#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p7p s ILE 2 N 0.00 4.79 0.24 2.02 -1.09 -1.26 -4.96 121.20 120.95 2p7p s ILE 2 Ca 0.00 2.00 -0.01 0.00 -2.23 0.00 0.00 60.65 60.41 2p7p s ILE 2 Cb 0.00 -4.29 0.04 0.00 -1.58 0.00 0.00 42.46 36.63 2p7p s ILE 2 CO 0.00 0.21 1.66 0.28 -1.23 0.00 0.00 174.94 175.86 2p7p h SER 3 N 6.46 0.60 0.00 3.58 0.02 -2.11 -3.49 113.55 118.61 2p7p h SER 3 Ca -0.42 -0.23 0.00 0.00 -0.84 0.00 0.00 61.79 60.31 2p7p h SER 3 Cb 1.22 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 63.59 2p7p h SER 3 CO 0.74 0.86 0.00 0.61 -1.14 0.00 0.00 176.83 177.90 2p7p n GLY 4 N -0.24 -0.40 3.74 -3.77 0.00 -1.26 -5.10 105.19 98.16 2p7p n GLY 4 Ca -0.01 -0.89 -0.39 0.00 0.00 0.00 0.00 46.02 44.74 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 4.34 -0.21 0.99 2.96 -1.26 -4.97 118.68 120.53 2p7p s LEU 5 Ca 0.00 1.03 -0.17 0.00 -0.22 0.00 0.00 54.13 54.77 2p7p s LEU 5 Cb 0.00 -2.87 -0.12 0.00 0.50 0.00 0.00 46.19 43.70 2p7p s LEU 5 CO 0.00 0.01 -0.07 -0.24 -1.32 0.00 0.00 176.35 174.73 2p7p n SER 6 N 3.34 1.88 -3.60 3.68 2.88 -1.26 -4.99 113.62 115.55 2p7p n SER 6 Ca -0.06 0.44 0.00 0.00 -1.33 0.00 0.00 58.87 57.93 2p7p n SER 6 Cb 0.51 -0.89 -0.01 0.00 -0.75 0.00 0.00 64.21 63.08 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 -2.43 -0.05 -0.04 0.66 -3.43 -1.26 -4.42 115.29 104.32 2p7p s HIS 7 Ca -0.28 -0.00 0.07 0.00 -0.80 0.00 0.00 55.06 54.05 2p7p s HIS 7 Cb 0.07 0.52 -0.02 0.00 -1.43 0.00 0.00 32.58 31.72 2p7p s HIS 7 CO 0.47 -0.14 -0.25 0.42 -2.00 0.00 0.00 174.74 173.23 2p7p s ILE 8 N -2.25 2.05 -0.13 -5.38 1.01 -0.99 -5.04 121.20 110.46 2p7p s ILE 8 Ca 0.13 -1.09 0.02 0.00 0.00 0.00 0.00 60.65 59.71 2p7p s ILE 8 Cb 0.03 -1.71 0.01 0.00 0.01 0.00 0.00 42.46 40.80 2p7p s ILE 8 CO -0.04 0.57 -0.19 -0.89 0.00 0.00 0.00 174.94 174.39 2p7p s THR 9 N -0.41 1.86 -0.03 2.92 2.01 -1.26 -0.98 115.64 119.75 2p7p s THR 9 Ca 0.04 -0.86 0.04 0.00 0.31 0.00 0.00 61.69 61.22 2p7p s THR 9 Cb -0.12 -1.67 -0.03 0.00 0.01 0.00 0.00 72.50 70.70 2p7p s THR 9 CO 0.01 0.51 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.56 2p7p s LEU 10 N 0.93 2.79 -0.23 4.42 1.43 -0.67 -5.00 118.68 122.35 2p7p s LEU 10 Ca -0.05 -0.21 -0.10 0.00 -1.03 0.00 0.00 54.13 52.74 2p7p s LEU 10 Cb -0.15 -1.59 -0.05 0.00 0.03 0.00 0.00 46.19 44.44 2p7p s LEU 10 CO -0.03 0.33 0.15 -0.63 0.23 0.00 0.00 176.35 176.40 2p7p s ILE 11 N -0.79 5.26 0.19 -0.59 -1.09 -1.26 -1.54 121.20 121.38 2p7p s ILE 11 Ca 0.12 0.15 0.06 0.00 -2.23 0.00 0.00 60.65 58.75 2p7p s ILE 11 Cb -0.11 -3.45 -0.05 0.00 -1.58 0.00 0.00 42.46 37.28 2p7p s ILE 11 CO 0.02 0.36 -0.11 0.68 -1.23 0.00 0.00 174.94 174.65 2p7p s VAL 12 N 1.02 1.45 0.08 2.92 -7.23 -0.37 -4.89 120.40 113.38 2p7p s VAL 12 Ca 0.07 -2.13 0.04 0.00 -1.81 0.00 0.00 61.98 58.15 2p7p s VAL 12 Cb -0.13 -2.00 -0.23 0.00 0.56 0.00 0.00 36.38 34.57 2p7p s VAL 12 CO 0.04 -0.63 1.15 0.50 -0.31 0.00 0.00 175.10 175.85 2p7p h LYS 13 N 2.63 0.08 -3.34 4.82 3.64 -1.87 0.82 116.57 123.35 2p7p h LYS 13 Ca -0.37 -0.14 -0.57 0.00 -1.27 0.00 0.00 60.65 58.30 2p7p h LYS 13 Cb 1.21 0.05 -0.40 0.00 -0.41 0.00 0.00 32.23 32.68 2p7p h LYS 13 CO 0.63 1.01 -0.76 0.34 -2.27 0.00 0.00 179.45 178.39 2p7p s ASP 14 N -6.76 3.89 0.16 4.20 -1.08 -1.26 -4.65 116.67 111.18 2p7p s ASP 14 Ca -0.02 -1.54 -0.15 0.00 -0.52 0.00 0.00 52.55 50.32 2p7p s ASP 14 Cb 0.09 -0.72 0.09 0.00 -1.46 0.00 0.00 42.92 40.92 2p7p s ASP 14 CO 0.84 -0.42 1.74 0.25 0.52 0.00 0.00 175.17 178.10 2p7p h LEU 15 N 8.17 0.10 -1.04 -1.34 5.85 -1.94 -1.89 115.31 123.23 2p7p h LEU 15 Ca -0.15 0.05 -0.06 0.00 0.84 0.00 0.00 57.88 58.56 2p7p h LEU 15 Cb 1.01 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.07 2p7p h LEU 15 CO 0.46 0.09 0.03 0.78 -0.34 0.00 0.00 178.44 179.46 2p7p h ASN 16 N 0.26 0.68 -0.25 1.25 2.35 -1.99 0.56 115.58 118.44 2p7p h ASN 16 Ca 0.19 -0.14 -0.19 0.00 -0.55 0.00 0.00 56.30 55.60 2p7p h ASN 16 Cb 0.19 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.38 2p7p h ASN 16 CO -0.21 0.73 -0.58 0.50 -1.65 0.00 0.00 177.43 176.22 2p7p h LYS 17 N 0.68 0.85 -0.00 0.81 3.64 -1.94 -2.88 116.57 117.73 2p7p h LYS 17 Ca 0.14 -0.56 -0.09 0.00 -1.27 0.00 0.00 60.65 58.87 2p7p h LYS 17 Cb 0.38 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.26 2p7p h LYS 17 CO 0.01 1.19 -0.44 1.15 -2.27 0.00 0.00 179.45 179.09 2p7p h THR 18 N 0.64 1.32 0.11 1.00 2.02 -1.06 -2.91 112.91 114.02 2p7p h THR 18 Ca 0.01 -1.51 -0.01 0.00 0.77 0.00 0.00 66.41 65.67 2p7p h THR 18 Cb 1.19 1.81 0.00 0.00 -1.74 0.00 0.00 68.15 69.41 2p7p h THR 18 CO 0.13 0.43 -0.05 0.74 0.37 0.00 0.00 175.52 177.14 2p7p h THR 19 N 0.00 1.03 -0.40 3.16 2.02 -0.76 -1.01 112.91 116.96 2p7p h THR 19 Ca -0.00 -0.54 -0.00 0.00 0.77 0.00 0.00 66.41 66.63 2p7p h THR 19 Cb 0.78 1.37 -0.02 0.00 -1.74 0.00 0.00 68.15 68.54 2p7p h THR 19 CO 0.06 0.13 0.23 0.00 0.37 0.00 0.00 175.52 176.30 2p7p h ALA 20 N 0.46 1.65 0.61 6.16 0.00 -1.50 -1.13 119.26 125.51 2p7p h ALA 20 Ca -0.01 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 2p7p h ALA 20 Cb 0.33 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 17.96 2p7p h ALA 20 CO 0.02 0.30 -0.29 0.35 0.00 0.00 0.00 179.25 179.63 2p7p h PHE 21 N 0.55 -0.76 -0.03 0.00 3.57 -1.33 0.10 116.94 119.04 2p7p h PHE 21 Ca 0.14 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.63 2p7p h PHE 21 Cb 0.00 0.25 -0.00 0.00 2.79 0.00 0.00 35.95 38.99 2p7p h PHE 21 CO 0.00 -0.42 0.02 -0.07 -2.23 0.00 0.00 178.31 175.61 2p7p h LEU 22 N -0.99 0.02 0.08 0.59 3.38 -0.89 -0.40 115.31 117.11 2p7p h LEU 22 Ca -0.08 -0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.60 2p7p h LEU 22 Cb 0.67 -0.01 0.02 0.00 0.09 0.00 0.00 40.66 41.44 2p7p h LEU 22 CO 0.14 0.02 -1.22 1.56 0.09 0.00 0.00 178.44 179.03 2p7p h GLN 23 N 0.03 0.53 -0.20 1.13 4.20 -1.10 -1.92 115.11 117.78 2p7p h GLN 23 Ca 0.01 -0.72 -0.09 0.00 0.06 0.00 0.00 58.65 57.91 2p7p h GLN 23 Cb 0.02 0.24 -0.00 0.00 0.30 0.00 0.00 27.48 28.04 2p7p h GLN 23 CO -0.00 1.32 -0.23 -0.91 -0.67 0.00 0.00 178.83 178.34 2p7p h ASN 24 N 0.23 0.54 0.00 1.46 2.35 -0.16 -2.32 115.58 117.68 2p7p h ASN 24 Ca -0.17 -0.49 -0.12 0.00 -0.55 0.00 0.00 56.30 54.97 2p7p h ASN 24 Cb 1.89 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 40.09 2p7p h ASN 24 CO 0.22 0.92 -0.67 0.40 -1.65 0.00 0.00 177.43 176.66 2p7p h ILE 25 N 0.16 1.22 -0.72 2.81 2.04 -1.21 -3.38 117.51 118.43 2p7p h ILE 25 Ca 0.03 -2.17 0.00 0.00 1.00 0.00 0.00 64.86 63.72 2p7p h ILE 25 Cb 0.78 2.55 0.00 0.00 -0.74 0.00 0.00 36.82 39.42 2p7p h ILE 25 CO 0.05 0.41 0.00 0.49 0.00 0.00 0.00 178.15 179.11 2p7p n PHE 26 N -4.52 0.99 -4.22 1.37 3.01 -0.90 -4.94 117.46 108.25 2p7p n PHE 26 Ca -0.21 -0.51 -0.35 0.00 1.01 0.00 0.00 57.45 57.39 2p7p n PHE 26 Cb 0.56 -0.01 -0.03 0.00 -0.01 0.00 0.00 39.48 39.98 2p7p n PHE 26 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 2p7p n ASN 27 N 1.58 -2.71 -4.75 4.37 4.05 -0.87 -4.81 115.26 112.12 2p7p n ASN 27 Ca 0.24 -1.04 -0.38 0.00 0.45 0.00 0.00 54.58 53.86 2p7p n ASN 27 Cb 0.63 -2.68 0.03 0.00 1.23 0.00 0.00 39.78 38.99 2p7p n ASN 27 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2p7p s ALA 28 N -3.41 2.84 -0.26 5.20 0.00 -0.77 -4.94 121.76 120.41 2p7p s ALA 28 Ca 0.63 1.24 -0.05 0.00 0.00 0.00 0.00 51.96 53.78 2p7p s ALA 28 Cb -0.35 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.25 2p7p s ALA 28 CO 0.93 -1.22 0.03 -2.00 0.00 0.00 0.00 175.76 173.50 2p7p s GLU 29 N -2.88 3.20 0.04 0.00 2.12 -0.87 -4.58 118.70 115.73 2p7p s GLU 29 Ca 0.70 -0.77 -0.31 0.00 0.36 0.00 0.00 54.97 54.96 2p7p s GLU 29 Cb -0.38 -3.23 -0.07 0.00 0.26 0.00 0.00 34.13 30.72 2p7p s GLU 29 CO 0.45 -0.34 1.46 -2.00 -0.54 0.00 0.00 175.26 174.28 2p7p s GLU 30 N 1.49 4.27 0.00 4.30 2.12 -1.26 -1.77 118.70 127.85 2p7p s GLU 30 Ca 0.03 2.08 0.00 0.00 0.36 0.00 0.00 54.97 57.45 2p7p s GLU 30 Cb -0.16 -3.51 0.00 0.00 0.26 0.00 0.00 34.13 30.72 2p7p s GLU 30 CO 0.00 -0.59 0.45 0.44 -0.54 0.00 0.00 175.26 175.03 2p7p n ILE 31 N 4.53 0.13 -3.61 -3.70 -5.35 0.35 -4.98 119.36 106.73 2p7p n ILE 31 Ca 0.13 -0.43 -0.12 0.00 -0.27 0.00 0.00 62.75 62.07 2p7p n ILE 31 Cb 0.43 1.16 -0.07 0.00 -1.74 0.00 0.00 39.64 39.42 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 -0.13 -0.57 -0.11 4.28 5.04 -1.15 -4.92 117.35 119.79 2p7p s TYR 32 Ca 0.00 1.28 -0.10 0.00 -2.44 0.00 0.00 57.07 55.81 2p7p s TYR 32 Cb 0.00 0.36 0.03 0.00 0.35 0.00 0.00 41.96 42.70 2p7p s TYR 32 CO 0.00 -0.34 0.28 0.45 -1.34 0.00 0.00 175.55 174.61 2p7p s SER 33 N -0.13 -0.30 0.32 4.32 0.15 -1.26 -1.46 113.70 115.34 2p7p s SER 33 Ca -0.00 0.57 -0.15 0.00 0.70 0.00 0.00 55.95 57.07 2p7p s SER 33 Cb -0.04 0.58 0.02 0.00 -1.71 0.00 0.00 66.02 64.88 2p7p s SER 33 CO -0.01 -0.10 0.65 -0.55 1.20 0.00 0.00 173.24 174.43 2p7p s SER 34 N 0.15 0.04 0.00 5.45 0.15 0.05 -5.00 113.70 114.55 2p7p s SER 34 Ca -0.00 -0.99 0.00 0.00 0.70 0.00 0.00 55.95 55.66 2p7p s SER 34 Cb -0.02 0.73 0.00 0.00 -1.71 0.00 0.00 66.02 65.02 2p7p s SER 34 CO 0.00 -1.41 0.00 0.61 1.20 0.00 0.00 173.24 173.65 2p7p n GLY 35 N -0.48 3.84 2.75 9.45 0.00 -1.25 -1.32 105.19 118.18 2p7p n GLY 35 Ca -0.04 -1.42 -0.18 0.00 0.00 0.00 0.00 46.02 44.38 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 1.55 0.30 1.61 -1.08 0.53 -4.90 116.67 114.67 2p7p s ASP 36 Ca 0.00 -0.45 0.01 0.00 -0.52 0.00 0.00 52.55 51.58 2p7p s ASP 36 Cb 0.00 0.43 0.52 0.00 -1.46 0.00 0.00 42.92 42.41 2p7p s ASP 36 CO 0.00 -0.35 1.90 0.50 0.52 0.00 0.00 175.17 177.74 2p7p h LYS 37 N 8.29 1.01 0.00 4.34 3.64 -1.97 0.08 116.57 131.96 2p7p h LYS 37 Ca -0.16 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 2p7p h LYS 37 Cb 1.12 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.71 2p7p h LYS 37 CO 0.31 0.67 0.00 1.79 -2.27 0.00 0.00 179.45 179.95 2p7p h THR 38 N 1.04 0.00 -0.33 1.00 1.35 -1.95 -3.16 112.91 110.86 2p7p h THR 38 Ca 0.40 -0.62 0.00 0.00 -0.55 0.00 0.00 66.41 65.64 2p7p h THR 38 Cb 0.22 1.60 0.00 0.00 -1.73 0.00 0.00 68.15 68.24 2p7p h THR 38 CO -0.16 0.00 0.00 0.33 -0.25 0.00 0.00 175.52 175.44 2p7p n PHE 39 N -2.59 0.43 -3.56 4.73 7.35 -0.79 -4.98 117.46 118.06 2p7p n PHE 39 Ca 0.04 -0.35 -0.20 0.00 -0.76 0.00 0.00 57.45 56.18 2p7p n PHE 39 Cb 0.43 -0.01 0.07 0.00 0.35 0.00 0.00 39.48 40.32 2p7p n PHE 39 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 2p7p n SER 40 N 0.85 -2.52 -4.08 -2.13 2.88 -0.55 -4.98 113.62 103.09 2p7p n SER 40 Ca 0.13 -0.68 -0.32 0.00 -1.33 0.00 0.00 58.87 56.68 2p7p n SER 40 Cb 0.45 -4.74 -0.15 0.00 -0.75 0.00 0.00 64.21 59.02 2p7p n SER 40 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2p7p s LEU 41 N -6.63 2.96 0.38 2.46 1.43 -0.09 -4.98 118.68 114.21 2p7p s LEU 41 Ca 0.12 -1.14 -0.25 0.00 -1.03 0.00 0.00 54.13 51.83 2p7p s LEU 41 Cb -0.05 -1.50 -0.12 0.00 0.03 0.00 0.00 46.19 44.55 2p7p s LEU 41 CO 0.76 -0.13 1.00 -1.54 0.23 0.00 0.00 176.35 176.67 2p7p n SER 42 N 4.51 1.26 -4.76 2.29 3.41 -1.26 -0.35 113.62 118.72 2p7p n SER 42 Ca -0.16 1.08 -0.40 0.00 -0.26 0.00 0.00 58.87 59.13 2p7p n SER 42 Cb 0.45 -1.33 -0.05 0.00 -0.26 0.00 0.00 64.21 63.02 2p7p n SER 42 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2p7p s LYS 43 N -1.86 4.71 0.10 4.33 1.02 -1.26 -3.84 119.74 122.95 2p7p s LYS 43 Ca 0.61 1.71 -0.24 0.00 0.02 0.00 0.00 55.97 58.07 2p7p s LYS 43 Cb -0.60 -3.22 0.07 0.00 -0.52 0.00 0.00 37.83 33.56 2p7p s LYS 43 CO 0.58 0.31 0.60 -1.83 -0.92 0.00 0.00 175.35 174.09 2p7p s GLU 44 N -1.37 1.20 0.01 1.68 -1.05 -0.44 -1.66 118.70 117.07 2p7p s GLU 44 Ca 0.43 -0.30 -0.03 0.00 -0.15 0.00 0.00 54.97 54.92 2p7p s GLU 44 Cb -0.30 0.55 -0.01 0.00 -0.44 0.00 0.00 34.13 33.94 2p7p s GLU 44 CO 0.38 -0.49 0.05 0.15 0.95 0.00 0.00 175.26 176.30 2p7p s LYS 45 N -3.08 0.34 -0.08 -4.83 1.02 -0.14 -0.77 119.74 112.20 2p7p s LYS 45 Ca -0.02 -0.42 0.03 0.00 0.02 0.00 0.00 55.97 55.57 2p7p s LYS 45 Cb -0.01 0.13 -0.02 0.00 -0.52 0.00 0.00 37.83 37.42 2p7p s LYS 45 CO -0.07 -0.07 -0.16 -0.06 -0.92 0.00 0.00 175.35 174.07 2p7p s PHE 46 N -1.20 2.68 0.16 3.18 2.99 -0.53 -0.61 117.98 124.64 2p7p s PHE 46 Ca -0.13 -0.43 0.06 0.00 0.00 0.00 0.00 56.93 56.43 2p7p s PHE 46 Cb -0.08 -1.69 -0.04 0.00 0.00 0.00 0.00 43.02 41.21 2p7p s PHE 46 CO 0.00 -0.02 -0.12 -0.06 -0.00 0.00 0.00 175.22 175.02 2p7p s PHE 47 N -0.27 1.40 -0.13 0.36 0.40 0.16 -0.49 117.98 119.41 2p7p s PHE 47 Ca 0.01 -0.66 0.01 0.00 -0.60 0.00 0.00 56.93 55.69 2p7p s PHE 47 Cb -0.13 -0.70 -0.01 0.00 0.51 0.00 0.00 43.02 42.70 2p7p s PHE 47 CO 0.03 0.17 -0.17 -0.51 0.70 0.00 0.00 175.22 175.43 2p7p s LEU 48 N -3.04 2.43 -0.25 -0.37 1.43 -0.73 -0.46 118.68 117.69 2p7p s LEU 48 Ca 0.16 -0.45 -0.01 0.00 -1.03 0.00 0.00 54.13 52.80 2p7p s LEU 48 Cb -0.00 -1.53 0.08 0.00 0.03 0.00 0.00 46.19 44.77 2p7p s LEU 48 CO 0.03 0.13 0.03 -0.63 0.23 0.00 0.00 176.35 176.15 2p7p s ILE 49 N 0.51 0.99 -1.41 -0.59 1.01 -0.47 -2.05 121.20 119.20 2p7p s ILE 49 Ca -0.11 -1.11 -0.10 0.00 0.00 0.00 0.00 60.65 59.33 2p7p s ILE 49 Cb -0.16 -1.53 0.04 0.00 0.01 0.00 0.00 42.46 40.81 2p7p s ILE 49 CO 0.05 -0.36 1.08 0.00 0.00 0.00 0.00 174.94 175.70 2p7p n ALA 50 N 4.84 -1.38 -0.96 9.38 0.00 -1.26 -0.98 120.51 130.14 2p7p n ALA 50 Ca -0.07 0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.64 2p7p n ALA 50 Cb 0.44 -4.77 0.00 0.00 0.00 0.00 0.00 19.45 15.13 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 -1.82 0.68 3.67 0.00 0.00 -1.26 -5.00 105.19 101.46 2p7p n GLY 51 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 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 4.13 -0.36 0.99 1.43 -0.15 -5.04 118.68 119.68 2p7p s LEU 52 Ca 0.00 0.20 -0.29 0.00 -1.03 0.00 0.00 54.13 53.01 2p7p s LEU 52 Cb 0.00 -2.18 0.00 0.00 0.03 0.00 0.00 46.19 44.04 2p7p s LEU 52 CO 0.00 0.05 1.47 0.86 0.23 0.00 0.00 176.35 178.96 2p7p s TRP 53 N 1.04 2.32 -0.13 0.29 -0.00 -1.26 -1.36 118.94 119.84 2p7p s TRP 53 Ca 0.10 0.68 0.00 0.00 -0.00 0.00 0.00 56.10 56.88 2p7p s TRP 53 Cb -0.14 -4.18 -0.01 0.00 -0.00 0.00 0.00 33.47 29.14 2p7p s TRP 53 CO 0.05 -2.19 -0.14 0.42 -0.00 0.00 0.00 176.95 175.09 2p7p s ILE 54 N 5.46 2.99 -0.02 5.86 -1.09 0.39 -2.36 121.20 132.43 2p7p s ILE 54 Ca 0.64 -0.68 0.03 0.00 -2.23 0.00 0.00 60.65 58.41 2p7p s ILE 54 Cb -0.17 -2.25 -0.03 0.00 -1.58 0.00 0.00 42.46 38.43 2p7p s ILE 54 CO 0.31 0.52 -0.10 0.00 -1.23 0.00 0.00 174.94 174.44 2p7p s ILE 56 N -0.88 0.86 -0.10 0.00 -1.09 0.22 -1.68 121.20 118.54 2p7p s ILE 56 Ca 0.14 -0.22 0.04 0.00 -2.23 0.00 0.00 60.65 58.38 2p7p s ILE 56 Cb -0.11 -0.89 0.00 0.00 -1.58 0.00 0.00 42.46 39.88 2p7p s ILE 56 CO 0.04 0.33 -0.23 -0.32 -1.23 0.00 0.00 174.94 173.53 2p7p s MET 57 N 1.51 2.93 -0.05 2.79 1.75 -0.59 -0.97 119.30 126.67 2p7p s MET 57 Ca 0.00 -0.84 -0.30 0.00 -1.25 0.00 0.00 55.69 53.31 2p7p s MET 57 Cb -0.13 -2.22 -0.03 0.00 2.84 0.00 0.00 34.83 35.28 2p7p s MET 57 CO -0.05 0.16 1.22 -2.00 -0.65 0.00 0.00 175.02 173.70 2p7p s GLU 58 N 0.38 4.34 0.22 4.11 2.12 -0.67 -1.24 118.70 127.97 2p7p s GLU 58 Ca -0.18 1.70 -0.05 0.00 0.36 0.00 0.00 54.97 56.80 2p7p s GLU 58 Cb -0.18 -3.56 0.02 0.00 0.26 0.00 0.00 34.13 30.67 2p7p s GLU 58 CO 0.08 -0.46 0.38 0.41 -0.54 0.00 0.00 175.26 175.12 2p7p n GLY 59 N 3.40 1.96 0.38 -1.50 0.00 0.28 -4.59 105.19 105.13 2p7p n GLY 59 Ca 0.11 -1.34 0.04 0.00 0.00 0.00 0.00 46.02 44.83 2p7p n GLY 59 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2p7p n ASP 60 N -1.57 2.35 -4.66 1.61 8.00 -1.26 -3.81 116.55 117.21 2p7p n ASP 60 Ca -0.02 -1.83 -0.43 0.00 0.71 0.00 0.00 54.79 53.22 2p7p n ASP 60 Cb 0.35 -0.11 -0.02 0.00 -0.02 0.00 0.00 41.12 41.31 2p7p n ASP 60 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2p7p s SER 61 N -0.90 7.00 -0.06 -2.24 0.01 -1.26 -5.00 113.70 111.25 2p7p s SER 61 Ca 0.13 1.63 -0.21 0.00 1.31 0.00 0.00 55.95 58.81 2p7p s SER 61 Cb 0.07 -2.54 -0.05 0.00 0.21 0.00 0.00 66.02 63.72 2p7p s SER 61 CO 0.10 -0.72 0.59 -0.76 0.41 0.00 0.00 173.24 172.86 2p7p s LEU 62 N 3.28 4.35 -0.18 2.44 1.43 -1.26 -4.87 118.68 123.86 2p7p s LEU 62 Ca 0.52 1.06 -0.06 0.00 -1.03 0.00 0.00 54.13 54.62 2p7p s LEU 62 Cb -0.20 -2.90 -0.04 0.00 0.03 0.00 0.00 46.19 43.09 2p7p s LEU 62 CO 0.13 0.01 0.04 -1.58 0.23 0.00 0.00 176.35 175.18 2p7p s GLN 63 N 0.33 3.85 0.79 1.70 0.74 -1.26 -5.08 119.66 120.72 2p7p s GLN 63 Ca 0.31 -0.41 -0.11 0.00 0.05 0.00 0.00 55.36 55.20 2p7p s GLN 63 Cb -0.17 -3.15 0.07 0.00 1.10 0.00 0.00 33.01 30.86 2p7p s GLN 63 CO 0.15 0.20 1.09 -1.83 -0.55 0.00 0.00 175.29 174.35 2p7p s GLU 64 N 0.53 2.13 -0.06 1.67 1.03 -1.26 -4.75 118.70 118.00 2p7p s GLU 64 Ca 0.01 0.95 -0.30 0.00 0.03 0.00 0.00 54.97 55.67 2p7p s GLU 64 Cb -0.13 -1.90 -0.03 0.00 -0.80 0.00 0.00 34.13 31.27 2p7p s GLU 64 CO 0.01 -1.67 1.15 0.50 -1.33 0.00 0.00 175.26 173.93 2p7p s ARG 65 N -4.98 4.38 0.35 -4.83 3.52 -1.26 -4.99 118.95 111.13 2p7p s ARG 65 Ca 0.61 1.61 0.05 0.00 -0.13 0.00 0.00 55.73 57.86 2p7p s ARG 65 Cb -0.16 -3.54 -0.02 0.00 -1.56 0.00 0.00 34.95 29.68 2p7p s ARG 65 CO 0.56 -0.39 0.36 0.95 -0.81 0.00 0.00 175.30 175.97 2p7p s THR 66 N 2.04 0.00 -2.16 4.11 -4.23 -1.26 -5.04 115.64 109.10 2p7p s THR 66 Ca 0.54 -1.86 0.18 0.00 -1.18 0.00 0.00 61.69 59.37 2p7p s THR 66 Cb -0.23 -2.57 0.43 0.00 1.34 0.00 0.00 72.50 71.47 2p7p s THR 66 CO 0.22 0.00 1.42 0.00 -0.54 0.00 0.00 174.62 175.72 2p7p n TYR 67 N -0.63 0.49 -2.09 3.99 9.36 -1.26 -4.80 117.16 122.22 2p7p n TYR 67 Ca 0.06 -0.24 -0.42 0.00 3.32 0.00 0.00 57.90 60.62 2p7p n TYR 67 Cb 0.62 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 39.30 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 -1.25 6.75 0.30 2.98 0.01 -1.26 -4.97 114.94 117.49 2p7p s ASN 68 Ca 0.33 2.50 -0.19 0.00 -0.71 0.00 0.00 52.86 54.79 2p7p s ASN 68 Cb 0.18 -2.61 0.02 0.00 0.41 0.00 0.00 41.25 39.26 2p7p s ASN 68 CO 0.25 -0.66 0.72 -1.38 -1.51 0.00 0.00 177.10 174.51 2p7p s HIS 69 N 0.50 -0.08 -0.05 2.20 -3.43 -1.26 -4.42 115.29 108.75 2p7p s HIS 69 Ca 0.62 -0.41 0.06 0.00 -0.80 0.00 0.00 55.06 54.53 2p7p s HIS 69 Cb -0.39 0.69 -0.01 0.00 -1.43 0.00 0.00 32.58 31.43 2p7p s HIS 69 CO 0.37 -1.29 -0.24 0.42 -2.00 0.00 0.00 174.74 172.00 2p7p s ILE 70 N -3.61 2.20 -0.11 -5.38 1.01 -1.20 -5.04 121.20 109.08 2p7p s ILE 70 Ca 0.13 -1.02 0.03 0.00 0.00 0.00 0.00 60.65 59.78 2p7p s ILE 70 Cb -0.05 -1.80 0.01 0.00 0.01 0.00 0.00 42.46 40.62 2p7p s ILE 70 CO 0.08 0.57 -0.21 0.00 0.00 0.00 0.00 174.94 175.38 2p7p s ALA 71 N -0.31 2.03 0.15 9.38 0.00 -1.26 -1.19 121.76 130.57 2p7p s ALA 71 Ca 0.01 -0.92 0.05 0.00 0.00 0.00 0.00 51.96 51.10 2p7p s ALA 71 Cb -0.13 -0.84 -0.04 0.00 0.00 0.00 0.00 23.12 22.12 2p7p s ALA 71 CO 0.02 0.13 0.13 -0.06 0.00 0.00 0.00 175.76 175.98 2p7p s PHE 72 N 0.60 3.15 0.12 0.00 0.40 0.93 -4.93 117.98 118.26 2p7p s PHE 72 Ca -0.13 -0.01 -0.20 0.00 -0.60 0.00 0.00 56.93 55.99 2p7p s PHE 72 Cb -0.17 -1.53 -0.07 0.00 0.51 0.00 0.00 43.02 41.77 2p7p s PHE 72 CO 0.04 0.52 0.62 -0.65 0.70 0.00 0.00 175.22 176.45 2p7p s GLN 73 N -3.00 4.23 0.27 0.44 -0.21 -1.26 -0.55 119.66 119.58 2p7p s GLN 73 Ca 0.31 0.79 0.01 0.00 0.02 0.00 0.00 55.36 56.49 2p7p s GLN 73 Cb -0.10 -3.14 -0.03 0.00 1.00 0.00 0.00 33.01 30.73 2p7p s GLN 73 CO 0.23 0.57 0.24 0.96 -2.12 0.00 0.00 175.29 175.17 2p7p s ILE 74 N -1.23 0.00 0.16 1.08 -4.36 -0.76 -4.86 121.20 111.22 2p7p s ILE 74 Ca 0.33 -1.93 -0.07 0.00 -0.26 0.00 0.00 60.65 58.73 2p7p s ILE 74 Cb -0.19 -2.50 -0.06 0.00 1.25 0.00 0.00 42.46 40.96 2p7p s ILE 74 CO 0.20 0.00 0.42 -1.10 0.24 0.00 0.00 174.94 174.71 2p7p s GLN 75 N -3.77 3.68 0.44 0.37 -1.52 -1.26 -4.07 119.66 113.54 2p7p s GLN 75 Ca 0.38 0.03 0.10 0.00 -1.95 0.00 0.00 55.36 53.93 2p7p s GLN 75 Cb 0.04 -2.81 0.99 0.00 -0.22 0.00 0.00 33.01 31.01 2p7p s GLN 75 CO 0.19 0.44 2.07 0.66 -0.25 0.00 0.00 175.29 178.40 2p7p h SER 76 N 2.84 0.28 -0.79 5.90 4.64 -1.95 -0.94 113.55 123.54 2p7p h SER 76 Ca -0.46 -0.01 0.01 0.00 -0.47 0.00 0.00 61.79 60.85 2p7p h SER 76 Cb 1.17 -0.07 -0.04 0.00 -0.31 0.00 0.00 62.40 63.15 2p7p h SER 76 CO 0.71 0.23 0.53 -0.33 -0.87 0.00 0.00 176.83 177.10 2p7p h GLU 77 N 0.33 1.04 -0.15 4.77 3.07 -1.97 -3.01 114.58 118.67 2p7p h GLU 77 Ca 0.09 -0.06 0.00 0.00 -0.50 0.00 0.00 59.36 58.88 2p7p h GLU 77 Cb 0.01 -0.24 0.00 0.00 -0.84 0.00 0.00 28.75 27.69 2p7p h GLU 77 CO -0.01 0.69 0.00 0.39 -1.40 0.00 0.00 179.01 178.68 2p7p n GLU 78 N -4.41 1.69 -0.19 2.33 1.02 -0.37 -4.44 120.64 116.26 2p7p n GLU 78 Ca 0.09 -1.04 -0.06 0.00 -0.02 0.00 0.00 57.16 56.13 2p7p n GLU 78 Cb 0.03 -1.40 0.04 0.00 -0.02 0.00 0.00 31.44 30.09 2p7p n GLU 78 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2p7p h VAL 79 N 2.13 1.12 -0.61 2.62 2.07 -1.39 -1.52 116.25 120.67 2p7p h VAL 79 Ca 0.00 -0.25 -0.04 0.00 0.82 0.00 0.00 66.70 67.23 2p7p h VAL 79 Cb 0.47 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 2p7p h VAL 79 CO 0.00 0.13 0.23 0.44 0.02 0.00 0.00 177.57 178.40 2p7p h ASP 80 N 0.74 0.85 -0.42 0.57 3.32 -1.82 0.48 116.42 120.14 2p7p h ASP 80 Ca 0.21 -0.18 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 2p7p h ASP 80 Cb -0.05 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.26 2p7p h ASP 80 CO -0.06 0.80 0.21 -0.08 -1.72 0.00 0.00 179.24 178.39 2p7p h GLU 81 N 0.85 0.59 -0.26 3.56 4.22 -1.78 -2.14 114.58 119.63 2p7p h GLU 81 Ca 0.20 -0.08 -0.10 0.00 0.08 0.00 0.00 59.36 59.46 2p7p h GLU 81 Cb 0.22 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 2p7p h GLU 81 CO -0.01 0.50 -0.26 1.88 -2.18 0.00 0.00 179.01 178.94 2p7p h TYR 82 N 0.53 0.55 -0.46 0.92 -1.99 -1.04 -1.59 116.97 113.90 2p7p h TYR 82 Ca 0.14 -0.12 -0.01 0.00 2.00 0.00 0.00 58.73 60.74 2p7p h TYR 82 Cb 0.09 -0.14 -0.02 0.00 2.00 0.00 0.00 36.73 38.66 2p7p h TYR 82 CO -0.02 0.71 0.23 1.15 -0.00 0.00 0.00 178.16 180.23 2p7p h THR 83 N 0.43 1.18 -0.09 -2.88 2.02 -0.54 -0.33 112.91 112.70 2p7p h THR 83 Ca 0.06 -0.49 -0.19 0.00 0.77 0.00 0.00 66.41 66.56 2p7p h THR 83 Cb 0.68 0.66 -0.00 0.00 -1.74 0.00 0.00 68.15 67.75 2p7p h THR 83 CO 0.05 0.19 -0.74 1.05 0.37 0.00 0.00 175.52 176.44 2p7p h GLU 84 N 0.60 0.49 0.03 6.66 4.11 -1.31 -1.89 114.58 123.27 2p7p h GLU 84 Ca 0.16 -0.40 0.01 0.00 0.07 0.00 0.00 59.36 59.20 2p7p h GLU 84 Cb 0.10 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 2p7p h GLU 84 CO -0.02 1.03 -0.07 -0.09 0.07 0.00 0.00 179.01 179.94 2p7p h ARG 85 N 0.33 -0.13 -0.27 1.06 2.43 -1.09 0.13 114.38 116.84 2p7p h ARG 85 Ca -0.04 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.13 2p7p h ARG 85 Cb 1.33 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.90 2p7p h ARG 85 CO 0.13 -0.08 0.11 0.82 -1.51 0.00 0.00 179.97 179.44 2p7p h ILE 86 N -0.13 1.17 -0.85 1.20 2.04 -1.05 -2.53 117.51 117.36 2p7p h ILE 86 Ca 0.02 -0.52 0.08 0.00 1.00 0.00 0.00 64.86 65.43 2p7p h ILE 86 Cb 0.15 1.02 -0.06 0.00 -0.74 0.00 0.00 36.82 37.18 2p7p h ILE 86 CO -0.04 0.18 0.55 0.50 0.00 0.00 0.00 178.15 179.34 2p7p h LYS 87 N 0.29 0.87 0.00 2.37 3.64 -1.08 -0.75 116.57 121.90 2p7p h LYS 87 Ca 0.09 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.37 2p7p h LYS 87 Cb 0.18 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 2p7p h LYS 87 CO -0.01 0.57 -0.24 0.00 -2.27 0.00 0.00 179.45 177.50 2p7p h ALA 88 N 1.55 1.54 0.00 5.00 0.00 -0.33 -1.74 119.26 125.29 2p7p h ALA 88 Ca 0.38 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2p7p h ALA 88 Cb 0.30 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2p7p h ALA 88 CO -0.14 0.30 0.00 1.28 0.00 0.00 0.00 179.25 180.69 2p7p n LEU 89 N -4.16 0.68 0.00 0.00 4.77 -0.30 -4.92 117.00 113.07 2p7p n LEU 89 Ca -0.02 0.60 0.00 0.00 -0.03 0.00 0.00 56.01 56.56 2p7p n LEU 89 Cb 0.30 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 2p7p n LEU 89 CO 0.36 -0.33 0.00 0.61 -1.33 0.00 0.00 177.39 176.71 2p7p n GLY 90 N 0.75 0.56 3.83 -0.72 0.00 -0.65 -5.03 105.19 103.92 2p7p n GLY 90 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 2p7p n GLY 90 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2p7p s VAL 91 N -2.25 4.21 0.08 1.61 -7.23 -1.26 -4.98 120.40 110.58 2p7p s VAL 91 Ca 0.00 0.74 -0.31 0.00 -1.81 0.00 0.00 61.98 60.60 2p7p s VAL 91 Cb 0.00 -3.53 -0.07 0.00 0.56 0.00 0.00 36.38 33.34 2p7p s VAL 91 CO 0.00 -0.92 1.44 -0.70 -0.31 0.00 0.00 175.10 174.62 2p7p s GLU 92 N -5.01 4.28 0.03 4.82 2.12 -1.26 -4.85 118.70 118.83 2p7p s GLU 92 Ca 0.58 2.09 0.07 0.00 0.36 0.00 0.00 54.97 58.07 2p7p s GLU 92 Cb -0.13 -3.39 -0.02 0.00 0.26 0.00 0.00 34.13 30.84 2p7p s GLU 92 CO 0.53 -0.53 -0.19 -1.64 -0.54 0.00 0.00 175.26 172.89 2p7p s MET 93 N 1.73 1.36 0.07 4.30 -1.94 -1.26 -1.39 119.30 122.16 2p7p s MET 93 Ca 0.66 -0.85 -0.20 0.00 -1.71 0.00 0.00 55.69 53.59 2p7p s MET 93 Cb -0.36 -1.42 -0.07 0.00 2.01 0.00 0.00 34.83 35.00 2p7p s MET 93 CO 0.29 0.37 0.60 0.15 -0.01 0.00 0.00 175.02 176.42 2p7p s LYS 94 N -0.99 4.26 0.30 2.03 1.02 -0.47 -5.01 119.74 120.88 2p7p s LYS 94 Ca 0.07 0.78 -0.30 0.00 0.02 0.00 0.00 55.97 56.54 2p7p s LYS 94 Cb -0.08 -3.26 -0.11 0.00 -0.52 0.00 0.00 37.83 33.86 2p7p s LYS 94 CO 0.01 0.59 1.52 -1.25 -0.92 0.00 0.00 175.35 175.30 2p7p s PRO 95 N -0.96 4.17 0.41 -1.68 0.04 -1.26 -4.55 135.00 131.18 2p7p s PRO 95 Ca 0.30 2.49 -0.27 0.00 0.04 0.00 0.00 61.00 63.56 2p7p s PRO 95 Cb -0.20 -3.04 -0.10 0.00 0.04 0.00 0.00 34.50 31.21 2p7p s PRO 95 CO 0.19 -0.54 1.45 -1.91 0.04 0.00 0.00 177.00 176.23 2p7p n GLU 96 N 1.84 2.42 -3.38 4.56 2.13 -1.26 -4.99 120.64 121.96 2p7p n GLU 96 Ca 0.06 0.86 -0.19 0.00 0.66 0.00 0.00 57.16 58.55 2p7p n GLU 96 Cb 0.39 -2.63 -0.01 0.00 0.27 0.00 0.00 31.44 29.46 2p7p n GLU 96 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 2p7p s ARG 97 N -2.26 2.81 0.13 5.31 1.81 -1.26 -5.05 118.95 120.44 2p7p s ARG 97 Ca 0.57 -1.26 -0.31 0.00 -1.72 0.00 0.00 55.73 53.01 2p7p s ARG 97 Cb -0.47 -2.64 -0.11 0.00 -0.45 0.00 0.00 34.95 31.29 2p7p s ARG 97 CO 0.61 -0.11 1.81 -2.14 -0.68 0.00 0.00 175.30 174.78 2p7p s PRO 98 N -4.20 4.14 0.18 3.54 0.02 -1.26 -4.90 135.00 132.52 2p7p s PRO 98 Ca 0.49 2.59 -0.32 0.00 0.02 0.00 0.00 61.00 63.78 2p7p s PRO 98 Cb -0.08 -3.52 -0.16 0.00 0.02 0.00 0.00 34.50 30.76 2p7p s PRO 98 CO 0.30 -0.83 0.97 0.54 -0.33 0.00 0.00 177.00 177.65 2p7p n ARG 99 N 5.43 0.75 -4.55 5.54 5.12 -1.26 -4.97 116.66 122.71 2p7p n ARG 99 Ca 0.17 0.27 -0.33 0.00 -1.93 0.00 0.00 57.85 56.03 2p7p n ARG 99 Cb 0.38 -1.62 -0.14 0.00 -1.16 0.00 0.00 32.46 29.91 2p7p n ARG 99 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2p7p s VAL 100 N -0.52 3.01 -0.21 1.55 1.01 -1.26 -5.07 120.40 118.92 2p7p s VAL 100 Ca 0.71 -0.66 -0.32 0.00 0.00 0.00 0.00 61.98 61.71 2p7p s VAL 100 Cb -0.90 -2.28 -0.09 0.00 0.00 0.00 0.00 36.38 33.10 2p7p s VAL 100 CO 0.55 0.51 2.11 0.00 0.00 0.00 0.00 175.10 178.27 2p7p n GLN 101 N 3.88 1.80 0.00 2.72 6.02 -1.26 -1.03 117.38 129.51 2p7p n GLN 101 Ca -0.18 0.56 0.00 0.00 -0.01 0.00 0.00 57.00 57.37 2p7p n GLN 101 Cb 0.52 -2.83 0.00 0.00 1.02 0.00 0.00 30.24 28.95 2p7p n GLN 101 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2p7p n GLY 102 N 5.57 0.75 2.78 1.08 0.00 -1.26 -5.05 105.19 109.05 2p7p n GLY 102 Ca 0.31 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.06 2p7p n GLY 102 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2p7p s GLU 103 N -0.50 0.81 0.00 1.61 2.02 -0.20 -3.10 118.70 119.34 2p7p s GLU 103 Ca 0.00 -0.33 0.00 0.00 0.02 0.00 0.00 54.97 54.66 2p7p s GLU 103 Cb 0.00 -1.84 0.00 0.00 0.10 0.00 0.00 34.13 32.39 2p7p s GLU 103 CO 0.00 -0.52 0.00 0.41 0.02 0.00 0.00 175.26 175.17 2p7p n GLY 104 N 5.03 -3.08 3.76 -1.39 0.00 -1.26 -4.08 105.19 104.18 2p7p n GLY 104 Ca -0.09 -1.04 -0.39 0.00 0.00 0.00 0.00 46.02 44.50 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 4.74 -0.01 1.61 1.81 -1.26 -4.76 118.95 121.08 2p7p s ARG 105 Ca 0.00 1.38 0.04 0.00 -1.72 0.00 0.00 55.73 55.43 2p7p s ARG 105 Cb 0.00 -3.20 -0.01 0.00 -0.45 0.00 0.00 34.95 31.29 2p7p s ARG 105 CO 0.00 0.49 -0.14 -1.12 -0.68 0.00 0.00 175.30 173.85 2p7p s SER 106 N -1.25 1.67 -0.13 0.23 0.01 -1.26 -1.19 113.70 111.77 2p7p s SER 106 Ca 0.41 -0.26 0.02 0.00 1.31 0.00 0.00 55.95 57.44 2p7p s SER 106 Cb -0.24 -0.18 0.00 0.00 0.21 0.00 0.00 66.02 65.81 2p7p s SER 106 CO 0.29 0.17 -0.21 -0.63 0.41 0.00 0.00 173.24 173.28 2p7p s ILE 107 N -0.34 2.25 -0.11 1.44 1.01 -0.01 -4.79 121.20 120.65 2p7p s ILE 107 Ca 0.05 -0.93 0.02 0.00 0.00 0.00 0.00 60.65 59.80 2p7p s ILE 107 Cb -0.05 -1.90 -0.01 0.00 0.01 0.00 0.00 42.46 40.51 2p7p s ILE 107 CO -0.01 0.54 -0.19 -0.31 0.00 0.00 0.00 174.94 174.98 2p7p s TYR 108 N 0.62 2.67 0.12 3.97 1.51 -1.26 -1.29 117.35 123.70 2p7p s TYR 108 Ca -0.11 -0.83 -0.19 0.00 -1.01 0.00 0.00 57.07 54.93 2p7p s TYR 108 Cb -0.16 -1.76 0.05 0.00 -0.11 0.00 0.00 41.96 39.97 2p7p s TYR 108 CO 0.03 -0.30 0.46 -0.59 -1.11 0.00 0.00 175.55 174.04 2p7p s PHE 109 N 0.30 -0.32 0.25 2.71 -0.12 -0.71 -1.37 117.98 118.72 2p7p s PHE 109 Ca -0.14 0.07 0.09 0.00 -0.05 0.00 0.00 56.93 56.89 2p7p s PHE 109 Cb -0.17 0.34 -0.04 0.00 -0.63 0.00 0.00 43.02 42.53 2p7p s PHE 109 CO 0.07 -0.73 0.05 0.71 -0.05 0.00 0.00 175.22 175.27 2p7p s TYR 110 N -3.62 2.82 0.00 3.49 1.51 -0.49 0.44 117.35 121.51 2p7p s TYR 110 Ca 0.01 -0.18 0.00 0.00 -1.01 0.00 0.00 57.07 55.89 2p7p s TYR 110 Cb 0.01 -1.27 0.00 0.00 -0.11 0.00 0.00 41.96 40.59 2p7p s TYR 110 CO -0.11 0.58 0.00 -0.40 -1.11 0.00 0.00 175.55 174.51 2p7p n ASP 111 N -0.88 0.00 -0.77 2.29 3.85 -1.04 -4.29 116.55 115.71 2p7p n ASP 111 Ca -0.07 0.00 0.10 0.00 -0.71 0.00 0.00 54.79 54.11 2p7p n ASP 111 Cb 0.58 0.00 0.29 0.00 -1.35 0.00 0.00 41.12 40.64 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 0.38 -2.56 2.11 3.01 -1.26 -4.26 117.46 114.88 2p7p n PHE 112 Ca 0.00 -0.19 -0.10 0.00 1.01 0.00 0.00 57.45 58.17 2p7p n PHE 112 Cb 0.00 0.00 0.03 0.00 -0.01 0.00 0.00 39.48 39.50 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 0.72 2.73 -1.80 4.37 8.00 -1.26 -4.95 116.55 124.37 2p7p n ASP 113 Ca 0.17 -2.75 -0.19 0.00 0.71 0.00 0.00 54.79 52.73 2p7p n ASP 113 Cb 0.41 -0.45 -0.06 0.00 -0.02 0.00 0.00 41.12 40.99 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 -0.53 -5.26 -4.63 -2.24 3.02 -1.26 -4.68 115.26 99.68 2p7p n ASN 114 Ca 0.20 0.35 -0.40 0.00 -0.03 0.00 0.00 54.58 54.71 2p7p n ASN 114 Cb 0.84 -4.60 -0.07 0.00 -0.61 0.00 0.00 39.78 35.34 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 3.29 -0.23 3.10 3.76 -1.26 -4.69 115.29 116.51 2p7p s HIS 115 Ca 0.00 0.64 -0.23 0.00 -0.15 0.00 0.00 55.06 55.32 2p7p s HIS 115 Cb 0.00 -2.70 -0.01 0.00 1.11 0.00 0.00 32.58 30.98 2p7p s HIS 115 CO 0.00 -0.24 0.75 -1.17 -0.85 0.00 0.00 174.74 173.23 2p7p s LEU 116 N 2.15 4.10 0.23 0.89 2.96 -1.26 -2.51 118.68 125.24 2p7p s LEU 116 Ca 0.21 0.95 0.08 0.00 -0.22 0.00 0.00 54.13 55.15 2p7p s LEU 116 Cb -0.16 -3.07 -0.04 0.00 0.50 0.00 0.00 46.19 43.42 2p7p s LEU 116 CO 0.09 -0.43 0.06 -0.36 -1.32 0.00 0.00 176.35 174.39 2p7p s PHE 117 N 2.51 2.88 -0.02 5.38 0.40 0.17 -3.21 117.98 126.09 2p7p s PHE 117 Ca 0.32 -0.15 -0.01 0.00 -0.60 0.00 0.00 56.93 56.49 2p7p s PHE 117 Cb -0.16 -1.33 0.02 0.00 0.51 0.00 0.00 43.02 42.07 2p7p s PHE 117 CO 0.09 0.56 0.04 -2.00 0.70 0.00 0.00 175.22 174.61 2p7p s GLU 118 N -3.46 0.00 -0.28 0.44 2.12 -0.33 -1.73 118.70 115.46 2p7p s GLU 118 Ca 0.31 0.15 -0.08 0.00 0.36 0.00 0.00 54.97 55.71 2p7p s GLU 118 Cb -0.08 -0.14 -0.01 0.00 0.26 0.00 0.00 34.13 34.16 2p7p s GLU 118 CO 0.21 -0.10 0.09 -0.51 -0.54 0.00 0.00 175.26 174.41 2p7p s LEU 119 N 0.68 3.70 -0.13 2.70 1.43 -0.41 -0.05 118.68 126.60 2p7p s LEU 119 Ca -0.06 -0.40 0.03 0.00 -1.03 0.00 0.00 54.13 52.67 2p7p s LEU 119 Cb -0.08 -1.93 0.01 0.00 0.03 0.00 0.00 46.19 44.21 2p7p s LEU 119 CO -0.02 -0.11 -0.22 -2.28 0.23 0.00 0.00 176.35 173.95 2p7p s HIS 120 N 1.59 2.65 -2.05 0.29 2.46 0.29 -0.83 115.29 119.69 2p7p s HIS 120 Ca 0.05 -1.22 0.19 0.00 0.47 0.00 0.00 55.06 54.55 2p7p s HIS 120 Cb -0.16 -1.80 0.53 0.00 -0.13 0.00 0.00 32.58 31.03 2p7p s HIS 120 CO 0.04 -0.54 1.44 0.00 -2.47 0.00 0.00 174.74 173.21 2p7p n ALA 121 N 3.91 2.41 -3.29 1.58 0.00 -0.34 -1.83 120.51 122.95 2p7p n ALA 121 Ca -0.20 -1.03 -0.04 0.00 0.00 0.00 0.00 53.44 52.18 2p7p n ALA 121 Cb 0.52 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 19.02 2p7p n ALA 121 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2p7p n GLY 122 N 1.45 2.49 3.23 0.00 0.00 -1.26 -4.47 105.19 106.63 2p7p n GLY 122 Ca 0.20 -2.17 -0.11 0.00 0.00 0.00 0.00 46.02 43.94 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 0.01 0.03 0.12 2.61 -4.23 -1.26 -4.95 115.64 107.97 2p7p s THR 123 Ca 0.07 -1.89 -0.14 0.00 -1.18 0.00 0.00 61.69 58.55 2p7p s THR 123 Cb -0.01 -2.32 -0.04 0.00 1.34 0.00 0.00 72.50 71.47 2p7p s THR 123 CO 0.04 -0.14 1.50 0.25 -0.54 0.00 0.00 174.62 175.74 2p7p h LEU 124 N 2.64 0.78 0.53 4.79 5.85 -1.98 -2.82 115.31 125.10 2p7p h LEU 124 Ca -0.35 -0.40 -0.02 0.00 0.84 0.00 0.00 57.88 57.96 2p7p h LEU 124 Cb 1.24 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 42.03 2p7p h LEU 124 CO 0.53 1.00 -0.48 -0.33 -0.34 0.00 0.00 178.44 178.82 2p7p h GLU 125 N 0.55 -0.96 -0.28 1.25 5.08 -1.97 0.75 114.58 119.01 2p7p h GLU 125 Ca 0.09 0.07 0.07 0.00 -1.00 0.00 0.00 59.36 58.58 2p7p h GLU 125 Cb 0.70 0.22 -0.01 0.00 0.50 0.00 0.00 28.75 30.15 2p7p h GLU 125 CO 0.05 -0.64 0.20 0.93 -1.00 0.00 0.00 179.01 178.55 2p7p h GLU 126 N -1.00 0.06 -0.11 2.33 4.39 -1.87 0.43 114.58 118.81 2p7p h GLU 126 Ca -0.06 -0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.43 2p7p h GLU 126 Cb 0.86 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.49 2p7p h GLU 126 CO -0.04 0.04 -0.75 -0.09 -1.16 0.00 0.00 179.01 177.01 2p7p h ARG 127 N 0.06 0.58 0.00 2.33 9.65 -1.15 -3.31 114.38 122.54 2p7p h ARG 127 Ca 0.13 -0.47 0.00 0.00 -1.10 0.00 0.00 59.98 58.54 2p7p h ARG 127 Cb 0.44 0.10 0.00 0.00 -1.39 0.00 0.00 29.97 29.12 2p7p h ARG 127 CO -0.01 1.10 -0.86 -0.07 2.80 0.00 0.00 179.97 182.93 2p7p h LEU 128 N 0.40 0.00 -1.52 3.80 3.38 0.13 -3.30 115.31 118.19 2p7p h LEU 128 Ca -0.04 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 2p7p h LEU 128 Cb 1.35 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.09 2p7p h LEU 128 CO 0.14 0.02 -0.12 0.11 0.09 0.00 0.00 178.44 178.68 2p7p h LYS 129 N 0.00 0.00 -0.63 1.13 1.79 -1.04 -2.99 116.57 114.83 2p7p h LYS 129 Ca 0.00 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.44 2p7p h LYS 129 Cb 0.95 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.57 2p7p h LYS 129 CO 0.00 0.12 0.26 0.00 -1.08 0.00 0.00 179.45 178.75 2p7p h ARG 130 N 0.00 0.93 0.00 3.15 -0.00 -1.67 -3.52 114.38 113.28 2p7p h ARG 130 Ca -0.00 -0.16 0.00 0.00 -0.50 0.00 0.00 59.98 59.31 2p7p h ARG 130 Cb 0.54 -0.15 0.00 0.00 0.00 0.00 0.00 29.97 30.35 2p7p h ARG 130 CO 0.02 0.78 0.00 2.48 0.00 0.00 0.00 179.97 183.25