#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jt1 s SER 2 N 0.00 -0.33 -0.57 3.17 1.04 -1.26 -5.10 113.70 110.65 2jt1 s SER 2 Ca 0.00 -0.41 -0.27 0.00 0.48 0.00 0.00 55.95 55.76 2jt1 s SER 2 Cb 0.00 0.65 -0.03 0.00 0.10 0.00 0.00 66.02 66.74 2jt1 s SER 2 CO 0.00 -1.16 1.92 -0.70 0.98 0.00 0.00 173.24 174.28 2jt1 s GLU 3 N -3.75 2.64 -0.02 4.02 2.56 -1.26 -4.84 118.70 118.06 2jt1 s GLU 3 Ca 0.09 0.79 0.00 0.00 0.00 0.00 0.00 54.97 55.85 2jt1 s GLU 3 Cb -0.04 -4.39 0.04 0.00 2.00 0.00 0.00 34.13 31.74 2jt1 s GLU 3 CO 0.01 -2.70 0.80 0.45 -0.56 0.00 0.00 175.26 173.25 2jt1 n SER 4 N 12.85 2.11 -0.21 -1.70 2.88 -1.26 -4.36 113.62 123.93 2jt1 n SER 4 Ca 0.22 -2.06 0.10 0.00 -1.33 0.00 0.00 58.87 55.80 2jt1 n SER 4 Cb 0.52 -0.51 0.39 0.00 -0.75 0.00 0.00 64.21 63.85 2jt1 n SER 4 CO 0.00 0.00 0.00 -0.29 -1.23 0.00 0.00 175.04 173.52 2jt1 h ILE 5 N 0.13 0.92 -0.05 2.46 6.09 -1.99 -2.15 117.51 122.91 2jt1 h ILE 5 Ca 0.02 -0.23 0.01 0.00 -1.37 0.00 0.00 64.86 63.29 2jt1 h ILE 5 Cb 0.83 0.19 -0.01 0.00 0.47 0.00 0.00 36.82 38.29 2jt1 h ILE 5 CO 0.04 0.12 -0.03 0.58 -3.07 0.00 0.00 178.15 175.79 2jt1 h VAL 6 N 0.67 0.90 -0.95 2.19 2.07 -2.01 0.27 116.25 119.39 2jt1 h VAL 6 Ca 0.37 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.88 2jt1 h VAL 6 Cb 0.52 0.90 -0.05 0.00 -1.52 0.00 0.00 31.29 31.14 2jt1 h VAL 6 CO -0.14 0.00 0.57 0.74 0.02 0.00 0.00 177.57 178.76 2jt1 h THR 7 N -0.03 1.26 -0.17 2.57 2.02 -1.77 -2.04 112.91 114.74 2jt1 h THR 7 Ca 0.03 -0.57 0.01 0.00 0.77 0.00 0.00 66.41 66.66 2jt1 h THR 7 Cb 0.08 -0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 66.39 2jt1 h THR 7 CO -0.07 0.27 0.07 0.50 0.37 0.00 0.00 175.52 176.66 2jt1 h LYS 8 N 1.31 0.15 -0.33 6.66 3.64 -0.91 0.04 116.57 127.13 2jt1 h LYS 8 Ca 0.34 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.76 2jt1 h LYS 8 Cb -0.06 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 31.69 2jt1 h LYS 8 CO -0.06 0.10 0.09 0.82 -2.27 0.00 0.00 179.45 178.12 2jt1 h ILE 9 N 0.16 0.86 -0.69 2.00 2.04 -0.63 0.73 117.51 121.98 2jt1 h ILE 9 Ca 0.07 -0.07 0.02 0.00 1.00 0.00 0.00 64.86 65.88 2jt1 h ILE 9 Cb 0.03 0.63 -0.04 0.00 -0.74 0.00 0.00 36.82 36.70 2jt1 h ILE 9 CO -0.06 0.04 0.44 0.40 0.00 0.00 0.00 178.15 178.97 2jt1 h ILE 10 N 0.21 1.12 -0.98 -0.67 2.04 -1.19 -2.01 117.51 116.04 2jt1 h ILE 10 Ca 0.15 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.71 2jt1 h ILE 10 Cb 0.15 0.16 -0.05 0.00 -0.74 0.00 0.00 36.82 36.35 2jt1 h ILE 10 CO -0.19 0.16 0.61 -1.28 0.00 0.00 0.00 178.15 177.46 2jt1 h SER 11 N 0.88 1.15 0.10 1.72 0.87 -0.26 -0.09 113.55 117.92 2jt1 h SER 11 Ca 0.27 -0.05 -0.01 0.00 -1.23 0.00 0.00 61.79 60.77 2jt1 h SER 11 Cb -0.03 -0.29 0.00 0.00 -0.44 0.00 0.00 62.40 61.64 2jt1 h SER 11 CO -0.09 0.86 -0.05 0.40 -0.53 0.00 0.00 176.83 177.42 2jt1 h ILE 12 N 1.34 0.93 -0.01 2.23 2.04 -0.45 -0.15 117.51 123.44 2jt1 h ILE 12 Ca 0.35 -0.12 0.01 0.00 1.00 0.00 0.00 64.86 66.11 2jt1 h ILE 12 Cb -0.10 1.01 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 2jt1 h ILE 12 CO -0.07 0.03 -0.07 0.58 0.00 0.00 0.00 178.15 178.62 2jt1 h VAL 13 N -0.19 0.81 -0.48 1.67 2.07 -1.12 -0.96 116.25 118.05 2jt1 h VAL 13 Ca -0.01 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.58 2jt1 h VAL 13 Cb 0.15 0.81 -0.06 0.00 -1.52 0.00 0.00 31.29 30.67 2jt1 h VAL 13 CO 0.02 0.00 0.11 -0.61 0.02 0.00 0.00 177.57 177.11 2jt1 h GLN 14 N -0.12 0.24 0.19 1.57 4.15 -0.97 -0.46 115.11 119.71 2jt1 h GLN 14 Ca 0.03 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.44 2jt1 h GLN 14 Cb 0.17 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 27.78 2jt1 h GLN 14 CO -0.08 0.16 -0.20 1.49 -1.93 0.00 0.00 178.83 178.27 2jt1 h GLU 15 N 0.25 -0.40 0.00 1.69 4.81 -0.73 0.27 114.58 120.46 2jt1 h GLU 15 Ca 0.24 0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.48 2jt1 h GLU 15 Cb 0.31 0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.77 2jt1 h GLU 15 CO -0.30 -0.27 -0.10 0.00 -0.73 0.00 0.00 179.01 177.61 2jt1 h ARG 16 N -0.42 0.00 0.00 1.92 2.47 -0.81 -0.99 114.38 116.55 2jt1 h ARG 16 Ca 0.00 0.00 -0.14 0.00 -1.26 0.00 0.00 59.98 58.58 2jt1 h ARG 16 Cb 0.40 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.70 2jt1 h ARG 16 CO -0.05 0.10 -0.70 1.96 0.56 0.00 0.00 179.97 181.84 2jt1 h GLN 17 N 0.00 0.00 0.00 0.04 4.20 -0.65 -1.17 115.11 117.53 2jt1 h GLN 17 Ca -0.00 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 2jt1 h GLN 17 Cb 0.21 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.98 2jt1 h GLN 17 CO 0.01 0.67 -0.14 -0.91 -0.67 0.00 0.00 178.83 177.79 2jt1 h ASN 18 N 0.00 0.00 0.08 1.46 2.35 0.39 0.34 115.58 120.19 2jt1 h ASN 18 Ca -0.01 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.74 2jt1 h ASN 18 Cb 1.53 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.90 2jt1 h ASN 18 CO 0.09 0.14 -0.04 0.24 -1.65 0.00 0.00 177.43 176.21 2jt1 h MET 19 N 0.00 -0.10 0.00 0.81 2.86 -1.21 -3.44 114.93 113.85 2jt1 h MET 19 Ca -0.00 0.01 -0.14 0.00 -2.06 0.00 0.00 59.70 57.51 2jt1 h MET 19 Cb 0.34 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.00 2jt1 h MET 19 CO 0.02 -0.07 -1.16 -0.25 1.06 0.00 0.00 176.91 176.51 2jt1 n ASP 20 N -4.80 1.88 0.00 1.22 8.00 -0.46 -4.98 116.55 117.41 2jt1 n ASP 20 Ca -0.01 0.46 0.00 0.00 0.71 0.00 0.00 54.79 55.95 2jt1 n ASP 20 Cb 0.04 -0.85 0.00 0.00 -0.02 0.00 0.00 41.12 40.29 2jt1 n ASP 20 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2jt1 n ASP 21 N -4.47 0.00 -0.09 -2.24 2.03 0.12 -4.10 116.55 107.80 2jt1 n ASP 21 Ca -0.23 0.00 0.04 0.00 0.52 0.00 0.00 54.79 55.12 2jt1 n ASP 21 Cb 0.53 0.00 0.37 0.00 -0.72 0.00 0.00 41.12 41.30 2jt1 n ASP 21 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 2jt1 h GLY 22 N 0.00 0.77 -6.02 0.27 0.00 -1.94 -3.40 103.07 92.75 2jt1 h GLY 22 Ca 0.00 -0.28 -0.59 0.00 0.00 0.00 0.00 47.33 46.46 2jt1 h GLY 22 CO 0.00 0.26 -0.33 0.00 0.00 0.00 0.00 176.54 176.47 2jt1 s ALA 23 N -5.62 3.59 0.90 3.60 0.00 -1.26 -5.09 121.76 117.89 2jt1 s ALA 23 Ca -0.09 -0.49 -0.11 0.00 0.00 0.00 0.00 51.96 51.26 2jt1 s ALA 23 Cb 0.18 -2.40 0.13 0.00 0.00 0.00 0.00 23.12 21.03 2jt1 s ALA 23 CO 0.75 0.04 1.09 -1.25 0.00 0.00 0.00 175.76 176.40 2jt1 s PRO 24 N 0.57 1.19 0.26 0.00 0.04 -1.26 -4.76 135.00 131.04 2jt1 s PRO 24 Ca 0.16 0.95 -0.20 0.00 0.04 0.00 0.00 61.00 61.95 2jt1 s PRO 24 Cb -0.13 -1.79 -0.09 0.00 0.04 0.00 0.00 34.50 32.53 2jt1 s PRO 24 CO 0.04 -2.32 0.76 0.08 0.04 0.00 0.00 177.00 175.60 2jt1 s VAL 25 N -2.86 4.54 0.08 -0.36 1.01 0.17 -4.86 120.40 118.12 2jt1 s VAL 25 Ca 0.64 1.30 -0.18 0.00 0.00 0.00 0.00 61.98 63.74 2jt1 s VAL 25 Cb -0.19 -3.82 -0.07 0.00 0.00 0.00 0.00 36.38 32.30 2jt1 s VAL 25 CO 0.58 0.11 0.54 -0.54 0.00 0.00 0.00 175.10 175.79 2jt1 s LYS 26 N -2.20 4.11 0.34 2.72 3.01 -1.26 -0.13 119.74 126.33 2jt1 s LYS 26 Ca 0.46 0.64 0.09 0.00 -1.01 0.00 0.00 55.97 56.15 2jt1 s LYS 26 Cb -0.15 -3.16 0.83 0.00 -1.01 0.00 0.00 37.83 34.33 2jt1 s LYS 26 CO 0.20 0.61 1.81 1.15 0.51 0.00 0.00 175.35 179.63 2jt1 h THR 27 N 3.39 0.73 -0.19 2.17 2.02 -1.93 -1.84 112.91 117.25 2jt1 h THR 27 Ca -0.50 -0.23 -0.01 0.00 0.77 0.00 0.00 66.41 66.44 2jt1 h THR 27 Cb 1.21 -0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 2jt1 h THR 27 CO 0.64 0.12 0.08 0.03 0.37 0.00 0.00 175.52 176.76 2jt1 h ARG 28 N 0.68 0.29 -0.23 6.66 -0.00 -1.93 -1.34 114.38 118.51 2jt1 h ARG 28 Ca 0.53 -0.05 0.06 0.00 -0.50 0.00 0.00 59.98 60.02 2jt1 h ARG 28 Cb 0.92 -0.05 -0.07 0.00 0.00 0.00 0.00 29.97 30.78 2jt1 h ARG 28 CO -0.30 0.36 -0.21 -0.44 0.00 0.00 0.00 179.97 179.39 2jt1 h ASP 29 N 0.16 -0.66 0.29 7.04 5.19 -1.75 0.11 116.42 126.79 2jt1 h ASP 29 Ca 0.06 0.13 -0.01 0.00 -0.62 0.00 0.00 57.03 56.59 2jt1 h ASP 29 Cb 0.18 0.32 -0.01 0.00 0.18 0.00 0.00 39.33 40.00 2jt1 h ASP 29 CO -0.00 -0.25 -0.21 0.40 -3.12 0.00 0.00 179.24 176.06 2jt1 h ILE 30 N -0.21 0.56 -0.44 0.35 2.04 -1.36 -0.71 117.51 117.75 2jt1 h ILE 30 Ca 0.13 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.99 2jt1 h ILE 30 Cb 0.41 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 2jt1 h ILE 30 CO -0.36 0.00 0.26 0.00 0.00 0.00 0.00 178.15 178.06 2jt1 h ALA 31 N 0.18 0.56 -0.72 1.87 0.00 -1.06 -0.01 119.26 120.08 2jt1 h ALA 31 Ca -0.02 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 2jt1 h ALA 31 Cb 0.42 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2jt1 h ALA 31 CO 0.00 0.05 0.21 0.22 0.00 0.00 0.00 179.25 179.73 2jt1 h ASP 32 N 0.58 1.05 -0.10 0.00 3.58 -0.72 0.14 116.42 120.95 2jt1 h ASP 32 Ca 0.16 -0.21 -0.19 0.00 0.42 0.00 0.00 57.03 57.21 2jt1 h ASP 32 Cb -0.00 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 40.77 2jt1 h ASP 32 CO -0.03 0.99 -0.62 0.00 -2.88 0.00 0.00 179.24 176.70 2jt1 h ALA 33 N 1.10 0.51 -0.17 -0.78 0.00 -0.92 -3.19 119.26 115.82 2jt1 h ALA 33 Ca 0.23 -0.54 -0.15 0.00 0.00 0.00 0.00 54.91 54.45 2jt1 h ALA 33 Cb 0.32 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2jt1 h ALA 33 CO -0.00 0.69 -0.52 0.00 0.00 0.00 0.00 179.25 179.42 2jt1 h ALA 34 N 0.77 0.79 0.00 0.00 0.00 -0.84 -3.48 119.26 116.49 2jt1 h ALA 34 Ca -0.01 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2jt1 h ALA 34 Cb 1.21 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2jt1 h ALA 34 CO 0.13 0.68 0.00 0.41 0.00 0.00 0.00 179.25 180.46 2jt1 n GLY 35 N 0.17 0.71 3.77 0.00 0.00 0.48 -5.08 105.19 105.24 2jt1 n GLY 35 Ca -0.03 -0.67 -0.25 0.00 0.00 0.00 0.00 46.02 45.07 2jt1 n GLY 35 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jt1 s LEU 36 N 0.00 3.03 0.40 0.99 1.43 -1.12 -5.05 118.68 118.35 2jt1 s LEU 36 Ca 0.00 -1.11 -0.25 0.00 -1.03 0.00 0.00 54.13 51.73 2jt1 s LEU 36 Cb 0.00 -1.40 -0.09 0.00 0.03 0.00 0.00 46.19 44.73 2jt1 s LEU 36 CO 0.00 -0.65 1.14 -0.44 0.23 0.00 0.00 176.35 176.63 2jt1 s SER 37 N -3.97 6.59 0.12 2.29 0.01 -1.26 -4.72 113.70 112.76 2jt1 s SER 37 Ca 0.38 2.28 -0.31 0.00 1.31 0.00 0.00 55.95 59.60 2jt1 s SER 37 Cb 0.02 -2.61 -0.10 0.00 0.21 0.00 0.00 66.02 63.55 2jt1 s SER 37 CO 0.21 -0.62 1.57 0.40 0.41 0.00 0.00 173.24 175.22 2jt1 h ILE 38 N 2.32 0.10 -0.96 1.44 1.08 -1.98 -0.86 117.51 118.65 2jt1 h ILE 38 Ca -0.49 0.00 0.13 0.00 -0.39 0.00 0.00 64.86 64.11 2jt1 h ILE 38 Cb 1.23 0.10 -0.09 0.00 -3.07 0.00 0.00 36.82 34.99 2jt1 h ILE 38 CO 0.63 0.00 0.58 0.10 -0.69 0.00 0.00 178.15 178.77 2jt1 h TYR 39 N -0.61 1.05 -0.18 1.37 -0.00 -1.99 -0.81 116.97 115.79 2jt1 h TYR 39 Ca 0.04 0.03 -0.02 0.00 0.00 0.00 0.00 58.73 58.78 2jt1 h TYR 39 Cb 0.68 -0.33 -0.01 0.00 0.00 0.00 0.00 36.73 37.08 2jt1 h TYR 39 CO -0.46 0.38 0.02 0.37 -0.00 0.00 0.00 178.16 178.47 2jt1 h GLN 40 N 0.89 0.30 -0.60 0.10 5.75 -1.73 -2.27 115.11 117.55 2jt1 h GLN 40 Ca 0.49 -0.08 0.03 0.00 -0.15 0.00 0.00 58.65 58.93 2jt1 h GLN 40 Cb 0.54 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 29.01 2jt1 h GLN 40 CO -0.29 0.48 0.37 0.28 -2.65 0.00 0.00 178.83 177.02 2jt1 h VAL 41 N 0.08 1.07 -0.47 2.39 2.07 -0.66 -1.95 116.25 118.78 2jt1 h VAL 41 Ca 0.05 -0.25 0.04 0.00 0.82 0.00 0.00 66.70 67.36 2jt1 h VAL 41 Cb 0.33 0.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.35 2jt1 h VAL 41 CO 0.00 0.13 0.31 0.03 0.02 0.00 0.00 177.57 178.07 2jt1 h ARG 42 N 0.73 0.45 0.26 1.57 3.08 -1.01 -0.08 114.38 119.39 2jt1 h ARG 42 Ca 0.24 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.25 2jt1 h ARG 42 Cb 0.02 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 29.97 2jt1 h ARG 42 CO -0.10 0.30 -0.13 -0.07 -1.07 0.00 0.00 179.97 178.90 2jt1 h LEU 43 N 0.47 -0.30 -0.50 3.04 3.38 -0.76 -0.00 115.31 120.64 2jt1 h LEU 43 Ca 0.19 0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.22 2jt1 h LEU 43 Cb 0.18 0.08 -0.05 0.00 0.09 0.00 0.00 40.66 40.97 2jt1 h LEU 43 CO -0.05 -0.21 0.24 1.88 0.09 0.00 0.00 178.44 180.39 2jt1 h TYR 44 N -0.36 0.43 -0.35 1.13 0.05 -1.08 -1.21 116.97 115.59 2jt1 h TYR 44 Ca -0.04 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.77 2jt1 h TYR 44 Cb 0.27 -0.12 -0.02 0.00 1.01 0.00 0.00 36.73 37.88 2jt1 h TYR 44 CO -0.06 0.20 0.23 -0.07 -1.05 0.00 0.00 178.16 177.41 2jt1 h LEU 45 N 0.46 0.39 -0.75 3.88 3.38 -0.85 -0.50 115.31 121.33 2jt1 h LEU 45 Ca 0.22 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 58.08 2jt1 h LEU 45 Cb 0.16 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 2jt1 h LEU 45 CO -0.17 0.28 -0.19 -0.08 0.09 0.00 0.00 178.44 178.37 2jt1 h GLU 46 N 0.46 0.75 -0.49 1.13 4.81 -0.81 -1.14 114.58 119.30 2jt1 h GLU 46 Ca 0.13 -0.28 0.01 0.00 -0.13 0.00 0.00 59.36 59.08 2jt1 h GLU 46 Cb -0.05 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.26 2jt1 h GLU 46 CO -0.03 0.88 0.32 1.96 -0.73 0.00 0.00 179.01 181.41 2jt1 h GLN 47 N 0.66 0.63 -0.38 1.92 4.20 -0.89 0.54 115.11 121.79 2jt1 h GLN 47 Ca 0.10 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.76 2jt1 h GLN 47 Cb 0.68 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.30 2jt1 h GLN 47 CO 0.05 0.42 0.17 -0.07 -0.67 0.00 0.00 178.83 178.73 2jt1 h LEU 48 N 0.65 0.47 -1.01 1.46 3.38 -0.78 0.49 115.31 119.97 2jt1 h LEU 48 Ca 0.19 -0.04 -0.10 0.00 0.09 0.00 0.00 57.88 58.02 2jt1 h LEU 48 Cb -0.05 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 2jt1 h LEU 48 CO -0.05 0.41 -0.46 -0.74 0.09 0.00 0.00 178.44 177.69 2jt1 h HIS 49 N 0.53 0.00 0.20 1.13 2.76 -0.52 0.29 115.15 119.54 2jt1 h HIS 49 Ca 0.13 0.00 -0.28 0.00 -2.20 0.00 0.00 60.37 58.03 2jt1 h HIS 49 Cb 0.08 0.00 0.03 0.00 1.55 0.00 0.00 27.41 29.07 2jt1 h HIS 49 CO 0.00 0.46 -1.21 0.22 -1.30 0.00 0.00 177.93 176.10 2jt1 h ASP 50 N 0.00 0.72 1.36 3.26 3.58 0.58 -3.32 116.42 122.61 2jt1 h ASP 50 Ca -0.00 -0.92 -0.09 0.00 0.42 0.00 0.00 57.03 56.44 2jt1 h ASP 50 Cb 0.88 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.69 2jt1 h ASP 50 CO 0.06 1.59 -0.42 -0.37 -2.88 0.00 0.00 179.24 177.22 2jt1 h VAL 51 N -0.02 0.77 0.00 2.25 -1.51 -1.03 -3.48 116.25 113.23 2jt1 h VAL 51 Ca -0.21 -1.91 0.00 0.00 -1.23 0.00 0.00 66.70 63.36 2jt1 h VAL 51 Cb 1.95 2.25 0.00 0.00 -2.13 0.00 0.00 31.29 33.35 2jt1 h VAL 51 CO 0.23 0.41 0.00 0.61 -1.23 0.00 0.00 177.57 177.59 2jt1 n GLY 52 N 0.94 0.72 2.02 5.19 0.00 -0.83 -5.10 105.19 108.12 2jt1 n GLY 52 Ca 0.02 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.31 2jt1 n GLY 52 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2jt1 n VAL 53 N 0.00 0.00 -4.08 1.61 0.31 0.95 -5.01 118.33 112.11 2jt1 n VAL 53 Ca 0.00 0.00 -0.33 0.00 -0.01 0.00 0.00 64.34 64.00 2jt1 n VAL 53 Cb 0.00 -0.42 -0.07 0.00 -0.91 0.00 0.00 33.84 32.44 2jt1 n VAL 53 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2jt1 s LEU 54 N -6.82 3.94 -0.06 7.52 1.43 -1.14 -1.93 118.68 121.63 2jt1 s LEU 54 Ca 0.00 0.16 -0.00 0.00 -1.03 0.00 0.00 54.13 53.26 2jt1 s LEU 54 Cb 0.00 -2.32 -0.03 0.00 0.03 0.00 0.00 46.19 43.87 2jt1 s LEU 54 CO 0.00 0.27 -0.03 -0.70 0.23 0.00 0.00 176.35 176.12 2jt1 s GLU 55 N -1.79 2.84 -0.79 1.70 2.56 0.62 -3.81 118.70 120.03 2jt1 s GLU 55 Ca 0.24 -0.51 -0.20 0.00 0.00 0.00 0.00 54.97 54.50 2jt1 s GLU 55 Cb -0.12 -2.68 0.11 0.00 2.00 0.00 0.00 34.13 33.43 2jt1 s GLU 55 CO 0.15 0.67 1.00 -1.59 -0.56 0.00 0.00 175.26 174.93 2jt1 s LYS 56 N -1.01 3.35 -1.11 4.30 -2.85 -1.26 -0.73 119.74 120.42 2jt1 s LYS 56 Ca 0.14 -1.39 -0.22 0.00 -1.00 0.00 0.00 55.97 53.50 2jt1 s LYS 56 Cb -0.11 -4.58 0.03 0.00 -2.06 0.00 0.00 37.83 31.11 2jt1 s LYS 56 CO 0.04 -1.75 1.65 0.08 0.10 0.00 0.00 175.35 175.47 2jt1 s VAL 57 N 3.11 3.89 -4.40 1.79 1.01 0.18 -4.78 120.40 121.20 2jt1 s VAL 57 Ca 0.26 -1.09 0.00 0.00 0.00 0.00 0.00 61.98 61.14 2jt1 s VAL 57 Cb -0.12 -4.92 0.00 0.00 0.00 0.00 0.00 36.38 31.34 2jt1 s VAL 57 CO -0.00 -1.75 0.00 -3.20 0.00 0.00 0.00 175.10 170.15 2jt1 n ASN 58 N 9.93 0.00 -2.79 3.32 5.15 -1.26 -2.55 115.26 127.05 2jt1 n ASN 58 Ca 0.40 0.00 -0.06 0.00 -0.60 0.00 0.00 54.58 54.32 2jt1 n ASN 58 Cb 0.48 0.00 0.05 0.00 -0.53 0.00 0.00 39.78 39.79 2jt1 n ASN 58 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2jt1 n ALA 59 N 0.00 -0.79 -3.00 5.20 0.00 -1.26 -5.02 120.51 115.64 2jt1 n ALA 59 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.10 2jt1 n ALA 59 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.43 2jt1 n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jt1 n GLY 60 N 0.51 4.46 2.60 0.00 0.00 -1.26 -4.78 105.19 106.73 2jt1 n GLY 60 Ca 0.03 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.91 2jt1 n GLY 60 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2jt1 n LYS 61 N 0.00 -0.64 0.00 1.61 4.81 -1.26 -3.77 118.16 118.91 2jt1 n LYS 61 Ca 0.00 0.16 0.00 0.00 -0.87 0.00 0.00 58.31 57.60 2jt1 n LYS 61 Cb 0.00 -3.70 0.00 0.00 0.02 0.00 0.00 35.03 31.35 2jt1 n LYS 61 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2jt1 n GLY 62 N -1.52 2.32 3.58 3.14 0.00 -1.26 -5.15 105.19 106.29 2jt1 n GLY 62 Ca 0.00 -0.24 -0.37 0.00 0.00 0.00 0.00 46.02 45.41 2jt1 n GLY 62 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2jt1 n VAL 63 N 0.00 3.01 0.01 1.61 0.24 -1.25 -4.94 118.33 117.01 2jt1 n VAL 63 Ca 0.00 -0.44 -0.01 0.00 -2.04 0.00 0.00 64.34 61.85 2jt1 n VAL 63 Cb 0.00 -1.02 -0.01 0.00 -1.47 0.00 0.00 33.84 31.35 2jt1 n VAL 63 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 2jt1 h PRO 64 N 0.06 -0.06 0.00 7.34 0.13 -1.96 -3.45 132.00 134.07 2jt1 h PRO 64 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2jt1 h PRO 64 Cb 1.36 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.50 2jt1 h PRO 64 CO 0.48 -0.04 0.00 0.41 -0.23 0.00 0.00 178.00 178.62 2jt1 n GLY 65 N -1.03 -1.54 3.52 1.56 0.00 -1.26 -4.94 105.19 101.49 2jt1 n GLY 65 Ca -0.01 -1.43 -0.34 0.00 0.00 0.00 0.00 46.02 44.24 2jt1 n GLY 65 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jt1 s LEU 66 N -2.38 3.17 -0.16 0.99 1.02 -1.06 -3.95 118.68 116.32 2jt1 s LEU 66 Ca 0.00 -0.11 -0.07 0.00 0.02 0.00 0.00 54.13 53.97 2jt1 s LEU 66 Cb 0.00 -1.73 -0.04 0.00 0.02 0.00 0.00 46.19 44.44 2jt1 s LEU 66 CO 0.00 0.24 0.09 0.26 0.02 0.00 0.00 176.35 176.96 2jt1 s TRP 67 N -0.06 3.37 -0.12 0.29 0.52 0.82 0.48 118.94 124.23 2jt1 s TRP 67 Ca 0.01 0.27 -0.04 0.00 0.02 0.00 0.00 56.10 56.36 2jt1 s TRP 67 Cb -0.13 -2.02 0.05 0.00 -1.15 0.00 0.00 33.47 30.22 2jt1 s TRP 67 CO 0.03 0.38 0.11 0.50 0.02 0.00 0.00 176.95 177.99 2jt1 s ARG 68 N -0.17 0.04 0.60 4.98 3.52 0.09 -0.66 118.95 127.35 2jt1 s ARG 68 Ca 0.09 0.20 -0.18 0.00 -0.13 0.00 0.00 55.73 55.71 2jt1 s ARG 68 Cb -0.12 -1.11 -0.03 0.00 -1.56 0.00 0.00 34.95 32.13 2jt1 s ARG 68 CO 0.01 -0.51 1.15 -0.48 -0.81 0.00 0.00 175.30 174.66 2jt1 s LEU 69 N 2.20 3.60 0.05 -0.88 0.05 -1.26 -0.28 118.68 122.17 2jt1 s LEU 69 Ca 0.04 2.21 -0.01 0.00 0.05 0.00 0.00 54.13 56.42 2jt1 s LEU 69 Cb -0.14 -4.58 -0.04 0.00 -2.05 0.00 0.00 46.19 39.38 2jt1 s LEU 69 CO -0.07 -1.52 -0.03 -1.48 -0.55 0.00 0.00 176.35 172.69 2jt1 s LEU 70 N -4.25 2.48 0.00 1.48 2.34 -0.81 -4.84 118.68 115.07 2jt1 s LEU 70 Ca 0.73 -0.98 0.26 0.00 0.06 0.00 0.00 54.13 54.20 2jt1 s LEU 70 Cb -0.25 0.17 0.67 0.00 -0.56 0.00 0.00 46.19 46.21 2jt1 s LEU 70 CO 0.34 -0.58 1.53 1.21 -1.06 0.00 0.00 176.35 177.79