#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 5.30 -0.16 2.62 2.01 -1.26 -4.90 115.64 119.25 1l2n s THR 22 Ca 0.00 0.52 -0.24 0.00 0.31 0.00 0.00 61.69 62.27 1l2n s THR 22 Cb 0.00 -3.63 -0.02 0.00 0.01 0.00 0.00 72.50 68.86 1l2n s THR 22 CO 0.00 0.35 0.78 -1.00 -0.69 0.00 0.00 174.62 174.06 1l2n s HIS 23 N 0.73 3.44 0.35 4.92 3.76 -1.26 0.21 115.29 127.45 1l2n s HIS 23 Ca 0.15 1.20 -0.10 0.00 -0.15 0.00 0.00 55.06 56.17 1l2n s HIS 23 Cb -0.13 -2.95 0.04 0.00 1.11 0.00 0.00 32.58 30.65 1l2n s HIS 23 CO 0.04 -0.17 0.65 0.44 -0.85 0.00 0.00 174.74 174.85 1l2n n ILE 24 N 4.57 0.00 -3.75 0.60 -5.35 -0.80 -4.78 119.36 109.84 1l2n n ILE 24 Ca 0.03 -1.13 -0.26 0.00 -0.27 0.00 0.00 62.75 61.11 1l2n n ILE 24 Cb 0.49 0.94 -0.03 0.00 -1.74 0.00 0.00 39.64 39.31 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 -2.94 6.36 0.04 7.28 4.22 -1.26 -1.57 114.94 127.07 1l2n s ASN 25 Ca 0.18 0.32 0.06 0.00 -2.14 0.00 0.00 52.86 51.28 1l2n s ASN 25 Cb -0.03 -1.97 -0.02 0.00 1.28 0.00 0.00 41.25 40.50 1l2n s ASN 25 CO 0.13 -0.05 -0.18 -0.22 -2.04 0.00 0.00 177.10 174.75 1l2n s LEU 26 N -3.45 2.16 -0.20 3.54 0.20 0.74 -2.58 118.68 119.09 1l2n s LEU 26 Ca 0.37 -0.48 -0.02 0.00 0.69 0.00 0.00 54.13 54.69 1l2n s LEU 26 Cb -0.11 -0.82 0.06 0.00 -0.43 0.00 0.00 46.19 44.90 1l2n s LEU 26 CO 0.29 0.11 0.02 -0.75 -0.29 0.00 0.00 176.35 175.74 1l2n s LYS 27 N -1.09 0.77 -0.25 1.98 2.36 0.11 -1.42 119.74 122.19 1l2n s LYS 27 Ca 0.05 -0.48 -0.15 0.00 -2.55 0.00 0.00 55.97 52.85 1l2n s LYS 27 Cb -0.08 -2.14 -0.04 0.00 -1.05 0.00 0.00 37.83 34.52 1l2n s LYS 27 CO 0.01 -0.63 0.37 0.14 1.55 0.00 0.00 175.35 176.80 1l2n s VAL 28 N 1.81 5.19 -0.45 4.02 -7.23 -0.22 -2.38 120.40 121.14 1l2n s VAL 28 Ca -0.01 0.59 -0.14 0.00 -1.81 0.00 0.00 61.98 60.60 1l2n s VAL 28 Cb -0.17 -3.70 0.06 0.00 0.56 0.00 0.00 36.38 33.13 1l2n s VAL 28 CO -0.08 0.19 0.35 -0.44 -0.31 0.00 0.00 175.10 174.81 1l2n s SER 29 N 1.46 6.05 0.05 4.85 0.01 0.79 -0.93 113.70 125.99 1l2n s SER 29 Ca 0.16 -1.23 0.04 0.00 1.31 0.00 0.00 55.95 56.23 1l2n s SER 29 Cb -0.15 -2.15 -0.02 0.00 0.21 0.00 0.00 66.02 63.91 1l2n s SER 29 CO 0.09 -0.57 -0.12 -0.62 0.41 0.00 0.00 173.24 172.43 1l2n s ASP 30 N 2.27 1.41 0.00 2.44 -1.08 -1.26 0.42 116.67 120.86 1l2n s ASP 30 Ca 0.04 -0.51 0.00 0.00 -0.52 0.00 0.00 52.55 51.56 1l2n s ASP 30 Cb -0.23 -0.05 0.00 0.00 -1.46 0.00 0.00 42.92 41.18 1l2n s ASP 30 CO 0.07 -0.06 0.00 0.61 0.52 0.00 0.00 175.17 176.31 1l2n n GLY 31 N 1.65 0.00 0.00 2.66 0.00 -1.26 -0.86 105.19 107.38 1l2n n GLY 31 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.97 0.69 0.01 1.61 2.88 -1.26 -4.55 113.62 112.04 1l2n n SER 32 Ca 0.00 -0.86 0.13 0.00 -1.33 0.00 0.00 58.87 56.81 1l2n n SER 32 Cb 0.00 0.25 0.39 0.00 -0.75 0.00 0.00 64.21 64.10 1l2n n SER 32 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1l2n n SER 33 N -0.25 0.36 -4.39 -3.46 2.88 -0.98 -4.89 113.62 102.89 1l2n n SER 33 Ca 0.00 0.13 -0.62 0.00 -1.33 0.00 0.00 58.87 57.05 1l2n n SER 33 Cb 0.01 -0.11 -0.11 0.00 -0.75 0.00 0.00 64.21 63.25 1l2n n SER 33 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 1l2n n GLU 34 N -1.63 0.05 -3.97 -1.46 0.28 -0.04 -4.64 120.64 109.22 1l2n n GLU 34 Ca 0.06 0.01 -0.08 0.00 -0.16 0.00 0.00 57.16 56.99 1l2n n GLU 34 Cb 0.36 -1.54 -0.09 0.00 1.43 0.00 0.00 31.44 31.60 1l2n n GLU 34 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 1l2n s ILE 35 N 5.27 0.17 0.00 3.84 -1.09 -0.11 -4.86 121.20 124.42 1l2n s ILE 35 Ca 1.16 -1.41 0.04 0.00 -2.23 0.00 0.00 60.65 58.21 1l2n s ILE 35 Cb -1.47 -1.27 -0.01 0.00 -1.58 0.00 0.00 42.46 38.12 1l2n s ILE 35 CO 0.69 -0.78 -0.13 0.72 -1.23 0.00 0.00 174.94 174.22 1l2n s PHE 36 N -3.50 1.16 0.16 3.97 -0.12 -1.26 -1.06 117.98 117.33 1l2n s PHE 36 Ca 0.03 -0.25 -0.20 0.00 -0.05 0.00 0.00 56.93 56.45 1l2n s PHE 36 Cb 0.04 -0.73 0.05 0.00 -0.63 0.00 0.00 43.02 41.75 1l2n s PHE 36 CO -0.09 -0.01 0.53 -0.06 -0.05 0.00 0.00 175.22 175.55 1l2n s PHE 37 N -0.43 -0.39 -0.09 3.49 0.08 -0.51 -5.03 117.98 115.09 1l2n s PHE 37 Ca 0.04 0.13 -0.04 0.00 0.12 0.00 0.00 56.93 57.17 1l2n s PHE 37 Cb -0.06 0.46 -0.04 0.00 -0.57 0.00 0.00 43.02 42.81 1l2n s PHE 37 CO -0.00 -0.82 0.09 0.15 -0.10 0.00 0.00 175.22 174.54 1l2n s LYS 38 N -3.78 3.25 0.17 0.44 3.01 -1.26 -0.18 119.74 121.38 1l2n s LYS 38 Ca 0.03 -0.27 -0.01 0.00 -1.01 0.00 0.00 55.97 54.71 1l2n s LYS 38 Cb -0.00 -3.02 -0.04 0.00 -1.01 0.00 0.00 37.83 33.76 1l2n s LYS 38 CO -0.11 0.74 0.10 0.42 0.51 0.00 0.00 175.35 177.01 1l2n s ILE 39 N -1.01 0.05 -1.00 2.17 1.09 -0.61 -4.92 121.20 116.98 1l2n s ILE 39 Ca 0.16 -1.93 -0.01 0.00 -1.10 0.00 0.00 60.65 57.76 1l2n s ILE 39 Cb -0.12 -2.26 0.32 0.00 -1.06 0.00 0.00 42.46 39.35 1l2n s ILE 39 CO 0.05 -0.24 1.82 0.29 -0.10 0.00 0.00 174.94 176.76 1l2n n LYS 40 N -0.18 5.16 0.00 2.79 4.01 -1.26 -1.91 118.16 126.77 1l2n n LYS 40 Ca -0.02 -4.58 0.00 0.00 -0.51 0.00 0.00 58.31 53.20 1l2n n LYS 40 Cb 0.65 -2.45 0.00 0.00 -0.51 0.00 0.00 35.03 32.72 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 -0.11 0.00 0.07 1.97 5.02 -0.94 -4.53 118.16 119.65 1l2n n LYS 41 Ca 0.47 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.53 1l2n n LYS 41 Cb 0.26 0.00 -0.15 0.00 -0.02 0.00 0.00 35.03 35.12 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 0.00 1.00 0.00 -0.18 1.03 0.22 -3.36 112.91 111.61 1l2n h THR 42 Ca 0.00 -2.51 -0.21 0.00 -0.01 0.00 0.00 66.41 63.67 1l2n h THR 42 Cb 0.00 2.80 -0.06 0.00 -1.07 0.00 0.00 68.15 69.82 1l2n h THR 42 CO 0.00 0.83 1.02 1.07 -0.01 0.00 0.00 175.52 178.43 1l2n n THR 43 N -3.67 0.00 0.04 0.00 5.66 -1.26 -4.65 114.28 110.40 1l2n n THR 43 Ca -0.24 -0.18 -0.16 0.00 -3.05 0.00 0.00 64.05 60.42 1l2n n THR 43 Cb 1.05 -0.08 -0.06 0.00 -1.55 0.00 0.00 70.33 69.68 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 5.93 0.59 -0.18 1.09 0.13 -1.89 0.44 132.00 138.12 1l2n h PRO 44 Ca 0.01 -0.58 0.04 0.00 -0.87 0.00 0.00 66.00 64.60 1l2n h PRO 44 Cb 0.62 0.15 -0.04 0.00 0.13 0.00 0.00 31.00 31.86 1l2n h PRO 44 CO 0.81 1.19 -0.08 1.37 -0.23 0.00 0.00 178.00 181.06 1l2n h LEU 45 N 0.36 -0.28 -0.00 1.56 -0.00 -1.82 0.36 115.31 115.49 1l2n h LEU 45 Ca -0.08 0.07 -0.24 0.00 -0.00 0.00 0.00 57.88 57.63 1l2n h LEU 45 Cb 1.54 0.16 -0.01 0.00 -0.00 0.00 0.00 40.66 42.35 1l2n h LEU 45 CO 0.17 -0.11 -1.09 0.03 -0.00 0.00 0.00 178.44 177.44 1l2n h ARG 46 N -0.07 0.18 0.00 0.17 3.08 -1.92 -3.04 114.38 112.78 1l2n h ARG 46 Ca 0.10 -0.27 0.00 0.00 0.07 0.00 0.00 59.98 59.87 1l2n h ARG 46 Cb 0.21 0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.36 1l2n h ARG 46 CO -0.22 1.10 0.00 0.54 -1.07 0.00 0.00 179.97 180.32 1l2n n ARG 47 N -3.51 0.00 -0.41 0.04 5.12 0.15 -2.98 116.66 115.07 1l2n n ARG 47 Ca -0.05 0.17 0.34 0.00 -1.93 0.00 0.00 57.85 56.38 1l2n n ARG 47 Cb 0.95 -1.11 0.62 0.00 -1.16 0.00 0.00 32.46 31.75 1l2n n ARG 47 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 1l2n h LEU 48 N 0.00 0.29 -0.98 0.55 5.85 -0.48 0.79 115.31 121.33 1l2n h LEU 48 Ca 0.00 0.17 0.35 0.00 0.84 0.00 0.00 57.88 59.23 1l2n h LEU 48 Cb 0.00 0.15 -0.17 0.00 0.37 0.00 0.00 40.66 41.02 1l2n h LEU 48 CO 0.00 -0.22 0.42 -0.03 -0.34 0.00 0.00 178.44 178.27 1l2n h MET 49 N 0.10 0.11 0.00 1.25 4.05 -1.43 0.15 114.93 119.16 1l2n h MET 49 Ca 0.82 -0.01 -0.43 0.00 -0.28 0.00 0.00 59.70 59.80 1l2n h MET 49 Cb 2.41 -0.02 -0.07 0.00 -0.80 0.00 0.00 31.60 33.11 1l2n h MET 49 CO -0.51 0.07 -2.50 -1.91 0.23 0.00 0.00 176.91 172.29 1l2n n GLU 50 N -5.24 0.60 -0.03 0.39 2.13 0.26 -3.97 120.64 114.76 1l2n n GLU 50 Ca 0.32 0.22 -0.02 0.00 0.66 0.00 0.00 57.16 58.33 1l2n n GLU 50 Cb 1.05 -1.48 -0.02 0.00 0.27 0.00 0.00 31.44 31.26 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 -0.66 -0.33 -0.28 4.31 0.00 -0.45 1.75 119.26 123.60 1l2n h ALA 51 Ca -0.65 0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.34 1l2n h ALA 51 Cb 1.70 0.83 -0.01 0.00 0.00 0.00 0.00 17.79 20.30 1l2n h ALA 51 CO -0.31 -0.38 0.34 0.35 0.00 0.00 0.00 179.25 179.24 1l2n h PHE 52 N -0.06 0.00 -0.01 0.00 3.57 -0.95 1.65 116.94 121.14 1l2n h PHE 52 Ca 0.02 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1l2n h PHE 52 Cb 0.10 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.84 1l2n h PHE 52 CO -0.68 0.00 -0.14 0.00 -2.23 0.00 0.00 178.31 175.26 1l2n n ALA 53 N -2.29 2.85 -0.07 2.41 0.00 0.19 -0.81 120.51 122.79 1l2n n ALA 53 Ca 0.04 -0.39 -0.07 0.00 0.00 0.00 0.00 53.44 53.02 1l2n n ALA 53 Cb 0.48 -1.18 -0.15 0.00 0.00 0.00 0.00 19.45 18.60 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 -0.42 0.67 -0.14 0.00 3.00 0.55 -3.00 118.16 118.82 1l2n n LYS 54 Ca 0.15 0.04 -0.28 0.00 -0.00 0.00 0.00 58.31 58.22 1l2n n LYS 54 Cb 0.33 -1.59 -0.10 0.00 0.00 0.00 0.00 35.03 33.67 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 -2.76 0.59 -0.05 1.64 0.00 -0.61 -4.50 116.66 110.97 1l2n n ARG 55 Ca -0.25 0.25 -0.21 0.00 -0.00 0.00 0.00 57.85 57.63 1l2n n ARG 55 Cb 1.05 -1.48 -0.13 0.00 0.00 0.00 0.00 32.46 31.90 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 -4.14 0.70 0.05 -0.14 -0.06 0.00 -4.09 117.38 109.70 1l2n n GLN 56 Ca -0.53 0.28 0.20 0.00 -2.00 0.00 0.00 57.00 54.94 1l2n n GLN 56 Cb 0.89 -1.66 0.54 0.00 -4.06 0.00 0.00 30.24 25.96 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 0.91 0.00 0.25 1.69 0.00 -1.05 0.31 103.07 105.18 1l2n h GLY 57 Ca -0.47 0.00 0.09 0.00 0.00 0.00 0.00 47.33 46.95 1l2n h GLY 57 CO -0.02 0.00 0.03 0.50 0.00 0.00 0.00 176.54 177.05 1l2n h LYS 58 N 0.00 0.14 0.00 4.80 1.79 -1.71 0.16 116.57 121.76 1l2n h LYS 58 Ca 0.25 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.71 1l2n h LYS 58 Cb 1.82 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 32.44 1l2n h LYS 58 CO -0.00 0.10 -0.31 0.39 -1.08 0.00 0.00 179.45 178.55 1l2n n GLU 59 N -5.19 0.16 -2.38 3.15 4.71 0.10 -4.90 120.64 116.30 1l2n n GLU 59 Ca 0.05 0.08 -0.03 0.00 -0.01 0.00 0.00 57.16 57.25 1l2n n GLU 59 Cb 0.26 -1.64 -0.00 0.00 -1.01 0.00 0.00 31.44 29.05 1l2n n GLU 59 CO 0.00 0.00 0.00 -0.12 0.09 0.00 0.00 177.13 177.10 1l2n n MET 60 N -1.89 -2.68 0.00 3.49 1.56 0.57 -4.70 117.12 113.48 1l2n n MET 60 Ca 0.05 0.15 0.11 0.00 -0.27 0.00 0.00 57.70 57.74 1l2n n MET 60 Cb 0.39 -4.64 0.02 0.00 2.15 0.00 0.00 33.22 31.15 1l2n n MET 60 CO 0.00 0.00 0.00 -0.25 -0.73 0.00 0.00 175.97 174.99 1l2n n ASP 61 N -1.40 1.00 -4.08 6.12 8.00 -1.26 -4.86 116.55 120.06 1l2n n ASP 61 Ca -0.04 -0.86 -0.26 0.00 0.71 0.00 0.00 54.79 54.34 1l2n n ASP 61 Cb 0.49 0.69 -0.17 0.00 -0.02 0.00 0.00 41.12 42.12 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 -2.91 2.07 0.00 -2.24 0.01 -1.26 -3.87 113.70 105.50 1l2n s SER 62 Ca 0.11 -0.35 0.00 0.00 1.31 0.00 0.00 55.95 57.02 1l2n s SER 62 Cb 0.17 -0.87 0.00 0.00 0.21 0.00 0.00 66.02 65.52 1l2n s SER 62 CO 0.77 0.08 0.85 0.00 0.41 0.00 0.00 173.24 175.35 1l2n n LEU 63 N 3.62 0.00 -4.37 2.44 -0.00 -1.17 -4.74 117.00 112.78 1l2n n LEU 63 Ca -0.21 -0.99 -0.45 0.00 -0.00 0.00 0.00 56.01 54.36 1l2n n LEU 63 Cb 0.52 0.00 -0.00 0.00 -0.00 0.00 0.00 43.42 43.94 1l2n n LEU 63 CO 0.26 0.46 0.91 -0.60 -0.00 0.00 0.00 177.39 178.41 1l2n s ARG 64 N 0.00 4.16 -0.21 1.47 3.52 -0.13 -4.74 118.95 123.03 1l2n s ARG 64 Ca 0.00 -3.06 -0.25 0.00 -0.13 0.00 0.00 55.73 52.29 1l2n s ARG 64 Cb 0.00 -4.66 -0.01 0.00 -1.56 0.00 0.00 34.95 28.72 1l2n s ARG 64 CO 0.00 -1.36 0.84 -0.59 -0.81 0.00 0.00 175.30 173.38 1l2n s PHE 65 N -0.60 3.37 0.14 5.12 -0.71 -1.26 0.16 117.98 124.19 1l2n s PHE 65 Ca 0.33 1.21 -0.20 0.00 -1.04 0.00 0.00 56.93 57.22 1l2n s PHE 65 Cb -0.08 -3.04 0.06 0.00 -1.21 0.00 0.00 43.02 38.74 1l2n s PHE 65 CO -0.06 -0.32 0.52 -0.48 -1.34 0.00 0.00 175.22 173.54 1l2n s LEU 66 N 2.51 -0.19 -0.24 -1.99 0.05 -0.46 -4.16 118.68 114.20 1l2n s LEU 66 Ca 0.37 -0.10 -0.03 0.00 0.05 0.00 0.00 54.13 54.41 1l2n s LEU 66 Cb -0.16 2.29 -0.17 0.00 -2.05 0.00 0.00 46.19 46.10 1l2n s LEU 66 CO 0.10 -0.91 -0.15 0.00 -0.55 0.00 0.00 176.35 174.84 1l2n n TYR 67 N -0.27 0.23 0.02 3.48 4.19 0.20 -2.18 117.16 122.83 1l2n n TYR 67 Ca -0.17 0.06 0.00 0.00 3.31 0.00 0.00 57.90 61.10 1l2n n TYR 67 Cb 0.64 -1.03 0.00 0.00 0.49 0.00 0.00 39.34 39.44 1l2n n TYR 67 CO 0.00 0.00 0.00 -3.47 0.91 0.00 0.00 176.86 174.30 1l2n n ASP 68 N -3.54 0.24 -1.84 2.98 2.03 -1.26 -4.64 116.55 110.52 1l2n n ASP 68 Ca -0.45 0.04 -0.01 0.00 0.52 0.00 0.00 54.79 54.90 1l2n n ASP 68 Cb 0.97 -0.06 0.03 0.00 -0.72 0.00 0.00 41.12 41.34 1l2n n ASP 68 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1l2n n GLY 69 N 3.27 -0.17 2.70 0.27 0.00 -1.26 -5.00 105.19 104.99 1l2n n GLY 69 Ca 0.00 -0.05 -0.05 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 -0.43 0.19 -4.12 -0.61 -5.35 -1.26 -4.99 119.36 102.79 1l2n n ILE 70 Ca -0.05 -1.54 -0.29 0.00 -0.27 0.00 0.00 62.75 60.60 1l2n n ILE 70 Cb 0.61 1.00 -0.08 0.00 -1.74 0.00 0.00 39.64 39.42 1l2n n ILE 70 CO 0.00 0.00 0.00 -2.11 -1.76 0.00 0.00 176.55 172.68 1l2n n ARG 71 N -0.94 -0.90 -3.76 6.28 0.00 -1.26 -4.90 116.66 111.18 1l2n n ARG 71 Ca -0.07 0.07 -0.25 0.00 -0.00 0.00 0.00 57.85 57.60 1l2n n ARG 71 Cb 0.86 -3.12 0.00 0.00 -0.00 0.00 0.00 32.46 30.20 1l2n n ARG 71 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.63 178.59 1l2n s ILE 72 N -4.20 1.73 0.34 8.89 -4.36 -1.26 -4.80 121.20 117.53 1l2n s ILE 72 Ca 0.03 -1.42 0.07 0.00 -0.26 0.00 0.00 60.65 59.07 1l2n s ILE 72 Cb -0.02 -2.14 -0.03 0.00 1.25 0.00 0.00 42.46 41.53 1l2n s ILE 72 CO 0.89 0.00 0.25 0.00 0.24 0.00 0.00 174.94 176.32 1l2n n GLN 73 N -1.84 0.43 0.00 0.37 3.00 -1.26 0.62 117.38 118.70 1l2n n GLN 73 Ca 0.01 -3.28 0.00 0.00 -0.01 0.00 0.00 57.00 53.72 1l2n n GLN 73 Cb 0.64 2.53 0.00 0.00 0.00 0.00 0.00 30.24 33.41 1l2n n GLN 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1l2n n ALA 74 N -0.82 0.00 -1.74 -1.58 0.00 -1.25 -4.62 120.51 110.50 1l2n n ALA 74 Ca -0.12 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 52.96 1l2n n ALA 74 Cb 0.59 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.09 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 -0.05 7.20 0.26 0.00 9.92 -1.26 -4.63 116.55 128.00 1l2n n ASP 75 Ca 0.00 -3.80 0.18 0.00 -0.53 0.00 0.00 54.79 50.63 1l2n n ASP 75 Cb 0.00 -0.93 0.89 0.00 -0.64 0.00 0.00 41.12 40.43 1l2n n ASP 75 CO 0.00 0.00 0.00 -0.61 0.13 0.00 0.00 177.20 176.72 1l2n h GLN 76 N 2.52 0.00 -6.91 -1.24 -0.00 -1.94 -3.32 115.11 104.21 1l2n h GLN 76 Ca 0.55 0.00 -0.49 0.00 -0.00 0.00 0.00 58.65 58.71 1l2n h GLN 76 Cb 0.51 0.00 0.01 0.00 0.00 0.00 0.00 27.48 28.00 1l2n h GLN 76 CO 1.41 0.00 0.42 0.99 0.00 0.00 0.00 178.83 181.65 1l2n s THR 77 N -3.82 3.73 -1.12 2.39 2.01 -1.26 -4.63 115.64 112.94 1l2n s THR 77 Ca -0.02 1.44 0.22 0.00 0.31 0.00 0.00 61.69 63.64 1l2n s THR 77 Cb 0.10 -3.80 0.24 0.00 0.01 0.00 0.00 72.50 69.05 1l2n s THR 77 CO 0.38 0.12 1.71 -0.81 -0.69 0.00 0.00 174.62 175.33 1l2n n PRO 78 N 0.35 0.09 0.00 4.92 -0.04 -1.26 -1.51 135.00 137.55 1l2n n PRO 78 Ca 0.03 0.11 0.10 0.00 -0.04 0.00 0.00 63.50 63.70 1l2n n PRO 78 Cb 0.48 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.35 1l2n n PRO 78 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1l2n n GLU 79 N -1.44 0.44 -0.13 0.54 4.07 -1.26 -3.52 120.64 119.34 1l2n n GLU 79 Ca 0.07 -0.17 -0.19 0.00 -0.06 0.00 0.00 57.16 56.81 1l2n n GLU 79 Cb 0.23 -1.46 -0.11 0.00 -0.06 0.00 0.00 31.44 30.04 1l2n n GLU 79 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 1l2n n ASP 80 N -1.23 2.04 -0.11 4.31 -0.08 -0.92 -3.86 116.55 116.70 1l2n n ASP 80 Ca 0.05 -0.08 -0.12 0.00 -1.51 0.00 0.00 54.79 53.13 1l2n n ASP 80 Cb 0.34 -0.44 -0.03 0.00 2.34 0.00 0.00 41.12 43.33 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 -0.12 0.67 -1.57 -2.67 8.10 -1.37 1.34 115.31 119.70 1l2n h LEU 81 Ca -0.57 -0.39 0.00 0.00 0.11 0.00 0.00 57.88 57.03 1l2n h LEU 81 Cb 1.83 -0.18 0.00 0.00 -0.44 0.00 0.00 40.66 41.87 1l2n h LEU 81 CO -0.13 0.90 0.00 0.44 -4.11 0.00 0.00 178.44 175.55 1l2n h ASP 82 N 0.43 0.00 0.00 0.17 5.19 -1.78 -3.34 116.42 117.09 1l2n h ASP 82 Ca 0.08 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.49 1l2n h ASP 82 Cb 0.63 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.14 1l2n h ASP 82 CO 0.04 0.00 0.00 0.80 -3.12 0.00 0.00 179.24 176.96 1l2n n MET 83 N -2.70 0.00 -1.06 3.56 1.56 -0.79 -5.03 117.12 112.66 1l2n n MET 83 Ca -0.00 0.00 -0.29 0.00 -0.27 0.00 0.00 57.70 57.14 1l2n n MET 83 Cb 0.19 -0.19 0.19 0.00 2.15 0.00 0.00 33.22 35.56 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 -0.38 0.24 -0.39 2.12 2.12 0.45 -5.03 118.70 117.82 1l2n s GLU 84 Ca 0.00 0.60 0.03 0.00 0.36 0.00 0.00 54.97 55.96 1l2n s GLU 84 Cb 0.00 -1.71 0.16 0.00 0.26 0.00 0.00 34.13 32.84 1l2n s GLU 84 CO 0.00 -2.88 0.31 0.16 -0.54 0.00 0.00 175.26 172.31 1l2n s ASP 85 N -3.28 1.78 -0.31 -1.70 -4.77 -1.26 -4.52 116.67 102.60 1l2n s ASP 85 Ca 0.66 -2.76 -0.12 0.00 -3.30 0.00 0.00 52.55 47.03 1l2n s ASP 85 Cb -0.20 -0.35 0.19 0.00 -1.09 0.00 0.00 42.92 41.47 1l2n s ASP 85 CO 0.59 -0.21 1.09 0.21 0.70 0.00 0.00 175.17 177.55 1l2n s ASN 86 N 0.40 -0.25 -0.21 2.11 3.84 -1.26 -4.91 114.94 114.65 1l2n s ASN 86 Ca 0.28 -0.04 -0.21 0.00 0.21 0.00 0.00 52.86 53.10 1l2n s ASN 86 Cb -0.04 0.79 -0.02 0.00 -0.55 0.00 0.00 41.25 41.43 1l2n s ASN 86 CO -0.13 -0.04 0.67 -1.81 -2.79 0.00 0.00 177.10 173.00 1l2n s ASP 87 N 2.54 6.69 -0.28 -4.21 -0.00 -1.07 -4.71 116.67 115.64 1l2n s ASP 87 Ca 0.23 0.85 -0.15 0.00 -0.00 0.00 0.00 52.55 53.48 1l2n s ASP 87 Cb 0.01 -2.36 0.08 0.00 -0.00 0.00 0.00 42.92 40.65 1l2n s ASP 87 CO -0.20 -0.33 0.68 0.27 -0.00 0.00 0.00 175.17 175.59 1l2n s ILE 88 N 2.18 -0.09 0.24 0.77 -0.00 -1.26 -0.71 121.20 122.34 1l2n s ILE 88 Ca 0.29 0.00 -0.12 0.00 -0.00 0.00 0.00 60.65 60.83 1l2n s ILE 88 Cb -0.16 -0.99 -0.01 0.00 -0.00 0.00 0.00 42.46 41.31 1l2n s ILE 88 CO 0.10 0.00 0.46 -0.63 -0.00 0.00 0.00 174.94 174.86 1l2n s ILE 89 N 1.75 0.00 -0.14 8.37 1.01 -1.00 -3.92 121.20 127.27 1l2n s ILE 89 Ca -0.10 -1.45 -0.02 0.00 0.00 0.00 0.00 60.65 59.08 1l2n s ILE 89 Cb -0.06 -2.23 -0.02 0.00 0.01 0.00 0.00 42.46 40.16 1l2n s ILE 89 CO -0.20 0.00 -0.07 -0.70 0.00 0.00 0.00 174.94 173.97 1l2n s GLU 90 N -4.02 3.50 -0.33 2.79 2.12 -0.93 -0.15 118.70 121.68 1l2n s GLU 90 Ca 0.24 -0.58 -0.06 0.00 0.36 0.00 0.00 54.97 54.92 1l2n s GLU 90 Cb -0.00 -2.79 0.03 0.00 0.26 0.00 0.00 34.13 31.63 1l2n s GLU 90 CO 0.09 0.27 0.09 0.00 -0.54 0.00 0.00 175.26 175.17 1l2n s ALA 91 N 0.25 3.03 0.58 6.30 0.00 0.17 -1.35 121.76 130.73 1l2n s ALA 91 Ca -0.05 -1.68 0.09 0.00 0.00 0.00 0.00 51.96 50.32 1l2n s ALA 91 Cb -0.14 -2.22 0.09 0.00 0.00 0.00 0.00 23.12 20.85 1l2n s ALA 91 CO 0.04 -1.24 0.76 0.72 0.00 0.00 0.00 175.76 176.04 1l2n n HIS 92 N 4.81 -2.14 -4.01 0.00 8.25 0.42 -4.04 115.22 118.52 1l2n n HIS 92 Ca -0.13 -2.13 -0.28 0.00 -0.26 0.00 0.00 57.72 54.92 1l2n n HIS 92 Cb 0.45 -0.54 -0.05 0.00 1.12 0.00 0.00 29.99 30.98 1l2n n HIS 92 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 1l2n s ARG 93 N -4.59 3.14 -0.50 -0.41 3.03 -1.26 -0.96 118.95 117.41 1l2n s ARG 93 Ca 0.58 -0.68 0.06 0.00 2.03 0.00 0.00 55.73 57.73 1l2n s ARG 93 Cb -0.05 -2.82 0.19 0.00 -1.03 0.00 0.00 34.95 31.24 1l2n s ARG 93 CO 0.37 0.53 0.69 0.39 -1.13 0.00 0.00 175.30 176.15 1l2n n GLU 94 N -0.12 0.51 -3.64 3.89 -0.58 -1.25 -4.17 120.64 115.29 1l2n n GLU 94 Ca -0.07 -2.19 -0.10 0.00 -0.42 0.00 0.00 57.16 54.37 1l2n n GLU 94 Cb 0.53 -1.49 -0.07 0.00 -0.57 0.00 0.00 31.44 29.84 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 0.70 0.77 0.00 3.49 2.00 -1.26 -4.38 119.66 120.98 1l2n s GLN 95 Ca 0.31 1.11 0.24 0.00 -2.00 0.00 0.00 55.36 55.02 1l2n s GLN 95 Cb 0.03 0.27 0.28 0.00 0.80 0.00 0.00 33.01 34.39 1l2n s GLN 95 CO -0.09 -0.12 1.31 -0.89 -0.50 0.00 0.00 175.29 174.99