#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2keo n LYS 22 N 0.00 0.90 -2.62 5.31 4.76 -1.26 -4.91 118.16 120.34 2keo n LYS 22 Ca 0.00 0.07 -0.40 0.00 -2.87 0.00 0.00 58.31 55.11 2keo n LYS 22 Cb 0.00 -2.93 -0.05 0.00 -1.84 0.00 0.00 35.03 30.21 2keo n LYS 22 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2keo s VAL 23 N 10.77 3.85 -0.41 -0.18 0.11 -1.26 -5.00 120.40 128.27 2keo s VAL 23 Ca 1.07 1.81 -0.29 0.00 -2.93 0.00 0.00 61.98 61.65 2keo s VAL 23 Cb -0.48 -4.15 0.01 0.00 -1.53 0.00 0.00 36.38 30.23 2keo s VAL 23 CO 0.34 0.41 1.38 -0.89 -3.33 0.00 0.00 175.10 173.01 2keo s THR 24 N -1.00 3.94 -0.56 5.04 2.01 -1.26 -4.95 115.64 118.86 2keo s THR 24 Ca 0.44 0.96 -0.26 0.00 0.31 0.00 0.00 61.69 63.14 2keo s THR 24 Cb -0.28 -4.24 0.04 0.00 0.01 0.00 0.00 72.50 68.02 2keo s THR 24 CO 0.36 -0.77 1.06 -0.76 -0.69 0.00 0.00 174.62 173.82 2keo s LEU 25 N 5.30 3.79 -0.21 4.42 1.43 -1.26 -1.16 118.68 130.99 2keo s LEU 25 Ca 0.60 -0.12 -0.16 0.00 -1.03 0.00 0.00 54.13 53.42 2keo s LEU 25 Cb -0.13 -3.00 -0.04 0.00 0.03 0.00 0.00 46.19 43.05 2keo s LEU 25 CO 0.32 -1.34 0.40 -0.69 0.23 0.00 0.00 176.35 175.27 2keo s VAL 26 N 4.42 5.19 0.82 -1.59 1.01 -0.31 -4.84 120.40 125.10 2keo s VAL 26 Ca 0.36 0.71 -0.11 0.00 0.00 0.00 0.00 61.98 62.94 2keo s VAL 26 Cb -0.10 -3.73 0.08 0.00 0.00 0.00 0.00 36.38 32.63 2keo s VAL 26 CO 0.22 0.24 1.09 -0.13 0.00 0.00 0.00 175.10 176.52 2keo s ARG 27 N 1.40 1.93 0.13 2.72 0.52 -1.26 -1.22 118.95 123.17 2keo s ARG 27 Ca 0.19 0.74 -0.14 0.00 -0.52 0.00 0.00 55.73 56.01 2keo s ARG 27 Cb -0.15 -1.89 -0.01 0.00 0.52 0.00 0.00 34.95 33.42 2keo s ARG 27 CO 0.08 -1.76 1.56 0.97 0.02 0.00 0.00 175.30 176.17 2keo h ILE 28 N -1.19 1.27 0.00 1.52 2.10 -1.97 -2.69 117.51 116.54 2keo h ILE 28 Ca -0.47 -1.12 -0.08 0.00 1.08 0.00 0.00 64.86 64.26 2keo h ILE 28 Cb 1.27 1.14 -0.01 0.00 -1.09 0.00 0.00 36.82 38.12 2keo h ILE 28 CO 0.57 0.38 -0.39 0.00 -1.08 0.00 0.00 178.15 177.63 2keo h ALA 29 N 0.87 1.29 -0.88 0.18 0.00 -1.95 -3.19 119.26 115.59 2keo h ALA 29 Ca 0.11 -0.36 0.02 0.00 0.00 0.00 0.00 54.91 54.69 2keo h ALA 29 Cb 0.57 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.24 2keo h ALA 29 CO 0.03 0.49 0.58 0.22 0.00 0.00 0.00 179.25 180.58 2keo h ASP 30 N 0.00 0.98 -0.27 0.00 1.82 -1.85 -0.80 116.42 116.29 2keo h ASP 30 Ca -0.00 -0.02 0.03 0.00 -0.39 0.00 0.00 57.03 56.65 2keo h ASP 30 Cb 0.72 -0.23 -0.03 0.00 0.68 0.00 0.00 39.33 40.47 2keo h ASP 30 CO 0.05 0.69 0.08 -0.07 -1.61 0.00 0.00 179.24 178.38 2keo h LEU 31 N 1.14 0.07 -0.38 2.28 4.07 -1.54 -2.19 115.31 118.76 2keo h LEU 31 Ca 0.34 0.03 -0.10 0.00 0.08 0.00 0.00 57.88 58.24 2keo h LEU 31 Cb -0.04 0.03 -0.01 0.00 1.08 0.00 0.00 40.66 41.71 2keo h LEU 31 CO -0.09 0.08 -0.14 -0.33 -1.08 0.00 0.00 178.44 176.88 2keo h GLU 32 N 0.20 0.77 -0.25 1.13 5.08 -1.32 -1.20 114.58 118.98 2keo h GLU 32 Ca 0.12 -0.32 -0.19 0.00 -1.00 0.00 0.00 59.36 57.98 2keo h GLU 32 Cb 0.10 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.32 2keo h GLU 32 CO -0.14 0.93 -0.58 -0.91 -1.00 0.00 0.00 179.01 177.31 2keo h ASN 33 N 0.57 0.95 0.03 1.42 2.35 -1.29 -1.51 115.58 118.09 2keo h ASN 33 Ca 0.09 -0.55 -0.08 0.00 -0.55 0.00 0.00 56.30 55.20 2keo h ASN 33 Cb 0.68 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.76 2keo h ASN 33 CO 0.05 1.33 -0.25 -0.74 -1.65 0.00 0.00 177.43 176.17 2keo h HIS 34 N 0.61 0.40 -0.41 1.19 2.76 -1.36 -1.80 115.15 116.53 2keo h HIS 34 Ca -0.00 -0.08 -0.04 0.00 -2.20 0.00 0.00 60.37 58.05 2keo h HIS 34 Cb 1.19 -0.10 -0.02 0.00 1.55 0.00 0.00 27.41 30.04 2keo h HIS 34 CO 0.08 0.58 0.10 -0.97 -1.30 0.00 0.00 177.93 176.43 2keo h ASN 35 N 0.32 0.62 0.08 3.26 -1.24 -0.71 -0.19 115.58 117.73 2keo h ASN 35 Ca 0.05 -0.23 -0.05 0.00 0.71 0.00 0.00 56.30 56.78 2keo h ASN 35 Cb 0.61 -0.16 -0.01 0.00 0.73 0.00 0.00 38.32 39.49 2keo h ASN 35 CO 0.04 0.69 -0.17 -1.13 -1.29 0.00 0.00 177.43 175.58 2keo h ASN 36 N 0.53 0.17 -0.08 1.15 -1.24 -0.98 -2.19 115.58 112.94 2keo h ASN 36 Ca 0.13 -0.04 -0.09 0.00 0.71 0.00 0.00 56.30 57.01 2keo h ASN 36 Cb 0.31 -0.04 -0.01 0.00 0.73 0.00 0.00 38.32 39.30 2keo h ASN 36 CO 0.00 0.36 -0.22 -0.78 -1.29 0.00 0.00 177.43 175.50 2keo h ASP 37 N 0.17 0.49 0.00 1.15 3.58 -1.14 -3.47 116.42 117.20 2keo h ASP 37 Ca 0.03 -0.16 0.00 0.00 0.42 0.00 0.00 57.03 57.32 2keo h ASP 37 Cb 0.40 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.32 2keo h ASP 37 CO 0.03 0.72 0.00 0.61 -2.88 0.00 0.00 179.24 177.72 2keo n GLY 38 N -0.43 1.18 2.67 -0.78 0.00 -0.82 -5.11 105.19 101.90 2keo n GLY 38 Ca -0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.18 0.88 -0.48 -0.02 0.00 -0.12 -4.99 107.32 101.40 2keo s GLY 39 Ca 0.00 -1.45 -0.28 0.00 0.00 0.00 0.00 44.72 42.99 2keo s GLY 39 CO 0.00 1.75 1.44 -0.12 0.00 0.00 0.00 173.10 176.17 2keo s PHE 40 N 1.78 2.30 -0.17 1.90 2.19 -1.26 -2.17 117.98 122.54 2keo s PHE 40 Ca 0.09 0.59 -0.07 0.00 0.33 0.00 0.00 56.93 57.87 2keo s PHE 40 Cb -0.17 -4.33 -0.04 0.00 -1.31 0.00 0.00 43.02 37.17 2keo s PHE 40 CO -0.28 -2.02 0.07 -1.58 1.83 0.00 0.00 175.22 173.24 2keo s TRP 41 N 5.90 3.29 0.04 10.12 0.52 -1.26 -0.74 118.94 136.80 2keo s TRP 41 Ca 0.58 0.15 0.06 0.00 0.02 0.00 0.00 56.10 56.92 2keo s TRP 41 Cb -0.13 -2.05 -0.02 0.00 -1.15 0.00 0.00 33.47 30.12 2keo s TRP 41 CO 0.29 0.25 -0.17 -0.08 0.02 0.00 0.00 176.95 177.26 2keo s THR 42 N 0.13 1.33 -0.39 2.01 -1.32 -0.61 -4.80 115.64 112.00 2keo s THR 42 Ca 0.05 -1.04 -0.17 0.00 -1.21 0.00 0.00 61.69 59.33 2keo s THR 42 Cb -0.12 -1.18 0.01 0.00 -1.51 0.00 0.00 72.50 69.70 2keo s THR 42 CO 0.00 0.12 0.43 0.54 -2.21 0.00 0.00 174.62 173.50 2keo s VAL 43 N -0.78 5.09 -0.18 5.08 0.11 -1.26 -1.35 120.40 127.12 2keo s VAL 43 Ca 0.04 -0.12 0.01 0.00 -2.93 0.00 0.00 61.98 58.99 2keo s VAL 43 Cb -0.08 -3.97 0.03 0.00 -1.53 0.00 0.00 36.38 30.83 2keo s VAL 43 CO 0.01 -0.30 -0.16 -0.63 -3.33 0.00 0.00 175.10 170.69 2keo s ILE 44 N 2.16 1.83 -1.46 7.04 1.01 -0.07 -4.82 121.20 126.89 2keo s ILE 44 Ca 0.13 -0.88 -0.02 0.00 0.00 0.00 0.00 60.65 59.88 2keo s ILE 44 Cb -0.17 -1.72 0.00 0.00 0.01 0.00 0.00 42.46 40.58 2keo s ILE 44 CO 0.13 0.42 0.29 -0.67 0.00 0.00 0.00 174.94 175.12 2keo n ASP 45 N 4.67 -5.47 0.00 3.58 2.03 -1.26 -1.91 116.55 118.20 2keo n ASP 45 Ca -0.18 -0.15 0.00 0.00 0.52 0.00 0.00 54.79 54.98 2keo n ASP 45 Cb 0.49 -4.41 0.00 0.00 -0.72 0.00 0.00 41.12 36.48 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 -1.25 0.68 3.55 0.27 0.00 -1.26 -5.05 105.19 102.13 2keo n GLY 46 Ca -0.15 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.20 1.90 -0.18 1.61 -0.14 -0.80 -1.65 119.74 120.28 2keo s LYS 47 Ca 0.00 -1.73 -0.02 0.00 -1.36 0.00 0.00 55.97 52.87 2keo s LYS 47 Cb 0.00 -1.87 -0.01 0.00 -1.68 0.00 0.00 37.83 34.28 2keo s LYS 47 CO 0.00 0.27 -0.09 0.08 -0.76 0.00 0.00 175.35 174.84 2keo s VAL 48 N -2.49 3.12 0.22 3.17 1.01 -0.55 -0.89 120.40 123.99 2keo s VAL 48 Ca 0.32 -0.60 0.11 0.00 0.00 0.00 0.00 61.98 61.80 2keo s VAL 48 Cb -0.03 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.94 2keo s VAL 48 CO 0.17 0.48 -0.17 -0.31 0.00 0.00 0.00 175.10 175.27 2keo s TYR 49 N 0.96 2.43 0.03 5.22 1.51 -0.45 -1.65 117.35 125.39 2keo s TYR 49 Ca -0.01 -0.30 -0.03 0.00 -1.01 0.00 0.00 57.07 55.71 2keo s TYR 49 Cb -0.15 -1.15 -0.04 0.00 -0.11 0.00 0.00 41.96 40.51 2keo s TYR 49 CO -0.01 0.57 0.24 0.34 -1.11 0.00 0.00 175.55 175.58 2keo s ASP 50 N -3.02 6.42 -0.12 2.29 -1.08 -1.05 -1.58 116.67 118.53 2keo s ASP 50 Ca 0.25 0.41 0.06 0.00 -0.52 0.00 0.00 52.55 52.76 2keo s ASP 50 Cb -0.07 -2.03 -0.12 0.00 -1.46 0.00 0.00 42.92 39.24 2keo s ASP 50 CO 0.14 0.21 -0.02 -0.38 0.52 0.00 0.00 175.17 175.64 2keo n ILE 51 N 0.73 0.75 0.14 4.11 2.08 0.08 -3.57 119.36 123.68 2keo n ILE 51 Ca -0.09 -0.40 -0.01 0.00 0.56 0.00 0.00 62.75 62.82 2keo n ILE 51 Cb 0.52 -0.81 0.17 0.00 -0.75 0.00 0.00 39.64 38.77 2keo n ILE 51 CO 0.00 0.00 0.00 0.07 0.56 0.00 0.00 176.55 177.18 2keo h LYS 52 N 0.00 0.00 -0.29 0.38 5.09 -1.95 -1.07 116.57 118.72 2keo h LYS 52 Ca -0.30 0.00 -0.18 0.00 0.09 0.00 0.00 60.65 60.27 2keo h LYS 52 Cb 1.59 0.00 -0.00 0.00 0.10 0.00 0.00 32.23 33.92 2keo h LYS 52 CO -0.01 0.61 -0.51 -0.44 -2.09 0.00 0.00 179.45 177.01 2keo h ASP 53 N 0.00 0.91 0.03 7.07 3.32 -1.91 -2.24 116.42 123.60 2keo h ASP 53 Ca -0.01 -0.47 0.03 0.00 0.02 0.00 0.00 57.03 56.60 2keo h ASP 53 Cb 1.12 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 40.37 2keo h ASP 53 CO 0.08 1.25 -0.27 0.15 -1.72 0.00 0.00 179.24 178.73 2keo h PHE 54 N 0.65 -0.74 0.00 4.55 3.04 -1.56 -3.00 116.94 119.87 2keo h PHE 54 Ca 0.02 0.02 -0.06 0.00 3.98 0.00 0.00 57.97 61.93 2keo h PHE 54 Cb 1.10 0.32 -0.01 0.00 2.56 0.00 0.00 35.95 39.93 2keo h PHE 54 CO 0.06 -0.37 -0.29 1.96 -2.02 0.00 0.00 178.31 177.65 2keo h GLN 55 N -0.44 0.00 -0.30 1.11 4.20 -1.17 0.36 115.11 118.88 2keo h GLN 55 Ca 0.05 0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.79 2keo h GLN 55 Cb 0.51 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.26 2keo h GLN 55 CO -0.22 0.29 0.13 1.15 -0.67 0.00 0.00 178.83 179.52 2keo h THR 56 N 0.00 0.97 0.00 -0.54 2.02 -1.31 -2.29 112.91 111.75 2keo h THR 56 Ca -0.00 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.08 2keo h THR 56 Cb 0.57 0.66 0.00 0.00 -1.74 0.00 0.00 68.15 67.64 2keo h THR 56 CO 0.04 0.05 0.00 1.56 0.37 0.00 0.00 175.52 177.54 2keo h GLN 57 N 0.28 0.00 0.00 6.66 1.08 -1.18 -3.08 115.11 118.87 2keo h GLN 57 Ca 0.13 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.29 2keo h GLN 57 Cb 0.06 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.49 2keo h GLN 57 CO -0.10 0.00 -0.18 1.03 -0.95 0.00 0.00 178.83 178.62 2keo h SER 58 N 0.00 0.00 -0.11 1.46 0.87 -0.54 -2.51 113.55 112.72 2keo h SER 58 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2keo h SER 58 Cb 0.79 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.75 2keo h SER 58 CO 0.00 0.18 0.00 0.18 -0.53 0.00 0.00 176.83 176.66 2keo n LEU 59 N -3.22 0.72 -4.64 2.23 4.77 -0.90 -4.39 117.00 111.57 2keo n LEU 59 Ca 0.02 -0.34 -0.35 0.00 -0.03 0.00 0.00 56.01 55.32 2keo n LEU 59 Cb 0.51 -0.07 -0.10 0.00 -2.33 0.00 0.00 43.42 41.42 2keo n LEU 59 CO 0.34 0.17 -0.29 -0.89 -1.33 0.00 0.00 177.39 175.39 2keo s THR 60 N -1.85 4.44 0.08 -5.08 2.01 -0.95 -5.04 115.64 109.24 2keo s THR 60 Ca 0.18 -0.18 -0.14 0.00 0.31 0.00 0.00 61.69 61.86 2keo s THR 60 Cb 0.09 -2.93 -0.21 0.00 0.01 0.00 0.00 72.50 69.45 2keo s THR 60 CO 0.13 0.53 1.21 1.05 -0.69 0.00 0.00 174.62 176.86 2keo h GLU 61 N 6.01 0.71 -0.01 4.92 4.11 -1.87 -3.22 114.58 125.23 2keo h GLU 61 Ca -0.42 -0.71 0.00 0.00 0.07 0.00 0.00 59.36 58.30 2keo h GLU 61 Cb 1.19 0.19 0.00 0.00 0.50 0.00 0.00 28.75 30.63 2keo h GLU 61 CO 0.62 1.30 0.00 0.09 0.07 0.00 0.00 179.01 181.08 2keo n ASN 62 N -3.90 0.33 -4.83 3.06 3.02 -1.26 -4.69 115.26 106.99 2keo n ASN 62 Ca -0.10 -1.18 -0.33 0.00 -0.03 0.00 0.00 54.58 52.95 2keo n ASN 62 Cb 0.83 -0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.94 2keo n ASN 62 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2keo s SER 63 N -1.92 6.83 0.51 6.41 0.01 -1.21 -4.97 113.70 119.36 2keo s SER 63 Ca 0.43 1.57 0.23 0.00 1.31 0.00 0.00 55.95 59.48 2keo s SER 63 Cb 0.20 -2.49 1.33 0.00 0.21 0.00 0.00 66.02 65.27 2keo s SER 63 CO 0.34 -0.38 2.00 0.16 0.41 0.00 0.00 173.24 175.77 2keo h ILE 64 N 1.69 0.78 0.00 1.44 3.07 -1.88 -2.69 117.51 119.92 2keo h ILE 64 Ca -0.48 -0.02 0.00 0.00 1.55 0.00 0.00 64.86 65.91 2keo h ILE 64 Cb 1.18 0.71 0.00 0.00 -0.27 0.00 0.00 36.82 38.44 2keo h ILE 64 CO 0.62 0.01 0.00 0.18 -1.05 0.00 0.00 178.15 177.91 2keo n LEU 65 N -4.41 0.00 -0.23 0.16 4.77 -1.26 -2.62 117.00 113.41 2keo n LEU 65 Ca 0.09 0.05 -0.08 0.00 -0.03 0.00 0.00 56.01 56.04 2keo n LEU 65 Cb 0.53 -0.05 0.03 0.00 -2.33 0.00 0.00 43.42 41.61 2keo n LEU 65 CO 0.36 -0.01 0.93 0.00 -1.33 0.00 0.00 177.39 177.34 2keo h ALA 66 N 3.32 0.83 0.00 -1.18 0.00 -1.63 -2.59 119.26 118.02 2keo h ALA 66 Ca 0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 2keo h ALA 66 Cb 0.03 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 2keo h ALA 66 CO 0.00 0.54 -0.07 -0.56 0.00 0.00 0.00 179.25 179.16 2keo h GLN 67 N 0.93 0.00 -0.14 0.00 3.07 -1.75 -3.09 115.11 114.14 2keo h GLN 67 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.94 2keo h GLN 67 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.91 2keo h GLN 67 CO 0.00 0.07 0.00 1.19 0.09 0.00 0.00 178.83 180.18 2keo n PHE 68 N -3.13 0.16 -2.03 0.06 3.72 -1.13 -4.88 117.46 110.23 2keo n PHE 68 Ca 0.03 -0.08 -0.43 0.00 -0.05 0.00 0.00 57.45 56.91 2keo n PHE 68 Cb 0.48 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.99 2keo n PHE 68 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2keo s ALA 69 N -1.84 3.03 0.00 4.37 0.00 -0.99 -2.01 121.76 124.33 2keo s ALA 69 Ca 0.34 0.36 0.00 0.00 0.00 0.00 0.00 51.96 52.67 2keo s ALA 69 Cb 0.20 -3.95 0.00 0.00 0.00 0.00 0.00 23.12 19.36 2keo s ALA 69 CO 0.30 -2.36 0.00 0.41 0.00 0.00 0.00 175.76 174.10 2keo n GLY 70 N 5.15 1.33 3.83 0.00 0.00 -1.26 -5.09 105.19 109.15 2keo n GLY 70 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.02 4.12 0.14 1.61 2.56 -0.85 -5.01 118.70 121.25 2keo s GLU 71 Ca 0.00 1.06 -0.32 0.00 0.00 0.00 0.00 54.97 55.72 2keo s GLU 71 Cb 0.00 -2.16 -0.11 0.00 2.00 0.00 0.00 34.13 33.85 2keo s GLU 71 CO 0.00 -0.12 1.79 -3.47 -0.56 0.00 0.00 175.26 172.90 2keo n ASP 72 N -0.99 3.96 -0.17 -1.70 2.03 -1.26 -4.88 116.55 113.54 2keo n ASP 72 Ca 0.07 1.01 0.13 0.00 0.52 0.00 0.00 54.79 56.52 2keo n ASP 72 Cb 0.54 -1.54 0.47 0.00 -0.72 0.00 0.00 41.12 39.87 2keo n ASP 72 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2keo h PRO 73 N 7.90 0.48 -0.00 -0.67 0.11 -1.95 -0.49 132.00 137.38 2keo h PRO 73 Ca -0.45 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 2keo h PRO 73 Cb 1.22 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2keo h PRO 73 CO 0.95 0.32 -0.03 0.28 -0.21 0.00 0.00 178.00 179.31 2keo h VAL 74 N 0.50 1.54 0.00 3.15 2.07 -1.97 -2.64 116.25 118.89 2keo h VAL 74 Ca 0.36 -1.61 -0.08 0.00 0.82 0.00 0.00 66.70 66.19 2keo h VAL 74 Cb 0.70 2.61 -0.01 0.00 -1.52 0.00 0.00 31.29 33.07 2keo h VAL 74 CO -0.12 0.42 -0.36 1.62 0.02 0.00 0.00 177.57 179.15 2keo h VAL 75 N -0.64 1.12 -0.24 2.57 3.04 -1.85 -0.50 116.25 119.74 2keo h VAL 75 Ca -0.00 -1.30 -0.15 0.00 -1.01 0.00 0.00 66.70 64.24 2keo h VAL 75 Cb 0.71 1.73 -0.01 0.00 -2.01 0.00 0.00 31.29 31.71 2keo h VAL 75 CO 0.01 0.36 -0.45 0.00 -1.01 0.00 0.00 177.57 176.47 2keo h ALA 76 N 1.64 0.76 -0.21 3.17 0.00 -1.17 -1.57 119.26 121.88 2keo h ALA 76 Ca -0.00 -0.46 -0.18 0.00 0.00 0.00 0.00 54.91 54.26 2keo h ALA 76 Cb 0.70 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 2keo h ALA 76 CO 0.05 0.66 -0.60 1.25 0.00 0.00 0.00 179.25 180.61 2keo h LEU 77 N 0.50 0.78 -0.05 0.00 6.46 -1.00 -1.99 115.31 120.01 2keo h LEU 77 Ca 0.03 -0.44 -0.00 0.00 -0.12 0.00 0.00 57.88 57.34 2keo h LEU 77 Cb 0.97 -0.23 -0.00 0.00 -0.73 0.00 0.00 40.66 40.67 2keo h LEU 77 CO 0.09 1.20 0.01 -0.33 -0.62 0.00 0.00 178.44 178.80 2keo h GLU 78 N 0.52 0.08 0.00 1.25 5.08 -0.98 -1.06 114.58 119.46 2keo h GLU 78 Ca -0.00 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.27 2keo h GLU 78 Cb 1.19 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 2keo h GLU 78 CO 0.12 0.27 -0.34 0.00 -1.00 0.00 0.00 179.01 178.07 2keo h ALA 79 N 0.81 1.40 -0.17 3.43 0.00 -1.37 -2.80 119.26 120.56 2keo h ALA 79 Ca 0.02 -0.31 -0.14 0.00 0.00 0.00 0.00 54.91 54.48 2keo h ALA 79 Cb 0.23 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2keo h ALA 79 CO -0.00 0.42 -0.50 0.00 0.00 0.00 0.00 179.25 179.17 2keo h ALA 80 N 1.66 0.82 -0.44 0.00 0.00 -1.08 -2.07 119.26 118.15 2keo h ALA 80 Ca -0.00 -0.49 -0.04 0.00 0.00 0.00 0.00 54.91 54.38 2keo h ALA 80 Cb 0.61 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2keo h ALA 80 CO 0.04 0.67 0.10 -0.07 0.00 0.00 0.00 179.25 179.99 2keo h LEU 81 N 0.36 0.61 -0.13 0.00 3.38 -0.93 -1.48 115.31 117.13 2keo h LEU 81 Ca 0.02 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 2keo h LEU 81 Cb 1.01 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.60 2keo h LEU 81 CO 0.09 0.62 -0.02 -0.61 0.09 0.00 0.00 178.44 178.61 2keo h GLN 82 N 0.64 0.24 -5.98 1.13 4.15 -1.44 -3.44 115.11 110.42 2keo h GLN 82 Ca 0.15 -0.09 -0.59 0.00 0.77 0.00 0.00 58.65 58.89 2keo h GLN 82 Cb 0.26 -0.02 -0.07 0.00 0.21 0.00 0.00 27.48 27.86 2keo h GLN 82 CO -0.00 0.52 0.68 0.12 -1.93 0.00 0.00 178.83 178.22 2keo s PHE 83 N -4.81 3.32 0.43 3.99 5.36 -0.79 -4.95 117.98 120.54 2keo s PHE 83 Ca -0.14 1.33 0.16 0.00 -0.96 0.00 0.00 56.93 57.32 2keo s PHE 83 Cb 0.05 -3.21 1.07 0.00 -0.34 0.00 0.00 43.02 40.59 2keo s PHE 83 CO 0.71 -0.46 1.91 1.05 -1.46 0.00 0.00 175.22 176.97 2keo h GLU 84 N 7.57 0.39 0.09 10.12 4.11 -1.85 -1.50 114.58 133.51 2keo h GLU 84 Ca -0.21 -0.02 -0.26 0.00 0.07 0.00 0.00 59.36 58.94 2keo h GLU 84 Cb 1.07 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.23 2keo h GLU 84 CO 0.94 0.26 -1.17 -0.44 0.07 0.00 0.00 179.01 178.67 2keo h ASP 85 N 0.40 0.32 0.45 3.06 3.32 -1.92 -3.36 116.42 118.70 2keo h ASP 85 Ca 0.38 -0.34 0.00 0.00 0.02 0.00 0.00 57.03 57.09 2keo h ASP 85 Cb 0.90 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.35 2keo h ASP 85 CO -0.12 1.26 -0.90 0.35 -1.72 0.00 0.00 179.24 178.11 2keo n THR 86 N -3.49 0.15 0.26 0.35 -2.24 -0.77 -3.86 114.28 104.67 2keo n THR 86 Ca -0.06 -0.19 0.15 0.00 -2.27 0.00 0.00 64.05 61.68 2keo n THR 86 Cb 1.00 0.24 0.50 0.00 -2.10 0.00 0.00 70.33 69.97 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 0.00 -0.63 -0.78 0.11 -0.29 -3.27 114.38 109.52 2keo h ARG 87 Ca 0.00 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 60.03 2keo h ARG 87 Cb 0.68 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.73 2keo h ARG 87 CO 0.00 0.00 0.18 0.93 0.10 0.00 0.00 179.97 181.18 2keo h GLU 88 N 0.00 0.96 0.01 0.08 4.39 -1.75 -1.10 114.58 117.18 2keo h GLU 88 Ca -0.00 -0.20 -0.20 0.00 0.34 0.00 0.00 59.36 59.31 2keo h GLU 88 Cb 0.69 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 29.18 2keo h GLU 88 CO 0.00 0.84 -0.92 1.03 -1.16 0.00 0.00 179.01 178.80 2keo h SER 89 N 0.93 0.13 0.95 1.42 0.87 -1.81 -3.20 113.55 112.83 2keo h SER 89 Ca 0.20 -0.11 -0.02 0.00 -1.23 0.00 0.00 61.79 60.63 2keo h SER 89 Cb 0.29 -0.04 -0.00 0.00 -0.44 0.00 0.00 62.40 62.21 2keo h SER 89 CO -0.01 0.97 -0.10 0.24 -0.53 0.00 0.00 176.83 177.41 2keo h MET 90 N 0.04 0.00 -0.54 2.24 2.86 -1.49 -1.79 114.93 116.26 2keo h MET 90 Ca -0.03 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.60 2keo h MET 90 Cb 1.59 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 33.22 2keo h MET 90 CO 0.13 0.10 0.31 1.25 1.06 0.00 0.00 176.91 179.76 2keo h HIS 91 N 0.00 0.71 0.12 -0.22 6.17 -1.22 -0.52 115.15 120.19 2keo h HIS 91 Ca -0.00 0.00 -0.29 0.00 0.71 0.00 0.00 60.37 60.79 2keo h HIS 91 Cb 0.60 -0.23 0.02 0.00 2.52 0.00 0.00 27.41 30.32 2keo h HIS 91 CO 0.00 0.48 -1.24 0.00 0.71 0.00 0.00 177.93 177.88 2keo h ALA 92 N 1.61 0.04 0.00 5.26 0.00 -1.48 -3.28 119.26 121.40 2keo h ALA 92 Ca 0.19 -0.79 0.00 0.00 0.00 0.00 0.00 54.91 54.31 2keo h ALA 92 Cb -0.01 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2keo h ALA 92 CO -0.04 0.75 0.00 1.19 0.00 0.00 0.00 179.25 181.16 2keo n PHE 93 N -3.73 0.79 -2.02 0.00 3.72 -0.96 -4.47 117.46 110.79 2keo n PHE 93 Ca -0.12 0.29 -0.26 0.00 -0.05 0.00 0.00 57.45 57.30 2keo n PHE 93 Cb 0.99 -0.97 -0.06 0.00 -0.94 0.00 0.00 39.48 38.50 2keo n PHE 93 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2keo h VAL 95 N 6.55 0.00 -1.89 0.00 -1.51 -1.53 -3.47 116.25 114.39 2keo h VAL 95 Ca 0.16 -0.43 0.15 0.00 -1.23 0.00 0.00 66.70 65.35 2keo h VAL 95 Cb 0.96 1.31 -0.03 0.00 -2.13 0.00 0.00 31.29 31.41 2keo h VAL 95 CO 1.20 0.00 0.43 0.61 -1.23 0.00 0.00 177.57 178.58 2keo n GLY 96 N 0.44 0.62 3.28 5.19 0.00 -0.97 -4.81 105.19 108.94 2keo n GLY 96 Ca 0.03 -1.00 -0.32 0.00 0.00 0.00 0.00 46.02 44.74 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 -2.02 2.69 0.33 1.61 0.74 -0.31 -1.48 119.66 121.22 2keo s GLN 97 Ca 0.15 -0.87 -0.27 0.00 0.05 0.00 0.00 55.36 54.42 2keo s GLN 97 Cb -0.01 -2.24 -0.09 0.00 1.10 0.00 0.00 33.01 31.77 2keo s GLN 97 CO 0.01 0.36 1.03 -0.47 -0.55 0.00 0.00 175.29 175.67 2keo s TYR 98 N -0.09 3.53 -0.03 1.67 5.04 -0.66 -1.17 117.35 125.65 2keo s TYR 98 Ca -0.05 1.72 -0.01 0.00 -2.44 0.00 0.00 57.07 56.29 2keo s TYR 98 Cb -0.14 -3.12 0.03 0.00 0.35 0.00 0.00 41.96 39.08 2keo s TYR 98 CO 0.04 -0.32 0.06 -1.17 -1.34 0.00 0.00 175.55 172.83 2keo s LEU 99 N -1.97 0.89 0.04 6.97 2.96 -0.36 -4.79 118.68 122.43 2keo s LEU 99 Ca 0.50 0.10 -0.16 0.00 -0.22 0.00 0.00 54.13 54.36 2keo s LEU 99 Cb -0.25 0.02 -0.06 0.00 0.50 0.00 0.00 46.19 46.40 2keo s LEU 99 CO 0.32 -0.15 0.47 -1.61 -1.32 0.00 0.00 176.35 174.06 2keo s GLU 100 N 1.22 3.99 0.51 1.98 2.02 -1.26 -3.90 118.70 123.27 2keo s GLU 100 Ca -0.08 0.50 0.24 0.00 0.02 0.00 0.00 54.97 55.65 2keo s GLU 100 Cb -0.13 -3.18 1.36 0.00 0.10 0.00 0.00 34.13 32.29 2keo s GLU 100 CO -0.04 0.65 2.07 -1.00 0.02 0.00 0.00 175.26 176.96 2keo h PRO 101 N 4.47 0.00 0.00 0.39 0.13 -1.98 -2.20 132.00 132.81 2keo h PRO 101 Ca -0.51 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.53 2keo h PRO 101 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 2keo h PRO 101 CO 0.63 0.12 -0.43 0.22 -0.23 0.00 0.00 178.00 178.31 2keo h ASP 102 N 0.00 0.00 0.49 1.44 3.58 -1.96 -3.23 116.42 116.73 2keo h ASP 102 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2keo h ASP 102 Cb 0.29 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.34 2keo h ASP 102 CO 0.02 0.43 0.00 1.67 -2.88 0.00 0.00 179.24 178.48 2keo n GLN 103 N -3.24 0.23 0.28 0.28 -0.06 -0.83 -2.27 117.38 111.78 2keo n GLN 103 Ca 0.02 0.10 0.15 0.00 -2.00 0.00 0.00 57.00 55.26 2keo n GLN 103 Cb 0.68 -1.50 0.83 0.00 -4.06 0.00 0.00 30.24 26.20 2keo n GLN 103 CO 0.00 0.00 0.00 0.93 -0.20 0.00 0.00 177.06 177.79 2keo h GLU 104 N 0.00 0.00 0.00 3.69 4.39 -1.59 -3.38 114.58 117.70 2keo h GLU 104 Ca 0.00 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.53 2keo h GLU 104 Cb 0.25 0.00 -0.14 0.00 -0.10 0.00 0.00 28.75 28.76 2keo h GLU 104 CO 0.00 0.07 -0.29 0.41 -1.16 0.00 0.00 179.01 178.04 2keo n GLY 105 N -0.81 -0.50 3.79 -3.84 0.00 -0.96 -5.15 105.19 97.71 2keo n GLY 105 Ca -0.02 0.43 -0.39 0.00 0.00 0.00 0.00 46.02 46.05 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 0.37 4.45 -0.19 1.61 0.11 -1.08 -5.05 120.40 120.62 2keo s VAL 106 Ca 0.27 1.56 -0.00 0.00 -2.93 0.00 0.00 61.98 60.88 2keo s VAL 106 Cb 0.25 -4.05 0.02 0.00 -1.53 0.00 0.00 36.38 31.06 2keo s VAL 106 CO -0.16 0.47 -0.16 0.28 -3.33 0.00 0.00 175.10 172.20 2keo s THR 107 N -1.22 2.38 -0.35 5.04 -1.32 -1.26 -5.09 115.64 113.82 2keo s THR 107 Ca 0.36 -0.87 0.03 0.00 -1.21 0.00 0.00 61.69 60.00 2keo s THR 107 Cb -0.21 -2.04 0.10 0.00 -1.51 0.00 0.00 72.50 68.83 2keo s THR 107 CO 0.24 0.48 0.07 -0.63 -2.21 0.00 0.00 174.62 172.57 2keo s ILE 108 N 1.33 2.12 0.58 5.08 1.01 -1.26 -5.13 121.20 124.94 2keo s ILE 108 Ca 0.04 -2.29 -0.20 0.00 0.00 0.00 0.00 60.65 58.20 2keo s ILE 108 Cb -0.14 -2.57 -0.03 0.00 0.01 0.00 0.00 42.46 39.73 2keo s ILE 108 CO -0.10 -0.62 1.34 -2.65 0.00 0.00 0.00 174.94 172.91 2keo n PRO 109 N 4.26 1.50 -2.26 2.79 -0.02 -1.26 -4.96 135.00 135.06 2keo n PRO 109 Ca 0.03 0.56 -0.41 0.00 -2.02 0.00 0.00 63.50 61.67 2keo n PRO 109 Cb 0.41 -2.57 -0.03 0.00 -0.02 0.00 0.00 33.50 31.30 2keo n PRO 109 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2keo s ASP 110 N -1.07 5.89 -0.21 2.55 2.15 -1.26 -4.82 116.67 119.89 2keo s ASP 110 Ca 0.76 0.41 0.13 0.00 0.43 0.00 0.00 52.55 54.27 2keo s ASP 110 Cb -0.40 -2.54 0.44 0.00 -0.30 0.00 0.00 42.92 40.12 2keo s ASP 110 CO 0.46 -1.88 1.33 0.18 -0.17 0.00 0.00 175.17 175.09 2keo n LEU 111 N 10.44 3.33 0.00 -1.34 4.77 -1.26 -5.38 117.00 127.56 2keo n LEU 111 Ca 0.15 -3.52 0.00 0.00 -0.03 0.00 0.00 56.01 52.61 2keo n LEU 111 Cb 0.50 -0.55 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 2keo n LEU 111 CO 0.71 1.07 0.08 0.61 -1.33 0.00 0.00 177.39 178.53