#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p7p n ILE 2 N 0.00 0.00 0.09 1.12 2.08 -1.26 -4.80 119.36 116.59 2p7p n ILE 2 Ca 0.00 0.00 -0.15 0.00 0.56 0.00 0.00 62.75 63.16 2p7p n ILE 2 Cb 0.00 -0.26 -0.14 0.00 -0.75 0.00 0.00 39.64 38.49 2p7p n ILE 2 CO 0.00 0.00 0.00 0.28 0.56 0.00 0.00 176.55 177.39 2p7p h SER 3 N 3.56 0.35 0.00 4.38 0.02 -2.11 -3.50 113.55 116.26 2p7p h SER 3 Ca -0.16 -0.39 0.00 0.00 -0.84 0.00 0.00 61.79 60.40 2p7p h SER 3 Cb 0.74 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.16 2p7p h SER 3 CO 0.54 1.31 0.00 0.61 -1.14 0.00 0.00 176.83 178.15 2p7p n GLY 4 N 1.52 -0.51 3.72 -3.77 0.00 -1.26 -5.12 105.19 99.77 2p7p n GLY 4 Ca -0.08 -0.94 -0.41 0.00 0.00 0.00 0.00 46.02 44.59 2p7p n GLY 4 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2p7p s LEU 5 N 0.00 4.44 -0.16 0.99 2.96 -1.26 -4.97 118.68 120.69 2p7p s LEU 5 Ca 0.00 1.72 -0.12 0.00 -0.22 0.00 0.00 54.13 55.51 2p7p s LEU 5 Cb 0.00 -3.56 -0.06 0.00 0.50 0.00 0.00 46.19 43.07 2p7p s LEU 5 CO 0.00 -0.14 -0.14 -0.24 -1.32 0.00 0.00 176.35 174.51 2p7p n SER 6 N 3.27 1.83 -3.53 3.68 2.88 -1.26 -5.00 113.62 115.48 2p7p n SER 6 Ca 0.04 0.58 -0.04 0.00 -1.33 0.00 0.00 58.87 58.12 2p7p n SER 6 Cb 0.50 -0.87 0.00 0.00 -0.75 0.00 0.00 64.21 63.09 2p7p n SER 6 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 2p7p s HIS 7 N -2.32 -0.03 -0.06 0.66 -3.43 -1.26 -4.43 115.29 104.42 2p7p s HIS 7 Ca -0.18 -0.35 0.02 0.00 -0.80 0.00 0.00 55.06 53.75 2p7p s HIS 7 Cb 0.03 0.68 0.02 0.00 -1.43 0.00 0.00 32.58 31.88 2p7p s HIS 7 CO 0.29 -0.94 -0.09 0.42 -2.00 0.00 0.00 174.74 172.42 2p7p s ILE 8 N -2.79 0.91 -0.14 -5.38 1.01 -0.70 -5.03 121.20 109.09 2p7p s ILE 8 Ca 0.16 -0.33 0.00 0.00 0.00 0.00 0.00 60.65 60.48 2p7p s ILE 8 Cb -0.02 -0.87 -0.01 0.00 0.01 0.00 0.00 42.46 41.57 2p7p s ILE 8 CO 0.04 0.31 -0.15 -0.89 0.00 0.00 0.00 174.94 174.25 2p7p s THR 9 N 0.86 2.75 -0.06 2.92 2.01 -1.26 0.51 115.64 123.37 2p7p s THR 9 Ca -0.11 -0.75 0.05 0.00 0.31 0.00 0.00 61.69 61.18 2p7p s THR 9 Cb -0.15 -2.15 -0.01 0.00 0.01 0.00 0.00 72.50 70.20 2p7p s THR 9 CO 0.01 0.52 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.48 2p7p s LEU 10 N 0.60 2.22 -0.21 4.42 1.43 0.15 -4.96 118.68 122.34 2p7p s LEU 10 Ca -0.09 -0.45 -0.15 0.00 -1.03 0.00 0.00 54.13 52.42 2p7p s LEU 10 Cb -0.16 -1.42 -0.04 0.00 0.03 0.00 0.00 46.19 44.60 2p7p s LEU 10 CO 0.03 0.26 0.34 -0.63 0.23 0.00 0.00 176.35 176.58 2p7p s ILE 11 N -0.22 5.24 0.09 -0.59 -1.09 -1.26 -1.07 121.20 122.30 2p7p s ILE 11 Ca -0.01 0.58 0.05 0.00 -2.23 0.00 0.00 60.65 59.04 2p7p s ILE 11 Cb -0.13 -3.67 -0.03 0.00 -1.58 0.00 0.00 42.46 37.04 2p7p s ILE 11 CO 0.03 0.28 -0.14 0.68 -1.23 0.00 0.00 174.94 174.56 2p7p s VAL 12 N 1.22 1.15 -0.01 2.92 -7.23 0.92 -4.65 120.40 114.72 2p7p s VAL 12 Ca 0.16 -1.47 0.11 0.00 -1.81 0.00 0.00 61.98 58.97 2p7p s VAL 12 Cb -0.14 -1.24 -0.10 0.00 0.56 0.00 0.00 36.38 35.46 2p7p s VAL 12 CO 0.07 -0.33 1.31 0.07 -0.31 0.00 0.00 175.10 175.92 2p7p h LYS 13 N 3.97 0.00 -3.08 4.82 2.10 -1.77 0.28 116.57 122.88 2p7p h LYS 13 Ca -0.40 0.00 -0.55 0.00 -2.00 0.00 0.00 60.65 57.70 2p7p h LYS 13 Cb 1.19 0.00 -0.40 0.00 -0.90 0.00 0.00 32.23 32.12 2p7p h LYS 13 CO 0.45 0.76 -0.77 0.34 -2.00 0.00 0.00 179.45 178.22 2p7p s ASP 14 N -6.56 3.71 0.26 7.07 -1.08 -1.26 -4.76 116.67 114.05 2p7p s ASP 14 Ca 0.02 -1.49 -0.04 0.00 -0.52 0.00 0.00 52.55 50.52 2p7p s ASP 14 Cb 0.09 -0.57 0.34 0.00 -1.46 0.00 0.00 42.92 41.32 2p7p s ASP 14 CO 0.79 -0.42 1.91 -0.07 0.52 0.00 0.00 175.17 177.90 2p7p h LEU 15 N 8.19 1.09 -0.29 -1.34 4.07 -1.95 -2.13 115.31 122.96 2p7p h LEU 15 Ca -0.16 -0.01 0.04 0.00 0.08 0.00 0.00 57.88 57.82 2p7p h LEU 15 Cb 1.01 -0.25 -0.04 0.00 1.08 0.00 0.00 40.66 42.46 2p7p h LEU 15 CO 0.45 0.75 0.07 0.78 -1.08 0.00 0.00 178.44 179.41 2p7p h ASN 16 N 1.27 0.05 -0.29 -0.43 2.35 -1.99 0.24 115.58 116.78 2p7p h ASN 16 Ca 0.39 0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 56.17 2p7p h ASN 16 Cb -0.01 0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.39 2p7p h ASN 16 CO -0.12 0.06 0.11 0.50 -1.65 0.00 0.00 177.43 176.33 2p7p h LYS 17 N 0.19 0.43 -0.77 0.81 3.64 -1.93 -2.52 116.57 116.42 2p7p h LYS 17 Ca 0.13 -0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 59.42 2p7p h LYS 17 Cb 0.12 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 31.84 2p7p h LYS 17 CO -0.16 0.46 0.43 1.15 -2.27 0.00 0.00 179.45 179.06 2p7p h THR 18 N 0.31 1.23 -0.57 1.00 2.02 -1.11 -2.43 112.91 113.37 2p7p h THR 18 Ca 0.10 -0.57 0.09 0.00 0.77 0.00 0.00 66.41 66.79 2p7p h THR 18 Cb 0.19 0.20 -0.07 0.00 -1.74 0.00 0.00 68.15 66.73 2p7p h THR 18 CO -0.01 0.26 0.17 0.74 0.37 0.00 0.00 175.52 177.05 2p7p h THR 19 N 1.07 0.74 0.13 3.16 2.02 -0.23 0.20 112.91 120.01 2p7p h THR 19 Ca 0.27 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 67.33 2p7p h THR 19 Cb 0.03 0.38 0.00 0.00 -1.74 0.00 0.00 68.15 66.82 2p7p h THR 19 CO -0.04 0.06 -0.06 0.00 0.37 0.00 0.00 175.52 175.84 2p7p h ALA 20 N 1.41 -0.18 -0.50 6.16 0.00 -1.23 -1.25 119.26 123.68 2p7p h ALA 20 Ca 0.29 -0.12 0.09 0.00 0.00 0.00 0.00 54.91 55.17 2p7p h ALA 20 Cb 0.37 0.07 -0.10 0.00 0.00 0.00 0.00 17.79 18.13 2p7p h ALA 20 CO -0.32 -0.51 -0.33 0.35 0.00 0.00 0.00 179.25 178.44 2p7p h PHE 21 N -0.37 -0.91 -0.74 0.00 3.57 -0.89 0.90 116.94 118.51 2p7p h PHE 21 Ca -0.02 0.06 -0.04 0.00 3.53 0.00 0.00 57.97 61.51 2p7p h PHE 21 Cb 0.30 0.47 -0.03 0.00 2.79 0.00 0.00 35.95 39.48 2p7p h PHE 21 CO -0.01 -0.38 0.30 -0.07 -2.23 0.00 0.00 178.31 175.92 2p7p h LEU 22 N -0.20 1.01 -0.16 0.59 3.38 -0.56 -1.77 115.31 117.60 2p7p h LEU 22 Ca 0.20 -0.17 -0.22 0.00 0.09 0.00 0.00 57.88 57.79 2p7p h LEU 22 Cb 0.54 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 41.04 2p7p h LEU 22 CO -0.61 0.90 -0.74 1.56 0.09 0.00 0.00 178.44 179.64 2p7p h GLN 23 N 1.06 0.79 0.00 1.13 4.20 -0.20 -0.56 115.11 121.53 2p7p h GLN 23 Ca 0.25 -0.63 -0.09 0.00 0.06 0.00 0.00 58.65 58.23 2p7p h GLN 23 Cb 0.20 0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 2p7p h GLN 23 CO -0.02 1.24 -0.43 -0.91 -0.67 0.00 0.00 178.83 178.04 2p7p h ASN 24 N 0.52 0.00 0.00 1.46 2.35 0.87 -1.20 115.58 119.58 2p7p h ASN 24 Ca -0.05 0.00 -0.40 0.00 -0.55 0.00 0.00 56.30 55.31 2p7p h ASN 24 Cb 1.38 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 39.69 2p7p h ASN 24 CO 0.15 0.43 -2.31 -0.38 -1.65 0.00 0.00 177.43 173.68 2p7p n ILE 25 N -3.73 1.44 0.12 2.81 5.41 -0.67 -4.67 119.36 120.07 2p7p n ILE 25 Ca -0.01 -0.31 0.11 0.00 1.00 0.00 0.00 62.75 63.53 2p7p n ILE 25 Cb 0.51 -1.90 0.22 0.00 -0.71 0.00 0.00 39.64 37.75 2p7p n ILE 25 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 2p7p n PHE 26 N -4.20 0.56 -3.95 1.39 3.01 -0.27 -4.97 117.46 109.03 2p7p n PHE 26 Ca -0.48 -0.31 -0.27 0.00 1.01 0.00 0.00 57.45 57.40 2p7p n PHE 26 Cb 0.83 -0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 40.29 2p7p n PHE 26 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 2p7p n ASN 27 N 1.35 -1.66 -4.76 4.37 5.03 -0.45 -4.85 115.26 114.29 2p7p n ASN 27 Ca 0.19 -0.94 -0.39 0.00 0.87 0.00 0.00 54.58 54.31 2p7p n ASN 27 Cb 0.57 -3.32 0.01 0.00 -1.02 0.00 0.00 39.78 36.02 2p7p n ASN 27 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2p7p s ALA 28 N -3.69 3.12 -0.33 5.41 0.00 -1.03 -4.90 121.76 120.34 2p7p s ALA 28 Ca 0.23 1.25 -0.08 0.00 0.00 0.00 0.00 51.96 53.36 2p7p s ALA 28 Cb -0.12 -3.51 0.02 0.00 0.00 0.00 0.00 23.12 19.52 2p7p s ALA 28 CO 0.87 -0.99 0.12 -2.00 0.00 0.00 0.00 175.76 173.77 2p7p s GLU 29 N -2.49 2.87 0.06 0.00 2.12 -0.38 -4.62 118.70 116.27 2p7p s GLU 29 Ca 0.62 -1.02 -0.31 0.00 0.36 0.00 0.00 54.97 54.62 2p7p s GLU 29 Cb -0.38 -3.50 -0.07 0.00 0.26 0.00 0.00 34.13 30.44 2p7p s GLU 29 CO 0.48 -0.58 1.43 -2.00 -0.54 0.00 0.00 175.26 174.05 2p7p s GLU 30 N 1.48 4.29 0.00 4.30 2.12 -1.26 -1.79 118.70 127.84 2p7p s GLU 30 Ca 0.01 2.07 0.00 0.00 0.36 0.00 0.00 54.97 57.41 2p7p s GLU 30 Cb -0.18 -3.42 0.00 0.00 0.26 0.00 0.00 34.13 30.78 2p7p s GLU 30 CO 0.04 -0.53 0.09 0.44 -0.54 0.00 0.00 175.26 174.75 2p7p n ILE 31 N 4.33 0.00 -3.62 -3.70 -5.35 -0.66 -4.99 119.36 105.37 2p7p n ILE 31 Ca 0.13 -0.29 -0.15 0.00 -0.27 0.00 0.00 62.75 62.16 2p7p n ILE 31 Cb 0.43 1.12 -0.07 0.00 -1.74 0.00 0.00 39.64 39.38 2p7p n ILE 31 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 2p7p s TYR 32 N -0.41 -0.44 -0.26 4.28 5.04 -1.22 -4.95 117.35 119.39 2p7p s TYR 32 Ca 0.00 0.68 -0.11 0.00 -2.44 0.00 0.00 57.07 55.20 2p7p s TYR 32 Cb 0.00 0.29 0.10 0.00 0.35 0.00 0.00 41.96 42.70 2p7p s TYR 32 CO 0.00 -0.54 0.59 0.45 -1.34 0.00 0.00 175.55 174.70 2p7p s SER 33 N -1.42 -0.85 0.16 4.32 0.15 -1.26 -1.87 113.70 112.92 2p7p s SER 33 Ca -0.10 1.37 -0.01 0.00 0.70 0.00 0.00 55.95 57.91 2p7p s SER 33 Cb -0.02 1.72 -0.04 0.00 -1.71 0.00 0.00 66.02 65.97 2p7p s SER 33 CO 0.05 -0.22 0.08 -0.55 1.20 0.00 0.00 173.24 173.80 2p7p s SER 34 N 2.37 0.29 0.00 5.45 0.15 0.29 -5.01 113.70 117.25 2p7p s SER 34 Ca -0.06 -1.27 0.00 0.00 0.70 0.00 0.00 55.95 55.31 2p7p s SER 34 Cb -0.10 0.32 0.00 0.00 -1.71 0.00 0.00 66.02 64.53 2p7p s SER 34 CO -0.17 -0.76 0.00 0.61 1.20 0.00 0.00 173.24 174.11 2p7p n GLY 35 N -0.16 3.40 3.15 9.45 0.00 -1.25 -1.18 105.19 118.60 2p7p n GLY 35 Ca -0.03 -1.88 0.05 0.00 0.00 0.00 0.00 46.02 44.17 2p7p n GLY 35 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2p7p s ASP 36 N 0.00 -0.63 0.39 1.61 3.68 -0.93 -4.95 116.67 115.84 2p7p s ASP 36 Ca 0.00 0.12 0.10 0.00 2.13 0.00 0.00 52.55 54.90 2p7p s ASP 36 Cb 0.00 1.42 0.79 0.00 -1.45 0.00 0.00 42.92 43.69 2p7p s ASP 36 CO 0.00 -0.12 1.92 0.11 0.13 0.00 0.00 175.17 177.21 2p7p h LYS 37 N 7.50 0.21 0.00 4.34 1.57 -1.96 -1.57 116.57 126.66 2p7p h LYS 37 Ca -0.09 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 2p7p h LYS 37 Cb 1.18 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.46 2p7p h LYS 37 CO -0.05 0.36 0.00 0.25 -0.57 0.00 0.00 179.45 179.44 2p7p n THR 38 N -4.27 0.00 -1.27 -0.16 -2.24 -1.26 -2.44 114.28 102.64 2p7p n THR 38 Ca -0.01 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.81 2p7p n THR 38 Cb 0.27 -0.46 0.06 0.00 -2.10 0.00 0.00 70.33 68.10 2p7p n THR 38 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2p7p n PHE 39 N -0.92 0.00 -4.01 4.78 7.35 -0.68 -5.03 117.46 118.95 2p7p n PHE 39 Ca 0.19 -0.47 -0.26 0.00 -0.76 0.00 0.00 57.45 56.14 2p7p n PHE 39 Cb 0.09 -0.09 -0.03 0.00 0.35 0.00 0.00 39.48 39.80 2p7p n PHE 39 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 2p7p n SER 40 N -0.65 -0.13 -4.13 -2.13 7.64 -0.93 -4.96 113.62 108.34 2p7p n SER 40 Ca 0.07 -1.05 -0.31 0.00 1.01 0.00 0.00 58.87 58.59 2p7p n SER 40 Cb 0.60 -2.82 -0.17 0.00 -1.01 0.00 0.00 64.21 60.82 2p7p n SER 40 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2p7p s LEU 41 N -7.04 1.94 0.50 -3.43 1.43 -0.71 -5.02 118.68 106.36 2p7p s LEU 41 Ca 0.01 -0.52 -0.22 0.00 -1.03 0.00 0.00 54.13 52.37 2p7p s LEU 41 Cb -0.01 -1.28 -0.07 0.00 0.03 0.00 0.00 46.19 44.86 2p7p s LEU 41 CO 0.91 0.06 1.16 -1.20 0.23 0.00 0.00 176.35 177.51 2p7p n SER 42 N 4.04 1.85 -4.74 2.29 7.64 -1.26 -2.18 113.62 121.25 2p7p n SER 42 Ca -0.20 0.98 -0.38 0.00 1.01 0.00 0.00 58.87 60.28 2p7p n SER 42 Cb 0.52 -1.46 -0.06 0.00 -1.01 0.00 0.00 64.21 62.20 2p7p n SER 42 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2p7p s LYS 43 N -2.48 4.31 0.00 1.43 1.02 -1.26 -3.86 119.74 118.91 2p7p s LYS 43 Ca 0.68 0.53 -0.13 0.00 0.02 0.00 0.00 55.97 57.07 2p7p s LYS 43 Cb -0.47 -3.41 0.02 0.00 -0.52 0.00 0.00 37.83 33.45 2p7p s LYS 43 CO 0.53 0.22 0.26 -1.83 -0.92 0.00 0.00 175.35 173.61 2p7p s GLU 44 N 0.39 0.66 0.05 1.68 -1.05 -0.32 -0.33 118.70 119.77 2p7p s GLU 44 Ca 0.28 -0.33 0.04 0.00 -0.15 0.00 0.00 54.97 54.81 2p7p s GLU 44 Cb -0.16 0.29 -0.02 0.00 -0.44 0.00 0.00 34.13 33.79 2p7p s GLU 44 CO 0.12 -0.18 -0.12 0.15 0.95 0.00 0.00 175.26 176.18 2p7p s LYS 45 N -1.67 0.77 -0.07 -4.83 1.02 -0.53 -0.55 119.74 113.89 2p7p s LYS 45 Ca -0.12 -0.77 0.00 0.00 0.02 0.00 0.00 55.97 55.11 2p7p s LYS 45 Cb -0.05 -0.72 -0.03 0.00 -0.52 0.00 0.00 37.83 36.52 2p7p s LYS 45 CO 0.02 0.17 -0.04 -0.06 -0.92 0.00 0.00 175.35 174.51 2p7p s PHE 46 N -1.03 3.01 0.16 3.18 2.99 -0.78 -1.71 117.98 123.80 2p7p s PHE 46 Ca -0.02 0.07 0.02 0.00 0.00 0.00 0.00 56.93 57.01 2p7p s PHE 46 Cb -0.08 -1.72 -0.05 0.00 0.00 0.00 0.00 43.02 41.17 2p7p s PHE 46 CO 0.01 0.38 -0.02 -0.06 -0.00 0.00 0.00 175.22 175.53 2p7p s PHE 47 N -0.86 1.20 -0.04 0.36 0.40 0.12 -1.66 117.98 117.50 2p7p s PHE 47 Ca 0.13 -0.95 0.06 0.00 -0.60 0.00 0.00 56.93 55.57 2p7p s PHE 47 Cb -0.11 -0.67 -0.01 0.00 0.51 0.00 0.00 43.02 42.73 2p7p s PHE 47 CO 0.02 -0.14 -0.24 -0.51 0.70 0.00 0.00 175.22 175.06 2p7p s LEU 48 N -3.16 2.04 -0.22 -0.37 1.43 -0.74 -1.38 118.68 116.27 2p7p s LEU 48 Ca 0.21 -0.47 -0.04 0.00 -1.03 0.00 0.00 54.13 52.81 2p7p s LEU 48 Cb 0.05 -1.28 0.10 0.00 0.03 0.00 0.00 46.19 45.09 2p7p s LEU 48 CO 0.02 0.25 0.20 -0.63 0.23 0.00 0.00 176.35 176.42 2p7p s ILE 49 N -0.26 -0.27 -1.42 -0.59 1.01 -0.47 -1.25 121.20 117.95 2p7p s ILE 49 Ca 0.00 -0.26 -0.10 0.00 0.00 0.00 0.00 60.65 60.29 2p7p s ILE 49 Cb -0.12 -0.75 0.04 0.00 0.01 0.00 0.00 42.46 41.64 2p7p s ILE 49 CO 0.02 -0.32 1.10 0.00 0.00 0.00 0.00 174.94 175.74 2p7p n ALA 50 N 5.30 -1.33 -0.95 9.38 0.00 -1.26 -0.72 120.51 130.93 2p7p n ALA 50 Ca -0.05 0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.70 2p7p n ALA 50 Cb 0.48 -5.01 0.00 0.00 0.00 0.00 0.00 19.45 14.92 2p7p n ALA 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2p7p n GLY 51 N -1.87 0.68 3.75 0.00 0.00 -1.26 -5.01 105.19 101.48 2p7p n GLY 51 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 2p7p n GLY 51 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2p7p s LEU 52 N 0.00 4.29 -0.52 0.99 1.43 0.10 -5.04 118.68 119.93 2p7p s LEU 52 Ca 0.00 0.65 -0.26 0.00 -1.03 0.00 0.00 54.13 53.49 2p7p s LEU 52 Cb 0.00 -2.48 0.03 0.00 0.03 0.00 0.00 46.19 43.78 2p7p s LEU 52 CO 0.00 0.11 1.01 0.86 0.23 0.00 0.00 176.35 178.57 2p7p s TRP 53 N 0.25 2.79 -0.12 0.29 -0.00 -1.26 -1.36 118.94 119.53 2p7p s TRP 53 Ca 0.20 0.27 -0.03 0.00 -0.00 0.00 0.00 56.10 56.54 2p7p s TRP 53 Cb -0.14 -4.18 -0.03 0.00 -0.00 0.00 0.00 33.47 29.12 2p7p s TRP 53 CO 0.07 -1.32 -0.02 0.42 -0.00 0.00 0.00 176.95 176.10 2p7p s ILE 54 N 4.17 4.12 -0.06 5.86 -1.09 -0.48 -1.72 121.20 132.00 2p7p s ILE 54 Ca 0.37 -0.30 0.06 0.00 -2.23 0.00 0.00 60.65 58.54 2p7p s ILE 54 Cb -0.10 -2.76 -0.01 0.00 -1.58 0.00 0.00 42.46 38.01 2p7p s ILE 54 CO 0.24 0.55 -0.24 0.00 -1.23 0.00 0.00 174.94 174.27 2p7p s ILE 56 N -0.07 1.85 0.02 0.00 -4.36 -0.69 0.34 121.20 118.30 2p7p s ILE 56 Ca -0.06 -0.99 0.03 0.00 -0.26 0.00 0.00 60.65 59.38 2p7p s ILE 56 Cb -0.14 -1.55 -0.02 0.00 1.25 0.00 0.00 42.46 42.00 2p7p s ILE 56 CO 0.04 0.52 -0.11 -0.32 0.24 0.00 0.00 174.94 175.32 2p7p s MET 57 N -0.39 0.76 0.15 0.37 1.75 -0.24 -1.45 119.30 120.25 2p7p s MET 57 Ca 0.04 -0.57 -0.31 0.00 -1.25 0.00 0.00 55.69 53.60 2p7p s MET 57 Cb -0.10 -0.71 -0.09 0.00 2.84 0.00 0.00 34.83 36.77 2p7p s MET 57 CO 0.01 0.18 1.40 -2.00 -0.65 0.00 0.00 175.02 173.96 2p7p s GLU 58 N -0.83 4.31 0.00 4.11 2.12 0.55 -0.06 118.70 128.91 2p7p s GLU 58 Ca 0.00 2.13 0.00 0.00 0.36 0.00 0.00 54.97 57.46 2p7p s GLU 58 Cb -0.06 -3.21 0.00 0.00 0.26 0.00 0.00 34.13 31.11 2p7p s GLU 58 CO 0.00 -0.42 0.00 0.41 -0.54 0.00 0.00 175.26 174.71 2p7p n GLY 59 N 3.22 -1.24 3.74 -1.50 0.00 0.09 -4.76 105.19 104.74 2p7p n GLY 59 Ca 0.10 -0.92 -0.32 0.00 0.00 0.00 0.00 46.02 44.88 2p7p n GLY 59 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2p7p s ASP 60 N -4.00 4.32 0.30 1.61 1.01 -1.26 -2.72 116.67 115.93 2p7p s ASP 60 Ca 0.00 2.07 -0.07 0.00 0.71 0.00 0.00 52.55 55.26 2p7p s ASP 60 Cb 0.00 -2.55 -0.06 0.00 1.01 0.00 0.00 42.92 41.32 2p7p s ASP 60 CO 0.00 -2.17 0.60 -0.44 0.21 0.00 0.00 175.17 173.37 2p7p s SER 61 N -2.70 6.49 0.29 0.27 0.01 -1.26 -4.34 113.70 112.45 2p7p s SER 61 Ca 0.67 0.83 -0.30 0.00 1.31 0.00 0.00 55.95 58.47 2p7p s SER 61 Cb -0.22 -2.19 -0.13 0.00 0.21 0.00 0.00 66.02 63.69 2p7p s SER 61 CO 0.50 -0.22 1.41 0.18 0.41 0.00 0.00 173.24 175.52 2p7p n LEU 62 N -0.87 3.60 0.24 2.44 4.77 -0.35 -4.85 117.00 121.99 2p7p n LEU 62 Ca -0.00 1.17 0.13 0.00 -0.03 0.00 0.00 56.01 57.28 2p7p n LEU 62 Cb 0.54 -1.49 0.43 0.00 -2.33 0.00 0.00 43.42 40.57 2p7p n LEU 62 CO 0.47 -0.32 0.86 1.56 -1.33 0.00 0.00 177.39 178.64 2p7p h GLN 63 N 3.73 0.00 -3.41 3.23 4.20 -1.95 -3.42 115.11 117.49 2p7p h GLN 63 Ca -0.46 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.19 2p7p h GLN 63 Cb 1.27 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 28.91 2p7p h GLN 63 CO 0.72 0.08 -0.13 -1.21 -0.67 0.00 0.00 178.83 177.62 2p7p s GLU 64 N -3.47 1.01 0.03 1.46 0.41 -1.26 -5.14 118.70 111.74 2p7p s GLU 64 Ca 0.03 -0.70 -0.09 0.00 -0.41 0.00 0.00 54.97 53.81 2p7p s GLU 64 Cb 0.08 0.44 -0.05 0.00 -1.78 0.00 0.00 34.13 32.81 2p7p s GLU 64 CO 0.62 -0.38 0.34 1.03 -0.49 0.00 0.00 175.26 176.37 2p7p s ARG 65 N -3.60 3.69 0.38 1.61 0.52 -1.26 -4.97 118.95 115.30 2p7p s ARG 65 Ca 0.02 0.08 0.06 0.00 -0.52 0.00 0.00 55.73 55.37 2p7p s ARG 65 Cb 0.02 -3.06 -0.02 0.00 0.52 0.00 0.00 34.95 32.40 2p7p s ARG 65 CO -0.10 0.62 0.22 0.95 0.02 0.00 0.00 175.30 177.01 2p7p s THR 66 N -1.31 0.22 -2.33 0.02 -4.23 -1.26 -5.06 115.64 101.69 2p7p s THR 66 Ca 0.29 -2.00 0.21 0.00 -1.18 0.00 0.00 61.69 59.01 2p7p s THR 66 Cb -0.14 -2.40 0.44 0.00 1.34 0.00 0.00 72.50 71.74 2p7p s THR 66 CO 0.16 0.00 1.50 0.00 -0.54 0.00 0.00 174.62 175.74 2p7p n TYR 67 N -0.78 0.29 -1.95 3.99 9.36 -1.26 -4.79 117.16 122.01 2p7p n TYR 67 Ca 0.02 -0.14 -0.41 0.00 3.32 0.00 0.00 57.90 60.68 2p7p n TYR 67 Cb 0.63 0.00 -0.01 0.00 -0.63 0.00 0.00 39.34 39.33 2p7p n TYR 67 CO 0.00 0.00 0.00 -0.80 0.22 0.00 0.00 176.86 176.28 2p7p s ASN 68 N -1.53 6.56 0.25 2.98 0.01 -1.26 -4.97 114.94 116.97 2p7p s ASN 68 Ca 0.33 2.83 -0.22 0.00 -0.71 0.00 0.00 52.86 55.09 2p7p s ASN 68 Cb 0.19 -2.65 0.03 0.00 0.41 0.00 0.00 41.25 39.23 2p7p s ASN 68 CO 0.27 -0.72 0.79 -1.38 -1.51 0.00 0.00 177.10 174.55 2p7p s HIS 69 N -0.74 -0.16 -0.05 2.20 -3.43 -1.26 -4.29 115.29 107.56 2p7p s HIS 69 Ca 0.54 -0.27 0.07 0.00 -0.80 0.00 0.00 55.06 54.60 2p7p s HIS 69 Cb -0.43 0.70 -0.01 0.00 -1.43 0.00 0.00 32.58 31.40 2p7p s HIS 69 CO 0.53 -1.13 -0.25 0.42 -2.00 0.00 0.00 174.74 172.31 2p7p s ILE 70 N -3.66 2.05 -0.11 -5.38 1.01 -1.13 -5.05 121.20 108.92 2p7p s ILE 70 Ca 0.12 -1.08 0.01 0.00 0.00 0.00 0.00 60.65 59.70 2p7p s ILE 70 Cb -0.05 -1.72 0.02 0.00 0.01 0.00 0.00 42.46 40.72 2p7p s ILE 70 CO 0.06 0.57 -0.12 0.00 0.00 0.00 0.00 174.94 175.45 2p7p s ALA 71 N -0.30 1.56 0.27 9.38 0.00 -1.26 -1.40 121.76 130.01 2p7p s ALA 71 Ca 0.01 -0.67 0.01 0.00 0.00 0.00 0.00 51.96 51.30 2p7p s ALA 71 Cb -0.13 -0.88 -0.04 0.00 0.00 0.00 0.00 23.12 22.08 2p7p s ALA 71 CO 0.02 -0.23 0.46 -0.06 0.00 0.00 0.00 175.76 175.95 2p7p s PHE 72 N 1.29 3.48 -0.18 0.00 0.40 0.12 -4.88 117.98 118.21 2p7p s PHE 72 Ca -0.01 0.28 -0.08 0.00 -0.60 0.00 0.00 56.93 56.52 2p7p s PHE 72 Cb -0.14 -1.82 -0.04 0.00 0.51 0.00 0.00 43.02 41.53 2p7p s PHE 72 CO -0.05 0.28 0.09 -1.14 0.70 0.00 0.00 175.22 175.09 2p7p s GLN 73 N -3.87 3.99 0.35 0.44 0.74 -1.26 -0.09 119.66 119.95 2p7p s GLN 73 Ca 0.38 -0.29 0.04 0.00 0.05 0.00 0.00 55.36 55.54 2p7p s GLN 73 Cb -0.10 -3.27 -0.05 0.00 1.10 0.00 0.00 33.01 30.69 2p7p s GLN 73 CO 0.32 0.33 0.07 0.96 -0.55 0.00 0.00 175.29 176.42 2p7p s ILE 74 N 0.23 1.04 0.35 -2.34 -4.36 -0.66 -4.90 121.20 110.56 2p7p s ILE 74 Ca 0.06 -2.00 -0.09 0.00 -0.26 0.00 0.00 60.65 58.35 2p7p s ILE 74 Cb -0.12 -2.67 -0.06 0.00 1.25 0.00 0.00 42.46 40.86 2p7p s ILE 74 CO -0.00 0.00 0.69 -1.10 0.24 0.00 0.00 174.94 174.77 2p7p s GLN 75 N -3.86 3.76 0.56 0.37 -1.52 -1.26 -3.92 119.66 113.80 2p7p s GLN 75 Ca 0.33 0.34 0.30 0.00 -1.95 0.00 0.00 55.36 54.39 2p7p s GLN 75 Cb 0.07 -2.49 1.69 0.00 -0.22 0.00 0.00 33.01 32.07 2p7p s GLN 75 CO 0.15 0.08 2.17 0.66 -0.25 0.00 0.00 175.29 178.10 2p7p h SER 76 N 1.57 0.00 1.64 5.90 4.64 -1.93 -0.46 113.55 124.91 2p7p h SER 76 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2p7p h SER 76 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2p7p h SER 76 CO 0.65 0.06 0.00 -0.33 -0.87 0.00 0.00 176.83 176.34 2p7p h GLU 77 N 0.00 0.00 0.00 4.77 3.07 -2.01 -3.15 114.58 117.26 2p7p h GLU 77 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2p7p h GLU 77 Cb 0.18 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.09 2p7p h GLU 77 CO 0.01 0.00 -0.84 0.93 -1.40 0.00 0.00 179.01 177.70 2p7p h GLU 78 N 0.00 0.00 -0.96 2.33 5.08 -1.47 -3.39 114.58 116.17 2p7p h GLU 78 Ca 0.00 0.00 0.31 0.00 -1.00 0.00 0.00 59.36 58.67 2p7p h GLU 78 Cb 0.82 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 29.91 2p7p h GLU 78 CO 0.00 0.00 0.33 0.28 -1.00 0.00 0.00 179.01 178.62 2p7p h VAL 79 N 0.00 0.16 0.01 3.13 2.07 -1.47 -1.83 116.25 118.32 2p7p h VAL 79 Ca 0.00 -0.05 -0.07 0.00 0.82 0.00 0.00 66.70 67.41 2p7p h VAL 79 Cb 0.90 0.02 0.01 0.00 -1.52 0.00 0.00 31.29 30.70 2p7p h VAL 79 CO 0.00 0.02 -0.26 0.44 0.02 0.00 0.00 177.57 177.79 2p7p h ASP 80 N 0.13 0.22 -0.76 0.57 3.32 -1.82 -1.18 116.42 116.91 2p7p h ASP 80 Ca 0.67 -0.80 0.11 0.00 0.02 0.00 0.00 57.03 57.03 2p7p h ASP 80 Cb 1.54 -0.07 -0.05 0.00 0.22 0.00 0.00 39.33 40.97 2p7p h ASP 80 CO -0.74 1.00 0.50 1.05 -1.72 0.00 0.00 179.24 179.33 2p7p h GLU 81 N -0.53 0.60 -0.02 3.56 4.11 -1.70 0.18 114.58 120.79 2p7p h GLU 81 Ca -0.03 -0.04 -0.02 0.00 0.07 0.00 0.00 59.36 59.34 2p7p h GLU 81 Cb 1.04 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.16 2p7p h GLU 81 CO 0.05 0.40 -0.05 1.88 0.07 0.00 0.00 179.01 181.37 2p7p h TYR 82 N 0.62 0.09 -0.83 2.06 -1.99 -1.38 -1.38 116.97 114.17 2p7p h TYR 82 Ca 0.36 -0.03 0.18 0.00 2.00 0.00 0.00 58.73 61.23 2p7p h TYR 82 Cb 0.54 -0.02 -0.11 0.00 2.00 0.00 0.00 36.73 39.14 2p7p h TYR 82 CO -0.00 0.62 0.34 1.15 -0.00 0.00 0.00 178.16 180.27 2p7p h THR 83 N -0.47 0.56 -0.15 -2.88 2.02 -0.31 0.15 112.91 111.84 2p7p h THR 83 Ca 0.00 -0.15 -0.03 0.00 0.77 0.00 0.00 66.41 67.01 2p7p h THR 83 Cb 0.62 0.10 -0.00 0.00 -1.74 0.00 0.00 68.15 67.13 2p7p h THR 83 CO 0.01 0.08 -0.02 -0.08 0.37 0.00 0.00 175.52 175.88 2p7p h GLU 84 N 0.42 0.28 0.16 6.66 4.57 -0.91 -1.10 114.58 124.67 2p7p h GLU 84 Ca 0.48 -0.10 0.02 0.00 -1.18 0.00 0.00 59.36 58.58 2p7p h GLU 84 Cb 0.83 -0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 29.36 2p7p h GLU 84 CO -0.47 0.54 -0.35 0.00 -1.18 0.00 0.00 179.01 177.55 2p7p h ARG 85 N -0.00 -0.58 -0.78 1.92 3.08 -0.11 0.32 114.38 118.22 2p7p h ARG 85 Ca 0.04 0.04 0.16 0.00 0.07 0.00 0.00 59.98 60.29 2p7p h ARG 85 Cb 0.43 0.13 -0.05 0.00 0.08 0.00 0.00 29.97 30.56 2p7p h ARG 85 CO 0.01 -0.39 0.52 0.82 -1.07 0.00 0.00 179.97 179.86 2p7p h ILE 86 N -0.61 0.78 0.03 2.04 2.04 -1.01 -0.52 117.51 120.25 2p7p h ILE 86 Ca 0.02 -0.14 -0.00 0.00 1.00 0.00 0.00 64.86 65.73 2p7p h ILE 86 Cb 0.62 0.32 0.00 0.00 -0.74 0.00 0.00 36.82 37.02 2p7p h ILE 86 CO -0.18 0.08 -0.01 0.50 0.00 0.00 0.00 178.15 178.53 2p7p h LYS 87 N 0.42 -0.04 -0.04 2.37 3.64 0.33 -2.66 116.57 120.59 2p7p h LYS 87 Ca 0.39 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.78 2p7p h LYS 87 Cb 0.90 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.73 2p7p h LYS 87 CO -0.13 0.30 0.03 0.00 -2.27 0.00 0.00 179.45 177.37 2p7p h ALA 88 N 0.58 2.03 0.00 5.00 0.00 0.10 -1.29 119.26 125.69 2p7p h ALA 88 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2p7p h ALA 88 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2p7p h ALA 88 CO 0.01 -0.05 0.00 1.28 0.00 0.00 0.00 179.25 180.49 2p7p n LEU 89 N -4.52 0.00 -0.11 0.00 4.77 -0.43 -4.85 117.00 111.86 2p7p n LEU 89 Ca -0.02 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 55.94 2p7p n LEU 89 Cb 0.13 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.21 2p7p n LEU 89 CO 0.34 0.00 -0.01 0.61 -1.33 0.00 0.00 177.39 177.00 2p7p n GLY 90 N 0.64 0.29 3.69 -0.72 0.00 -0.48 -4.95 105.19 103.65 2p7p n GLY 90 Ca 0.12 -0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 2p7p n GLY 90 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2p7p s VAL 91 N -1.43 4.66 0.14 1.61 1.01 -1.02 -5.01 120.40 120.37 2p7p s VAL 91 Ca 0.00 1.93 -0.30 0.00 0.00 0.00 0.00 61.98 63.61 2p7p s VAL 91 Cb 0.00 -4.24 -0.08 0.00 0.00 0.00 0.00 36.38 32.06 2p7p s VAL 91 CO 0.00 0.02 1.26 -1.83 0.00 0.00 0.00 175.10 174.55 2p7p s GLU 92 N 1.93 4.42 -0.05 2.72 -1.05 -1.26 -4.56 118.70 120.85 2p7p s GLU 92 Ca 0.51 1.93 0.04 0.00 -0.15 0.00 0.00 54.97 57.30 2p7p s GLU 92 Cb -0.20 -3.26 -0.02 0.00 -0.44 0.00 0.00 34.13 30.21 2p7p s GLU 92 CO 0.20 -0.24 -0.17 -1.64 0.95 0.00 0.00 175.26 174.36 2p7p s MET 93 N 0.40 2.52 0.44 -4.83 -1.94 -1.26 -3.93 119.30 110.69 2p7p s MET 93 Ca 0.58 -0.75 -0.22 0.00 -1.71 0.00 0.00 55.69 53.58 2p7p s MET 93 Cb -0.34 -2.32 -0.09 0.00 2.01 0.00 0.00 34.83 34.09 2p7p s MET 93 CO 0.34 0.56 1.05 0.15 -0.01 0.00 0.00 175.02 177.10 2p7p s LYS 94 N -0.56 3.98 0.40 2.03 -0.14 0.07 -5.00 119.74 120.51 2p7p s LYS 94 Ca 0.08 1.46 -0.24 0.00 -1.36 0.00 0.00 55.97 55.91 2p7p s LYS 94 Cb -0.11 -2.34 -0.09 0.00 -1.68 0.00 0.00 37.83 33.62 2p7p s LYS 94 CO 0.01 -0.30 1.07 -1.25 -0.76 0.00 0.00 175.35 174.13 2p7p s PRO 95 N -2.83 4.11 0.13 -1.68 0.04 -1.26 -4.60 135.00 128.90 2p7p s PRO 95 Ca 0.62 1.58 -0.28 0.00 0.04 0.00 0.00 61.00 62.95 2p7p s PRO 95 Cb -0.20 -2.55 -0.16 0.00 0.04 0.00 0.00 34.50 31.63 2p7p s PRO 95 CO 0.25 -0.20 0.62 0.39 0.04 0.00 0.00 177.00 178.09 2p7p n GLU 96 N -0.09 0.00 -2.94 4.56 -0.58 -1.26 -4.97 120.64 115.36 2p7p n GLU 96 Ca 0.05 0.00 -0.27 0.00 -0.42 0.00 0.00 57.16 56.52 2p7p n GLU 96 Cb 0.49 -1.03 -0.01 0.00 -0.57 0.00 0.00 31.44 30.32 2p7p n GLU 96 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 2p7p s ARG 97 N -0.63 3.55 0.19 3.49 0.52 -1.26 -5.00 118.95 119.80 2p7p s ARG 97 Ca 0.65 0.04 -0.33 0.00 -0.52 0.00 0.00 55.73 55.57 2p7p s ARG 97 Cb -0.93 -2.49 -0.15 0.00 0.52 0.00 0.00 34.95 31.90 2p7p s ARG 97 CO 0.51 -0.05 1.29 -2.30 0.02 0.00 0.00 175.30 174.77 2p7p n PRO 98 N -1.92 1.52 -4.33 3.54 -0.02 -1.26 -4.97 135.00 127.56 2p7p n PRO 98 Ca -0.01 0.54 -0.25 0.00 -2.02 0.00 0.00 63.50 61.76 2p7p n PRO 98 Cb 0.55 -2.13 -0.09 0.00 -0.02 0.00 0.00 33.50 31.82 2p7p n PRO 98 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2p7p s ARG 99 N -0.21 2.09 -0.06 -0.52 0.52 -1.26 -5.13 118.95 114.38 2p7p s ARG 99 Ca 0.73 -1.82 0.03 0.00 -0.52 0.00 0.00 55.73 54.14 2p7p s ARG 99 Cb -0.78 -1.90 0.01 0.00 0.52 0.00 0.00 34.95 32.80 2p7p s ARG 99 CO 0.50 0.05 -0.13 0.08 0.02 0.00 0.00 175.30 175.81 2p7p s VAL 100 N -2.57 1.20 -0.21 3.52 1.01 -1.26 -5.07 120.40 117.02 2p7p s VAL 100 Ca 0.36 -0.54 -0.38 0.00 0.00 0.00 0.00 61.98 61.42 2p7p s VAL 100 Cb 0.02 -1.07 -0.15 0.00 0.00 0.00 0.00 36.38 35.18 2p7p s VAL 100 CO 0.20 0.36 1.76 1.67 0.00 0.00 0.00 175.10 179.09 2p7p n GLN 101 N 3.62 1.42 0.00 2.72 0.00 -1.26 -2.44 117.38 121.44 2p7p n GLN 101 Ca -0.21 0.52 0.00 0.00 -0.00 0.00 0.00 57.00 57.31 2p7p n GLN 101 Cb 0.52 -2.24 0.00 0.00 0.00 0.00 0.00 30.24 28.52 2p7p n GLN 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2p7p n GLY 102 N 4.16 3.23 3.73 1.69 0.00 -1.26 -4.96 105.19 111.77 2p7p n GLY 102 Ca 0.25 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 45.21 2p7p n GLY 102 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2p7p s GLU 103 N 0.00 4.19 0.00 1.61 -1.05 -1.02 -4.56 118.70 117.86 2p7p s GLU 103 Ca 0.00 2.44 0.00 0.00 -0.15 0.00 0.00 54.97 57.26 2p7p s GLU 103 Cb 0.00 -3.11 0.00 0.00 -0.44 0.00 0.00 34.13 30.58 2p7p s GLU 103 CO 0.00 -0.62 0.00 0.41 0.95 0.00 0.00 175.26 176.00 2p7p n GLY 104 N 3.35 -2.05 3.30 -3.83 0.00 -1.26 -4.87 105.19 99.83 2p7p n GLY 104 Ca 0.12 -0.51 -0.30 0.00 0.00 0.00 0.00 46.02 45.34 2p7p n GLY 104 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2p7p s ARG 105 N 0.00 1.96 0.12 1.61 1.81 -0.87 -4.96 118.95 118.61 2p7p s ARG 105 Ca 0.00 -0.93 0.08 0.00 -1.72 0.00 0.00 55.73 53.16 2p7p s ARG 105 Cb 0.00 -1.94 -0.04 0.00 -0.45 0.00 0.00 34.95 32.52 2p7p s ARG 105 CO 0.00 0.53 -0.20 -1.12 -0.68 0.00 0.00 175.30 173.83 2p7p s SER 106 N -0.72 2.52 -0.31 0.23 0.01 -1.26 -0.46 113.70 113.71 2p7p s SER 106 Ca 0.10 -0.73 0.00 0.00 1.31 0.00 0.00 55.95 56.63 2p7p s SER 106 Cb -0.10 -0.14 0.10 0.00 0.21 0.00 0.00 66.02 66.10 2p7p s SER 106 CO -0.00 0.02 0.08 -0.63 0.41 0.00 0.00 173.24 173.12 2p7p s ILE 107 N -1.42 1.18 -0.04 1.44 1.01 -0.74 -4.92 121.20 117.72 2p7p s ILE 107 Ca 0.08 -1.59 -0.16 0.00 0.00 0.00 0.00 60.65 58.98 2p7p s ILE 107 Cb -0.09 -1.88 -0.05 0.00 0.01 0.00 0.00 42.46 40.45 2p7p s ILE 107 CO 0.05 -0.65 0.43 -0.31 0.00 0.00 0.00 174.94 174.46 2p7p s TYR 108 N 1.46 3.65 -0.10 3.97 1.51 -1.26 -2.11 117.35 124.47 2p7p s TYR 108 Ca 0.10 0.96 -0.30 0.00 -1.01 0.00 0.00 57.07 56.82 2p7p s TYR 108 Cb -0.18 -2.39 0.07 0.00 -0.11 0.00 0.00 41.96 39.36 2p7p s TYR 108 CO -0.21 0.47 0.71 -0.59 -1.11 0.00 0.00 175.55 174.82 2p7p s PHE 109 N -0.47 -0.66 0.15 2.71 -0.12 -0.30 -0.75 117.98 118.53 2p7p s PHE 109 Ca 0.24 1.25 0.00 0.00 -0.05 0.00 0.00 56.93 58.38 2p7p s PHE 109 Cb -0.16 0.39 -0.04 0.00 -0.63 0.00 0.00 43.02 42.57 2p7p s PHE 109 CO 0.12 -0.54 0.31 0.71 -0.05 0.00 0.00 175.22 175.77 2p7p s TYR 110 N -0.86 3.49 0.00 3.49 1.51 -1.25 0.79 117.35 124.51 2p7p s TYR 110 Ca -0.08 0.24 0.00 0.00 -1.01 0.00 0.00 57.07 56.22 2p7p s TYR 110 Cb -0.01 -1.77 0.00 0.00 -0.11 0.00 0.00 41.96 40.07 2p7p s TYR 110 CO 0.07 0.48 0.00 -0.40 -1.11 0.00 0.00 175.55 174.60 2p7p n ASP 111 N -0.36 0.00 -1.52 2.29 3.85 -0.71 -4.75 116.55 115.35 2p7p n ASP 111 Ca -0.06 0.00 0.05 0.00 -0.71 0.00 0.00 54.79 54.08 2p7p n ASP 111 Cb 0.53 0.00 0.30 0.00 -1.35 0.00 0.00 41.12 40.60 2p7p n ASP 111 CO 0.00 0.00 0.00 0.49 -1.01 0.00 0.00 177.20 176.68 2p7p n PHE 112 N 0.00 1.52 -2.07 2.11 3.01 -1.26 -4.07 117.46 116.70 2p7p n PHE 112 Ca 0.00 -0.53 0.01 0.00 1.01 0.00 0.00 57.45 57.93 2p7p n PHE 112 Cb 0.00 -0.39 0.01 0.00 -0.01 0.00 0.00 39.48 39.09 2p7p n PHE 112 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 2p7p n ASP 113 N 0.51 0.21 -1.69 4.37 8.00 -1.26 -4.90 116.55 121.79 2p7p n ASP 113 Ca 0.21 -2.02 -0.14 0.00 0.71 0.00 0.00 54.79 53.54 2p7p n ASP 113 Cb 0.93 -0.22 -0.00 0.00 -0.02 0.00 0.00 41.12 41.81 2p7p n ASP 113 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2p7p n ASN 114 N 0.06 -4.41 -4.77 -2.24 3.02 -1.26 -1.21 115.26 104.46 2p7p n ASN 114 Ca 0.01 -0.03 -0.36 0.00 -0.03 0.00 0.00 54.58 54.17 2p7p n ASN 114 Cb 0.78 -3.54 -0.07 0.00 -0.61 0.00 0.00 39.78 36.34 2p7p n ASN 114 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 2p7p s HIS 115 N -2.74 3.52 -0.22 3.10 3.76 -1.26 -4.68 115.29 116.76 2p7p s HIS 115 Ca 0.02 0.59 -0.16 0.00 -0.15 0.00 0.00 55.06 55.36 2p7p s HIS 115 Cb -0.01 -2.22 -0.04 0.00 1.11 0.00 0.00 32.58 31.42 2p7p s HIS 115 CO 0.03 0.40 0.42 -1.17 -0.85 0.00 0.00 174.74 173.57 2p7p s LEU 116 N -0.06 4.12 0.33 0.89 2.96 -1.26 -1.74 118.68 123.92 2p7p s LEU 116 Ca 0.16 0.48 0.08 0.00 -0.22 0.00 0.00 54.13 54.63 2p7p s LEU 116 Cb -0.13 -2.53 -0.04 0.00 0.50 0.00 0.00 46.19 43.99 2p7p s LEU 116 CO 0.04 -0.13 0.10 -0.36 -1.32 0.00 0.00 176.35 174.68 2p7p s PHE 117 N 1.62 2.68 -0.20 5.38 0.40 0.24 -2.84 117.98 125.25 2p7p s PHE 117 Ca 0.19 -0.38 -0.16 0.00 -0.60 0.00 0.00 56.93 55.98 2p7p s PHE 117 Cb -0.15 -1.57 0.06 0.00 0.51 0.00 0.00 43.02 41.87 2p7p s PHE 117 CO 0.09 0.39 0.53 -2.00 0.70 0.00 0.00 175.22 174.93 2p7p s GLU 118 N -3.81 0.58 -0.25 0.44 2.12 -0.50 -1.15 118.70 116.15 2p7p s GLU 118 Ca 0.36 0.82 -0.07 0.00 0.36 0.00 0.00 54.97 56.45 2p7p s GLU 118 Cb -0.02 0.20 -0.03 0.00 0.26 0.00 0.00 34.13 34.54 2p7p s GLU 118 CO 0.22 -0.10 0.07 -0.51 -0.54 0.00 0.00 175.26 174.39 2p7p s LEU 119 N 0.74 3.44 -0.16 2.70 1.43 -0.90 0.12 118.68 126.05 2p7p s LEU 119 Ca -0.04 -0.20 -0.01 0.00 -1.03 0.00 0.00 54.13 52.85 2p7p s LEU 119 Cb -0.05 -1.92 -0.01 0.00 0.03 0.00 0.00 46.19 44.24 2p7p s LEU 119 CO -0.05 -0.03 -0.11 -2.28 0.23 0.00 0.00 176.35 174.11 2p7p s HIS 120 N 1.56 2.86 -0.51 0.29 2.46 0.87 -1.78 115.29 121.03 2p7p s HIS 120 Ca 0.06 -0.80 -0.17 0.00 0.47 0.00 0.00 55.06 54.62 2p7p s HIS 120 Cb -0.15 -1.93 0.09 0.00 -0.13 0.00 0.00 32.58 30.46 2p7p s HIS 120 CO 0.04 -0.35 0.52 0.00 -2.47 0.00 0.00 174.74 172.47 2p7p s ALA 121 N 0.75 3.52 0.00 1.58 0.00 0.40 -1.65 121.76 126.35 2p7p s ALA 121 Ca -0.05 -2.15 0.00 0.00 0.00 0.00 0.00 51.96 49.76 2p7p s ALA 121 Cb -0.15 -3.25 0.00 0.00 0.00 0.00 0.00 23.12 19.72 2p7p s ALA 121 CO 0.02 -1.95 0.00 0.41 0.00 0.00 0.00 175.76 174.23 2p7p n GLY 122 N 5.22 4.81 3.99 0.00 0.00 -1.25 -2.05 105.19 115.90 2p7p n GLY 122 Ca -0.11 -1.12 -0.22 0.00 0.00 0.00 0.00 46.02 44.57 2p7p n GLY 122 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2p7p s THR 123 N -1.66 2.44 0.09 2.61 -4.23 -1.26 -4.96 115.64 108.68 2p7p s THR 123 Ca 0.00 -0.67 -0.19 0.00 -1.18 0.00 0.00 61.69 59.65 2p7p s THR 123 Cb 0.00 -2.77 -0.08 0.00 1.34 0.00 0.00 72.50 70.99 2p7p s THR 123 CO 0.00 0.00 1.54 0.25 -0.54 0.00 0.00 174.62 175.87 2p7p h LEU 124 N -0.12 0.42 -0.74 4.79 5.85 -2.01 -2.76 115.31 120.74 2p7p h LEU 124 Ca -0.39 -0.29 0.16 0.00 0.84 0.00 0.00 57.88 58.20 2p7p h LEU 124 Cb 1.29 -0.11 -0.11 0.00 0.37 0.00 0.00 40.66 42.09 2p7p h LEU 124 CO 0.47 0.60 0.18 -0.33 -0.34 0.00 0.00 178.44 179.02 2p7p h GLU 125 N 0.22 0.26 -0.73 1.25 3.07 -1.98 0.13 114.58 116.80 2p7p h GLU 125 Ca 0.07 -0.02 -0.06 0.00 -0.50 0.00 0.00 59.36 58.85 2p7p h GLU 125 Cb 0.38 -0.06 -0.03 0.00 -0.84 0.00 0.00 28.75 28.20 2p7p h GLU 125 CO 0.01 0.17 0.20 0.93 -1.40 0.00 0.00 179.01 178.92 2p7p h GLU 126 N 0.26 1.14 -0.05 2.33 5.08 -1.92 -2.05 114.58 119.38 2p7p h GLU 126 Ca 0.42 -0.26 -0.01 0.00 -1.00 0.00 0.00 59.36 58.51 2p7p h GLU 126 Cb 0.72 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.81 2p7p h GLU 126 CO -0.52 0.99 0.00 -0.09 -1.00 0.00 0.00 179.01 178.39 2p7p h ARG 127 N 1.09 0.09 0.00 2.33 9.65 -0.62 -2.99 114.38 123.93 2p7p h ARG 127 Ca 0.23 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 59.08 2p7p h ARG 127 Cb 0.34 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 28.91 2p7p h ARG 127 CO -0.00 0.36 0.00 1.28 2.80 0.00 0.00 179.97 184.40 2p7p n LEU 128 N -4.89 0.29 0.00 3.80 4.77 0.22 -4.00 117.00 117.19 2p7p n LEU 128 Ca -0.07 0.57 0.00 0.00 -0.03 0.00 0.00 56.01 56.49 2p7p n LEU 128 Cb 0.18 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 40.73 2p7p n LEU 128 CO 0.34 -0.40 0.49 1.17 -1.33 0.00 0.00 177.39 177.66 2p7p n LYS 129 N -1.83 0.00 -0.38 3.23 4.81 -0.78 -1.60 118.16 121.62 2p7p n LYS 129 Ca 0.03 0.74 0.36 0.00 -0.87 0.00 0.00 58.31 58.56 2p7p n LYS 129 Cb 0.19 -1.47 0.71 0.00 0.02 0.00 0.00 35.03 34.48 2p7p n LYS 129 CO 0.00 0.00 0.00 -0.09 1.17 0.00 0.00 177.40 178.48 2p7p h ARG 130 N 0.00 0.07 0.00 1.64 2.43 -1.77 -3.52 114.38 113.22 2p7p h ARG 130 Ca 0.00 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2p7p h ARG 130 Cb 0.00 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.53 2p7p h ARG 130 CO 0.00 0.04 0.00 0.98 -1.51 0.00 0.00 179.97 179.48