#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 5.13 -0.15 2.62 2.01 -1.26 -4.88 115.64 119.11 1l2n s THR 22 Ca 0.00 0.86 -0.26 0.00 0.31 0.00 0.00 61.69 62.59 1l2n s THR 22 Cb 0.00 -3.80 -0.01 0.00 0.01 0.00 0.00 72.50 68.69 1l2n s THR 22 CO 0.00 0.18 0.88 -1.00 -0.69 0.00 0.00 174.62 173.99 1l2n s HIS 23 N 1.67 3.45 0.39 4.92 3.76 -1.26 0.20 115.29 128.41 1l2n s HIS 23 Ca 0.22 1.35 -0.11 0.00 -0.15 0.00 0.00 55.06 56.37 1l2n s HIS 23 Cb -0.15 -3.05 0.05 0.00 1.11 0.00 0.00 32.58 30.53 1l2n s HIS 23 CO 0.09 -0.22 0.72 0.44 -0.85 0.00 0.00 174.74 174.92 1l2n n ILE 24 N 4.64 0.00 -3.61 0.60 -5.35 -0.81 -4.79 119.36 110.04 1l2n n ILE 24 Ca 0.05 -1.22 -0.21 0.00 -0.27 0.00 0.00 62.75 61.10 1l2n n ILE 24 Cb 0.49 1.03 -0.01 0.00 -1.74 0.00 0.00 39.64 39.40 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 -3.11 6.19 0.01 7.28 2.20 -1.26 -1.41 114.94 124.83 1l2n s ASN 25 Ca 0.20 0.13 0.01 0.00 -0.94 0.00 0.00 52.86 52.25 1l2n s ASN 25 Cb -0.04 -1.73 -0.01 0.00 -2.00 0.00 0.00 41.25 37.48 1l2n s ASN 25 CO 0.14 -0.27 -0.03 -0.22 -2.94 0.00 0.00 177.10 173.79 1l2n s LEU 26 N -4.16 2.07 -0.07 3.54 0.20 -0.25 -2.28 118.68 117.73 1l2n s LEU 26 Ca 0.39 -0.16 -0.01 0.00 0.69 0.00 0.00 54.13 55.04 1l2n s LEU 26 Cb -0.09 -0.08 0.03 0.00 -0.43 0.00 0.00 46.19 45.62 1l2n s LEU 26 CO 0.32 -0.05 0.00 -0.54 -0.29 0.00 0.00 176.35 175.79 1l2n s LYS 27 N -0.43 0.60 -0.21 1.98 3.01 -0.03 -2.14 119.74 122.51 1l2n s LYS 27 Ca -0.03 0.11 -0.06 0.00 -1.01 0.00 0.00 55.97 54.97 1l2n s LYS 27 Cb -0.03 -0.95 -0.03 0.00 -1.01 0.00 0.00 37.83 35.81 1l2n s LYS 27 CO -0.00 -0.29 0.03 0.14 0.51 0.00 0.00 175.35 175.73 1l2n s VAL 28 N 1.92 4.16 -0.03 3.17 -7.23 -0.38 -2.46 120.40 119.55 1l2n s VAL 28 Ca 0.04 -0.24 0.06 0.00 -1.81 0.00 0.00 61.98 60.04 1l2n s VAL 28 Cb -0.12 -2.90 -0.02 0.00 0.56 0.00 0.00 36.38 33.90 1l2n s VAL 28 CO -0.05 0.40 -0.22 -0.94 -0.31 0.00 0.00 175.10 173.98 1l2n s SER 29 N 1.11 3.36 0.18 4.85 1.04 -0.70 -1.42 113.70 122.12 1l2n s SER 29 Ca 0.03 -0.39 -0.23 0.00 0.48 0.00 0.00 55.95 55.84 1l2n s SER 29 Cb -0.14 -0.55 0.06 0.00 0.10 0.00 0.00 66.02 65.48 1l2n s SER 29 CO 0.02 0.32 0.71 -0.62 0.98 0.00 0.00 173.24 174.65 1l2n s ASP 30 N -0.60 -0.40 0.00 7.02 -1.08 0.16 0.19 116.67 121.96 1l2n s ASP 30 Ca 0.09 -0.25 0.00 0.00 -0.52 0.00 0.00 52.55 51.87 1l2n s ASP 30 Cb -0.11 0.61 0.00 0.00 -1.46 0.00 0.00 42.92 41.97 1l2n s ASP 30 CO -0.00 -1.06 0.00 0.61 0.52 0.00 0.00 175.17 175.24 1l2n n GLY 31 N -0.40 0.00 0.00 2.66 0.00 -1.25 -2.18 105.19 104.01 1l2n n GLY 31 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 -1.26 0.64 -4.40 1.61 2.88 -1.26 -4.94 113.62 106.88 1l2n n SER 32 Ca 0.00 -0.83 -0.44 0.00 -1.33 0.00 0.00 58.87 56.27 1l2n n SER 32 Cb 0.00 0.31 -0.05 0.00 -0.75 0.00 0.00 64.21 63.72 1l2n n SER 32 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1l2n s SER 33 N -0.31 6.20 -0.10 -3.46 0.15 -0.93 -5.00 113.70 110.25 1l2n s SER 33 Ca 0.00 -1.24 -0.02 0.00 0.70 0.00 0.00 55.95 55.39 1l2n s SER 33 Cb 0.00 -2.31 0.04 0.00 -1.71 0.00 0.00 66.02 62.04 1l2n s SER 33 CO 0.00 -1.07 0.03 -1.83 1.20 0.00 0.00 173.24 171.57 1l2n s GLU 34 N 2.76 0.42 -0.01 5.44 1.03 -1.26 0.35 118.70 127.43 1l2n s GLU 34 Ca 0.13 0.04 0.01 0.00 0.03 0.00 0.00 54.97 55.19 1l2n s GLU 34 Cb -0.22 -1.19 0.00 0.00 -0.80 0.00 0.00 34.13 31.93 1l2n s GLU 34 CO 0.08 -0.41 -0.03 -1.50 -1.33 0.00 0.00 175.26 172.07 1l2n s ILE 35 N 2.01 0.27 -0.11 1.83 -1.16 -0.51 -5.02 121.20 118.51 1l2n s ILE 35 Ca 0.04 -0.10 -0.00 0.00 -0.51 0.00 0.00 60.65 60.07 1l2n s ILE 35 Cb -0.13 -0.26 0.02 0.00 0.61 0.00 0.00 42.46 42.70 1l2n s ILE 35 CO -0.06 0.10 -0.08 -0.36 -2.81 0.00 0.00 174.94 171.73 1l2n s PHE 36 N 0.19 1.50 0.14 3.50 0.08 -1.26 -1.24 117.98 120.88 1l2n s PHE 36 Ca -0.02 -0.74 -0.16 0.00 0.12 0.00 0.00 56.93 56.13 1l2n s PHE 36 Cb -0.05 -1.24 0.03 0.00 -0.57 0.00 0.00 43.02 41.20 1l2n s PHE 36 CO -0.00 -0.51 0.42 -0.06 -0.10 0.00 0.00 175.22 174.97 1l2n s PHE 37 N 1.66 -0.16 -0.01 0.36 0.08 -0.91 -5.05 117.98 113.95 1l2n s PHE 37 Ca 0.04 -0.17 -0.02 0.00 0.12 0.00 0.00 56.93 56.90 1l2n s PHE 37 Cb -0.13 0.27 -0.04 0.00 -0.57 0.00 0.00 43.02 42.56 1l2n s PHE 37 CO -0.08 -0.75 0.16 0.15 -0.10 0.00 0.00 175.22 174.60 1l2n s LYS 38 N -3.83 3.36 0.18 0.44 1.02 -1.26 -1.08 119.74 118.56 1l2n s LYS 38 Ca 0.05 -0.35 -0.01 0.00 0.02 0.00 0.00 55.97 55.69 1l2n s LYS 38 Cb 0.01 -3.05 -0.04 0.00 -0.52 0.00 0.00 37.83 34.23 1l2n s LYS 38 CO -0.09 0.67 0.09 0.42 -0.92 0.00 0.00 175.35 175.52 1l2n s ILE 39 N -1.28 0.14 -1.03 2.17 1.09 -0.50 -4.92 121.20 116.87 1l2n s ILE 39 Ca 0.26 -1.96 -0.01 0.00 -1.10 0.00 0.00 60.65 57.83 1l2n s ILE 39 Cb -0.12 -2.31 0.31 0.00 -1.06 0.00 0.00 42.46 39.27 1l2n s ILE 39 CO 0.17 -0.21 1.90 0.29 -0.10 0.00 0.00 174.94 176.99 1l2n n LYS 40 N -0.22 5.09 0.00 2.79 4.01 -1.26 -1.92 118.16 126.65 1l2n n LYS 40 Ca -0.02 -4.45 0.00 0.00 -0.51 0.00 0.00 58.31 53.34 1l2n n LYS 40 Cb 0.65 -2.46 0.00 0.00 -0.51 0.00 0.00 35.03 32.71 1l2n n LYS 40 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 1l2n n LYS 41 N 0.02 0.00 -0.04 1.97 5.02 -0.96 -4.55 118.16 119.62 1l2n n LYS 41 Ca 0.49 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 56.56 1l2n n LYS 41 Cb 0.26 0.00 -0.13 0.00 -0.02 0.00 0.00 35.03 35.14 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 0.01 0.84 0.00 -0.18 1.03 0.19 -3.35 112.91 111.45 1l2n h THR 42 Ca 0.00 -2.29 -0.24 0.00 -0.01 0.00 0.00 66.41 63.87 1l2n h THR 42 Cb 0.00 2.44 -0.07 0.00 -1.07 0.00 0.00 68.15 69.45 1l2n h THR 42 CO 0.00 0.62 1.18 1.07 -0.01 0.00 0.00 175.52 178.38 1l2n n THR 43 N -3.97 0.00 -0.02 0.00 5.66 -1.26 -4.70 114.28 109.99 1l2n n THR 43 Ca -0.30 -0.21 -0.16 0.00 -3.05 0.00 0.00 64.05 60.33 1l2n n THR 43 Cb 0.86 -0.09 -0.11 0.00 -1.55 0.00 0.00 70.33 69.44 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 6.85 0.26 -1.30 1.09 0.13 -1.89 0.31 132.00 137.45 1l2n h PRO 44 Ca 0.01 -0.26 0.44 0.00 -0.87 0.00 0.00 66.00 65.32 1l2n h PRO 44 Cb 0.72 0.07 -0.13 0.00 0.13 0.00 0.00 31.00 31.78 1l2n h PRO 44 CO 0.94 0.95 0.83 1.37 -0.23 0.00 0.00 178.00 181.86 1l2n h LEU 45 N -0.32 0.25 0.00 1.56 -0.00 -1.83 1.86 115.31 116.82 1l2n h LEU 45 Ca -0.04 0.15 -0.14 0.00 -0.00 0.00 0.00 57.88 57.86 1l2n h LEU 45 Cb 1.05 0.14 -0.03 0.00 -0.00 0.00 0.00 40.66 41.82 1l2n h LEU 45 CO 0.07 -0.21 -1.83 0.54 -0.00 0.00 0.00 178.44 177.00 1l2n n ARG 46 N -4.75 0.65 0.06 0.17 1.74 -1.21 -3.66 116.66 109.66 1l2n n ARG 46 Ca 0.38 -0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 57.43 1l2n n ARG 46 Cb 1.43 -1.63 -0.01 0.00 -1.02 0.00 0.00 32.46 31.23 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 -0.15 -0.90 5.56 9.65 0.49 -3.22 114.38 125.81 1l2n h ARG 47 Ca -0.18 0.01 0.17 0.00 -1.10 0.00 0.00 59.98 58.87 1l2n h ARG 47 Cb 1.48 0.03 -0.07 0.00 -1.39 0.00 0.00 29.97 30.02 1l2n h ARG 47 CO 0.02 -0.10 0.58 1.25 2.80 0.00 0.00 179.97 184.52 1l2n h LEU 48 N -0.22 0.57 -0.98 3.80 5.85 -0.62 0.49 115.31 124.20 1l2n h LEU 48 Ca -0.02 0.05 0.33 0.00 0.84 0.00 0.00 57.88 59.08 1l2n h LEU 48 Cb 0.12 -0.06 -0.16 0.00 0.37 0.00 0.00 40.66 40.92 1l2n h LEU 48 CO 0.03 0.26 0.42 -0.03 -0.34 0.00 0.00 178.44 178.77 1l2n h MET 49 N 0.59 0.14 0.00 1.25 4.05 -1.62 0.54 114.93 119.87 1l2n h MET 49 Ca 0.46 -0.01 -0.36 0.00 -0.28 0.00 0.00 59.70 59.52 1l2n h MET 49 Cb 0.89 -0.03 -0.06 0.00 -0.80 0.00 0.00 31.60 31.60 1l2n h MET 49 CO -0.21 0.09 -2.35 -1.91 0.23 0.00 0.00 176.91 172.76 1l2n n GLU 50 N -5.22 0.64 0.06 0.39 4.07 -0.10 -3.95 120.64 116.53 1l2n n GLU 50 Ca 0.31 0.12 -0.03 0.00 -0.06 0.00 0.00 57.16 57.50 1l2n n GLU 50 Cb 1.00 -1.48 -0.02 0.00 -0.06 0.00 0.00 31.44 30.89 1l2n n GLU 50 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1l2n h ALA 51 N 0.11 -0.92 0.00 4.31 0.00 0.76 0.50 119.26 124.02 1l2n h ALA 51 Ca -0.53 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1l2n h ALA 51 Cb 1.86 0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.87 1l2n h ALA 51 CO -0.07 -0.92 0.15 0.35 0.00 0.00 0.00 179.25 178.77 1l2n h PHE 52 N -0.18 0.00 -0.01 0.00 3.57 -0.16 1.46 116.94 121.61 1l2n h PHE 52 Ca -0.01 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.49 1l2n h PHE 52 Cb 0.15 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.89 1l2n h PHE 52 CO 0.03 0.00 -0.26 0.00 -2.23 0.00 0.00 178.31 175.85 1l2n n ALA 53 N -1.80 3.09 0.01 2.41 0.00 -0.68 -2.21 120.51 121.34 1l2n n ALA 53 Ca -0.02 -0.53 0.08 0.00 0.00 0.00 0.00 53.44 52.97 1l2n n ALA 53 Cb 0.19 -0.98 -0.12 0.00 0.00 0.00 0.00 19.45 18.54 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 -0.07 0.64 -0.14 0.00 3.00 0.50 -2.60 118.16 119.50 1l2n n LYS 54 Ca 0.12 -0.05 -0.29 0.00 -0.00 0.00 0.00 58.31 58.10 1l2n n LYS 54 Cb 0.42 -1.63 -0.10 0.00 0.00 0.00 0.00 35.03 33.72 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 -2.49 0.58 -0.12 1.64 0.00 -0.99 -4.55 116.66 110.72 1l2n n ARG 55 Ca -0.07 0.26 -0.17 0.00 -0.00 0.00 0.00 57.85 57.87 1l2n n ARG 55 Cb 0.66 -1.48 -0.12 0.00 0.00 0.00 0.00 32.46 31.52 1l2n n ARG 55 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.63 178.57 1l2n n GLN 56 N -4.24 0.65 0.18 -0.14 -0.06 -0.94 -4.29 117.38 108.55 1l2n n GLN 56 Ca -0.53 0.13 0.16 0.00 -2.00 0.00 0.00 57.00 54.76 1l2n n GLN 56 Cb 0.87 -1.51 0.59 0.00 -4.06 0.00 0.00 30.24 26.13 1l2n n GLN 56 CO 0.00 0.00 0.00 0.78 -0.20 0.00 0.00 177.06 177.64 1l2n h GLY 57 N 2.20 0.00 0.71 1.69 0.00 -1.21 0.52 103.07 106.98 1l2n h GLY 57 Ca -0.57 0.00 0.10 0.00 0.00 0.00 0.00 47.33 46.87 1l2n h GLY 57 CO -0.07 0.00 0.57 1.70 0.00 0.00 0.00 176.54 178.73 1l2n h LYS 58 N 0.00 0.82 0.00 4.80 3.64 -1.70 0.17 116.57 124.30 1l2n h LYS 58 Ca 0.13 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1l2n h LYS 58 Cb 1.38 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 1l2n h LYS 58 CO -0.00 0.54 -0.73 0.39 -2.27 0.00 0.00 179.45 177.37 1l2n n GLU 59 N -4.53 0.22 -2.35 1.90 1.02 0.18 -4.93 120.64 112.15 1l2n n GLU 59 Ca 0.15 0.04 -0.06 0.00 -0.02 0.00 0.00 57.16 57.27 1l2n n GLU 59 Cb 0.33 -1.61 -0.01 0.00 -0.02 0.00 0.00 31.44 30.13 1l2n n GLU 59 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 1l2n n MET 60 N -1.91 -2.47 -0.00 3.49 2.81 0.61 -4.72 117.12 114.92 1l2n n MET 60 Ca 0.03 0.31 0.10 0.00 -1.81 0.00 0.00 57.70 56.33 1l2n n MET 60 Cb 0.41 -4.82 -0.13 0.00 -0.71 0.00 0.00 33.22 27.98 1l2n n MET 60 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1l2n n ASP 61 N -1.47 0.75 -4.22 7.83 8.00 -1.26 -4.86 116.55 121.32 1l2n n ASP 61 Ca -0.07 -0.74 -0.33 0.00 0.71 0.00 0.00 54.79 54.36 1l2n n ASP 61 Cb 0.52 1.25 -0.15 0.00 -0.02 0.00 0.00 41.12 42.72 1l2n n ASP 61 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1l2n s SER 62 N -3.36 3.51 -0.23 -2.24 1.04 -1.26 -3.95 113.70 107.20 1l2n s SER 62 Ca 0.04 -0.53 0.21 0.00 0.48 0.00 0.00 55.95 56.15 1l2n s SER 62 Cb 0.15 -1.54 0.49 0.00 0.10 0.00 0.00 66.02 65.22 1l2n s SER 62 CO 0.87 0.05 1.13 0.00 0.98 0.00 0.00 173.24 176.26 1l2n n LEU 63 N 4.31 1.89 -4.11 2.42 -0.00 -1.17 -4.75 117.00 115.58 1l2n n LEU 63 Ca -0.20 -3.11 -0.35 0.00 -0.00 0.00 0.00 56.01 52.35 1l2n n LEU 63 Cb 0.51 0.33 -0.12 0.00 -0.00 0.00 0.00 43.42 44.13 1l2n n LEU 63 CO 0.28 1.09 -0.22 -0.60 -0.00 0.00 0.00 177.39 177.94 1l2n s ARG 64 N -3.37 1.96 -0.29 1.47 3.52 -0.34 -4.61 118.95 117.28 1l2n s ARG 64 Ca 0.30 -1.76 -0.09 0.00 -0.13 0.00 0.00 55.73 54.05 1l2n s ARG 64 Cb 0.34 -3.47 -0.02 0.00 -1.56 0.00 0.00 34.95 30.24 1l2n s ARG 64 CO -0.05 -0.99 0.14 -0.59 -0.81 0.00 0.00 175.30 173.00 1l2n s PHE 65 N 1.11 3.16 0.21 5.12 -0.71 -1.26 0.15 117.98 125.76 1l2n s PHE 65 Ca 0.07 -0.43 -0.22 0.00 -1.04 0.00 0.00 56.93 55.30 1l2n s PHE 65 Cb -0.22 -2.33 0.05 0.00 -1.21 0.00 0.00 43.02 39.31 1l2n s PHE 65 CO -0.04 -0.39 0.66 -0.48 -1.34 0.00 0.00 175.22 173.63 1l2n s LEU 66 N 1.64 -0.43 -0.14 -1.99 0.05 -0.53 -4.32 118.68 112.96 1l2n s LEU 66 Ca 0.05 -0.26 0.00 0.00 0.05 0.00 0.00 54.13 53.97 1l2n s LEU 66 Cb -0.16 2.64 -0.09 0.00 -2.05 0.00 0.00 46.19 46.52 1l2n s LEU 66 CO 0.06 -1.12 -0.13 0.00 -0.55 0.00 0.00 176.35 174.61 1l2n n TYR 67 N -0.41 0.00 0.00 3.48 9.36 0.43 -1.12 117.16 128.90 1l2n n TYR 67 Ca -0.11 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.11 1l2n n TYR 67 Cb 0.62 -0.54 0.00 0.00 -0.63 0.00 0.00 39.34 38.79 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 -3.00 0.00 -1.41 2.98 8.00 -1.26 -4.67 116.55 117.19 1l2n n ASP 68 Ca -0.25 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.24 1l2n n ASP 68 Cb 0.76 -0.04 0.01 0.00 -0.02 0.00 0.00 41.12 41.84 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 3.18 -0.35 0.92 0.44 0.00 -1.26 -4.97 105.19 103.15 1l2n n GLY 69 Ca 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.23 0.00 -3.25 -0.61 -0.00 -1.26 -5.00 119.36 109.01 1l2n n ILE 70 Ca -0.04 -0.30 -0.15 0.00 -0.00 0.00 0.00 62.75 62.26 1l2n n ILE 70 Cb 0.51 0.55 0.08 0.00 -0.00 0.00 0.00 39.64 40.78 1l2n n ILE 70 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.55 177.09 1l2n n ARG 71 N 0.15 -5.50 -3.87 6.28 1.74 -1.26 -5.02 116.66 109.17 1l2n n ARG 71 Ca -0.05 0.76 -0.23 0.00 -0.77 0.00 0.00 57.85 57.56 1l2n n ARG 71 Cb 0.79 -5.49 -0.05 0.00 -1.02 0.00 0.00 32.46 26.69 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 -3.32 2.64 0.35 0.55 -4.36 -1.26 -4.84 121.20 110.95 1l2n s ILE 72 Ca 0.04 -1.53 0.04 0.00 -0.26 0.00 0.00 60.65 58.95 1l2n s ILE 72 Cb -0.01 -3.01 -0.03 0.00 1.25 0.00 0.00 42.46 40.67 1l2n s ILE 72 CO 0.65 -0.04 0.18 -1.10 0.24 0.00 0.00 174.94 174.87 1l2n s GLN 73 N -3.99 1.75 0.00 0.37 -0.21 -1.26 0.16 119.66 116.48 1l2n s GLN 73 Ca 0.43 -2.03 0.00 0.00 0.02 0.00 0.00 55.36 53.79 1l2n s GLN 73 Cb -0.01 -0.16 0.00 0.00 1.00 0.00 0.00 33.01 33.85 1l2n s GLN 73 CO 0.25 -0.51 0.00 0.00 -2.12 0.00 0.00 175.29 172.91 1l2n n ALA 74 N -0.70 0.00 -1.87 6.09 0.00 -1.26 -4.62 120.51 118.15 1l2n n ALA 74 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 1l2n n ALA 74 Cb 0.64 0.00 0.04 0.00 0.00 0.00 0.00 19.45 20.13 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 -0.14 7.01 0.00 0.00 9.92 -1.26 -4.64 116.55 127.44 1l2n n ASP 75 Ca 0.00 -3.81 0.05 0.00 -0.53 0.00 0.00 54.79 50.50 1l2n n ASP 75 Cb 0.00 -0.92 0.23 0.00 -0.64 0.00 0.00 41.12 39.79 1l2n n ASP 75 CO 0.00 0.00 0.00 1.67 0.13 0.00 0.00 177.20 179.00 1l2n n GLN 76 N -0.63 0.05 -3.49 -1.24 0.00 -1.26 -3.90 117.38 106.91 1l2n n GLN 76 Ca 0.53 0.28 -0.35 0.00 -0.00 0.00 0.00 57.00 57.46 1l2n n GLN 76 Cb 0.44 -1.50 -0.06 0.00 0.00 0.00 0.00 30.24 29.12 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 -2.84 5.00 -0.93 1.69 2.01 -1.26 -4.68 115.64 114.63 1l2n s THR 77 Ca 0.07 0.61 0.22 0.00 0.31 0.00 0.00 61.69 62.90 1l2n s THR 77 Cb 0.07 -3.68 0.20 0.00 0.01 0.00 0.00 72.50 69.09 1l2n s THR 77 CO 0.17 0.29 1.70 -0.81 -0.69 0.00 0.00 174.62 175.28 1l2n n PRO 78 N 0.91 0.04 0.00 4.92 -0.04 -1.26 -1.02 135.00 138.56 1l2n n PRO 78 Ca -0.07 0.16 0.10 0.00 -0.04 0.00 0.00 63.50 63.65 1l2n n PRO 78 Cb 0.52 -1.56 -0.07 0.00 -0.04 0.00 0.00 33.50 32.35 1l2n n PRO 78 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1l2n n GLU 79 N -1.64 0.03 -0.13 0.54 1.02 -1.26 -3.64 120.64 115.57 1l2n n GLU 79 Ca 0.05 -0.01 -0.26 0.00 -0.02 0.00 0.00 57.16 56.92 1l2n n GLU 79 Cb 0.27 -1.50 -0.09 0.00 -0.02 0.00 0.00 31.44 30.09 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 -1.54 1.84 -0.14 1.62 -0.08 -0.95 -3.88 116.55 113.43 1l2n n ASP 80 Ca 0.04 0.26 -0.06 0.00 -1.51 0.00 0.00 54.79 53.52 1l2n n ASP 80 Cb 0.34 -0.71 0.03 0.00 2.34 0.00 0.00 41.12 43.13 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 -0.81 0.29 -0.35 -2.67 8.10 -1.19 1.60 115.31 120.29 1l2n h LEU 81 Ca -0.64 0.03 0.00 0.00 0.11 0.00 0.00 57.88 57.38 1l2n h LEU 81 Cb 1.60 -0.03 0.00 0.00 -0.44 0.00 0.00 40.66 41.79 1l2n h LEU 81 CO -0.36 0.21 0.00 -0.67 -4.11 0.00 0.00 178.44 173.51 1l2n n ASP 82 N -4.93 0.28 0.00 0.17 -0.08 -1.24 -3.94 116.55 106.81 1l2n n ASP 82 Ca 0.03 0.58 0.00 0.00 -1.51 0.00 0.00 54.79 53.88 1l2n n ASP 82 Cb 0.12 -0.63 0.00 0.00 2.34 0.00 0.00 41.12 42.94 1l2n n ASP 82 CO 0.00 0.00 0.00 0.80 0.12 0.00 0.00 177.20 178.12 1l2n n MET 83 N -1.82 0.00 -1.23 -0.67 1.56 0.12 -5.01 117.12 110.07 1l2n n MET 83 Ca 0.02 0.00 -0.30 0.00 -0.27 0.00 0.00 57.70 57.15 1l2n n MET 83 Cb 0.17 -0.14 0.12 0.00 2.15 0.00 0.00 33.22 35.52 1l2n n MET 83 CO 0.00 0.00 0.00 -2.00 -0.73 0.00 0.00 175.97 173.24 1l2n s GLU 84 N -0.28 1.64 -0.50 2.12 2.12 0.51 -5.02 118.70 119.28 1l2n s GLU 84 Ca 0.00 0.94 0.04 0.00 0.36 0.00 0.00 54.97 56.31 1l2n s GLU 84 Cb 0.00 -1.84 0.16 0.00 0.26 0.00 0.00 34.13 32.71 1l2n s GLU 84 CO 0.00 -2.01 0.36 0.16 -0.54 0.00 0.00 175.26 173.23 1l2n s ASP 85 N -3.43 2.96 -0.32 -1.70 -4.77 -1.26 -4.56 116.67 103.60 1l2n s ASP 85 Ca 0.62 -3.18 -0.10 0.00 -3.30 0.00 0.00 52.55 46.60 1l2n s ASP 85 Cb -0.18 -0.91 0.19 0.00 -1.09 0.00 0.00 42.92 40.94 1l2n s ASP 85 CO 0.57 -0.17 1.09 0.21 0.70 0.00 0.00 175.17 177.56 1l2n s ASN 86 N -0.29 -0.23 -0.21 2.11 2.47 -1.26 -4.91 114.94 112.61 1l2n s ASN 86 Ca 0.27 -0.15 -0.26 0.00 0.42 0.00 0.00 52.86 53.14 1l2n s ASN 86 Cb -0.05 0.30 -0.00 0.00 -1.45 0.00 0.00 41.25 40.04 1l2n s ASN 86 CO -0.14 -0.02 0.90 -1.81 -3.72 0.00 0.00 177.10 172.30 1l2n s ASP 87 N 1.80 6.96 -0.28 -4.21 1.01 -0.97 -4.74 116.67 116.23 1l2n s ASP 87 Ca 0.16 1.19 -0.15 0.00 0.71 0.00 0.00 52.55 54.47 1l2n s ASP 87 Cb 0.05 -2.48 0.09 0.00 1.01 0.00 0.00 42.92 41.60 1l2n s ASP 87 CO -0.15 -0.52 0.69 -0.51 0.21 0.00 0.00 175.17 174.89 1l2n s ILE 88 N 2.69 -0.21 0.23 0.77 -1.16 -1.26 -0.85 121.20 121.41 1l2n s ILE 88 Ca 0.39 0.00 -0.07 0.00 -0.51 0.00 0.00 60.65 60.46 1l2n s ILE 88 Cb -0.16 -1.00 -0.02 0.00 0.61 0.00 0.00 42.46 41.89 1l2n s ILE 88 CO 0.09 0.00 0.31 -0.63 -2.81 0.00 0.00 174.94 171.90 1l2n s ILE 89 N 1.90 0.00 0.01 2.00 1.01 -1.03 -3.98 121.20 121.12 1l2n s ILE 89 Ca -0.09 -1.71 0.06 0.00 0.00 0.00 0.00 60.65 58.91 1l2n s ILE 89 Cb -0.06 -2.36 -0.03 0.00 0.01 0.00 0.00 42.46 40.01 1l2n s ILE 89 CO -0.20 0.00 -0.15 -0.70 0.00 0.00 0.00 174.94 173.90 1l2n s GLU 90 N -4.06 2.27 0.18 2.79 2.12 -0.28 -1.72 118.70 120.00 1l2n s GLU 90 Ca 0.31 -0.86 0.11 0.00 0.36 0.00 0.00 54.97 54.88 1l2n s GLU 90 Cb 0.03 -2.30 -0.04 0.00 0.26 0.00 0.00 34.13 32.08 1l2n s GLU 90 CO 0.11 0.57 -0.22 0.00 -0.54 0.00 0.00 175.26 175.18 1l2n s ALA 91 N -0.90 2.58 0.37 6.30 0.00 0.13 -1.45 121.76 128.79 1l2n s ALA 91 Ca 0.15 -1.59 -0.03 0.00 0.00 0.00 0.00 51.96 50.48 1l2n s ALA 91 Cb -0.11 -0.40 0.01 0.00 0.00 0.00 0.00 23.12 22.63 1l2n s ALA 91 CO 0.05 0.45 0.54 0.72 0.00 0.00 0.00 175.76 177.51 1l2n n HIS 92 N 0.31 -1.57 -3.87 0.00 8.25 0.41 -3.96 115.22 114.78 1l2n n HIS 92 Ca -0.13 -2.40 -0.36 0.00 -0.26 0.00 0.00 57.72 54.57 1l2n n HIS 92 Cb 0.56 0.61 -0.06 0.00 1.12 0.00 0.00 29.99 32.22 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 -2.77 3.45 -0.51 -0.41 1.81 -1.26 -1.20 118.95 118.07 1l2n s ARG 93 Ca 0.29 -0.16 0.06 0.00 -1.72 0.00 0.00 55.73 54.20 1l2n s ARG 93 Cb -0.01 -3.17 0.20 0.00 -0.45 0.00 0.00 34.95 31.52 1l2n s ARG 93 CO 0.21 0.75 0.77 0.39 -0.68 0.00 0.00 175.30 176.74 1l2n n GLU 94 N 1.73 0.56 -3.32 3.54 -0.58 -1.25 -4.59 120.64 116.72 1l2n n GLU 94 Ca -0.18 -1.95 0.00 0.00 -0.42 0.00 0.00 57.16 54.61 1l2n n GLU 94 Cb 0.54 -1.41 -0.03 0.00 -0.57 0.00 0.00 31.44 29.97 1l2n n GLU 94 CO 0.00 0.00 0.00 -1.14 -0.48 0.00 0.00 177.13 175.51 1l2n s GLN 95 N 0.85 0.52 0.00 3.49 0.74 -1.26 -4.15 119.66 119.85 1l2n s GLN 95 Ca 0.30 1.04 0.27 0.00 0.05 0.00 0.00 55.36 57.02 1l2n s GLN 95 Cb 0.04 0.46 0.84 0.00 1.10 0.00 0.00 33.01 35.45 1l2n s GLN 95 CO -0.08 -0.51 1.63 0.44 -0.55 0.00 0.00 175.29 176.22