#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p7m s ILE 2 N 0.00 3.47 0.02 2.02 -1.09 -1.26 -4.93 121.20 119.43 2p7m s ILE 2 Ca 0.00 1.11 0.13 0.00 -2.23 0.00 0.00 60.65 59.67 2p7m s ILE 2 Cb 0.00 -3.71 0.00 0.00 -1.58 0.00 0.00 42.46 37.17 2p7m s ILE 2 CO 0.00 0.12 1.48 0.28 -1.23 0.00 0.00 174.94 175.58 2p7m h SER 3 N 6.26 0.00 0.00 3.58 0.02 -2.11 -3.49 113.55 117.80 2p7m h SER 3 Ca -0.43 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 2p7m h SER 3 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 2p7m h SER 3 CO 0.82 0.61 0.00 0.61 -1.14 0.00 0.00 176.83 177.73 2p7m n GLY 4 N 0.97 -0.14 3.73 -3.77 0.00 -1.26 -5.10 105.19 99.62 2p7m n GLY 4 Ca 0.01 -1.29 -0.39 0.00 0.00 0.00 0.00 46.02 44.34 2p7m n GLY 4 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2p7m s LEU 5 N 0.00 4.35 -0.08 0.99 2.96 -1.26 -4.99 118.68 120.65 2p7m s LEU 5 Ca 0.00 1.20 -0.06 0.00 -0.22 0.00 0.00 54.13 55.05 2p7m s LEU 5 Cb 0.00 -3.05 -0.02 0.00 0.50 0.00 0.00 46.19 43.62 2p7m s LEU 5 CO 0.00 -0.04 -0.11 -0.24 -1.32 0.00 0.00 176.35 174.64 2p7m n SER 6 N 3.41 1.05 -3.83 3.68 2.88 -1.26 -4.98 113.62 114.57 2p7m n SER 6 Ca -0.03 0.46 -0.06 0.00 -1.33 0.00 0.00 58.87 57.91 2p7m n SER 6 Cb 0.51 -0.71 -0.02 0.00 -0.75 0.00 0.00 64.21 63.24 2p7m n SER 6 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 2p7m s HIS 7 N -1.74 -0.17 -0.08 0.66 -3.43 -1.26 -4.35 115.29 104.92 2p7m s HIS 7 Ca -0.09 -0.24 0.04 0.00 -0.80 0.00 0.00 55.06 53.97 2p7m s HIS 7 Cb 0.01 0.69 -0.00 0.00 -1.43 0.00 0.00 32.58 31.85 2p7m s HIS 7 CO 0.13 -1.11 -0.22 0.42 -2.00 0.00 0.00 174.74 171.96 2p7m s ILE 8 N -3.72 1.89 -0.12 -5.38 1.01 -0.87 -5.01 121.20 108.99 2p7m s ILE 8 Ca 0.11 -0.94 0.01 0.00 0.00 0.00 0.00 60.65 59.83 2p7m s ILE 8 Cb -0.05 -1.63 -0.01 0.00 0.01 0.00 0.00 42.46 40.78 2p7m s ILE 8 CO 0.06 0.53 -0.15 -0.89 0.00 0.00 0.00 174.94 174.48 2p7m s THR 9 N 0.22 2.85 0.01 2.92 2.01 -1.26 -0.16 115.64 122.24 2p7m s THR 9 Ca -0.13 -0.73 0.07 0.00 0.31 0.00 0.00 61.69 61.20 2p7m s THR 9 Cb -0.16 -2.18 -0.02 0.00 0.01 0.00 0.00 72.50 70.15 2p7m s THR 9 CO 0.06 0.53 -0.20 -0.76 -0.69 0.00 0.00 174.62 173.56 2p7m s LEU 10 N 0.34 2.09 -0.18 4.42 1.43 -0.10 -4.99 118.68 121.69 2p7m s LEU 10 Ca -0.13 -0.43 -0.07 0.00 -1.03 0.00 0.00 54.13 52.48 2p7m s LEU 10 Cb -0.16 -1.02 -0.04 0.00 0.03 0.00 0.00 46.19 45.00 2p7m s LEU 10 CO 0.06 0.21 0.04 -0.63 0.23 0.00 0.00 176.35 176.27 2p7m s ILE 11 N -0.61 4.60 0.24 -0.59 -1.09 -1.26 -1.03 121.20 121.46 2p7m s ILE 11 Ca 0.08 -0.10 0.01 0.00 -2.23 0.00 0.00 60.65 58.41 2p7m s ILE 11 Cb -0.08 -3.06 -0.05 0.00 -1.58 0.00 0.00 42.46 37.68 2p7m s ILE 11 CO 0.00 0.47 0.08 0.68 -1.23 0.00 0.00 174.94 174.94 2p7m s VAL 12 N 0.38 0.54 -0.14 2.92 -7.23 0.60 -4.91 120.40 112.55 2p7m s VAL 12 Ca 0.02 -2.00 -0.21 0.00 -1.81 0.00 0.00 61.98 57.98 2p7m s VAL 12 Cb -0.13 -2.53 -0.24 0.00 0.56 0.00 0.00 36.38 34.04 2p7m s VAL 12 CO 0.01 -0.09 0.51 0.50 -0.31 0.00 0.00 175.10 175.72 2p7m h LYS 13 N 2.46 0.11 -4.47 4.82 1.63 -1.86 0.37 116.57 119.63 2p7m h LYS 13 Ca -0.38 -0.18 -0.65 0.00 -0.85 0.00 0.00 60.65 58.59 2p7m h LYS 13 Cb 1.24 0.07 -0.40 0.00 -0.60 0.00 0.00 32.23 32.54 2p7m h LYS 13 CO 0.61 1.09 -0.72 0.34 -3.45 0.00 0.00 179.45 177.31 2p7m s ASP 14 N -6.77 4.64 0.47 4.20 -1.08 -1.26 -4.61 116.67 112.25 2p7m s ASP 14 Ca -0.22 -2.10 0.18 0.00 -0.52 0.00 0.00 52.55 49.89 2p7m s ASP 14 Cb 0.03 -1.51 1.17 0.00 -1.46 0.00 0.00 42.92 41.15 2p7m s ASP 14 CO 0.69 -0.38 1.98 0.25 0.52 0.00 0.00 175.17 178.24 2p7m h LEU 15 N 7.65 0.23 -0.14 -1.34 5.85 -1.94 -2.16 115.31 123.46 2p7m h LEU 15 Ca -0.06 0.01 -0.19 0.00 0.84 0.00 0.00 57.88 58.49 2p7m h LEU 15 Cb 1.02 -0.04 0.01 0.00 0.37 0.00 0.00 40.66 42.01 2p7m h LEU 15 CO 0.52 0.13 -0.64 0.78 -0.34 0.00 0.00 178.44 178.89 2p7m h ASN 16 N 0.25 0.81 -0.60 1.25 2.35 -1.99 -1.39 115.58 116.26 2p7m h ASN 16 Ca 0.27 -0.63 -0.02 0.00 -0.55 0.00 0.00 56.30 55.37 2p7m h ASN 16 Cb 0.73 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.84 2p7m h ASN 16 CO -0.06 1.30 0.28 0.11 -1.65 0.00 0.00 177.43 177.41 2p7m h LYS 17 N 0.37 0.87 -0.35 0.81 1.57 -1.87 -2.49 116.57 115.48 2p7m h LYS 17 Ca -0.04 -0.13 -0.07 0.00 -1.87 0.00 0.00 60.65 58.53 2p7m h LYS 17 Cb 1.27 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 33.41 2p7m h LYS 17 CO 0.13 0.71 -0.09 1.15 -0.57 0.00 0.00 179.45 180.78 2p7m h THR 18 N 0.82 1.23 -0.41 -0.16 2.02 -1.38 -2.66 112.91 112.36 2p7m h THR 18 Ca 0.20 -1.02 0.02 0.00 0.77 0.00 0.00 66.41 66.38 2p7m h THR 18 Cb 0.14 1.06 -0.03 0.00 -1.74 0.00 0.00 68.15 67.58 2p7m h THR 18 CO -0.02 0.34 0.25 0.74 0.37 0.00 0.00 175.52 177.20 2p7m h THR 19 N 0.55 1.06 -0.72 3.16 2.02 -0.80 -1.06 112.91 117.12 2p7m h THR 19 Ca 0.10 -0.17 -0.05 0.00 0.77 0.00 0.00 66.41 67.06 2p7m h THR 19 Cb 0.48 0.50 -0.03 0.00 -1.74 0.00 0.00 68.15 67.37 2p7m h THR 19 CO 0.03 0.09 0.26 0.00 0.37 0.00 0.00 175.52 176.27 2p7m h ALA 20 N 1.18 0.94 0.50 6.16 0.00 -1.33 -0.98 119.26 125.72 2p7m h ALA 20 Ca 0.16 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2p7m h ALA 20 Cb -0.00 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 2p7m h ALA 20 CO -0.07 0.59 -0.43 0.35 0.00 0.00 0.00 179.25 179.69 2p7m h PHE 21 N 1.04 -1.16 -0.65 0.00 3.57 -1.11 0.16 116.94 118.80 2p7m h PHE 21 Ca 0.24 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.78 2p7m h PHE 21 Cb 0.25 0.44 -0.05 0.00 2.79 0.00 0.00 35.95 39.39 2p7m h PHE 21 CO 0.02 -0.60 0.38 -0.07 -2.23 0.00 0.00 178.31 175.81 2p7m h LEU 22 N -0.92 0.60 -0.57 0.59 3.38 -1.07 -0.42 115.31 116.90 2p7m h LEU 22 Ca -0.05 0.02 -0.14 0.00 0.09 0.00 0.00 57.88 57.79 2p7m h LEU 22 Cb 0.79 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 2p7m h LEU 22 CO -0.02 0.40 -0.35 1.56 0.09 0.00 0.00 178.44 180.12 2p7m h GLN 23 N 0.73 0.77 -0.02 1.13 4.20 -1.05 -0.18 115.11 120.68 2p7m h GLN 23 Ca 0.28 -0.37 -0.20 0.00 0.06 0.00 0.00 58.65 58.41 2p7m h GLN 23 Cb 0.10 -0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.90 2p7m h GLN 23 CO -0.14 1.00 -0.76 -0.91 -0.67 0.00 0.00 178.83 177.34 2p7m h ASN 24 N 0.64 0.71 0.08 1.46 2.35 -0.42 -2.38 115.58 118.03 2p7m h ASN 24 Ca 0.06 -0.73 -0.24 0.00 -0.55 0.00 0.00 56.30 54.84 2p7m h ASN 24 Cb 0.89 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 39.04 2p7m h ASN 24 CO 0.08 1.34 -1.24 0.40 -1.65 0.00 0.00 177.43 176.36 2p7m h ILE 25 N 0.15 1.09 -0.27 2.81 2.04 -1.14 -3.39 117.51 118.80 2p7m h ILE 25 Ca -0.09 -2.36 0.00 0.00 1.00 0.00 0.00 64.86 63.41 2p7m h ILE 25 Cb 1.44 2.71 0.00 0.00 -0.74 0.00 0.00 36.82 40.23 2p7m h ILE 25 CO 0.15 0.63 0.00 0.49 0.00 0.00 0.00 178.15 179.42 2p7m n PHE 26 N -4.08 0.35 -3.56 1.37 3.01 -0.12 -4.95 117.46 109.48 2p7m n PHE 26 Ca -0.24 -0.21 -0.26 0.00 1.01 0.00 0.00 57.45 57.75 2p7m n PHE 26 Cb 0.82 -0.00 0.03 0.00 -0.01 0.00 0.00 39.48 40.32 2p7m n PHE 26 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 2p7m n ASN 27 N 1.21 -5.25 -4.77 4.37 3.02 -0.89 -4.83 115.26 108.12 2p7m n ASN 27 Ca 0.15 -0.56 -0.39 0.00 -0.03 0.00 0.00 54.58 53.76 2p7m n ASN 27 Cb 0.53 -4.20 0.01 0.00 -0.61 0.00 0.00 39.78 35.50 2p7m n ASN 27 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2p7m s ALA 28 N -3.21 3.18 -0.28 5.41 0.00 -0.94 -4.92 121.76 121.00 2p7m s ALA 28 Ca 0.53 1.29 -0.06 0.00 0.00 0.00 0.00 51.96 53.72 2p7m s ALA 28 Cb -0.26 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.35 2p7m s ALA 28 CO 0.65 -0.99 0.05 -2.00 0.00 0.00 0.00 175.76 173.48 2p7m s GLU 29 N -2.41 3.18 0.02 0.00 2.12 -0.63 -4.50 118.70 116.48 2p7m s GLU 29 Ca 0.60 -0.79 -0.30 0.00 0.36 0.00 0.00 54.97 54.84 2p7m s GLU 29 Cb -0.39 -3.30 -0.06 0.00 0.26 0.00 0.00 34.13 30.64 2p7m s GLU 29 CO 0.50 -0.38 1.45 -2.00 -0.54 0.00 0.00 175.26 174.30 2p7m s GLU 30 N 1.50 4.27 0.00 4.30 2.12 -1.26 -1.27 118.70 128.36 2p7m s GLU 30 Ca 0.03 2.05 0.00 0.00 0.36 0.00 0.00 54.97 57.41 2p7m s GLU 30 Cb -0.17 -3.56 0.00 0.00 0.26 0.00 0.00 34.13 30.66 2p7m s GLU 30 CO 0.01 -0.60 0.78 0.44 -0.54 0.00 0.00 175.26 175.35 2p7m n ILE 31 N 4.64 0.60 -3.63 -3.70 -5.35 -0.49 -4.97 119.36 106.46 2p7m n ILE 31 Ca 0.14 -0.67 -0.07 0.00 -0.27 0.00 0.00 62.75 61.88 2p7m n ILE 31 Cb 0.43 0.75 -0.07 0.00 -1.74 0.00 0.00 39.64 39.01 2p7m n ILE 31 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 2p7m s TYR 32 N -0.60 -0.28 -0.13 4.28 5.04 -1.20 -4.90 117.35 119.56 2p7m s TYR 32 Ca 0.00 0.65 -0.10 0.00 -2.44 0.00 0.00 57.07 55.18 2p7m s TYR 32 Cb 0.00 0.43 0.04 0.00 0.35 0.00 0.00 41.96 42.77 2p7m s TYR 32 CO 0.00 -0.16 0.33 0.45 -1.34 0.00 0.00 175.55 174.83 2p7m s SER 33 N -0.10 -0.36 0.36 4.32 0.15 -1.26 -1.13 113.70 115.68 2p7m s SER 33 Ca 0.05 0.67 -0.11 0.00 0.70 0.00 0.00 55.95 57.26 2p7m s SER 33 Cb -0.04 0.64 0.03 0.00 -1.71 0.00 0.00 66.02 64.94 2p7m s SER 33 CO -0.09 -0.13 0.66 -0.94 1.20 0.00 0.00 173.24 173.94 2p7m s SER 34 N 0.55 0.34 0.00 5.45 1.04 0.04 -5.00 113.70 116.12 2p7m s SER 34 Ca -0.03 -1.25 0.00 0.00 0.48 0.00 0.00 55.95 55.15 2p7m s SER 34 Cb -0.05 0.77 0.00 0.00 0.10 0.00 0.00 66.02 66.84 2p7m s SER 34 CO -0.03 -1.51 0.00 0.61 0.98 0.00 0.00 173.24 173.29 2p7m n GLY 35 N -0.54 3.38 3.15 7.32 0.00 -1.26 -1.66 105.19 115.59 2p7m n GLY 35 Ca -0.04 -1.71 0.04 0.00 0.00 0.00 0.00 46.02 44.31 2p7m n GLY 35 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2p7m s ASP 36 N 0.00 -1.21 0.34 1.61 -1.08 0.59 -4.88 116.67 112.04 2p7m s ASP 36 Ca 0.00 0.33 0.04 0.00 -0.52 0.00 0.00 52.55 52.40 2p7m s ASP 36 Cb 0.00 1.85 0.67 0.00 -1.46 0.00 0.00 42.92 43.98 2p7m s ASP 36 CO 0.00 -0.22 1.95 0.50 0.52 0.00 0.00 175.17 177.91 2p7m h LYS 37 N 7.86 0.82 0.00 4.34 3.64 -1.95 0.86 116.57 132.14 2p7m h LYS 37 Ca -0.09 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 2p7m h LYS 37 Cb 1.18 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 2p7m h LYS 37 CO 0.10 0.54 0.00 1.79 -2.27 0.00 0.00 179.45 179.61 2p7m h THR 38 N 0.85 0.00 -0.09 1.00 1.35 -1.96 0.04 112.91 114.09 2p7m h THR 38 Ca 0.33 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.98 2p7m h THR 38 Cb 0.22 1.04 0.00 0.00 -1.73 0.00 0.00 68.15 67.68 2p7m h THR 38 CO -0.11 0.00 0.00 0.33 -0.25 0.00 0.00 175.52 175.49 2p7m n PHE 39 N -2.71 0.10 -3.56 4.73 7.35 0.18 -4.97 117.46 118.57 2p7m n PHE 39 Ca -0.00 -0.07 -0.22 0.00 -0.76 0.00 0.00 57.45 56.40 2p7m n PHE 39 Cb 0.17 -0.00 0.08 0.00 0.35 0.00 0.00 39.48 40.08 2p7m n PHE 39 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 2p7m n SER 40 N 1.04 -4.95 -4.02 -2.13 7.64 -0.00 -5.00 113.62 106.19 2p7m n SER 40 Ca 0.12 -0.58 -0.31 0.00 1.01 0.00 0.00 58.87 59.11 2p7m n SER 40 Cb 0.46 -5.02 -0.16 0.00 -1.01 0.00 0.00 64.21 58.49 2p7m n SER 40 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2p7m s LEU 41 N -7.02 2.25 0.67 -3.43 1.43 -0.48 -5.00 118.68 107.11 2p7m s LEU 41 Ca 0.40 -0.83 -0.17 0.00 -1.03 0.00 0.00 54.13 52.50 2p7m s LEU 41 Cb -0.18 -1.28 0.00 0.00 0.03 0.00 0.00 46.19 44.76 2p7m s LEU 41 CO 0.73 -0.11 1.25 -0.94 0.23 0.00 0.00 176.35 177.51 2p7m s SER 42 N 1.37 4.52 0.55 2.29 1.04 -1.26 -0.30 113.70 121.91 2p7m s SER 42 Ca 0.00 2.50 -0.19 0.00 0.48 0.00 0.00 55.95 58.74 2p7m s SER 42 Cb -0.15 -2.61 -0.06 0.00 0.10 0.00 0.00 66.02 63.30 2p7m s SER 42 CO -0.09 -2.05 1.11 -0.54 0.98 0.00 0.00 173.24 172.65 2p7m s LYS 43 N -3.56 3.36 -0.17 4.02 1.02 -1.26 -4.18 119.74 118.97 2p7m s LYS 43 Ca 0.79 1.55 -0.27 0.00 0.02 0.00 0.00 55.97 58.06 2p7m s LYS 43 Cb -0.34 -2.01 0.07 0.00 -0.52 0.00 0.00 37.83 35.03 2p7m s LYS 43 CO 0.41 -0.83 0.69 -2.00 -0.92 0.00 0.00 175.35 172.70 2p7m s GLU 44 N -3.38 0.92 0.03 1.68 2.12 -0.66 -1.74 118.70 117.68 2p7m s GLU 44 Ca 0.71 0.67 0.01 0.00 0.36 0.00 0.00 54.97 56.73 2p7m s GLU 44 Cb -0.22 0.44 -0.02 0.00 0.26 0.00 0.00 34.13 34.59 2p7m s GLU 44 CO 0.28 -0.20 -0.05 0.15 -0.54 0.00 0.00 175.26 174.90 2p7m s LYS 45 N -0.29 0.43 -0.03 4.30 1.02 -0.00 -0.78 119.74 124.38 2p7m s LYS 45 Ca -0.05 -0.72 0.04 0.00 0.02 0.00 0.00 55.97 55.26 2p7m s LYS 45 Cb -0.03 -0.07 -0.03 0.00 -0.52 0.00 0.00 37.83 37.19 2p7m s LYS 45 CO 0.05 -0.01 -0.14 -0.06 -0.92 0.00 0.00 175.35 174.27 2p7m s PHE 46 N -1.59 2.71 0.11 3.18 2.99 -0.29 -0.83 117.98 124.26 2p7m s PHE 46 Ca -0.12 -0.15 0.04 0.00 0.00 0.00 0.00 56.93 56.71 2p7m s PHE 46 Cb -0.09 -1.61 -0.04 0.00 0.00 0.00 0.00 43.02 41.29 2p7m s PHE 46 CO -0.01 0.22 -0.11 -0.06 -0.00 0.00 0.00 175.22 175.26 2p7m s PHE 47 N -0.79 1.16 -0.16 0.36 0.40 0.83 -1.39 117.98 118.40 2p7m s PHE 47 Ca 0.12 -0.64 -0.00 0.00 -0.60 0.00 0.00 56.93 55.81 2p7m s PHE 47 Cb -0.11 -0.62 0.00 0.00 0.51 0.00 0.00 43.02 42.80 2p7m s PHE 47 CO 0.02 0.04 -0.15 -0.51 0.70 0.00 0.00 175.22 175.32 2p7m s LEU 48 N -2.52 2.47 -0.26 -0.37 1.43 -0.39 -0.71 118.68 118.33 2p7m s LEU 48 Ca 0.07 -0.48 -0.00 0.00 -1.03 0.00 0.00 54.13 52.69 2p7m s LEU 48 Cb -0.03 -1.57 0.08 0.00 0.03 0.00 0.00 46.19 44.70 2p7m s LEU 48 CO 0.01 0.07 0.02 -0.63 0.23 0.00 0.00 176.35 176.05 2p7m s ILE 49 N 0.92 1.21 -1.48 -0.59 1.01 -0.64 -1.60 121.20 120.02 2p7m s ILE 49 Ca -0.03 -1.25 -0.06 0.00 0.00 0.00 0.00 60.65 59.30 2p7m s ILE 49 Cb -0.15 -1.69 0.05 0.00 0.01 0.00 0.00 42.46 40.67 2p7m s ILE 49 CO -0.02 -0.34 0.61 0.00 0.00 0.00 0.00 174.94 175.19 2p7m n ALA 50 N 4.76 -1.75 -0.93 9.38 0.00 -1.26 0.03 120.51 130.74 2p7m n ALA 50 Ca -0.07 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.24 2p7m n ALA 50 Cb 0.44 -2.38 0.00 0.00 0.00 0.00 0.00 19.45 17.51 2p7m n ALA 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2p7m n GLY 51 N -1.77 0.85 3.64 0.00 0.00 -1.26 -4.99 105.19 101.66 2p7m n GLY 51 Ca -0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.45 2p7m n GLY 51 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2p7m s LEU 52 N 0.00 4.10 -0.29 0.99 1.43 0.10 -5.02 118.68 119.99 2p7m s LEU 52 Ca 0.00 0.57 -0.29 0.00 -1.03 0.00 0.00 54.13 53.38 2p7m s LEU 52 Cb 0.00 -2.64 0.00 0.00 0.03 0.00 0.00 46.19 43.58 2p7m s LEU 52 CO 0.00 -0.20 1.24 0.86 0.23 0.00 0.00 176.35 178.48 2p7m s TRP 53 N 1.87 2.82 -0.12 0.29 -0.00 -1.26 -1.63 118.94 120.91 2p7m s TRP 53 Ca 0.22 0.96 -0.00 0.00 -0.00 0.00 0.00 56.10 57.28 2p7m s TRP 53 Cb -0.15 -3.82 -0.02 0.00 -0.00 0.00 0.00 33.47 29.47 2p7m s TRP 53 CO 0.09 -1.47 -0.12 0.42 -0.00 0.00 0.00 176.95 175.87 2p7m s ILE 54 N 4.11 3.20 -0.16 5.86 -1.09 0.11 -2.06 121.20 131.18 2p7m s ILE 54 Ca 0.53 -0.62 -0.00 0.00 -2.23 0.00 0.00 60.65 58.33 2p7m s ILE 54 Cb -0.16 -2.34 -0.00 0.00 -1.58 0.00 0.00 42.46 38.38 2p7m s ILE 54 CO 0.20 0.53 -0.15 0.00 -1.23 0.00 0.00 174.94 174.30 2p7m s ILE 56 N 0.92 2.79 -0.05 0.00 -1.09 -0.01 -0.92 121.20 122.84 2p7m s ILE 56 Ca -0.03 -0.72 0.06 0.00 -2.23 0.00 0.00 60.65 57.73 2p7m s ILE 56 Cb -0.15 -2.19 -0.01 0.00 -1.58 0.00 0.00 42.46 38.53 2p7m s ILE 56 CO -0.02 0.51 -0.25 -0.04 -1.23 0.00 0.00 174.94 173.91 2p7m s MET 57 N 0.86 2.50 -0.01 2.79 -1.94 -0.20 -0.82 119.30 122.47 2p7m s MET 57 Ca -0.04 -0.90 -0.23 0.00 -1.71 0.00 0.00 55.69 52.80 2p7m s MET 57 Cb -0.15 -2.16 -0.05 0.00 2.01 0.00 0.00 34.83 34.49 2p7m s MET 57 CO -0.00 0.41 0.71 -2.00 -0.01 0.00 0.00 175.02 174.12 2p7m s GLU 58 N -0.23 4.43 0.11 2.03 2.12 -0.71 -0.29 118.70 126.17 2p7m s GLU 58 Ca -0.02 0.92 -0.25 0.00 0.36 0.00 0.00 54.97 55.99 2p7m s GLU 58 Cb -0.13 -3.39 0.08 0.00 0.26 0.00 0.00 34.13 30.95 2p7m s GLU 58 CO 0.03 0.21 1.11 0.20 -0.54 0.00 0.00 175.26 176.27 2p7m s GLY 59 N 0.27 -0.04 0.00 -1.50 0.00 0.13 -4.57 107.32 101.61 2p7m s GLY 59 Ca 0.37 -0.08 0.22 0.00 0.00 0.00 0.00 44.72 45.23 2p7m s GLY 59 CO 0.20 2.58 1.08 1.22 0.00 0.00 0.00 173.10 178.17 2p7m n ASP 60 N -1.02 0.91 -4.67 1.64 8.00 -1.26 -4.01 116.55 116.15 2p7m n ASP 60 Ca -0.02 -0.80 -0.42 0.00 0.71 0.00 0.00 54.79 54.25 2p7m n ASP 60 Cb 0.60 0.73 -0.03 0.00 -0.02 0.00 0.00 41.12 42.40 2p7m n ASP 60 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2p7m s SER 61 N -2.96 6.58 0.19 -2.24 0.01 -1.26 -4.96 113.70 109.07 2p7m s SER 61 Ca 0.10 2.43 -0.19 0.00 1.31 0.00 0.00 55.95 59.60 2p7m s SER 61 Cb 0.17 -2.54 -0.08 0.00 0.21 0.00 0.00 66.02 63.78 2p7m s SER 61 CO 0.80 -0.96 0.68 -0.76 0.41 0.00 0.00 173.24 173.40 2p7m s LEU 62 N 3.92 4.36 -0.30 2.44 1.43 -1.26 -4.82 118.68 124.45 2p7m s LEU 62 Ca 0.78 1.34 -0.17 0.00 -1.03 0.00 0.00 54.13 55.05 2p7m s LEU 62 Cb -0.38 -3.46 -0.02 0.00 0.03 0.00 0.00 46.19 42.37 2p7m s LEU 62 CO 0.34 0.07 0.48 -1.58 0.23 0.00 0.00 176.35 175.89 2p7m s GLN 63 N -1.89 3.85 0.35 1.70 2.00 -1.26 -5.05 119.66 119.36 2p7m s GLN 63 Ca 0.41 0.04 -0.27 0.00 -2.00 0.00 0.00 55.36 53.54 2p7m s GLN 63 Cb -0.17 -3.72 -0.09 0.00 0.80 0.00 0.00 33.01 29.83 2p7m s GLN 63 CO 0.21 -0.47 1.14 -1.83 -0.50 0.00 0.00 175.29 173.84 2p7m s GLU 64 N 2.29 4.32 -0.17 1.67 -1.05 -1.26 -4.70 118.70 119.81 2p7m s GLU 64 Ca 0.19 1.82 -0.29 0.00 -0.15 0.00 0.00 54.97 56.53 2p7m s GLU 64 Cb -0.16 -2.89 -0.01 0.00 -0.44 0.00 0.00 34.13 30.63 2p7m s GLU 64 CO 0.11 -0.08 1.25 0.50 0.95 0.00 0.00 175.26 177.99 2p7m s ARG 65 N -1.96 4.24 0.33 -4.83 3.52 -1.26 -4.99 118.95 114.00 2p7m s ARG 65 Ca 0.52 1.65 -0.03 0.00 -0.13 0.00 0.00 55.73 57.73 2p7m s ARG 65 Cb -0.31 -3.76 0.01 0.00 -1.56 0.00 0.00 34.95 29.34 2p7m s ARG 65 CO 0.39 -0.70 0.49 0.25 -0.81 0.00 0.00 175.30 174.92 2p7m n THR 66 N 5.36 0.00 1.51 4.11 -2.24 -1.26 -5.05 114.28 116.70 2p7m n THR 66 Ca 0.14 -1.61 0.14 0.00 -2.27 0.00 0.00 64.05 60.45 2p7m n THR 66 Cb 0.45 1.02 0.60 0.00 -2.10 0.00 0.00 70.33 70.30 2p7m n THR 66 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2p7m n TYR 67 N -0.54 0.00 -1.79 4.78 9.36 -1.26 -4.81 117.16 122.90 2p7m n TYR 67 Ca -0.00 0.00 -0.42 0.00 3.32 0.00 0.00 57.90 60.80 2p7m n TYR 67 Cb 0.55 -0.08 -0.03 0.00 -0.63 0.00 0.00 39.34 39.15 2p7m n TYR 67 CO 0.00 0.00 0.00 -0.80 0.22 0.00 0.00 176.86 176.28 2p7m s ASN 68 N -2.25 6.48 0.15 2.98 0.01 -1.26 -4.92 114.94 116.13 2p7m s ASN 68 Ca 0.34 2.69 -0.25 0.00 -0.71 0.00 0.00 52.86 54.93 2p7m s ASN 68 Cb 0.21 -2.57 0.07 0.00 0.41 0.00 0.00 41.25 39.37 2p7m s ASN 68 CO 0.42 -0.96 1.01 -1.38 -1.51 0.00 0.00 177.10 174.68 2p7m s HIS 69 N 2.47 -0.07 -0.06 2.20 -3.43 -1.26 -4.66 115.29 110.48 2p7m s HIS 69 Ca 0.78 -0.25 0.03 0.00 -0.80 0.00 0.00 55.06 54.81 2p7m s HIS 69 Cb -0.45 0.65 -0.03 0.00 -1.43 0.00 0.00 32.58 31.33 2p7m s HIS 69 CO 0.35 -0.82 -0.13 0.42 -2.00 0.00 0.00 174.74 172.56 2p7m s ILE 70 N -2.92 3.19 -0.09 -5.38 1.09 -1.26 -5.04 121.20 110.79 2p7m s ILE 70 Ca 0.15 -0.67 0.04 0.00 -1.10 0.00 0.00 60.65 59.06 2p7m s ILE 70 Cb -0.01 -2.26 -0.01 0.00 -1.06 0.00 0.00 42.46 39.12 2p7m s ILE 70 CO 0.03 0.59 -0.22 0.00 -0.10 0.00 0.00 174.94 175.24 2p7m s ALA 71 N -0.70 2.26 0.08 9.38 0.00 -1.26 -2.04 121.76 129.48 2p7m s ALA 71 Ca 0.11 -0.98 0.03 0.00 0.00 0.00 0.00 51.96 51.12 2p7m s ALA 71 Cb -0.11 -0.85 -0.04 0.00 0.00 0.00 0.00 23.12 22.13 2p7m s ALA 71 CO 0.01 0.32 0.07 -0.06 0.00 0.00 0.00 175.76 176.10 2p7m s PHE 72 N 0.18 3.17 0.09 0.00 0.40 0.61 -4.91 117.98 117.53 2p7m s PHE 72 Ca -0.13 0.06 -0.23 0.00 -0.60 0.00 0.00 56.93 56.03 2p7m s PHE 72 Cb -0.16 -1.61 -0.07 0.00 0.51 0.00 0.00 43.02 41.69 2p7m s PHE 72 CO 0.07 0.52 0.69 -0.65 0.70 0.00 0.00 175.22 176.55 2p7m s GLN 73 N -2.41 4.41 0.27 0.44 -0.21 -1.26 -0.40 119.66 120.50 2p7m s GLN 73 Ca 0.29 0.96 0.02 0.00 0.02 0.00 0.00 55.36 56.65 2p7m s GLN 73 Cb -0.12 -3.28 -0.04 0.00 1.00 0.00 0.00 33.01 30.57 2p7m s GLN 73 CO 0.22 0.51 0.17 0.96 -2.12 0.00 0.00 175.29 175.02 2p7m s ILE 74 N -0.81 0.18 0.04 1.08 -4.36 -0.43 -4.89 121.20 112.01 2p7m s ILE 74 Ca 0.34 -2.00 -0.06 0.00 -0.26 0.00 0.00 60.65 58.66 2p7m s ILE 74 Cb -0.21 -2.52 -0.05 0.00 1.25 0.00 0.00 42.46 40.93 2p7m s ILE 74 CO 0.22 0.00 0.30 -1.10 0.24 0.00 0.00 174.94 174.60 2p7m s GLN 75 N -3.88 3.60 0.27 0.37 -1.52 -1.26 -4.16 119.66 113.09 2p7m s GLN 75 Ca 0.38 -0.06 -0.01 0.00 -1.95 0.00 0.00 55.36 53.72 2p7m s GLN 75 Cb 0.05 -3.04 0.61 0.00 -0.22 0.00 0.00 33.01 30.42 2p7m s GLN 75 CO 0.17 0.61 1.67 0.77 -0.25 0.00 0.00 175.29 178.26 2p7m h SER 76 N 3.76 0.05 0.33 5.90 0.02 -1.95 0.52 113.55 122.17 2p7m h SER 76 Ca -0.49 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 2p7m h SER 76 Cb 1.19 0.22 0.00 0.00 0.14 0.00 0.00 62.40 63.95 2p7m h SER 76 CO 0.67 -0.09 0.00 -0.62 -1.14 0.00 0.00 176.83 175.66 2p7m n GLU 77 N -5.17 0.15 0.01 3.45 4.71 -1.26 -2.53 120.64 119.99 2p7m n GLU 77 Ca 0.19 0.52 0.11 0.00 -0.01 0.00 0.00 57.16 57.97 2p7m n GLU 77 Cb 0.59 -1.87 -0.09 0.00 -1.01 0.00 0.00 31.44 29.06 2p7m n GLU 77 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 2p7m n GLU 78 N -2.17 0.32 -0.01 3.49 1.02 0.18 -4.62 120.64 118.85 2p7m n GLU 78 Ca 0.00 -0.06 -0.12 0.00 -0.02 0.00 0.00 57.16 56.96 2p7m n GLU 78 Cb 0.12 -1.54 -0.06 0.00 -0.02 0.00 0.00 31.44 29.93 2p7m n GLU 78 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2p7m h VAL 79 N 0.00 0.13 -0.73 2.62 2.07 -1.31 -1.02 116.25 118.01 2p7m h VAL 79 Ca 0.00 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.64 2p7m h VAL 79 Cb 0.74 0.13 -0.09 0.00 -1.52 0.00 0.00 31.29 30.56 2p7m h VAL 79 CO 0.00 0.00 0.31 0.44 0.02 0.00 0.00 177.57 178.34 2p7m h ASP 80 N -0.49 0.33 -0.07 0.57 3.32 -1.82 0.22 116.42 118.49 2p7m h ASP 80 Ca 0.07 0.09 -0.00 0.00 0.02 0.00 0.00 57.03 57.21 2p7m h ASP 80 Cb 0.63 0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.23 2p7m h ASP 80 CO -0.41 0.15 0.03 -0.08 -1.72 0.00 0.00 179.24 177.21 2p7m h GLU 81 N 0.49 0.10 -0.93 3.56 4.22 -1.73 -2.27 114.58 118.02 2p7m h GLU 81 Ca 0.39 -0.02 0.03 0.00 0.08 0.00 0.00 59.36 59.84 2p7m h GLU 81 Cb 0.53 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.71 2p7m h GLU 81 CO -0.36 0.23 0.61 1.88 -2.18 0.00 0.00 179.01 179.19 2p7m h TYR 82 N -0.06 1.14 -0.86 0.92 -1.99 -0.64 -0.55 116.97 114.93 2p7m h TYR 82 Ca 0.02 0.03 0.06 0.00 2.00 0.00 0.00 58.73 60.84 2p7m h TYR 82 Cb 0.17 -0.38 -0.06 0.00 2.00 0.00 0.00 36.73 38.46 2p7m h TYR 82 CO -0.02 0.68 0.54 1.15 -0.00 0.00 0.00 178.16 180.51 2p7m h THR 83 N 1.20 1.07 -0.09 -2.88 2.02 -0.74 0.52 112.91 114.00 2p7m h THR 83 Ca 0.36 -0.34 -0.20 0.00 0.77 0.00 0.00 66.41 66.99 2p7m h THR 83 Cb -0.04 -0.02 0.00 0.00 -1.74 0.00 0.00 68.15 66.35 2p7m h THR 83 CO -0.11 0.18 -0.78 -0.08 0.37 0.00 0.00 175.52 175.10 2p7m h GLU 84 N 1.00 0.53 -0.35 6.66 4.22 -0.80 -1.69 114.58 124.15 2p7m h GLU 84 Ca 0.37 -0.46 -0.02 0.00 0.08 0.00 0.00 59.36 59.34 2p7m h GLU 84 Cb 0.13 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 2p7m h GLU 84 CO -0.16 1.09 0.15 -0.09 -2.18 0.00 0.00 179.01 177.82 2p7m h ARG 85 N 0.35 0.51 -0.19 1.92 2.43 -0.44 0.05 114.38 119.01 2p7m h ARG 85 Ca -0.05 -0.08 -0.03 0.00 -0.81 0.00 0.00 59.98 59.01 2p7m h ARG 85 Cb 1.39 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.84 2p7m h ARG 85 CO 0.14 0.48 -0.01 0.82 -1.51 0.00 0.00 179.97 179.89 2p7m h ILE 86 N 0.42 1.26 -0.94 1.20 2.04 -0.91 -2.78 117.51 117.80 2p7m h ILE 86 Ca 0.12 -0.89 0.05 0.00 1.00 0.00 0.00 64.86 65.14 2p7m h ILE 86 Cb 0.15 1.48 -0.06 0.00 -0.74 0.00 0.00 36.82 37.65 2p7m h ILE 86 CO -0.01 0.27 0.61 0.50 0.00 0.00 0.00 178.15 179.52 2p7m h LYS 87 N 0.08 1.08 -0.78 2.37 1.63 -1.18 -1.27 116.57 118.51 2p7m h LYS 87 Ca 0.05 -0.07 0.04 0.00 -0.85 0.00 0.00 60.65 59.83 2p7m h LYS 87 Cb 0.41 -0.24 -0.04 0.00 -0.60 0.00 0.00 32.23 31.75 2p7m h LYS 87 CO 0.01 0.72 0.51 0.00 -3.45 0.00 0.00 179.45 177.24 2p7m h ALA 88 N 1.48 1.55 0.00 5.00 0.00 -0.76 -0.22 119.26 126.30 2p7m h ALA 88 Ca 0.39 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.27 2p7m h ALA 88 Cb 0.12 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.65 2p7m h ALA 88 CO -0.14 0.36 0.00 1.28 0.00 0.00 0.00 179.25 180.76 2p7m n LEU 89 N -4.46 0.70 -0.06 0.00 4.77 -0.49 -4.90 117.00 112.56 2p7m n LEU 89 Ca 0.10 0.66 -0.01 0.00 -0.03 0.00 0.00 56.01 56.73 2p7m n LEU 89 Cb 0.13 -0.55 -0.00 0.00 -2.33 0.00 0.00 43.42 40.66 2p7m n LEU 89 CO 0.35 -0.53 -0.01 0.61 -1.33 0.00 0.00 177.39 176.48 2p7m n GLY 90 N 0.12 0.49 3.88 -0.72 0.00 -0.10 -5.04 105.19 103.83 2p7m n GLY 90 Ca 0.02 -0.40 -0.30 0.00 0.00 0.00 0.00 46.02 45.34 2p7m n GLY 90 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2p7m s VAL 91 N -1.97 4.63 0.01 1.61 -7.23 -1.25 -4.98 120.40 111.21 2p7m s VAL 91 Ca 0.00 0.65 -0.30 0.00 -1.81 0.00 0.00 61.98 60.52 2p7m s VAL 91 Cb 0.00 -3.82 -0.07 0.00 0.56 0.00 0.00 36.38 33.05 2p7m s VAL 91 CO 0.00 -1.01 1.60 -0.70 -0.31 0.00 0.00 175.10 174.68 2p7m s GLU 92 N -5.08 4.21 -0.05 4.82 2.12 -1.26 -4.82 118.70 118.63 2p7m s GLU 92 Ca 0.53 2.20 0.01 0.00 0.36 0.00 0.00 54.97 58.07 2p7m s GLU 92 Cb -0.11 -3.74 0.02 0.00 0.26 0.00 0.00 34.13 30.56 2p7m s GLU 92 CO 0.51 -0.74 -0.05 1.41 -0.54 0.00 0.00 175.26 175.85 2p7m s MET 93 N 3.13 0.93 0.41 4.30 -2.45 -1.26 -0.77 119.30 123.59 2p7m s MET 93 Ca 0.71 -0.12 -0.23 0.00 -1.25 0.00 0.00 55.69 54.80 2p7m s MET 93 Cb -0.35 -0.96 -0.09 0.00 1.25 0.00 0.00 34.83 34.68 2p7m s MET 93 CO 0.30 -0.11 1.04 0.15 1.05 0.00 0.00 175.02 177.45 2p7m s LYS 94 N 1.07 4.13 0.30 4.11 1.02 -0.41 -4.99 119.74 124.96 2p7m s LYS 94 Ca -0.09 1.47 -0.29 0.00 0.02 0.00 0.00 55.97 57.08 2p7m s LYS 94 Cb -0.14 -2.47 -0.10 0.00 -0.52 0.00 0.00 37.83 34.59 2p7m s LYS 94 CO -0.01 -0.16 1.39 -1.25 -0.92 0.00 0.00 175.35 174.40 2p7m s PRO 95 N -2.61 4.29 0.46 -1.68 0.04 -1.26 -4.60 135.00 129.63 2p7m s PRO 95 Ca 0.59 2.30 -0.24 0.00 0.04 0.00 0.00 61.00 63.68 2p7m s PRO 95 Cb -0.21 -3.08 -0.08 0.00 0.04 0.00 0.00 34.50 31.18 2p7m s PRO 95 CO 0.26 -0.33 1.29 -1.91 0.04 0.00 0.00 177.00 176.34 2p7m n GLU 96 N 1.42 1.86 -2.89 4.56 2.13 -1.26 -4.99 120.64 121.47 2p7m n GLU 96 Ca 0.03 0.67 -0.23 0.00 0.66 0.00 0.00 57.16 58.29 2p7m n GLU 96 Cb 0.41 -2.44 0.02 0.00 0.27 0.00 0.00 31.44 29.70 2p7m n GLU 96 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 2p7m s ARG 97 N -2.40 3.00 0.49 5.31 1.81 -1.26 -5.07 118.95 120.83 2p7m s ARG 97 Ca 0.64 -0.47 -0.21 0.00 -1.72 0.00 0.00 55.73 53.97 2p7m s ARG 97 Cb -0.48 -2.52 -0.08 0.00 -0.45 0.00 0.00 34.95 31.42 2p7m s ARG 97 CO 0.56 -0.36 1.07 -1.25 -0.68 0.00 0.00 175.30 174.64 2p7m s PRO 98 N -4.62 3.72 0.71 3.54 0.04 -1.26 -4.97 135.00 132.16 2p7m s PRO 98 Ca 0.50 1.48 -0.17 0.00 0.04 0.00 0.00 61.00 62.85 2p7m s PRO 98 Cb -0.10 -2.15 -0.12 0.00 0.04 0.00 0.00 34.50 32.18 2p7m s PRO 98 CO 0.39 -0.52 -0.13 -2.13 0.04 0.00 0.00 177.00 174.64 2p7m n ARG 99 N -0.92 0.08 -3.72 4.56 0.63 -1.26 -5.02 116.66 111.01 2p7m n ARG 99 Ca 0.09 0.04 -0.15 0.00 -0.92 0.00 0.00 57.85 56.91 2p7m n ARG 99 Cb 0.51 -1.24 -0.15 0.00 0.45 0.00 0.00 32.46 32.03 2p7m n ARG 99 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 2p7m s VAL 100 N -1.98 -0.12 0.13 5.15 1.01 -1.26 -5.12 120.40 118.21 2p7m s VAL 100 Ca 0.54 0.25 -0.35 0.00 0.00 0.00 0.00 61.98 62.43 2p7m s VAL 100 Cb -0.36 -0.25 -0.16 0.00 0.00 0.00 0.00 36.38 35.61 2p7m s VAL 100 CO 0.69 0.10 1.26 0.00 0.00 0.00 0.00 175.10 177.15 2p7m n GLN 101 N 4.60 1.19 0.00 2.72 0.00 -1.26 -1.35 117.38 123.28 2p7m n GLN 101 Ca -0.19 0.43 0.00 0.00 0.00 0.00 0.00 57.00 57.24 2p7m n GLN 101 Cb 0.51 -2.00 0.00 0.00 0.00 0.00 0.00 30.24 28.75 2p7m n GLN 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2p7m n GLY 102 N 2.29 1.92 3.86 2.61 0.00 -1.26 -4.98 105.19 109.63 2p7m n GLY 102 Ca 0.17 -0.17 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 2p7m n GLY 102 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2p7m s GLU 103 N 0.00 3.89 0.00 1.61 2.02 -0.46 -3.13 118.70 122.63 2p7m s GLU 103 Ca 0.00 0.46 0.00 0.00 0.02 0.00 0.00 54.97 55.45 2p7m s GLU 103 Cb 0.00 -2.54 0.00 0.00 0.10 0.00 0.00 34.13 31.69 2p7m s GLU 103 CO 0.00 0.23 0.00 0.41 0.02 0.00 0.00 175.26 175.92 2p7m n GLY 104 N -0.31 2.31 3.78 -1.39 0.00 -1.26 -4.45 105.19 103.87 2p7m n GLY 104 Ca 0.02 -2.14 -0.36 0.00 0.00 0.00 0.00 46.02 43.54 2p7m n GLY 104 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2p7m s ARG 105 N -1.75 4.25 0.00 1.61 0.52 -1.26 -4.80 118.95 117.52 2p7m s ARG 105 Ca 0.00 1.46 -0.02 0.00 -0.52 0.00 0.00 55.73 56.64 2p7m s ARG 105 Cb 0.00 -2.57 -0.01 0.00 0.52 0.00 0.00 34.95 32.89 2p7m s ARG 105 CO 0.00 -0.06 0.04 -1.12 0.02 0.00 0.00 175.30 174.18 2p7m s SER 106 N -1.61 0.10 -0.13 0.23 0.01 -1.26 -1.09 113.70 109.95 2p7m s SER 106 Ca 0.57 -0.25 0.02 0.00 1.31 0.00 0.00 55.95 57.60 2p7m s SER 106 Cb -0.21 0.13 0.00 0.00 0.21 0.00 0.00 66.02 66.16 2p7m s SER 106 CO 0.26 -0.24 -0.19 -0.63 0.41 0.00 0.00 173.24 172.85 2p7m s ILE 107 N -1.01 2.38 -0.11 1.44 1.01 0.00 -4.78 121.20 120.12 2p7m s ILE 107 Ca -0.11 -0.89 0.01 0.00 0.00 0.00 0.00 60.65 59.67 2p7m s ILE 107 Cb -0.07 -1.96 -0.01 0.00 0.01 0.00 0.00 42.46 40.43 2p7m s ILE 107 CO -0.00 0.54 -0.16 -0.31 0.00 0.00 0.00 174.94 175.01 2p7m s TYR 108 N 0.62 2.73 0.24 3.97 1.51 -1.26 -1.03 117.35 124.12 2p7m s TYR 108 Ca -0.10 -0.71 -0.18 0.00 -1.01 0.00 0.00 57.07 55.07 2p7m s TYR 108 Cb -0.16 -1.79 0.02 0.00 -0.11 0.00 0.00 41.96 39.92 2p7m s TYR 108 CO 0.03 -0.23 0.60 -0.59 -1.11 0.00 0.00 175.55 174.24 2p7m s PHE 109 N 0.24 -0.03 0.23 2.71 -0.12 -0.63 -1.29 117.98 119.09 2p7m s PHE 109 Ca -0.11 -0.36 0.12 0.00 -0.05 0.00 0.00 56.93 56.52 2p7m s PHE 109 Cb -0.16 0.47 -0.05 0.00 -0.63 0.00 0.00 43.02 42.66 2p7m s PHE 109 CO 0.06 -1.07 -0.21 0.71 -0.05 0.00 0.00 175.22 174.66 2p7m s TYR 110 N -3.93 2.32 0.00 3.49 1.51 0.05 0.02 117.35 120.81 2p7m s TYR 110 Ca 0.13 -0.34 0.00 0.00 -1.01 0.00 0.00 57.07 55.86 2p7m s TYR 110 Cb -0.03 -1.08 0.00 0.00 -0.11 0.00 0.00 41.96 40.74 2p7m s TYR 110 CO 0.04 0.60 0.00 -0.40 -1.11 0.00 0.00 175.55 174.69 2p7m n ASP 111 N -0.18 0.00 -0.46 2.29 3.85 -0.98 -4.28 116.55 116.80 2p7m n ASP 111 Ca -0.09 -0.16 0.07 0.00 -0.71 0.00 0.00 54.79 53.91 2p7m n ASP 111 Cb 0.58 0.00 0.26 0.00 -1.35 0.00 0.00 41.12 40.61 2p7m n ASP 111 CO 0.00 0.00 0.00 0.49 -1.01 0.00 0.00 177.20 176.68 2p7m n PHE 112 N -0.23 0.27 -2.57 2.11 3.01 -1.26 -4.20 117.46 114.58 2p7m n PHE 112 Ca 0.00 -0.13 -0.05 0.00 1.01 0.00 0.00 57.45 58.27 2p7m n PHE 112 Cb 0.00 0.00 0.05 0.00 -0.01 0.00 0.00 39.48 39.52 2p7m n PHE 112 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 2p7m n ASP 113 N 0.18 2.35 -1.24 4.37 8.00 -1.26 -4.96 116.55 123.99 2p7m n ASP 113 Ca 0.12 -2.50 -0.16 0.00 0.71 0.00 0.00 54.79 52.97 2p7m n ASP 113 Cb 0.25 -0.43 -0.06 0.00 -0.02 0.00 0.00 41.12 40.85 2p7m n ASP 113 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2p7m n ASN 114 N -0.55 -4.88 -4.59 -2.24 4.13 -1.26 -4.34 115.26 101.52 2p7m n ASN 114 Ca 0.16 0.37 -0.40 0.00 1.68 0.00 0.00 54.58 56.39 2p7m n ASN 114 Cb 0.87 -3.78 -0.08 0.00 -1.54 0.00 0.00 39.78 35.25 2p7m n ASN 114 CO 0.00 0.00 0.00 -1.00 0.28 0.00 0.00 177.26 176.54 2p7m s HIS 115 N -2.59 3.23 0.03 3.10 3.76 -1.26 -4.70 115.29 116.85 2p7m s HIS 115 Ca 0.00 0.43 -0.26 0.00 -0.15 0.00 0.00 55.06 55.08 2p7m s HIS 115 Cb 0.00 -2.78 -0.05 0.00 1.11 0.00 0.00 32.58 30.86 2p7m s HIS 115 CO 0.00 -0.38 0.81 -1.17 -0.85 0.00 0.00 174.74 173.16 2p7m s LEU 116 N 2.31 4.42 0.06 0.89 2.96 -1.26 -2.31 118.68 125.76 2p7m s LEU 116 Ca 0.19 1.49 0.08 0.00 -0.22 0.00 0.00 54.13 55.67 2p7m s LEU 116 Cb -0.16 -3.31 -0.03 0.00 0.50 0.00 0.00 46.19 43.20 2p7m s LEU 116 CO 0.11 -0.06 -0.22 -0.36 -1.32 0.00 0.00 176.35 174.50 2p7m s PHE 117 N 0.24 1.92 -0.04 5.38 0.40 0.10 -4.11 117.98 121.88 2p7m s PHE 117 Ca 0.41 -0.39 0.04 0.00 -0.60 0.00 0.00 56.93 56.40 2p7m s PHE 117 Cb -0.21 -1.12 -0.00 0.00 0.51 0.00 0.00 43.02 42.20 2p7m s PHE 117 CO 0.24 0.13 -0.17 -2.00 0.70 0.00 0.00 175.22 174.12 2p7m s GLU 118 N -1.36 1.77 -0.31 0.44 2.12 -0.87 -1.61 118.70 118.89 2p7m s GLU 118 Ca 0.08 -0.61 -0.04 0.00 0.36 0.00 0.00 54.97 54.76 2p7m s GLU 118 Cb -0.09 -1.55 0.04 0.00 0.26 0.00 0.00 34.13 32.79 2p7m s GLU 118 CO 0.02 0.26 0.05 -0.51 -0.54 0.00 0.00 175.26 174.54 2p7m s LEU 119 N 0.00 4.00 -0.10 2.70 1.43 -0.20 -0.28 118.68 126.23 2p7m s LEU 119 Ca -0.03 -1.12 -0.01 0.00 -1.03 0.00 0.00 54.13 51.94 2p7m s LEU 119 Cb -0.11 -1.79 -0.03 0.00 0.03 0.00 0.00 46.19 44.29 2p7m s LEU 119 CO 0.02 -0.27 -0.05 -2.28 0.23 0.00 0.00 176.35 174.00 2p7m s HIS 120 N 1.35 3.00 -1.53 0.29 2.46 0.46 -0.82 115.29 120.50 2p7m s HIS 120 Ca -0.02 -0.08 0.15 0.00 0.47 0.00 0.00 55.06 55.57 2p7m s HIS 120 Cb -0.19 -1.81 0.32 0.00 -0.13 0.00 0.00 32.58 30.77 2p7m s HIS 120 CO 0.01 0.21 1.23 0.00 -2.47 0.00 0.00 174.74 173.72 2p7m n ALA 121 N 2.71 2.33 -2.99 1.58 0.00 -0.25 -1.31 120.51 122.57 2p7m n ALA 121 Ca -0.18 -1.00 -0.11 0.00 0.00 0.00 0.00 53.44 52.15 2p7m n ALA 121 Cb 0.53 -0.58 0.03 0.00 0.00 0.00 0.00 19.45 19.43 2p7m n ALA 121 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2p7m n GLY 122 N 0.91 1.89 3.16 0.00 0.00 -1.26 -4.49 105.19 105.39 2p7m n GLY 122 Ca 0.14 -2.17 -0.13 0.00 0.00 0.00 0.00 46.02 43.86 2p7m n GLY 122 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2p7m s THR 123 N -0.62 0.83 0.20 2.61 -4.23 -1.26 -4.98 115.64 108.18 2p7m s THR 123 Ca 0.27 -1.62 -0.10 0.00 -1.18 0.00 0.00 61.69 59.06 2p7m s THR 123 Cb -0.02 -1.32 0.13 0.00 1.34 0.00 0.00 72.50 72.63 2p7m s THR 123 CO 0.17 -0.60 1.79 0.25 -0.54 0.00 0.00 174.62 175.70 2p7m h LEU 124 N 3.57 0.92 -0.08 4.79 5.85 -1.99 -1.90 115.31 126.48 2p7m h LEU 124 Ca -0.37 -0.13 0.02 0.00 0.84 0.00 0.00 57.88 58.25 2p7m h LEU 124 Cb 1.19 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.95 2p7m h LEU 124 CO 0.54 0.79 -0.07 -0.08 -0.34 0.00 0.00 178.44 179.27 2p7m h GLU 125 N 0.99 -0.08 -0.81 1.25 4.81 -1.97 0.18 114.58 118.95 2p7m h GLU 125 Ca 0.25 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.46 2p7m h GLU 125 Cb 0.10 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.46 2p7m h GLU 125 CO -0.03 -0.05 0.43 1.49 -0.73 0.00 0.00 179.01 180.11 2p7m h GLU 126 N -0.09 1.13 -0.41 1.92 4.57 -1.82 -0.14 114.58 119.75 2p7m h GLU 126 Ca 0.06 -0.14 -0.03 0.00 -1.18 0.00 0.00 59.36 58.08 2p7m h GLU 126 Cb 0.17 -0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 28.52 2p7m h GLU 126 CO -0.13 0.84 0.15 -0.09 -1.18 0.00 0.00 179.01 178.59 2p7m h ARG 127 N 1.14 0.62 -0.19 1.92 9.65 -0.69 -3.17 114.38 123.66 2p7m h ARG 127 Ca 0.28 -0.12 -0.19 0.00 -1.10 0.00 0.00 59.98 58.85 2p7m h ARG 127 Cb 0.04 -0.10 0.00 0.00 -1.39 0.00 0.00 29.97 28.53 2p7m h ARG 127 CO -0.04 0.60 -0.65 -0.07 2.80 0.00 0.00 179.97 182.60 2p7m h LEU 128 N 0.52 0.80 0.00 3.80 3.38 -0.70 -3.47 115.31 119.63 2p7m h LEU 128 Ca 0.13 -0.47 0.00 0.00 0.09 0.00 0.00 57.88 57.63 2p7m h LEU 128 Cb 0.22 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.73 2p7m h LEU 128 CO -0.01 1.24 0.00 1.17 0.09 0.00 0.00 178.44 180.94