#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jtd s GLU 2 N 0.00 3.47 -0.28 5.31 8.01 -1.26 -5.02 118.70 128.93 2jtd s GLU 2 Ca 0.00 -0.33 -0.28 0.00 0.01 0.00 0.00 54.97 54.37 2jtd s GLU 2 Cb 0.00 -3.04 -0.04 0.00 -4.31 0.00 0.00 34.13 26.74 2jtd s GLU 2 CO 0.00 0.62 2.10 -1.21 0.01 0.00 0.00 175.26 176.78 2jtd s GLU 3 N -2.27 3.10 0.59 1.61 2.02 -1.26 -4.81 118.70 117.68 2jtd s GLU 3 Ca 0.32 1.77 0.39 0.00 0.02 0.00 0.00 54.97 57.48 2jtd s GLU 3 Cb -0.13 -4.34 2.05 0.00 0.10 0.00 0.00 34.13 31.81 2jtd s GLU 3 CO 0.24 -2.14 2.20 1.98 0.02 0.00 0.00 175.26 177.55 2jtd h MET 4 N 14.77 0.00 -0.47 1.61 1.85 -2.02 -1.77 114.93 128.90 2jtd h MET 4 Ca -0.37 0.00 0.05 0.00 -0.61 0.00 0.00 59.70 58.77 2jtd h MET 4 Cb 1.22 0.00 -0.03 0.00 0.43 0.00 0.00 31.60 33.22 2jtd h MET 4 CO 1.00 0.00 0.32 0.87 -0.40 0.00 0.00 176.91 178.70 2jtd h LYS 5 N 0.00 0.41 -0.61 0.39 1.79 -2.00 -1.90 116.57 114.65 2jtd h LYS 5 Ca 0.00 -0.02 -0.03 0.00 -2.18 0.00 0.00 60.65 58.42 2jtd h LYS 5 Cb 0.10 -0.09 -0.03 0.00 -1.58 0.00 0.00 32.23 30.63 2jtd h LYS 5 CO 0.00 0.27 0.26 -0.09 -1.08 0.00 0.00 179.45 178.81 2jtd h ARG 6 N 0.42 0.87 0.00 3.15 1.12 -1.71 0.83 114.38 119.07 2jtd h ARG 6 Ca 0.20 -0.13 -0.09 0.00 -1.11 0.00 0.00 59.98 58.86 2jtd h ARG 6 Cb 0.28 -0.16 -0.01 0.00 -0.01 0.00 0.00 29.97 30.06 2jtd h ARG 6 CO -0.05 0.70 -0.43 -0.07 -3.11 0.00 0.00 179.97 177.02 2jtd h LEU 7 N 0.86 0.00 0.03 3.80 3.38 -1.52 -0.91 115.31 120.95 2jtd h LEU 7 Ca 0.21 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.88 2jtd h LEU 7 Cb 0.14 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 2jtd h LEU 7 CO -0.02 0.43 -1.70 -0.07 0.09 0.00 0.00 178.44 177.16 2jtd h LEU 8 N 0.00 0.11 0.03 1.67 3.38 -1.29 -3.37 115.31 115.83 2jtd h LEU 8 Ca -0.00 -0.22 -0.26 0.00 0.09 0.00 0.00 57.88 57.48 2jtd h LEU 8 Cb 0.93 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.61 2jtd h LEU 8 CO 0.06 1.20 -1.37 0.00 0.09 0.00 0.00 178.44 178.41 2jtd h ALA 9 N 0.79 0.48 -2.52 1.53 0.00 -0.82 -3.46 119.26 115.27 2jtd h ALA 9 Ca -0.29 -1.15 -0.53 0.00 0.00 0.00 0.00 54.91 52.94 2jtd h ALA 9 Cb 2.00 0.17 0.04 0.00 0.00 0.00 0.00 17.79 20.00 2jtd h ALA 9 CO 0.09 1.35 1.04 -1.17 0.00 0.00 0.00 179.25 180.56 2jtd s LEU 10 N -6.55 4.38 -0.00 0.00 0.20 -0.35 -4.72 118.68 111.64 2jtd s LEU 10 Ca -0.03 2.67 -0.04 0.00 0.69 0.00 0.00 54.13 57.42 2jtd s LEU 10 Cb 0.09 -3.57 -0.00 0.00 -0.43 0.00 0.00 46.19 42.27 2jtd s LEU 10 CO 0.83 -0.95 0.08 -0.44 -0.29 0.00 0.00 176.35 175.58 2jtd s SER 11 N 2.31 0.05 0.72 3.68 0.01 -1.26 -4.97 113.70 114.24 2jtd s SER 11 Ca 0.77 -0.17 -0.11 0.00 1.31 0.00 0.00 55.95 57.75 2jtd s SER 11 Cb -0.44 0.17 0.03 0.00 0.21 0.00 0.00 66.02 65.98 2jtd s SER 11 CO 0.34 -0.25 1.10 -1.10 0.41 0.00 0.00 173.24 173.74 2jtd s GLN 12 N -0.97 2.70 0.24 12.44 -0.21 -1.26 -4.99 119.66 127.61 2jtd s GLN 12 Ca -0.11 0.52 -0.30 0.00 0.02 0.00 0.00 55.36 55.50 2jtd s GLN 12 Cb -0.06 -2.00 -0.09 0.00 1.00 0.00 0.00 33.01 31.86 2jtd s GLN 12 CO 0.00 -1.16 1.12 -1.83 -2.12 0.00 0.00 175.29 171.30 2jtd s GLU 13 N -5.30 4.60 -0.35 2.91 1.03 -1.26 -5.01 118.70 115.32 2jtd s GLU 13 Ca 0.59 1.79 -0.00 0.00 0.03 0.00 0.00 54.97 57.38 2jtd s GLU 13 Cb -0.12 -3.22 0.13 0.00 -0.80 0.00 0.00 34.13 30.12 2jtd s GLU 13 CO 0.52 0.12 0.20 -1.01 -1.33 0.00 0.00 175.26 173.77 2jtd s HIS 14 N -0.71 0.77 -0.08 4.83 3.76 -1.26 -5.12 115.29 117.47 2jtd s HIS 14 Ca 0.47 -1.59 -0.29 0.00 -0.15 0.00 0.00 55.06 53.50 2jtd s HIS 14 Cb -0.31 -0.99 -0.05 0.00 1.11 0.00 0.00 32.58 32.34 2jtd s HIS 14 CO 0.39 -0.83 1.68 0.21 -0.85 0.00 0.00 174.74 175.34 2jtd s LYS 15 N 1.15 4.08 -0.23 1.40 2.47 -1.26 -4.90 119.74 122.44 2jtd s LYS 15 Ca 0.17 2.11 -0.16 0.00 -1.56 0.00 0.00 55.97 56.53 2jtd s LYS 15 Cb -0.22 -4.01 -0.10 0.00 -1.46 0.00 0.00 37.83 32.03 2jtd s LYS 15 CO -0.04 -0.97 -0.31 1.19 0.16 0.00 0.00 175.35 175.38 2jtd n PHE 16 N 7.53 0.11 -2.52 4.03 3.72 -1.26 -4.92 117.46 124.16 2jtd n PHE 16 Ca 0.18 0.05 -0.43 0.00 -0.05 0.00 0.00 57.45 57.20 2jtd n PHE 16 Cb 0.43 -0.82 -0.02 0.00 -0.94 0.00 0.00 39.48 38.12 2jtd n PHE 16 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 176.76 174.57 2jtd s PRO 17 N -2.63 4.32 -0.58 -1.08 0.02 -1.26 -4.98 135.00 128.81 2jtd s PRO 17 Ca -0.34 1.57 -0.28 0.00 0.02 0.00 0.00 61.00 61.98 2jtd s PRO 17 Cb 0.10 -3.62 0.02 0.00 0.02 0.00 0.00 34.50 31.01 2jtd s PRO 17 CO 0.46 -0.52 1.40 0.99 -0.33 0.00 0.00 177.00 179.00 2jtd s THR 18 N 2.68 3.79 -0.28 0.99 2.01 -1.26 -4.94 115.64 118.63 2jtd s THR 18 Ca 0.52 0.66 -0.20 0.00 0.31 0.00 0.00 61.69 62.98 2jtd s THR 18 Cb -0.21 -4.48 0.09 0.00 0.01 0.00 0.00 72.50 67.90 2jtd s THR 18 CO 0.17 -1.23 0.75 0.54 -0.69 0.00 0.00 174.62 174.16 2jtd s VAL 19 N 6.03 0.00 -0.63 3.82 0.11 -1.26 -5.10 120.40 123.37 2jtd s VAL 19 Ca 0.51 0.00 -0.26 0.00 -2.93 0.00 0.00 61.98 59.30 2jtd s VAL 19 Cb -0.10 -1.00 -0.08 0.00 -1.53 0.00 0.00 36.38 33.67 2jtd s VAL 19 CO 0.24 0.00 2.30 -2.84 -3.33 0.00 0.00 175.10 171.47 2jtd s PRO 20 N 1.06 2.05 0.00 1.54 0.02 -1.26 -4.79 135.00 133.61 2jtd s PRO 20 Ca -0.05 0.90 0.00 0.00 0.02 0.00 0.00 61.00 61.87 2jtd s PRO 20 Cb -0.05 -4.65 0.00 0.00 0.02 0.00 0.00 34.50 29.82 2jtd s PRO 20 CO -0.11 -3.57 0.00 -2.37 -0.33 0.00 0.00 177.00 170.62 2jtd n THR 21 N 8.12 0.00 -1.17 0.99 5.66 -1.26 -4.91 114.28 121.70 2jtd n THR 21 Ca 0.38 0.00 -0.01 0.00 -3.05 0.00 0.00 64.05 61.36 2jtd n THR 21 Cb 0.50 0.00 0.25 0.00 -1.55 0.00 0.00 70.33 69.53 2jtd n THR 21 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2jtd n LYS 22 N -0.35 2.74 -3.61 1.09 4.76 -1.26 -4.94 118.16 116.59 2jtd n LYS 22 Ca 0.00 -3.03 -0.37 0.00 -2.87 0.00 0.00 58.31 52.05 2jtd n LYS 22 Cb 0.00 -1.96 -0.09 0.00 -1.84 0.00 0.00 35.03 31.15 2jtd n LYS 22 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2jtd s SER 23 N -1.86 6.23 -0.07 4.39 0.15 -1.25 -3.48 113.70 117.81 2jtd s SER 23 Ca 0.47 0.25 -0.03 0.00 0.70 0.00 0.00 55.95 57.35 2jtd s SER 23 Cb 0.40 -2.13 0.04 0.00 -1.71 0.00 0.00 66.02 62.62 2jtd s SER 23 CO 0.07 0.06 0.14 -0.70 1.20 0.00 0.00 173.24 174.02 2jtd s GLU 24 N 0.91 0.03 -0.37 5.44 2.56 -1.17 -4.95 118.70 121.16 2jtd s GLU 24 Ca 0.11 0.49 -0.08 0.00 0.00 0.00 0.00 54.97 55.49 2jtd s GLU 24 Cb -0.13 -0.27 0.05 0.00 2.00 0.00 0.00 34.13 35.77 2jtd s GLU 24 CO 0.04 -0.28 0.17 -1.17 -0.56 0.00 0.00 175.26 173.46 2jtd s LEU 25 N 2.01 4.65 -0.00 2.70 1.98 -1.26 -2.51 118.68 126.25 2jtd s LEU 25 Ca 0.00 -1.21 0.08 0.00 -2.89 0.00 0.00 54.13 50.11 2jtd s LEU 25 Cb -0.12 -1.94 -0.02 0.00 0.66 0.00 0.00 46.19 44.77 2jtd s LEU 25 CO -0.05 -0.40 -0.26 0.00 -1.89 0.00 0.00 176.35 173.75 2jtd s ALA 26 N 1.44 2.14 -0.15 5.97 0.00 -0.72 -5.00 121.76 125.44 2jtd s ALA 26 Ca 0.01 -1.14 0.00 0.00 0.00 0.00 0.00 51.96 50.83 2jtd s ALA 26 Cb -0.20 -0.51 0.03 0.00 0.00 0.00 0.00 23.12 22.43 2jtd s ALA 26 CO 0.03 0.52 -0.11 0.08 0.00 0.00 0.00 175.76 176.28 2jtd s VAL 27 N -0.66 1.44 -0.23 0.00 1.01 -1.26 -2.25 120.40 118.45 2jtd s VAL 27 Ca 0.10 -0.63 -0.05 0.00 0.00 0.00 0.00 61.98 61.40 2jtd s VAL 27 Cb -0.10 -1.42 -0.02 0.00 0.00 0.00 0.00 36.38 34.85 2jtd s VAL 27 CO -0.00 0.36 0.00 -1.61 0.00 0.00 0.00 175.10 173.85 2jtd s GLU 28 N 1.53 3.51 -0.33 2.72 0.41 0.13 -4.99 118.70 121.67 2jtd s GLU 28 Ca 0.04 -0.56 -0.09 0.00 -0.41 0.00 0.00 54.97 53.95 2jtd s GLU 28 Cb -0.14 -3.13 0.01 0.00 -1.78 0.00 0.00 34.13 29.10 2jtd s GLU 28 CO -0.10 -0.16 0.16 0.42 -0.49 0.00 0.00 175.26 175.09 2jtd s ILE 29 N 1.44 4.41 -0.11 -1.63 1.09 -1.26 -0.38 121.20 124.76 2jtd s ILE 29 Ca 0.05 -0.69 -0.08 0.00 -1.10 0.00 0.00 60.65 58.83 2jtd s ILE 29 Cb -0.15 -3.35 -0.04 0.00 -1.06 0.00 0.00 42.46 37.86 2jtd s ILE 29 CO 0.00 -0.06 0.17 -0.76 -0.10 0.00 0.00 174.94 174.19 2jtd s LEU 30 N 1.55 4.38 0.00 2.97 2.01 -1.02 -4.50 118.68 124.09 2jtd s LEU 30 Ca 0.03 0.51 0.16 0.00 0.01 0.00 0.00 54.13 54.84 2jtd s LEU 30 Cb -0.18 -2.14 0.79 0.00 0.01 0.00 0.00 46.19 44.67 2jtd s LEU 30 CO 0.05 0.38 1.45 -1.84 1.01 0.00 0.00 176.35 177.40 2jtd n GLU 31 N 2.10 0.22 -0.01 1.70 0.28 -1.26 -1.71 120.64 121.96 2jtd n GLU 31 Ca -0.19 0.14 0.12 0.00 -0.16 0.00 0.00 57.16 57.07 2jtd n GLU 31 Cb 0.54 -1.50 0.62 0.00 1.43 0.00 0.00 31.44 32.53 2jtd n GLU 31 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2jtd n LYS 32 N -1.29 1.18 -0.41 3.44 4.01 -1.26 -4.87 118.16 118.97 2jtd n LYS 32 Ca 0.07 -0.27 0.00 0.00 -0.51 0.00 0.00 58.31 57.60 2jtd n LYS 32 Cb 0.13 -1.38 0.00 0.00 -0.51 0.00 0.00 35.03 33.27 2jtd n LYS 32 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2jtd n GLY 33 N 0.93 0.75 3.25 0.72 0.00 -0.69 -5.06 105.19 105.10 2jtd n GLY 33 Ca 0.17 -0.40 -0.35 0.00 0.00 0.00 0.00 46.02 45.45 2jtd n GLY 33 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jtd s GLN 34 N -0.80 3.23 -0.31 1.61 -1.52 -1.20 -4.61 119.66 116.06 2jtd s GLN 34 Ca 0.00 -0.71 -0.17 0.00 -1.95 0.00 0.00 55.36 52.53 2jtd s GLN 34 Cb 0.00 -2.90 -0.02 0.00 -0.22 0.00 0.00 33.01 29.87 2jtd s GLN 34 CO 0.00 -0.22 0.48 0.08 -0.25 0.00 0.00 175.29 175.38 2jtd s VAL 35 N 1.42 5.07 -0.41 1.09 1.01 0.11 -2.42 120.40 126.27 2jtd s VAL 35 Ca 0.05 0.49 -0.17 0.00 0.00 0.00 0.00 61.98 62.36 2jtd s VAL 35 Cb -0.14 -3.87 0.02 0.00 0.00 0.00 0.00 36.38 32.38 2jtd s VAL 35 CO -0.06 -0.07 0.40 -0.60 0.00 0.00 0.00 175.10 174.78 2jtd s ARG 36 N 2.29 3.15 -0.17 2.72 3.52 0.48 -2.34 118.95 128.59 2jtd s ARG 36 Ca 0.18 -0.75 0.00 0.00 -0.13 0.00 0.00 55.73 55.03 2jtd s ARG 36 Cb -0.16 -3.94 0.01 0.00 -1.56 0.00 0.00 34.95 29.30 2jtd s ARG 36 CO 0.12 -0.79 -0.16 0.12 -0.81 0.00 0.00 175.30 173.78 2jtd s PHE 37 N 2.04 2.80 0.00 5.12 2.19 -0.98 0.17 117.98 129.33 2jtd s PHE 37 Ca 0.11 -1.28 -0.08 0.00 0.33 0.00 0.00 56.93 56.01 2jtd s PHE 37 Cb -0.17 -1.93 0.00 0.00 -1.31 0.00 0.00 43.02 39.61 2jtd s PHE 37 CO 0.13 -0.63 0.15 1.67 1.83 0.00 0.00 175.22 178.37 2jtd s TRP 38 N 1.11 0.02 -0.02 10.12 1.48 -0.95 -0.18 118.94 130.51 2jtd s TRP 38 Ca 0.00 -0.10 -0.06 0.00 -1.06 0.00 0.00 56.10 54.89 2jtd s TRP 38 Cb -0.14 -0.04 0.01 0.00 -1.16 0.00 0.00 33.47 32.14 2jtd s TRP 38 CO -0.06 -0.29 0.13 0.00 -4.06 0.00 0.00 176.95 172.67 2jtd s MET 39 N -1.37 0.31 0.02 3.25 0.23 0.14 -1.75 119.30 120.13 2jtd s MET 39 Ca -0.15 -0.11 -0.01 0.00 -1.03 0.00 0.00 55.69 54.40 2jtd s MET 39 Cb -0.07 0.13 -0.04 0.00 -1.53 0.00 0.00 34.83 33.32 2jtd s MET 39 CO 0.02 -0.06 0.14 1.14 -2.03 0.00 0.00 175.02 174.23 2jtd s GLN 40 N -0.65 3.24 0.03 3.16 -2.07 -1.04 -0.23 119.66 122.10 2jtd s GLN 40 Ca -0.07 -0.45 0.01 0.00 -1.82 0.00 0.00 55.36 53.03 2jtd s GLN 40 Cb -0.04 -2.96 -0.02 0.00 -1.09 0.00 0.00 33.01 28.89 2jtd s GLN 40 CO 0.01 0.64 -0.05 0.00 -1.32 0.00 0.00 175.29 174.57 2jtd s ALA 41 N -1.32 0.31 -1.19 2.60 0.00 0.52 -3.05 121.76 119.63 2jtd s ALA 41 Ca 0.27 -0.69 0.18 0.00 0.00 0.00 0.00 51.96 51.73 2jtd s ALA 41 Cb -0.12 0.12 0.68 0.00 0.00 0.00 0.00 23.12 23.79 2jtd s ALA 41 CO 0.19 -0.12 1.59 -0.85 0.00 0.00 0.00 175.76 176.58 2jtd n GLU 42 N 1.46 3.53 -3.91 0.00 0.28 -1.26 -4.67 120.64 116.08 2jtd n GLU 42 Ca -0.23 -2.82 -0.11 0.00 -0.16 0.00 0.00 57.16 53.85 2jtd n GLU 42 Cb 0.55 -1.81 -0.11 0.00 1.43 0.00 0.00 31.44 31.50 2jtd n GLU 42 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 2jtd s LYS 43 N -1.73 0.31 -0.05 3.44 -0.14 -1.26 -5.07 119.74 115.25 2jtd s LYS 43 Ca 0.49 -0.35 -0.09 0.00 -1.36 0.00 0.00 55.97 54.67 2jtd s LYS 43 Cb 0.31 0.13 -0.03 0.00 -1.68 0.00 0.00 37.83 36.55 2jtd s LYS 43 CO 0.25 -0.06 -0.17 1.28 -0.76 0.00 0.00 175.35 175.88 2jtd n LEU 44 N 1.92 1.40 -4.82 3.17 4.77 -1.26 -4.67 117.00 117.50 2jtd n LEU 44 Ca -0.20 0.22 -0.38 0.00 -0.03 0.00 0.00 56.01 55.61 2jtd n LEU 44 Cb 0.56 -0.53 -0.06 0.00 -2.33 0.00 0.00 43.42 41.06 2jtd n LEU 44 CO 0.21 -0.49 0.13 -0.55 -1.33 0.00 0.00 177.39 175.36 2jtd s SER 45 N -5.78 6.83 -1.29 -1.43 0.15 -1.26 -3.92 113.70 107.00 2jtd s SER 45 Ca -0.14 0.99 -0.07 0.00 0.70 0.00 0.00 55.95 57.42 2jtd s SER 45 Cb 0.02 -2.27 0.01 0.00 -1.71 0.00 0.00 66.02 62.07 2jtd s SER 45 CO 0.21 0.29 1.12 -0.24 1.20 0.00 0.00 173.24 175.83 2jtd n SER 46 N 1.96 -5.35 -4.33 5.45 2.88 -1.26 -4.98 113.62 108.00 2jtd n SER 46 Ca -0.13 -0.55 -0.29 0.00 -1.33 0.00 0.00 58.87 56.58 2jtd n SER 46 Cb 0.52 -4.96 0.23 0.00 -0.75 0.00 0.00 64.21 59.26 2jtd n SER 46 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2jtd s ASN 47 N -3.54 1.13 0.50 -3.46 2.20 -1.25 -4.96 114.94 105.55 2jtd s ASN 47 Ca 0.45 1.18 -0.23 0.00 -0.94 0.00 0.00 52.86 53.32 2jtd s ASN 47 Cb -0.20 -1.82 -0.06 0.00 -2.00 0.00 0.00 41.25 37.17 2jtd s ASN 47 CO 0.71 -4.06 1.31 0.00 -2.94 0.00 0.00 177.10 172.12 2jtd s ALA 48 N -2.67 2.96 -0.44 3.54 0.00 -1.26 -4.93 121.76 118.96 2jtd s ALA 48 Ca 0.68 1.23 -0.29 0.00 0.00 0.00 0.00 51.96 53.58 2jtd s ALA 48 Cb -0.20 -3.51 0.03 0.00 0.00 0.00 0.00 23.12 19.44 2jtd s ALA 48 CO 0.61 -1.10 1.11 0.21 0.00 0.00 0.00 175.76 176.59 2jtd s LYS 49 N -2.72 3.79 -0.01 0.00 2.20 -0.55 -4.91 119.74 117.53 2jtd s LYS 49 Ca 0.67 0.65 0.05 0.00 -0.36 0.00 0.00 55.97 56.98 2jtd s LYS 49 Cb -0.37 -3.87 -0.03 0.00 -1.51 0.00 0.00 37.83 32.05 2jtd s LYS 49 CO 0.45 -1.27 -0.16 0.54 -0.36 0.00 0.00 175.35 174.55 2jtd s VAL 50 N 4.24 2.89 -0.32 4.02 0.11 -1.26 0.02 120.40 130.11 2jtd s VAL 50 Ca 0.47 -0.92 -0.10 0.00 -2.93 0.00 0.00 61.98 58.50 2jtd s VAL 50 Cb -0.08 -2.15 -0.00 0.00 -1.53 0.00 0.00 36.38 32.61 2jtd s VAL 50 CO 0.28 0.50 0.16 -0.44 -3.33 0.00 0.00 175.10 172.26 2jtd s SER 51 N -0.98 5.57 -1.13 3.54 0.01 0.66 -5.00 113.70 116.38 2jtd s SER 51 Ca 0.13 -0.56 -0.21 0.00 1.31 0.00 0.00 55.95 56.62 2jtd s SER 51 Cb -0.11 -2.00 0.02 0.00 0.21 0.00 0.00 66.02 64.14 2jtd s SER 51 CO 0.02 -0.21 1.70 -0.31 0.41 0.00 0.00 173.24 174.85 2jtd s TYR 52 N 1.61 2.43 -0.13 2.43 2.02 -1.26 -3.46 117.35 120.98 2jtd s TYR 52 Ca 0.04 -0.71 0.00 0.00 -0.37 0.00 0.00 57.07 56.04 2jtd s TYR 52 Cb -0.17 -4.52 -0.01 0.00 -0.40 0.00 0.00 41.96 36.86 2jtd s TYR 52 CO 0.06 -1.76 -0.14 0.42 -1.57 0.00 0.00 175.55 172.56 2jtd s ILE 53 N 6.35 2.88 -0.07 2.71 -1.09 -1.26 -1.80 121.20 128.92 2jtd s ILE 53 Ca 0.56 -0.72 -0.01 0.00 -2.23 0.00 0.00 60.65 58.25 2jtd s ILE 53 Cb 0.00 -2.20 0.03 0.00 -1.58 0.00 0.00 42.46 38.71 2jtd s ILE 53 CO 0.01 0.52 -0.01 0.12 -1.23 0.00 0.00 174.94 174.35 2jtd s PHE 54 N 0.45 0.74 -1.46 3.97 5.36 0.08 -3.44 117.98 123.68 2jtd s PHE 54 Ca -0.11 -0.22 -0.10 0.00 -0.96 0.00 0.00 56.93 55.55 2jtd s PHE 54 Cb -0.16 -0.81 0.04 0.00 -0.34 0.00 0.00 43.02 41.75 2jtd s PHE 54 CO 0.05 -0.32 0.91 -1.71 -1.46 0.00 0.00 175.22 172.69 2jtd n ASN 55 N 4.95 -5.54 -1.40 6.13 2.85 -0.61 -1.04 115.26 120.60 2jtd n ASN 55 Ca -0.11 -0.54 -0.15 0.00 -0.11 0.00 0.00 54.58 53.67 2jtd n ASN 55 Cb 0.50 -4.43 -0.04 0.00 1.24 0.00 0.00 39.78 37.06 2jtd n ASN 55 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 2jtd n GLU 56 N -4.54 -1.11 -5.09 1.20 1.02 -1.26 -5.00 120.64 105.86 2jtd n GLU 56 Ca -0.01 0.90 -0.29 0.00 -0.02 0.00 0.00 57.16 57.74 2jtd n GLU 56 Cb 0.56 -5.12 -0.16 0.00 -0.02 0.00 0.00 31.44 26.70 2jtd n GLU 56 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2jtd s LYS 57 N -3.92 2.15 -0.17 3.49 -0.14 -0.20 -5.10 119.74 115.85 2jtd s LYS 57 Ca 0.00 -0.78 -0.29 0.00 -1.36 0.00 0.00 55.97 53.53 2jtd s LYS 57 Cb 0.00 -1.88 -0.01 0.00 -1.68 0.00 0.00 37.83 34.26 2jtd s LYS 57 CO 0.00 0.35 1.21 -1.21 -0.76 0.00 0.00 175.35 174.94 2jtd s GLU 58 N -0.16 4.25 0.46 1.68 2.02 -1.26 -0.74 118.70 124.95 2jtd s GLU 58 Ca -0.01 1.60 0.05 0.00 0.02 0.00 0.00 54.97 56.62 2jtd s GLU 58 Cb -0.12 -3.72 0.05 0.00 0.10 0.00 0.00 34.13 30.43 2jtd s GLU 58 CO 0.02 -0.67 0.39 0.44 0.02 0.00 0.00 175.26 175.47 2jtd n ILE 59 N 5.30 0.00 -3.68 -1.63 -5.35 -0.74 -4.98 119.36 108.27 2jtd n ILE 59 Ca 0.13 -1.78 -0.10 0.00 -0.27 0.00 0.00 62.75 60.74 2jtd n ILE 59 Cb 0.45 -0.18 -0.05 0.00 -1.74 0.00 0.00 39.64 38.12 2jtd n ILE 59 CO 0.00 0.00 0.00 0.72 -1.76 0.00 0.00 176.55 175.51 2jtd s PHE 60 N -2.22 -0.14 0.43 4.28 -0.71 -1.26 -4.96 117.98 113.40 2jtd s PHE 60 Ca 0.30 -0.19 -0.24 0.00 -1.04 0.00 0.00 56.93 55.76 2jtd s PHE 60 Cb -0.02 0.25 -0.08 0.00 -1.21 0.00 0.00 43.02 41.96 2jtd s PHE 60 CO 0.19 -0.73 1.16 -2.00 -1.34 0.00 0.00 175.22 172.50 2jtd s GLU 61 N -3.83 3.91 0.00 1.99 2.12 -1.26 -4.77 118.70 116.86 2jtd s GLU 61 Ca 0.05 1.80 0.00 0.00 0.36 0.00 0.00 54.97 57.17 2jtd s GLU 61 Cb 0.02 -2.54 0.00 0.00 0.26 0.00 0.00 34.13 31.87 2jtd s GLU 61 CO -0.10 -0.43 0.00 0.41 -0.54 0.00 0.00 175.26 174.61 2jtd n GLY 62 N 0.52 -1.37 0.00 -1.50 0.00 -1.08 -4.98 105.19 96.78 2jtd n GLY 62 Ca 0.06 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.60 2jtd n GLY 62 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2jtd n PRO 63 N 0.00 0.00 -0.41 1.61 -0.04 -1.26 -4.11 135.00 130.79 2jtd n PRO 63 Ca 0.00 0.20 0.08 0.00 -0.04 0.00 0.00 63.50 63.74 2jtd n PRO 63 Cb 0.00 -1.17 0.25 0.00 -0.04 0.00 0.00 33.50 32.54 2jtd n PRO 63 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2jtd n LYS 64 N -1.11 3.15 -4.71 0.54 -0.00 -1.26 -4.96 118.16 109.82 2jtd n LYS 64 Ca 0.00 -2.61 -0.33 0.00 -0.00 0.00 0.00 58.31 55.37 2jtd n LYS 64 Cb 0.00 -1.69 -0.14 0.00 -0.00 0.00 0.00 35.03 33.20 2jtd n LYS 64 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 2jtd s TYR 65 N -2.05 2.83 -0.12 5.58 2.02 -1.26 -4.08 117.35 120.28 2jtd s TYR 65 Ca 0.38 -0.64 -0.03 0.00 -0.37 0.00 0.00 57.07 56.42 2jtd s TYR 65 Cb 0.27 -1.86 0.05 0.00 -0.40 0.00 0.00 41.96 40.01 2jtd s TYR 65 CO 0.14 -0.21 0.05 0.21 -1.57 0.00 0.00 175.55 174.17 2jtd s LYS 66 N 0.40 0.26 0.09 -0.62 2.47 -1.25 -2.62 119.74 118.47 2jtd s LYS 66 Ca -0.10 0.01 0.04 0.00 -1.56 0.00 0.00 55.97 54.37 2jtd s LYS 66 Cb -0.16 -1.36 -0.03 0.00 -1.46 0.00 0.00 37.83 34.82 2jtd s LYS 66 CO 0.05 -0.50 -0.11 1.41 0.16 0.00 0.00 175.35 176.36 2jtd s MET 67 N 2.06 0.82 -0.10 4.03 -2.45 -1.26 -1.99 119.30 120.40 2jtd s MET 67 Ca 0.03 -1.07 0.04 0.00 -1.25 0.00 0.00 55.69 53.44 2jtd s MET 67 Cb -0.14 -0.62 0.00 0.00 1.25 0.00 0.00 34.83 35.32 2jtd s MET 67 CO -0.06 0.11 -0.24 -1.01 1.05 0.00 0.00 175.02 174.87 2jtd s HIS 68 N -1.98 2.57 0.29 4.11 0.09 -1.14 -5.02 115.29 114.21 2jtd s HIS 68 Ca 0.02 -1.09 -0.23 0.00 -0.00 0.00 0.00 55.06 53.77 2jtd s HIS 68 Cb -0.06 -1.72 -0.09 0.00 -0.00 0.00 0.00 32.58 30.71 2jtd s HIS 68 CO 0.01 -0.44 0.86 0.96 -0.00 0.00 0.00 174.74 176.12 2jtd s ILE 69 N 0.40 4.37 -0.96 0.60 -4.36 -1.26 -4.23 121.20 115.76 2jtd s ILE 69 Ca -0.17 1.57 -0.23 0.00 -0.26 0.00 0.00 60.65 61.56 2jtd s ILE 69 Cb -0.18 -3.91 0.06 0.00 1.25 0.00 0.00 42.46 39.68 2jtd s ILE 69 CO 0.08 0.12 1.36 1.51 0.24 0.00 0.00 174.94 178.25 2jtd s ASP 70 N -1.69 6.47 0.00 4.36 -4.77 -1.26 -4.45 116.67 115.32 2jtd s ASP 70 Ca 0.48 -1.41 0.00 0.00 -3.30 0.00 0.00 52.55 48.33 2jtd s ASP 70 Cb -0.17 -2.54 0.00 0.00 -1.09 0.00 0.00 42.92 39.12 2jtd s ASP 70 CO 0.22 -1.48 0.00 0.54 0.70 0.00 0.00 175.17 175.15 2jtd n ARG 71 N 8.54 0.00 -0.09 2.11 1.74 -1.26 -4.75 116.66 122.95 2jtd n ARG 71 Ca 0.27 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.26 2jtd n ARG 71 Cb 0.50 -0.55 -0.16 0.00 -1.02 0.00 0.00 32.46 31.24 2jtd n ARG 71 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2jtd n ASN 72 N -1.67 0.10 -0.04 0.55 3.02 -1.26 -4.75 115.26 111.21 2jtd n ASN 72 Ca 0.00 0.05 -0.08 0.00 -0.03 0.00 0.00 54.58 54.52 2jtd n ASN 72 Cb 0.07 0.91 -0.03 0.00 -0.61 0.00 0.00 39.78 40.12 2jtd n ASN 72 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2jtd n THR 73 N -2.77 1.28 0.00 3.41 -2.24 -1.26 -5.02 114.28 107.68 2jtd n THR 73 Ca -0.30 0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 2jtd n THR 73 Cb 1.13 -1.97 0.00 0.00 -2.10 0.00 0.00 70.33 67.39 2jtd n THR 73 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jtd n GLY 74 N 2.22 0.67 3.31 3.38 0.00 -1.26 -5.02 105.19 108.49 2jtd n GLY 74 Ca -0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.50 2jtd n GLY 74 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jtd s ILE 75 N -2.00 3.96 -0.47 -0.61 -1.09 -1.26 -0.35 121.20 119.37 2jtd s ILE 75 Ca 0.00 -0.92 -0.22 0.00 -2.23 0.00 0.00 60.65 57.27 2jtd s ILE 75 Cb 0.00 -3.16 0.03 0.00 -1.58 0.00 0.00 42.46 37.75 2jtd s ILE 75 CO 0.00 -0.08 0.75 -0.63 -1.23 0.00 0.00 174.94 173.75 2jtd s ILE 76 N 1.46 4.68 0.01 2.92 1.01 0.68 -4.80 121.20 127.17 2jtd s ILE 76 Ca 0.00 0.23 0.06 0.00 0.00 0.00 0.00 60.65 60.94 2jtd s ILE 76 Cb -0.19 -4.32 -0.02 0.00 0.01 0.00 0.00 42.46 37.94 2jtd s ILE 76 CO 0.03 -0.76 -0.18 -1.83 0.00 0.00 0.00 174.94 172.20 2jtd s GLU 77 N 3.20 1.36 0.03 2.79 4.04 -1.26 0.26 118.70 129.12 2jtd s GLU 77 Ca 0.26 -0.76 0.00 0.00 0.04 0.00 0.00 54.97 54.52 2jtd s GLU 77 Cb -0.13 -1.37 -0.02 0.00 0.02 0.00 0.00 34.13 32.62 2jtd s GLU 77 CO 0.20 0.36 -0.04 0.00 -1.84 0.00 0.00 175.26 173.95 2jtd s MET 78 N -0.77 0.40 -0.17 -4.83 0.23 0.75 -2.88 119.30 112.04 2jtd s MET 78 Ca 0.06 -0.76 0.01 0.00 -1.03 0.00 0.00 55.69 53.97 2jtd s MET 78 Cb -0.08 0.08 0.02 0.00 -1.53 0.00 0.00 34.83 33.32 2jtd s MET 78 CO 0.00 -0.05 -0.19 0.12 -2.03 0.00 0.00 175.02 172.87 2jtd s PHE 79 N -1.99 2.64 0.16 3.16 5.36 -0.84 -2.31 117.98 124.16 2jtd s PHE 79 Ca -0.10 -1.51 0.02 0.00 -0.96 0.00 0.00 56.93 54.38 2jtd s PHE 79 Cb -0.06 -1.84 -0.05 0.00 -0.34 0.00 0.00 43.02 40.74 2jtd s PHE 79 CO -0.03 -0.74 -0.00 -1.64 -1.46 0.00 0.00 175.22 171.35 2jtd s MET 80 N 1.22 1.06 0.35 10.12 -1.94 -0.99 -3.79 119.30 125.33 2jtd s MET 80 Ca 0.02 -1.50 -0.07 0.00 -1.71 0.00 0.00 55.69 52.43 2jtd s MET 80 Cb -0.14 -0.23 0.02 0.00 2.01 0.00 0.00 34.83 36.49 2jtd s MET 80 CO -0.10 -0.12 0.57 -1.83 -0.01 0.00 0.00 175.02 173.53 2jtd s GLU 81 N -3.91 2.00 0.11 2.03 -1.05 -1.26 -0.71 118.70 115.90 2jtd s GLU 81 Ca 0.22 -1.64 -0.19 0.00 -0.15 0.00 0.00 54.97 53.22 2jtd s GLU 81 Cb 0.06 0.50 -0.07 0.00 -0.44 0.00 0.00 34.13 34.18 2jtd s GLU 81 CO 0.03 -0.86 0.59 -1.59 0.95 0.00 0.00 175.26 174.37 2jtd s LYS 82 N -2.87 4.19 -0.25 -4.83 0.00 -1.26 -4.80 119.74 109.91 2jtd s LYS 82 Ca 0.25 0.73 -0.12 0.00 0.00 0.00 0.00 55.97 56.83 2jtd s LYS 82 Cb -0.02 -3.15 -0.11 0.00 0.00 0.00 0.00 37.83 34.55 2jtd s LYS 82 CO 0.17 0.58 -0.32 -0.11 0.00 0.00 0.00 175.35 175.67 2jtd n LEU 83 N 1.44 1.82 -4.37 2.77 7.94 -1.26 -5.01 117.00 120.34 2jtd n LEU 83 Ca -0.08 0.29 -0.21 0.00 -1.11 0.00 0.00 56.01 54.90 2jtd n LEU 83 Cb 0.51 -0.75 -0.10 0.00 0.53 0.00 0.00 43.42 43.61 2jtd n LEU 83 CO 0.42 0.54 -0.46 -1.58 -1.11 0.00 0.00 177.39 175.20 2jtd s GLN 84 N -2.46 1.38 0.64 1.96 2.00 -1.26 -5.02 119.66 116.89 2jtd s GLN 84 Ca -0.35 -1.56 0.41 0.00 -2.00 0.00 0.00 55.36 51.85 2jtd s GLN 84 Cb 0.13 -1.32 2.18 0.00 0.80 0.00 0.00 33.01 34.80 2jtd s GLN 84 CO 0.45 0.24 2.29 -0.44 -0.50 0.00 0.00 175.29 177.34 2jtd h ASP 85 N 2.74 0.00 0.03 6.67 5.19 -1.95 -2.80 116.42 126.31 2jtd h ASP 85 Ca -0.40 0.00 -0.26 0.00 -0.62 0.00 0.00 57.03 55.75 2jtd h ASP 85 Cb 1.22 0.00 0.02 0.00 0.18 0.00 0.00 39.33 40.76 2jtd h ASP 85 CO 0.58 0.01 -1.02 -0.08 -3.12 0.00 0.00 179.24 175.60 2jtd h GLU 86 N 0.00 0.63 0.00 3.56 4.81 -2.00 -3.29 114.58 118.29 2jtd h GLU 86 Ca -0.00 -0.73 0.00 0.00 -0.13 0.00 0.00 59.36 58.50 2jtd h GLU 86 Cb 0.09 0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.69 2jtd h GLU 86 CO 0.00 1.31 0.00 -0.40 -0.73 0.00 0.00 179.01 179.19 2jtd n ASP 87 N -3.90 0.00 -4.47 1.04 5.68 -1.06 -4.43 116.55 109.40 2jtd n ASP 87 Ca -0.12 -0.11 -0.41 0.00 -0.50 0.00 0.00 54.79 53.66 2jtd n ASP 87 Cb 0.88 -0.30 -0.11 0.00 -1.14 0.00 0.00 41.12 40.45 2jtd n ASP 87 CO 0.00 0.00 0.00 -0.70 -1.33 0.00 0.00 177.20 175.17 2jtd s GLU 88 N -2.60 3.21 0.00 0.11 2.56 -1.23 -4.94 118.70 115.82 2jtd s GLU 88 Ca 0.28 -0.83 0.00 0.00 0.00 0.00 0.00 54.97 54.41 2jtd s GLU 88 Cb 0.20 -3.82 0.00 0.00 2.00 0.00 0.00 34.13 32.51 2jtd s GLU 88 CO 0.46 -0.57 0.00 0.41 -0.56 0.00 0.00 175.26 175.00 2jtd n GLY 89 N 5.09 0.60 3.50 -1.50 0.00 -0.83 -4.52 105.19 107.53 2jtd n GLY 89 Ca -0.12 0.47 -0.43 0.00 0.00 0.00 0.00 46.02 45.94 2jtd n GLY 89 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jtd s THR 90 N 2.59 4.33 -0.12 2.61 2.01 -1.26 -0.70 115.64 125.09 2jtd s THR 90 Ca 0.00 0.03 -0.14 0.00 0.31 0.00 0.00 61.69 61.90 2jtd s THR 90 Cb 0.00 -4.61 -0.05 0.00 0.01 0.00 0.00 72.50 67.85 2jtd s THR 90 CO 0.00 -1.29 0.32 -0.31 -0.69 0.00 0.00 174.62 172.65 2jtd s TYR 91 N 4.08 3.54 -0.25 4.92 1.51 0.66 -1.57 117.35 130.24 2jtd s TYR 91 Ca 0.27 0.70 -0.03 0.00 -1.01 0.00 0.00 57.07 57.00 2jtd s TYR 91 Cb -0.14 -2.31 0.10 0.00 -0.11 0.00 0.00 41.96 39.51 2jtd s TYR 91 CO 0.15 0.37 0.19 0.99 -1.11 0.00 0.00 175.55 176.15 2jtd s THR 92 N -0.01 -0.24 -0.37 -0.71 2.01 -1.22 -0.38 115.64 114.73 2jtd s THR 92 Ca 0.19 -0.42 -0.13 0.00 0.31 0.00 0.00 61.69 61.64 2jtd s THR 92 Cb -0.14 -0.84 0.00 0.00 0.01 0.00 0.00 72.50 71.54 2jtd s THR 92 CO 0.06 -0.45 0.25 0.12 -0.69 0.00 0.00 174.62 173.92 2jtd s PHE 93 N 2.24 3.23 -0.31 4.92 5.36 -0.59 -4.08 117.98 128.75 2jtd s PHE 93 Ca 0.07 -0.48 -0.12 0.00 -0.96 0.00 0.00 56.93 55.45 2jtd s PHE 93 Cb -0.15 -2.51 -0.03 0.00 -0.34 0.00 0.00 43.02 39.99 2jtd s PHE 93 CO -0.25 -0.49 0.21 -1.14 -1.46 0.00 0.00 175.22 172.09 2jtd s GLN 94 N 1.68 3.63 -0.19 10.12 -0.44 -1.22 -0.64 119.66 132.59 2jtd s GLN 94 Ca 0.05 -0.54 -0.00 0.00 -2.50 0.00 0.00 55.36 52.36 2jtd s GLN 94 Cb -0.18 -3.72 0.01 0.00 -1.64 0.00 0.00 33.01 27.48 2jtd s GLN 94 CO 0.10 -0.35 -0.16 0.42 0.50 0.00 0.00 175.29 175.80 2jtd s ILE 95 N 1.72 2.40 -0.44 -2.34 1.01 0.09 -0.24 121.20 123.39 2jtd s ILE 95 Ca 0.06 -0.83 -0.10 0.00 0.00 0.00 0.00 60.65 59.78 2jtd s ILE 95 Cb -0.17 -2.04 0.09 0.00 0.01 0.00 0.00 42.46 40.35 2jtd s ILE 95 CO 0.10 0.51 0.30 -1.58 0.00 0.00 0.00 174.94 174.27 2jtd s GLN 96 N 1.34 2.64 -0.41 2.79 0.74 0.10 0.12 119.66 126.97 2jtd s GLN 96 Ca 0.05 -1.52 -0.05 0.00 0.05 0.00 0.00 55.36 53.90 2jtd s GLN 96 Cb -0.13 -3.87 0.10 0.00 1.10 0.00 0.00 33.01 30.21 2jtd s GLN 96 CO -0.10 -1.02 0.22 0.34 -0.55 0.00 0.00 175.29 174.17 2jtd s ASP 97 N 2.34 5.36 0.00 6.67 2.15 -0.32 -1.47 116.67 131.39 2jtd s ASP 97 Ca 0.04 -1.88 0.00 0.00 0.43 0.00 0.00 52.55 51.13 2jtd s ASP 97 Cb -0.24 -1.87 0.00 0.00 -0.30 0.00 0.00 42.92 40.51 2jtd s ASP 97 CO 0.02 -0.55 0.00 0.61 -0.17 0.00 0.00 175.17 175.08 2jtd n GLY 98 N 4.69 1.13 0.00 2.66 0.00 -1.26 -2.47 105.19 109.94 2jtd n GLY 98 Ca -0.05 0.29 0.00 0.00 0.00 0.00 0.00 46.02 46.26 2jtd n GLY 98 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jtd n LYS 99 N 0.00 0.01 -3.11 1.61 4.76 -1.26 -5.06 118.16 115.11 2jtd n LYS 99 Ca 0.00 0.00 -0.39 0.00 -2.87 0.00 0.00 58.31 55.05 2jtd n LYS 99 Cb 0.00 -0.85 -0.06 0.00 -1.84 0.00 0.00 35.03 32.28 2jtd n LYS 99 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2jtd s ALA 100 N -1.70 3.47 -0.29 7.82 0.00 -1.03 -5.05 121.76 124.97 2jtd s ALA 100 Ca 0.00 0.17 -0.07 0.00 0.00 0.00 0.00 51.96 52.06 2jtd s ALA 100 Cb 0.00 -2.84 0.01 0.00 0.00 0.00 0.00 23.12 20.29 2jtd s ALA 100 CO 0.00 0.21 0.07 0.95 0.00 0.00 0.00 175.76 176.99 2jtd s THR 101 N -0.52 3.91 -0.31 0.00 -4.23 -1.26 -1.18 115.64 112.06 2jtd s THR 101 Ca 0.34 -0.71 -0.05 0.00 -1.18 0.00 0.00 61.69 60.08 2jtd s THR 101 Cb -0.20 -3.02 0.03 0.00 1.34 0.00 0.00 72.50 70.65 2jtd s THR 101 CO 0.21 0.08 0.06 -0.83 -0.54 0.00 0.00 174.62 173.60 2jtd s GLY 102 N 1.49 1.79 -0.15 3.99 0.00 0.12 -4.91 107.32 109.64 2jtd s GLY 102 Ca 0.02 -1.62 -0.04 0.00 0.00 0.00 0.00 44.72 43.08 2jtd s GLY 102 CO 0.02 0.69 -0.01 -2.38 0.00 0.00 0.00 173.10 171.43 2jtd s HIS 103 N 1.40 3.11 -0.38 1.90 -3.43 -1.26 -0.73 115.29 115.90 2jtd s HIS 103 Ca -0.01 -0.11 -0.10 0.00 -0.80 0.00 0.00 55.06 54.05 2jtd s HIS 103 Cb -0.18 -1.95 0.04 0.00 -1.43 0.00 0.00 32.58 29.05 2jtd s HIS 103 CO 0.01 0.11 0.20 0.45 -2.00 0.00 0.00 174.74 173.52 2jtd s SER 104 N 0.11 5.65 -0.28 7.38 0.15 0.18 -4.91 113.70 121.98 2jtd s SER 104 Ca 0.01 -1.12 -0.13 0.00 0.70 0.00 0.00 55.95 55.41 2jtd s SER 104 Cb -0.13 -1.99 -0.04 0.00 -1.71 0.00 0.00 66.02 62.15 2jtd s SER 104 CO 0.02 -0.41 0.28 -0.89 1.20 0.00 0.00 173.24 173.44 2jtd s THR 105 N 1.50 5.25 -0.04 6.45 2.01 -1.26 -1.54 115.64 128.02 2jtd s THR 105 Ca 0.01 0.29 -0.01 0.00 0.31 0.00 0.00 61.69 62.29 2jtd s THR 105 Cb -0.20 -3.63 0.03 0.00 0.01 0.00 0.00 72.50 68.72 2jtd s THR 105 CO 0.05 0.17 0.06 -0.22 -0.69 0.00 0.00 174.62 174.00 2jtd s LEU 106 N 1.90 0.63 -0.19 4.42 1.98 0.49 -5.01 118.68 122.91 2jtd s LEU 106 Ca 0.10 0.11 -0.02 0.00 -2.89 0.00 0.00 54.13 51.43 2jtd s LEU 106 Cb -0.16 -0.01 -0.00 0.00 0.66 0.00 0.00 46.19 46.68 2jtd s LEU 106 CO 0.11 -0.18 -0.10 0.54 -1.89 0.00 0.00 176.35 174.82 2jtd s VAL 107 N 1.54 2.96 -0.30 1.68 0.11 -1.26 -0.25 120.40 124.89 2jtd s VAL 107 Ca -0.04 -0.64 0.02 0.00 -2.93 0.00 0.00 61.98 58.39 2jtd s VAL 107 Cb -0.12 -2.31 0.08 0.00 -1.53 0.00 0.00 36.38 32.50 2jtd s VAL 107 CO -0.04 0.47 0.01 -0.76 -3.33 0.00 0.00 175.10 171.46 2jtd s LEU 108 N 1.19 3.57 -0.06 2.54 1.43 0.12 -4.67 118.68 122.79 2jtd s LEU 108 Ca 0.02 -1.71 -0.02 0.00 -1.03 0.00 0.00 54.13 51.38 2jtd s LEU 108 Cb -0.14 -1.36 0.04 0.00 0.03 0.00 0.00 46.19 44.75 2jtd s LEU 108 CO -0.04 -0.32 0.12 -0.63 0.23 0.00 0.00 176.35 175.71 2jtd s ILE 109 N 1.19 -0.12 0.00 -0.59 1.01 -1.26 -1.97 121.20 119.46 2jtd s ILE 109 Ca 0.04 0.26 0.00 0.00 0.00 0.00 0.00 60.65 60.95 2jtd s ILE 109 Cb -0.19 -0.22 0.00 0.00 0.01 0.00 0.00 42.46 42.06 2jtd s ILE 109 CO -0.10 0.11 0.00 0.61 0.00 0.00 0.00 174.94 175.55 2jtd n GLY 110 N 4.62 2.63 0.35 6.18 0.00 -1.26 -0.20 105.19 117.50 2jtd n GLY 110 Ca -0.18 0.24 0.13 0.00 0.00 0.00 0.00 46.02 46.20 2jtd n GLY 110 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2jtd h ASP 111 N 0.00 0.26 0.06 1.61 3.58 -1.99 -2.64 116.42 117.29 2jtd h ASP 111 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.46 2jtd h ASP 111 Cb 0.00 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 40.99 2jtd h ASP 111 CO 0.00 0.16 -0.06 0.58 -2.88 0.00 0.00 179.24 177.04 2jtd h VAL 112 N 0.29 0.87 0.00 2.25 2.07 -0.97 -2.33 116.25 118.43 2jtd h VAL 112 Ca 0.23 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.75 2jtd h VAL 112 Cb 0.54 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 2jtd h VAL 112 CO -0.05 0.00 0.00 0.10 0.02 0.00 0.00 177.57 177.64 2jtd h TYR 113 N -0.13 0.00 -0.09 1.57 -0.00 -1.47 -2.99 116.97 113.86 2jtd h TYR 113 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 58.73 58.58 2jtd h TYR 113 Cb 0.12 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.84 2jtd h TYR 113 CO -0.10 0.00 -0.63 1.57 -0.00 0.00 0.00 178.16 179.00 2jtd h LYS 114 N 0.00 0.32 -0.05 0.10 2.10 -1.24 -2.37 116.57 115.43 2jtd h LYS 114 Ca 0.00 -0.23 -0.25 0.00 -2.00 0.00 0.00 60.65 58.17 2jtd h LYS 114 Cb 0.61 0.04 0.02 0.00 -0.90 0.00 0.00 32.23 32.00 2jtd h LYS 114 CO 0.00 0.85 -0.95 -0.22 -2.00 0.00 0.00 179.45 177.13 2jtd h LYS 115 N 0.24 0.72 -0.68 0.07 3.64 -1.36 -1.53 116.57 117.67 2jtd h LYS 115 Ca -0.01 -0.71 -0.00 0.00 -1.27 0.00 0.00 60.65 58.66 2jtd h LYS 115 Cb 1.16 0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 33.13 2jtd h LYS 115 CO 0.10 1.29 0.41 -0.07 -2.27 0.00 0.00 179.45 178.92 2jtd h LEU 116 N 0.44 0.81 -0.22 5.20 4.07 -1.52 0.30 115.31 124.38 2jtd h LEU 116 Ca -0.10 -0.04 -0.03 0.00 0.08 0.00 0.00 57.88 57.79 2jtd h LEU 116 Cb 1.59 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 43.12 2jtd h LEU 116 CO 0.19 0.62 0.04 1.56 -1.08 0.00 0.00 178.44 179.77 2jtd h GLN 117 N 0.94 0.36 -0.16 1.13 4.20 -1.33 -1.24 115.11 119.01 2jtd h GLN 117 Ca 0.25 -0.10 -0.04 0.00 0.06 0.00 0.00 58.65 58.81 2jtd h GLN 117 Cb -0.04 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 2jtd h GLN 117 CO -0.05 0.50 -0.10 -0.22 -0.67 0.00 0.00 178.83 178.30 2jtd h LYS 118 N 0.17 0.25 -0.04 1.46 3.64 -0.38 0.51 116.57 122.18 2jtd h LYS 118 Ca 0.07 -0.05 -0.23 0.00 -1.27 0.00 0.00 60.65 59.17 2jtd h LYS 118 Cb 0.31 -0.04 0.02 0.00 -0.41 0.00 0.00 32.23 32.11 2jtd h LYS 118 CO 0.00 0.36 -0.86 0.93 -2.27 0.00 0.00 179.45 177.62 2jtd h GLU 119 N 0.24 0.64 -0.04 1.90 4.39 -0.33 -3.31 114.58 118.07 2jtd h GLU 119 Ca 0.05 -0.65 -0.14 0.00 0.34 0.00 0.00 59.36 58.97 2jtd h GLU 119 Cb 0.33 0.17 0.01 0.00 -0.10 0.00 0.00 28.75 29.17 2jtd h GLU 119 CO 0.02 1.25 -0.51 0.00 -1.16 0.00 0.00 179.01 178.61 2jtd h ALA 120 N 0.41 0.12 -2.71 3.43 0.00 -0.95 -3.38 119.26 116.18 2jtd h ALA 120 Ca -0.10 -0.52 -0.78 0.00 0.00 0.00 0.00 54.91 53.51 2jtd h ALA 120 Cb 1.52 0.01 -0.26 0.00 0.00 0.00 0.00 17.79 19.07 2jtd h ALA 120 CO 0.17 0.32 0.22 -1.21 0.00 0.00 0.00 179.25 178.75 2jtd s GLU 121 N -3.41 3.70 0.00 0.00 0.41 0.18 -5.08 118.70 114.49 2jtd s GLU 121 Ca -0.13 -2.52 0.00 0.00 -0.41 0.00 0.00 54.97 51.91 2jtd s GLU 121 Cb 0.04 -4.49 0.00 0.00 -1.78 0.00 0.00 34.13 27.90 2jtd s GLU 121 CO 0.81 -1.33 0.15 0.34 -0.49 0.00 0.00 175.26 174.74