jtn s ALA 64 Cb -0.42 -3.94 0.00 0.00 0.00 0.00 0.00 23.12 18.75 2jtn s ALA 64 CO 0.48 -2.17 0.00 0.41 0.00 0.00 0.00 175.76 174.48 2jtn n GLY 65 N 5.08 3.32 3.51 0.00 0.00 -1.26 -4.37 105.19 111.47 2jtn n GLY 65 Ca 0.24 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.03 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 -3.24 0.77 0.00 0.00 2.03 -1.26 -4.69 116.55 110.16 2jtn n ASP 67 Ca 0.15 -2.47 0.00 0.00 0.52 0.00 0.00 54.79 52.99 2jtn n ASP 67 Cb 0.53 -0.20 0.00 0.00 -0.72 0.00 0.00 41.12 40.73 2jtn n ASP 67 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2jtn n GLN 68 N -0.38 0.00 -3.20 -0.67 6.02 -1.26 -5.08 117.38 112.81 2jtn n GLN 68 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.04 2jtn n GLN 68 Cb 0.82 0.00 0.00 0.00 1.02 0.00 0.00 30.24 32.08 2jtn n GLN 68 CO 0.00 0.00 0.00 -2.39 -1.01 0.00 0.00 177.06 173.66 2jtn n HIS 69 N -0.67 0.00 -4.28 1.08 1.44 -1.26 -4.43 115.22 107.11 2jtn n HIS 69 Ca 0.00 0.00 -0.21 0.00 -2.01 0.00 0.00 57.72 55.50 2jtn n HIS 69 Cb 0.00 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.00 2jtn n HIS 69 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 2jtn s ILE 70 N -2.25 1.58 -0.06 0.61 -1.09 -1.23 -4.47 121.20 114.30 2jtn s ILE 70 Ca 0.00 -1.74 0.02 0.00 -2.23 0.00 0.00 60.65 56.71 2jtn s ILE 70 Cb 0.00 -1.63 0.08 0.00 -1.58 0.00 0.00 42.46 39.33 2jtn s ILE 70 CO 0.00 -0.30 0.63 0.00 -1.23 0.00 0.00 174.94 174.05 2jtn n LEU 71 N 0.58 -0.45 0.00 2.97 -0.00 -1.26 -4.99 117.00 113.85 2jtn n LEU 71 Ca -0.16 -1.29 -0.19 0.00 -0.00 0.00 0.00 56.01 54.37 2jtn n LEU 71 Cb 0.56 0.36 0.06 0.00 -0.00 0.00 0.00 43.42 44.40 2jtn n LEU 71 CO 0.27 1.07 0.35 0.47 -0.00 0.00 0.00 177.39 179.55 2jtn n ASP 72 N -0.30 2.10 0.00 1.45 8.00 -1.25 -4.45 116.55 122.10 2jtn n ASP 72 Ca -0.08 -2.53 0.00 0.00 0.71 0.00 0.00 54.79 52.89 2jtn n ASP 72 Cb 0.53 -0.41 0.00 0.00 -0.02 0.00 0.00 41.12 41.22 2jtn n ASP 72 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2jtn n ARG 73 N -2.23 0.00 -2.62 -1.24 3.00 -1.26 -4.09 116.66 108.21 2jtn n ARG 73 Ca 0.16 0.02 -0.41 0.00 -0.01 0.00 0.00 57.85 57.60 2jtn n ARG 73 Cb 0.59 -0.48 -0.04 0.00 0.00 0.00 0.00 32.46 32.54 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 -0.04 3.65 0.06 -1.55 0.40 -1.26 0.10 117.98 119.33 2jtn s PHE 74 Ca 0.00 1.64 0.02 0.00 -0.60 0.00 0.00 56.93 57.99 2jtn s PHE 74 Cb 0.00 -3.19 -0.03 0.00 0.51 0.00 0.00 43.02 40.31 2jtn s PHE 74 CO 0.00 -0.31 -0.07 0.42 0.70 0.00 0.00 175.22 175.96 2jtn s ILE 75 N 0.42 0.57 -0.39 0.64 -1.09 0.10 -4.89 121.20 116.57 2jtn s ILE 75 Ca 0.51 -1.29 -0.09 0.00 -2.23 0.00 0.00 60.65 57.55 2jtn s ILE 75 Cb -0.25 -0.87 0.06 0.00 -1.58 0.00 0.00 42.46 39.82 2jtn s ILE 75 CO 0.30 -0.51 0.21 -0.76 -1.23 0.00 0.00 174.94 172.96 2jtn s LEU 76 N -1.94 4.89 -0.24 2.97 1.02 -1.25 -1.48 118.68 122.64 2jtn s LEU 76 Ca -0.05 -1.34 -0.19 0.00 0.02 0.00 0.00 54.13 52.58 2jtn s LEU 76 Cb -0.06 -1.97 -0.02 0.00 0.02 0.00 0.00 46.19 44.16 2jtn s LEU 76 CO -0.01 -0.46 0.57 -0.75 0.02 0.00 0.00 176.35 175.72 2jtn s LYS 77 N 1.44 4.11 0.04 1.70 2.20 -0.57 0.65 119.74 129.32 2jtn s LYS 77 Ca 0.02 0.46 -0.19 0.00 -0.36 0.00 0.00 55.97 55.90 2jtn s LYS 77 Cb -0.21 -3.63 0.04 0.00 -1.51 0.00 0.00 37.83 32.51 2jtn s LYS 77 CO 0.03 -0.34 0.44 0.00 -0.36 0.00 0.00 175.35 175.11 2jtn s ALA 78 N 2.27 -1.08 -1.46 3.13 0.00 0.28 0.43 121.76 125.33 2jtn s ALA 78 Ca 0.24 0.37 -0.10 0.00 0.00 0.00 0.00 51.96 52.47 2jtn s ALA 78 Cb -0.16 0.36 0.05 0.00 0.00 0.00 0.00 23.12 23.38 2jtn s ALA 78 CO 0.09 -0.47 0.80 1.28 0.00 0.00 0.00 175.76 177.46 2jtn n LEU 79 N 0.48 -2.44 -3.33 0.00 4.77 -1.26 -1.30 117.00 113.93 2jtn n LEU 79 Ca -0.18 -0.53 -0.22 0.00 -0.03 0.00 0.00 56.01 55.05 2jtn n LEU 79 Cb 0.60 -2.61 0.07 0.00 -2.33 0.00 0.00 43.42 39.15 2jtn n LEU 79 CO 0.20 0.36 0.22 0.47 -1.33 0.00 0.00 177.39 177.31 2jtn n ASP 80 N -2.65 -5.76 -3.61 -1.43 9.92 -1.26 -4.97 116.55 106.79 2jtn n ASP 80 Ca -0.01 -0.50 -0.04 0.00 -0.53 0.00 0.00 54.79 53.71 2jtn n ASP 80 Cb 0.56 -4.65 -0.02 0.00 -0.64 0.00 0.00 41.12 36.36 2jtn n ASP 80 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 2jtn s ARG 81 N -6.14 0.21 -0.29 -1.24 3.52 -0.42 -5.13 118.95 109.46 2jtn s ARG 81 Ca 0.50 -0.07 -0.25 0.00 -0.13 0.00 0.00 55.73 55.79 2jtn s ARG 81 Cb -0.22 0.10 0.00 0.00 -1.56 0.00 0.00 34.95 33.27 2jtn s ARG 81 CO 0.67 -0.09 0.84 -3.38 -0.81 0.00 0.00 175.30 172.53 2jtn s HIS 82 N -2.19 3.23 -0.22 5.12 -3.43 -1.26 0.10 115.29 116.64 2jtn s HIS 82 Ca 0.10 0.97 -0.06 0.00 -0.80 0.00 0.00 55.06 55.26 2jtn s HIS 82 Cb -0.01 -3.23 -0.03 0.00 -1.43 0.00 0.00 32.58 27.88 2jtn s HIS 82 CO -0.04 -0.54 0.04 -1.58 -2.00 0.00 0.00 174.74 170.62 2jtn s TRP 83 N 3.02 3.08 0.68 0.38 0.52 0.21 -2.25 118.94 124.57 2jtn s TRP 83 Ca 0.35 -0.39 -0.17 0.00 0.02 0.00 0.00 56.10 55.91 2jtn s TRP 83 Cb -0.14 -2.16 -0.01 0.00 -1.15 0.00 0.00 33.47 30.01 2jtn s TRP 83 CO 0.11 -0.26 0.97 0.72 0.02 0.00 0.00 176.95 178.51 2jtn n HIS 84 N 4.50 0.73 -0.13 -1.98 8.25 -1.26 -3.94 115.22 121.39 2jtn n HIS 84 Ca -0.17 0.41 0.04 0.00 -0.26 0.00 0.00 57.72 57.74 2jtn n HIS 84 Cb 0.52 -2.10 0.35 0.00 1.12 0.00 0.00 29.99 29.87 2jtn n HIS 84 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2jtn h SER 85 N 0.03 0.66 0.01 0.41 4.64 -1.93 0.24 113.55 117.61 2jtn h SER 85 Ca -0.48 -0.01 -0.27 0.00 -0.47 0.00 0.00 61.79 60.56 2jtn h SER 85 Cb 1.35 -0.15 -0.04 0.00 -0.31 0.00 0.00 62.40 63.24 2jtn h SER 85 CO 0.48 0.46 -1.50 0.29 -0.87 0.00 0.00 176.83 175.70 2jtn n LYS 86 N -4.46 0.59 0.22 4.77 5.02 -1.26 -4.19 118.16 118.85 2jtn n LYS 86 Ca 0.08 0.51 0.14 0.00 -2.02 0.00 0.00 58.31 57.01 2jtn n LYS 86 Cb 0.12 -1.71 0.75 0.00 -0.02 0.00 0.00 35.03 34.17 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 -8.38 3.24 0.10 0.00 2.96 0.84 -4.86 118.68 112.58 2jtn s LEU 88 Ca -0.05 -0.98 0.02 0.00 -0.22 0.00 0.00 54.13 52.90 2jtn s LEU 88 Cb 0.17 -2.57 -0.04 0.00 0.50 0.00 0.00 46.19 44.25 2jtn s LEU 88 CO 0.62 -2.48 -0.07 -0.54 -1.32 0.00 0.00 176.35 172.56 2jtn s LYS 89 N 6.46 0.86 0.56 1.98 -0.14 -1.26 -2.51 119.74 125.69 2jtn s LYS 89 Ca 0.64 -1.32 -0.21 0.00 -1.36 0.00 0.00 55.97 53.73 2jtn s LYS 89 Cb -0.04 -0.30 -0.04 0.00 -1.68 0.00 0.00 37.83 35.77 2jtn s LYS 89 CO -0.01 0.01 1.34 0.00 -0.76 0.00 0.00 175.35 175.93 2jtn h SER 91 N 1.31 1.11 0.00 0.00 0.02 -1.43 -1.45 113.55 113.10 2jtn h SER 91 Ca -0.51 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.30 2jtn h SER 91 Cb 1.31 -0.29 0.00 0.00 0.14 0.00 0.00 62.40 63.56 2jtn h SER 91 CO 0.57 0.95 -0.68 -0.67 -1.14 0.00 0.00 176.83 175.85 2jtn n ASP 92 N -4.30 1.33 -0.06 3.07 2.03 -1.26 -4.56 116.55 112.80 2jtn n ASP 92 Ca 0.08 0.24 0.12 0.00 0.52 0.00 0.00 54.79 55.75 2jtn n ASP 92 Cb 0.15 -0.67 0.52 0.00 -0.72 0.00 0.00 41.12 40.41 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 -4.46 -0.81 -2.46 0.00 -0.00 -0.55 -4.89 115.22 102.04 2jtn n HIS 94 Ca 0.09 0.00 -0.28 0.00 0.46 0.00 0.00 57.72 58.00 2jtn n HIS 94 Cb 0.38 -2.88 0.01 0.00 -0.12 0.00 0.00 29.99 27.38 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 -2.47 4.49 -0.14 3.57 -7.23 -1.26 -4.67 120.40 112.70 2jtn s VAL 95 Ca 0.00 0.22 -0.35 0.00 -1.81 0.00 0.00 61.98 60.05 2jtn s VAL 95 Cb 0.00 -3.74 -0.12 0.00 0.56 0.00 0.00 36.38 33.09 2jtn s VAL 95 CO 0.00 -0.77 1.90 -2.65 -0.31 0.00 0.00 175.10 173.28 2jtn n PRO 96 N -2.43 1.98 -3.52 4.82 -0.02 -1.26 -3.44 135.00 131.13 2jtn n PRO 96 Ca 0.02 0.71 -0.27 0.00 -2.02 0.00 0.00 63.50 61.95 2jtn n PRO 96 Cb 0.56 -2.59 -0.09 0.00 -0.02 0.00 0.00 33.50 31.35 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 6.94 2.22 -0.99 2.45 4.32 -1.04 -4.88 117.00 126.01 2jtn n LEU 97 Ca 0.25 -5.07 -0.02 0.00 -0.02 0.00 0.00 56.01 51.15 2jtn n LEU 97 Cb 0.28 -0.26 0.19 0.00 -1.62 0.00 0.00 43.42 42.00 2jtn n LEU 97 CO 0.74 1.94 0.50 0.00 -1.22 0.00 0.00 177.39 179.35 2jtn n ALA 98 N 1.60 4.12 0.07 -1.18 0.00 -1.26 -4.65 120.51 119.20 2jtn n ALA 98 Ca 0.25 -3.29 0.00 0.00 0.00 0.00 0.00 53.44 50.40 2jtn n ALA 98 Cb 0.42 -0.54 0.00 0.00 0.00 0.00 0.00 19.45 19.34 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 -1.09 0.00 -4.49 0.00 1.02 -1.26 -5.11 120.64 109.71 2jtn n GLU 99 Ca 0.28 0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 57.20 2jtn n GLU 99 Cb 0.86 -0.06 -0.16 0.00 -0.02 0.00 0.00 31.44 32.06 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 -2.00 1.18 0.32 3.49 1.04 -1.26 -4.64 118.95 117.08 2jtn s ARG 100 Ca 0.00 -0.37 0.09 0.00 -1.04 0.00 0.00 55.73 54.41 2jtn s ARG 100 Cb 0.00 -1.07 -0.05 0.00 -2.04 0.00 0.00 34.95 31.79 2jtn s ARG 100 CO 0.00 0.13 0.08 0.00 -0.04 0.00 0.00 175.30 175.46 2jtn s PHE 102 N -2.43 -0.97 0.28 0.00 2.19 -1.26 -4.49 117.98 111.30 2jtn s PHE 102 Ca 0.35 1.70 -0.11 0.00 0.33 0.00 0.00 56.93 59.21 2jtn s PHE 102 Cb -0.03 0.58 0.00 0.00 -1.31 0.00 0.00 43.02 42.27 2jtn s PHE 102 CO 0.21 -0.48 0.51 -1.54 1.83 0.00 0.00 175.22 175.75 2jtn s SER 103 N 2.55 0.10 -0.29 6.13 1.04 -1.26 0.17 113.70 122.13 2jtn s SER 103 Ca -0.05 -1.05 -0.15 0.00 0.48 0.00 0.00 55.95 55.19 2jtn s SER 103 Cb -0.08 0.63 0.15 0.00 0.10 0.00 0.00 66.02 66.81 2jtn s SER 103 CO -0.18 -1.22 0.91 -0.60 0.98 0.00 0.00 173.24 173.12 2jtn s ARG 104 N -3.69 0.40 1.39 4.02 3.52 -0.16 -4.91 118.95 119.52 2jtn s ARG 104 Ca 0.23 0.86 0.00 0.00 -0.13 0.00 0.00 55.73 56.69 2jtn s ARG 104 Cb -0.01 0.37 0.00 0.00 -1.56 0.00 0.00 34.95 33.75 2jtn s ARG 104 CO 0.11 -0.11 0.00 0.41 -0.81 0.00 0.00 175.30 174.90 2jtn n GLY 105 N 4.59 2.28 2.18 8.12 0.00 -1.26 -3.31 105.19 117.79 2jtn n GLY 105 Ca -0.13 -0.05 -0.01 0.00 0.00 0.00 0.00 46.02 45.82 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 0.00 0.96 -3.66 1.61 1.02 -1.26 -5.11 120.64 114.20 2jtn n GLU 106 Ca 0.00 -1.97 -0.14 0.00 -0.02 0.00 0.00 57.16 55.03 2jtn n GLU 106 Cb 0.00 -0.22 -0.08 0.00 -0.02 0.00 0.00 31.44 31.12 2jtn n GLU 106 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2jtn s SER 107 N -2.03 -0.58 -0.26 1.62 0.01 -1.21 -5.15 113.70 106.11 2jtn s SER 107 Ca 0.17 1.01 -0.04 0.00 1.31 0.00 0.00 55.95 58.40 2jtn s SER 107 Cb 0.31 1.01 0.01 0.00 0.21 0.00 0.00 66.02 67.57 2jtn s SER 107 CO -0.08 -0.29 -0.02 0.54 0.41 0.00 0.00 173.24 173.80 2jtn s VAL 108 N -0.08 3.28 -0.10 3.43 0.11 -1.26 -0.98 120.40 124.80 2jtn s VAL 108 Ca -0.03 -0.83 -0.00 0.00 -2.93 0.00 0.00 61.98 58.19 2jtn s VAL 108 Cb -0.04 -2.64 0.02 0.00 -1.53 0.00 0.00 36.38 32.19 2jtn s VAL 108 CO 0.03 0.20 -0.07 -0.72 -3.33 0.00 0.00 175.10 171.21 2jtn s TYR 109 N 1.40 1.40 1.06 1.54 1.13 0.13 -0.93 117.35 123.08 2jtn s TYR 109 Ca 0.02 -0.66 -0.18 0.00 -1.41 0.00 0.00 57.07 54.84 2jtn s TYR 109 Cb -0.16 -1.17 0.09 0.00 -1.10 0.00 0.00 41.96 39.62 2jtn s TYR 109 CO -0.02 -0.47 -0.08 0.00 -2.51 0.00 0.00 175.55 172.46 2jtn h LYS 111 N -2.18 0.00 -0.16 0.00 1.57 -1.93 -2.60 116.57 111.27 2jtn h LYS 111 Ca -0.41 0.00 0.05 0.00 -1.87 0.00 0.00 60.65 58.42 2jtn h LYS 111 Cb 1.13 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.39 2jtn h LYS 111 CO 0.27 0.80 -0.22 0.22 -0.57 0.00 0.00 179.45 179.95 2jtn h ASP 112 N 0.00 -0.68 1.54 0.86 1.82 -1.98 -2.12 116.42 115.87 2jtn h ASP 112 Ca -0.01 0.12 -0.02 0.00 -0.39 0.00 0.00 57.03 56.73 2jtn h ASP 112 Cb 1.52 0.31 -0.00 0.00 0.68 0.00 0.00 39.33 41.84 2jtn h ASP 112 CO 0.10 -0.26 -0.47 -2.24 -1.61 0.00 0.00 179.24 174.76 2jtn h ASP 113 N -0.26 0.00 -0.25 2.28 3.04 -1.93 -3.30 116.42 116.00 2jtn h ASP 113 Ca 0.11 0.00 -0.02 0.00 -3.24 0.00 0.00 57.03 53.89 2jtn h ASP 113 Cb 0.42 0.00 -0.02 0.00 -1.04 0.00 0.00 39.33 38.70 2jtn h ASP 113 CO -0.31 0.07 0.12 0.15 -2.04 0.00 0.00 179.24 177.23 2jtn h PHE 114 N 0.00 0.41 -0.48 4.15 3.04 -0.99 -1.34 116.94 121.74 2jtn h PHE 114 Ca -0.01 -0.01 0.01 0.00 3.98 0.00 0.00 57.97 61.94 2jtn h PHE 114 Cb 1.06 -0.13 -0.03 0.00 2.56 0.00 0.00 35.95 39.41 2jtn h PHE 114 CO 0.00 0.33 0.31 0.74 -2.02 0.00 0.00 178.31 177.67 2jtn h PHE 115 N 0.42 0.59 0.00 0.41 0.04 -1.49 -1.84 116.94 115.06 2jtn h PHE 115 Ca 0.11 0.01 -0.11 0.00 2.80 0.00 0.00 57.97 60.78 2jtn h PHE 115 Cb 0.09 -0.20 -0.02 0.00 2.20 0.00 0.00 35.95 38.03 2jtn h PHE 115 CO 0.00 0.36 -0.52 0.87 -0.60 0.00 0.00 178.31 178.43 2jtn h LYS 116 N 0.63 0.00 0.40 1.51 1.57 -1.63 0.49 116.57 119.54 2jtn h LYS 116 Ca 0.18 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.94 2jtn h LYS 116 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.26 2jtn h LYS 116 CO -0.05 0.52 -0.19 0.00 -0.57 0.00 0.00 179.45 179.15 2jtn h ARG 117 N 0.00 -0.52 0.00 3.15 3.08 -0.64 -3.42 114.38 116.04 2jtn h ARG 117 Ca -0.01 0.04 -0.06 0.00 0.07 0.00 0.00 59.98 60.02 2jtn h ARG 117 Cb 1.13 0.12 -0.01 0.00 0.08 0.00 0.00 29.97 31.29 2jtn h ARG 117 CO 0.07 -0.24 -1.22 1.19 -1.07 0.00 0.00 179.97 178.69 2jtn n PHE 118 N -5.24 0.00 -0.49 3.04 3.01 -0.75 -5.06 117.46 111.97 2jtn n PHE 118 Ca -0.11 0.00 -0.29 0.00 1.01 0.00 0.00 57.45 58.06 2jtn n PHE 118 Cb 0.28 -0.15 0.24 0.00 -0.01 0.00 0.00 39.48 39.83 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 3.14 -2.54 3.71 1.37 0.00 0.17 -4.91 105.19 106.13 2jtn n GLY 119 Ca -0.07 -1.13 -0.37 0.00 0.00 0.00 0.00 46.02 44.44 2jtn n GLY 119 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2jtn n THR 120 N -4.96 4.52 -3.79 2.61 -1.04 -1.24 -4.49 114.28 105.89 2jtn n THR 120 Ca 0.03 -0.50 -0.10 0.00 -2.04 0.00 0.00 64.05 61.45 2jtn n THR 120 Cb 0.56 -1.46 -0.06 0.00 -1.82 0.00 0.00 70.33 67.56 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 -3.16 1.09 0.55 -2.82 2.20 -1.26 -4.38 119.74 111.96 2jtn s LYS 121 Ca 0.79 -0.91 -0.15 0.00 -0.36 0.00 0.00 55.97 55.34 2jtn s LYS 121 Cb -0.39 0.42 -0.06 0.00 -1.51 0.00 0.00 37.83 36.29 2jtn s LYS 121 CO 0.43 -0.41 1.01 0.00 -0.36 0.00 0.00 175.35 176.02 2jtn n ALA 123 N -1.93 2.33 -0.01 0.00 0.00 -1.25 -3.53 120.51 116.11 2jtn n ALA 123 Ca 0.07 -0.25 -0.04 0.00 0.00 0.00 0.00 53.44 53.21 2jtn n ALA 123 Cb 0.54 -0.31 -0.03 0.00 0.00 0.00 0.00 19.45 19.64 2jtn n ALA 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jtn h ALA 124 N 0.87 -0.10 0.00 0.00 0.00 -1.86 -3.38 119.26 114.79 2jtn h ALA 124 Ca -0.01 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2jtn h ALA 124 Cb 0.51 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2jtn h ALA 124 CO 0.00 -0.10 -1.10 0.00 0.00 0.00 0.00 179.25 178.05 2jtn n GLN 126 N -1.67 -5.09 -4.38 0.00 -0.06 -1.23 -5.00 117.38 99.93 2jtn n GLN 126 Ca 0.03 0.76 -0.32 0.00 -2.00 0.00 0.00 57.00 55.47 2jtn n GLN 126 Cb 0.38 -5.39 -0.10 0.00 -4.06 0.00 0.00 30.24 21.07 2jtn n GLN 126 CO 0.00 0.00 0.00 -1.17 -0.20 0.00 0.00 177.06 175.69 2jtn s LEU 127 N -6.01 3.33 -0.41 1.69 2.96 -1.26 -4.84 118.68 114.14 2jtn s LEU 127 Ca 0.34 -0.08 -0.27 0.00 -0.22 0.00 0.00 54.13 53.91 2jtn s LEU 127 Cb -0.15 -1.90 -0.05 0.00 0.50 0.00 0.00 46.19 44.59 2jtn s LEU 127 CO 0.42 0.29 2.20 -0.83 -1.32 0.00 0.00 176.35 177.11 2jtn s GLY 128 N -1.44 0.08 0.38 7.98 0.00 -1.26 -2.45 107.32 110.61 2jtn s GLY 128 Ca 0.18 0.18 -0.28 0.00 0.00 0.00 0.00 44.72 44.81 2jtn s GLY 128 CO 0.08 3.84 1.45 -0.42 0.00 0.00 0.00 173.10 178.05 2jtn s ILE 129 N 9.97 2.15 1.01 0.90 1.01 -1.26 -4.96 121.20 130.02 2jtn s ILE 129 Ca 0.92 0.15 -0.23 0.00 0.00 0.00 0.00 60.65 61.49 2jtn s ILE 129 Cb -0.22 -3.09 -0.08 0.00 0.01 0.00 0.00 42.46 39.08 2jtn s ILE 129 CO 0.29 0.03 -0.94 -2.65 0.00 0.00 0.00 174.94 171.67 2jtn n PRO 130 N 0.42 -0.59 -0.01 2.79 -0.02 -1.26 -4.96 135.00 131.38 2jtn n PRO 130 Ca 0.01 -0.17 -0.08 0.00 -2.02 0.00 0.00 63.50 61.25 2jtn n PRO 130 Cb 0.40 -1.22 -0.06 0.00 -0.02 0.00 0.00 33.50 32.59 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 -1.45 -0.10 0.00 0.52 0.13 -1.98 -3.42 132.00 125.70 2jtn h PRO 131 Ca -0.40 0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 64.72 2jtn h PRO 131 Cb 1.28 0.02 -0.02 0.00 0.13 0.00 0.00 31.00 32.41 2jtn h PRO 131 CO 0.25 0.32 -0.24 2.41 -0.23 0.00 0.00 178.00 180.50 2jtn n THR 132 N -4.80 1.30 -0.21 1.56 -1.04 -1.26 0.15 114.28 109.97 2jtn n THR 132 Ca -0.05 -1.66 -0.27 0.00 -2.04 0.00 0.00 64.05 60.02 2jtn n THR 132 Cb 0.23 0.03 0.26 0.00 -1.82 0.00 0.00 70.33 69.03 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 -0.91 -4.52 -4.03 -2.82 1.13 -1.26 -4.80 117.38 100.16 2jtn n GLN 133 Ca 0.11 -1.30 -0.31 0.00 -1.94 0.00 0.00 57.00 53.56 2jtn n GLN 133 Cb 0.69 -1.71 -0.16 0.00 0.11 0.00 0.00 30.24 29.17 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 -1.99 1.84 0.20 5.09 1.01 -1.26 -3.63 120.40 121.66 2jtn s VAL 134 Ca 0.60 -1.15 -0.19 0.00 0.00 0.00 0.00 61.98 61.23 2jtn s VAL 134 Cb -0.11 -1.88 0.03 0.00 0.00 0.00 0.00 36.38 34.43 2jtn s VAL 134 CO 0.50 0.18 0.56 0.54 0.00 0.00 0.00 175.10 176.88 2jtn s VAL 135 N 1.31 0.02 -0.07 2.92 0.11 -1.26 -4.81 120.40 118.61 2jtn s VAL 135 Ca -0.02 -0.67 -0.12 0.00 -2.93 0.00 0.00 61.98 58.24 2jtn s VAL 135 Cb -0.17 -1.53 -0.05 0.00 -1.53 0.00 0.00 36.38 33.10 2jtn s VAL 135 CO -0.08 -0.08 0.31 -0.13 -3.33 0.00 0.00 175.10 171.79 2jtn s ARG 136 N -3.86 3.86 -0.15 1.54 3.00 -1.26 0.20 118.95 122.28 2jtn s ARG 136 Ca 0.08 0.19 -0.06 0.00 0.00 0.00 0.00 55.73 55.94 2jtn s ARG 136 Cb -0.02 -3.26 -0.04 0.00 0.00 0.00 0.00 34.95 31.64 2jtn s ARG 136 CO -0.03 0.61 0.05 1.03 0.00 0.00 0.00 175.30 176.95 2jtn s ARG 137 N -0.70 3.65 -0.70 3.54 3.00 -1.26 -3.84 118.95 122.64 2jtn s ARG 137 Ca 0.20 -0.35 -0.26 0.00 0.00 0.00 0.00 55.73 55.32 2jtn s ARG 137 Cb -0.15 -3.08 -0.04 0.00 0.00 0.00 0.00 34.95 31.68 2jtn s ARG 137 CO 0.09 0.43 1.99 0.00 0.00 0.00 0.00 175.30 177.81 2jtn s ALA 138 N -0.10 1.85 0.00 2.13 0.00 0.39 -4.76 121.76 121.27 2jtn s ALA 138 Ca 0.06 -0.84 0.00 0.00 0.00 0.00 0.00 51.96 51.18 2jtn s ALA 138 Cb -0.12 -4.40 0.00 0.00 0.00 0.00 0.00 23.12 18.59 2jtn s ALA 138 CO 0.01 -4.39 0.00 1.04 0.00 0.00 0.00 175.76 172.43 2jtn n GLN 139 N 9.04 0.00 0.14 0.00 3.00 -1.26 0.69 117.38 128.99 2jtn n GLN 139 Ca 0.30 0.00 -0.24 0.00 -0.01 0.00 0.00 57.00 57.05 2jtn n GLN 139 Cb 0.50 0.00 -0.16 0.00 0.00 0.00 0.00 30.24 30.59 2jtn n GLN 139 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.06 177.28 2jtn h ASP 140 N 0.00 0.79 -1.17 1.08 1.82 -2.05 -3.47 116.42 113.42 2jtn h ASP 140 Ca 0.00 -0.88 -0.51 0.00 -0.39 0.00 0.00 57.03 55.25 2jtn h ASP 140 Cb 0.00 -0.26 -0.03 0.00 0.68 0.00 0.00 39.33 39.72 2jtn h ASP 140 CO 0.00 1.69 -0.32 -0.36 -1.61 0.00 0.00 179.24 178.65 2jtn s PHE 141 N -2.60 2.26 0.08 0.28 0.40 0.22 -5.14 117.98 113.47 2jtn s PHE 141 Ca -0.09 -0.61 0.07 0.00 -0.60 0.00 0.00 56.93 55.70 2jtn s PHE 141 Cb 0.04 -2.11 -0.03 0.00 0.51 0.00 0.00 43.02 41.43 2jtn s PHE 141 CO 0.93 -0.35 -0.19 0.54 0.70 0.00 0.00 175.22 176.85 2jtn s VAL 142 N -2.57 1.53 0.13 -0.44 0.11 -1.26 0.15 120.40 118.04 2jtn s VAL 142 Ca 0.46 -1.40 0.04 0.00 -2.93 0.00 0.00 61.98 58.15 2jtn s VAL 142 Cb -0.03 -1.39 -0.04 0.00 -1.53 0.00 0.00 36.38 33.38 2jtn s VAL 142 CO 0.28 -0.06 -0.10 -0.31 -3.33 0.00 0.00 175.10 171.58 2jtn s TYR 143 N -1.11 1.22 0.26 1.54 1.51 -1.25 -3.82 117.35 115.69 2jtn s TYR 143 Ca 0.04 -0.74 -0.30 0.00 -1.01 0.00 0.00 57.07 55.07 2jtn s TYR 143 Cb -0.10 -0.63 -0.09 0.00 -0.11 0.00 0.00 41.96 41.03 2jtn s TYR 143 CO 0.03 0.06 1.20 -1.01 -1.11 0.00 0.00 175.55 174.73 2jtn s HIS 144 N -3.12 3.37 0.19 2.71 3.76 -1.26 -4.60 115.29 116.34 2jtn s HIS 144 Ca 0.14 1.50 0.34 0.00 -0.15 0.00 0.00 55.06 56.88 2jtn s HIS 144 Cb 0.01 -3.46 1.73 0.00 1.11 0.00 0.00 32.58 31.98 2jtn s HIS 144 CO 0.00 -1.21 2.02 1.37 -0.85 0.00 0.00 174.74 176.08 2jtn h LEU 145 N 4.30 0.00 0.15 0.89 -0.00 -1.91 1.18 115.31 119.92 2jtn h LEU 145 Ca -0.46 0.00 -0.32 0.00 -0.00 0.00 0.00 57.88 57.09 2jtn h LEU 145 Cb 1.22 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.88 2jtn h LEU 145 CO 0.70 0.00 -1.60 0.45 -0.00 0.00 0.00 178.44 177.99 2jtn h HIS 146 N 0.00 0.58 0.00 0.17 3.86 -1.98 -3.36 115.15 114.41 2jtn h HIS 146 Ca 0.00 -0.42 0.00 0.00 -1.16 0.00 0.00 60.37 58.79 2jtn h HIS 146 Cb 0.11 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.56 2jtn h HIS 146 CO 0.00 1.49 -1.56 0.00 0.86 0.00 0.00 177.93 178.71 2jtn s PHE 148 N -3.42 1.26 0.07 0.00 5.36 0.40 -4.90 117.98 116.74 2jtn s PHE 148 Ca -0.04 -0.43 -0.17 0.00 -0.96 0.00 0.00 56.93 55.33 2jtn s PHE 148 Cb 0.13 -4.24 0.06 0.00 -0.34 0.00 0.00 43.02 38.63 2jtn s PHE 148 CO 0.86 -5.55 0.79 0.00 -1.46 0.00 0.00 175.22 169.86 2jtn n ALA 149 N 7.75 -2.14 -2.08 11.12 0.00 -1.26 -3.79 120.51 130.12 2jtn n ALA 149 Ca 0.20 -0.65 -0.33 0.00 0.00 0.00 0.00 53.44 52.67 2jtn n ALA 149 Cb 0.41 0.28 -0.06 0.00 0.00 0.00 0.00 19.45 20.08 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 1.94 1.32 0.00 0.00 -1.51 -0.74 -1.42 116.25 115.84 2jtn h VAL 151 Ca -0.48 -1.54 -0.18 0.00 -1.23 0.00 0.00 66.70 63.27 2jtn h VAL 151 Cb 1.18 1.82 -0.03 0.00 -2.13 0.00 0.00 31.29 32.13 2jtn h VAL 151 CO 0.64 0.44 -1.48 0.52 -1.23 0.00 0.00 177.57 176.46 2jtn n VAL 152 N -4.01 0.95 0.22 7.19 0.31 -1.26 -4.63 118.33 117.11 2jtn n VAL 152 Ca -0.02 -0.08 0.07 0.00 -0.01 0.00 0.00 64.34 64.30 2jtn n VAL 152 Cb 0.47 -1.78 0.51 0.00 -0.91 0.00 0.00 33.84 32.13 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 -4.32 -4.96 0.00 4.81 -0.54 -4.85 118.16 104.33 2jtn n LYS 154 Ca -0.02 0.85 -0.32 0.00 -0.87 0.00 0.00 58.31 57.94 2jtn n LYS 154 Cb 0.32 -5.66 -0.14 0.00 0.02 0.00 0.00 35.03 29.57 2jtn n LYS 154 CO 0.00 0.00 0.00 0.50 1.17 0.00 0.00 177.40 179.07 2jtn s ARG 155 N -5.67 2.65 0.73 1.64 3.52 -1.26 -4.63 118.95 115.93 2jtn s ARG 155 Ca 0.28 -0.74 -0.14 0.00 -0.13 0.00 0.00 55.73 55.00 2jtn s ARG 155 Cb -0.13 -2.37 0.04 0.00 -1.56 0.00 0.00 34.95 30.93 2jtn s ARG 155 CO 0.35 0.50 1.17 -0.65 -0.81 0.00 0.00 175.30 175.86 2jtn s GLN 156 N -0.42 2.21 0.33 5.12 -0.21 -1.25 -1.52 119.66 123.93 2jtn s GLN 156 Ca 0.05 1.61 0.09 0.00 0.02 0.00 0.00 55.36 57.12 2jtn s GLN 156 Cb -0.12 -1.86 -0.05 0.00 1.00 0.00 0.00 33.01 31.98 2jtn s GLN 156 CO 0.02 -1.74 0.02 -0.51 -2.12 0.00 0.00 175.29 170.95 2jtn s LEU 157 N -5.26 3.02 0.21 2.90 2.01 -1.26 -4.92 118.68 115.39 2jtn s LEU 157 Ca 0.71 -0.94 -0.07 0.00 0.01 0.00 0.00 54.13 53.84 2jtn s LEU 157 Cb -0.25 -1.42 -0.02 0.00 0.01 0.00 0.00 46.19 44.51 2jtn s LEU 157 CO 0.46 -0.21 0.30 0.00 1.01 0.00 0.00 176.35 177.91 2jtn s ALA 158 N -2.49 0.41 -0.33 4.21 0.00 -1.26 -5.00 121.76 117.30 2jtn s ALA 158 Ca 0.35 -1.24 -0.43 0.00 0.00 0.00 0.00 51.96 50.63 2jtn s ALA 158 Cb -0.01 1.18 -0.19 0.00 0.00 0.00 0.00 23.12 24.10 2jtn s ALA 158 CO 0.20 -0.71 1.55 2.41 0.00 0.00 0.00 175.76 179.20 2jtn n THR 159 N -0.31 0.09 0.00 0.00 -1.04 -1.22 -0.06 114.28 111.74 2jtn n THR 159 Ca -0.01 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 2jtn n THR 159 Cb 0.64 -0.65 0.00 0.00 -1.82 0.00 0.00 70.33 68.50 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 3.59 3.17 3.71 3.41 0.00 0.20 -4.91 105.19 114.36 2jtn n GLY 160 Ca 0.27 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.57 6.59 -0.34 1.61 -1.08 0.92 -4.67 116.67 119.12 2jtn s ASP 161 Ca 0.00 2.59 -0.20 0.00 -0.52 0.00 0.00 52.55 54.42 2jtn s ASP 161 Cb 0.00 -2.59 -0.00 0.00 -1.46 0.00 0.00 42.92 38.87 2jtn s ASP 161 CO 0.00 -0.84 0.61 -1.61 0.52 0.00 0.00 175.17 173.85 2jtn s GLU 162 N 1.49 3.72 0.22 4.34 2.02 -1.26 0.11 118.70 129.33 2jtn s GLU 162 Ca 0.71 0.06 0.00 0.00 0.02 0.00 0.00 54.97 55.77 2jtn s GLU 162 Cb -0.43 -3.79 -0.04 0.00 0.10 0.00 0.00 34.13 29.97 2jtn s GLU 162 CO 0.31 -0.68 0.10 -0.59 0.02 0.00 0.00 175.26 174.43 2jtn s PHE 163 N 2.62 1.29 0.43 1.61 -0.71 -0.97 -4.29 117.98 117.96 2jtn s PHE 163 Ca 0.23 -1.27 0.07 0.00 -1.04 0.00 0.00 56.93 54.93 2jtn s PHE 163 Cb -0.15 -0.70 -0.05 0.00 -1.21 0.00 0.00 43.02 40.91 2jtn s PHE 163 CO 0.14 -0.48 0.14 0.71 -1.34 0.00 0.00 175.22 174.39 2jtn s TYR 164 N -3.96 2.49 -0.18 3.49 2.02 0.29 -2.58 117.35 118.92 2jtn s TYR 164 Ca 0.36 -0.64 0.01 0.00 -0.37 0.00 0.00 57.07 56.42 2jtn s TYR 164 Cb 0.07 -1.89 0.04 0.00 -0.40 0.00 0.00 41.96 39.77 2jtn s TYR 164 CO 0.11 0.22 -0.11 -1.17 -1.57 0.00 0.00 175.55 173.03 2jtn s LEU 165 N -3.88 2.01 0.00 -1.29 2.96 -1.26 -2.79 118.68 114.43 2jtn s LEU 165 Ca 0.37 -0.73 -0.13 0.00 -0.22 0.00 0.00 54.13 53.42 2jtn s LEU 165 Cb 0.05 -1.18 0.18 0.00 0.50 0.00 0.00 46.19 45.74 2jtn s LEU 165 CO 0.20 -0.12 0.73 0.23 -1.32 0.00 0.00 176.35 176.07 2jtn n MET 166 N 4.74 -2.00 0.09 1.98 2.81 -0.51 -4.92 117.12 119.31 2jtn n MET 166 Ca -0.15 -1.16 -0.00 0.00 -1.81 0.00 0.00 57.70 54.58 2jtn n MET 166 Cb 0.48 -1.00 -0.03 0.00 -0.71 0.00 0.00 33.22 31.95 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 0.00 -1.00 0.03 4.39 -2.01 -3.29 114.58 112.70 2jtn h GLU 167 Ca -0.26 0.00 -0.45 0.00 0.34 0.00 0.00 59.36 58.98 2jtn h GLU 167 Cb 0.79 0.00 -0.27 0.00 -0.10 0.00 0.00 28.75 29.17 2jtn h GLU 167 CO 0.18 0.53 0.57 -3.47 -1.16 0.00 0.00 179.01 175.66 2jtn n ASP 168 N -3.15 3.77 -3.59 1.42 -0.08 -1.26 -4.88 116.55 108.78 2jtn n ASP 168 Ca -0.02 -3.39 -0.22 0.00 -1.51 0.00 0.00 54.79 49.65 2jtn n ASP 168 Cb 0.81 -0.80 0.07 0.00 2.34 0.00 0.00 41.12 43.54 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 -0.91 -3.76 -4.76 1.67 3.41 -1.24 -5.00 113.62 103.03 2jtn n SER 169 Ca 0.52 -0.64 -0.26 0.00 -0.26 0.00 0.00 58.87 58.23 2jtn n SER 169 Cb 1.48 -4.79 -0.06 0.00 -0.26 0.00 0.00 64.21 60.58 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 -5.93 2.77 -0.23 4.33 3.00 -1.26 -4.72 118.95 116.91 2jtn s ARG 170 Ca 0.28 -0.95 -0.07 0.00 0.00 0.00 0.00 55.73 54.99 2jtn s ARG 170 Cb -0.13 -2.56 -0.03 0.00 0.00 0.00 0.00 34.95 32.22 2jtn s ARG 170 CO 0.75 0.47 0.07 -0.51 0.00 0.00 0.00 175.30 176.09 2jtn s LEU 171 N -3.13 3.59 -0.06 2.53 1.02 -1.26 -1.42 118.68 119.95 2jtn s LEU 171 Ca 0.30 -0.10 -0.02 0.00 0.02 0.00 0.00 54.13 54.33 2jtn s LEU 171 Cb -0.10 -1.94 0.04 0.00 0.02 0.00 0.00 46.19 44.21 2jtn s LEU 171 CO 0.22 0.04 0.12 0.54 0.02 0.00 0.00 176.35 177.29 2jtn s VAL 172 N 1.20 -0.13 0.10 -1.59 0.11 -1.12 0.07 120.40 119.04 2jtn s VAL 172 Ca 0.05 0.28 -0.02 0.00 -2.93 0.00 0.00 61.98 59.36 2jtn s VAL 172 Cb -0.14 -0.23 0.02 0.00 -1.53 0.00 0.00 36.38 34.50 2jtn s VAL 172 CO 0.03 0.12 0.13 0.00 -3.33 0.00 0.00 175.10 172.05 2jtn h LYS 174 N 0.00 0.01 -0.29 0.00 1.57 -1.94 -1.79 116.57 114.12 2jtn h LYS 174 Ca -0.04 -0.02 -0.09 0.00 -1.87 0.00 0.00 60.65 58.63 2jtn h LYS 174 Cb 0.12 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 2jtn h LYS 174 CO 0.03 0.96 -0.18 0.00 -0.57 0.00 0.00 179.45 179.69 2jtn h ALA 175 N 1.03 1.14 -0.26 3.86 0.00 -1.93 -2.90 119.26 120.19 2jtn h ALA 175 Ca -0.01 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2jtn h ALA 175 Cb 1.70 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.35 2jtn h ALA 175 CO 0.13 0.54 0.00 -0.40 0.00 0.00 0.00 179.25 179.52 2jtn n ASP 176 N -4.16 3.00 0.14 0.00 5.68 -1.23 -4.49 116.55 115.49 2jtn n ASP 176 Ca 0.00 -1.88 -0.06 0.00 -0.50 0.00 0.00 54.79 52.36 2jtn n ASP 176 Cb 0.37 -0.16 -0.03 0.00 -1.14 0.00 0.00 41.12 40.16 2jtn n ASP 176 CO 0.00 0.00 0.00 0.22 -1.33 0.00 0.00 177.20 176.09 2jtn h TYR 177 N 3.62 -0.35 -0.05 2.11 3.20 -1.10 -1.78 116.97 122.62 2jtn h TYR 177 Ca 0.00 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.88 2jtn h TYR 177 Cb 0.84 0.11 -0.00 0.00 1.54 0.00 0.00 36.73 39.22 2jtn h TYR 177 CO 0.16 -0.22 0.06 0.93 -1.64 0.00 0.00 178.16 177.45 2jtn h GLU 178 N -0.49 0.00 0.00 1.82 4.39 -1.68 0.42 114.58 119.05 2jtn h GLU 178 Ca -0.04 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.56 2jtn h GLU 178 Cb 0.29 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.92 2jtn h GLU 178 CO 0.06 0.00 -0.50 1.15 -1.16 0.00 0.00 179.01 178.56 2jtn h THR 179 N 0.00 1.13 0.01 1.13 2.02 -1.77 -3.25 112.91 112.17 2jtn h THR 179 Ca 0.03 -1.86 -0.36 0.00 0.77 0.00 0.00 66.41 64.99 2jtn h THR 179 Cb 0.14 2.07 -0.06 0.00 -1.74 0.00 0.00 68.15 68.56 2jtn h THR 179 CO -0.00 0.49 -2.24 0.00 0.37 0.00 0.00 175.52 174.14 2jtn n ALA 180 N -2.34 1.45 0.00 6.16 0.00 -0.13 -5.07 120.51 120.59 2jtn n ALA 180 Ca -0.00 -1.14 0.00 0.00 0.00 0.00 0.00 53.44 52.30 2jtn n ALA 180 Cb 0.58 -0.34 0.00 0.00 0.00 0.00 0.00 19.45 19.69 2jtn n ALA 180 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2jtn n LYS 181 N -2.93 -0.47 -0.51 0.00 -0.00 0.13 -5.10 118.16 109.29 2jtn n LYS 181 Ca -0.32 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 57.99 2jtn n LYS 181 Cb 1.10 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 36.13 2jtn n LYS 181 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.40 178.34