#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p7l n ILE 2 N 0.00 0.09 0.89 3.17 5.41 -1.26 -4.84 119.36 122.82 2p7l n ILE 2 Ca 0.00 -0.02 0.11 0.00 1.00 0.00 0.00 62.75 63.85 2p7l n ILE 2 Cb 0.00 -0.67 0.07 0.00 -0.71 0.00 0.00 39.64 38.33 2p7l n ILE 2 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 2p7l n SER 3 N 3.56 0.70 0.00 4.38 3.41 -1.26 -5.06 113.62 119.34 2p7l n SER 3 Ca 0.25 -0.50 0.00 0.00 -0.26 0.00 0.00 58.87 58.36 2p7l n SER 3 Cb 0.08 0.65 0.00 0.00 -0.26 0.00 0.00 64.21 64.68 2p7l n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2p7l n GLY 4 N 1.47 0.14 3.74 5.00 0.00 -1.26 -5.11 105.19 109.17 2p7l n GLY 4 Ca 0.04 -1.47 -0.41 0.00 0.00 0.00 0.00 46.02 44.18 2p7l n GLY 4 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2p7l s LEU 5 N 0.00 4.57 -0.24 0.99 2.96 -1.26 -4.97 118.68 120.73 2p7l s LEU 5 Ca 0.00 1.88 -0.17 0.00 -0.22 0.00 0.00 54.13 55.63 2p7l s LEU 5 Cb 0.00 -3.60 -0.13 0.00 0.50 0.00 0.00 46.19 42.96 2p7l s LEU 5 CO 0.00 0.03 -0.16 -0.24 -1.32 0.00 0.00 176.35 174.66 2p7l n SER 6 N 2.16 1.92 -3.60 3.68 2.88 -1.26 -5.00 113.62 114.40 2p7l n SER 6 Ca 0.00 0.38 0.02 0.00 -1.33 0.00 0.00 58.87 57.94 2p7l n SER 6 Cb 0.48 -0.86 -0.01 0.00 -0.75 0.00 0.00 64.21 63.07 2p7l n SER 6 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 2p7l s HIS 7 N -2.48 -0.03 -0.06 0.66 -3.43 -1.26 -4.45 115.29 104.23 2p7l s HIS 7 Ca -0.34 -0.03 0.06 0.00 -0.80 0.00 0.00 55.06 53.95 2p7l s HIS 7 Cb 0.11 0.53 -0.01 0.00 -1.43 0.00 0.00 32.58 31.77 2p7l s HIS 7 CO 0.51 -0.16 -0.24 0.42 -2.00 0.00 0.00 174.74 173.26 2p7l s ILE 8 N -2.26 2.01 -0.14 -5.38 1.01 -0.66 -5.01 121.20 110.77 2p7l s ILE 8 Ca 0.14 -1.03 -0.00 0.00 0.00 0.00 0.00 60.65 59.75 2p7l s ILE 8 Cb 0.05 -1.71 -0.01 0.00 0.01 0.00 0.00 42.46 40.80 2p7l s ILE 8 CO -0.05 0.56 -0.12 -0.89 0.00 0.00 0.00 174.94 174.44 2p7l s THR 9 N -0.05 3.08 0.03 2.92 2.01 -1.26 0.22 115.64 122.59 2p7l s THR 9 Ca -0.07 -0.65 0.09 0.00 0.31 0.00 0.00 61.69 61.37 2p7l s THR 9 Cb -0.14 -2.30 -0.03 0.00 0.01 0.00 0.00 72.50 70.04 2p7l s THR 9 CO 0.05 0.52 -0.25 -0.76 -0.69 0.00 0.00 174.62 173.48 2p7l s LEU 10 N 0.45 2.13 -0.18 4.42 1.43 0.22 -4.97 118.68 122.19 2p7l s LEU 10 Ca -0.09 -0.54 -0.05 0.00 -1.03 0.00 0.00 54.13 52.42 2p7l s LEU 10 Cb -0.16 -1.23 -0.03 0.00 0.03 0.00 0.00 46.19 44.80 2p7l s LEU 10 CO 0.05 0.26 -0.01 -0.63 0.23 0.00 0.00 176.35 176.24 2p7l s ILE 11 N -0.74 4.04 0.05 -0.59 -1.09 -1.26 -0.90 121.20 120.71 2p7l s ILE 11 Ca 0.10 -0.30 0.02 0.00 -2.23 0.00 0.00 60.65 58.25 2p7l s ILE 11 Cb -0.10 -2.80 -0.03 0.00 -1.58 0.00 0.00 42.46 37.96 2p7l s ILE 11 CO 0.01 0.46 -0.07 0.68 -1.23 0.00 0.00 174.94 174.79 2p7l s VAL 12 N 0.62 0.55 0.17 2.92 -7.23 0.05 -4.71 120.40 112.76 2p7l s VAL 12 Ca -0.01 -1.25 0.04 0.00 -1.81 0.00 0.00 61.98 58.95 2p7l s VAL 12 Cb -0.14 -0.82 -0.15 0.00 0.56 0.00 0.00 36.38 35.83 2p7l s VAL 12 CO 0.02 -0.49 1.39 0.07 -0.31 0.00 0.00 175.10 175.77 2p7l h LYS 13 N 4.18 0.15 -3.96 4.82 2.10 -1.79 -0.28 116.57 121.78 2p7l h LYS 13 Ca -0.36 -0.17 -0.60 0.00 -2.00 0.00 0.00 60.65 57.53 2p7l h LYS 13 Cb 1.19 0.05 -0.40 0.00 -0.90 0.00 0.00 32.23 32.18 2p7l h LYS 13 CO 0.46 0.93 -0.75 0.34 -2.00 0.00 0.00 179.45 178.42 2p7l s ASP 14 N -6.89 4.09 0.14 7.07 -1.08 -1.26 -4.72 116.67 114.02 2p7l s ASP 14 Ca -0.02 -1.62 -0.23 0.00 -0.52 0.00 0.00 52.55 50.17 2p7l s ASP 14 Cb 0.10 -1.08 0.01 0.00 -1.46 0.00 0.00 42.92 40.49 2p7l s ASP 14 CO 0.82 -0.37 1.64 -0.07 0.52 0.00 0.00 175.17 177.71 2p7l h LEU 15 N 7.96 -0.71 -0.31 -1.34 -0.00 -1.96 -2.21 115.31 116.74 2p7l h LEU 15 Ca -0.12 0.13 0.01 0.00 -0.00 0.00 0.00 57.88 57.89 2p7l h LEU 15 Cb 1.03 0.33 -0.02 0.00 -0.00 0.00 0.00 40.66 42.01 2p7l h LEU 15 CO 0.46 -0.27 0.19 0.78 -0.00 0.00 0.00 178.44 179.61 2p7l h ASN 16 N -0.25 0.32 -0.76 -0.43 -0.26 -1.98 0.54 115.58 112.76 2p7l h ASN 16 Ca 0.12 -0.00 0.04 0.00 -0.56 0.00 0.00 56.30 55.90 2p7l h ASN 16 Cb 0.44 -0.07 -0.04 0.00 -1.06 0.00 0.00 38.32 37.58 2p7l h ASN 16 CO -0.34 0.23 0.50 0.11 -1.06 0.00 0.00 177.43 176.87 2p7l h LYS 17 N 0.39 0.89 -0.17 0.81 1.79 -1.97 -1.93 116.57 116.39 2p7l h LYS 17 Ca 0.12 -0.05 -0.22 0.00 -2.18 0.00 0.00 60.65 58.32 2p7l h LYS 17 Cb -0.01 -0.20 0.01 0.00 -1.58 0.00 0.00 32.23 30.44 2p7l h LYS 17 CO -0.05 0.59 -0.74 1.15 -1.08 0.00 0.00 179.45 179.32 2p7l h THR 18 N 0.92 1.28 -0.38 -0.16 2.02 -0.71 -2.66 112.91 113.21 2p7l h THR 18 Ca 0.30 -1.94 0.07 0.00 0.77 0.00 0.00 66.41 65.61 2p7l h THR 18 Cb 0.06 1.93 -0.06 0.00 -1.74 0.00 0.00 68.15 68.33 2p7l h THR 18 CO -0.09 0.62 -0.01 0.74 0.37 0.00 0.00 175.52 177.15 2p7l h THR 19 N 0.55 0.70 0.55 3.16 2.02 0.76 -0.17 112.91 120.49 2p7l h THR 19 Ca -0.04 -0.03 -0.02 0.00 0.77 0.00 0.00 66.41 67.09 2p7l h THR 19 Cb 1.36 0.61 -0.00 0.00 -1.74 0.00 0.00 68.15 68.38 2p7l h THR 19 CO 0.15 0.02 -0.32 0.00 0.37 0.00 0.00 175.52 175.74 2p7l h ALA 20 N 1.34 -0.83 -0.70 6.16 0.00 -1.36 -1.87 119.26 122.00 2p7l h ALA 20 Ca 0.19 -0.17 0.12 0.00 0.00 0.00 0.00 54.91 55.04 2p7l h ALA 20 Cb 0.26 0.39 -0.12 0.00 0.00 0.00 0.00 17.79 18.32 2p7l h ALA 20 CO -0.32 -0.98 -0.36 0.35 0.00 0.00 0.00 179.25 177.94 2p7l h PHE 21 N -0.83 -1.01 -0.84 0.00 3.57 -1.08 0.51 116.94 117.26 2p7l h PHE 21 Ca -0.07 0.08 0.03 0.00 3.53 0.00 0.00 57.97 61.55 2p7l h PHE 21 Cb 0.66 0.54 -0.05 0.00 2.79 0.00 0.00 35.95 39.90 2p7l h PHE 21 CO -0.08 -0.39 0.54 -0.07 -2.23 0.00 0.00 178.31 176.07 2p7l h LEU 22 N -0.13 0.89 -0.10 0.59 3.38 -0.90 -1.78 115.31 117.26 2p7l h LEU 22 Ca 0.26 -0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.12 2p7l h LEU 22 Cb 0.56 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.12 2p7l h LEU 22 CO -0.76 0.61 -0.35 1.56 0.09 0.00 0.00 178.44 179.59 2p7l h GLN 23 N 1.04 0.41 -0.96 1.13 4.20 -0.27 -0.71 115.11 119.97 2p7l h GLN 23 Ca 0.34 -0.31 0.02 0.00 0.06 0.00 0.00 58.65 58.76 2p7l h GLN 23 Cb 0.02 0.06 -0.05 0.00 0.30 0.00 0.00 27.48 27.80 2p7l h GLN 23 CO -0.12 0.94 0.63 -0.91 -0.67 0.00 0.00 178.83 178.70 2p7l h ASN 24 N -0.02 1.07 0.00 1.46 2.35 0.14 -1.17 115.58 119.40 2p7l h ASN 24 Ca -0.02 -0.02 -0.21 0.00 -0.55 0.00 0.00 56.30 55.51 2p7l h ASN 24 Cb 0.98 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 39.06 2p7l h ASN 24 CO 0.07 0.75 -1.43 -0.38 -1.65 0.00 0.00 177.43 174.80 2p7l n ILE 25 N -4.45 1.50 -0.08 2.81 5.41 -0.69 -4.57 119.36 119.30 2p7l n ILE 25 Ca 0.12 -0.05 0.10 0.00 1.00 0.00 0.00 62.75 63.92 2p7l n ILE 25 Cb 0.05 -2.13 0.29 0.00 -0.71 0.00 0.00 39.64 37.15 2p7l n ILE 25 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 2p7l n PHE 26 N -4.42 0.88 -3.88 1.39 3.01 -0.38 -4.91 117.46 109.15 2p7l n PHE 26 Ca -0.30 -0.44 -0.30 0.00 1.01 0.00 0.00 57.45 57.42 2p7l n PHE 26 Cb 0.62 -0.00 0.02 0.00 -0.01 0.00 0.00 39.48 40.11 2p7l n PHE 26 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 2p7l n ASN 27 N 1.41 -4.57 -4.66 4.37 4.13 -0.44 -4.79 115.26 110.70 2p7l n ASN 27 Ca 0.22 -0.76 -0.45 0.00 1.68 0.00 0.00 54.58 55.28 2p7l n ASN 27 Cb 0.55 -3.67 -0.02 0.00 -1.54 0.00 0.00 39.78 35.10 2p7l n ASN 27 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2p7l n ALA 28 N -4.49 0.93 -3.08 5.41 0.00 -0.55 -4.89 120.51 113.83 2p7l n ALA 28 Ca 0.04 0.40 -0.39 0.00 0.00 0.00 0.00 53.44 53.50 2p7l n ALA 28 Cb 0.52 -2.24 -0.12 0.00 0.00 0.00 0.00 19.45 17.62 2p7l n ALA 28 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2p7l s GLU 29 N -0.78 2.70 0.10 0.00 2.12 -0.26 -4.48 118.70 118.10 2p7l s GLU 29 Ca 0.65 -1.14 -0.30 0.00 0.36 0.00 0.00 54.97 54.54 2p7l s GLU 29 Cb -0.65 -3.55 -0.06 0.00 0.26 0.00 0.00 34.13 30.12 2p7l s GLU 29 CO 0.53 -0.67 1.17 -2.00 -0.54 0.00 0.00 175.26 173.75 2p7l s GLU 30 N 1.46 4.48 0.00 4.30 2.12 -1.26 -0.29 118.70 129.51 2p7l s GLU 30 Ca -0.00 1.76 0.00 0.00 0.36 0.00 0.00 54.97 57.09 2p7l s GLU 30 Cb -0.19 -3.32 0.00 0.00 0.26 0.00 0.00 34.13 30.87 2p7l s GLU 30 CO 0.04 -0.16 0.19 0.44 -0.54 0.00 0.00 175.26 175.23 2p7l n ILE 31 N 3.42 0.00 -3.57 -3.70 -5.35 0.32 -4.96 119.36 105.51 2p7l n ILE 31 Ca 0.07 -0.28 -0.15 0.00 -0.27 0.00 0.00 62.75 62.12 2p7l n ILE 31 Cb 0.46 1.31 -0.06 0.00 -1.74 0.00 0.00 39.64 39.61 2p7l n ILE 31 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 2p7l s TYR 32 N -0.17 -0.64 -0.13 4.28 5.04 -1.15 -4.94 117.35 119.65 2p7l s TYR 32 Ca 0.00 1.31 -0.08 0.00 -2.44 0.00 0.00 57.07 55.86 2p7l s TYR 32 Cb 0.00 0.37 0.05 0.00 0.35 0.00 0.00 41.96 42.72 2p7l s TYR 32 CO 0.00 -0.46 0.32 0.45 -1.34 0.00 0.00 175.55 174.52 2p7l s SER 33 N -0.54 -0.36 0.06 4.32 0.15 -1.26 -1.37 113.70 114.70 2p7l s SER 33 Ca -0.05 0.67 0.01 0.00 0.70 0.00 0.00 55.95 57.28 2p7l s SER 33 Cb -0.02 0.59 -0.03 0.00 -1.71 0.00 0.00 66.02 64.84 2p7l s SER 33 CO 0.04 -0.16 -0.05 -0.55 1.20 0.00 0.00 173.24 173.72 2p7l s SER 34 N 1.05 0.72 0.00 5.45 0.15 0.80 -4.98 113.70 116.89 2p7l s SER 34 Ca -0.07 -0.83 0.00 0.00 0.70 0.00 0.00 55.95 55.74 2p7l s SER 34 Cb -0.08 0.12 0.00 0.00 -1.71 0.00 0.00 66.02 64.35 2p7l s SER 34 CO -0.08 -0.43 0.00 0.61 1.20 0.00 0.00 173.24 174.54 2p7l n GLY 35 N 0.56 4.94 3.17 9.45 0.00 -1.26 -0.10 105.19 121.96 2p7l n GLY 35 Ca -0.17 -0.91 0.04 0.00 0.00 0.00 0.00 46.02 44.98 2p7l n GLY 35 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2p7l s ASP 36 N 0.00 -1.25 0.41 1.61 3.68 -0.81 -4.94 116.67 115.37 2p7l s ASP 36 Ca 0.00 0.83 0.28 0.00 2.13 0.00 0.00 52.55 55.79 2p7l s ASP 36 Cb 0.00 2.07 1.02 0.00 -1.45 0.00 0.00 42.92 44.56 2p7l s ASP 36 CO 0.00 -0.23 1.82 0.11 0.13 0.00 0.00 175.17 177.00 2p7l h LYS 37 N 8.00 0.00 -0.00 4.34 1.79 -1.96 -0.45 116.57 128.29 2p7l h LYS 37 Ca -0.22 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.25 2p7l h LYS 37 Cb 1.16 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.81 2p7l h LYS 37 CO 0.21 0.00 -0.05 0.25 -1.08 0.00 0.00 179.45 178.78 2p7l n THR 38 N -2.76 0.00 -0.02 -0.16 -2.24 -1.26 -2.91 114.28 104.92 2p7l n THR 38 Ca 0.02 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 2p7l n THR 38 Cb 0.34 -0.37 0.00 0.00 -2.10 0.00 0.00 70.33 68.20 2p7l n THR 38 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2p7l n PHE 39 N -1.25 0.00 -3.45 4.78 7.35 -0.97 -5.01 117.46 118.91 2p7l n PHE 39 Ca 0.13 -0.26 -0.20 0.00 -0.76 0.00 0.00 57.45 56.37 2p7l n PHE 39 Cb 0.27 -0.03 0.08 0.00 0.35 0.00 0.00 39.48 40.15 2p7l n PHE 39 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 2p7l n SER 40 N -0.26 -4.39 -4.18 -2.13 7.64 -1.00 -5.01 113.62 104.29 2p7l n SER 40 Ca 0.00 -0.54 -0.34 0.00 1.01 0.00 0.00 58.87 59.00 2p7l n SER 40 Cb 0.14 -4.81 -0.15 0.00 -1.01 0.00 0.00 64.21 58.38 2p7l n SER 40 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2p7l s LEU 41 N -6.59 2.90 0.38 -3.43 1.43 -0.22 -5.01 118.68 108.15 2p7l s LEU 41 Ca 0.32 -0.81 -0.27 0.00 -1.03 0.00 0.00 54.13 52.34 2p7l s LEU 41 Cb -0.14 -1.61 -0.10 0.00 0.03 0.00 0.00 46.19 44.37 2p7l s LEU 41 CO 0.69 -0.09 1.40 -0.44 0.23 0.00 0.00 176.35 178.14 2p7l s SER 42 N 1.31 6.38 0.57 2.29 0.01 -1.26 -1.93 113.70 121.07 2p7l s SER 42 Ca 0.01 2.86 -0.20 0.00 1.31 0.00 0.00 55.95 59.93 2p7l s SER 42 Cb -0.16 -2.66 -0.04 0.00 0.21 0.00 0.00 66.02 63.38 2p7l s SER 42 CO -0.07 -0.83 1.28 -1.59 0.41 0.00 0.00 173.24 172.45 2p7l s LYS 43 N -2.10 3.03 -0.16 12.44 0.00 -1.26 -4.37 119.74 127.32 2p7l s LYS 43 Ca 0.54 2.04 -0.15 0.00 0.00 0.00 0.00 55.97 58.39 2p7l s LYS 43 Cb -0.43 -2.09 0.04 0.00 0.00 0.00 0.00 37.83 35.35 2p7l s LYS 43 CO 0.57 -1.22 0.43 -2.00 0.00 0.00 0.00 175.35 173.13 2p7l s GLU 44 N -3.10 0.51 0.02 1.78 2.12 0.86 -3.27 118.70 117.61 2p7l s GLU 44 Ca 0.75 0.59 0.02 0.00 0.36 0.00 0.00 54.97 56.69 2p7l s GLU 44 Cb -0.36 0.25 -0.01 0.00 0.26 0.00 0.00 34.13 34.27 2p7l s GLU 44 CO 0.40 -0.06 -0.06 0.15 -0.54 0.00 0.00 175.26 175.15 2p7l s LYS 45 N 0.21 0.43 -0.15 4.30 1.02 -0.93 -0.14 119.74 124.48 2p7l s LYS 45 Ca -0.00 -0.47 -0.03 0.00 0.02 0.00 0.00 55.97 55.49 2p7l s LYS 45 Cb -0.03 -0.28 -0.02 0.00 -0.52 0.00 0.00 37.83 36.97 2p7l s LYS 45 CO 0.01 0.06 -0.06 -0.06 -0.92 0.00 0.00 175.35 174.38 2p7l s PHE 46 N -0.81 2.97 0.27 3.18 2.99 -0.47 -2.12 117.98 123.99 2p7l s PHE 46 Ca -0.05 -0.37 0.07 0.00 0.00 0.00 0.00 56.93 56.58 2p7l s PHE 46 Cb -0.06 -1.93 -0.06 0.00 0.00 0.00 0.00 43.02 40.98 2p7l s PHE 46 CO 0.00 -0.07 -0.09 -0.06 -0.00 0.00 0.00 175.22 175.01 2p7l s PHE 47 N 0.33 1.96 -0.08 0.36 0.40 0.72 -0.52 117.98 121.15 2p7l s PHE 47 Ca -0.05 -0.64 0.01 0.00 -0.60 0.00 0.00 56.93 55.65 2p7l s PHE 47 Cb -0.15 -1.06 0.02 0.00 0.51 0.00 0.00 43.02 42.34 2p7l s PHE 47 CO 0.04 0.35 -0.11 -0.51 0.70 0.00 0.00 175.22 175.68 2p7l s LEU 48 N -3.43 1.51 -0.20 -0.37 1.43 0.61 -0.88 118.68 117.34 2p7l s LEU 48 Ca 0.28 -0.30 -0.01 0.00 -1.03 0.00 0.00 54.13 53.08 2p7l s LEU 48 Cb 0.02 -0.82 0.05 0.00 0.03 0.00 0.00 46.19 45.47 2p7l s LEU 48 CO 0.11 -0.01 -0.03 -0.63 0.23 0.00 0.00 176.35 176.02 2p7l s ILE 49 N 0.98 1.12 -1.54 -0.59 1.01 -0.68 -1.11 121.20 120.39 2p7l s ILE 49 Ca -0.09 -0.82 -0.14 0.00 0.00 0.00 0.00 60.65 59.61 2p7l s ILE 49 Cb -0.15 -1.40 0.10 0.00 0.01 0.00 0.00 42.46 41.02 2p7l s ILE 49 CO -0.00 -0.03 0.86 0.00 0.00 0.00 0.00 174.94 175.78 2p7l n ALA 50 N 4.85 -1.23 -0.44 9.38 0.00 -1.26 -0.45 120.51 131.35 2p7l n ALA 50 Ca -0.11 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2p7l n ALA 50 Cb 0.46 -4.04 0.00 0.00 0.00 0.00 0.00 19.45 15.88 2p7l n ALA 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2p7l n GLY 51 N -1.55 1.63 3.71 0.00 0.00 -1.26 -5.02 105.19 102.70 2p7l n GLY 51 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 2p7l n GLY 51 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2p7l s LEU 52 N 0.00 4.26 -0.45 0.99 1.43 0.40 -5.02 118.68 120.30 2p7l s LEU 52 Ca 0.00 0.90 -0.29 0.00 -1.03 0.00 0.00 54.13 53.72 2p7l s LEU 52 Cb 0.00 -2.81 0.01 0.00 0.03 0.00 0.00 46.19 43.41 2p7l s LEU 52 CO 0.00 -0.07 1.43 0.86 0.23 0.00 0.00 176.35 178.80 2p7l s TRP 53 N 0.88 2.34 -0.14 0.29 -0.00 -1.26 -1.68 118.94 119.37 2p7l s TRP 53 Ca 0.29 0.63 -0.03 0.00 -0.00 0.00 0.00 56.10 56.99 2p7l s TRP 53 Cb -0.16 -4.32 -0.03 0.00 -0.00 0.00 0.00 33.47 28.96 2p7l s TRP 53 CO 0.12 -2.01 -0.04 0.42 -0.00 0.00 0.00 176.95 175.45 2p7l s ILE 54 N 5.68 3.91 -0.07 5.86 -1.09 -0.06 -1.66 121.20 133.78 2p7l s ILE 54 Ca 0.60 -0.36 0.05 0.00 -2.23 0.00 0.00 60.65 58.71 2p7l s ILE 54 Cb -0.13 -2.70 -0.00 0.00 -1.58 0.00 0.00 42.46 38.04 2p7l s ILE 54 CO 0.31 0.51 -0.21 0.00 -1.23 0.00 0.00 174.94 174.31 2p7l s ILE 56 N 0.14 1.77 0.03 0.00 -4.36 -0.90 0.69 121.20 118.57 2p7l s ILE 56 Ca -0.10 -0.95 0.03 0.00 -0.26 0.00 0.00 60.65 59.37 2p7l s ILE 56 Cb -0.15 -1.48 -0.02 0.00 1.25 0.00 0.00 42.46 42.07 2p7l s ILE 56 CO 0.05 0.50 -0.09 -0.04 0.24 0.00 0.00 174.94 175.60 2p7l s MET 57 N -0.44 0.63 0.31 0.37 -1.94 -0.08 -2.20 119.30 115.96 2p7l s MET 57 Ca 0.06 -0.57 -0.28 0.00 -1.71 0.00 0.00 55.69 53.19 2p7l s MET 57 Cb -0.09 -0.54 -0.09 0.00 2.01 0.00 0.00 34.83 36.11 2p7l s MET 57 CO -0.00 0.13 1.09 -1.83 -0.01 0.00 0.00 175.02 174.40 2p7l s GLU 58 N -0.96 4.52 0.00 2.03 -1.05 -1.20 -0.77 118.70 121.27 2p7l s GLU 58 Ca -0.02 1.74 0.00 0.00 -0.15 0.00 0.00 54.97 56.53 2p7l s GLU 58 Cb -0.07 -3.03 0.00 0.00 -0.44 0.00 0.00 34.13 30.59 2p7l s GLU 58 CO 0.00 0.12 0.00 0.41 0.95 0.00 0.00 175.26 176.75 2p7l n GLY 59 N 0.99 -1.30 3.76 -3.83 0.00 -0.12 -4.79 105.19 99.90 2p7l n GLY 59 Ca 0.00 -0.99 -0.37 0.00 0.00 0.00 0.00 46.02 44.66 2p7l n GLY 59 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2p7l s ASP 60 N -4.00 5.73 0.72 1.61 1.01 -1.26 -2.64 116.67 117.84 2p7l s ASP 60 Ca 0.00 2.47 -0.11 0.00 0.71 0.00 0.00 52.55 55.62 2p7l s ASP 60 Cb 0.00 -2.61 0.02 0.00 1.01 0.00 0.00 42.92 41.34 2p7l s ASP 60 CO 0.00 -1.23 1.07 -0.44 0.21 0.00 0.00 175.17 174.78 2p7l s SER 61 N -1.25 5.23 0.34 0.27 0.01 -1.26 -4.56 113.70 112.47 2p7l s SER 61 Ca 0.68 1.44 -0.29 0.00 1.31 0.00 0.00 55.95 59.09 2p7l s SER 61 Cb -0.33 -2.28 -0.11 0.00 0.21 0.00 0.00 66.02 63.51 2p7l s SER 61 CO 0.39 -1.52 1.44 -0.76 0.41 0.00 0.00 173.24 173.20 2p7l s LEU 62 N -5.55 4.36 0.50 2.44 1.43 -0.75 -4.88 118.68 116.23 2p7l s LEU 62 Ca 0.58 2.89 0.29 0.00 -1.03 0.00 0.00 54.13 56.86 2p7l s LEU 62 Cb -0.13 -3.65 0.90 0.00 0.03 0.00 0.00 46.19 43.33 2p7l s LEU 62 CO 0.54 -0.75 1.81 1.56 0.23 0.00 0.00 176.35 179.74 2p7l h GLN 63 N 3.51 0.00 -3.56 1.70 4.20 -1.93 -3.43 115.11 115.60 2p7l h GLN 63 Ca -0.49 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.14 2p7l h GLN 63 Cb 1.23 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 28.87 2p7l h GLN 63 CO 0.67 0.02 -0.24 -1.21 -0.67 0.00 0.00 178.83 177.40 2p7l s GLU 64 N -3.46 0.91 -0.03 1.46 0.41 -1.26 -5.15 118.70 111.58 2p7l s GLU 64 Ca 0.04 -0.78 -0.14 0.00 -0.41 0.00 0.00 54.97 53.68 2p7l s GLU 64 Cb 0.07 0.39 -0.05 0.00 -1.78 0.00 0.00 34.13 32.76 2p7l s GLU 64 CO 0.60 -0.32 0.37 1.03 -0.49 0.00 0.00 175.26 176.46 2p7l s ARG 65 N -3.57 3.89 0.18 1.61 0.52 -1.26 -4.99 118.95 115.33 2p7l s ARG 65 Ca 0.02 0.33 -0.01 0.00 -0.52 0.00 0.00 55.73 55.55 2p7l s ARG 65 Cb 0.03 -3.23 -0.04 0.00 0.52 0.00 0.00 34.95 32.22 2p7l s ARG 65 CO -0.10 0.66 0.10 0.95 0.02 0.00 0.00 175.30 176.94 2p7l s THR 66 N -0.94 0.05 -1.94 0.02 -4.23 -1.26 -5.05 115.64 102.28 2p7l s THR 66 Ca 0.22 -1.97 0.32 0.00 -1.18 0.00 0.00 61.69 59.08 2p7l s THR 66 Cb -0.16 -2.34 0.85 0.00 1.34 0.00 0.00 72.50 72.19 2p7l s THR 66 CO 0.12 -0.17 2.19 0.00 -0.54 0.00 0.00 174.62 176.22 2p7l n TYR 67 N -0.21 0.00 -1.83 3.99 9.36 -1.26 -4.74 117.16 122.47 2p7l n TYR 67 Ca -0.01 0.00 -0.42 0.00 3.32 0.00 0.00 57.90 60.79 2p7l n TYR 67 Cb 0.65 -0.04 -0.03 0.00 -0.63 0.00 0.00 39.34 39.30 2p7l n TYR 67 CO 0.00 0.00 0.00 -0.80 0.22 0.00 0.00 176.86 176.28 2p7l s ASN 68 N -2.07 6.52 0.13 2.98 0.01 -1.26 -4.93 114.94 116.31 2p7l s ASN 68 Ca 0.45 2.42 -0.21 0.00 -0.71 0.00 0.00 52.86 54.81 2p7l s ASN 68 Cb 0.22 -2.53 0.06 0.00 0.41 0.00 0.00 41.25 39.40 2p7l s ASN 68 CO 0.38 -1.03 0.54 -1.38 -1.51 0.00 0.00 177.10 174.10 2p7l s HIS 69 N 4.40 -0.44 -0.02 2.20 -3.43 -1.26 -4.58 115.29 112.16 2p7l s HIS 69 Ca 0.82 0.26 -0.13 0.00 -0.80 0.00 0.00 55.06 55.20 2p7l s HIS 69 Cb -0.38 0.44 -0.05 0.00 -1.43 0.00 0.00 32.58 31.16 2p7l s HIS 69 CO 0.36 -0.77 0.35 0.42 -2.00 0.00 0.00 174.74 173.09 2p7l s ILE 70 N -3.50 5.14 -0.15 -5.38 1.01 -1.25 -5.01 121.20 112.06 2p7l s ILE 70 Ca 0.00 0.69 0.00 0.00 0.00 0.00 0.00 60.65 61.34 2p7l s ILE 70 Cb -0.00 -3.64 0.02 0.00 0.01 0.00 0.00 42.46 38.85 2p7l s ILE 70 CO -0.10 0.58 -0.15 0.00 0.00 0.00 0.00 174.94 175.27 2p7l s ALA 71 N -1.08 1.92 0.26 9.38 0.00 -1.26 -2.29 121.76 128.69 2p7l s ALA 71 Ca 0.22 -0.95 -0.02 0.00 0.00 0.00 0.00 51.96 51.21 2p7l s ALA 71 Cb -0.16 -1.07 -0.04 0.00 0.00 0.00 0.00 23.12 21.85 2p7l s ALA 71 CO 0.11 -0.38 0.47 -0.06 0.00 0.00 0.00 175.76 175.90 2p7l s PHE 72 N 1.46 3.48 -0.08 0.00 0.40 0.43 -4.91 117.98 118.77 2p7l s PHE 72 Ca 0.05 0.44 -0.04 0.00 -0.60 0.00 0.00 56.93 56.78 2p7l s PHE 72 Cb -0.13 -1.94 -0.04 0.00 0.51 0.00 0.00 43.02 41.42 2p7l s PHE 72 CO -0.11 0.26 0.09 -1.14 0.70 0.00 0.00 175.22 175.03 2p7l s GLN 73 N -3.59 3.23 0.34 0.44 0.74 -1.26 -0.12 119.66 119.44 2p7l s GLN 73 Ca 0.40 -0.30 0.05 0.00 0.05 0.00 0.00 55.36 55.57 2p7l s GLN 73 Cb -0.11 -3.00 -0.03 0.00 1.10 0.00 0.00 33.01 30.98 2p7l s GLN 73 CO 0.31 0.72 0.21 0.96 -0.55 0.00 0.00 175.29 176.94 2p7l s ILE 74 N -1.05 0.19 0.17 -2.34 -4.36 0.07 -4.88 121.20 109.00 2p7l s ILE 74 Ca 0.17 -2.00 -0.07 0.00 -0.26 0.00 0.00 60.65 58.49 2p7l s ILE 74 Cb -0.12 -2.46 -0.06 0.00 1.25 0.00 0.00 42.46 41.07 2p7l s ILE 74 CO 0.07 0.00 0.45 -1.10 0.24 0.00 0.00 174.94 174.60 2p7l s GLN 75 N -3.61 3.71 0.20 0.37 -1.52 -1.26 -4.12 119.66 113.44 2p7l s GLN 75 Ca 0.35 0.09 -0.13 0.00 -1.95 0.00 0.00 55.36 53.73 2p7l s GLN 75 Cb 0.03 -2.79 0.24 0.00 -0.22 0.00 0.00 33.01 30.27 2p7l s GLN 75 CO 0.22 0.42 1.66 1.03 -0.25 0.00 0.00 175.29 178.37 2p7l h SER 76 N 2.84 -0.33 0.00 5.90 0.87 -1.93 -2.98 113.55 117.91 2p7l h SER 76 Ca -0.47 0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.24 2p7l h SER 76 Cb 1.17 0.28 0.00 0.00 -0.44 0.00 0.00 62.40 63.41 2p7l h SER 76 CO 0.70 -0.13 0.00 -0.62 -0.53 0.00 0.00 176.83 176.26 2p7l n GLU 77 N -5.30 0.00 0.00 2.24 4.71 -1.26 -2.11 120.64 118.92 2p7l n GLU 77 Ca 0.07 0.80 0.00 0.00 -0.01 0.00 0.00 57.16 58.02 2p7l n GLU 77 Cb 0.32 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.25 2p7l n GLU 77 CO 0.00 0.00 0.00 -0.85 0.09 0.00 0.00 177.13 176.37 2p7l n GLU 78 N -2.59 0.00 -0.16 3.49 0.28 -1.13 -3.44 120.64 117.10 2p7l n GLU 78 Ca 0.00 0.00 0.03 0.00 -0.16 0.00 0.00 57.16 57.03 2p7l n GLU 78 Cb 0.00 -1.27 0.32 0.00 1.43 0.00 0.00 31.44 31.92 2p7l n GLU 78 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 2p7l h VAL 79 N 0.00 1.12 0.00 3.84 2.07 -1.36 -0.56 116.25 121.35 2p7l h VAL 79 Ca 0.00 -0.29 -0.18 0.00 0.82 0.00 0.00 66.70 67.06 2p7l h VAL 79 Cb 0.00 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 29.96 2p7l h VAL 79 CO 0.00 0.15 -0.83 0.44 0.02 0.00 0.00 177.57 177.35 2p7l h ASP 80 N 0.83 0.09 0.78 0.57 3.32 -1.80 -2.32 116.42 117.89 2p7l h ASP 80 Ca 0.26 -0.07 -0.04 0.00 0.02 0.00 0.00 57.03 57.20 2p7l h ASP 80 Cb 0.02 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2p7l h ASP 80 CO -0.07 0.88 -0.43 -0.08 -1.72 0.00 0.00 179.24 177.82 2p7l h GLU 81 N 0.04 -1.08 -0.91 3.56 4.22 -1.38 -2.50 114.58 116.52 2p7l h GLU 81 Ca -0.02 0.07 0.00 0.00 0.08 0.00 0.00 59.36 59.49 2p7l h GLU 81 Cb 1.45 0.25 -0.04 0.00 0.50 0.00 0.00 28.75 30.90 2p7l h GLU 81 CO 0.11 -0.72 0.58 1.88 -2.18 0.00 0.00 179.01 178.68 2p7l h TYR 82 N -1.12 1.18 -0.51 0.92 -1.99 -1.35 -0.41 116.97 113.69 2p7l h TYR 82 Ca -0.10 0.01 0.09 0.00 2.00 0.00 0.00 58.73 60.72 2p7l h TYR 82 Cb 0.88 -0.39 -0.07 0.00 2.00 0.00 0.00 36.73 39.15 2p7l h TYR 82 CO -0.06 0.77 0.10 1.15 -0.00 0.00 0.00 178.16 180.12 2p7l h THR 83 N 1.25 0.71 -0.11 -2.88 2.02 -1.31 -0.38 112.91 112.22 2p7l h THR 83 Ca 0.33 -0.08 -0.23 0.00 0.77 0.00 0.00 66.41 67.19 2p7l h THR 83 Cb -0.09 0.45 0.01 0.00 -1.74 0.00 0.00 68.15 66.78 2p7l h THR 83 CO -0.07 0.04 -0.85 -0.33 0.37 0.00 0.00 175.52 174.69 2p7l h GLU 84 N 0.24 0.77 -0.87 6.66 3.07 -1.18 -2.74 114.58 120.53 2p7l h GLU 84 Ca 0.26 -0.68 0.11 0.00 -0.50 0.00 0.00 59.36 58.55 2p7l h GLU 84 Cb 0.35 0.16 -0.08 0.00 -0.84 0.00 0.00 28.75 28.34 2p7l h GLU 84 CO -0.33 1.28 0.50 -0.09 -1.40 0.00 0.00 179.01 178.96 2p7l h ARG 85 N 0.49 0.79 -0.19 2.33 2.43 -0.48 0.66 114.38 120.40 2p7l h ARG 85 Ca -0.08 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 58.93 2p7l h ARG 85 Cb 1.49 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 30.86 2p7l h ARG 85 CO 0.17 0.52 -0.33 0.82 -1.51 0.00 0.00 179.97 179.64 2p7l h ILE 86 N 0.81 1.33 -0.87 1.20 2.04 -1.10 -3.00 117.51 117.92 2p7l h ILE 86 Ca 0.43 -1.56 0.03 0.00 1.00 0.00 0.00 64.86 64.76 2p7l h ILE 86 Cb 0.44 1.86 -0.05 0.00 -0.74 0.00 0.00 36.82 38.33 2p7l h ILE 86 CO -0.27 0.48 0.57 0.11 0.00 0.00 0.00 178.15 179.04 2p7l h LYS 87 N 0.23 1.08 -0.42 2.37 1.57 -1.10 -0.79 116.57 119.50 2p7l h LYS 87 Ca 0.01 -0.07 0.12 0.00 -1.87 0.00 0.00 60.65 58.85 2p7l h LYS 87 Cb 0.92 -0.24 -0.02 0.00 0.08 0.00 0.00 32.23 32.97 2p7l h LYS 87 CO 0.08 0.72 0.30 0.00 -0.57 0.00 0.00 179.45 179.98 2p7l h ALA 88 N 1.35 2.38 -0.01 3.86 0.00 -0.80 0.21 119.26 126.27 2p7l h ALA 88 Ca 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2p7l h ALA 88 Cb -0.02 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2p7l h ALA 88 CO -0.11 -0.50 -0.09 1.28 0.00 0.00 0.00 179.25 179.83 2p7l n LEU 89 N -4.41 0.87 -0.87 0.00 4.77 -0.33 -4.91 117.00 112.13 2p7l n LEU 89 Ca 0.07 -0.22 -0.09 0.00 -0.03 0.00 0.00 56.01 55.73 2p7l n LEU 89 Cb 0.49 -0.08 -0.02 0.00 -2.33 0.00 0.00 43.42 41.48 2p7l n LEU 89 CO 0.36 0.15 -0.10 0.61 -1.33 0.00 0.00 177.39 177.08 2p7l n GLY 90 N 1.22 0.56 3.67 -0.72 0.00 0.75 -4.98 105.19 105.68 2p7l n GLY 90 Ca 0.17 -0.56 -0.42 0.00 0.00 0.00 0.00 46.02 45.21 2p7l n GLY 90 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2p7l s VAL 91 N -2.40 4.85 0.21 1.61 1.01 -1.08 -5.00 120.40 119.60 2p7l s VAL 91 Ca 0.00 1.69 -0.32 0.00 0.00 0.00 0.00 61.98 63.34 2p7l s VAL 91 Cb 0.00 -4.16 -0.13 0.00 0.00 0.00 0.00 36.38 32.09 2p7l s VAL 91 CO 0.00 -0.01 1.50 1.21 0.00 0.00 0.00 175.10 177.81 2p7l n GLU 92 N 5.41 2.17 -4.35 2.72 2.13 -1.26 -4.62 120.64 122.84 2p7l n GLU 92 Ca 0.06 0.78 -0.23 0.00 0.66 0.00 0.00 57.16 58.42 2p7l n GLU 92 Cb 0.48 -2.50 -0.11 0.00 0.27 0.00 0.00 31.44 29.58 2p7l n GLU 92 CO 0.00 0.00 0.00 -1.64 -0.41 0.00 0.00 177.13 175.08 2p7l s MET 93 N 0.16 1.33 0.05 5.31 -1.94 -1.26 -3.35 119.30 119.61 2p7l s MET 93 Ca 0.72 -1.44 0.03 0.00 -1.71 0.00 0.00 55.69 53.30 2p7l s MET 93 Cb -0.64 -1.44 -0.04 0.00 2.01 0.00 0.00 34.83 34.72 2p7l s MET 93 CO 0.44 0.30 0.01 0.15 -0.01 0.00 0.00 175.02 175.91 2p7l s LYS 94 N -2.79 2.69 0.82 2.03 -0.14 -0.64 -5.00 119.74 116.71 2p7l s LYS 94 Ca 0.17 -0.73 -0.11 0.00 -1.36 0.00 0.00 55.97 53.94 2p7l s LYS 94 Cb -0.06 -2.62 0.09 0.00 -1.68 0.00 0.00 37.83 33.56 2p7l s LYS 94 CO 0.07 0.58 1.09 -1.25 -0.76 0.00 0.00 175.35 175.08 2p7l s PRO 95 N -2.04 1.83 0.66 -1.68 0.04 -1.26 -4.52 135.00 128.02 2p7l s PRO 95 Ca 0.24 1.03 -0.17 0.00 0.04 0.00 0.00 61.00 62.14 2p7l s PRO 95 Cb -0.12 -1.86 -0.00 0.00 0.04 0.00 0.00 34.50 32.56 2p7l s PRO 95 CO 0.16 -1.90 1.21 -2.00 0.04 0.00 0.00 177.00 174.51 2p7l s GLU 96 N -4.91 2.60 0.48 4.56 2.12 -1.26 -4.97 118.70 117.31 2p7l s GLU 96 Ca 0.62 1.81 -0.02 0.00 0.36 0.00 0.00 54.97 57.74 2p7l s GLU 96 Cb -0.18 -1.88 -0.01 0.00 0.26 0.00 0.00 34.13 32.32 2p7l s GLU 96 CO 0.56 -1.50 0.73 1.03 -0.54 0.00 0.00 175.26 175.55 2p7l s ARG 97 N -3.60 3.21 0.26 4.30 0.52 -1.26 -5.01 118.95 117.37 2p7l s ARG 97 Ca 0.76 -0.19 -0.31 0.00 -0.52 0.00 0.00 55.73 55.48 2p7l s ARG 97 Cb -0.30 -2.46 -0.13 0.00 0.52 0.00 0.00 34.95 32.58 2p7l s ARG 97 CO 0.39 -0.29 1.45 -2.30 0.02 0.00 0.00 175.30 174.57 2p7l n PRO 98 N -2.20 2.23 -4.62 3.54 -0.02 -1.26 -4.99 135.00 127.69 2p7l n PRO 98 Ca 0.01 0.79 -0.28 0.00 -2.02 0.00 0.00 63.50 62.00 2p7l n PRO 98 Cb 0.57 -2.48 -0.10 0.00 -0.02 0.00 0.00 33.50 31.47 2p7l n PRO 98 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 2p7l s ARG 99 N -0.55 1.97 -0.14 -0.52 1.70 -1.26 -5.09 118.95 115.05 2p7l s ARG 99 Ca 0.66 -2.17 0.20 0.00 -0.47 0.00 0.00 55.73 53.95 2p7l s ARG 99 Cb -0.60 -1.36 0.45 0.00 -0.57 0.00 0.00 34.95 32.87 2p7l s ARG 99 CO 0.50 -0.21 1.17 1.55 -1.08 0.00 0.00 175.30 177.23 2p7l n VAL 100 N -1.00 1.10 -2.17 4.99 3.14 -1.26 -5.09 118.33 118.04 2p7l n VAL 100 Ca -0.09 -2.35 0.00 0.00 -2.96 0.00 0.00 64.34 58.94 2p7l n VAL 100 Cb 0.67 0.54 0.00 0.00 -1.06 0.00 0.00 33.84 33.98 2p7l n VAL 100 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2p7l n GLN 101 N -0.27 -5.11 0.00 1.45 0.00 -1.26 -4.74 117.38 107.44 2p7l n GLN 101 Ca 0.14 3.64 0.00 0.00 0.00 0.00 0.00 57.00 60.77 2p7l n GLN 101 Cb 0.94 -4.19 0.00 0.00 0.00 0.00 0.00 30.24 26.99 2p7l n GLN 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2p7l n GLY 102 N 1.92 2.08 3.77 2.61 0.00 -1.26 -5.07 105.19 109.25 2p7l n GLY 102 Ca 0.00 -0.66 -0.38 0.00 0.00 0.00 0.00 46.02 44.99 2p7l n GLY 102 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2p7l s GLU 103 N 0.00 4.08 0.00 1.61 2.02 -1.26 -4.42 118.70 120.73 2p7l s GLU 103 Ca 0.00 1.73 0.00 0.00 0.02 0.00 0.00 54.97 56.72 2p7l s GLU 103 Cb 0.00 -2.63 0.00 0.00 0.10 0.00 0.00 34.13 31.60 2p7l s GLU 103 CO 0.00 -0.27 0.00 0.41 0.02 0.00 0.00 175.26 175.42 2p7l n GLY 104 N 0.56 -1.88 3.24 -1.39 0.00 -1.25 -4.96 105.19 99.51 2p7l n GLY 104 Ca 0.05 -1.12 -0.27 0.00 0.00 0.00 0.00 46.02 44.67 2p7l n GLY 104 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2p7l s ARG 105 N 0.00 1.63 0.32 1.61 1.81 -0.99 -4.96 118.95 118.37 2p7l s ARG 105 Ca 0.00 -0.83 0.08 0.00 -1.72 0.00 0.00 55.73 53.27 2p7l s ARG 105 Cb 0.00 -1.63 -0.06 0.00 -0.45 0.00 0.00 34.95 32.80 2p7l s ARG 105 CO 0.00 0.44 -0.08 -1.12 -0.68 0.00 0.00 175.30 173.86 2p7l s SER 106 N -0.72 3.30 -0.06 0.23 0.01 -1.26 -1.20 113.70 114.01 2p7l s SER 106 Ca 0.08 -1.20 -0.00 0.00 1.31 0.00 0.00 55.95 56.14 2p7l s SER 106 Cb -0.08 -0.27 0.03 0.00 0.21 0.00 0.00 66.02 65.90 2p7l s SER 106 CO 0.00 -0.26 -0.01 -0.63 0.41 0.00 0.00 173.24 172.75 2p7l s ILE 107 N -2.79 0.39 -0.10 1.44 1.01 -0.35 -4.92 121.20 115.87 2p7l s ILE 107 Ca 0.31 0.06 0.03 0.00 0.00 0.00 0.00 60.65 61.04 2p7l s ILE 107 Cb 0.03 -0.50 -0.01 0.00 0.01 0.00 0.00 42.46 41.98 2p7l s ILE 107 CO 0.14 0.24 -0.19 -0.31 0.00 0.00 0.00 174.94 174.82 2p7l s TYR 108 N 1.58 2.66 0.07 3.97 1.51 -1.26 -1.17 117.35 124.71 2p7l s TYR 108 Ca -0.01 -0.73 -0.17 0.00 -1.01 0.00 0.00 57.07 55.14 2p7l s TYR 108 Cb -0.13 -1.74 0.03 0.00 -0.11 0.00 0.00 41.96 40.02 2p7l s TYR 108 CO -0.03 -0.24 0.40 -0.59 -1.11 0.00 0.00 175.55 173.98 2p7l s PHE 109 N 0.15 -0.23 0.26 2.71 -0.12 -0.91 -1.61 117.98 118.22 2p7l s PHE 109 Ca -0.10 0.09 0.08 0.00 -0.05 0.00 0.00 56.93 56.95 2p7l s PHE 109 Cb -0.16 0.23 -0.04 0.00 -0.63 0.00 0.00 43.02 42.42 2p7l s PHE 109 CO 0.06 -0.62 0.12 0.71 -0.05 0.00 0.00 175.22 175.44 2p7l s TYR 110 N -2.97 2.92 0.00 3.49 1.51 -1.21 -0.27 117.35 120.81 2p7l s TYR 110 Ca -0.02 -0.17 0.00 0.00 -1.01 0.00 0.00 57.07 55.87 2p7l s TYR 110 Cb 0.00 -1.34 0.00 0.00 -0.11 0.00 0.00 41.96 40.52 2p7l s TYR 110 CO -0.06 0.55 0.00 -0.40 -1.11 0.00 0.00 175.55 174.53 2p7l n ASP 111 N -1.07 0.00 -0.76 2.29 3.85 -0.95 -4.70 116.55 115.20 2p7l n ASP 111 Ca -0.07 0.00 0.10 0.00 -0.71 0.00 0.00 54.79 54.11 2p7l n ASP 111 Cb 0.58 0.00 0.28 0.00 -1.35 0.00 0.00 41.12 40.64 2p7l n ASP 111 CO 0.00 0.00 0.00 0.49 -1.01 0.00 0.00 177.20 176.68 2p7l n PHE 112 N 0.00 0.39 -1.67 2.11 3.01 -1.26 -4.10 117.46 115.95 2p7l n PHE 112 Ca 0.00 -0.20 0.06 0.00 1.01 0.00 0.00 57.45 58.32 2p7l n PHE 112 Cb 0.00 0.00 0.15 0.00 -0.01 0.00 0.00 39.48 39.62 2p7l n PHE 112 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 2p7l n ASP 113 N 0.72 1.62 -1.43 4.37 8.00 -1.26 -4.98 116.55 123.59 2p7l n ASP 113 Ca 0.16 -3.31 -0.13 0.00 0.71 0.00 0.00 54.79 52.22 2p7l n ASP 113 Cb 0.40 -0.45 -0.01 0.00 -0.02 0.00 0.00 41.12 41.04 2p7l n ASP 113 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2p7l n ASN 114 N -0.85 -4.12 -4.67 -2.24 3.02 -1.26 -1.82 115.26 103.32 2p7l n ASN 114 Ca 0.15 0.02 -0.38 0.00 -0.03 0.00 0.00 54.58 54.35 2p7l n ASN 114 Cb 0.76 -3.25 -0.08 0.00 -0.61 0.00 0.00 39.78 36.60 2p7l n ASN 114 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 2p7l s HIS 115 N -2.63 3.37 0.03 3.10 3.76 -1.26 -4.70 115.29 116.95 2p7l s HIS 115 Ca 0.00 0.51 -0.21 0.00 -0.15 0.00 0.00 55.06 55.21 2p7l s HIS 115 Cb 0.00 -2.44 -0.06 0.00 1.11 0.00 0.00 32.58 31.19 2p7l s HIS 115 CO 0.00 0.03 0.62 -1.17 -0.85 0.00 0.00 174.74 173.37 2p7l s LEU 116 N 1.17 4.46 0.18 0.89 2.96 -1.26 -2.25 118.68 124.83 2p7l s LEU 116 Ca 0.16 1.24 0.09 0.00 -0.22 0.00 0.00 54.13 55.40 2p7l s LEU 116 Cb -0.14 -2.97 -0.04 0.00 0.50 0.00 0.00 46.19 43.53 2p7l s LEU 116 CO 0.07 0.14 -0.18 -0.36 -1.32 0.00 0.00 176.35 174.70 2p7l s PHE 117 N -0.46 1.85 0.01 5.38 0.40 0.62 -3.91 117.98 121.87 2p7l s PHE 117 Ca 0.32 -0.47 0.00 0.00 -0.60 0.00 0.00 56.93 56.17 2p7l s PHE 117 Cb -0.19 -0.90 -0.01 0.00 0.51 0.00 0.00 43.02 42.43 2p7l s PHE 117 CO 0.19 0.37 -0.02 -2.00 0.70 0.00 0.00 175.22 174.46 2p7l s GLU 118 N -3.02 0.18 -0.21 0.44 2.12 -0.97 -2.15 118.70 115.08 2p7l s GLU 118 Ca 0.18 -0.24 0.02 0.00 0.36 0.00 0.00 54.97 55.29 2p7l s GLU 118 Cb -0.05 -0.05 0.04 0.00 0.26 0.00 0.00 34.13 34.33 2p7l s GLU 118 CO 0.07 0.01 -0.15 -0.51 -0.54 0.00 0.00 175.26 174.14 2p7l s LEU 119 N -0.51 2.62 -0.07 2.70 1.43 -0.31 -0.42 118.68 124.11 2p7l s LEU 119 Ca -0.05 -0.95 0.03 0.00 -1.03 0.00 0.00 54.13 52.13 2p7l s LEU 119 Cb -0.04 -1.46 -0.02 0.00 0.03 0.00 0.00 46.19 44.70 2p7l s LEU 119 CO -0.00 -0.09 -0.14 -2.28 0.23 0.00 0.00 176.35 174.07 2p7l s HIS 120 N 1.24 2.74 -0.31 0.29 2.46 0.83 -1.22 115.29 121.32 2p7l s HIS 120 Ca -0.01 -0.28 -0.06 0.00 0.47 0.00 0.00 55.06 55.18 2p7l s HIS 120 Cb -0.16 -1.69 0.02 0.00 -0.13 0.00 0.00 32.58 30.62 2p7l s HIS 120 CO -0.09 0.09 0.08 0.00 -2.47 0.00 0.00 174.74 172.35 2p7l s ALA 121 N -0.45 3.04 0.00 1.58 0.00 -0.34 -0.75 121.76 124.84 2p7l s ALA 121 Ca 0.06 -1.58 0.00 0.00 0.00 0.00 0.00 51.96 50.44 2p7l s ALA 121 Cb -0.12 -2.18 0.00 0.00 0.00 0.00 0.00 23.12 20.82 2p7l s ALA 121 CO 0.02 -1.10 0.00 0.41 0.00 0.00 0.00 175.76 175.09 2p7l n GLY 122 N 4.83 4.31 3.90 0.00 0.00 -1.26 -2.35 105.19 114.63 2p7l n GLY 122 Ca -0.14 -0.70 -0.29 0.00 0.00 0.00 0.00 46.02 44.90 2p7l n GLY 122 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2p7l s THR 123 N -0.11 2.44 0.12 2.61 -4.23 -1.26 -4.94 115.64 110.26 2p7l s THR 123 Ca 0.00 0.07 -0.16 0.00 -1.18 0.00 0.00 61.69 60.42 2p7l s THR 123 Cb 0.00 -3.13 -0.03 0.00 1.34 0.00 0.00 72.50 70.68 2p7l s THR 123 CO 0.00 -0.16 1.58 0.25 -0.54 0.00 0.00 174.62 175.75 2p7l h LEU 124 N -0.87 0.60 -0.71 4.79 5.85 -2.01 -2.67 115.31 120.29 2p7l h LEU 124 Ca -0.46 -0.28 0.12 0.00 0.84 0.00 0.00 57.88 58.10 2p7l h LEU 124 Cb 1.31 -0.16 -0.09 0.00 0.37 0.00 0.00 40.66 42.09 2p7l h LEU 124 CO 0.65 0.73 0.29 -0.33 -0.34 0.00 0.00 178.44 179.44 2p7l h GLU 125 N 0.45 0.45 -0.74 1.25 3.07 -1.94 -0.84 114.58 116.27 2p7l h GLU 125 Ca 0.11 -0.03 -0.04 0.00 -0.50 0.00 0.00 59.36 58.90 2p7l h GLU 125 Cb 0.41 -0.10 -0.03 0.00 -0.84 0.00 0.00 28.75 28.18 2p7l h GLU 125 CO 0.01 0.30 0.29 0.93 -1.40 0.00 0.00 179.01 179.14 2p7l h GLU 126 N 0.46 1.10 -0.78 2.33 5.08 -1.90 -2.81 114.58 118.05 2p7l h GLU 126 Ca 0.38 -0.19 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 2p7l h GLU 126 Cb 0.52 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.55 2p7l h GLU 126 CO -0.36 0.89 0.47 -0.09 -1.00 0.00 0.00 179.01 178.92 2p7l h ARG 127 N 1.07 1.07 -4.19 2.33 9.65 -0.83 -3.34 114.38 120.14 2p7l h ARG 127 Ca 0.25 -0.10 -0.71 0.00 -1.10 0.00 0.00 59.98 58.32 2p7l h ARG 127 Cb 0.21 -0.22 -0.06 0.00 -1.39 0.00 0.00 29.97 28.51 2p7l h ARG 127 CO -0.02 0.76 2.89 1.28 2.80 0.00 0.00 179.97 187.68 2p7l n LEU 128 N -4.47 6.59 -2.23 3.80 4.77 -0.79 -4.69 117.00 119.97 2p7l n LEU 128 Ca 0.08 -4.17 -0.31 0.00 -0.03 0.00 0.00 56.01 51.58 2p7l n LEU 128 Cb 0.06 -1.65 0.06 0.00 -2.33 0.00 0.00 43.42 39.55 2p7l n LEU 128 CO 0.37 1.01 0.99 0.29 -1.33 0.00 0.00 177.39 178.72 2p7l n LYS 129 N 6.15 3.03 0.00 3.23 4.01 -1.25 -4.98 118.16 128.35 2p7l n LYS 129 Ca 0.50 -3.62 0.05 0.00 -0.51 0.00 0.00 58.31 54.72 2p7l n LYS 129 Cb 0.40 -2.29 0.04 0.00 -0.51 0.00 0.00 35.03 32.67 2p7l n LYS 129 CO 0.00 0.00 0.00 2.89 -1.11 0.00 0.00 177.40 179.18