#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p7l s ILE 2 N 0.00 4.96 0.17 3.17 -1.09 -1.26 -4.95 121.20 122.20 2p7l s ILE 2 Ca 0.00 1.75 -0.04 0.00 -2.23 0.00 0.00 60.65 60.13 2p7l s ILE 2 Cb 0.00 -4.18 -0.08 0.00 -1.58 0.00 0.00 42.46 36.62 2p7l s ILE 2 CO 0.00 0.21 1.46 0.28 -1.23 0.00 0.00 174.94 175.66 2p7l h SER 3 N 6.78 0.64 0.00 3.58 0.02 -2.10 -3.49 113.55 118.97 2p7l h SER 3 Ca -0.41 -0.37 0.00 0.00 -0.84 0.00 0.00 61.79 60.17 2p7l h SER 3 Cb 1.21 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.56 2p7l h SER 3 CO 0.75 1.10 0.00 0.61 -1.14 0.00 0.00 176.83 178.15 2p7l n GLY 4 N 0.38 -0.45 3.71 -3.77 0.00 -1.26 -5.10 105.19 98.70 2p7l n GLY 4 Ca -0.04 -1.05 -0.42 0.00 0.00 0.00 0.00 46.02 44.51 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 4.34 -0.13 0.99 2.96 -1.26 -4.96 118.68 120.63 2p7l s LEU 5 Ca 0.00 1.54 -0.06 0.00 -0.22 0.00 0.00 54.13 55.39 2p7l s LEU 5 Cb 0.00 -3.47 -0.02 0.00 0.50 0.00 0.00 46.19 43.20 2p7l s LEU 5 CO 0.00 -0.26 -0.09 -1.28 -1.32 0.00 0.00 176.35 173.39 2p7l h SER 6 N 6.85 0.00 -5.08 3.68 0.87 -1.99 -3.48 113.55 114.40 2p7l h SER 6 Ca -0.39 -0.02 0.23 0.00 -1.23 0.00 0.00 61.79 60.38 2p7l h SER 6 Cb 1.20 0.00 -0.13 0.00 -0.44 0.00 0.00 62.40 63.03 2p7l h SER 6 CO 0.77 0.67 0.66 -1.38 -0.53 0.00 0.00 176.83 177.02 2p7l s HIS 7 N -1.98 -0.15 -0.05 2.24 -3.43 -1.26 -4.42 115.29 106.24 2p7l s HIS 7 Ca -0.09 -0.01 0.05 0.00 -0.80 0.00 0.00 55.06 54.21 2p7l s HIS 7 Cb 0.01 0.56 -0.02 0.00 -1.43 0.00 0.00 32.58 31.71 2p7l s HIS 7 CO 0.14 -0.46 -0.21 0.42 -2.00 0.00 0.00 174.74 172.63 2p7l s ILE 8 N -2.80 2.43 -0.10 -5.38 1.01 -0.86 -5.02 121.20 110.49 2p7l s ILE 8 Ca 0.11 -0.95 0.02 0.00 0.00 0.00 0.00 60.65 59.83 2p7l s ILE 8 Cb 0.01 -1.91 -0.01 0.00 0.01 0.00 0.00 42.46 40.56 2p7l s ILE 8 CO -0.03 0.57 -0.17 -0.89 0.00 0.00 0.00 174.94 174.42 2p7l s THR 9 N -0.40 2.74 0.04 2.92 2.01 -1.26 -0.75 115.64 120.93 2p7l s THR 9 Ca 0.04 -0.80 0.05 0.00 0.31 0.00 0.00 61.69 61.30 2p7l s THR 9 Cb -0.12 -2.10 -0.02 0.00 0.01 0.00 0.00 72.50 70.27 2p7l s THR 9 CO 0.02 0.55 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.58 2p7l s LEU 10 N 0.05 2.16 -0.12 4.42 1.43 0.05 -4.99 118.68 121.68 2p7l s LEU 10 Ca -0.07 -0.46 -0.03 0.00 -1.03 0.00 0.00 54.13 52.54 2p7l s LEU 10 Cb -0.15 -0.71 -0.03 0.00 0.03 0.00 0.00 46.19 45.33 2p7l s LEU 10 CO 0.05 0.08 0.01 -0.63 0.23 0.00 0.00 176.35 176.08 2p7l s ILE 11 N -0.80 4.36 0.01 -0.59 -1.09 -1.26 -0.52 121.20 121.30 2p7l s ILE 11 Ca 0.03 -0.21 -0.02 0.00 -2.23 0.00 0.00 60.65 58.22 2p7l s ILE 11 Cb -0.08 -2.88 -0.01 0.00 -1.58 0.00 0.00 42.46 37.92 2p7l s ILE 11 CO 0.01 0.55 0.02 0.68 -1.23 0.00 0.00 174.94 174.98 2p7l s VAL 12 N -0.38 0.07 0.26 2.92 -7.23 -0.13 -4.94 120.40 110.98 2p7l s VAL 12 Ca 0.08 -0.61 -0.00 0.00 -1.81 0.00 0.00 61.98 59.64 2p7l s VAL 12 Cb -0.12 -0.24 0.07 0.00 0.56 0.00 0.00 36.38 36.65 2p7l s VAL 12 CO 0.02 -0.33 1.71 0.50 -0.31 0.00 0.00 175.10 176.69 2p7l h LYS 13 N 4.98 0.62 -3.18 4.82 3.64 -1.84 0.06 116.57 125.67 2p7l h LYS 13 Ca -0.30 -0.22 -0.58 0.00 -1.27 0.00 0.00 60.65 58.29 2p7l h LYS 13 Cb 1.21 -0.04 -0.40 0.00 -0.41 0.00 0.00 32.23 32.58 2p7l h LYS 13 CO 0.43 0.77 -0.77 0.34 -2.27 0.00 0.00 179.45 177.95 2p7l s ASP 14 N -6.76 3.72 0.28 4.20 -1.08 -1.26 -4.59 116.67 111.18 2p7l s ASP 14 Ca -0.08 -1.87 0.00 0.00 -0.52 0.00 0.00 52.55 50.09 2p7l s ASP 14 Cb 0.14 -0.75 0.52 0.00 -1.46 0.00 0.00 42.92 41.37 2p7l s ASP 14 CO 0.81 -0.37 1.84 0.25 0.52 0.00 0.00 175.17 178.21 2p7l h LEU 15 N 7.70 0.92 -0.24 -1.34 5.85 -1.94 -1.68 115.31 124.58 2p7l h LEU 15 Ca -0.09 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.70 2p7l h LEU 15 Cb 0.99 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.85 2p7l h LEU 15 CO 0.44 0.50 0.09 0.78 -0.34 0.00 0.00 178.44 179.91 2p7l h ASN 16 N 1.00 0.10 -0.29 1.25 -0.26 -1.98 0.10 115.58 115.50 2p7l h ASN 16 Ca 0.48 0.02 -0.02 0.00 -0.56 0.00 0.00 56.30 56.23 2p7l h ASN 16 Cb 0.45 0.01 -0.01 0.00 -1.06 0.00 0.00 38.32 37.70 2p7l h ASN 16 CO -0.26 0.09 0.10 0.11 -1.06 0.00 0.00 177.43 176.41 2p7l h LYS 17 N 0.20 0.45 -0.88 0.81 1.57 -1.82 -2.85 116.57 114.05 2p7l h LYS 17 Ca 0.11 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2p7l h LYS 17 Cb 0.07 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.27 2p7l h LYS 17 CO -0.11 0.50 0.49 1.15 -0.57 0.00 0.00 179.45 180.91 2p7l h THR 18 N 0.32 1.25 -0.30 -0.16 2.02 -1.07 -2.49 112.91 112.47 2p7l h THR 18 Ca 0.10 -0.61 0.03 0.00 0.77 0.00 0.00 66.41 66.69 2p7l h THR 18 Cb 0.23 0.06 -0.03 0.00 -1.74 0.00 0.00 68.15 66.67 2p7l h THR 18 CO -0.00 0.28 0.13 0.74 0.37 0.00 0.00 175.52 177.04 2p7l h THR 19 N 1.22 0.96 -0.97 3.16 2.02 -0.72 0.22 112.91 118.81 2p7l h THR 19 Ca 0.31 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.39 2p7l h THR 19 Cb 0.01 0.65 -0.05 0.00 -1.74 0.00 0.00 68.15 67.03 2p7l h THR 19 CO -0.05 0.05 0.61 0.00 0.37 0.00 0.00 175.52 176.50 2p7l h ALA 20 N 1.17 1.23 0.13 6.16 0.00 -1.28 0.22 119.26 126.88 2p7l h ALA 20 Ca 0.13 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2p7l h ALA 20 Cb 0.07 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.47 2p7l h ALA 20 CO -0.11 0.66 -0.06 0.35 0.00 0.00 0.00 179.25 180.09 2p7l h PHE 21 N 1.32 -0.16 -0.76 0.00 3.57 -0.93 0.28 116.94 120.26 2p7l h PHE 21 Ca 0.35 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.81 2p7l h PHE 21 Cb -0.10 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.66 2p7l h PHE 21 CO 0.00 -0.05 0.32 -0.07 -2.23 0.00 0.00 178.31 176.28 2p7l h LEU 22 N -0.22 1.04 -0.86 0.59 3.38 -0.11 -0.81 115.31 118.32 2p7l h LEU 22 Ca -0.02 -0.16 -0.11 0.00 0.09 0.00 0.00 57.88 57.67 2p7l h LEU 22 Cb 0.17 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2p7l h LEU 22 CO 0.03 0.92 -0.40 1.56 0.09 0.00 0.00 178.44 180.64 2p7l h GLN 23 N 1.09 0.35 0.19 1.13 4.20 -0.38 -2.39 115.11 119.31 2p7l h GLN 23 Ca 0.26 -0.17 -0.01 0.00 0.06 0.00 0.00 58.65 58.79 2p7l h GLN 23 Cb 0.19 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.97 2p7l h GLN 23 CO -0.02 0.70 -0.09 -0.91 -0.67 0.00 0.00 178.83 177.83 2p7l h ASN 24 N 0.29 -0.22 0.45 1.46 2.35 0.12 -3.15 115.58 116.89 2p7l h ASN 24 Ca 0.03 -0.28 -0.31 0.00 -0.55 0.00 0.00 56.30 55.19 2p7l h ASN 24 Cb 0.83 0.06 0.01 0.00 0.05 0.00 0.00 38.32 39.27 2p7l h ASN 24 CO 0.07 0.32 -1.44 -0.29 -1.65 0.00 0.00 177.43 174.44 2p7l h ILE 25 N -0.93 1.29 -0.58 2.81 6.09 -1.27 -3.36 117.51 121.57 2p7l h ILE 25 Ca -0.03 -2.85 0.00 0.00 -1.37 0.00 0.00 64.86 60.62 2p7l h ILE 25 Cb 0.49 2.89 0.00 0.00 0.47 0.00 0.00 36.82 40.67 2p7l h ILE 25 CO 0.04 0.85 0.00 0.49 -3.07 0.00 0.00 178.15 176.46 2p7l n PHE 26 N -3.56 0.80 -4.17 2.19 0.99 -0.93 -4.96 117.46 107.83 2p7l n PHE 26 Ca -0.14 -0.51 -0.34 0.00 -0.00 0.00 0.00 57.45 56.46 2p7l n PHE 26 Cb 1.05 -0.03 -0.03 0.00 -1.00 0.00 0.00 39.48 39.48 2p7l n PHE 26 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.76 176.85 2p7l n ASN 27 N 1.16 -2.73 -4.74 4.37 4.13 -1.19 -4.75 115.26 111.52 2p7l n ASN 27 Ca 0.20 -1.01 -0.42 0.00 1.68 0.00 0.00 54.58 55.03 2p7l n ASN 27 Cb 0.56 -2.83 -0.03 0.00 -1.54 0.00 0.00 39.78 35.95 2p7l n ASN 27 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2p7l s ALA 28 N -3.44 3.65 -0.42 5.41 0.00 -1.05 -4.91 121.76 121.00 2p7l s ALA 28 Ca 0.59 1.31 -0.16 0.00 0.00 0.00 0.00 51.96 53.70 2p7l s ALA 28 Cb -0.32 -3.57 0.02 0.00 0.00 0.00 0.00 23.12 19.26 2p7l s ALA 28 CO 0.92 -0.73 0.37 -2.00 0.00 0.00 0.00 175.76 174.32 2p7l s GLU 29 N 0.05 3.03 0.10 0.00 2.12 -0.57 -4.61 118.70 118.83 2p7l s GLU 29 Ca 0.62 -0.89 -0.31 0.00 0.36 0.00 0.00 54.97 54.74 2p7l s GLU 29 Cb -0.42 -3.98 -0.08 0.00 0.26 0.00 0.00 34.13 29.92 2p7l s GLU 29 CO 0.40 -0.81 1.39 -2.00 -0.54 0.00 0.00 175.26 173.69 2p7l s GLU 30 N 1.91 4.32 0.00 4.30 2.12 -1.26 -1.14 118.70 128.95 2p7l s GLU 30 Ca 0.09 2.05 0.00 0.00 0.36 0.00 0.00 54.97 57.47 2p7l s GLU 30 Cb -0.18 -3.30 0.00 0.00 0.26 0.00 0.00 34.13 30.91 2p7l s GLU 30 CO 0.12 -0.45 0.00 0.44 -0.54 0.00 0.00 175.26 174.83 2p7l n ILE 31 N 4.04 0.00 -3.70 -3.70 -5.35 -0.70 -4.96 119.36 105.00 2p7l n ILE 31 Ca 0.12 -0.28 -0.14 0.00 -0.27 0.00 0.00 62.75 62.17 2p7l n ILE 31 Cb 0.43 0.83 -0.07 0.00 -1.74 0.00 0.00 39.64 39.08 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 -1.03 -0.27 -0.21 4.28 5.04 -1.20 -4.97 117.35 118.99 2p7l s TYR 32 Ca 0.00 0.36 -0.21 0.00 -2.44 0.00 0.00 57.07 54.78 2p7l s TYR 32 Cb 0.00 0.18 0.06 0.00 0.35 0.00 0.00 41.96 42.54 2p7l s TYR 32 CO 0.00 -0.48 0.59 0.45 -1.34 0.00 0.00 175.55 174.77 2p7l s SER 33 N -1.56 -0.61 0.19 4.32 0.15 -1.26 -1.88 113.70 113.05 2p7l s SER 33 Ca -0.10 1.15 -0.16 0.00 0.70 0.00 0.00 55.95 57.54 2p7l s SER 33 Cb -0.03 1.16 0.02 0.00 -1.71 0.00 0.00 66.02 65.47 2p7l s SER 33 CO 0.03 -0.23 0.49 -0.94 1.20 0.00 0.00 173.24 173.79 2p7l s SER 34 N 0.22 -0.21 0.00 5.45 1.04 -0.51 -5.02 113.70 114.67 2p7l s SER 34 Ca -0.01 -0.54 0.00 0.00 0.48 0.00 0.00 55.95 55.89 2p7l s SER 34 Cb -0.04 0.56 0.00 0.00 0.10 0.00 0.00 66.02 66.64 2p7l s SER 34 CO 0.01 -1.03 0.00 0.61 0.98 0.00 0.00 173.24 173.81 2p7l n GLY 35 N -0.32 4.33 3.04 7.32 0.00 -1.26 -1.21 105.19 117.09 2p7l n GLY 35 Ca -0.10 -1.24 -0.02 0.00 0.00 0.00 0.00 46.02 44.66 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 -0.65 0.41 1.61 -1.08 -0.53 -4.92 116.67 111.52 2p7l s ASP 36 Ca 0.00 0.23 0.10 0.00 -0.52 0.00 0.00 52.55 52.36 2p7l s ASP 36 Cb 0.00 1.64 0.87 0.00 -1.46 0.00 0.00 42.92 43.97 2p7l s ASP 36 CO 0.00 -0.30 1.99 0.50 0.52 0.00 0.00 175.17 177.87 2p7l h LYS 37 N 8.08 0.28 0.00 4.34 3.11 -1.95 0.20 116.57 130.63 2p7l h LYS 37 Ca -0.13 -0.04 0.00 0.00 -2.81 0.00 0.00 60.65 57.67 2p7l h LYS 37 Cb 1.16 -0.05 0.00 0.00 -1.00 0.00 0.00 32.23 32.34 2p7l h LYS 37 CO 0.23 0.32 0.00 0.25 -2.81 0.00 0.00 179.45 177.44 2p7l n THR 38 N -4.37 0.73 0.24 1.00 -2.24 -1.26 -2.03 114.28 106.35 2p7l n THR 38 Ca -0.00 0.03 0.09 0.00 -2.27 0.00 0.00 64.05 61.89 2p7l n THR 38 Cb 0.19 -0.93 0.15 0.00 -2.10 0.00 0.00 70.33 67.64 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 -2.23 0.34 -3.67 4.78 7.35 -0.05 -4.98 117.46 119.00 2p7l n PHE 39 Ca 0.04 -0.24 -0.22 0.00 -0.76 0.00 0.00 57.45 56.26 2p7l n PHE 39 Cb 0.31 -0.01 0.05 0.00 0.35 0.00 0.00 39.48 40.18 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 1.01 -2.65 -3.96 -2.13 7.64 -0.62 -4.97 113.62 107.95 2p7l n SER 40 Ca 0.14 -0.74 -0.29 0.00 1.01 0.00 0.00 58.87 58.99 2p7l n SER 40 Cb 0.47 -4.37 -0.16 0.00 -1.01 0.00 0.00 64.21 59.14 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 -6.80 1.82 0.76 -3.43 1.43 -0.57 -5.02 118.68 106.87 2p7l s LEU 41 Ca 0.20 -0.66 -0.12 0.00 -1.03 0.00 0.00 54.13 52.51 2p7l s LEU 41 Cb -0.09 -1.08 0.05 0.00 0.03 0.00 0.00 46.19 45.10 2p7l s LEU 41 CO 0.79 -0.14 1.12 -0.94 0.23 0.00 0.00 176.35 177.41 2p7l s SER 42 N 1.53 4.38 0.62 2.29 1.04 -1.26 -1.45 113.70 120.84 2p7l s SER 42 Ca 0.01 1.99 -0.16 0.00 0.48 0.00 0.00 55.95 58.28 2p7l s SER 42 Cb -0.15 -2.54 -0.02 0.00 0.10 0.00 0.00 66.02 63.40 2p7l s SER 42 CO -0.09 -2.12 1.08 -0.54 0.98 0.00 0.00 173.24 172.55 2p7l s LYS 43 N -4.52 3.13 -0.17 4.02 1.02 -1.26 -4.35 119.74 117.62 2p7l s LYS 43 Ca 0.65 1.28 -0.27 0.00 0.02 0.00 0.00 55.97 57.66 2p7l s LYS 43 Cb -0.20 -2.00 0.07 0.00 -0.52 0.00 0.00 37.83 35.17 2p7l s LYS 43 CO 0.51 -0.97 0.68 -2.00 -0.92 0.00 0.00 175.35 172.65 2p7l s GLU 44 N -4.06 0.91 0.04 1.68 2.12 -0.35 -1.79 118.70 117.26 2p7l s GLU 44 Ca 0.65 0.65 -0.00 0.00 0.36 0.00 0.00 54.97 56.63 2p7l s GLU 44 Cb -0.18 0.44 -0.03 0.00 0.26 0.00 0.00 34.13 34.62 2p7l s GLU 44 CO 0.38 -0.19 -0.04 0.15 -0.54 0.00 0.00 175.26 175.02 2p7l s LYS 45 N -0.31 0.46 -0.02 4.30 1.02 -0.54 -1.42 119.74 123.23 2p7l s LYS 45 Ca -0.05 -0.87 0.06 0.00 0.02 0.00 0.00 55.97 55.13 2p7l s LYS 45 Cb -0.03 0.08 -0.02 0.00 -0.52 0.00 0.00 37.83 37.34 2p7l s LYS 45 CO 0.05 -0.06 -0.20 -0.06 -0.92 0.00 0.00 175.35 174.16 2p7l s PHE 46 N -2.41 2.51 0.13 3.18 2.99 -0.79 -0.99 117.98 122.61 2p7l s PHE 46 Ca -0.06 -0.30 0.03 0.00 0.00 0.00 0.00 56.93 56.61 2p7l s PHE 46 Cb -0.03 -1.55 -0.04 0.00 0.00 0.00 0.00 43.02 41.40 2p7l s PHE 46 CO -0.04 0.09 -0.08 -0.06 -0.00 0.00 0.00 175.22 175.13 2p7l s PHE 47 N -0.70 1.14 -0.21 0.36 0.40 0.83 -1.72 117.98 118.07 2p7l s PHE 47 Ca 0.11 -0.83 -0.02 0.00 -0.60 0.00 0.00 56.93 55.60 2p7l s PHE 47 Cb -0.10 -0.61 0.01 0.00 0.51 0.00 0.00 43.02 42.83 2p7l s PHE 47 CO 0.00 -0.01 -0.10 -1.17 0.70 0.00 0.00 175.22 174.64 2p7l s LEU 48 N -3.13 2.65 -0.19 -0.37 2.96 -0.30 -0.88 118.68 119.43 2p7l s LEU 48 Ca 0.15 -0.56 -0.01 0.00 -0.22 0.00 0.00 54.13 53.50 2p7l s LEU 48 Cb 0.04 -1.63 0.05 0.00 0.50 0.00 0.00 46.19 45.15 2p7l s LEU 48 CO -0.01 -0.03 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.33 2p7l s ILE 49 N 1.39 1.09 -1.51 6.68 1.01 -0.66 -1.51 121.20 127.69 2p7l s ILE 49 Ca 0.05 -0.76 -0.03 0.00 0.00 0.00 0.00 60.65 59.90 2p7l s ILE 49 Cb -0.14 -1.36 0.03 0.00 0.01 0.00 0.00 42.46 40.99 2p7l s ILE 49 CO -0.07 -0.00 0.30 0.00 0.00 0.00 0.00 174.94 175.17 2p7l n ALA 50 N 4.86 -1.90 -0.92 9.38 0.00 -1.26 0.27 120.51 130.94 2p7l n ALA 50 Ca -0.11 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.03 2p7l n ALA 50 Cb 0.47 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.46 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 -2.12 0.49 3.81 0.00 0.00 -1.26 -5.00 105.19 101.11 2p7l n GLY 51 Ca -0.26 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.40 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 4.25 -0.43 0.99 1.43 0.14 -5.05 118.68 120.02 2p7l s LEU 52 Ca 0.00 0.36 -0.25 0.00 -1.03 0.00 0.00 54.13 53.21 2p7l s LEU 52 Cb 0.00 -2.05 0.02 0.00 0.03 0.00 0.00 46.19 44.19 2p7l s LEU 52 CO 0.00 0.33 0.87 0.86 0.23 0.00 0.00 176.35 178.64 2p7l s TRP 53 N -0.53 2.98 -0.17 0.29 -0.00 -1.26 -1.65 118.94 118.61 2p7l s TRP 53 Ca 0.12 0.40 -0.03 0.00 -0.00 0.00 0.00 56.10 56.60 2p7l s TRP 53 Cb -0.12 -3.78 -0.02 0.00 -0.00 0.00 0.00 33.47 29.56 2p7l s TRP 53 CO 0.02 -0.99 -0.06 0.42 -0.00 0.00 0.00 176.95 176.34 2p7l s ILE 54 N 3.52 3.54 -0.19 5.86 -1.09 -0.06 -2.02 121.20 130.75 2p7l s ILE 54 Ca 0.35 -0.47 -0.05 0.00 -2.23 0.00 0.00 60.65 58.25 2p7l s ILE 54 Cb -0.11 -2.55 -0.02 0.00 -1.58 0.00 0.00 42.46 38.19 2p7l s ILE 54 CO 0.23 0.48 -0.02 0.00 -1.23 0.00 0.00 174.94 174.40 2p7l s ILE 56 N 0.96 2.98 -0.07 0.00 -1.09 -0.16 -0.77 121.20 123.04 2p7l s ILE 56 Ca 0.01 -0.64 0.02 0.00 -2.23 0.00 0.00 60.65 57.81 2p7l s ILE 56 Cb -0.14 -2.32 -0.02 0.00 -1.58 0.00 0.00 42.46 38.40 2p7l s ILE 56 CO 0.01 0.47 -0.12 -0.04 -1.23 0.00 0.00 174.94 174.04 2p7l s MET 57 N 1.23 2.78 -0.15 2.79 -1.94 0.32 -1.46 119.30 122.88 2p7l s MET 57 Ca 0.03 -0.65 -0.25 0.00 -1.71 0.00 0.00 55.69 53.11 2p7l s MET 57 Cb -0.14 -2.50 -0.02 0.00 2.01 0.00 0.00 34.83 34.18 2p7l s MET 57 CO -0.04 0.54 0.80 -2.00 -0.01 0.00 0.00 175.02 174.31 2p7l s GLU 58 N -0.50 4.33 0.14 2.03 2.12 -0.74 -0.95 118.70 125.13 2p7l s GLU 58 Ca 0.07 0.98 -0.24 0.00 0.36 0.00 0.00 54.97 56.13 2p7l s GLU 58 Cb -0.12 -3.55 0.08 0.00 0.26 0.00 0.00 34.13 30.80 2p7l s GLU 58 CO 0.02 -0.24 1.03 0.20 -0.54 0.00 0.00 175.26 175.73 2p7l s GLY 59 N 1.10 -0.11 -0.20 -1.50 0.00 0.01 -4.59 107.32 102.02 2p7l s GLY 59 Ca 0.38 0.00 0.15 0.00 0.00 0.00 0.00 44.72 45.26 2p7l s GLY 59 CO 0.14 1.04 1.63 1.22 0.00 0.00 0.00 173.10 177.13 2p7l n ASP 60 N -0.78 5.01 -4.68 1.64 8.00 -1.26 -3.01 116.55 121.47 2p7l n ASP 60 Ca -0.05 -2.89 -0.42 0.00 0.71 0.00 0.00 54.79 52.14 2p7l n ASP 60 Cb 0.60 -0.62 -0.04 0.00 -0.02 0.00 0.00 41.12 41.05 2p7l n ASP 60 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2p7l s SER 61 N -1.17 7.05 -0.08 -2.24 0.15 -1.26 -5.03 113.70 111.12 2p7l s SER 61 Ca 0.50 1.29 0.02 0.00 0.70 0.00 0.00 55.95 58.46 2p7l s SER 61 Cb 0.38 -2.49 0.01 0.00 -1.71 0.00 0.00 66.02 62.21 2p7l s SER 61 CO 0.15 -0.42 -0.14 -0.22 1.20 0.00 0.00 173.24 173.81 2p7l s LEU 62 N 2.13 1.70 0.20 3.45 2.96 -1.26 -4.73 118.68 123.13 2p7l s LEU 62 Ca 0.41 -0.35 -0.14 0.00 -0.22 0.00 0.00 54.13 53.83 2p7l s LEU 62 Cb -0.17 -0.94 -0.07 0.00 0.50 0.00 0.00 46.19 45.51 2p7l s LEU 62 CO 0.14 0.04 0.60 -1.58 -1.32 0.00 0.00 176.35 174.23 2p7l s GLN 63 N 0.69 3.98 0.70 1.98 2.00 -1.26 -5.06 119.66 122.68 2p7l s GLN 63 Ca -0.14 0.52 -0.12 0.00 -2.00 0.00 0.00 55.36 53.62 2p7l s GLN 63 Cb -0.16 -2.78 0.02 0.00 0.80 0.00 0.00 33.01 30.88 2p7l s GLN 63 CO 0.04 0.38 1.08 -1.83 -0.50 0.00 0.00 175.29 174.46 2p7l s GLU 64 N -2.32 2.73 0.18 1.67 1.03 -1.26 -4.79 118.70 115.94 2p7l s GLU 64 Ca 0.43 1.17 -0.30 0.00 0.03 0.00 0.00 54.97 56.30 2p7l s GLU 64 Cb -0.14 -1.96 -0.08 0.00 -0.80 0.00 0.00 34.13 31.15 2p7l s GLU 64 CO 0.20 -1.28 1.32 1.03 -1.33 0.00 0.00 175.26 175.20 2p7l s ARG 65 N -4.62 4.38 0.29 -4.83 0.52 -1.26 -5.01 118.95 108.41 2p7l s ARG 65 Ca 0.62 2.05 -0.07 0.00 -0.52 0.00 0.00 55.73 57.81 2p7l s ARG 65 Cb -0.17 -3.21 -0.00 0.00 0.52 0.00 0.00 34.95 32.09 2p7l s ARG 65 CO 0.49 -0.29 0.45 0.95 0.02 0.00 0.00 175.30 176.93 2p7l s THR 66 N 0.31 0.00 -2.15 0.02 -4.23 -1.26 -5.03 115.64 103.30 2p7l s THR 66 Ca 0.58 -1.53 0.25 0.00 -1.18 0.00 0.00 61.69 59.80 2p7l s THR 66 Cb -0.36 -2.45 0.62 0.00 1.34 0.00 0.00 72.50 71.65 2p7l s THR 66 CO 0.37 0.00 1.83 0.00 -0.54 0.00 0.00 174.62 176.27 2p7l n TYR 67 N -0.45 0.04 -1.92 3.99 9.36 -1.26 -4.76 117.16 122.16 2p7l n TYR 67 Ca -0.00 -0.02 -0.42 0.00 3.32 0.00 0.00 57.90 60.77 2p7l n TYR 67 Cb 0.62 0.00 -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 -1.77 6.60 0.23 2.98 0.01 -1.26 -4.93 114.94 116.79 2p7l s ASN 68 Ca 0.36 2.51 -0.22 0.00 -0.71 0.00 0.00 52.86 54.80 2p7l s ASN 68 Cb 0.18 -2.57 0.05 0.00 0.41 0.00 0.00 41.25 39.32 2p7l s ASN 68 CO 0.29 -0.88 0.87 -1.38 -1.51 0.00 0.00 177.10 174.49 2p7l s HIS 69 N 2.40 -0.09 -0.09 2.20 -3.43 -1.26 -4.66 115.29 110.35 2p7l s HIS 69 Ca 0.73 -0.32 -0.02 0.00 -0.80 0.00 0.00 55.06 54.65 2p7l s HIS 69 Cb -0.41 0.70 -0.03 0.00 -1.43 0.00 0.00 32.58 31.41 2p7l s HIS 69 CO 0.32 -1.07 0.00 0.42 -2.00 0.00 0.00 174.74 172.41 2p7l s ILE 70 N -3.24 4.31 -0.13 -5.38 1.01 -1.23 -5.04 121.20 111.49 2p7l s ILE 70 Ca 0.13 -0.25 0.02 0.00 0.00 0.00 0.00 60.65 60.55 2p7l s ILE 70 Cb -0.04 -2.82 0.01 0.00 0.01 0.00 0.00 42.46 39.63 2p7l s ILE 70 CO 0.05 0.60 -0.18 0.00 0.00 0.00 0.00 174.94 175.41 2p7l s ALA 71 N -0.79 1.97 0.14 9.38 0.00 -1.26 -1.95 121.76 129.25 2p7l s ALA 71 Ca 0.12 -0.93 -0.03 0.00 0.00 0.00 0.00 51.96 51.12 2p7l s ALA 71 Cb -0.11 -0.95 -0.05 0.00 0.00 0.00 0.00 23.12 22.00 2p7l s ALA 71 CO 0.02 -0.12 0.36 -0.06 0.00 0.00 0.00 175.76 175.96 2p7l s PHE 72 N 1.02 3.48 -0.17 0.00 0.40 -0.08 -4.94 117.98 117.69 2p7l s PHE 72 Ca -0.04 0.48 -0.16 0.00 -0.60 0.00 0.00 56.93 56.60 2p7l s PHE 72 Cb -0.15 -1.94 -0.04 0.00 0.51 0.00 0.00 43.02 41.40 2p7l s PHE 72 CO -0.04 0.44 0.40 -1.14 0.70 0.00 0.00 175.22 175.59 2p7l s GLN 73 N -2.77 4.24 0.37 0.44 0.74 -1.26 -1.18 119.66 120.24 2p7l s GLN 73 Ca 0.40 0.26 0.04 0.00 0.05 0.00 0.00 55.36 56.11 2p7l s GLN 73 Cb -0.12 -3.48 -0.02 0.00 1.10 0.00 0.00 33.01 30.49 2p7l s GLN 73 CO 0.26 0.07 0.16 0.44 -0.55 0.00 0.00 175.29 175.68 2p7l n ILE 74 N 3.99 0.00 -4.05 -2.34 -5.35 -0.62 -4.92 119.36 106.07 2p7l n ILE 74 Ca -0.09 -2.24 -0.26 0.00 -0.27 0.00 0.00 62.75 59.90 2p7l n ILE 74 Cb 0.51 0.87 -0.05 0.00 -1.74 0.00 0.00 39.64 39.23 2p7l n ILE 74 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 2p7l s GLN 75 N -3.42 3.04 0.26 6.28 -1.52 -1.26 -3.93 119.66 119.11 2p7l s GLN 75 Ca 0.23 -0.81 -0.02 0.00 -1.95 0.00 0.00 55.36 52.80 2p7l s GLN 75 Cb 0.01 -2.72 0.45 0.00 -0.22 0.00 0.00 33.01 30.53 2p7l s GLN 75 CO 0.16 0.49 1.84 0.77 -0.25 0.00 0.00 175.29 178.30 2p7l h SER 76 N 2.27 0.86 0.27 5.90 0.02 -1.94 -0.62 113.55 120.30 2p7l h SER 76 Ca -0.48 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 2p7l h SER 76 Cb 1.20 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.60 2p7l h SER 76 CO 0.64 0.50 0.00 -0.62 -1.14 0.00 0.00 176.83 176.21 2p7l n GLU 77 N -4.64 0.22 -0.00 3.45 4.71 -1.26 -2.63 120.64 120.49 2p7l n GLU 77 Ca 0.16 0.14 0.07 0.00 -0.01 0.00 0.00 57.16 57.52 2p7l n GLU 77 Cb 0.28 -1.50 -0.10 0.00 -1.01 0.00 0.00 31.44 29.11 2p7l n GLU 77 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 2p7l n GLU 78 N -1.27 1.45 -0.21 3.49 1.02 -0.25 -4.62 120.64 120.25 2p7l n GLU 78 Ca 0.07 -0.06 0.01 0.00 -0.02 0.00 0.00 57.16 57.17 2p7l n GLU 78 Cb 0.12 -1.26 0.11 0.00 -0.02 0.00 0.00 31.44 30.39 2p7l n GLU 78 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2p7l h VAL 79 N 0.00 0.52 -0.02 2.62 2.07 -1.39 -0.80 116.25 119.25 2p7l h VAL 79 Ca 0.00 -0.05 0.01 0.00 0.82 0.00 0.00 66.70 67.48 2p7l h VAL 79 Cb 0.49 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 2p7l h VAL 79 CO 0.00 0.03 -0.03 0.44 0.02 0.00 0.00 177.57 178.03 2p7l h ASP 80 N 0.16 -0.10 -0.10 0.57 3.32 -1.82 -1.55 116.42 116.90 2p7l h ASP 80 Ca 0.33 0.02 0.01 0.00 0.02 0.00 0.00 57.03 57.41 2p7l h ASP 80 Cb 0.53 0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.12 2p7l h ASP 80 CO -0.50 -0.05 0.05 -0.33 -1.72 0.00 0.00 179.24 176.69 2p7l h GLU 81 N -0.05 0.10 -0.35 3.56 5.08 -1.65 -0.72 114.58 120.55 2p7l h GLU 81 Ca 0.02 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.40 2p7l h GLU 81 Cb 0.08 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 2p7l h GLU 81 CO -0.05 0.07 0.24 1.88 -1.00 0.00 0.00 179.01 180.15 2p7l h TYR 82 N 0.11 0.37 -0.39 4.33 -1.99 -1.07 0.18 116.97 118.50 2p7l h TYR 82 Ca 0.04 0.01 -0.04 0.00 2.00 0.00 0.00 58.73 60.74 2p7l h TYR 82 Cb 0.01 -0.12 -0.02 0.00 2.00 0.00 0.00 36.73 38.60 2p7l h TYR 82 CO -0.09 0.22 0.08 1.15 -0.00 0.00 0.00 178.16 179.52 2p7l h THR 83 N 0.39 1.24 -0.63 -2.88 2.02 -0.47 0.29 112.91 112.86 2p7l h THR 83 Ca 0.14 -0.83 -0.02 0.00 0.77 0.00 0.00 66.41 66.47 2p7l h THR 83 Cb 0.09 1.02 -0.03 0.00 -1.74 0.00 0.00 68.15 67.49 2p7l h THR 83 CO -0.03 0.29 0.31 -0.08 0.37 0.00 0.00 175.52 176.38 2p7l h GLU 84 N 0.50 0.90 -0.71 6.66 4.57 0.18 -0.96 114.58 125.73 2p7l h GLU 84 Ca 0.12 -0.13 -0.03 0.00 -1.18 0.00 0.00 59.36 58.15 2p7l h GLU 84 Cb 0.34 -0.17 -0.03 0.00 -0.16 0.00 0.00 28.75 28.74 2p7l h GLU 84 CO 0.01 0.71 0.34 0.00 -1.18 0.00 0.00 179.01 178.89 2p7l h ARG 85 N 0.86 1.02 -0.52 1.92 3.08 -0.26 -2.77 114.38 117.71 2p7l h ARG 85 Ca 0.22 -0.15 -0.10 0.00 0.07 0.00 0.00 59.98 60.01 2p7l h ARG 85 Cb 0.10 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 2p7l h ARG 85 CO -0.03 0.81 -0.09 0.82 -1.07 0.00 0.00 179.97 180.41 2p7l h ILE 86 N 0.99 1.26 -0.23 2.04 2.04 -0.03 -2.84 117.51 120.75 2p7l h ILE 86 Ca 0.24 -1.21 -0.03 0.00 1.00 0.00 0.00 64.86 64.86 2p7l h ILE 86 Cb 0.12 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 2p7l h ILE 86 CO -0.03 0.43 0.03 0.11 0.00 0.00 0.00 178.15 178.68 2p7l h LYS 87 N 0.85 0.33 0.00 2.37 1.57 -0.94 -1.95 116.57 118.81 2p7l h LYS 87 Ca 0.14 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.83 2p7l h LYS 87 Cb 0.62 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.87 2p7l h LYS 87 CO 0.04 0.34 -0.21 0.00 -0.57 0.00 0.00 179.45 179.05 2p7l h ALA 88 N 1.71 1.26 0.00 3.86 0.00 -1.25 -2.74 119.26 122.10 2p7l h ALA 88 Ca 0.08 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2p7l h ALA 88 Cb 0.18 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2p7l h ALA 88 CO 0.00 0.26 0.00 -0.07 0.00 0.00 0.00 179.25 179.44 2p7l h LEU 89 N 0.00 0.00 0.00 0.00 3.38 -1.31 -3.47 115.31 113.91 2p7l h LEU 89 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2p7l h LEU 89 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2p7l h LEU 89 CO 0.03 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.17 2p7l n GLY 90 N 0.79 0.63 3.82 0.83 0.00 -1.03 -5.01 105.19 105.22 2p7l n GLY 90 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 2p7l n GLY 90 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2p7l s VAL 91 N -2.79 4.14 0.18 1.61 -7.23 -1.26 -4.96 120.40 110.09 2p7l s VAL 91 Ca 0.00 0.94 -0.32 0.00 -1.81 0.00 0.00 61.98 60.79 2p7l s VAL 91 Cb 0.00 -3.53 -0.12 0.00 0.56 0.00 0.00 36.38 33.29 2p7l s VAL 91 CO 0.00 -0.67 1.73 1.21 -0.31 0.00 0.00 175.10 177.06 2p7l n GLU 92 N -2.12 2.69 -4.28 4.82 2.13 -1.26 -4.88 120.64 117.74 2p7l n GLU 92 Ca 0.08 0.97 -0.20 0.00 0.66 0.00 0.00 57.16 58.67 2p7l n GLU 92 Cb 0.53 -2.82 -0.16 0.00 0.27 0.00 0.00 31.44 29.27 2p7l n GLU 92 CO 0.00 0.00 0.00 1.41 -0.41 0.00 0.00 177.13 178.13 2p7l s MET 93 N 1.49 0.88 0.08 5.31 -2.45 -1.26 -1.80 119.30 121.55 2p7l s MET 93 Ca 0.77 -0.21 -0.29 0.00 -1.25 0.00 0.00 55.69 54.71 2p7l s MET 93 Cb -0.53 -0.84 -0.05 0.00 1.25 0.00 0.00 34.83 34.66 2p7l s MET 93 CO 0.34 0.03 0.92 0.15 1.05 0.00 0.00 175.02 177.51 2p7l s LYS 94 N 0.47 4.63 0.31 4.11 1.02 -0.87 -5.01 119.74 124.41 2p7l s LYS 94 Ca -0.07 1.35 -0.29 0.00 0.02 0.00 0.00 55.97 56.98 2p7l s LYS 94 Cb -0.11 -3.39 -0.11 0.00 -0.52 0.00 0.00 37.83 33.71 2p7l s LYS 94 CO 0.01 0.19 1.51 -1.25 -0.92 0.00 0.00 175.35 174.88 2p7l s PRO 95 N 0.14 4.17 0.14 -1.68 0.04 -1.26 -4.58 135.00 131.97 2p7l s PRO 95 Ca 0.46 2.49 -0.31 0.00 0.04 0.00 0.00 61.00 63.67 2p7l s PRO 95 Cb -0.22 -3.03 -0.10 0.00 0.04 0.00 0.00 34.50 31.19 2p7l s PRO 95 CO 0.28 -0.52 1.68 -2.00 0.04 0.00 0.00 177.00 176.47 2p7l s GLU 96 N -1.03 4.18 0.18 4.56 2.12 -1.26 -5.01 118.70 122.44 2p7l s GLU 96 Ca 0.58 2.45 0.01 0.00 0.36 0.00 0.00 54.97 58.37 2p7l s GLU 96 Cb -0.45 -3.34 -0.04 0.00 0.26 0.00 0.00 34.13 30.56 2p7l s GLU 96 CO 0.52 -0.72 0.34 -0.98 -0.54 0.00 0.00 175.26 173.88 2p7l s ARG 97 N 1.86 3.48 0.06 4.30 1.70 -1.26 -5.06 118.95 124.02 2p7l s ARG 97 Ca 0.74 -0.46 -0.31 0.00 -0.47 0.00 0.00 55.73 55.23 2p7l s ARG 97 Cb -0.44 -2.90 -0.06 0.00 -0.57 0.00 0.00 34.95 30.97 2p7l s ARG 97 CO 0.33 0.46 1.33 -1.25 -1.08 0.00 0.00 175.30 175.08 2p7l s PRO 98 N -3.29 4.34 0.29 3.89 0.04 -1.26 -4.92 135.00 134.09 2p7l s PRO 98 Ca 0.37 1.94 0.03 0.00 0.04 0.00 0.00 61.00 63.37 2p7l s PRO 98 Cb -0.11 -3.39 -0.03 0.00 0.04 0.00 0.00 34.50 31.01 2p7l s PRO 98 CO 0.29 -0.43 0.45 0.50 0.04 0.00 0.00 177.00 177.85 2p7l s ARG 99 N 1.55 3.45 0.68 4.56 3.52 -1.26 -5.07 118.95 126.38 2p7l s ARG 99 Ca 0.62 -0.56 -0.17 0.00 -0.13 0.00 0.00 55.73 55.49 2p7l s ARG 99 Cb -0.33 -2.78 0.01 0.00 -1.56 0.00 0.00 34.95 30.29 2p7l s ARG 99 CO 0.28 0.28 1.28 0.08 -0.81 0.00 0.00 175.30 176.41 2p7l s VAL 100 N -2.15 2.05 0.41 7.11 1.01 -1.26 -4.89 120.40 122.68 2p7l s VAL 100 Ca 0.37 0.03 0.14 0.00 0.00 0.00 0.00 61.98 62.52 2p7l s VAL 100 Cb -0.09 -2.89 0.35 0.00 0.00 0.00 0.00 36.38 33.74 2p7l s VAL 100 CO 0.32 -0.01 1.91 -0.61 0.00 0.00 0.00 175.10 176.72 2p7l h GLN 101 N 0.26 0.47 0.24 2.72 4.15 -1.97 -3.00 115.11 117.98 2p7l h GLN 101 Ca -0.50 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 58.88 2p7l h GLN 101 Cb 1.33 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 28.92 2p7l h GLN 101 CO 0.52 0.31 -0.12 0.78 -1.93 0.00 0.00 178.83 178.39 2p7l h GLY 102 N 0.48 -0.34 -1.59 2.39 0.00 -1.93 -3.46 103.07 98.63 2p7l h GLY 102 Ca 0.38 0.13 -0.48 0.00 0.00 0.00 0.00 47.33 47.36 2p7l h GLY 102 CO -0.14 -0.12 -0.90 -1.84 0.00 0.00 0.00 176.54 173.54 2p7l n GLU 103 N -4.99 -1.28 0.00 4.80 0.00 -1.13 -4.64 120.64 113.40 2p7l n GLU 103 Ca -0.06 -0.35 0.00 0.00 0.00 0.00 0.00 57.16 56.75 2p7l n GLU 103 Cb 0.20 -1.76 0.00 0.00 0.00 0.00 0.00 31.44 29.88 2p7l n GLU 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2p7l n GLY 104 N 1.83 0.71 2.98 -1.84 0.00 -1.26 -4.75 105.19 102.88 2p7l n GLY 104 Ca 0.02 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 2p7l n GLY 104 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2p7l s ARG 105 N 1.23 0.13 0.04 1.61 3.52 -0.79 -4.78 118.95 119.90 2p7l s ARG 105 Ca 0.00 0.20 0.01 0.00 -0.13 0.00 0.00 55.73 55.82 2p7l s ARG 105 Cb 0.00 0.02 -0.03 0.00 -1.56 0.00 0.00 34.95 33.39 2p7l s ARG 105 CO 0.00 -0.04 -0.06 -1.12 -0.81 0.00 0.00 175.30 173.27 2p7l s SER 106 N 0.26 0.63 0.01 -2.12 0.01 -1.26 -0.89 113.70 110.34 2p7l s SER 106 Ca -0.02 -0.61 0.04 0.00 1.31 0.00 0.00 55.95 56.67 2p7l s SER 106 Cb -0.03 0.08 -0.01 0.00 0.21 0.00 0.00 66.02 66.27 2p7l s SER 106 CO -0.01 -0.29 -0.11 0.27 0.41 0.00 0.00 173.24 173.51 2p7l s ILE 107 N -1.80 0.87 0.08 1.44 -4.36 -0.33 -4.74 121.20 112.36 2p7l s ILE 107 Ca -0.09 -0.66 0.07 0.00 -0.26 0.00 0.00 60.65 59.72 2p7l s ILE 107 Cb -0.07 -0.76 -0.03 0.00 1.25 0.00 0.00 42.46 42.84 2p7l s ILE 107 CO -0.01 0.11 -0.20 -0.31 0.24 0.00 0.00 174.94 174.77 2p7l s TYR 108 N -0.52 1.70 0.01 1.37 1.51 -1.26 -0.44 117.35 119.73 2p7l s TYR 108 Ca 0.02 -0.41 -0.28 0.00 -1.01 0.00 0.00 57.07 55.40 2p7l s TYR 108 Cb -0.06 -0.96 0.10 0.00 -0.11 0.00 0.00 41.96 40.93 2p7l s TYR 108 CO 0.00 0.15 0.82 -0.59 -1.11 0.00 0.00 175.55 174.83 2p7l s PHE 109 N -1.06 -0.41 0.26 2.71 -0.12 -0.62 -2.05 117.98 116.69 2p7l s PHE 109 Ca 0.06 0.36 0.07 0.00 -0.05 0.00 0.00 56.93 57.37 2p7l s PHE 109 Cb -0.10 0.52 -0.03 0.00 -0.63 0.00 0.00 43.02 42.78 2p7l s PHE 109 CO 0.03 -0.59 0.23 0.71 -0.05 0.00 0.00 175.22 175.56 2p7l s TYR 110 N -2.84 3.13 0.00 3.49 1.51 -0.75 0.05 117.35 121.94 2p7l s TYR 110 Ca 0.02 -0.13 0.00 0.00 -1.01 0.00 0.00 57.07 55.95 2p7l s TYR 110 Cb -0.01 -1.48 0.00 0.00 -0.11 0.00 0.00 41.96 40.36 2p7l s TYR 110 CO -0.07 0.46 0.00 -0.40 -1.11 0.00 0.00 175.55 174.43 2p7l n ASP 111 N -1.24 0.00 -1.23 2.29 3.85 -0.98 -4.43 116.55 114.81 2p7l n ASP 111 Ca -0.07 0.00 0.11 0.00 -0.71 0.00 0.00 54.79 54.12 2p7l n ASP 111 Cb 0.58 0.00 0.27 0.00 -1.35 0.00 0.00 41.12 40.62 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 0.76 -2.62 2.11 3.01 -1.26 -4.47 117.46 114.99 2p7l n PHE 112 Ca 0.00 -0.40 -0.10 0.00 1.01 0.00 0.00 57.45 57.96 2p7l n PHE 112 Cb 0.00 -0.00 0.03 0.00 -0.01 0.00 0.00 39.48 39.50 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 1.52 2.35 -1.29 4.37 8.00 -1.26 -4.95 116.55 125.29 2p7l n ASP 113 Ca 0.22 -2.72 -0.15 0.00 0.71 0.00 0.00 54.79 52.84 2p7l n ASP 113 Cb 0.60 -0.48 -0.07 0.00 -0.02 0.00 0.00 41.12 41.16 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 -0.39 -4.91 -4.68 -2.24 3.02 -1.26 -4.70 115.26 100.10 2p7l n ASN 114 Ca 0.17 0.38 -0.41 0.00 -0.03 0.00 0.00 54.58 54.69 2p7l n ASN 114 Cb 0.81 -4.14 -0.04 0.00 -0.61 0.00 0.00 39.78 35.79 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 -2.29 3.44 -0.19 3.10 3.76 -1.26 -4.72 115.29 117.13 2p7l s HIS 115 Ca 0.00 1.20 -0.15 0.00 -0.15 0.00 0.00 55.06 55.96 2p7l s HIS 115 Cb 0.00 -2.94 -0.04 0.00 1.11 0.00 0.00 32.58 30.71 2p7l s HIS 115 CO 0.00 -0.17 0.36 -1.17 -0.85 0.00 0.00 174.74 172.90 2p7l s LEU 116 N 1.88 4.19 0.17 0.89 2.96 -1.26 -2.32 118.68 125.18 2p7l s LEU 116 Ca 0.36 0.50 0.08 0.00 -0.22 0.00 0.00 54.13 54.86 2p7l s LEU 116 Cb -0.17 -2.46 -0.04 0.00 0.50 0.00 0.00 46.19 44.03 2p7l s LEU 116 CO 0.13 -0.01 -0.09 -0.36 -1.32 0.00 0.00 176.35 174.70 2p7l s PHE 117 N 1.00 2.66 -0.01 5.38 0.40 0.11 -3.56 117.98 123.97 2p7l s PHE 117 Ca 0.18 -0.21 0.02 0.00 -0.60 0.00 0.00 56.93 56.32 2p7l s PHE 117 Cb -0.14 -1.32 -0.00 0.00 0.51 0.00 0.00 43.02 42.07 2p7l s PHE 117 CO 0.07 0.50 -0.06 -2.00 0.70 0.00 0.00 175.22 174.42 2p7l s GLU 118 N -2.72 0.51 -0.21 0.44 2.12 -0.82 -1.59 118.70 116.42 2p7l s GLU 118 Ca 0.24 -0.21 -0.03 0.00 0.36 0.00 0.00 54.97 55.34 2p7l s GLU 118 Cb -0.09 -0.50 -0.00 0.00 0.26 0.00 0.00 34.13 33.80 2p7l s GLU 118 CO 0.15 0.11 -0.07 -0.51 -0.54 0.00 0.00 175.26 174.40 2p7l s LEU 119 N -0.05 2.77 -0.12 2.70 1.43 0.42 -0.90 118.68 124.92 2p7l s LEU 119 Ca 0.01 -0.47 0.02 0.00 -1.03 0.00 0.00 54.13 52.66 2p7l s LEU 119 Cb -0.03 -1.69 0.01 0.00 0.03 0.00 0.00 46.19 44.51 2p7l s LEU 119 CO -0.00 -0.02 -0.18 -2.28 0.23 0.00 0.00 176.35 174.09 2p7l s HIS 120 N 1.43 2.27 -0.35 0.29 2.46 -0.32 -1.19 115.29 119.87 2p7l s HIS 120 Ca 0.05 -1.08 -0.13 0.00 0.47 0.00 0.00 55.06 54.37 2p7l s HIS 120 Cb -0.14 -1.58 -0.01 0.00 -0.13 0.00 0.00 32.58 30.72 2p7l s HIS 120 CO -0.05 -0.52 0.26 0.00 -2.47 0.00 0.00 174.74 171.96 2p7l s ALA 121 N 0.86 3.50 0.00 1.58 0.00 -0.07 -1.58 121.76 126.05 2p7l s ALA 121 Ca -0.08 -1.43 0.00 0.00 0.00 0.00 0.00 51.96 50.45 2p7l s ALA 121 Cb -0.15 -2.72 0.00 0.00 0.00 0.00 0.00 23.12 20.25 2p7l s ALA 121 CO -0.01 -1.07 0.00 0.41 0.00 0.00 0.00 175.76 175.10 2p7l n GLY 122 N 5.11 4.34 3.92 0.00 0.00 -1.26 -1.89 105.19 115.42 2p7l n GLY 122 Ca -0.12 -0.89 -0.29 0.00 0.00 0.00 0.00 46.02 44.72 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 -0.28 2.01 0.06 2.61 -4.23 -1.26 -4.94 115.64 109.62 2p7l s THR 123 Ca 0.00 -0.03 -0.18 0.00 -1.18 0.00 0.00 61.69 60.30 2p7l s THR 123 Cb 0.00 -2.98 -0.13 0.00 1.34 0.00 0.00 72.50 70.73 2p7l s THR 123 CO 0.00 0.00 1.35 0.25 -0.54 0.00 0.00 174.62 175.68 2p7l h LEU 124 N -1.40 0.56 0.21 4.79 5.85 -2.01 -2.90 115.31 120.42 2p7l h LEU 124 Ca -0.45 -0.50 0.01 0.00 0.84 0.00 0.00 57.88 57.78 2p7l h LEU 124 Cb 1.27 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.11 2p7l h LEU 124 CO 0.47 0.95 -0.33 -0.33 -0.34 0.00 0.00 178.44 178.86 2p7l h GLU 125 N 0.18 -0.60 -0.31 1.25 3.07 -1.95 -0.14 114.58 116.09 2p7l h GLU 125 Ca 0.02 0.04 0.09 0.00 -0.50 0.00 0.00 59.36 59.01 2p7l h GLU 125 Cb 0.81 0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 28.85 2p7l h GLU 125 CO 0.06 -0.40 0.30 0.93 -1.40 0.00 0.00 179.01 178.50 2p7l h GLU 126 N -0.62 0.00 -0.00 2.33 5.08 -1.95 0.52 114.58 119.94 2p7l h GLU 126 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2p7l h GLU 126 Cb 0.61 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.86 2p7l h GLU 126 CO -0.14 0.00 -0.09 -2.13 -1.00 0.00 0.00 179.01 175.65 2p7l n ARG 127 N -3.92 0.56 -0.73 2.33 3.00 -0.15 -3.58 116.66 114.19 2p7l n ARG 127 Ca 0.05 -0.15 0.06 0.00 -0.00 0.00 0.00 57.85 57.80 2p7l n ARG 127 Cb 0.45 -1.50 0.12 0.00 0.00 0.00 0.00 32.46 31.54 2p7l n ARG 127 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 2p7l n LEU 128 N -1.09 1.88 -4.59 6.15 4.77 0.18 -4.90 117.00 119.40 2p7l n LEU 128 Ca 0.14 -2.92 -0.42 0.00 -0.03 0.00 0.00 56.01 52.78 2p7l n LEU 128 Cb 0.27 -0.31 -0.03 0.00 -2.33 0.00 0.00 43.42 41.02 2p7l n LEU 128 CO 0.24 0.91 1.42 -0.54 -1.33 0.00 0.00 177.39 178.09 2p7l s LYS 129 N -1.95 3.31 0.00 3.23 -0.14 -1.00 -5.02 119.74 118.17 2p7l s LYS 129 Ca 0.31 1.05 0.00 0.00 -1.36 0.00 0.00 55.97 55.98 2p7l s LYS 129 Cb 0.32 -4.16 0.00 0.00 -1.68 0.00 0.00 37.83 32.31 2p7l s LYS 129 CO -0.07 -1.89 0.00 2.89 -0.76 0.00 0.00 175.35 175.52