#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2keo s LYS 22 N 0.00 4.39 -0.00 3.49 -0.14 -1.26 -5.05 119.74 121.17 2keo s LYS 22 Ca 0.00 2.13 0.08 0.00 -1.36 0.00 0.00 55.97 56.82 2keo s LYS 22 Cb 0.00 -3.13 -0.02 0.00 -1.68 0.00 0.00 37.83 33.00 2keo s LYS 22 CO 0.00 -0.18 -0.26 0.54 -0.76 0.00 0.00 175.35 174.69 2keo s VAL 23 N -0.67 2.10 -0.43 3.17 0.11 -1.26 -5.09 120.40 118.33 2keo s VAL 23 Ca 0.52 -1.18 -0.28 0.00 -2.93 0.00 0.00 61.98 58.11 2keo s VAL 23 Cb -0.38 -1.75 -0.00 0.00 -1.53 0.00 0.00 36.38 32.72 2keo s VAL 23 CO 0.46 0.52 1.62 0.42 -3.33 0.00 0.00 175.10 174.79 2keo s THR 24 N -0.67 3.66 -0.29 5.04 -4.23 -1.26 -4.90 115.64 112.99 2keo s THR 24 Ca 0.11 0.63 -0.28 0.00 -1.18 0.00 0.00 61.69 60.97 2keo s THR 24 Cb -0.10 -3.99 0.01 0.00 1.34 0.00 0.00 72.50 69.76 2keo s THR 24 CO -0.00 -0.70 0.99 -0.76 -0.54 0.00 0.00 174.62 173.60 2keo s LEU 25 N 6.53 4.01 -0.19 4.79 1.43 -1.26 -1.31 118.68 132.69 2keo s LEU 25 Ca 0.68 1.05 -0.18 0.00 -1.03 0.00 0.00 54.13 54.64 2keo s LEU 25 Cb -0.16 -3.42 -0.03 0.00 0.03 0.00 0.00 46.19 42.60 2keo s LEU 25 CO 0.30 -0.75 0.49 -0.69 0.23 0.00 0.00 176.35 175.94 2keo s VAL 26 N 3.34 5.13 0.63 -1.59 1.01 -0.22 -4.87 120.40 123.84 2keo s VAL 26 Ca 0.42 0.91 -0.17 0.00 0.00 0.00 0.00 61.98 63.14 2keo s VAL 26 Cb -0.13 -3.82 -0.02 0.00 0.00 0.00 0.00 36.38 32.41 2keo s VAL 26 CO 0.12 0.21 1.14 -0.13 0.00 0.00 0.00 175.10 176.45 2keo s ARG 27 N 1.42 2.88 0.17 2.72 0.52 -1.26 -1.39 118.95 124.01 2keo s ARG 27 Ca 0.24 1.58 -0.14 0.00 -0.52 0.00 0.00 55.73 56.88 2keo s ARG 27 Cb -0.15 -1.95 0.06 0.00 0.52 0.00 0.00 34.95 33.43 2keo s ARG 27 CO 0.09 -1.22 1.81 0.97 0.02 0.00 0.00 175.30 176.98 2keo h ILE 28 N 0.44 1.15 -0.06 1.52 2.10 -1.95 -0.12 117.51 120.60 2keo h ILE 28 Ca -0.48 -0.33 -0.11 0.00 1.08 0.00 0.00 64.86 65.02 2keo h ILE 28 Cb 1.27 0.42 -0.01 0.00 -1.09 0.00 0.00 36.82 37.40 2keo h ILE 28 CO 0.54 0.15 -0.47 0.00 -1.08 0.00 0.00 178.15 177.30 2keo h ALA 29 N 1.17 1.11 -0.37 0.18 0.00 -1.94 -0.97 119.26 118.44 2keo h ALA 29 Ca 0.19 -0.44 -0.13 0.00 0.00 0.00 0.00 54.91 54.53 2keo h ALA 29 Cb -0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2keo h ALA 29 CO -0.04 0.62 -0.29 0.22 0.00 0.00 0.00 179.25 179.76 2keo h ASP 30 N 0.11 0.80 0.13 0.00 3.58 -1.84 -2.04 116.42 117.17 2keo h ASP 30 Ca 0.01 -0.32 -0.01 0.00 0.42 0.00 0.00 57.03 57.13 2keo h ASP 30 Cb 0.88 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 41.71 2keo h ASP 30 CO 0.07 1.04 -0.06 0.25 -2.88 0.00 0.00 179.24 177.66 2keo h LEU 31 N 0.66 -0.15 0.29 2.28 5.85 -0.59 -2.97 115.31 120.68 2keo h LEU 31 Ca 0.08 -0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.59 2keo h LEU 31 Cb 0.82 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.89 2keo h LEU 31 CO 0.07 0.12 -0.14 -0.33 -0.34 0.00 0.00 178.44 177.82 2keo h GLU 32 N -0.42 -0.37 0.00 1.25 4.39 -1.15 -1.73 114.58 116.55 2keo h GLU 32 Ca -0.02 0.03 -0.15 0.00 0.34 0.00 0.00 59.36 59.56 2keo h GLU 32 Cb 0.34 0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.05 2keo h GLU 32 CO 0.03 -0.11 -0.70 -0.91 -1.16 0.00 0.00 179.01 176.15 2keo h ASN 33 N -0.60 0.00 -0.00 1.42 2.35 -1.52 -0.73 115.58 116.50 2keo h ASN 33 Ca -0.04 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.52 2keo h ASN 33 Cb 0.43 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.80 2keo h ASN 33 CO 0.07 0.70 -0.67 -0.74 -1.65 0.00 0.00 177.43 175.14 2keo h HIS 34 N 0.00 0.82 -0.59 1.19 2.76 -1.54 0.31 115.15 118.10 2keo h HIS 34 Ca -0.01 -0.33 -0.03 0.00 -2.20 0.00 0.00 60.37 57.80 2keo h HIS 34 Cb 1.27 -0.14 -0.03 0.00 1.55 0.00 0.00 27.41 30.06 2keo h HIS 34 CO 0.00 1.12 0.24 -0.97 -1.30 0.00 0.00 177.93 177.02 2keo h ASN 35 N 0.45 0.81 0.58 3.26 -1.24 -1.19 -2.75 115.58 115.50 2keo h ASN 35 Ca -0.02 -0.17 -0.06 0.00 0.71 0.00 0.00 56.30 56.77 2keo h ASN 35 Cb 1.26 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 40.09 2keo h ASN 35 CO 0.13 0.75 -0.28 -1.13 -1.29 0.00 0.00 177.43 175.61 2keo h ASN 36 N 0.81 0.00 -0.16 1.15 -1.24 -0.99 -3.03 115.58 112.12 2keo h ASN 36 Ca 0.20 0.00 -0.09 0.00 0.71 0.00 0.00 56.30 57.12 2keo h ASN 36 Cb 0.19 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.23 2keo h ASN 36 CO -0.02 0.28 -0.17 -0.78 -1.29 0.00 0.00 177.43 175.45 2keo h ASP 37 N 0.00 0.56 0.00 1.15 3.58 -0.64 -3.47 116.42 117.60 2keo h ASP 37 Ca -0.00 -0.17 0.00 0.00 0.42 0.00 0.00 57.03 57.28 2keo h ASP 37 Cb 0.65 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.55 2keo h ASP 37 CO 0.04 0.75 0.00 0.61 -2.88 0.00 0.00 179.24 177.75 2keo n GLY 38 N -0.48 1.17 3.58 -0.78 0.00 -1.14 -5.04 105.19 102.50 2keo n GLY 38 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 2keo n GLY 38 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2keo s GLY 39 N -0.69 0.23 -0.32 -0.02 0.00 -1.12 -4.91 107.32 100.49 2keo s GLY 39 Ca 0.00 -2.10 -0.29 0.00 0.00 0.00 0.00 44.72 42.33 2keo s GLY 39 CO 0.00 3.51 1.38 -0.12 0.00 0.00 0.00 173.10 177.87 2keo s PHE 40 N 10.61 2.52 0.44 1.90 2.19 -1.26 -3.38 117.98 130.99 2keo s PHE 40 Ca 0.68 0.77 0.08 0.00 0.33 0.00 0.00 56.93 58.78 2keo s PHE 40 Cb -0.01 -4.02 -0.01 0.00 -1.31 0.00 0.00 43.02 37.67 2keo s PHE 40 CO 0.11 -1.97 0.41 -1.58 1.83 0.00 0.00 175.22 174.02 2keo s TRP 41 N 4.79 2.52 -0.20 10.12 0.51 -1.26 -1.14 118.94 134.29 2keo s TRP 41 Ca 0.60 -0.54 -0.23 0.00 -2.12 0.00 0.00 56.10 53.81 2keo s TRP 41 Cb -0.17 -2.15 0.06 0.00 -0.81 0.00 0.00 33.47 30.40 2keo s TRP 41 CO 0.26 -0.23 0.63 -0.08 -0.51 0.00 0.00 176.95 177.02 2keo s THR 42 N -2.51 0.00 -0.35 2.01 -1.32 -0.12 -4.80 115.64 108.55 2keo s THR 42 Ca 0.48 -0.02 -0.11 0.00 -1.21 0.00 0.00 61.69 60.83 2keo s THR 42 Cb -0.03 -0.89 0.01 0.00 -1.51 0.00 0.00 72.50 70.08 2keo s THR 42 CO 0.28 -0.01 0.19 0.54 -2.21 0.00 0.00 174.62 173.40 2keo s VAL 43 N -0.00 4.64 -0.13 5.08 0.11 -1.26 -1.21 120.40 127.63 2keo s VAL 43 Ca -0.03 -0.63 -0.00 0.00 -2.93 0.00 0.00 61.98 58.39 2keo s VAL 43 Cb -0.04 -3.48 0.02 0.00 -1.53 0.00 0.00 36.38 31.35 2keo s VAL 43 CO 0.03 -0.10 -0.10 -0.63 -3.33 0.00 0.00 175.10 170.97 2keo s ILE 44 N 1.59 1.26 -1.22 7.04 1.01 -0.04 -4.82 121.20 126.02 2keo s ILE 44 Ca 0.03 -0.44 -0.08 0.00 0.00 0.00 0.00 60.65 60.17 2keo s ILE 44 Cb -0.18 -1.23 0.01 0.00 0.01 0.00 0.00 42.46 41.07 2keo s ILE 44 CO 0.07 0.41 1.07 -0.67 0.00 0.00 0.00 174.94 175.81 2keo n ASP 45 N 4.85 -5.93 -0.42 3.58 2.03 -1.26 -2.12 116.55 117.28 2keo n ASP 45 Ca -0.14 -0.48 -0.06 0.00 0.52 0.00 0.00 54.79 54.62 2keo n ASP 45 Cb 0.50 -4.57 -0.02 0.00 -0.72 0.00 0.00 41.12 36.30 2keo n ASP 45 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2keo n GLY 46 N -1.86 0.76 3.41 0.27 0.00 -1.26 -5.01 105.19 101.49 2keo n GLY 46 Ca 0.01 -0.33 -0.30 0.00 0.00 0.00 0.00 46.02 45.41 2keo n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2keo s LYS 47 N -2.00 1.66 -0.24 1.61 -0.14 -0.90 -1.04 119.74 118.68 2keo s LYS 47 Ca 0.00 -1.21 -0.07 0.00 -1.36 0.00 0.00 55.97 53.32 2keo s LYS 47 Cb 0.00 -2.00 -0.03 0.00 -1.68 0.00 0.00 37.83 34.12 2keo s LYS 47 CO 0.00 0.48 0.07 0.08 -0.76 0.00 0.00 175.35 175.22 2keo s VAL 48 N -1.01 4.32 0.43 3.17 1.01 -0.38 -0.86 120.40 127.08 2keo s VAL 48 Ca 0.14 -0.17 0.06 0.00 0.00 0.00 0.00 61.98 62.02 2keo s VAL 48 Cb -0.10 -3.01 -0.06 0.00 0.00 0.00 0.00 36.38 33.20 2keo s VAL 48 CO 0.06 0.35 0.07 -0.31 0.00 0.00 0.00 175.10 175.27 2keo s TYR 49 N 1.49 2.45 0.23 5.22 2.02 -0.35 -2.03 117.35 126.38 2keo s TYR 49 Ca 0.06 -0.68 0.05 0.00 -0.37 0.00 0.00 57.07 56.13 2keo s TYR 49 Cb -0.15 -1.81 -0.03 0.00 -0.40 0.00 0.00 41.96 39.56 2keo s TYR 49 CO 0.03 0.33 0.29 0.16 -1.57 0.00 0.00 175.55 174.80 2keo s ASP 50 N -3.80 6.03 -0.02 2.29 1.47 -1.11 -0.94 116.67 120.60 2keo s ASP 50 Ca 0.33 -0.04 0.06 0.00 1.18 0.00 0.00 52.55 54.09 2keo s ASP 50 Cb 0.07 -1.70 -0.09 0.00 -0.34 0.00 0.00 42.92 40.86 2keo s ASP 50 CO 0.18 -0.04 0.12 -0.38 0.68 0.00 0.00 175.17 175.72 2keo n ILE 51 N -1.23 0.06 0.21 2.11 2.08 -0.29 -4.55 119.36 117.75 2keo n ILE 51 Ca -0.08 -0.16 -0.13 0.00 0.56 0.00 0.00 62.75 62.94 2keo n ILE 51 Cb 0.57 0.19 -0.07 0.00 -0.75 0.00 0.00 39.64 39.58 2keo n ILE 51 CO 0.00 0.00 0.00 0.50 0.56 0.00 0.00 176.55 177.61 2keo h LYS 52 N 0.00 -0.56 -0.38 0.38 1.63 -1.90 -0.65 116.57 115.10 2keo h LYS 52 Ca -0.02 0.04 -0.11 0.00 -0.85 0.00 0.00 60.65 59.71 2keo h LYS 52 Cb 0.44 0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 32.18 2keo h LYS 52 CO 0.00 -0.25 -0.20 0.22 -3.45 0.00 0.00 179.45 175.77 2keo h ASP 53 N -0.97 0.75 -0.19 4.20 3.58 -1.88 -3.12 116.42 118.79 2keo h ASP 53 Ca -0.06 -0.26 0.05 0.00 0.42 0.00 0.00 57.03 57.19 2keo h ASP 53 Cb 0.56 -0.20 -0.06 0.00 1.72 0.00 0.00 39.33 41.35 2keo h ASP 53 CO 0.10 0.94 -0.18 0.15 -2.88 0.00 0.00 179.24 177.36 2keo h PHE 54 N 0.65 -0.47 0.00 0.28 3.57 -1.79 -1.60 116.94 117.59 2keo h PHE 54 Ca 0.10 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.55 2keo h PHE 54 Cb 0.69 0.24 -0.01 0.00 2.79 0.00 0.00 35.95 39.66 2keo h PHE 54 CO 0.03 -0.26 -0.34 -0.56 -2.23 0.00 0.00 178.31 174.95 2keo h GLN 55 N -0.20 0.00 -0.16 1.11 3.07 -1.12 -1.92 115.11 115.89 2keo h GLN 55 Ca 0.12 0.00 -0.13 0.00 0.09 0.00 0.00 58.65 58.72 2keo h GLN 55 Cb 0.38 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.93 2keo h GLN 55 CO -0.31 0.34 -0.48 1.15 0.09 0.00 0.00 178.83 179.62 2keo h THR 56 N 0.00 1.33 0.00 1.86 2.02 -1.38 -3.16 112.91 113.57 2keo h THR 56 Ca -0.00 -1.70 -0.05 0.00 0.77 0.00 0.00 66.41 65.42 2keo h THR 56 Cb 0.74 1.73 -0.01 0.00 -1.74 0.00 0.00 68.15 68.88 2keo h THR 56 CO 0.04 0.52 -0.26 1.56 0.37 0.00 0.00 175.52 177.75 2keo h GLN 57 N 0.32 0.00 0.00 6.66 1.08 -0.52 -2.78 115.11 119.87 2keo h GLN 57 Ca 0.02 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.22 2keo h GLN 57 Cb 0.97 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.40 2keo h GLN 57 CO 0.08 0.26 0.00 -1.13 -0.95 0.00 0.00 178.83 177.09 2keo n SER 58 N -3.40 0.00 0.00 1.46 3.41 -0.98 -2.24 113.62 111.87 2keo n SER 58 Ca 0.00 0.06 0.14 0.00 -0.26 0.00 0.00 58.87 58.82 2keo n SER 58 Cb 0.46 -0.34 0.80 0.00 -0.26 0.00 0.00 64.21 64.86 2keo n SER 58 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2keo n LEU 59 N -1.34 0.00 -4.66 1.04 7.99 -1.05 -4.56 117.00 114.42 2keo n LEU 59 Ca 0.11 0.12 -0.43 0.00 -0.01 0.00 0.00 56.01 55.81 2keo n LEU 59 Cb 0.23 -0.12 -0.02 0.00 -0.11 0.00 0.00 43.42 43.40 2keo n LEU 59 CO 0.21 -0.01 1.00 -0.89 -1.51 0.00 0.00 177.39 176.19 2keo s THR 60 N -2.25 4.47 0.30 -5.08 2.01 -0.95 -4.95 115.64 109.19 2keo s THR 60 Ca 0.36 1.77 -0.00 0.00 0.31 0.00 0.00 61.69 64.13 2keo s THR 60 Cb 0.19 -4.14 0.19 0.00 0.01 0.00 0.00 72.50 68.75 2keo s THR 60 CO 0.38 -0.15 1.88 1.05 -0.69 0.00 0.00 174.62 177.09 2keo h GLU 61 N 7.83 0.85 -3.50 4.92 4.11 -1.90 -3.32 114.58 123.58 2keo h GLU 61 Ca -0.23 -0.13 -0.70 0.00 0.07 0.00 0.00 59.36 58.36 2keo h GLU 61 Cb 1.09 -0.15 -0.35 0.00 0.50 0.00 0.00 28.75 29.84 2keo h GLU 61 CO 0.97 0.70 -0.26 -0.80 0.07 0.00 0.00 179.01 179.69 2keo s ASN 62 N -6.53 5.54 0.15 3.06 0.01 -1.26 -4.83 114.94 111.09 2keo s ASN 62 Ca -0.10 -3.12 -0.09 0.00 -0.71 0.00 0.00 52.86 48.85 2keo s ASN 62 Cb 0.16 -1.89 -0.01 0.00 0.41 0.00 0.00 41.25 39.92 2keo s ASN 62 CO 0.79 -0.32 0.26 -0.94 -1.51 0.00 0.00 177.10 175.38 2keo s SER 63 N 0.49 0.06 0.45 -1.22 1.04 -1.25 -5.02 113.70 108.25 2keo s SER 63 Ca 0.20 -0.86 0.30 0.00 0.48 0.00 0.00 55.95 56.07 2keo s SER 63 Cb -0.16 0.42 1.33 0.00 0.10 0.00 0.00 66.02 67.71 2keo s SER 63 CO -0.06 -0.87 1.91 0.16 0.98 0.00 0.00 173.24 175.36 2keo h ILE 64 N 2.58 0.00 -0.00 -1.02 3.07 -1.94 -2.86 117.51 117.34 2keo h ILE 64 Ca -0.32 -0.33 0.00 0.00 1.55 0.00 0.00 64.86 65.76 2keo h ILE 64 Cb 1.22 1.20 0.00 0.00 -0.27 0.00 0.00 36.82 38.97 2keo h ILE 64 CO 0.50 0.00 -0.74 0.18 -1.05 0.00 0.00 178.15 177.04 2keo n LEU 65 N -2.73 1.02 0.06 0.16 4.77 -1.26 -4.15 117.00 114.86 2keo n LEU 65 Ca 0.01 -0.39 -0.03 0.00 -0.03 0.00 0.00 56.01 55.57 2keo n LEU 65 Cb 0.24 -0.07 0.21 0.00 -2.33 0.00 0.00 43.42 41.46 2keo n LEU 65 CO 0.23 0.23 0.66 0.00 -1.33 0.00 0.00 177.39 177.18 2keo h ALA 66 N 3.18 1.08 0.00 -1.18 0.00 -1.72 -0.14 119.26 120.48 2keo h ALA 66 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2keo h ALA 66 Cb 0.54 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2keo h ALA 66 CO 0.00 0.58 0.00 -0.56 0.00 0.00 0.00 179.25 179.27 2keo h GLN 67 N 0.29 0.00 -0.35 0.00 3.07 -1.72 -3.20 115.11 113.20 2keo h GLN 67 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.77 2keo h GLN 67 Cb 0.78 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.34 2keo h GLN 67 CO 0.06 0.00 0.00 1.19 0.09 0.00 0.00 178.83 180.17 2keo n PHE 68 N -3.07 0.46 -0.15 0.06 3.72 -0.99 -4.64 117.46 112.84 2keo n PHE 68 Ca 0.03 -0.36 -0.06 0.00 -0.05 0.00 0.00 57.45 57.01 2keo n PHE 68 Cb 0.45 -0.01 0.12 0.00 -0.94 0.00 0.00 39.48 39.09 2keo n PHE 68 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2keo h ALA 69 N 2.82 1.03 0.00 4.37 0.00 -1.02 -2.39 119.26 124.06 2keo h ALA 69 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2keo h ALA 69 Cb 0.77 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2keo h ALA 69 CO 0.00 0.61 0.00 0.41 0.00 0.00 0.00 179.25 180.27 2keo n GLY 70 N -0.61 -1.37 3.93 0.00 0.00 -1.26 -4.81 105.19 101.07 2keo n GLY 70 Ca 0.03 -0.11 -0.27 0.00 0.00 0.00 0.00 46.02 45.67 2keo n GLY 70 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2keo s GLU 71 N -2.83 3.54 0.12 1.61 2.56 -0.90 -5.07 118.70 117.73 2keo s GLU 71 Ca 0.19 -0.28 -0.35 0.00 0.00 0.00 0.00 54.97 54.52 2keo s GLU 71 Cb 0.19 -2.78 -0.16 0.00 2.00 0.00 0.00 34.13 33.38 2keo s GLU 71 CO 0.48 0.33 1.33 -3.47 -0.56 0.00 0.00 175.26 173.37 2keo n ASP 72 N -0.89 1.77 0.05 -1.70 -0.08 -1.26 -4.80 116.55 109.63 2keo n ASP 72 Ca -0.04 1.12 0.03 0.00 -1.51 0.00 0.00 54.79 54.39 2keo n ASP 72 Cb 0.54 -1.23 0.41 0.00 2.34 0.00 0.00 41.12 43.18 2keo n ASP 72 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2keo h PRO 73 N 4.42 0.43 -0.08 -0.67 0.13 -1.92 0.21 132.00 134.53 2keo h PRO 73 Ca -0.46 -0.05 -0.21 0.00 -0.87 0.00 0.00 66.00 64.40 2keo h PRO 73 Cb 1.33 -0.08 0.01 0.00 0.13 0.00 0.00 31.00 32.39 2keo h PRO 73 CO 0.77 0.37 -0.79 0.28 -0.23 0.00 0.00 178.00 178.41 2keo h VAL 74 N 0.43 1.31 -0.12 1.56 2.07 -1.98 -1.55 116.25 117.98 2keo h VAL 74 Ca 0.11 -2.04 -0.10 0.00 0.82 0.00 0.00 66.70 65.48 2keo h VAL 74 Cb 0.11 2.23 -0.01 0.00 -1.52 0.00 0.00 31.29 32.10 2keo h VAL 74 CO -0.01 0.63 -0.39 0.58 0.02 0.00 0.00 177.57 178.40 2keo h VAL 75 N 0.33 1.30 -0.30 2.57 2.07 -1.85 -2.54 116.25 117.82 2keo h VAL 75 Ca -0.08 -1.47 -0.13 0.00 0.82 0.00 0.00 66.70 65.84 2keo h VAL 75 Cb 1.44 1.65 -0.01 0.00 -1.52 0.00 0.00 31.29 32.84 2keo h VAL 75 CO 0.16 0.44 -0.34 0.00 0.02 0.00 0.00 177.57 177.86 2keo h ALA 76 N 1.38 0.85 -0.51 1.67 0.00 -0.53 -1.46 119.26 120.65 2keo h ALA 76 Ca 0.02 -0.41 -0.05 0.00 0.00 0.00 0.00 54.91 54.47 2keo h ALA 76 Cb 0.79 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 2keo h ALA 76 CO 0.06 0.64 0.11 1.25 0.00 0.00 0.00 179.25 181.31 2keo h LEU 77 N 0.56 0.79 -0.72 0.00 5.85 -1.11 -1.47 115.31 119.21 2keo h LEU 77 Ca 0.06 -0.24 -0.05 0.00 0.84 0.00 0.00 57.88 58.49 2keo h LEU 77 Cb 0.84 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.63 2keo h LEU 77 CO 0.07 0.83 0.27 -0.33 -0.34 0.00 0.00 178.44 178.94 2keo h GLU 78 N 0.72 1.09 -0.27 1.25 5.08 -1.20 0.98 114.58 122.23 2keo h GLU 78 Ca 0.16 -0.21 -0.08 0.00 -1.00 0.00 0.00 59.36 58.23 2keo h GLU 78 Cb 0.35 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 2keo h GLU 78 CO 0.00 0.91 -0.17 0.00 -1.00 0.00 0.00 179.01 178.76 2keo h ALA 79 N 1.13 1.21 0.00 3.43 0.00 -1.20 -0.16 119.26 123.66 2keo h ALA 79 Ca 0.24 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.74 2keo h ALA 79 Cb 0.24 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2keo h ALA 79 CO -0.02 0.51 -0.55 0.00 0.00 0.00 0.00 179.25 179.20 2keo h ALA 80 N 1.39 0.73 -0.00 0.00 0.00 -0.85 -2.20 119.26 118.32 2keo h ALA 80 Ca 0.08 -0.50 -0.17 0.00 0.00 0.00 0.00 54.91 54.32 2keo h ALA 80 Cb 0.55 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2keo h ALA 80 CO 0.04 0.69 -0.80 -0.07 0.00 0.00 0.00 179.25 179.10 2keo h LEU 81 N 0.00 0.09 -0.02 0.00 3.38 -0.36 -1.25 115.31 117.14 2keo h LEU 81 Ca -0.01 -0.07 -0.10 0.00 0.09 0.00 0.00 57.88 57.79 2keo h LEU 81 Cb 1.29 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 42.02 2keo h LEU 81 CO 0.07 0.85 -0.39 -0.61 0.09 0.00 0.00 178.44 178.44 2keo h GLN 82 N 0.04 0.31 -6.56 1.13 5.75 -0.92 -3.44 115.11 111.41 2keo h GLN 82 Ca -0.02 -0.30 -0.52 0.00 -0.15 0.00 0.00 58.65 57.67 2keo h GLN 82 Cb 1.40 0.08 -0.03 0.00 1.07 0.00 0.00 27.48 30.00 2keo h GLN 82 CO 0.11 0.98 0.27 0.12 -2.65 0.00 0.00 178.83 177.66 2keo s PHE 83 N -3.32 3.88 0.24 3.99 5.36 -0.84 -4.98 117.98 122.32 2keo s PHE 83 Ca -0.14 1.73 -0.03 0.00 -0.96 0.00 0.00 56.93 57.53 2keo s PHE 83 Cb 0.03 -2.91 0.28 0.00 -0.34 0.00 0.00 43.02 40.08 2keo s PHE 83 CO 0.78 0.39 1.71 1.05 -1.46 0.00 0.00 175.22 177.69 2keo h GLU 84 N 4.78 0.78 -0.36 10.12 4.11 -1.88 -1.65 114.58 130.48 2keo h GLU 84 Ca -0.45 -0.25 -0.05 0.00 0.07 0.00 0.00 59.36 58.68 2keo h GLU 84 Cb 1.21 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.37 2keo h GLU 84 CO 0.69 0.84 0.01 0.22 0.07 0.00 0.00 179.01 180.84 2keo h ASP 85 N 0.71 0.61 1.03 3.06 3.58 -1.93 -3.32 116.42 120.17 2keo h ASP 85 Ca 0.13 -0.30 -0.19 0.00 0.42 0.00 0.00 57.03 57.08 2keo h ASP 85 Cb 0.55 -0.16 -0.03 0.00 1.72 0.00 0.00 39.33 41.41 2keo h ASP 85 CO 0.03 0.76 -1.00 0.71 -2.88 0.00 0.00 179.24 176.87 2keo h THR 86 N 0.45 1.34 0.00 2.25 1.35 -1.72 -3.34 112.91 113.23 2keo h THR 86 Ca 0.10 -2.97 -0.04 0.00 -0.55 0.00 0.00 66.41 62.95 2keo h THR 86 Cb 0.44 2.65 -0.01 0.00 -1.73 0.00 0.00 68.15 69.51 2keo h THR 86 CO 0.02 0.76 -0.17 0.08 -0.25 0.00 0.00 175.52 175.96 2keo h ARG 87 N 0.00 0.00 0.00 4.72 0.11 -0.24 -1.77 114.38 117.20 2keo h ARG 87 Ca -0.05 0.00 -0.06 0.00 0.10 0.00 0.00 59.98 59.97 2keo h ARG 87 Cb 1.70 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.77 2keo h ARG 87 CO 0.10 0.17 -0.27 0.93 0.10 0.00 0.00 179.97 181.01 2keo h GLU 88 N 0.00 0.00 0.00 0.08 5.08 -1.73 -2.76 114.58 115.25 2keo h GLU 88 Ca -0.00 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.17 2keo h GLU 88 Cb 0.38 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.60 2keo h GLU 88 CO 0.02 0.27 -0.92 1.03 -1.00 0.00 0.00 179.01 178.42 2keo h SER 89 N 0.00 0.00 0.37 1.42 0.87 -1.53 -3.27 113.55 111.40 2keo h SER 89 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2keo h SER 89 Cb 1.19 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.15 2keo h SER 89 CO 0.04 0.87 0.00 0.24 -0.53 0.00 0.00 176.83 177.44 2keo h MET 90 N 0.00 0.00 -0.53 2.24 2.86 -1.08 -2.36 114.93 116.05 2keo h MET 90 Ca -0.02 0.00 0.06 0.00 -2.06 0.00 0.00 59.70 57.68 2keo h MET 90 Cb 1.68 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 33.31 2keo h MET 90 CO 0.11 0.00 0.36 1.25 1.06 0.00 0.00 176.91 179.69 2keo h HIS 91 N 0.00 0.48 -0.43 -0.22 6.17 -1.60 -0.66 115.15 118.89 2keo h HIS 91 Ca 0.00 0.01 -0.10 0.00 0.71 0.00 0.00 60.37 61.00 2keo h HIS 91 Cb 0.19 -0.16 -0.02 0.00 2.52 0.00 0.00 27.41 29.94 2keo h HIS 91 CO 0.00 0.26 -0.12 0.00 0.71 0.00 0.00 177.93 178.78 2keo h ALA 92 N 1.71 0.98 0.00 5.26 0.00 -1.66 -3.05 119.26 122.50 2keo h ALA 92 Ca 0.23 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2keo h ALA 92 Cb 0.30 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2keo h ALA 92 CO -0.06 0.60 -0.37 1.19 0.00 0.00 0.00 179.25 180.61 2keo n PHE 93 N -4.16 0.43 -2.13 0.00 3.72 -0.74 -4.70 117.46 109.87 2keo n PHE 93 Ca 0.01 0.12 -0.32 0.00 -0.05 0.00 0.00 57.45 57.22 2keo n PHE 93 Cb 0.37 -0.60 -0.04 0.00 -0.94 0.00 0.00 39.48 38.27 2keo n PHE 93 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2keo n VAL 95 N 7.54 0.27 -3.71 0.00 0.24 -0.86 -5.00 118.33 116.81 2keo n VAL 95 Ca 0.33 -0.15 0.00 0.00 -2.04 0.00 0.00 64.34 62.49 2keo n VAL 95 Cb 0.49 -0.34 0.00 0.00 -1.47 0.00 0.00 33.84 32.51 2keo n VAL 95 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2keo n GLY 96 N 1.41 -1.30 3.63 7.63 0.00 -1.04 -4.83 105.19 110.68 2keo n GLY 96 Ca 0.06 -1.10 -0.34 0.00 0.00 0.00 0.00 46.02 44.64 2keo n GLY 96 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2keo s GLN 97 N -1.41 2.86 0.23 1.61 0.74 -0.43 -1.25 119.66 122.01 2keo s GLN 97 Ca 0.00 -0.48 -0.30 0.00 0.05 0.00 0.00 55.36 54.63 2keo s GLN 97 Cb 0.00 -2.68 -0.09 0.00 1.10 0.00 0.00 33.01 31.34 2keo s GLN 97 CO 0.00 0.68 1.22 -0.47 -0.55 0.00 0.00 175.29 176.16 2keo s TYR 98 N -0.83 3.37 -0.18 1.67 5.04 -0.21 -1.06 117.35 125.15 2keo s TYR 98 Ca 0.13 1.44 -0.00 0.00 -2.44 0.00 0.00 57.07 56.19 2keo s TYR 98 Cb -0.11 -3.47 0.01 0.00 0.35 0.00 0.00 41.96 38.74 2keo s TYR 98 CO 0.02 -1.30 -0.15 -1.17 -1.34 0.00 0.00 175.55 171.61 2keo s LEU 99 N -0.68 2.40 0.14 6.97 1.98 -0.48 -4.81 118.68 124.20 2keo s LEU 99 Ca 0.51 -0.54 -0.30 0.00 -2.89 0.00 0.00 54.13 50.91 2keo s LEU 99 Cb -0.34 -1.56 -0.07 0.00 0.66 0.00 0.00 46.19 44.88 2keo s LEU 99 CO 0.40 0.02 1.19 -0.70 -1.89 0.00 0.00 176.35 175.38 2keo s GLU 100 N 1.18 4.48 0.23 1.98 2.12 -1.26 -3.72 118.70 123.70 2keo s GLU 100 Ca 0.02 1.82 0.20 0.00 0.36 0.00 0.00 54.97 57.37 2keo s GLU 100 Cb -0.14 -3.28 0.93 0.00 0.26 0.00 0.00 34.13 31.89 2keo s GLU 100 CO -0.07 -0.14 1.62 -0.35 -0.54 0.00 0.00 175.26 175.79 2keo n PRO 101 N 3.05 0.14 -0.01 4.30 -0.04 -1.26 -1.70 135.00 139.48 2keo n PRO 101 Ca 0.06 0.47 0.09 0.00 -0.04 0.00 0.00 63.50 64.07 2keo n PRO 101 Cb 0.45 -1.83 -0.13 0.00 -0.04 0.00 0.00 33.50 31.96 2keo n PRO 101 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2keo n ASP 102 N -2.11 1.00 0.22 3.54 2.03 -1.26 -4.62 116.55 115.35 2keo n ASP 102 Ca 0.01 -0.15 0.06 0.00 0.52 0.00 0.00 54.79 55.23 2keo n ASP 102 Cb 0.15 1.66 0.50 0.00 -0.72 0.00 0.00 41.12 42.71 2keo n ASP 102 CO 0.00 0.00 0.00 -0.61 -1.92 0.00 0.00 177.20 174.67 2keo h GLN 103 N 0.00 0.00 0.00 -0.67 5.75 -1.73 -1.54 115.11 116.92 2keo h GLN 103 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2keo h GLN 103 Cb 0.72 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.27 2keo h GLN 103 CO 0.00 0.23 0.00 0.39 -2.65 0.00 0.00 178.83 176.80 2keo n GLU 104 N -4.10 0.58 -2.68 1.69 1.02 -1.26 -4.03 120.64 111.85 2keo n GLU 104 Ca -0.02 0.03 -0.06 0.00 -0.02 0.00 0.00 57.16 57.09 2keo n GLU 104 Cb 0.30 -1.50 0.07 0.00 -0.02 0.00 0.00 31.44 30.29 2keo n GLU 104 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2keo n GLY 105 N 0.71 0.26 3.56 0.62 0.00 -0.83 -5.13 105.19 104.38 2keo n GLY 105 Ca 0.15 0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 2keo n GLY 105 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2keo s VAL 106 N 0.13 4.83 0.11 1.61 0.11 -0.64 -5.03 120.40 121.52 2keo s VAL 106 Ca 0.15 0.49 -0.01 0.00 -2.93 0.00 0.00 61.98 59.68 2keo s VAL 106 Cb 0.25 -4.15 -0.05 0.00 -1.53 0.00 0.00 36.38 30.91 2keo s VAL 106 CO -0.07 -0.44 0.29 0.28 -3.33 0.00 0.00 175.10 171.83 2keo s THR 107 N 2.85 5.29 -0.11 5.04 -1.32 -1.26 -5.07 115.64 121.05 2keo s THR 107 Ca 0.25 -0.27 0.03 0.00 -1.21 0.00 0.00 61.69 60.50 2keo s THR 107 Cb -0.14 -3.65 0.01 0.00 -1.51 0.00 0.00 72.50 67.21 2keo s THR 107 CO 0.17 0.05 -0.21 -0.63 -2.21 0.00 0.00 174.62 171.79 2keo s ILE 108 N -1.62 1.92 0.32 5.08 1.01 -1.26 -5.13 121.20 121.52 2keo s ILE 108 Ca 0.37 -0.92 -0.29 0.00 0.00 0.00 0.00 60.65 59.82 2keo s ILE 108 Cb -0.12 -1.69 -0.10 0.00 0.01 0.00 0.00 42.46 40.55 2keo s ILE 108 CO 0.27 0.53 1.39 -2.84 0.00 0.00 0.00 174.94 174.28 2keo s PRO 109 N 0.64 4.27 -1.79 2.79 0.02 -1.26 -2.98 135.00 136.69 2keo s PRO 109 Ca -0.12 2.32 0.00 0.00 0.02 0.00 0.00 61.00 63.22 2keo s PRO 109 Cb -0.16 -3.06 0.00 0.00 0.02 0.00 0.00 34.50 31.30 2keo s PRO 109 CO 0.03 -0.34 0.00 -0.25 -0.33 0.00 0.00 177.00 176.11 2keo n ASP 110 N 1.19 -5.78 -0.16 2.53 9.92 -1.26 -4.90 116.55 118.08 2keo n ASP 110 Ca 0.02 0.04 -0.10 0.00 -0.53 0.00 0.00 54.79 54.22 2keo n ASP 110 Cb 0.41 -4.82 -0.00 0.00 -0.64 0.00 0.00 41.12 36.06 2keo n ASP 110 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 2keo h LEU 111 N 0.00 0.83 0.00 0.64 5.85 -1.99 -3.57 115.31 117.07 2keo h LEU 111 Ca -0.48 -0.32 0.00 0.00 0.84 0.00 0.00 57.88 57.92 2keo h LEU 111 Cb 1.36 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 42.16 2keo h LEU 111 CO 0.58 0.95 0.00 0.61 -0.34 0.00 0.00 178.44 180.24