#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jp2 s SER 2 N 0.00 4.89 -0.33 1.61 0.01 -1.26 -4.59 113.70 114.04 2jp2 s SER 2 Ca 0.00 -0.03 0.15 0.00 1.31 0.00 0.00 55.95 57.38 2jp2 s SER 2 Cb 0.00 -2.54 0.44 0.00 0.21 0.00 0.00 66.02 64.13 2jp2 s SER 2 CO 0.00 -2.83 1.34 0.80 0.41 0.00 0.00 173.24 172.96 2jp2 n MET 3 N 8.97 1.40 -3.48 12.44 0.00 -1.26 -5.10 117.12 130.09 2jp2 n MET 3 Ca 0.35 -2.13 -0.41 0.00 -0.00 0.00 0.00 57.70 55.51 2jp2 n MET 3 Cb 0.49 -0.35 -0.10 0.00 0.00 0.00 0.00 33.22 33.25 2jp2 n MET 3 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 2jp2 s THR 4 N -1.19 5.26 0.44 1.12 -4.23 -1.26 -5.06 115.64 110.71 2jp2 s THR 4 Ca 0.18 -0.36 0.04 0.00 -1.18 0.00 0.00 61.69 60.37 2jp2 s THR 4 Cb 0.41 -3.82 -0.05 0.00 1.34 0.00 0.00 72.50 70.39 2jp2 s THR 4 CO -0.08 -0.14 0.02 -1.61 -0.54 0.00 0.00 174.62 172.27 2jp2 s GLU 5 N 1.75 2.01 0.00 3.99 2.02 -1.26 -4.89 118.70 122.32 2jp2 s GLU 5 Ca 0.06 -2.21 0.00 0.00 0.02 0.00 0.00 54.97 52.85 2jp2 s GLU 5 Cb -0.18 -1.40 0.00 0.00 0.10 0.00 0.00 34.13 32.65 2jp2 s GLU 5 CO 0.11 -0.23 0.00 -1.91 0.02 0.00 0.00 175.26 173.24 2jp2 n GLU 6 N -1.04 0.00 -2.95 1.61 0.00 -1.26 -4.87 120.64 112.12 2jp2 n GLU 6 Ca -0.10 0.00 -0.02 0.00 0.00 0.00 0.00 57.16 57.04 2jp2 n GLU 6 Cb 0.67 0.00 -0.01 0.00 0.00 0.00 0.00 31.44 32.09 2jp2 n GLU 6 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 2jp2 n THR 7 N 0.00 -4.68 0.10 6.31 -2.24 -1.26 -4.57 114.28 107.94 2jp2 n THR 7 Ca 0.00 0.86 0.00 0.00 -2.27 0.00 0.00 64.05 62.64 2jp2 n THR 7 Cb 0.00 -3.79 0.00 0.00 -2.10 0.00 0.00 70.33 64.44 2jp2 n THR 7 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2jp2 n HIS 8 N 2.14 -2.70 -0.53 4.78 8.25 -1.26 -2.84 115.22 123.05 2jp2 n HIS 8 Ca -0.11 0.59 -0.01 0.00 -0.26 0.00 0.00 57.72 57.93 2jp2 n HIS 8 Cb 0.22 1.61 -0.01 0.00 1.12 0.00 0.00 29.99 32.93 2jp2 n HIS 8 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2jp2 n PRO 9 N -2.99 1.06 0.00 -0.41 -0.04 -1.26 -2.67 135.00 128.69 2jp2 n PRO 9 Ca 0.00 -0.07 0.00 0.00 -0.04 0.00 0.00 63.50 63.39 2jp2 n PRO 9 Cb 0.00 -1.08 0.00 0.00 -0.04 0.00 0.00 33.50 32.38 2jp2 n PRO 9 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2jp2 n ASP 10 N 1.58 0.00 -1.35 3.54 2.03 -1.26 -5.14 116.55 115.96 2jp2 n ASP 10 Ca 0.03 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.34 2jp2 n ASP 10 Cb 0.52 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.92 2jp2 n ASP 10 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2jp2 n ASP 11 N -0.34 -1.98 0.00 1.67 9.92 -1.09 -5.06 116.55 119.67 2jp2 n ASP 11 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 2jp2 n ASP 11 Cb 0.00 -0.99 0.00 0.00 -0.64 0.00 0.00 41.12 39.49 2jp2 n ASP 11 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 2jp2 n ASP 12 N 0.00 0.00 -0.08 -2.24 8.00 -1.22 -4.89 116.55 116.12 2jp2 n ASP 12 Ca 0.00 0.00 0.13 0.00 0.71 0.00 0.00 54.79 55.63 2jp2 n ASP 12 Cb 0.00 0.00 0.33 0.00 -0.02 0.00 0.00 41.12 41.43 2jp2 n ASP 12 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2jp2 n SER 13 N -0.19 0.64 -4.85 -2.24 7.64 -1.13 -4.90 113.62 108.58 2jp2 n SER 13 Ca 0.00 -0.43 -0.34 0.00 1.01 0.00 0.00 58.87 59.11 2jp2 n SER 13 Cb 0.00 0.16 -0.06 0.00 -1.01 0.00 0.00 64.21 63.30 2jp2 n SER 13 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2jp2 s TYR 14 N -2.81 3.49 -0.18 1.43 2.02 -1.26 -2.19 117.35 117.84 2jp2 s TYR 14 Ca 0.16 1.12 0.04 0.00 -0.37 0.00 0.00 57.07 58.03 2jp2 s TYR 14 Cb 0.18 -2.44 -0.13 0.00 -0.40 0.00 0.00 41.96 39.17 2jp2 s TYR 14 CO 0.62 0.26 -0.12 -0.89 -1.57 0.00 0.00 175.55 173.85 2jp2 n ILE 15 N 0.15 1.04 -4.11 2.71 2.08 -0.35 -4.90 119.36 115.97 2jp2 n ILE 15 Ca -0.00 -0.45 -0.15 0.00 0.56 0.00 0.00 62.75 62.71 2jp2 n ILE 15 Cb 0.52 -1.04 -0.13 0.00 -0.75 0.00 0.00 39.64 38.24 2jp2 n ILE 15 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 2jp2 s VAL 16 N -2.36 0.42 -0.43 1.39 1.01 -1.14 -5.04 120.40 114.24 2jp2 s VAL 16 Ca -0.21 -0.46 0.05 0.00 0.00 0.00 0.00 61.98 61.35 2jp2 s VAL 16 Cb 0.06 -0.40 0.17 0.00 0.00 0.00 0.00 36.38 36.21 2jp2 s VAL 16 CO 0.46 -0.04 0.47 -0.60 0.00 0.00 0.00 175.10 175.39 2jp2 s ARG 17 N -0.55 0.86 -0.05 2.72 3.52 -1.26 0.37 118.95 124.56 2jp2 s ARG 17 Ca -0.02 -1.31 -0.00 0.00 -0.13 0.00 0.00 55.73 54.27 2jp2 s ARG 17 Cb -0.04 -0.73 -0.03 0.00 -1.56 0.00 0.00 34.95 32.59 2jp2 s ARG 17 CO -0.00 -1.30 -0.00 0.08 -0.81 0.00 0.00 175.30 173.27 2jp2 s VAL 18 N 0.84 4.23 -0.08 7.11 1.01 -0.92 -4.87 120.40 127.72 2jp2 s VAL 18 Ca 0.26 -0.39 -0.27 0.00 0.00 0.00 0.00 61.98 61.58 2jp2 s VAL 18 Cb -0.04 -2.82 -0.02 0.00 0.00 0.00 0.00 36.38 33.49 2jp2 s VAL 18 CO -0.09 0.52 0.87 -1.59 0.00 0.00 0.00 175.10 174.81 2jp2 s LYS 19 N -1.14 4.43 0.27 2.72 0.00 -1.26 -0.34 119.74 124.43 2jp2 s LYS 19 Ca 0.16 1.17 -0.10 0.00 0.00 0.00 0.00 55.97 57.20 2jp2 s LYS 19 Cb -0.11 -3.50 -0.00 0.00 0.00 0.00 0.00 37.83 34.21 2jp2 s LYS 19 CO 0.05 -0.14 0.46 0.00 0.00 0.00 0.00 175.35 175.72 2jp2 s ALA 20 N 1.44 0.04 -0.78 0.59 0.00 0.03 -4.86 121.76 118.22 2jp2 s ALA 20 Ca 0.44 -1.06 -0.23 0.00 0.00 0.00 0.00 51.96 51.11 2jp2 s ALA 20 Cb -0.18 1.10 0.07 0.00 0.00 0.00 0.00 23.12 24.10 2jp2 s ALA 20 CO 0.19 -0.83 1.15 0.08 0.00 0.00 0.00 175.76 176.35 2jp2 s VAL 21 N -3.78 4.17 -0.38 0.00 1.01 -1.02 0.04 120.40 120.45 2jp2 s VAL 21 Ca 0.25 -0.42 -0.29 0.00 0.00 0.00 0.00 61.98 61.52 2jp2 s VAL 21 Cb -0.00 -4.82 0.02 0.00 0.00 0.00 0.00 36.38 31.58 2jp2 s VAL 21 CO 0.11 -1.64 1.14 -0.69 0.00 0.00 0.00 175.10 174.02 2jp2 s VAL 22 N 4.42 4.33 0.19 2.92 1.01 -1.20 -0.20 120.40 131.87 2jp2 s VAL 22 Ca 0.31 1.47 0.03 0.00 0.00 0.00 0.00 61.98 63.78 2jp2 s VAL 22 Cb -0.10 -4.45 -0.03 0.00 0.00 0.00 0.00 36.38 31.79 2jp2 s VAL 22 CO 0.05 -0.69 0.33 -0.04 0.00 0.00 0.00 175.10 174.75 2jp2 s MET 23 N 4.06 3.45 0.01 2.72 -1.94 0.23 -3.96 119.30 123.87 2jp2 s MET 23 Ca 0.48 -0.60 0.04 0.00 -1.71 0.00 0.00 55.69 53.90 2jp2 s MET 23 Cb -0.11 -2.91 -0.01 0.00 2.01 0.00 0.00 34.83 33.80 2jp2 s MET 23 CO 0.23 0.46 -0.13 -0.08 -0.01 0.00 0.00 175.02 175.49 2jp2 s THR 24 N -1.85 1.02 -0.58 2.05 -1.32 -0.67 -0.61 115.64 113.67 2jp2 s THR 24 Ca 0.35 -0.70 -0.19 0.00 -1.21 0.00 0.00 61.69 59.94 2jp2 s THR 24 Cb -0.10 -0.88 0.09 0.00 -1.51 0.00 0.00 72.50 70.10 2jp2 s THR 24 CO 0.29 0.17 0.71 -0.60 -2.21 0.00 0.00 174.62 172.98 2jp2 s ARG 25 N -0.60 3.07 -0.14 7.08 3.00 -1.08 -2.07 118.95 128.21 2jp2 s ARG 25 Ca 0.03 -1.18 -0.36 0.00 -1.00 0.00 0.00 55.73 53.22 2jp2 s ARG 25 Cb -0.06 -4.22 -0.13 0.00 0.00 0.00 0.00 34.95 30.53 2jp2 s ARG 25 CO 0.00 -1.49 1.81 -3.47 0.00 0.00 0.00 175.30 172.15 2jp2 n ASP 26 N 6.41 3.01 -4.12 -2.12 2.03 -1.26 -4.58 116.55 115.91 2jp2 n ASP 26 Ca -0.08 1.02 -0.55 0.00 0.52 0.00 0.00 54.79 55.69 2jp2 n ASP 26 Cb 0.43 -1.29 -0.12 0.00 -0.72 0.00 0.00 41.12 39.43 2jp2 n ASP 26 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2jp2 n ASP 27 N 5.95 0.66 -3.26 1.67 2.03 -1.26 -2.06 116.55 120.28 2jp2 n ASP 27 Ca 0.24 0.59 -0.23 0.00 0.52 0.00 0.00 54.79 55.90 2jp2 n ASP 27 Cb 0.23 -0.87 0.02 0.00 -0.72 0.00 0.00 41.12 39.79 2jp2 n ASP 27 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 2jp2 n SER 28 N 7.61 -6.40 0.01 1.67 3.41 -1.26 -4.99 113.62 113.66 2jp2 n SER 28 Ca 0.54 0.20 0.00 0.00 -0.26 0.00 0.00 58.87 59.35 2jp2 n SER 28 Cb -0.03 -2.73 0.00 0.00 -0.26 0.00 0.00 64.21 61.19 2jp2 n SER 28 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2jp2 n SER 29 N 0.09 0.02 0.00 4.04 2.88 -0.88 -5.12 113.62 114.66 2jp2 n SER 29 Ca -0.02 0.02 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2jp2 n SER 29 Cb 0.56 0.01 0.00 0.00 -0.75 0.00 0.00 64.21 64.02 2jp2 n SER 29 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jp2 n GLY 30 N 2.39 -1.37 0.00 0.46 0.00 -1.26 -5.13 105.19 100.28 2jp2 n GLY 30 Ca 0.00 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.54 2jp2 n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jp2 n GLY 31 N 0.00 5.27 3.28 -0.02 0.00 -1.26 -5.12 105.19 107.34 2jp2 n GLY 31 Ca 0.00 -1.23 -0.24 0.00 0.00 0.00 0.00 46.02 44.55 2jp2 n GLY 31 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2jp2 s TRP 32 N 3.21 1.78 0.02 1.61 0.52 -1.26 -4.37 118.94 120.45 2jp2 s TRP 32 Ca 0.00 -0.41 -0.13 0.00 0.02 0.00 0.00 56.10 55.58 2jp2 s TRP 32 Cb 0.00 -0.99 0.02 0.00 -1.15 0.00 0.00 33.47 31.35 2jp2 s TRP 32 CO 0.00 0.19 0.28 -0.59 0.02 0.00 0.00 176.95 176.85 2jp2 s PHE 33 N -1.12 -0.10 0.10 -1.98 -0.71 -0.88 -4.99 117.98 108.31 2jp2 s PHE 33 Ca 0.06 0.03 -0.31 0.00 -1.04 0.00 0.00 56.93 55.68 2jp2 s PHE 33 Cb -0.10 0.07 -0.09 0.00 -1.21 0.00 0.00 43.02 41.69 2jp2 s PHE 33 CO 0.04 -0.44 1.71 -1.25 -1.34 0.00 0.00 175.22 173.94 2jp2 s PRO 34 N -2.05 4.17 0.00 1.99 0.04 -1.26 -1.67 135.00 136.21 2jp2 s PRO 34 Ca -0.09 2.44 0.00 0.00 0.04 0.00 0.00 61.00 63.39 2jp2 s PRO 34 Cb -0.03 -3.54 0.00 0.00 0.04 0.00 0.00 34.50 30.97 2jp2 s PRO 34 CO -0.00 -0.76 0.00 0.00 0.04 0.00 0.00 177.00 176.27 2jp2 n GLN 35 N 5.44 -0.81 0.16 4.56 -0.00 -1.25 -4.57 117.38 120.90 2jp2 n GLN 35 Ca 0.16 0.00 0.08 0.00 -0.00 0.00 0.00 57.00 57.25 2jp2 n GLN 35 Cb 0.39 0.00 0.45 0.00 -0.00 0.00 0.00 30.24 31.09 2jp2 n GLN 35 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 2jp2 n GLU 36 N -1.34 0.11 -0.16 2.61 1.02 -1.26 0.36 120.64 121.97 2jp2 n GLU 36 Ca 0.00 0.60 -0.11 0.00 -0.02 0.00 0.00 57.16 57.63 2jp2 n GLU 36 Cb 0.00 -2.02 -0.00 0.00 -0.02 0.00 0.00 31.44 29.40 2jp2 n GLU 36 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 2jp2 h GLY 37 N 0.00 1.03 0.00 0.62 0.00 -1.91 -3.47 103.07 99.34 2jp2 h GLY 37 Ca 0.00 -0.86 0.00 0.00 0.00 0.00 0.00 47.33 46.47 2jp2 h GLY 37 CO 0.00 0.79 0.00 0.61 0.00 0.00 0.00 176.54 177.94 2jp2 n GLY 38 N -0.19 2.27 0.00 4.60 0.00 0.16 -4.62 105.19 107.41 2jp2 n GLY 38 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.91 2jp2 n GLY 38 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jp2 n GLY 39 N 0.00 0.18 3.73 -0.02 0.00 -1.26 -4.78 105.19 103.03 2jp2 n GLY 39 Ca 0.00 0.46 -0.42 0.00 0.00 0.00 0.00 46.02 46.07 2jp2 n GLY 39 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jp2 s ILE 40 N 1.51 2.12 0.02 -0.61 1.09 -1.26 -3.22 121.20 120.85 2jp2 s ILE 40 Ca 0.00 0.09 -0.09 0.00 -1.10 0.00 0.00 60.65 59.56 2jp2 s ILE 40 Cb 0.00 -3.06 0.00 0.00 -1.06 0.00 0.00 42.46 38.34 2jp2 s ILE 40 CO 0.00 0.01 0.17 -0.44 -0.10 0.00 0.00 174.94 174.58 2jp2 s SER 41 N 0.92 0.04 -0.52 3.58 0.01 0.11 -3.77 113.70 114.07 2jp2 s SER 41 Ca 0.70 -0.31 -0.28 0.00 1.31 0.00 0.00 55.95 57.37 2jp2 s SER 41 Cb -0.48 0.25 -0.00 0.00 0.21 0.00 0.00 66.02 66.00 2jp2 s SER 41 CO 0.38 -0.48 1.60 -0.13 0.41 0.00 0.00 173.24 175.01 2jp2 s ARG 42 N -2.10 3.16 -0.99 12.44 1.81 0.95 -0.79 118.95 133.43 2jp2 s ARG 42 Ca -0.09 0.72 -0.21 0.00 -1.72 0.00 0.00 55.73 54.43 2jp2 s ARG 42 Cb -0.03 -4.20 0.08 0.00 -0.45 0.00 0.00 34.95 30.35 2jp2 s ARG 42 CO -0.02 -2.09 1.34 0.08 -0.68 0.00 0.00 175.30 173.93 2jp2 s VAL 43 N 6.91 4.22 -0.57 3.52 1.01 0.54 -1.20 120.40 134.83 2jp2 s VAL 43 Ca 0.62 -1.07 -0.23 0.00 0.00 0.00 0.00 61.98 61.30 2jp2 s VAL 43 Cb -0.14 -4.96 0.05 0.00 0.00 0.00 0.00 36.38 31.34 2jp2 s VAL 43 CO 0.26 -1.78 0.90 -0.83 0.00 0.00 0.00 175.10 173.64 2jp2 s GLY 44 N 4.48 1.46 -1.06 4.51 0.00 0.67 -2.16 107.32 115.22 2jp2 s GLY 44 Ca 0.41 -1.49 -0.22 0.00 0.00 0.00 0.00 44.72 43.43 2jp2 s GLY 44 CO -0.10 1.96 1.48 0.14 0.00 0.00 0.00 173.10 176.58 2jp2 s VAL 45 N 3.77 4.00 0.27 1.40 1.01 0.16 -1.02 120.40 129.98 2jp2 s VAL 45 Ca 0.26 -1.00 -0.18 0.00 0.00 0.00 0.00 61.98 61.06 2jp2 s VAL 45 Cb -0.15 -5.07 -0.09 0.00 0.00 0.00 0.00 36.38 31.08 2jp2 s VAL 45 CO 0.15 -1.93 0.73 0.00 0.00 0.00 0.00 175.10 174.06 2jp2 s LYS 47 N -2.39 0.35 -0.17 0.00 2.20 -0.93 -0.55 119.74 118.25 2jp2 s LYS 47 Ca 0.48 -0.63 -0.10 0.00 -0.36 0.00 0.00 55.97 55.35 2jp2 s LYS 47 Cb -0.14 -1.01 -0.05 0.00 -1.51 0.00 0.00 37.83 35.12 2jp2 s LYS 47 CO 0.19 -1.08 0.18 0.14 -0.36 0.00 0.00 175.35 174.42 2jp2 s VAL 48 N 1.88 5.40 0.54 4.02 -7.23 -0.06 -4.89 120.40 120.06 2jp2 s VAL 48 Ca 0.12 0.29 -0.18 0.00 -1.81 0.00 0.00 61.98 60.40 2jp2 s VAL 48 Cb -0.17 -3.50 -0.06 0.00 0.56 0.00 0.00 36.38 33.22 2jp2 s VAL 48 CO -0.24 0.48 1.06 0.00 -0.31 0.00 0.00 175.10 176.08 2jp2 s MET 49 N 0.00 3.53 -0.24 4.82 0.23 -1.26 0.62 119.30 126.99 2jp2 s MET 49 Ca 0.12 1.35 -0.16 0.00 -1.03 0.00 0.00 55.69 55.96 2jp2 s MET 49 Cb -0.12 -2.05 -0.03 0.00 -1.53 0.00 0.00 34.83 31.09 2jp2 s MET 49 CO 0.01 -0.66 0.44 -1.01 -2.03 0.00 0.00 175.02 171.77 2jp2 s HIS 50 N -2.13 3.29 0.16 3.16 3.76 -0.99 -4.78 115.29 117.76 2jp2 s HIS 50 Ca 0.67 0.57 -0.23 0.00 -0.15 0.00 0.00 55.06 55.92 2jp2 s HIS 50 Cb -0.18 -2.62 0.04 0.00 1.11 0.00 0.00 32.58 30.94 2jp2 s HIS 50 CO 0.28 -0.18 1.61 -1.35 -0.85 0.00 0.00 174.74 174.24 2jp2 h PRO 51 N 7.86 -0.26 -2.29 8.40 0.11 -1.94 -3.43 132.00 140.46 2jp2 h PRO 51 Ca -0.32 0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.78 2jp2 h PRO 51 Cb 1.15 0.06 -0.24 0.00 0.11 0.00 0.00 31.00 32.09 2jp2 h PRO 51 CO 0.69 -0.17 -0.18 -2.00 -0.21 0.00 0.00 178.00 176.13 2jp2 s GLU 52 N -6.02 0.51 0.00 1.05 -6.30 -1.26 -5.14 118.70 101.54 2jp2 s GLU 52 Ca -0.15 1.12 0.00 0.00 -2.50 0.00 0.00 54.97 53.44 2jp2 s GLU 52 Cb 0.13 0.29 0.00 0.00 0.00 0.00 0.00 34.13 34.55 2jp2 s GLU 52 CO 0.68 -0.18 0.00 0.41 0.02 0.00 0.00 175.26 176.18 2jp2 n GLY 53 N 4.78 0.27 3.73 -1.50 0.00 -1.26 -5.09 105.19 106.11 2jp2 n GLY 53 Ca -0.17 -1.51 -0.37 0.00 0.00 0.00 0.00 46.02 43.98 2jp2 n GLY 53 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2jp2 s ASN 54 N -4.00 6.46 0.00 1.61 2.47 -1.26 -4.96 114.94 115.26 2jp2 s ASN 54 Ca 0.00 0.54 0.00 0.00 0.42 0.00 0.00 52.86 53.82 2jp2 s ASN 54 Cb 0.00 -2.19 0.00 0.00 -1.45 0.00 0.00 41.25 37.61 2jp2 s ASN 54 CO 0.00 0.09 0.00 0.61 -3.72 0.00 0.00 177.10 174.08 2jp2 n GLY 55 N 3.38 3.61 0.08 1.21 0.00 -1.26 -5.03 105.19 107.18 2jp2 n GLY 55 Ca -0.11 -1.58 -0.10 0.00 0.00 0.00 0.00 46.02 44.24 2jp2 n GLY 55 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2jp2 h ARG 56 N 0.00 0.00 -2.30 1.61 2.43 -1.93 -3.42 114.38 110.78 2jp2 h ARG 56 Ca 0.00 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.12 2jp2 h ARG 56 Cb 0.00 0.00 -0.23 0.00 -0.42 0.00 0.00 29.97 29.32 2jp2 h ARG 56 CO 0.00 0.39 -0.09 -1.12 -1.51 0.00 0.00 179.97 177.65 2jp2 s SER 57 N -6.06 -0.70 0.39 -3.80 0.01 -1.26 -2.35 113.70 99.92 2jp2 s SER 57 Ca -0.16 1.22 -0.23 0.00 1.31 0.00 0.00 55.95 58.08 2jp2 s SER 57 Cb 0.02 1.15 -0.10 0.00 0.21 0.00 0.00 66.02 67.30 2jp2 s SER 57 CO 0.33 -0.21 0.98 -0.83 0.41 0.00 0.00 173.24 173.92 2jp2 s GLY 58 N 1.06 2.62 -0.24 3.44 0.00 0.20 -4.80 107.32 109.60 2jp2 s GLY 58 Ca -0.06 0.52 -0.08 0.00 0.00 0.00 0.00 44.72 45.10 2jp2 s GLY 58 CO -0.10 0.89 0.10 -1.36 0.00 0.00 0.00 173.10 172.63 2jp2 s PHE 59 N -1.86 3.15 -0.41 1.90 0.40 -1.08 -0.88 117.98 119.20 2jp2 s PHE 59 Ca 0.57 -0.17 -0.12 0.00 -0.60 0.00 0.00 56.93 56.61 2jp2 s PHE 59 Cb -0.16 -2.24 0.05 0.00 0.51 0.00 0.00 43.02 41.19 2jp2 s PHE 59 CO 0.20 -0.19 0.27 -1.17 0.70 0.00 0.00 175.22 175.03 2jp2 s LEU 60 N 1.36 5.09 -0.87 -0.37 0.20 0.28 -0.49 118.68 123.89 2jp2 s LEU 60 Ca 0.06 -1.23 -0.25 0.00 0.69 0.00 0.00 54.13 53.40 2jp2 s LEU 60 Cb -0.15 -2.06 -0.03 0.00 -0.43 0.00 0.00 46.19 43.53 2jp2 s LEU 60 CO 0.05 -0.50 1.84 -0.63 -0.29 0.00 0.00 176.35 176.82 2jp2 s ILE 61 N 1.54 3.51 -0.56 6.68 1.01 0.13 -1.86 121.20 131.64 2jp2 s ILE 61 Ca 0.03 -0.30 -0.17 0.00 0.00 0.00 0.00 60.65 60.20 2jp2 s ILE 61 Cb -0.22 -4.17 0.11 0.00 0.01 0.00 0.00 42.46 38.20 2jp2 s ILE 61 CO 0.05 -1.11 0.60 -2.28 0.00 0.00 0.00 174.94 172.21 2jp2 s HIS 62 N 9.08 3.12 -0.37 3.97 2.46 -0.19 -1.59 115.29 131.77 2jp2 s HIS 62 Ca 0.65 -1.09 -0.14 0.00 0.47 0.00 0.00 55.06 54.94 2jp2 s HIS 62 Cb -0.07 -3.87 0.00 0.00 -0.13 0.00 0.00 32.58 28.51 2jp2 s HIS 62 CO 0.02 -1.14 0.29 0.20 -2.47 0.00 0.00 174.74 171.64 2jp2 s GLY 63 N 3.55 1.97 -0.10 1.59 0.00 0.73 -0.24 107.32 114.81 2jp2 s GLY 63 Ca 0.07 -1.49 -0.02 0.00 0.00 0.00 0.00 44.72 43.28 2jp2 s GLY 63 CO 0.05 0.89 -0.00 -0.54 0.00 0.00 0.00 173.10 173.50 2jp2 s GLU 64 N 1.78 3.12 0.15 2.90 2.02 -0.34 -0.65 118.70 127.67 2jp2 s GLU 64 Ca 0.07 -0.42 -0.31 0.00 0.02 0.00 0.00 54.97 54.33 2jp2 s GLU 64 Cb -0.18 -2.83 -0.09 0.00 0.10 0.00 0.00 34.13 31.14 2jp2 s GLU 64 CO 0.11 0.62 1.43 0.50 0.02 0.00 0.00 175.26 177.94 2jp2 s ARG 65 N -0.66 4.30 0.78 1.61 3.52 -0.78 -0.04 118.95 127.68 2jp2 s ARG 65 Ca 0.11 2.16 -0.14 0.00 -0.13 0.00 0.00 55.73 57.73 2jp2 s ARG 65 Cb -0.12 -3.21 0.05 0.00 -1.56 0.00 0.00 34.95 30.12 2jp2 s ARG 65 CO 0.02 -0.46 1.10 0.94 -0.81 0.00 0.00 175.30 176.10 2jp2 n GLN 66 N 3.69 0.31 0.00 5.12 -0.06 -1.25 -0.43 117.38 124.77 2jp2 n GLN 66 Ca 0.11 0.17 0.00 0.00 -2.00 0.00 0.00 57.00 55.29 2jp2 n GLN 66 Cb 0.41 -2.36 0.00 0.00 -4.06 0.00 0.00 30.24 24.24 2jp2 n GLN 66 CO 0.00 0.00 0.00 1.17 -0.20 0.00 0.00 177.06 178.03 2jp2 n LYS 67 N -2.71 0.00 -0.02 3.69 4.81 -1.26 -4.02 118.16 118.65 2jp2 n LYS 67 Ca 0.13 0.00 -0.07 0.00 -0.87 0.00 0.00 58.31 57.50 2jp2 n LYS 67 Cb 0.50 0.00 0.10 0.00 0.02 0.00 0.00 35.03 35.65 2jp2 n LYS 67 CO 0.00 0.00 0.00 0.22 1.17 0.00 0.00 177.40 178.79 2jp2 h ASP 68 N 0.00 0.64 -4.99 3.14 3.58 -2.00 -3.48 116.42 113.30 2jp2 h ASP 68 Ca 0.00 -0.27 0.00 0.00 0.42 0.00 0.00 57.03 57.18 2jp2 h ASP 68 Cb 0.00 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 40.87 2jp2 h ASP 68 CO 0.00 0.95 -0.69 0.29 -2.88 0.00 0.00 179.24 176.91 2jp2 n LYS 69 N -4.04 -2.71 -3.75 0.28 5.02 0.43 -5.04 118.16 108.35 2jp2 n LYS 69 Ca -0.01 2.30 -0.12 0.00 -2.02 0.00 0.00 58.31 58.46 2jp2 n LYS 69 Cb 0.50 -5.13 -0.07 0.00 -0.02 0.00 0.00 35.03 30.31 2jp2 n LYS 69 CO 0.00 0.00 0.00 -0.48 -0.52 0.00 0.00 177.40 176.40 2jp2 s LEU 70 N -1.94 0.84 -0.86 -0.35 -0.00 -1.25 -4.92 118.68 110.19 2jp2 s LEU 70 Ca 0.11 -0.18 -0.25 0.00 -0.00 0.00 0.00 54.13 53.81 2jp2 s LEU 70 Cb -0.03 1.39 -0.02 0.00 -0.00 0.00 0.00 46.19 47.53 2jp2 s LEU 70 CO 0.71 -0.62 1.79 -0.69 -0.00 0.00 0.00 176.35 177.53 2jp2 s VAL 71 N -2.55 3.54 -0.07 1.48 1.01 -1.26 -1.86 120.40 120.69 2jp2 s VAL 71 Ca -0.05 -0.28 -0.04 0.00 0.00 0.00 0.00 61.98 61.61 2jp2 s VAL 71 Cb -0.01 -4.26 -0.27 0.00 0.00 0.00 0.00 36.38 31.84 2jp2 s VAL 71 CO -0.03 -1.20 0.57 -0.37 0.00 0.00 0.00 175.10 174.07 2jp2 h VAL 72 N 7.01 0.82 -4.13 2.92 -1.51 -1.57 -3.46 116.25 116.33 2jp2 h VAL 72 Ca 0.02 -2.52 -0.69 0.00 -1.23 0.00 0.00 66.70 62.28 2jp2 h VAL 72 Cb 1.04 2.59 -0.28 0.00 -2.13 0.00 0.00 31.29 32.51 2jp2 h VAL 72 CO 1.26 0.81 -0.83 -0.76 -1.23 0.00 0.00 177.57 176.82 2jp2 s LEU 73 N -6.92 2.36 -0.21 4.19 2.01 0.18 -5.01 118.68 115.29 2jp2 s LEU 73 Ca -0.16 -0.37 -0.04 0.00 0.01 0.00 0.00 54.13 53.57 2jp2 s LEU 73 Cb 0.07 -1.45 0.11 0.00 0.01 0.00 0.00 46.19 44.92 2jp2 s LEU 73 CO 0.81 0.30 0.36 -0.70 1.01 0.00 0.00 176.35 178.12 2jp2 s GLU 74 N -0.45 0.29 -0.28 1.70 2.12 -1.25 -0.20 118.70 120.63 2jp2 s GLU 74 Ca 0.05 0.68 -0.03 0.00 0.36 0.00 0.00 54.97 56.03 2jp2 s GLU 74 Cb -0.12 -0.24 0.09 0.00 0.26 0.00 0.00 34.13 34.13 2jp2 s GLU 74 CO 0.01 -0.47 0.12 0.00 -0.54 0.00 0.00 175.26 174.38 2jp2 s TYR 76 N 1.99 3.00 -0.56 0.00 5.04 -1.26 -0.69 117.35 124.87 2jp2 s TYR 76 Ca 0.08 0.58 -0.17 0.00 -2.44 0.00 0.00 57.07 55.12 2jp2 s TYR 76 Cb -0.16 -3.80 0.11 0.00 0.35 0.00 0.00 41.96 38.46 2jp2 s TYR 76 CO -0.31 -0.96 0.59 0.14 -1.34 0.00 0.00 175.55 173.68 2jp2 s VAL 77 N 3.60 5.03 0.04 3.14 -7.23 0.36 -4.94 120.40 120.40 2jp2 s VAL 77 Ca 0.37 -1.24 -0.20 0.00 -1.81 0.00 0.00 61.98 59.11 2jp2 s VAL 77 Cb -0.11 -4.40 -0.15 0.00 0.56 0.00 0.00 36.38 32.28 2jp2 s VAL 77 CO 0.22 -0.97 1.30 0.08 -0.31 0.00 0.00 175.10 175.42 2jp2 h ARG 78 N 9.02 0.39 0.00 4.82 0.11 -1.95 -2.87 114.38 123.90 2jp2 h ARG 78 Ca -0.30 -0.24 -0.12 0.00 0.10 0.00 0.00 59.98 59.43 2jp2 h ARG 78 Cb 1.09 0.02 -0.12 0.00 1.11 0.00 0.00 29.97 32.08 2jp2 h ARG 78 CO 1.06 0.82 -0.27 1.17 0.10 0.00 0.00 179.97 182.86 2jp2 n LYS 79 N -4.48 0.00 -3.75 0.08 4.81 -1.26 -4.72 118.16 108.84 2jp2 n LYS 79 Ca -0.07 -0.92 -0.13 0.00 -0.87 0.00 0.00 58.31 56.32 2jp2 n LYS 79 Cb 0.42 0.49 -0.10 0.00 0.02 0.00 0.00 35.03 35.85 2jp2 n LYS 79 CO 0.00 0.00 0.00 0.16 1.17 0.00 0.00 177.40 178.73 2jp2 s ASP 80 N -0.92 -0.35 -0.29 3.14 -4.77 -1.26 -5.04 116.67 107.18 2jp2 s ASP 80 Ca 0.00 0.64 0.03 0.00 -3.30 0.00 0.00 52.55 49.92 2jp2 s ASP 80 Cb 0.00 0.67 0.17 0.00 -1.09 0.00 0.00 42.92 42.68 2jp2 s ASP 80 CO 0.00 -0.15 0.48 -0.76 0.70 0.00 0.00 175.17 175.44 2jp2 s LEU 81 N 0.04 -1.11 -0.07 2.11 1.43 -1.26 -4.76 118.68 115.05 2jp2 s LEU 81 Ca -0.01 -0.06 -0.22 0.00 -1.03 0.00 0.00 54.13 52.81 2jp2 s LEU 81 Cb -0.03 1.50 -0.18 0.00 0.03 0.00 0.00 46.19 47.52 2jp2 s LEU 81 CO 0.01 -0.33 0.86 -0.37 0.23 0.00 0.00 176.35 176.76 2jp2 h VAL 82 N 6.10 1.09 -4.23 -1.59 -1.51 -1.93 -3.49 116.25 110.69 2jp2 h VAL 82 Ca -0.08 -1.38 -0.15 0.00 -1.23 0.00 0.00 66.70 63.86 2jp2 h VAL 82 Cb 1.15 1.88 0.01 0.00 -2.13 0.00 0.00 31.29 32.20 2jp2 h VAL 82 CO 0.22 0.30 -0.61 0.00 -1.23 0.00 0.00 177.57 176.26 2jp2 n TYR 83 N -4.84 -1.00 -4.69 5.19 9.36 -1.25 -4.95 117.16 114.98 2jp2 n TYR 83 Ca -0.08 0.42 -0.33 0.00 3.32 0.00 0.00 57.90 61.23 2jp2 n TYR 83 Cb 0.29 -0.80 -0.13 0.00 -0.63 0.00 0.00 39.34 38.07 2jp2 n TYR 83 CO 0.00 0.00 0.00 0.99 0.22 0.00 0.00 176.86 178.07 2jp2 s THR 84 N -0.69 3.34 -0.58 2.97 2.01 0.38 -4.91 115.64 118.17 2jp2 s THR 84 Ca 0.15 -0.58 -0.20 0.00 0.31 0.00 0.00 61.69 61.37 2jp2 s THR 84 Cb -0.01 -2.40 0.08 0.00 0.01 0.00 0.00 72.50 70.18 2jp2 s THR 84 CO 0.33 0.54 0.72 -1.59 -0.69 0.00 0.00 174.62 173.93 2jp2 s LYS 85 N -0.04 3.08 -0.04 4.92 -2.85 -1.26 -0.51 119.74 123.03 2jp2 s LYS 85 Ca -0.02 -1.10 -0.26 0.00 -1.00 0.00 0.00 55.97 53.59 2jp2 s LYS 85 Cb -0.14 -4.21 -0.21 0.00 -2.06 0.00 0.00 37.83 31.21 2jp2 s LYS 85 CO 0.03 -1.49 1.15 0.00 0.10 0.00 0.00 175.35 175.15 2jp2 h ALA 86 N 9.19 0.02 -2.84 0.59 0.00 -1.70 -3.45 119.26 121.08 2jp2 h ALA 86 Ca -0.29 -0.32 -0.59 0.00 0.00 0.00 0.00 54.91 53.71 2jp2 h ALA 86 Cb 1.09 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.80 2jp2 h ALA 86 CO 1.07 -0.15 -0.56 -0.80 0.00 0.00 0.00 179.25 178.81 2jp2 s ASN 87 N -5.89 5.64 0.50 0.00 0.02 -1.07 -4.99 114.94 109.15 2jp2 s ASN 87 Ca -0.16 -0.05 0.31 0.00 -1.02 0.00 0.00 52.86 51.94 2jp2 s ASN 87 Cb 0.01 -1.52 1.43 0.00 0.02 0.00 0.00 41.25 41.19 2jp2 s ASN 87 CO 0.69 0.10 1.79 -0.65 0.02 0.00 0.00 177.10 179.05 2jp2 h PRO 88 N 2.67 0.10 0.00 -0.60 0.11 -2.03 -0.44 132.00 131.81 2jp2 h PRO 88 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2jp2 h PRO 88 Cb 1.19 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2jp2 h PRO 88 CO 0.65 0.07 -0.00 0.25 -0.21 0.00 0.00 178.00 178.76 2jp2 n THR 89 N -4.32 1.56 -3.82 -1.15 -2.24 -1.26 -4.94 114.28 98.11 2jp2 n THR 89 Ca 0.26 -1.80 -0.29 0.00 -2.27 0.00 0.00 64.05 59.94 2jp2 n THR 89 Cb 1.15 0.03 -0.16 0.00 -2.10 0.00 0.00 70.33 69.25 2jp2 n THR 89 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2jp2 s PHE 90 N -2.18 1.88 -0.16 4.78 2.19 -0.18 -0.59 117.98 123.72 2jp2 s PHE 90 Ca 0.20 -1.59 -0.07 0.00 0.33 0.00 0.00 56.93 55.80 2jp2 s PHE 90 Cb 0.18 -1.57 -0.04 0.00 -1.31 0.00 0.00 43.02 40.27 2jp2 s PHE 90 CO 0.02 -0.78 0.08 -1.58 1.83 0.00 0.00 175.22 174.79 2jp2 s HIS 91 N 1.56 3.34 0.13 10.12 2.46 -0.25 -1.67 115.29 130.97 2jp2 s HIS 91 Ca 0.02 0.22 0.06 0.00 0.47 0.00 0.00 55.06 55.83 2jp2 s HIS 91 Cb -0.18 -2.03 -0.04 0.00 -0.13 0.00 0.00 32.58 30.20 2jp2 s HIS 91 CO -0.13 0.33 -0.14 -3.38 -2.47 0.00 0.00 174.74 168.95 2jp2 s HIS 92 N -0.07 1.43 0.07 3.88 -3.43 0.33 0.31 115.29 117.80 2jp2 s HIS 92 Ca 0.07 -0.56 -0.07 0.00 -0.80 0.00 0.00 55.06 53.71 2jp2 s HIS 92 Cb -0.12 -0.74 -0.01 0.00 -1.43 0.00 0.00 32.58 30.28 2jp2 s HIS 92 CO 0.01 0.16 0.13 1.67 -2.00 0.00 0.00 174.74 174.70 2jp2 s TRP 93 N -2.21 0.23 -0.00 0.38 -2.14 -0.02 -0.47 118.94 114.71 2jp2 s TRP 93 Ca 0.10 -0.64 -0.06 0.00 2.66 0.00 0.00 56.10 58.16 2jp2 s TRP 93 Cb -0.04 -0.14 -0.00 0.00 -3.10 0.00 0.00 33.47 30.19 2jp2 s TRP 93 CO 0.03 -0.46 0.12 -1.59 -2.66 0.00 0.00 176.95 172.38 2jp2 s LYS 94 N -3.50 0.43 0.06 3.25 -2.85 -1.26 -0.26 119.74 115.60 2jp2 s LYS 94 Ca 0.02 -0.37 0.00 0.00 -1.00 0.00 0.00 55.97 54.62 2jp2 s LYS 94 Cb 0.04 0.18 0.00 0.00 -2.06 0.00 0.00 37.83 35.99 2jp2 s LYS 94 CO -0.09 -0.10 0.00 1.33 0.10 0.00 0.00 175.35 176.59 2jp2 n VAL 95 N 1.62 0.24 -3.88 1.79 0.24 -1.15 -4.65 118.33 112.53 2jp2 n VAL 95 Ca -0.22 0.08 -0.28 0.00 -2.04 0.00 0.00 64.34 61.88 2jp2 n VAL 95 Cb 0.56 -0.79 -0.12 0.00 -1.47 0.00 0.00 33.84 32.02 2jp2 n VAL 95 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 2jp2 s ASP 96 N -4.93 4.70 0.00 -1.34 1.01 -1.26 -4.90 116.67 109.94 2jp2 s ASP 96 Ca 0.00 -3.84 0.00 0.00 0.71 0.00 0.00 52.55 49.42 2jp2 s ASP 96 Cb 0.00 -1.59 0.00 0.00 1.01 0.00 0.00 42.92 42.34 2jp2 s ASP 96 CO 0.00 -0.09 0.00 -3.20 0.21 0.00 0.00 175.17 172.09 2jp2 n ASN 97 N 1.99 0.00 -4.76 0.27 2.85 -1.26 -4.92 115.26 109.43 2jp2 n ASN 97 Ca 0.20 0.00 -0.41 0.00 -0.11 0.00 0.00 54.58 54.27 2jp2 n ASN 97 Cb 0.36 0.00 -0.03 0.00 1.24 0.00 0.00 39.78 41.35 2jp2 n ASN 97 CO 0.00 0.00 0.00 -0.60 -2.11 0.00 0.00 177.26 174.55 2jp2 s ARG 98 N 0.00 4.42 -0.05 1.20 6.06 -1.26 -5.02 118.95 124.30 2jp2 s ARG 98 Ca 0.00 2.11 0.06 0.00 -2.50 0.00 0.00 55.73 55.39 2jp2 s ARG 98 Cb 0.00 -3.11 -0.01 0.00 0.06 0.00 0.00 34.95 31.89 2jp2 s ARG 98 CO 0.00 -0.10 -0.23 0.21 -2.50 0.00 0.00 175.30 172.68 2jp2 s LYS 99 N -1.54 2.34 0.29 5.12 2.20 -1.26 -2.95 119.74 123.94 2jp2 s LYS 99 Ca 0.49 -0.83 0.08 0.00 -0.36 0.00 0.00 55.97 55.34 2jp2 s LYS 99 Cb -0.38 -2.00 -0.06 0.00 -1.51 0.00 0.00 37.83 33.88 2jp2 s LYS 99 CO 0.49 0.35 -0.08 -0.06 -0.36 0.00 0.00 175.35 175.69 2jp2 s PHE 100 N -0.13 2.07 0.05 4.03 0.08 0.63 -2.62 117.98 122.10 2jp2 s PHE 100 Ca -0.03 -0.62 -0.01 0.00 0.12 0.00 0.00 56.93 56.39 2jp2 s PHE 100 Cb -0.13 -1.16 -0.04 0.00 -0.57 0.00 0.00 43.02 41.12 2jp2 s PHE 100 CO 0.03 0.38 -0.03 0.20 -0.10 0.00 0.00 175.22 175.70 2jp2 s GLY 101 N -3.48 0.49 -0.11 4.36 0.00 0.21 -0.84 107.32 107.95 2jp2 s GLY 101 Ca 0.30 -1.21 -0.03 0.00 0.00 0.00 0.00 44.72 43.78 2jp2 s GLY 101 CO 0.13 -1.31 0.07 -2.27 0.00 0.00 0.00 173.10 169.71 2jp2 s LEU 102 N -2.89 0.30 -0.27 0.66 0.20 0.15 -0.60 118.68 116.23 2jp2 s LEU 102 Ca 0.07 -0.30 -0.17 0.00 0.69 0.00 0.00 54.13 54.42 2jp2 s LEU 102 Cb 0.07 -0.22 -0.03 0.00 -0.43 0.00 0.00 46.19 45.58 2jp2 s LEU 102 CO -0.09 -0.30 0.48 -0.89 -0.29 0.00 0.00 176.35 175.26 2jp2 s THR 103 N 2.13 5.09 0.73 3.68 2.01 0.72 -1.10 115.64 128.91 2jp2 s THR 103 Ca 0.03 0.76 -0.12 0.00 0.31 0.00 0.00 61.69 62.68 2jp2 s THR 103 Cb -0.14 -3.80 0.04 0.00 0.01 0.00 0.00 72.50 68.60 2jp2 s THR 103 CO -0.06 0.08 1.10 -0.36 -0.69 0.00 0.00 174.62 174.69 2jp2 s PHE 104 N 2.26 2.62 -0.16 4.92 0.08 0.25 -2.43 117.98 125.51 2jp2 s PHE 104 Ca 0.19 1.55 -0.05 0.00 0.12 0.00 0.00 56.93 58.74 2jp2 s PHE 104 Cb -0.16 -3.08 -0.08 0.00 -0.57 0.00 0.00 43.02 39.13 2jp2 s PHE 104 CO 0.10 -1.74 -0.19 1.04 -0.10 0.00 0.00 175.22 174.34 2jp2 n GLN 105 N -3.15 0.36 -4.15 0.44 6.02 -1.26 -4.88 117.38 110.76 2jp2 n GLN 105 Ca 0.09 0.13 -0.12 0.00 -0.01 0.00 0.00 57.00 57.09 2jp2 n GLN 105 Cb 0.53 -1.17 -0.11 0.00 1.02 0.00 0.00 30.24 30.51 2jp2 n GLN 105 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 2jp2 s SER 106 N -6.12 1.17 0.53 1.08 0.01 -1.26 -5.03 113.70 104.06 2jp2 s SER 106 Ca -0.22 -0.85 0.30 0.00 1.31 0.00 0.00 55.95 56.48 2jp2 s SER 106 Cb 0.08 0.06 1.44 0.00 0.21 0.00 0.00 66.02 67.80 2jp2 s SER 106 CO 0.31 -0.35 1.90 -0.65 0.41 0.00 0.00 173.24 174.86 2jp2 h PRO 107 N 3.47 0.04 0.89 12.44 0.11 -1.98 -1.38 132.00 145.59 2jp2 h PRO 107 Ca -0.36 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.71 2jp2 h PRO 107 Cb 1.18 -0.01 0.01 0.00 0.11 0.00 0.00 31.00 32.29 2jp2 h PRO 107 CO 0.56 0.02 -0.43 0.00 -0.21 0.00 0.00 178.00 177.95 2jp2 h ALA 108 N 1.58 -1.29 -0.41 -0.75 0.00 -1.99 0.41 119.26 116.81 2jp2 h ALA 108 Ca 0.41 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 2jp2 h ALA 108 Cb 1.58 0.46 -0.02 0.00 0.00 0.00 0.00 17.79 19.82 2jp2 h ALA 108 CO -0.02 -1.21 0.05 0.38 0.00 0.00 0.00 179.25 178.45 2jp2 h ASP 109 N -1.22 0.67 -0.11 0.00 2.03 -1.90 -1.19 116.42 114.70 2jp2 h ASP 109 Ca -0.12 -0.28 0.05 0.00 -0.73 0.00 0.00 57.03 55.95 2jp2 h ASP 109 Cb 0.92 -0.18 -0.06 0.00 -0.83 0.00 0.00 39.33 39.18 2jp2 h ASP 109 CO 0.20 0.78 -0.30 0.00 -1.03 0.00 0.00 179.24 178.89 2jp2 h ALA 110 N 0.92 -0.35 -0.84 4.15 0.00 -1.29 0.61 119.26 122.45 2jp2 h ALA 110 Ca 0.12 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2jp2 h ALA 110 Cb 0.41 0.57 -0.04 0.00 0.00 0.00 0.00 17.79 18.73 2jp2 h ALA 110 CO 0.01 -0.78 0.45 -0.09 0.00 0.00 0.00 179.25 178.84 2jp2 h ARG 111 N -0.39 1.17 -0.58 0.00 2.43 -0.80 -1.16 114.38 115.05 2jp2 h ARG 111 Ca 0.09 -0.14 -0.02 0.00 -0.81 0.00 0.00 59.98 59.11 2jp2 h ARG 111 Cb 0.53 -0.23 -0.03 0.00 -0.42 0.00 0.00 29.97 29.82 2jp2 h ARG 111 CO -0.33 0.86 0.30 0.00 -1.51 0.00 0.00 179.97 179.29 2jp2 h ALA 112 N 1.32 0.75 -0.39 2.80 0.00 -0.50 -1.52 119.26 121.73 2jp2 h ALA 112 Ca 0.29 -0.12 -0.16 0.00 0.00 0.00 0.00 54.91 54.93 2jp2 h ALA 112 Cb 0.04 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2jp2 h ALA 112 CO -0.05 0.29 -0.37 0.74 0.00 0.00 0.00 179.25 179.86 2jp2 h PHE 113 N 0.79 1.12 0.80 0.00 0.04 -0.36 0.30 116.94 119.64 2jp2 h PHE 113 Ca 0.20 -0.33 -0.04 0.00 2.80 0.00 0.00 57.97 60.60 2jp2 h PHE 113 Cb 0.08 -0.24 0.01 0.00 2.20 0.00 0.00 35.95 38.00 2jp2 h PHE 113 CO -0.01 1.16 -0.38 -0.44 -0.60 0.00 0.00 178.31 178.04 2jp2 h ASP 114 N 0.77 -0.91 0.23 2.17 3.32 -1.05 0.12 116.42 121.07 2jp2 h ASP 114 Ca 0.07 0.03 -0.08 0.00 0.02 0.00 0.00 57.03 57.07 2jp2 h ASP 114 Cb 0.97 0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.74 2jp2 h ASP 114 CO 0.09 -0.64 -0.31 0.03 -1.72 0.00 0.00 179.24 176.69 2jp2 h ARG 115 N -1.08 0.13 -0.08 3.56 2.47 -1.32 -1.89 114.38 116.17 2jp2 h ARG 115 Ca -0.11 -0.05 -0.01 0.00 -1.26 0.00 0.00 59.98 58.56 2jp2 h ARG 115 Cb 0.82 -0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 29.13 2jp2 h ARG 115 CO 0.18 0.44 0.02 0.78 0.56 0.00 0.00 179.97 181.95 2jp2 h GLY 116 N 1.02 0.14 1.29 0.04 0.00 -0.19 -1.09 103.07 104.28 2jp2 h GLY 116 Ca 0.02 -0.09 -0.10 0.00 0.00 0.00 0.00 47.33 47.16 2jp2 h GLY 116 CO 0.04 0.08 -0.13 -0.24 0.00 0.00 0.00 176.54 176.29 2jp2 h VAL 117 N -0.06 1.26 -0.21 4.60 3.04 -0.60 -0.37 116.25 123.91 2jp2 h VAL 117 Ca 0.03 -1.23 0.04 0.00 -1.01 0.00 0.00 66.70 64.53 2jp2 h VAL 117 Cb 0.22 1.06 -0.03 0.00 -2.01 0.00 0.00 31.29 30.53 2jp2 h VAL 117 CO -0.00 0.42 -0.00 -0.09 -1.01 0.00 0.00 177.57 176.89 2jp2 h ARG 118 N 0.75 0.06 -0.59 4.17 9.65 -1.24 0.18 114.38 127.36 2jp2 h ARG 118 Ca 0.12 -0.00 0.03 0.00 -1.10 0.00 0.00 59.98 59.02 2jp2 h ARG 118 Cb 0.64 -0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 29.17 2jp2 h ARG 118 CO 0.04 0.04 0.36 -0.22 2.80 0.00 0.00 179.97 183.00 2jp2 h LYS 119 N 0.06 0.69 -0.35 0.20 1.63 -0.89 -0.98 116.57 116.93 2jp2 h LYS 119 Ca 0.10 -0.04 0.03 0.00 -0.85 0.00 0.00 60.65 59.89 2jp2 h LYS 119 Cb 0.13 -0.16 -0.03 0.00 -0.60 0.00 0.00 32.23 31.57 2jp2 h LYS 119 CO -0.17 0.46 0.16 0.00 -3.45 0.00 0.00 179.45 176.45 2jp2 h ALA 120 N 1.26 0.43 -0.37 5.00 0.00 -0.45 -2.02 119.26 123.12 2jp2 h ALA 120 Ca 0.24 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.18 2jp2 h ALA 120 Cb 0.03 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2jp2 h ALA 120 CO -0.10 -0.21 0.22 0.82 0.00 0.00 0.00 179.25 179.97 2jp2 h ILE 121 N 0.34 1.04 0.07 0.00 1.08 -0.21 0.24 117.51 120.08 2jp2 h ILE 121 Ca 0.15 -0.15 0.02 0.00 -0.39 0.00 0.00 64.86 64.49 2jp2 h ILE 121 Cb 0.08 0.56 -0.05 0.00 -3.07 0.00 0.00 36.82 34.34 2jp2 h ILE 121 CO -0.12 0.08 -0.45 -0.33 -0.69 0.00 0.00 178.15 176.64 2jp2 h GLU 122 N 0.44 -0.63 -0.04 2.37 4.39 -0.76 -0.21 114.58 120.14 2jp2 h GLU 122 Ca 0.14 0.04 -0.17 0.00 0.34 0.00 0.00 59.36 59.71 2jp2 h GLU 122 Cb -0.00 0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 28.78 2jp2 h GLU 122 CO -0.06 -0.42 -0.73 0.22 -1.16 0.00 0.00 179.01 176.86 2jp2 h ASP 123 N -0.65 0.31 -0.57 1.42 3.58 -1.24 -1.23 116.42 118.04 2jp2 h ASP 123 Ca 0.02 -0.21 -0.06 0.00 0.42 0.00 0.00 57.03 57.20 2jp2 h ASP 123 Cb 0.70 -0.09 -0.02 0.00 1.72 0.00 0.00 39.33 41.63 2jp2 h ASP 123 CO -0.29 0.93 0.11 0.25 -2.88 0.00 0.00 179.24 177.36 2jp2 h LEU 124 N 0.17 0.89 0.03 2.28 5.85 -0.31 -3.30 115.31 120.92 2jp2 h LEU 124 Ca -0.02 -0.25 -0.00 0.00 0.84 0.00 0.00 57.88 58.44 2jp2 h LEU 124 Cb 1.29 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 42.09 2jp2 h LEU 124 CO 0.11 0.91 -0.01 0.40 -0.34 0.00 0.00 178.44 179.51 2jp2 h ILE 125 N 0.83 0.71 0.00 4.05 1.08 -1.00 -3.48 117.51 119.70 2jp2 h ILE 125 Ca 0.17 -1.47 0.00 0.00 -0.39 0.00 0.00 64.86 63.18 2jp2 h ILE 125 Cb 0.39 1.33 0.00 0.00 -3.07 0.00 0.00 36.82 35.47 2jp2 h ILE 125 CO 0.01 0.23 0.00 -1.84 -0.69 0.00 0.00 178.15 175.86