#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l2n s THR 22 N 0.00 0.01 -0.36 2.62 -1.32 -1.26 -4.93 115.64 110.39 1l2n s THR 22 Ca 0.00 -0.05 -0.28 0.00 -1.21 0.00 0.00 61.69 60.14 1l2n s THR 22 Cb 0.00 -0.88 0.02 0.00 -1.51 0.00 0.00 72.50 70.13 1l2n s THR 22 CO 0.00 -0.03 1.05 -2.28 -2.21 0.00 0.00 174.62 171.15 1l2n s HIS 23 N -0.37 3.07 0.35 9.09 2.46 -1.26 -0.85 115.29 127.78 1l2n s HIS 23 Ca -0.05 0.99 -0.06 0.00 0.47 0.00 0.00 55.06 56.41 1l2n s HIS 23 Cb -0.03 -3.83 0.03 0.00 -0.13 0.00 0.00 32.58 28.62 1l2n s HIS 23 CO 0.04 -0.88 0.57 0.44 -2.47 0.00 0.00 174.74 172.44 1l2n n ILE 24 N 6.09 0.00 -4.11 0.89 -5.35 -0.86 -4.86 119.36 111.16 1l2n n ILE 24 Ca 0.11 -1.44 -0.22 0.00 -0.27 0.00 0.00 62.75 60.93 1l2n n ILE 24 Cb 0.48 1.01 -0.05 0.00 -1.74 0.00 0.00 39.64 39.34 1l2n n ILE 24 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1l2n s ASN 25 N -3.04 5.08 0.02 7.28 4.22 -1.26 -1.48 114.94 125.75 1l2n s ASN 25 Ca 0.23 -0.49 0.04 0.00 -2.14 0.00 0.00 52.86 50.51 1l2n s ASN 25 Cb -0.02 -1.07 -0.02 0.00 1.28 0.00 0.00 41.25 41.42 1l2n s ASN 25 CO 0.17 -0.12 -0.14 -0.22 -2.04 0.00 0.00 177.10 174.75 1l2n s LEU 26 N -3.82 2.12 -0.17 3.54 0.20 0.52 -2.43 118.68 118.64 1l2n s LEU 26 Ca 0.35 -0.38 -0.01 0.00 0.69 0.00 0.00 54.13 54.77 1l2n s LEU 26 Cb -0.06 -0.61 0.05 0.00 -0.43 0.00 0.00 46.19 45.13 1l2n s LEU 26 CO 0.23 0.07 -0.02 -0.75 -0.29 0.00 0.00 176.35 175.59 1l2n s LYS 27 N -0.87 1.16 -0.25 1.98 2.36 0.02 -1.63 119.74 122.51 1l2n s LYS 27 Ca 0.02 -0.46 -0.13 0.00 -2.55 0.00 0.00 55.97 52.86 1l2n s LYS 27 Cb -0.07 -1.96 -0.04 0.00 -1.05 0.00 0.00 37.83 34.71 1l2n s LYS 27 CO 0.01 -0.48 0.27 0.14 1.55 0.00 0.00 175.35 176.83 1l2n s VAL 28 N 1.71 5.27 -0.07 4.02 -7.23 -0.08 -2.62 120.40 121.39 1l2n s VAL 28 Ca 0.00 0.38 0.03 0.00 -1.81 0.00 0.00 61.98 60.58 1l2n s VAL 28 Cb -0.16 -3.60 -0.02 0.00 0.56 0.00 0.00 36.38 33.16 1l2n s VAL 28 CO -0.07 0.25 -0.16 -0.44 -0.31 0.00 0.00 175.10 174.37 1l2n s SER 29 N 1.40 3.86 0.08 4.85 0.01 -0.60 -1.04 113.70 122.25 1l2n s SER 29 Ca 0.11 -0.28 -0.15 0.00 1.31 0.00 0.00 55.95 56.94 1l2n s SER 29 Cb -0.15 -1.03 0.03 0.00 0.21 0.00 0.00 66.02 65.07 1l2n s SER 29 CO 0.08 0.28 0.34 -1.81 0.41 0.00 0.00 173.24 172.55 1l2n s ASP 30 N -0.36 -0.16 0.00 2.44 1.01 0.14 0.28 116.67 120.02 1l2n s ASP 30 Ca 0.03 -0.26 0.00 0.00 0.71 0.00 0.00 52.55 53.03 1l2n s ASP 30 Cb -0.12 0.41 0.00 0.00 1.01 0.00 0.00 42.92 44.22 1l2n s ASP 30 CO 0.02 -0.73 0.03 0.61 0.21 0.00 0.00 175.17 175.31 1l2n n GLY 31 N 0.18 -0.10 0.00 0.21 0.00 -1.26 -2.08 105.19 102.14 1l2n n GLY 31 Ca -0.17 0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1l2n n GLY 31 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1l2n n SER 32 N -1.67 0.56 -4.34 1.61 2.88 -1.26 -4.94 113.62 106.47 1l2n n SER 32 Ca 0.00 -0.79 -0.45 0.00 -1.33 0.00 0.00 58.87 56.30 1l2n n SER 32 Cb 0.00 0.38 -0.06 0.00 -0.75 0.00 0.00 64.21 63.78 1l2n n SER 32 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1l2n s SER 33 N -0.38 6.14 -0.09 -3.46 0.01 -0.88 -5.03 113.70 110.02 1l2n s SER 33 Ca 0.00 -1.61 -0.00 0.00 1.31 0.00 0.00 55.95 55.65 1l2n s SER 33 Cb 0.00 -2.19 0.02 0.00 0.21 0.00 0.00 66.02 64.07 1l2n s SER 33 CO 0.00 -0.76 -0.05 -1.61 0.41 0.00 0.00 173.24 171.23 1l2n s GLU 34 N 1.60 1.15 0.12 12.44 2.02 -1.26 0.27 118.70 135.05 1l2n s GLU 34 Ca 0.03 -0.13 -0.00 0.00 0.02 0.00 0.00 54.97 54.89 1l2n s GLU 34 Cb -0.27 -1.27 -0.04 0.00 0.10 0.00 0.00 34.13 32.65 1l2n s GLU 34 CO 0.04 -0.22 0.02 0.42 0.02 0.00 0.00 175.26 175.54 1l2n s ILE 35 N 1.58 0.25 -0.14 -1.63 -1.09 -0.21 -5.02 121.20 114.94 1l2n s ILE 35 Ca 0.01 -1.90 -0.12 0.00 -2.23 0.00 0.00 60.65 56.40 1l2n s ILE 35 Cb -0.13 -1.94 0.04 0.00 -1.58 0.00 0.00 42.46 38.85 1l2n s ILE 35 CO -0.05 -0.59 0.36 0.72 -1.23 0.00 0.00 174.94 174.15 1l2n s PHE 36 N -3.94 -0.40 0.16 3.97 -0.71 -1.26 -0.90 117.98 114.89 1l2n s PHE 36 Ca 0.20 0.97 -0.20 0.00 -1.04 0.00 0.00 56.93 56.87 1l2n s PHE 36 Cb 0.07 0.14 0.05 0.00 -1.21 0.00 0.00 43.02 42.07 1l2n s PHE 36 CO -0.00 -0.20 0.53 -0.06 -1.34 0.00 0.00 175.22 174.15 1l2n s PHE 37 N 0.31 -0.36 -0.10 3.49 0.08 -0.64 -5.04 117.98 115.72 1l2n s PHE 37 Ca -0.01 0.08 -0.04 0.00 0.12 0.00 0.00 56.93 57.08 1l2n s PHE 37 Cb -0.03 0.45 -0.04 0.00 -0.57 0.00 0.00 43.02 42.83 1l2n s PHE 37 CO -0.01 -0.83 0.07 0.15 -0.10 0.00 0.00 175.22 174.51 1l2n s LYS 38 N -3.79 3.21 0.01 0.44 1.02 -1.26 -0.36 119.74 119.02 1l2n s LYS 38 Ca 0.03 -0.27 -0.02 0.00 0.02 0.00 0.00 55.97 55.74 1l2n s LYS 38 Cb -0.00 -2.99 -0.01 0.00 -0.52 0.00 0.00 37.83 34.30 1l2n s LYS 38 CO -0.10 0.74 0.01 0.42 -0.92 0.00 0.00 175.35 175.50 1l2n s ILE 39 N -0.96 0.10 -1.36 2.17 1.09 -0.55 -4.94 121.20 116.74 1l2n s ILE 39 Ca 0.14 -0.79 -0.09 0.00 -1.10 0.00 0.00 60.65 58.82 1l2n s ILE 39 Cb -0.12 -0.28 -0.08 0.00 -1.06 0.00 0.00 42.46 40.92 1l2n s ILE 39 CO 0.03 -0.43 2.95 1.17 -0.10 0.00 0.00 174.94 178.56 1l2n n LYS 40 N 1.68 3.61 0.00 2.79 3.00 -1.26 -2.03 118.16 125.95 1l2n n LYS 40 Ca -0.23 -2.26 0.00 0.00 -0.00 0.00 0.00 58.31 55.83 1l2n n LYS 40 Cb 0.55 -2.66 0.00 0.00 0.00 0.00 0.00 35.03 32.92 1l2n n LYS 40 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1l2n n LYS 41 N 3.10 0.00 -0.02 1.64 5.02 -0.42 -4.61 118.16 122.87 1l2n n LYS 41 Ca 0.71 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 56.79 1l2n n LYS 41 Cb 0.32 0.00 -0.13 0.00 -0.02 0.00 0.00 35.03 35.20 1l2n n LYS 41 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1l2n h THR 42 N 0.06 0.75 0.00 -0.18 1.03 -1.28 -3.38 112.91 109.92 1l2n h THR 42 Ca 0.00 -2.31 -0.17 0.00 -0.01 0.00 0.00 66.41 63.92 1l2n h THR 42 Cb 0.00 2.46 -0.05 0.00 -1.07 0.00 0.00 68.15 69.48 1l2n h THR 42 CO 0.00 0.73 0.93 1.07 -0.01 0.00 0.00 175.52 178.23 1l2n n THR 43 N -3.78 0.00 -0.02 0.00 5.66 -1.26 -4.69 114.28 110.19 1l2n n THR 43 Ca -0.31 -0.22 -0.15 0.00 -3.05 0.00 0.00 64.05 60.32 1l2n n THR 43 Cb 0.94 -0.01 -0.11 0.00 -1.55 0.00 0.00 70.33 69.60 1l2n n THR 43 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 175.07 173.57 1l2n h PRO 44 N 5.07 0.25 -1.18 1.09 0.13 -1.89 0.03 132.00 135.49 1l2n h PRO 44 Ca 0.02 -0.24 0.44 0.00 -0.87 0.00 0.00 66.00 65.35 1l2n h PRO 44 Cb 0.52 0.06 -0.15 0.00 0.13 0.00 0.00 31.00 31.56 1l2n h PRO 44 CO 0.74 0.93 0.71 1.47 -0.23 0.00 0.00 178.00 181.62 1l2n n LEU 45 N -4.45 0.26 -0.03 1.56 -0.00 -1.26 0.25 117.00 113.32 1l2n n LEU 45 Ca -0.09 1.44 -0.01 0.00 -0.00 0.00 0.00 56.01 57.35 1l2n n LEU 45 Cb 0.52 -0.71 -0.13 0.00 -0.00 0.00 0.00 43.42 43.10 1l2n n LEU 45 CO 0.41 -1.59 -0.74 0.54 -0.00 0.00 0.00 177.39 176.01 1l2n n ARG 46 N -4.86 0.66 0.16 1.47 1.74 -1.21 -3.63 116.66 110.98 1l2n n ARG 46 Ca 0.38 0.03 -0.06 0.00 -0.77 0.00 0.00 57.85 57.42 1l2n n ARG 46 Cb 1.40 -1.63 -0.03 0.00 -1.02 0.00 0.00 32.46 31.18 1l2n n ARG 46 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 1l2n h ARG 47 N 0.00 -0.40 -0.97 5.56 9.65 0.53 -3.13 114.38 125.61 1l2n h ARG 47 Ca -0.27 0.03 0.12 0.00 -1.10 0.00 0.00 59.98 58.76 1l2n h ARG 47 Cb 1.69 0.09 -0.08 0.00 -1.39 0.00 0.00 29.97 30.28 1l2n h ARG 47 CO 0.03 -0.27 0.60 1.25 2.80 0.00 0.00 179.97 184.38 1l2n h LEU 48 N -0.53 0.88 -1.00 3.80 5.85 -0.49 0.62 115.31 124.44 1l2n h LEU 48 Ca -0.04 0.05 0.38 0.00 0.84 0.00 0.00 57.88 59.11 1l2n h LEU 48 Cb 0.32 -0.12 -0.17 0.00 0.37 0.00 0.00 40.66 41.05 1l2n h LEU 48 CO 0.07 0.47 0.49 -0.03 -0.34 0.00 0.00 178.44 179.10 1l2n h MET 49 N 0.95 0.06 0.00 1.25 4.05 -1.61 0.49 114.93 120.13 1l2n h MET 49 Ca 0.48 -0.00 -0.45 0.00 -0.28 0.00 0.00 59.70 59.45 1l2n h MET 49 Cb 0.47 -0.01 -0.07 0.00 -0.80 0.00 0.00 31.60 31.19 1l2n h MET 49 CO -0.27 0.04 -2.50 -1.91 0.23 0.00 0.00 176.91 172.50 1l2n n GLU 50 N -5.25 0.58 0.01 0.39 2.13 -0.31 -3.92 120.64 114.28 1l2n n GLU 50 Ca 0.35 0.24 -0.05 0.00 0.66 0.00 0.00 57.16 58.36 1l2n n GLU 50 Cb 1.17 -1.47 -0.03 0.00 0.27 0.00 0.00 31.44 31.38 1l2n n GLU 50 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1l2n h ALA 51 N -0.83 -0.62 -0.01 4.31 0.00 0.78 1.66 119.26 124.55 1l2n h ALA 51 Ca -0.67 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.22 1l2n h ALA 51 Cb 1.64 0.68 -0.00 0.00 0.00 0.00 0.00 17.79 20.11 1l2n h ALA 51 CO -0.37 -0.68 0.22 0.35 0.00 0.00 0.00 179.25 178.77 1l2n h PHE 52 N -0.21 0.00 -0.00 0.00 3.57 -0.23 1.47 116.94 121.53 1l2n h PHE 52 Ca 0.01 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1l2n h PHE 52 Cb 0.23 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.97 1l2n h PHE 52 CO -0.44 0.00 -0.51 0.00 -2.23 0.00 0.00 178.31 175.13 1l2n n ALA 53 N -1.97 3.62 -0.04 2.41 0.00 0.84 -0.69 120.51 124.68 1l2n n ALA 53 Ca -0.02 -0.45 -0.08 0.00 0.00 0.00 0.00 53.44 52.89 1l2n n ALA 53 Cb 0.28 -1.02 -0.14 0.00 0.00 0.00 0.00 19.45 18.57 1l2n n ALA 53 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1l2n n LYS 54 N -1.02 0.65 -0.10 0.00 3.00 0.53 -3.09 118.16 118.12 1l2n n LYS 54 Ca 0.08 0.19 -0.15 0.00 -0.00 0.00 0.00 58.31 58.44 1l2n n LYS 54 Cb 0.36 -1.71 -0.05 0.00 0.00 0.00 0.00 35.03 33.63 1l2n n LYS 54 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 1l2n n ARG 55 N -2.93 0.53 0.04 1.64 3.00 -0.55 -4.53 116.66 113.86 1l2n n ARG 55 Ca -0.21 0.22 -0.21 0.00 -0.00 0.00 0.00 57.85 57.65 1l2n n ARG 55 Cb 1.05 -1.41 -0.14 0.00 0.00 0.00 0.00 32.46 31.95 1l2n n ARG 55 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.63 178.00 1l2n h GLN 56 N -0.97 0.31 -1.00 -0.14 -0.00 -1.44 -3.29 115.11 108.58 1l2n h GLN 56 Ca -0.20 -0.52 0.29 0.00 -0.00 0.00 0.00 58.65 58.22 1l2n h GLN 56 Cb 1.15 0.19 -0.04 0.00 0.00 0.00 0.00 27.48 28.79 1l2n h GLN 56 CO -0.12 1.25 1.07 0.78 0.00 0.00 0.00 178.83 181.81 1l2n h GLY 57 N -0.10 0.00 0.42 2.39 0.00 -0.84 1.02 103.07 105.97 1l2n h GLY 57 Ca -0.23 0.00 0.12 0.00 0.00 0.00 0.00 47.33 47.22 1l2n h GLY 57 CO 0.13 0.00 0.50 1.70 0.00 0.00 0.00 176.54 178.87 1l2n h LYS 58 N 0.00 0.77 0.00 4.80 3.64 -1.63 0.16 116.57 124.31 1l2n h LYS 58 Ca 0.47 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.81 1l2n h LYS 58 Cb 2.61 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 34.26 1l2n h LYS 58 CO -0.00 0.51 -0.63 0.39 -2.27 0.00 0.00 179.45 177.44 1l2n n GLU 59 N -4.75 0.14 -2.47 1.90 1.02 0.35 -4.91 120.64 111.91 1l2n n GLU 59 Ca 0.16 0.03 -0.06 0.00 -0.02 0.00 0.00 57.16 57.26 1l2n n GLU 59 Cb 0.35 -1.57 -0.01 0.00 -0.02 0.00 0.00 31.44 30.18 1l2n n GLU 59 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1l2n n MET 60 N -1.76 -2.28 0.00 3.49 0.00 0.56 -4.64 117.12 112.49 1l2n n MET 60 Ca 0.04 0.02 0.10 0.00 0.00 0.00 0.00 57.70 57.87 1l2n n MET 60 Cb 0.38 -3.69 -0.10 0.00 0.00 0.00 0.00 33.22 29.82 1l2n n MET 60 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1l2n n ASP 61 N -1.33 0.69 -4.16 3.17 8.00 -1.26 -4.86 116.55 116.79 1l2n n ASP 61 Ca 0.02 -0.62 -0.32 0.00 0.71 0.00 0.00 54.79 54.58 1l2n n ASP 61 Cb 0.40 1.17 -0.17 0.00 -0.02 0.00 0.00 41.12 42.50 1l2n n ASP 61 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1l2n s SER 62 N -3.48 2.98 -0.23 -2.24 0.01 -1.26 -3.87 113.70 105.60 1l2n s SER 62 Ca 0.04 -0.56 0.21 0.00 1.31 0.00 0.00 55.95 56.95 1l2n s SER 62 Cb 0.15 -1.37 0.47 0.00 0.21 0.00 0.00 66.02 65.48 1l2n s SER 62 CO 0.86 0.08 1.19 0.00 0.41 0.00 0.00 173.24 175.78 1l2n n LEU 63 N 3.98 0.93 -4.16 2.44 -0.00 -1.10 -4.81 117.00 114.28 1l2n n LEU 63 Ca -0.20 -2.89 -0.38 0.00 -0.00 0.00 0.00 56.01 52.55 1l2n n LEU 63 Cb 0.52 0.34 -0.11 0.00 -0.00 0.00 0.00 43.42 44.17 1l2n n LEU 63 CO 0.27 1.09 -0.13 -0.60 -0.00 0.00 0.00 177.39 178.01 1l2n s ARG 64 N -2.57 2.18 -0.65 1.47 3.52 0.02 -4.65 118.95 118.27 1l2n s ARG 64 Ca 0.24 -1.76 -0.24 0.00 -0.13 0.00 0.00 55.73 53.83 1l2n s ARG 64 Cb 0.34 -3.67 0.05 0.00 -1.56 0.00 0.00 34.95 30.11 1l2n s ARG 64 CO -0.07 -1.08 1.05 -0.59 -0.81 0.00 0.00 175.30 173.80 1l2n s PHE 65 N 1.22 2.60 0.05 5.12 -0.71 -1.26 0.17 117.98 125.17 1l2n s PHE 65 Ca 0.07 -0.25 0.02 0.00 -1.04 0.00 0.00 56.93 55.73 1l2n s PHE 65 Cb -0.24 -4.34 -0.03 0.00 -1.21 0.00 0.00 43.02 37.21 1l2n s PHE 65 CO -0.03 -1.69 -0.07 -1.17 -1.34 0.00 0.00 175.22 170.92 1l2n s LEU 66 N 4.51 2.30 -0.04 -1.99 0.20 -0.19 -3.31 118.68 120.16 1l2n s LEU 66 Ca 0.28 -0.63 0.00 0.00 0.69 0.00 0.00 54.13 54.48 1l2n s LEU 66 Cb -0.13 -0.13 -0.03 0.00 -0.43 0.00 0.00 46.19 45.47 1l2n s LEU 66 CO 0.14 -0.26 -0.03 0.00 -0.29 0.00 0.00 176.35 175.91 1l2n n TYR 67 N 1.19 0.00 0.00 5.38 9.36 0.50 -1.12 117.16 132.47 1l2n n TYR 67 Ca -0.21 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.01 1l2n n TYR 67 Cb 0.56 -0.15 0.00 0.00 -0.63 0.00 0.00 39.34 39.11 1l2n n TYR 67 CO 0.00 0.00 0.00 -0.25 0.22 0.00 0.00 176.86 176.83 1l2n n ASP 68 N -2.58 0.00 -2.31 2.98 8.00 -1.26 -4.75 116.55 116.63 1l2n n ASP 68 Ca -0.07 0.00 -0.03 0.00 0.71 0.00 0.00 54.79 55.40 1l2n n ASP 68 Cb 0.58 0.00 0.04 0.00 -0.02 0.00 0.00 41.12 41.71 1l2n n ASP 68 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1l2n n GLY 69 N 3.17 -0.00 2.47 0.44 0.00 -1.26 -4.99 105.19 105.01 1l2n n GLY 69 Ca 0.00 -0.06 -0.03 0.00 0.00 0.00 0.00 46.02 45.93 1l2n n GLY 69 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1l2n n ILE 70 N -0.57 0.00 -4.29 -0.61 -5.35 -1.26 -4.99 119.36 102.29 1l2n n ILE 70 Ca -0.14 -0.90 -0.32 0.00 -0.27 0.00 0.00 62.75 61.12 1l2n n ILE 70 Cb 0.67 0.86 -0.09 0.00 -1.74 0.00 0.00 39.64 39.34 1l2n n ILE 70 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1l2n n ARG 71 N -0.92 -0.98 -3.68 6.28 1.74 -1.26 -4.92 116.66 112.92 1l2n n ARG 71 Ca -0.12 0.10 -0.22 0.00 -0.77 0.00 0.00 57.85 56.84 1l2n n ARG 71 Cb 0.78 -3.54 -0.04 0.00 -1.02 0.00 0.00 32.46 28.64 1l2n n ARG 71 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 1l2n s ILE 72 N -4.31 2.54 0.43 0.55 -4.36 -1.21 -4.66 121.20 110.18 1l2n s ILE 72 Ca 0.03 -1.42 0.03 0.00 -0.26 0.00 0.00 60.65 59.04 1l2n s ILE 72 Cb -0.02 -2.95 -0.03 0.00 1.25 0.00 0.00 42.46 40.70 1l2n s ILE 72 CO 0.99 0.00 0.05 -1.10 0.24 0.00 0.00 174.94 175.13 1l2n s GLN 73 N -4.10 1.99 0.00 0.37 1.11 -1.26 0.19 119.66 117.96 1l2n s GLN 73 Ca 0.46 -2.21 0.00 0.00 0.01 0.00 0.00 55.36 53.62 1l2n s GLN 73 Cb -0.02 -1.16 0.00 0.00 -1.01 0.00 0.00 33.01 30.82 1l2n s GLN 73 CO 0.27 -0.32 0.00 0.00 0.01 0.00 0.00 175.29 175.25 1l2n n ALA 74 N -1.02 0.00 -1.04 6.09 0.00 -1.25 -4.57 120.51 118.73 1l2n n ALA 74 Ca -0.10 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.15 1l2n n ALA 74 Cb 0.66 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.12 1l2n n ALA 74 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1l2n n ASP 75 N 0.00 6.41 0.00 0.00 10.43 -1.26 -4.44 116.55 127.69 1l2n n ASP 75 Ca 0.00 -3.07 0.05 0.00 2.57 0.00 0.00 54.79 54.35 1l2n n ASP 75 Cb 0.00 -1.11 0.27 0.00 1.84 0.00 0.00 41.12 42.11 1l2n n ASP 75 CO 0.00 0.00 0.00 1.67 -1.07 0.00 0.00 177.20 177.80 1l2n n GLN 76 N 0.57 0.12 -3.76 -1.24 0.00 -1.26 -4.11 117.38 107.70 1l2n n GLN 76 Ca 0.35 0.22 -0.35 0.00 -0.00 0.00 0.00 57.00 57.21 1l2n n GLN 76 Cb 0.58 -1.50 -0.05 0.00 0.00 0.00 0.00 30.24 29.27 1l2n n GLN 76 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 1l2n s THR 77 N -2.69 5.31 -0.46 1.69 2.01 -1.26 -4.72 115.64 115.52 1l2n s THR 77 Ca 0.09 0.21 0.26 0.00 0.31 0.00 0.00 61.69 62.57 1l2n s THR 77 Cb 0.07 -3.56 0.30 0.00 0.01 0.00 0.00 72.50 69.33 1l2n s THR 77 CO 0.18 0.40 1.77 1.55 -0.69 0.00 0.00 174.62 177.83 1l2n h PRO 78 N 4.13 0.00 0.00 4.92 0.13 -2.00 -1.13 132.00 138.06 1l2n h PRO 78 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1l2n h PRO 78 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1l2n h PRO 78 CO 0.65 0.00 -0.51 0.39 -0.23 0.00 0.00 178.00 178.30 1l2n n GLU 79 N -2.53 0.10 -0.10 0.86 1.02 -1.26 -3.12 120.64 115.61 1l2n n GLU 79 Ca 0.03 0.03 -0.14 0.00 -0.02 0.00 0.00 57.16 57.06 1l2n n GLU 79 Cb 0.36 -1.56 -0.05 0.00 -0.02 0.00 0.00 31.44 30.17 1l2n n GLU 79 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1l2n n ASP 80 N -1.70 1.93 -0.35 1.62 -0.08 -0.98 -3.97 116.55 113.02 1l2n n ASP 80 Ca 0.05 0.33 0.13 0.00 -1.51 0.00 0.00 54.79 53.79 1l2n n ASP 80 Cb 0.37 -0.76 0.32 0.00 2.34 0.00 0.00 41.12 43.40 1l2n n ASP 80 CO 0.00 0.00 0.00 0.17 0.12 0.00 0.00 177.20 177.49 1l2n h LEU 81 N -0.99 0.78 -1.88 -2.67 8.10 -1.38 1.99 115.31 119.25 1l2n h LEU 81 Ca -0.18 0.10 -0.03 0.00 0.11 0.00 0.00 57.88 57.88 1l2n h LEU 81 Cb 1.15 -0.04 -0.00 0.00 -0.44 0.00 0.00 40.66 41.33 1l2n h LEU 81 CO -0.11 0.27 -0.13 -0.78 -4.11 0.00 0.00 178.44 173.58 1l2n h ASP 82 N 0.75 0.00 0.00 0.17 1.82 -1.76 -3.36 116.42 114.04 1l2n h ASP 82 Ca 0.58 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 57.22 1l2n h ASP 82 Cb 0.91 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.92 1l2n h ASP 82 CO -0.39 0.13 0.00 0.80 -1.61 0.00 0.00 179.24 178.17 1l2n n MET 83 N -3.83 0.00 -0.57 0.28 1.56 0.45 -5.02 117.12 109.99 1l2n n MET 83 Ca -0.02 0.00 -0.30 0.00 -0.27 0.00 0.00 57.70 57.11 1l2n n MET 83 Cb 0.23 -0.12 0.22 0.00 2.15 0.00 0.00 33.22 35.70 1l2n n MET 83 CO 0.00 0.00 0.00 -1.91 -0.73 0.00 0.00 175.97 173.33 1l2n n GLU 84 N -1.74 -1.69 -3.35 2.12 4.07 0.57 -5.01 120.64 115.61 1l2n n GLU 84 Ca 0.00 -0.45 -0.25 0.00 -0.06 0.00 0.00 57.16 56.40 1l2n n GLU 84 Cb 0.00 -2.17 -0.09 0.00 -0.06 0.00 0.00 31.44 29.12 1l2n n GLU 84 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 1l2n s ASP 85 N -2.40 1.49 -0.30 4.31 1.11 -1.26 -4.47 116.67 115.15 1l2n s ASP 85 Ca 0.66 -2.63 -0.12 0.00 0.18 0.00 0.00 52.55 50.64 1l2n s ASP 85 Cb -0.23 -0.14 0.18 0.00 1.07 0.00 0.00 42.92 43.80 1l2n s ASP 85 CO 0.63 -0.20 1.09 0.21 1.18 0.00 0.00 175.17 178.08 1l2n s ASN 86 N 0.48 -0.29 -0.29 0.27 2.47 -1.26 -4.94 114.94 111.38 1l2n s ASN 86 Ca 0.28 -0.01 -0.22 0.00 0.42 0.00 0.00 52.86 53.33 1l2n s ASN 86 Cb -0.04 0.98 -0.01 0.00 -1.45 0.00 0.00 41.25 40.73 1l2n s ASN 86 CO -0.12 -0.05 0.72 -1.81 -3.72 0.00 0.00 177.10 172.11 1l2n s ASP 87 N 2.73 6.61 -0.27 -4.21 1.01 -1.02 -4.61 116.67 116.90 1l2n s ASP 87 Ca 0.26 0.62 -0.15 0.00 0.71 0.00 0.00 52.55 53.99 1l2n s ASP 87 Cb 0.00 -2.37 0.08 0.00 1.01 0.00 0.00 42.92 41.64 1l2n s ASP 87 CO -0.21 -0.53 0.66 0.27 0.21 0.00 0.00 175.17 175.58 1l2n s ILE 88 N 2.77 -0.09 0.22 0.77 -0.00 -1.26 -0.80 121.20 122.82 1l2n s ILE 88 Ca 0.29 0.01 -0.12 0.00 -0.00 0.00 0.00 60.65 60.84 1l2n s ILE 88 Cb -0.15 -0.97 -0.00 0.00 -0.00 0.00 0.00 42.46 41.34 1l2n s ILE 88 CO 0.11 0.00 0.42 -0.63 -0.00 0.00 0.00 174.94 174.85 1l2n s ILE 89 N 1.73 0.01 -0.09 8.37 1.01 -1.08 -3.89 121.20 127.27 1l2n s ILE 89 Ca -0.10 -1.39 0.03 0.00 0.00 0.00 0.00 60.65 59.19 1l2n s ILE 89 Cb -0.06 -2.11 -0.01 0.00 0.01 0.00 0.00 42.46 40.29 1l2n s ILE 89 CO -0.19 -0.06 -0.19 -0.70 0.00 0.00 0.00 174.94 173.79 1l2n s GLU 90 N -4.01 2.89 -0.51 2.79 2.12 -0.27 -1.56 118.70 120.15 1l2n s GLU 90 Ca 0.22 -0.80 -0.02 0.00 0.36 0.00 0.00 54.97 54.72 1l2n s GLU 90 Cb 0.01 -2.37 0.13 0.00 0.26 0.00 0.00 34.13 32.16 1l2n s GLU 90 CO 0.07 0.33 0.31 0.00 -0.54 0.00 0.00 175.26 175.43 1l2n s ALA 91 N -0.00 3.35 1.02 6.30 0.00 0.14 -1.02 121.76 131.55 1l2n s ALA 91 Ca -0.06 -2.91 -0.15 0.00 0.00 0.00 0.00 51.96 48.83 1l2n s ALA 91 Cb -0.15 -2.50 0.21 0.00 0.00 0.00 0.00 23.12 20.68 1l2n s ALA 91 CO 0.05 -1.95 1.18 0.72 0.00 0.00 0.00 175.76 175.76 1l2n n HIS 92 N 3.98 -3.99 -3.59 0.00 8.25 0.44 -4.32 115.22 116.01 1l2n n HIS 92 Ca 0.03 -1.04 -0.37 0.00 -0.26 0.00 0.00 57.72 56.08 1l2n n HIS 92 Cb 0.39 -0.93 -0.06 0.00 1.12 0.00 0.00 29.99 30.51 1l2n n HIS 92 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1l2n s ARG 93 N -5.59 3.80 -0.52 -0.41 1.81 -1.26 -0.80 118.95 115.98 1l2n s ARG 93 Ca 0.67 0.26 0.07 0.00 -1.72 0.00 0.00 55.73 55.01 1l2n s ARG 93 Cb -0.02 -3.17 0.19 0.00 -0.45 0.00 0.00 34.95 31.50 1l2n s ARG 93 CO 0.48 0.68 0.73 0.39 -0.68 0.00 0.00 175.30 176.90 1l2n n GLU 94 N 1.65 0.55 -3.17 3.54 1.02 -1.25 -4.57 120.64 118.41 1l2n n GLU 94 Ca -0.14 -2.04 0.02 0.00 -0.02 0.00 0.00 57.16 54.99 1l2n n GLU 94 Cb 0.53 -1.47 -0.01 0.00 -0.02 0.00 0.00 31.44 30.47 1l2n n GLU 94 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 1l2n s GLN 95 N 0.85 0.54 0.00 3.49 2.00 -1.26 -4.20 119.66 121.07 1l2n s GLN 95 Ca 0.30 0.49 0.13 0.00 -2.00 0.00 0.00 55.36 54.27 1l2n s GLN 95 Cb 0.02 0.17 0.10 0.00 0.80 0.00 0.00 33.01 34.10 1l2n s GLN 95 CO -0.06 -1.05 0.90 -0.89 -0.50 0.00 0.00 175.29 173.68