#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 3.11 -0.13 3.49 0.00 -1.26 -5.04 119.74 119.92 2keo s LYS 22 Ca 0.00 1.79 -0.05 0.00 0.00 0.00 0.00 55.97 57.71 2keo s LYS 22 Cb 0.00 -1.99 -0.04 0.00 0.00 0.00 0.00 37.83 35.81 2keo s LYS 22 CO 0.00 -1.09 0.08 0.54 0.00 0.00 0.00 175.35 174.88 2keo s VAL 23 N -1.62 4.94 -0.33 1.79 0.11 -1.26 -5.08 120.40 118.96 2keo s VAL 23 Ca 0.75 0.00 -0.02 0.00 -2.93 0.00 0.00 61.98 59.79 2keo s VAL 23 Cb -0.29 -3.15 0.06 0.00 -1.53 0.00 0.00 36.38 31.47 2keo s VAL 23 CO 0.32 0.57 0.05 -0.89 -3.33 0.00 0.00 175.10 171.82 2keo s THR 24 N -0.62 3.04 -0.29 5.04 2.01 -1.26 -5.07 115.64 118.50 2keo s THR 24 Ca 0.11 -1.56 -0.14 0.00 0.31 0.00 0.00 61.69 60.42 2keo s THR 24 Cb -0.12 -2.84 -0.04 0.00 0.01 0.00 0.00 72.50 69.51 2keo s THR 24 CO 0.02 -0.25 0.30 -0.76 -0.69 0.00 0.00 174.62 173.25 2keo s LEU 25 N 1.22 4.11 -0.16 4.42 1.43 -1.26 -0.52 118.68 127.93 2keo s LEU 25 Ca -0.02 0.08 -0.05 0.00 -1.03 0.00 0.00 54.13 53.11 2keo s LEU 25 Cb -0.20 -2.30 -0.03 0.00 0.03 0.00 0.00 46.19 43.69 2keo s LEU 25 CO -0.02 -0.17 0.01 -0.69 0.23 0.00 0.00 176.35 175.71 2keo s VAL 26 N 1.94 4.30 0.42 -1.59 1.01 -0.23 -4.94 120.40 121.31 2keo s VAL 26 Ca 0.11 -0.22 0.08 0.00 0.00 0.00 0.00 61.98 61.96 2keo s VAL 26 Cb -0.16 -2.89 -0.01 0.00 0.00 0.00 0.00 36.38 33.32 2keo s VAL 26 CO 0.11 0.50 0.46 0.00 0.00 0.00 0.00 175.10 176.17 2keo s ARG 27 N 0.19 2.64 0.48 2.72 1.70 -1.26 -1.62 118.95 123.80 2keo s ARG 27 Ca 0.01 -1.43 0.16 0.00 -0.47 0.00 0.00 55.73 54.00 2keo s ARG 27 Cb -0.13 -2.53 1.17 0.00 -0.57 0.00 0.00 34.95 32.89 2keo s ARG 27 CO 0.02 -0.24 2.07 0.97 -1.08 0.00 0.00 175.30 177.03 2keo h ILE 28 N 0.85 0.94 -0.79 4.99 2.10 -1.98 -1.88 117.51 121.74 2keo h ILE 28 Ca -0.41 -0.07 0.05 0.00 1.08 0.00 0.00 64.86 65.52 2keo h ILE 28 Cb 1.27 0.74 -0.05 0.00 -1.09 0.00 0.00 36.82 37.69 2keo h ILE 28 CO 0.52 0.03 0.49 0.00 -1.08 0.00 0.00 178.15 178.11 2keo h ALA 29 N 1.83 1.06 -0.49 0.18 0.00 -1.97 -2.00 119.26 117.87 2keo h ALA 29 Ca 0.14 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 2keo h ALA 29 Cb 0.31 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2keo h ALA 29 CO -0.02 0.24 0.11 -0.44 0.00 0.00 0.00 179.25 179.14 2keo h ASP 30 N 0.92 0.69 0.13 0.00 3.32 -1.74 -2.96 116.42 116.78 2keo h ASP 30 Ca 0.34 -0.12 -0.01 0.00 0.02 0.00 0.00 57.03 57.26 2keo h ASP 30 Cb 0.11 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.48 2keo h ASP 30 CO -0.15 0.69 -0.06 -0.07 -1.72 0.00 0.00 179.24 177.93 2keo h LEU 31 N 0.72 -0.15 -0.40 1.55 3.38 -1.35 -2.42 115.31 116.63 2keo h LEU 31 Ca 0.16 -0.16 0.02 0.00 0.09 0.00 0.00 57.88 57.99 2keo h LEU 31 Cb 0.28 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 2keo h LEU 31 CO -0.00 0.07 0.24 -0.33 0.09 0.00 0.00 178.44 178.51 2keo h GLU 32 N -0.37 0.48 0.00 1.13 5.08 -1.30 -0.88 114.58 118.72 2keo h GLU 32 Ca -0.02 -0.03 -0.18 0.00 -1.00 0.00 0.00 59.36 58.13 2keo h GLU 32 Cb 0.30 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 2keo h GLU 32 CO 0.03 0.32 -0.86 -2.95 -1.00 0.00 0.00 179.01 174.55 2keo h ASN 33 N 0.49 0.02 0.92 1.42 7.08 -1.60 -3.20 115.58 120.70 2keo h ASN 33 Ca 0.16 -0.01 -0.09 0.00 -3.08 0.00 0.00 56.30 53.28 2keo h ASN 33 Cb -0.00 -0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 36.22 2keo h ASN 33 CO -0.07 0.87 -0.43 -0.74 -2.08 0.00 0.00 177.43 174.98 2keo h HIS 34 N 0.01 0.00 -0.70 4.14 2.76 -1.02 -2.53 115.15 117.80 2keo h HIS 34 Ca -0.01 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.15 2keo h HIS 34 Cb 1.52 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 30.44 2keo h HIS 34 CO 0.00 0.43 0.39 -0.97 -1.30 0.00 0.00 177.93 176.48 2keo h ASN 35 N 0.00 0.86 0.27 3.26 -1.24 -1.16 -1.94 115.58 115.64 2keo h ASN 35 Ca -0.00 -0.07 -0.13 0.00 0.71 0.00 0.00 56.30 56.81 2keo h ASN 35 Cb 1.00 -0.22 -0.01 0.00 0.73 0.00 0.00 38.32 39.82 2keo h ASN 35 CO 0.06 0.69 -0.51 -1.13 -1.29 0.00 0.00 177.43 175.24 2keo h ASN 36 N 0.98 0.30 -0.10 1.15 -0.73 -1.53 -3.06 115.58 112.59 2keo h ASN 36 Ca 0.25 -0.15 -0.06 0.00 1.87 0.00 0.00 56.30 58.21 2keo h ASN 36 Cb 0.02 -0.08 -0.01 0.00 0.27 0.00 0.00 38.32 38.51 2keo h ASN 36 CO -0.04 0.76 -0.09 -0.78 -0.37 0.00 0.00 177.43 176.91 2keo h ASP 37 N 0.21 0.37 0.00 1.15 3.58 -1.02 -3.47 116.42 117.25 2keo h ASP 37 Ca 0.01 -0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.38 2keo h ASP 37 Cb 0.98 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 41.93 2keo h ASP 37 CO 0.08 0.51 0.00 0.61 -2.88 0.00 0.00 179.24 177.56 2keo n GLY 38 N -0.81 1.04 3.59 -0.78 0.00 -0.78 -5.08 105.19 102.37 2keo n GLY 38 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.93 0.93 -0.53 -0.02 0.00 -1.12 -4.95 107.32 100.70 2keo s GLY 39 Ca 0.00 -0.29 -0.28 0.00 0.00 0.00 0.00 44.72 44.15 2keo s GLY 39 CO 0.00 2.89 1.16 -0.12 0.00 0.00 0.00 173.10 177.03 2keo s PHE 40 N 6.07 2.71 0.15 1.90 2.19 -1.26 -3.70 117.98 126.04 2keo s PHE 40 Ca 0.61 0.54 0.02 0.00 0.33 0.00 0.00 56.93 58.44 2keo s PHE 40 Cb -0.14 -4.46 -0.04 0.00 -1.31 0.00 0.00 43.02 37.07 2keo s PHE 40 CO 0.30 -1.43 0.29 -1.58 1.83 0.00 0.00 175.22 174.63 2keo s TRP 41 N 4.68 3.49 0.16 10.12 0.51 -1.26 -0.36 118.94 136.27 2keo s TRP 41 Ca 0.45 0.13 -0.09 0.00 -2.12 0.00 0.00 56.10 54.47 2keo s TRP 41 Cb -0.07 -1.68 -0.01 0.00 -0.81 0.00 0.00 33.47 30.90 2keo s TRP 41 CO 0.28 0.51 0.29 -0.08 -0.51 0.00 0.00 176.95 177.44 2keo s THR 42 N -1.75 0.07 -0.20 2.01 -1.32 -0.83 -4.90 115.64 108.73 2keo s THR 42 Ca 0.35 -1.33 0.01 0.00 -1.21 0.00 0.00 61.69 59.51 2keo s THR 42 Cb -0.11 -1.77 0.03 0.00 -1.51 0.00 0.00 72.50 69.14 2keo s THR 42 CO 0.29 -0.32 -0.17 -0.69 -2.21 0.00 0.00 174.62 171.51 2keo s VAL 43 N -3.95 2.01 -0.01 5.08 1.01 -1.26 -1.46 120.40 121.83 2keo s VAL 43 Ca 0.15 -1.07 0.00 0.00 0.00 0.00 0.00 61.98 61.06 2keo s VAL 43 Cb 0.03 -1.91 0.00 0.00 0.00 0.00 0.00 36.38 34.51 2keo s VAL 43 CO -0.01 0.38 -0.01 -0.63 0.00 0.00 0.00 175.10 174.83 2keo s ILE 44 N 1.27 0.12 -1.50 2.22 1.01 -0.47 -4.88 121.20 118.98 2keo s ILE 44 Ca 0.01 -0.03 -0.00 0.00 0.00 0.00 0.00 60.65 60.63 2keo s ILE 44 Cb -0.15 -0.13 0.00 0.00 0.01 0.00 0.00 42.46 42.20 2keo s ILE 44 CO -0.11 0.05 0.06 -0.67 0.00 0.00 0.00 174.94 174.28 2keo n ASP 45 N 3.25 -5.23 -0.82 3.58 2.03 -1.26 -1.63 116.55 116.47 2keo n ASP 45 Ca -0.15 -0.05 -0.11 0.00 0.52 0.00 0.00 54.79 55.01 2keo n ASP 45 Cb 0.58 -4.28 -0.05 0.00 -0.72 0.00 0.00 41.12 36.65 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 -1.07 1.17 3.29 0.27 0.00 -1.26 -5.01 105.19 102.58 2keo n GLY 46 Ca -0.20 -0.33 -0.25 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.76 1.24 -0.21 1.61 -0.14 -0.64 -1.48 119.74 117.35 2keo s LYS 47 Ca 0.00 -1.14 -0.10 0.00 -1.36 0.00 0.00 55.97 53.37 2keo s LYS 47 Cb 0.00 -1.50 -0.05 0.00 -1.68 0.00 0.00 37.83 34.60 2keo s LYS 47 CO 0.00 0.36 0.13 0.08 -0.76 0.00 0.00 175.35 175.16 2keo s VAL 48 N -1.06 5.39 0.05 3.17 1.01 -0.32 -1.36 120.40 127.27 2keo s VAL 48 Ca 0.08 0.18 0.08 0.00 0.00 0.00 0.00 61.98 62.32 2keo s VAL 48 Cb -0.10 -3.47 -0.03 0.00 0.00 0.00 0.00 36.38 32.79 2keo s VAL 48 CO 0.04 0.42 -0.24 -0.31 0.00 0.00 0.00 175.10 175.01 2keo s TYR 49 N 0.51 2.06 -0.57 5.22 2.02 -0.53 -1.11 117.35 124.95 2keo s TYR 49 Ca 0.08 -0.39 -0.23 0.00 -0.37 0.00 0.00 57.07 56.15 2keo s TYR 49 Cb -0.12 -1.23 0.05 0.00 -0.40 0.00 0.00 41.96 40.27 2keo s TYR 49 CO -0.01 0.12 0.92 0.34 -1.57 0.00 0.00 175.55 175.35 2keo s ASP 50 N -1.25 6.29 0.42 2.29 2.15 -1.12 -1.96 116.67 123.49 2keo s ASP 50 Ca 0.10 -0.53 0.11 0.00 0.43 0.00 0.00 52.55 52.65 2keo s ASP 50 Cb -0.09 -2.42 0.91 0.00 -0.30 0.00 0.00 42.92 41.02 2keo s ASP 50 CO 0.02 -1.24 1.99 0.40 -0.17 0.00 0.00 175.17 176.18 2keo h ILE 51 N 5.99 1.13 -0.70 4.11 1.08 -1.05 -1.84 117.51 126.23 2keo h ILE 51 Ca -0.27 -0.50 0.01 0.00 -0.39 0.00 0.00 64.86 63.71 2keo h ILE 51 Cb 1.07 1.04 -0.03 0.00 -3.07 0.00 0.00 36.82 35.83 2keo h ILE 51 CO 1.09 0.16 0.47 0.50 -0.69 0.00 0.00 178.15 179.68 2keo h LYS 52 N 0.23 0.93 -0.03 2.37 3.64 -1.89 -1.43 116.57 120.39 2keo h LYS 52 Ca 0.05 -0.06 -0.19 0.00 -1.27 0.00 0.00 60.65 59.18 2keo h LYS 52 Cb 0.21 -0.21 0.01 0.00 -0.41 0.00 0.00 32.23 31.84 2keo h LYS 52 CO 0.01 0.61 -0.74 0.22 -2.27 0.00 0.00 179.45 177.28 2keo h ASP 53 N 0.95 0.70 -0.35 4.20 3.58 -1.79 -3.22 116.42 120.50 2keo h ASP 53 Ca 0.26 -0.72 0.08 0.00 0.42 0.00 0.00 57.03 57.06 2keo h ASP 53 Cb -0.11 -0.21 -0.08 0.00 1.72 0.00 0.00 39.33 40.65 2keo h ASP 53 CO -0.06 1.33 -0.19 0.15 -2.88 0.00 0.00 179.24 177.60 2keo h PHE 54 N 0.14 -0.47 0.00 0.28 3.04 -0.80 -1.02 116.94 118.11 2keo h PHE 54 Ca -0.08 0.04 -0.06 0.00 3.98 0.00 0.00 57.97 61.84 2keo h PHE 54 Cb 1.41 0.26 -0.01 0.00 2.56 0.00 0.00 35.95 40.18 2keo h PHE 54 CO 0.12 -0.26 -0.30 -0.56 -2.02 0.00 0.00 178.31 175.29 2keo h GLN 55 N -0.13 0.00 -0.42 1.11 3.07 -1.42 -2.32 115.11 114.99 2keo h GLN 55 Ca 0.18 0.00 -0.13 0.00 0.09 0.00 0.00 58.65 58.79 2keo h GLN 55 Cb 0.40 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.95 2keo h GLN 55 CO -0.43 0.30 -0.25 1.15 0.09 0.00 0.00 178.83 179.68 2keo h THR 56 N 0.00 1.27 0.00 1.86 2.02 -1.24 -3.20 112.91 113.62 2keo h THR 56 Ca -0.00 -1.40 -0.11 0.00 0.77 0.00 0.00 66.41 65.66 2keo h THR 56 Cb 0.61 1.21 -0.02 0.00 -1.74 0.00 0.00 68.15 68.22 2keo h THR 56 CO 0.04 0.47 -0.52 1.56 0.37 0.00 0.00 175.52 177.44 2keo h GLN 57 N 0.76 0.00 0.00 6.66 1.08 -0.81 -2.93 115.11 119.87 2keo h GLN 57 Ca 0.09 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.29 2keo h GLN 57 Cb 0.81 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.24 2keo h GLN 57 CO 0.07 0.52 0.00 -1.13 -0.95 0.00 0.00 178.83 177.34 2keo n SER 58 N -3.52 0.07 0.20 1.46 3.41 -0.91 -2.30 113.62 112.01 2keo n SER 58 Ca -0.00 0.51 0.14 0.00 -0.26 0.00 0.00 58.87 59.26 2keo n SER 58 Cb 0.62 -0.53 0.55 0.00 -0.26 0.00 0.00 64.21 64.59 2keo n SER 58 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2keo h LEU 59 N 0.00 0.00 -9.47 1.04 4.07 -1.56 -3.43 115.31 105.96 2keo h LEU 59 Ca 0.00 0.00 -0.56 0.00 0.08 0.00 0.00 57.88 57.40 2keo h LEU 59 Cb 0.37 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 42.05 2keo h LEU 59 CO 0.00 0.00 0.02 -0.89 -1.08 0.00 0.00 178.44 176.49 2keo s THR 60 N -3.45 4.94 0.19 0.22 2.01 -0.97 -4.97 115.64 113.60 2keo s THR 60 Ca 0.04 1.32 0.05 0.00 0.31 0.00 0.00 61.69 63.40 2keo s THR 60 Cb 0.09 -3.97 -0.11 0.00 0.01 0.00 0.00 72.50 68.52 2keo s THR 60 CO 0.49 0.37 1.44 -0.08 -0.69 0.00 0.00 174.62 176.14 2keo h GLU 61 N 5.97 0.14 -3.16 4.92 4.81 -1.87 -3.34 114.58 122.04 2keo h GLU 61 Ca -0.44 -0.14 -0.70 0.00 -0.13 0.00 0.00 59.36 57.95 2keo h GLU 61 Cb 1.20 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 30.57 2keo h GLU 61 CO 0.71 0.86 3.17 0.09 -0.73 0.00 0.00 179.01 183.12 2keo n ASN 62 N -3.69 7.23 -3.88 1.04 4.13 -1.26 -4.70 115.26 114.13 2keo n ASN 62 Ca -0.02 -2.82 -0.09 0.00 1.68 0.00 0.00 54.58 53.33 2keo n ASN 62 Cb 0.75 -1.52 -0.07 0.00 -1.54 0.00 0.00 39.78 37.40 2keo n ASN 62 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 2keo s SER 63 N 1.80 0.14 0.52 6.41 1.04 -1.25 -5.03 113.70 117.33 2keo s SER 63 Ca 0.58 -0.68 0.30 0.00 0.48 0.00 0.00 55.95 56.62 2keo s SER 63 Cb 0.16 0.33 1.35 0.00 0.10 0.00 0.00 66.02 67.97 2keo s SER 63 CO -0.07 -0.73 2.00 0.16 0.98 0.00 0.00 173.24 175.58 2keo h ILE 64 N 2.77 0.35 -0.12 -1.02 3.07 -1.91 -3.14 117.51 117.51 2keo h ILE 64 Ca -0.34 -0.67 0.00 0.00 1.55 0.00 0.00 64.86 65.40 2keo h ILE 64 Cb 1.20 1.49 0.00 0.00 -0.27 0.00 0.00 36.82 39.24 2keo h ILE 64 CO 0.57 0.11 0.00 0.18 -1.05 0.00 0.00 178.15 177.95 2keo n LEU 65 N -3.35 1.87 0.05 0.16 4.77 -1.26 -3.94 117.00 115.30 2keo n LEU 65 Ca -0.01 -0.72 0.02 0.00 -0.03 0.00 0.00 56.01 55.27 2keo n LEU 65 Cb 0.30 -0.07 0.36 0.00 -2.33 0.00 0.00 43.42 41.68 2keo n LEU 65 CO 0.29 0.36 0.96 0.00 -1.33 0.00 0.00 177.39 177.67 2keo h ALA 66 N 4.25 1.49 0.00 -1.18 0.00 -1.75 -0.13 119.26 121.95 2keo h ALA 66 Ca 0.00 -0.17 -0.16 0.00 0.00 0.00 0.00 54.91 54.58 2keo h ALA 66 Cb 0.57 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 2keo h ALA 66 CO 0.00 0.37 -0.78 -0.56 0.00 0.00 0.00 179.25 178.27 2keo h GLN 67 N 0.39 0.00 -0.08 0.00 3.07 -1.83 -3.23 115.11 113.44 2keo h GLN 67 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.83 2keo h GLN 67 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.84 2keo h GLN 67 CO 0.01 0.78 0.00 1.19 0.09 0.00 0.00 178.83 180.90 2keo n PHE 68 N -3.59 0.08 0.25 0.06 3.72 -0.85 -4.12 117.46 113.01 2keo n PHE 68 Ca -0.01 -0.04 0.11 0.00 -0.05 0.00 0.00 57.45 57.46 2keo n PHE 68 Cb 0.76 0.00 0.65 0.00 -0.94 0.00 0.00 39.48 39.95 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 4.28 1.33 -0.81 4.37 0.00 -1.06 -2.19 119.26 125.19 2keo h ALA 69 Ca 0.00 -0.14 -0.43 0.00 0.00 0.00 0.00 54.91 54.34 2keo h ALA 69 Cb 0.54 -0.02 -0.25 0.00 0.00 0.00 0.00 17.79 18.05 2keo h ALA 69 CO 0.00 0.19 0.44 0.41 0.00 0.00 0.00 179.25 180.29 2keo n GLY 70 N -0.66 4.72 3.05 0.00 0.00 -1.26 -4.96 105.19 106.08 2keo n GLY 70 Ca -0.02 -1.22 -0.09 0.00 0.00 0.00 0.00 46.02 44.69 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 -3.32 0.49 0.24 1.61 2.56 -0.82 -5.14 118.70 114.31 2keo s GLU 71 Ca 0.54 -0.91 -0.31 0.00 0.00 0.00 0.00 54.97 54.28 2keo s GLU 71 Cb 0.46 0.07 -0.12 0.00 2.00 0.00 0.00 34.13 36.54 2keo s GLU 71 CO 0.07 -0.06 1.68 -3.47 -0.56 0.00 0.00 175.26 172.93 2keo n ASP 72 N 0.90 3.96 -0.21 -1.70 2.03 -1.26 -4.88 116.55 115.38 2keo n ASP 72 Ca -0.19 1.09 0.04 0.00 0.52 0.00 0.00 54.79 56.25 2keo n ASP 72 Cb 0.58 -1.58 0.30 0.00 -0.72 0.00 0.00 41.12 39.70 2keo n ASP 72 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2keo h PRO 73 N 6.12 0.85 -0.03 -0.67 0.13 -1.98 0.76 132.00 137.18 2keo h PRO 73 Ca -0.44 -0.05 -0.11 0.00 -0.87 0.00 0.00 66.00 64.53 2keo h PRO 73 Cb 1.21 -0.19 0.01 0.00 0.13 0.00 0.00 31.00 32.15 2keo h PRO 73 CO 0.90 0.56 -0.39 0.28 -0.23 0.00 0.00 178.00 179.12 2keo h VAL 74 N 0.87 1.45 -0.36 1.56 2.07 -1.97 -1.70 116.25 118.19 2keo h VAL 74 Ca 0.31 -1.89 -0.09 0.00 0.82 0.00 0.00 66.70 65.86 2keo h VAL 74 Cb 0.13 2.51 -0.02 0.00 -1.52 0.00 0.00 31.29 32.39 2keo h VAL 74 CO -0.10 0.54 -0.14 0.58 0.02 0.00 0.00 177.57 178.48 2keo h VAL 75 N -0.21 1.25 -0.18 2.57 2.07 -1.92 -2.30 116.25 117.53 2keo h VAL 75 Ca -0.04 -1.13 -0.13 0.00 0.82 0.00 0.00 66.70 66.22 2keo h VAL 75 Cb 1.09 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.98 2keo h VAL 75 CO 0.08 0.38 -0.44 0.00 0.02 0.00 0.00 177.57 177.60 2keo h ALA 76 N 1.28 0.90 -0.53 1.67 0.00 -0.89 -2.73 119.26 118.96 2keo h ALA 76 Ca 0.10 -0.45 -0.09 0.00 0.00 0.00 0.00 54.91 54.46 2keo h ALA 76 Cb 0.57 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2keo h ALA 76 CO 0.04 0.64 -0.04 1.25 0.00 0.00 0.00 179.25 181.14 2keo h LEU 77 N 0.36 0.92 -0.05 0.00 5.85 -0.97 0.12 115.31 121.53 2keo h LEU 77 Ca 0.03 -0.26 0.01 0.00 0.84 0.00 0.00 57.88 58.50 2keo h LEU 77 Cb 0.92 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 2keo h LEU 77 CO 0.08 1.00 -0.02 -0.33 -0.34 0.00 0.00 178.44 178.82 2keo h GLU 78 N 0.85 -0.02 -0.35 1.25 5.08 -1.24 -0.79 114.58 119.36 2keo h GLU 78 Ca 0.15 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.48 2keo h GLU 78 Cb 0.56 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 2keo h GLU 78 CO 0.03 -0.02 0.09 0.00 -1.00 0.00 0.00 179.01 178.12 2keo h ALA 79 N 1.02 1.51 0.00 3.43 0.00 -1.34 -2.49 119.26 121.39 2keo h ALA 79 Ca 0.03 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.68 2keo h ALA 79 Cb 0.06 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2keo h ALA 79 CO -0.06 0.37 -0.60 0.00 0.00 0.00 0.00 179.25 178.95 2keo h ALA 80 N 1.61 0.88 0.00 0.00 0.00 -0.59 -0.23 119.26 120.93 2keo h ALA 80 Ca 0.12 -0.55 -0.11 0.00 0.00 0.00 0.00 54.91 54.37 2keo h ALA 80 Cb 0.18 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2keo h ALA 80 CO -0.01 0.75 -0.53 -0.07 0.00 0.00 0.00 179.25 179.39 2keo h LEU 81 N 0.00 0.00 0.00 0.00 -0.00 -0.71 -1.42 115.31 113.18 2keo h LEU 81 Ca -0.01 0.00 -0.15 0.00 -0.00 0.00 0.00 57.88 57.73 2keo h LEU 81 Cb 1.15 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.78 2keo h LEU 81 CO 0.08 0.53 -1.39 0.00 -0.00 0.00 0.00 178.44 177.66 2keo n GLN 82 N -3.76 0.62 -3.34 1.13 6.02 -1.00 -4.69 117.38 112.35 2keo n GLN 82 Ca -0.01 0.20 -0.38 0.00 -0.01 0.00 0.00 57.00 56.80 2keo n GLN 82 Cb 0.57 -1.80 -0.06 0.00 1.02 0.00 0.00 30.24 29.97 2keo n GLN 82 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.06 176.17 2keo s PHE 83 N -2.98 3.61 0.29 1.08 5.36 -0.13 -5.00 117.98 120.20 2keo s PHE 83 Ca -0.03 0.99 -0.01 0.00 -0.96 0.00 0.00 56.93 56.92 2keo s PHE 83 Cb 0.09 -2.49 0.43 0.00 -0.34 0.00 0.00 43.02 40.70 2keo s PHE 83 CO 0.81 0.34 1.85 1.05 -1.46 0.00 0.00 175.22 177.81 2keo h GLU 84 N 5.93 0.84 0.00 10.12 4.11 -1.90 -0.57 114.58 133.11 2keo h GLU 84 Ca -0.45 -0.15 -0.11 0.00 0.07 0.00 0.00 59.36 58.72 2keo h GLU 84 Cb 1.19 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 30.29 2keo h GLU 84 CO 0.71 0.72 -0.52 0.22 0.07 0.00 0.00 179.01 180.21 2keo h ASP 85 N 0.82 0.00 0.00 3.06 3.58 -1.94 -3.35 116.42 118.59 2keo h ASP 85 Ca 0.19 0.00 -0.34 0.00 0.42 0.00 0.00 57.03 57.30 2keo h ASP 85 Cb 0.23 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 41.21 2keo h ASP 85 CO -0.01 0.52 -2.29 0.35 -2.88 0.00 0.00 179.24 174.93 2keo n THR 86 N -3.53 1.29 0.13 2.25 -2.24 -1.00 -4.52 114.28 106.67 2keo n THR 86 Ca -0.00 -0.77 0.06 0.00 -2.27 0.00 0.00 64.05 61.07 2keo n THR 86 Cb 0.61 -0.59 0.53 0.00 -2.10 0.00 0.00 70.33 68.78 2keo n THR 86 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 2keo h ARG 87 N 0.00 0.27 -0.48 -0.78 -0.00 0.05 -1.64 114.38 111.80 2keo h ARG 87 Ca -0.51 -0.02 -0.04 0.00 -0.00 0.00 0.00 59.98 59.41 2keo h ARG 87 Cb 2.12 -0.06 -0.02 0.00 -0.00 0.00 0.00 29.97 32.01 2keo h ARG 87 CO 0.02 0.18 0.13 1.05 -0.00 0.00 0.00 179.97 181.35 2keo h GLU 88 N 0.28 0.76 0.00 0.08 4.11 -1.79 -3.01 114.58 115.01 2keo h GLU 88 Ca 0.07 -0.18 0.00 0.00 0.07 0.00 0.00 59.36 59.33 2keo h GLU 88 Cb -0.02 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.13 2keo h GLU 88 CO -0.02 0.74 0.00 1.03 0.07 0.00 0.00 179.01 180.83 2keo h SER 89 N 0.65 0.00 0.07 3.06 0.87 -1.57 -3.10 113.55 113.52 2keo h SER 89 Ca 0.15 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.70 2keo h SER 89 Cb 0.31 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.27 2keo h SER 89 CO 0.00 0.00 -0.05 0.24 -0.53 0.00 0.00 176.83 176.49 2keo h MET 90 N 0.00 0.00 0.00 2.24 2.86 -1.28 -1.68 114.93 117.07 2keo h MET 90 Ca 0.00 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 2keo h MET 90 Cb 0.77 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.42 2keo h MET 90 CO 0.00 0.05 -0.13 0.45 1.06 0.00 0.00 176.91 178.34 2keo h HIS 91 N 0.00 0.00 0.00 -0.22 3.86 -1.66 -1.57 115.15 115.56 2keo h HIS 91 Ca -0.00 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.12 2keo h HIS 91 Cb 0.09 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.55 2keo h HIS 91 CO 0.00 0.13 -0.44 0.00 0.86 0.00 0.00 177.93 178.48 2keo h ALA 92 N 1.87 0.84 0.00 2.45 0.00 -1.51 -3.13 119.26 119.78 2keo h ALA 92 Ca -0.00 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.49 2keo h ALA 92 Cb 0.32 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 2keo h ALA 92 CO 0.02 0.55 -0.70 0.74 0.00 0.00 0.00 179.25 179.86 2keo h PHE 93 N 0.00 0.00 -1.61 0.00 0.04 -1.37 -3.45 116.94 110.55 2keo h PHE 93 Ca -0.00 0.00 -0.43 0.00 2.80 0.00 0.00 57.97 60.34 2keo h PHE 93 Cb 1.11 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.24 2keo h PHE 93 CO 0.00 0.06 1.24 0.00 -0.60 0.00 0.00 178.31 179.02 2keo n VAL 95 N 7.58 0.55 0.00 0.00 0.24 -0.27 -4.94 118.33 121.49 2keo n VAL 95 Ca 0.29 0.11 0.00 0.00 -2.04 0.00 0.00 64.34 62.70 2keo n VAL 95 Cb 0.51 -0.78 0.00 0.00 -1.47 0.00 0.00 33.84 32.11 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 0.70 -0.04 3.88 7.63 0.00 -1.20 -5.02 105.19 111.15 2keo n GLY 96 Ca 0.05 -1.09 -0.30 0.00 0.00 0.00 0.00 46.02 44.68 2keo n GLY 96 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2keo s GLN 97 N -2.00 3.03 0.07 1.61 -0.21 0.32 -1.17 119.66 121.31 2keo s GLN 97 Ca 0.00 0.49 0.09 0.00 0.02 0.00 0.00 55.36 55.96 2keo s GLN 97 Cb 0.00 -2.06 -0.03 0.00 1.00 0.00 0.00 33.01 31.92 2keo s GLN 97 CO 0.00 -0.90 -0.23 -0.47 -2.12 0.00 0.00 175.29 171.57 2keo s TYR 98 N -3.29 2.43 -0.06 0.91 5.04 -0.55 -1.07 117.35 120.76 2keo s TYR 98 Ca 0.57 -0.33 -0.02 0.00 -2.44 0.00 0.00 57.07 54.84 2keo s TYR 98 Cb -0.11 -1.38 0.04 0.00 0.35 0.00 0.00 41.96 40.86 2keo s TYR 98 CO 0.52 0.25 0.12 -1.17 -1.34 0.00 0.00 175.55 173.92 2keo s LEU 99 N -1.60 0.47 0.27 6.97 1.98 -0.64 -4.82 118.68 121.31 2keo s LEU 99 Ca 0.14 0.24 -0.29 0.00 -2.89 0.00 0.00 54.13 51.32 2keo s LEU 99 Cb -0.10 0.20 -0.10 0.00 0.66 0.00 0.00 46.19 46.85 2keo s LEU 99 CO 0.05 -0.19 1.25 -1.61 -1.89 0.00 0.00 176.35 173.97 2keo s GLU 100 N 1.62 4.44 0.27 1.98 8.01 -1.26 -4.24 118.70 129.51 2keo s GLU 100 Ca -0.04 2.05 -0.00 0.00 0.01 0.00 0.00 54.97 56.99 2keo s GLU 100 Cb -0.12 -3.15 0.56 0.00 -4.31 0.00 0.00 34.13 27.11 2keo s GLU 100 CO -0.05 -0.11 1.75 -1.35 0.01 0.00 0.00 175.26 175.51 2keo h PRO 101 N 4.22 0.58 0.19 0.39 0.11 -1.98 -1.27 132.00 134.23 2keo h PRO 101 Ca -0.47 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.60 2keo h PRO 101 Cb 1.22 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 2keo h PRO 101 CO 0.70 0.38 -0.12 0.22 -0.21 0.00 0.00 178.00 178.97 2keo h ASP 102 N 0.60 -0.31 -0.64 -2.05 3.58 -1.92 -2.46 116.42 113.22 2keo h ASP 102 Ca 0.48 0.02 0.03 0.00 0.42 0.00 0.00 57.03 57.98 2keo h ASP 102 Cb 0.70 0.09 -0.04 0.00 1.72 0.00 0.00 39.33 41.81 2keo h ASP 102 CO -0.38 -0.20 0.42 -0.61 -2.88 0.00 0.00 179.24 175.59 2keo h GLN 103 N -0.31 0.74 -0.37 0.28 5.75 -1.67 -1.56 115.11 117.98 2keo h GLN 103 Ca -0.02 -0.04 -0.11 0.00 -0.15 0.00 0.00 58.65 58.33 2keo h GLN 103 Cb 0.26 -0.17 -0.01 0.00 1.07 0.00 0.00 27.48 28.63 2keo h GLN 103 CO 0.01 0.49 -0.20 1.49 -2.65 0.00 0.00 178.83 177.98 2keo h GLU 104 N 0.76 0.79 0.00 1.69 4.22 -1.06 -3.38 114.58 117.60 2keo h GLU 104 Ca 0.25 -0.35 0.00 0.00 0.08 0.00 0.00 59.36 59.34 2keo h GLU 104 Cb 0.07 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.30 2keo h GLU 104 CO -0.07 0.98 0.00 0.41 -2.18 0.00 0.00 179.01 178.15 2keo n GLY 105 N -0.04 0.18 2.77 1.92 0.00 -0.89 -4.96 105.19 104.18 2keo n GLY 105 Ca -0.02 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.39 -0.04 0.17 1.61 0.11 -0.64 -5.11 120.40 116.11 2keo s VAL 106 Ca 0.00 0.21 -0.27 0.00 -2.93 0.00 0.00 61.98 58.99 2keo s VAL 106 Cb 0.00 -0.10 -0.08 0.00 -1.53 0.00 0.00 36.38 34.67 2keo s VAL 106 CO 0.00 0.10 0.84 0.28 -3.33 0.00 0.00 175.10 172.99 2keo s THR 107 N 1.11 4.33 -0.41 5.04 -1.32 -1.26 -4.36 115.64 118.77 2keo s THR 107 Ca -0.09 1.84 -0.19 0.00 -1.21 0.00 0.00 61.69 62.04 2keo s THR 107 Cb -0.13 -4.21 0.02 0.00 -1.51 0.00 0.00 72.50 66.67 2keo s THR 107 CO -0.03 0.49 0.55 -0.63 -2.21 0.00 0.00 174.62 172.78 2keo s ILE 108 N -0.96 4.95 0.05 5.08 1.01 -1.26 -5.05 121.20 125.01 2keo s ILE 108 Ca 0.38 0.00 -0.31 0.00 0.00 0.00 0.00 60.65 60.73 2keo s ILE 108 Cb -0.24 -4.10 -0.07 0.00 0.01 0.00 0.00 42.46 38.07 2keo s ILE 108 CO 0.28 -0.46 1.42 -2.16 0.00 0.00 0.00 174.94 174.02 2keo s PRO 109 N 2.50 4.29 -0.40 2.79 0.04 -1.26 -4.92 135.00 138.04 2keo s PRO 109 Ca 0.18 2.03 -0.27 0.00 0.04 0.00 0.00 61.00 62.98 2keo s PRO 109 Cb -0.15 -3.47 -0.04 0.00 0.04 0.00 0.00 34.50 30.88 2keo s PRO 109 CO 0.16 -0.54 2.06 0.34 0.04 0.00 0.00 177.00 179.06 2keo s ASP 110 N 1.67 5.30 -0.28 6.66 2.15 -1.26 -4.90 116.67 126.01 2keo s ASP 110 Ca 0.65 1.19 -0.17 0.00 0.43 0.00 0.00 52.55 54.64 2keo s ASP 110 Cb -0.34 -2.52 0.11 0.00 -0.30 0.00 0.00 42.92 39.88 2keo s ASP 110 CO 0.28 -2.20 0.86 -0.22 -0.17 0.00 0.00 175.17 173.73 2keo s LEU 111 N 9.00 -0.68 0.00 -1.34 0.20 -1.26 -5.36 118.68 119.24 2keo s LEU 111 Ca 0.86 1.11 0.00 0.00 0.69 0.00 0.00 54.13 56.80 2keo s LEU 111 Cb -0.22 2.03 0.00 0.00 -0.43 0.00 0.00 46.19 47.58 2keo s LEU 111 CO 0.29 -0.18 0.00 0.61 -0.29 0.00 0.00 176.35 176.79