#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tvm n GLY 2 N 0.00 0.66 3.51 3.17 0.00 -1.26 -5.13 105.19 106.15 1tvm n GLY 2 Ca 0.00 -0.27 -0.30 0.00 0.00 0.00 0.00 46.02 45.45 1tvm n GLY 2 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1tvm s SER 3 N -1.07 4.06 -0.32 1.61 0.01 -1.26 -5.11 113.70 111.62 1tvm s SER 3 Ca 0.00 -0.44 0.03 0.00 1.31 0.00 0.00 55.95 56.85 1tvm s SER 3 Cb 0.00 -0.69 0.08 0.00 0.21 0.00 0.00 66.02 65.63 1tvm s SER 3 CO 0.00 0.21 0.01 -0.44 0.41 0.00 0.00 173.24 173.43 1tvm s SER 4 N -1.90 4.72 -0.11 2.44 0.01 -1.26 -5.08 113.70 112.53 1tvm s SER 4 Ca 0.18 -1.82 -0.29 0.00 1.31 0.00 0.00 55.95 55.33 1tvm s SER 4 Cb -0.11 -1.63 0.07 0.00 0.21 0.00 0.00 66.02 64.56 1tvm s SER 4 CO 0.09 -0.32 0.68 -1.00 0.41 0.00 0.00 173.24 173.10 1tvm s HIS 5 N 1.02 -0.68 0.00 2.43 3.76 -1.26 -5.04 115.29 115.52 1tvm s HIS 5 Ca 0.03 1.30 0.00 0.00 -0.15 0.00 0.00 55.06 56.24 1tvm s HIS 5 Cb -0.20 0.36 0.00 0.00 1.11 0.00 0.00 32.58 33.86 1tvm s HIS 5 CO -0.06 -0.54 0.00 -2.39 -0.85 0.00 0.00 174.74 170.90 1tvm n HIS 6 N 1.39 0.00 0.00 1.40 -0.00 -1.26 -5.07 115.22 111.68 1tvm n HIS 6 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.54 1tvm n HIS 6 Cb 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.55 1tvm n HIS 6 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 1tvm n HIS 7 N 0.00 0.00 -3.94 -1.40 8.25 -1.26 -4.58 115.22 112.28 1tvm n HIS 7 Ca 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.42 1tvm n HIS 7 Cb 0.00 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.10 1tvm n HIS 7 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 1tvm n HIS 8 N 0.00 -0.29 -1.60 4.41 -0.00 -1.26 -5.15 115.22 111.34 1tvm n HIS 8 Ca 0.00 -0.32 -0.30 0.00 -0.00 0.00 0.00 57.72 57.10 1tvm n HIS 8 Cb 0.00 -0.05 0.21 0.00 -0.00 0.00 0.00 29.99 30.15 1tvm n HIS 8 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 1tvm s HIS 9 N -0.98 1.09 0.00 1.57 0.09 -1.26 -5.02 115.29 110.77 1tvm s HIS 9 Ca 0.01 0.36 0.00 0.00 -0.00 0.00 0.00 55.06 55.44 1tvm s HIS 9 Cb -0.00 -3.88 0.00 0.00 -0.00 0.00 0.00 32.58 28.70 1tvm s HIS 9 CO 0.01 -3.18 0.70 0.72 -0.00 0.00 0.00 174.74 172.99 1tvm n HIS 10 N -4.18 0.00 0.00 1.40 8.25 -1.26 -4.89 115.22 114.54 1tvm n HIS 10 Ca 0.15 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.61 1tvm n HIS 10 Cb 0.59 -0.20 0.00 0.00 1.12 0.00 0.00 29.99 31.50 1tvm n HIS 10 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 1tvm n HIS 11 N -1.11 0.00 -0.01 4.41 -0.00 -1.26 -5.01 115.22 112.23 1tvm n HIS 11 Ca 0.00 0.00 -0.01 0.00 0.46 0.00 0.00 57.72 58.17 1tvm n HIS 11 Cb 0.00 0.00 -0.01 0.00 -0.12 0.00 0.00 29.99 29.86 1tvm n HIS 11 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 1tvm n HIS 12 N 0.00 0.00 -2.83 1.57 -0.00 -1.26 -5.04 115.22 107.67 1tvm n HIS 12 Ca 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 57.72 57.57 1tvm n HIS 12 Cb 0.00 -0.07 0.03 0.00 -0.00 0.00 0.00 29.99 29.95 1tvm n HIS 12 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.34 174.43 1tvm n GLU 13 N -2.44 -3.55 -2.89 -0.41 2.13 -1.26 -4.99 120.64 107.23 1tvm n GLU 13 Ca -0.03 0.60 -0.36 0.00 0.66 0.00 0.00 57.16 58.03 1tvm n GLU 13 Cb 0.54 -4.82 -0.06 0.00 0.27 0.00 0.00 31.44 27.36 1tvm n GLU 13 CO 0.00 0.00 0.00 -0.80 -0.41 0.00 0.00 177.13 175.92 1tvm s ASN 14 N -2.86 7.18 -0.01 4.31 0.02 -1.26 -4.97 114.94 117.35 1tvm s ASN 14 Ca 0.23 1.68 0.13 0.00 -1.02 0.00 0.00 52.86 53.87 1tvm s ASN 14 Cb -0.10 -2.52 -0.16 0.00 0.02 0.00 0.00 41.25 38.49 1tvm s ASN 14 CO 0.28 -0.09 0.48 0.00 0.02 0.00 0.00 177.10 177.80 1tvm n LEU 15 N 0.39 0.45 -4.29 0.60 -0.00 -1.26 -4.81 117.00 108.08 1tvm n LEU 15 Ca 0.02 -0.36 -0.45 0.00 -0.00 0.00 0.00 56.01 55.22 1tvm n LEU 15 Cb 0.51 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.90 1tvm n LEU 15 CO 0.43 0.11 0.44 -0.47 -0.00 0.00 0.00 177.39 177.90 1tvm s TYR 16 N -2.44 3.82 0.01 1.47 5.04 -1.26 -5.01 117.35 118.98 1tvm s TYR 16 Ca 0.02 -2.26 -0.10 0.00 -2.44 0.00 0.00 57.07 52.29 1tvm s TYR 16 Cb 0.10 -3.72 0.01 0.00 0.35 0.00 0.00 41.96 38.69 1tvm s TYR 16 CO 0.55 -0.95 0.21 0.12 -1.34 0.00 0.00 175.55 174.14 1tvm s PHE 17 N -0.21 -0.03 -0.50 4.97 5.36 -1.26 -5.05 117.98 121.26 1tvm s PHE 17 Ca 0.21 -0.03 -0.06 0.00 -0.96 0.00 0.00 56.93 56.09 1tvm s PHE 17 Cb -0.11 0.01 -0.09 0.00 -0.34 0.00 0.00 43.02 42.49 1tvm s PHE 17 CO -0.08 -0.36 3.11 1.04 -1.46 0.00 0.00 175.22 177.47 1tvm n GLN 18 N 1.19 2.64 -1.79 10.12 6.02 -1.26 -4.80 117.38 129.49 1tvm n GLN 18 Ca -0.21 -1.89 -0.41 0.00 -0.01 0.00 0.00 57.00 54.47 1tvm n GLN 18 Cb 0.57 -2.22 -0.01 0.00 1.02 0.00 0.00 30.24 29.60 1tvm n GLN 18 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1tvm n GLY 19 N 1.98 4.54 3.93 1.08 0.00 -1.26 -4.82 105.19 110.62 1tvm n GLY 19 Ca 0.52 -1.72 0.03 0.00 0.00 0.00 0.00 46.02 44.85 1tvm n GLY 19 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1tvm s SER 20 N 2.20 -0.00 0.00 1.61 1.04 -1.26 -5.05 113.70 112.24 1tvm s SER 20 Ca 0.51 -0.11 0.00 0.00 0.48 0.00 0.00 55.95 56.83 1tvm s SER 20 Cb 0.14 0.09 0.00 0.00 0.10 0.00 0.00 66.02 66.35 1tvm s SER 20 CO -0.06 -0.17 0.00 1.17 0.98 0.00 0.00 173.24 175.16 1tvm n LYS 21 N -0.85 0.00 -4.43 4.02 3.00 -1.26 -5.02 118.16 113.63 1tvm n LYS 21 Ca 0.02 0.00 -0.29 0.00 -0.00 0.00 0.00 58.31 58.04 1tvm n LYS 21 Cb 0.59 0.00 -0.12 0.00 0.00 0.00 0.00 35.03 35.50 1tvm n LYS 21 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 1tvm s ARG 22 N -0.28 1.64 -0.18 1.64 0.52 -1.26 -4.93 118.95 116.11 1tvm s ARG 22 Ca 0.00 -1.23 -0.01 0.00 -0.52 0.00 0.00 55.73 53.97 1tvm s ARG 22 Cb 0.00 -2.02 0.05 0.00 0.52 0.00 0.00 34.95 33.50 1tvm s ARG 22 CO 0.00 0.48 -0.02 0.15 0.02 0.00 0.00 175.30 175.92 1tvm s LYS 23 N -1.96 1.17 0.12 3.54 1.02 -1.26 -2.20 119.74 120.17 1tvm s LYS 23 Ca 0.15 -0.51 0.03 0.00 0.02 0.00 0.00 55.97 55.66 1tvm s LYS 23 Cb -0.10 -2.03 -0.04 0.00 -0.52 0.00 0.00 37.83 35.14 1tvm s LYS 23 CO 0.07 -0.50 0.20 0.42 -0.92 0.00 0.00 175.35 174.61 1tvm s ILE 24 N 1.69 5.00 0.04 2.17 1.01 -0.69 0.38 121.20 130.80 1tvm s ILE 24 Ca -0.00 -0.73 0.06 0.00 0.00 0.00 0.00 60.65 59.98 1tvm s ILE 24 Cb -0.16 -3.51 -0.02 0.00 0.01 0.00 0.00 42.46 38.78 1tvm s ILE 24 CO -0.07 -0.01 -0.17 -0.63 0.00 0.00 0.00 174.94 174.06 1tvm s ILE 25 N -1.63 1.38 -0.12 2.92 1.01 -0.77 0.73 121.20 124.72 1tvm s ILE 25 Ca 0.33 -1.10 0.01 0.00 0.00 0.00 0.00 60.65 59.88 1tvm s ILE 25 Cb -0.11 -1.22 0.02 0.00 0.01 0.00 0.00 42.46 41.15 1tvm s ILE 25 CO 0.26 0.09 -0.14 0.54 0.00 0.00 0.00 174.94 175.70 1tvm s VAL 26 N -0.83 1.46 -0.12 2.92 0.11 0.11 -0.09 120.40 123.95 1tvm s VAL 26 Ca 0.04 -0.59 0.03 0.00 -2.93 0.00 0.00 61.98 58.53 1tvm s VAL 26 Cb -0.08 -1.36 0.01 0.00 -1.53 0.00 0.00 36.38 33.42 1tvm s VAL 26 CO 0.02 0.44 -0.21 0.00 -3.33 0.00 0.00 175.10 172.01 1tvm s ALA 27 N 1.24 2.10 0.15 1.54 0.00 -0.53 -1.51 121.76 124.76 1tvm s ALA 27 Ca -0.01 -0.98 -0.17 0.00 0.00 0.00 0.00 51.96 50.80 1tvm s ALA 27 Cb -0.14 -0.92 0.03 0.00 0.00 0.00 0.00 23.12 22.10 1tvm s ALA 27 CO -0.06 0.03 0.44 0.00 0.00 0.00 0.00 175.76 176.18 1tvm s GLY 29 N -2.82 1.88 0.00 0.00 0.00 -1.26 -4.82 107.32 100.30 1tvm s GLY 29 Ca 0.05 -2.80 0.00 0.00 0.00 0.00 0.00 44.72 41.97 1tvm s GLY 29 CO -0.09 2.19 0.00 0.61 0.00 0.00 0.00 173.10 175.81 1tvm n GLY 30 N 5.47 2.13 0.00 0.20 0.00 -1.26 -5.09 105.19 106.64 1tvm n GLY 30 Ca 0.30 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.47 1tvm n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tvm n ALA 31 N -1.50 0.00 0.00 4.61 0.00 -1.26 -4.73 120.51 117.63 1tvm n ALA 31 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1tvm n ALA 31 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1tvm n ALA 31 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1tvm n VAL 32 N 0.00 0.00 0.00 0.00 0.31 -1.26 -4.97 118.33 112.41 1tvm n VAL 32 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1tvm n VAL 32 Cb 0.00 -0.10 0.00 0.00 -0.91 0.00 0.00 33.84 32.83 1tvm n VAL 32 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1tvm n ALA 33 N -1.72 2.13 0.32 3.52 0.00 -1.26 -4.82 120.51 118.68 1tvm n ALA 33 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 1tvm n ALA 33 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 1tvm n ALA 33 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1tvm h THR 34 N 0.00 0.28 -1.00 0.00 2.02 -1.96 -1.40 112.91 110.85 1tvm h THR 34 Ca 0.00 -0.29 0.22 0.00 0.77 0.00 0.00 66.41 67.11 1tvm h THR 34 Cb 0.00 0.37 -0.11 0.00 -1.74 0.00 0.00 68.15 66.67 1tvm h THR 34 CO 0.00 0.03 0.61 -1.28 0.37 0.00 0.00 175.52 175.26 1tvm h SER 35 N -1.03 0.68 0.45 4.18 0.87 -1.92 0.45 113.55 117.23 1tvm h SER 35 Ca -0.08 0.10 -0.11 0.00 -1.23 0.00 0.00 61.79 60.47 1tvm h SER 35 Cb 0.67 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.61 1tvm h SER 35 CO 0.14 0.19 -0.50 0.74 -0.53 0.00 0.00 176.83 176.86 1tvm h THR 36 N 0.63 1.36 0.28 2.23 2.02 -1.85 -2.70 112.91 114.88 1tvm h THR 36 Ca 0.60 -1.73 -0.00 0.00 0.77 0.00 0.00 66.41 66.04 1tvm h THR 36 Cb 1.11 1.90 -0.01 0.00 -1.74 0.00 0.00 68.15 69.41 1tvm h THR 36 CO -0.39 0.50 -0.22 0.24 0.37 0.00 0.00 175.52 176.02 1tvm h MET 37 N 0.05 -0.49 0.78 6.66 2.86 0.10 0.32 114.93 125.22 1tvm h MET 37 Ca -0.00 0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.63 1tvm h MET 37 Cb 0.91 0.11 0.01 0.00 0.06 0.00 0.00 31.60 32.69 1tvm h MET 37 CO 0.07 -0.33 -0.38 0.00 1.06 0.00 0.00 176.91 177.33 1tvm h ALA 38 N 0.15 -1.05 0.06 6.32 0.00 -1.49 0.63 119.26 123.89 1tvm h ALA 38 Ca -0.02 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.68 1tvm h ALA 38 Cb 0.45 0.41 -0.05 0.00 0.00 0.00 0.00 17.79 18.60 1tvm h ALA 38 CO -0.01 -1.04 -0.43 0.00 0.00 0.00 0.00 179.25 177.76 1tvm h ALA 39 N -0.99 -0.74 -0.75 0.00 0.00 -1.47 0.83 119.26 116.13 1tvm h ALA 39 Ca -0.11 -0.06 0.07 0.00 0.00 0.00 0.00 54.91 54.81 1tvm h ALA 39 Cb 0.82 0.74 -0.05 0.00 0.00 0.00 0.00 17.79 19.30 1tvm h ALA 39 CO 0.18 -0.99 0.49 1.49 0.00 0.00 0.00 179.25 180.42 1tvm h GLU 40 N -0.63 0.75 0.14 0.00 4.81 -0.40 0.24 114.58 119.50 1tvm h GLU 40 Ca 0.03 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1tvm h GLU 40 Cb 0.68 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.89 1tvm h GLU 40 CO -0.28 0.50 -0.07 0.93 -0.73 0.00 0.00 179.01 179.36 1tvm h GLU 41 N 0.77 -0.18 -0.44 1.92 5.08 0.14 -2.80 114.58 119.08 1tvm h GLU 41 Ca 0.33 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.70 1tvm h GLU 41 Cb 0.28 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1tvm h GLU 41 CO -0.11 0.27 0.26 0.82 -1.00 0.00 0.00 179.01 179.25 1tvm h ILE 42 N -0.82 1.13 0.84 3.13 1.08 0.83 -2.34 117.51 121.36 1tvm h ILE 42 Ca -0.02 -0.29 -0.04 0.00 -0.39 0.00 0.00 64.86 64.12 1tvm h ILE 42 Cb 0.54 0.51 0.01 0.00 -3.07 0.00 0.00 36.82 34.81 1tvm h ILE 42 CO 0.03 0.14 -0.41 0.50 -0.69 0.00 0.00 178.15 177.72 1tvm h LYS 43 N 0.61 -1.09 -0.74 2.37 3.64 -0.57 0.11 116.57 120.89 1tvm h LYS 43 Ca 0.16 0.07 0.16 0.00 -1.27 0.00 0.00 60.65 59.77 1tvm h LYS 43 Cb -0.02 0.25 -0.05 0.00 -0.41 0.00 0.00 32.23 32.00 1tvm h LYS 43 CO -0.03 -0.72 0.50 1.05 -2.27 0.00 0.00 179.45 177.98 1tvm h GLU 44 N -1.22 0.34 0.20 1.90 4.11 -1.36 -1.79 114.58 116.76 1tvm h GLU 44 Ca -0.12 -0.02 -0.01 0.00 0.07 0.00 0.00 59.36 59.28 1tvm h GLU 44 Cb 0.88 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.05 1tvm h GLU 44 CO 0.19 0.23 -0.09 1.25 0.07 0.00 0.00 179.01 180.65 1tvm h LEU 45 N 0.35 -0.22 -1.35 3.06 5.85 -1.15 -1.93 115.31 119.92 1tvm h LEU 45 Ca 0.37 -0.27 0.27 0.00 0.84 0.00 0.00 57.88 59.08 1tvm h LEU 45 Cb 0.92 0.06 -0.10 0.00 0.37 0.00 0.00 40.66 41.91 1tvm h LEU 45 CO -0.11 0.19 0.67 0.00 -0.34 0.00 0.00 178.44 178.85 1tvm h GLN 47 N 0.40 0.56 -0.88 0.00 7.50 -1.41 0.59 115.11 121.87 1tvm h GLN 47 Ca 0.60 -0.60 0.17 0.00 0.50 0.00 0.00 58.65 59.31 1tvm h GLN 47 Cb 1.49 0.17 -0.10 0.00 0.05 0.00 0.00 27.48 29.09 1tvm h GLN 47 CO -0.30 1.22 0.45 0.77 -1.50 0.00 0.00 178.83 179.47 1tvm h SER 48 N 0.14 0.53 0.03 1.46 0.02 -0.05 0.72 113.55 116.39 1tvm h SER 48 Ca -0.11 0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1tvm h SER 48 Cb 1.52 0.02 0.00 0.00 0.14 0.00 0.00 62.40 64.08 1tvm h SER 48 CO 0.16 0.19 -0.21 1.41 -1.14 0.00 0.00 176.83 177.24 1tvm n HIS 49 N -4.89 0.00 -3.67 3.45 8.25 -0.84 -4.97 115.22 112.55 1tvm n HIS 49 Ca 0.19 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.44 1tvm n HIS 49 Cb 0.49 -0.02 0.04 0.00 1.12 0.00 0.00 29.99 31.62 1tvm n HIS 49 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1tvm n ASN 50 N 0.29 -1.51 -4.24 0.41 3.02 0.24 -4.95 115.26 108.53 1tvm n ASN 50 Ca 0.13 -0.81 -0.42 0.00 -0.03 0.00 0.00 54.58 53.45 1tvm n ASN 50 Cb 0.46 -4.14 -0.07 0.00 -0.61 0.00 0.00 39.78 35.42 1tvm n ASN 50 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1tvm s ILE 51 N -3.63 4.61 -0.20 2.41 1.01 0.07 -5.02 121.20 120.45 1tvm s ILE 51 Ca 0.03 -2.02 -0.32 0.00 0.00 0.00 0.00 60.65 58.34 1tvm s ILE 51 Cb -0.01 -3.97 -0.10 0.00 0.01 0.00 0.00 42.46 38.39 1tvm s ILE 51 CO 0.81 -0.86 2.08 -2.65 0.00 0.00 0.00 174.94 174.32 1tvm n PRO 52 N 4.61 1.83 -3.73 2.79 -0.02 -1.26 -4.84 135.00 134.37 1tvm n PRO 52 Ca -0.03 0.59 -0.09 0.00 -2.02 0.00 0.00 63.50 61.95 1tvm n PRO 52 Cb 0.41 -2.79 -0.02 0.00 -0.02 0.00 0.00 33.50 31.08 1tvm n PRO 52 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1tvm s VAL 53 N 6.29 0.00 -0.13 -1.45 -7.23 -1.26 -4.18 120.40 112.44 1tvm s VAL 53 Ca 1.00 -0.73 -0.00 0.00 -1.81 0.00 0.00 61.98 60.44 1tvm s VAL 53 Cb -0.62 -1.69 0.03 0.00 0.56 0.00 0.00 36.38 34.66 1tvm s VAL 53 CO 0.46 -0.02 -0.09 -1.61 -0.31 0.00 0.00 175.10 173.53 1tvm s GLU 54 N -3.87 1.71 -0.27 4.82 2.02 -0.94 -5.03 118.70 117.15 1tvm s GLU 54 Ca 0.09 -0.38 -0.12 0.00 0.02 0.00 0.00 54.97 54.59 1tvm s GLU 54 Cb -0.04 -1.79 -0.05 0.00 0.10 0.00 0.00 34.13 32.36 1tvm s GLU 54 CO 0.00 -0.29 0.21 -1.17 0.02 0.00 0.00 175.26 174.04 1tvm s LEU 55 N 1.64 4.04 0.10 1.80 0.20 -1.26 -1.70 118.68 123.50 1tvm s LEU 55 Ca 0.04 0.06 0.04 0.00 0.69 0.00 0.00 54.13 54.96 1tvm s LEU 55 Cb -0.13 -2.17 -0.04 0.00 -0.43 0.00 0.00 46.19 43.42 1tvm s LEU 55 CO -0.09 -0.05 0.05 0.27 -0.29 0.00 0.00 176.35 176.24 1tvm s ILE 56 N 1.68 4.26 -0.08 6.68 -4.36 0.22 -4.97 121.20 124.64 1tvm s ILE 56 Ca 0.08 -0.93 0.04 0.00 -0.26 0.00 0.00 60.65 59.59 1tvm s ILE 56 Cb -0.16 -3.06 -0.00 0.00 1.25 0.00 0.00 42.46 40.49 1tvm s ILE 56 CO 0.10 0.09 -0.22 -1.58 0.24 0.00 0.00 174.94 173.56 1tvm s GLN 57 N -2.45 2.61 0.22 0.37 -0.44 -1.26 0.04 119.66 118.75 1tvm s GLN 57 Ca 0.28 -0.80 -0.16 0.00 -2.50 0.00 0.00 55.36 52.18 1tvm s GLN 57 Cb -0.12 -2.07 0.01 0.00 -1.64 0.00 0.00 33.01 29.19 1tvm s GLN 57 CO 0.20 0.23 0.52 0.00 0.50 0.00 0.00 175.29 176.74 1tvm n ARG 59 N -0.36 1.69 0.00 0.00 1.74 -1.26 -3.45 116.66 115.02 1tvm n ARG 59 Ca -0.06 0.00 0.13 0.00 -0.77 0.00 0.00 57.85 57.15 1tvm n ARG 59 Cb 0.62 0.00 0.37 0.00 -1.02 0.00 0.00 32.46 32.43 1tvm n ARG 59 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 1tvm n VAL 60 N -0.21 0.00 -2.59 1.55 0.24 -1.26 -4.17 118.33 111.88 1tvm n VAL 60 Ca 0.00 -0.15 -0.15 0.00 -2.04 0.00 0.00 64.34 62.00 1tvm n VAL 60 Cb 0.00 0.46 0.02 0.00 -1.47 0.00 0.00 33.84 32.85 1tvm n VAL 60 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1tvm n ASN 61 N -0.51 2.62 0.00 -1.34 4.13 -1.26 -4.80 115.26 114.11 1tvm n ASN 61 Ca 0.13 -3.06 0.00 0.00 1.68 0.00 0.00 54.58 53.33 1tvm n ASN 61 Cb 0.36 -0.50 0.00 0.00 -1.54 0.00 0.00 39.78 38.09 1tvm n ASN 61 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1tvm n GLU 62 N -0.22 0.00 -0.28 3.52 4.71 -1.26 -4.81 120.64 122.31 1tvm n GLU 62 Ca 0.20 0.00 0.15 0.00 -0.01 0.00 0.00 57.16 57.50 1tvm n GLU 62 Cb 0.77 -0.50 0.42 0.00 -1.01 0.00 0.00 31.44 31.12 1tvm n GLU 62 CO 0.00 0.00 0.00 0.82 0.09 0.00 0.00 177.13 178.04 1tvm h ILE 63 N 0.00 0.75 -0.27 -3.67 2.04 -1.87 0.49 117.51 114.98 1tvm h ILE 63 Ca 0.00 -0.21 -0.13 0.00 1.00 0.00 0.00 64.86 65.53 1tvm h ILE 63 Cb 0.00 0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.17 1tvm h ILE 63 CO 0.00 0.11 -0.36 -0.33 0.00 0.00 0.00 178.15 177.57 1tvm h GLU 64 N 0.60 0.62 0.07 2.37 4.39 -1.92 0.26 114.58 120.96 1tvm h GLU 64 Ca 0.48 -0.30 -0.22 0.00 0.34 0.00 0.00 59.36 59.67 1tvm h GLU 64 Cb 0.92 -0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.59 1tvm h GLU 64 CO -0.23 0.88 -0.89 1.79 -1.16 0.00 0.00 179.01 179.41 1tvm h THR 65 N 0.52 1.39 -0.38 1.13 1.35 -1.13 -3.23 112.91 112.56 1tvm h THR 65 Ca 0.05 -2.31 0.00 0.00 -0.55 0.00 0.00 66.41 63.60 1tvm h THR 65 Cb 0.86 2.74 0.00 0.00 -1.73 0.00 0.00 68.15 70.02 1tvm h THR 65 CO 0.07 0.68 0.00 -1.22 -0.25 0.00 0.00 175.52 174.81 1tvm n TYR 66 N -4.04 0.67 -0.56 4.73 4.01 0.15 -4.56 117.16 117.56 1tvm n TYR 66 Ca -0.12 -0.30 -0.06 0.00 -0.16 0.00 0.00 57.90 57.27 1tvm n TYR 66 Cb 0.82 -0.07 -0.08 0.00 -0.31 0.00 0.00 39.34 39.70 1tvm n TYR 66 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 1tvm n MET 67 N 0.60 1.12 -0.14 -0.72 2.81 0.91 -4.33 117.12 117.37 1tvm n MET 67 Ca 0.14 -0.47 -0.12 0.00 -1.81 0.00 0.00 57.70 55.43 1tvm n MET 67 Cb 0.43 -1.65 -0.01 0.00 -0.71 0.00 0.00 33.22 31.29 1tvm n MET 67 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 1tvm h ASP 68 N 3.50 1.02 0.00 7.83 5.19 -1.85 -3.41 116.42 128.71 1tvm h ASP 68 Ca 0.09 -0.43 -0.22 0.00 -0.62 0.00 0.00 57.03 55.85 1tvm h ASP 68 Cb 0.90 -0.28 -0.14 0.00 0.18 0.00 0.00 39.33 39.98 1tvm h ASP 68 CO 0.24 1.23 -0.37 0.61 -3.12 0.00 0.00 179.24 177.82 1tvm n GLY 69 N 0.01 0.33 3.70 2.75 0.00 -1.26 -5.13 105.19 105.58 1tvm n GLY 69 Ca -0.01 0.13 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 1tvm n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tvm s VAL 70 N 0.24 5.15 -0.18 1.61 0.11 -1.26 -4.21 120.40 121.86 1tvm s VAL 70 Ca 0.22 0.98 0.21 0.00 -2.93 0.00 0.00 61.98 60.46 1tvm s VAL 70 Cb 0.29 -3.84 -0.09 0.00 -1.53 0.00 0.00 36.38 31.21 1tvm s VAL 70 CO -0.07 0.27 0.88 1.57 -3.33 0.00 0.00 175.10 174.42 1tvm n HIS 71 N 4.09 0.78 -3.65 1.54 -0.00 0.16 -4.86 115.22 113.29 1tvm n HIS 71 Ca -0.06 0.23 -0.15 0.00 0.46 0.00 0.00 57.72 58.20 1tvm n HIS 71 Cb 0.51 -0.90 -0.08 0.00 -0.12 0.00 0.00 29.99 29.41 1tvm n HIS 71 CO 0.00 0.00 0.00 -0.51 0.46 0.00 0.00 176.34 176.29 1tvm s LEU 72 N -5.27 -0.12 0.01 0.27 1.43 -1.06 -4.71 118.68 109.23 1tvm s LEU 72 Ca -0.02 0.79 0.04 0.00 -1.03 0.00 0.00 54.13 53.90 1tvm s LEU 72 Cb 0.10 2.00 -0.01 0.00 0.03 0.00 0.00 46.19 48.31 1tvm s LEU 72 CO 0.82 -0.38 -0.11 -0.51 0.23 0.00 0.00 176.35 176.39 1tvm s ILE 73 N -0.52 0.86 -0.16 -0.59 1.10 0.14 -1.84 121.20 120.19 1tvm s ILE 73 Ca -0.06 -0.64 -0.00 0.00 -0.51 0.00 0.00 60.65 59.44 1tvm s ILE 73 Cb -0.03 -0.75 0.04 0.00 0.15 0.00 0.00 42.46 41.86 1tvm s ILE 73 CO 0.04 0.11 -0.08 0.00 -2.11 0.00 0.00 174.94 172.91 1tvm s THR 75 N 1.58 0.10 -1.00 0.00 2.01 -0.93 -1.45 115.64 115.94 1tvm s THR 75 Ca 0.02 -0.84 -0.03 0.00 0.31 0.00 0.00 61.69 61.15 1tvm s THR 75 Cb -0.14 -0.33 0.30 0.00 0.01 0.00 0.00 72.50 72.33 1tvm s THR 75 CO -0.08 -0.46 1.32 1.07 -0.69 0.00 0.00 174.62 175.78 1tvm n THR 76 N 1.53 4.75 -3.67 -0.82 5.66 -1.25 -4.17 114.28 116.31 1tvm n THR 76 Ca -0.24 -5.77 -0.15 0.00 -3.05 0.00 0.00 64.05 54.84 1tvm n THR 76 Cb 0.55 -2.12 -0.08 0.00 -1.55 0.00 0.00 70.33 67.14 1tvm n THR 76 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1tvm s ALA 77 N -2.63 -1.19 -1.39 1.79 0.00 -1.26 -5.05 121.76 112.03 1tvm s ALA 77 Ca 0.32 0.87 -0.09 0.00 0.00 0.00 0.00 51.96 53.06 1tvm s ALA 77 Cb 0.05 -0.13 -0.07 0.00 0.00 0.00 0.00 23.12 22.97 1tvm s ALA 77 CO 0.07 -0.29 2.66 0.54 0.00 0.00 0.00 175.76 178.74 1tvm n ARG 78 N 1.48 3.14 -0.38 0.00 1.74 -1.26 -4.93 116.66 116.44 1tvm n ARG 78 Ca -0.19 -1.97 -0.25 0.00 -0.77 0.00 0.00 57.85 54.67 1tvm n ARG 78 Cb 0.56 -2.71 0.23 0.00 -1.02 0.00 0.00 32.46 29.53 1tvm n ARG 78 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 1tvm n VAL 79 N 3.86 0.00 0.02 1.55 0.24 -1.26 -4.97 118.33 117.78 1tvm n VAL 79 Ca 0.67 -0.12 0.06 0.00 -2.04 0.00 0.00 64.34 62.91 1tvm n VAL 79 Cb 0.21 -0.92 -0.10 0.00 -1.47 0.00 0.00 33.84 31.56 1tvm n VAL 79 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1tvm n ASP 80 N -5.11 0.46 -4.41 -1.34 8.00 -1.26 -4.97 116.55 107.92 1tvm n ASP 80 Ca 0.12 0.19 -0.40 0.00 0.71 0.00 0.00 54.79 55.40 1tvm n ASP 80 Cb 0.49 0.99 -0.06 0.00 -0.02 0.00 0.00 41.12 42.52 1tvm n ASP 80 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1tvm n ARG 81 N -2.59 -1.76 0.00 -1.24 0.63 -1.26 -4.76 116.66 105.68 1tvm n ARG 81 Ca -0.08 0.24 0.00 0.00 -0.92 0.00 0.00 57.85 57.09 1tvm n ARG 81 Cb 0.70 -4.87 0.00 0.00 0.45 0.00 0.00 32.46 28.74 1tvm n ARG 81 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 1tvm n SER 82 N -2.55 0.90 -4.38 6.15 3.41 -1.26 -4.97 113.62 110.92 1tvm n SER 82 Ca 0.10 -1.20 -0.45 0.00 -0.26 0.00 0.00 58.87 57.06 1tvm n SER 82 Cb 0.47 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.38 1tvm n SER 82 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1tvm s PHE 83 N -0.20 2.97 0.00 7.33 -0.71 -1.26 -4.91 117.98 121.21 1tvm s PHE 83 Ca 0.00 -0.94 0.00 0.00 -1.04 0.00 0.00 56.93 54.95 1tvm s PHE 83 Cb 0.00 -4.05 0.00 0.00 -1.21 0.00 0.00 43.02 37.76 1tvm s PHE 83 CO 0.00 -1.33 0.00 0.41 -1.34 0.00 0.00 175.22 172.96 1tvm n GLY 84 N 5.28 2.37 1.11 1.99 0.00 -1.26 -3.85 105.19 110.83 1tvm n GLY 84 Ca -0.08 -0.40 -0.01 0.00 0.00 0.00 0.00 46.02 45.52 1tvm n GLY 84 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1tvm n ASP 85 N 9.07 0.04 -4.53 1.61 8.00 -1.26 -5.08 116.55 124.39 1tvm n ASP 85 Ca 0.00 -1.91 -0.40 0.00 0.71 0.00 0.00 54.79 53.20 1tvm n ASP 85 Cb 0.00 -0.03 -0.05 0.00 -0.02 0.00 0.00 41.12 41.01 1tvm n ASP 85 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1tvm n ILE 86 N 0.21 0.01 -1.90 0.53 0.13 -1.25 -4.82 119.36 112.27 1tvm n ILE 86 Ca -0.08 -0.56 -0.23 0.00 -1.10 0.00 0.00 62.75 60.77 1tvm n ILE 86 Cb 0.87 -2.26 -0.08 0.00 -0.84 0.00 0.00 39.64 37.33 1tvm n ILE 86 CO 0.00 0.00 0.00 -2.16 2.80 0.00 0.00 176.55 177.19 1tvm s PRO 87 N 7.92 2.02 -0.01 9.51 0.04 -1.26 -4.92 135.00 148.30 1tvm s PRO 87 Ca 1.06 -0.84 -0.06 0.00 0.04 0.00 0.00 61.00 61.21 1tvm s PRO 87 Cb -0.46 -5.13 -0.05 0.00 0.04 0.00 0.00 34.50 28.90 1tvm s PRO 87 CO 0.34 -4.50 0.24 -1.17 0.04 0.00 0.00 177.00 171.95 1tvm s LEU 88 N 13.17 4.37 0.04 -3.56 0.20 -1.26 -0.68 118.68 130.97 1tvm s LEU 88 Ca 0.74 0.51 0.02 0.00 0.69 0.00 0.00 54.13 56.09 1tvm s LEU 88 Cb -0.03 -2.60 -0.02 0.00 -0.43 0.00 0.00 46.19 43.11 1tvm s LEU 88 CO 0.14 0.27 -0.08 0.68 -0.29 0.00 0.00 176.35 177.07 1tvm s VAL 89 N -1.27 0.59 0.21 1.68 -7.23 0.20 -4.93 120.40 109.64 1tvm s VAL 89 Ca 0.26 -1.06 -0.26 0.00 -1.81 0.00 0.00 61.98 59.10 1tvm s VAL 89 Cb -0.13 -0.64 -0.08 0.00 0.56 0.00 0.00 36.38 36.08 1tvm s VAL 89 CO 0.15 -0.35 0.84 -1.00 -0.31 0.00 0.00 175.10 174.44 1tvm s HIS 90 N -1.32 3.89 -0.24 2.82 3.76 -1.26 -2.19 115.29 120.76 1tvm s HIS 90 Ca -0.09 1.72 0.04 0.00 -0.15 0.00 0.00 55.06 56.58 1tvm s HIS 90 Cb -0.10 -2.84 0.10 0.00 1.11 0.00 0.00 32.58 30.86 1tvm s HIS 90 CO 0.01 0.46 1.08 0.41 -0.85 0.00 0.00 174.74 175.84 1tvm n GLY 91 N 1.40 3.06 0.25 -2.22 0.00 -1.26 -4.73 105.19 101.69 1tvm n GLY 91 Ca -0.04 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1tvm n GLY 91 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1tvm h MET 92 N 0.54 0.53 -0.12 1.61 4.05 -1.93 0.10 114.93 119.71 1tvm h MET 92 Ca 0.00 -0.03 -0.17 0.00 -0.28 0.00 0.00 59.70 59.22 1tvm h MET 92 Cb 0.60 -0.12 -0.01 0.00 -0.80 0.00 0.00 31.60 31.28 1tvm h MET 92 CO 0.00 0.35 -0.63 -1.00 0.23 0.00 0.00 176.91 175.86 1tvm h PRO 93 N 0.54 0.43 -0.17 0.39 0.13 -1.99 -2.85 132.00 128.49 1tvm h PRO 93 Ca 0.32 -0.31 -0.18 0.00 -0.87 0.00 0.00 66.00 64.97 1tvm h PRO 93 Cb 0.34 0.05 -0.00 0.00 0.13 0.00 0.00 31.00 31.52 1tvm h PRO 93 CO -0.26 0.93 -0.62 0.35 -0.23 0.00 0.00 178.00 178.16 1tvm h PHE 94 N 0.32 0.75 0.00 1.56 3.57 -1.75 -3.02 116.94 118.38 1tvm h PHE 94 Ca -0.01 -0.29 -0.02 0.00 3.53 0.00 0.00 57.97 61.18 1tvm h PHE 94 Cb 1.18 -0.13 -0.00 0.00 2.79 0.00 0.00 35.95 39.79 1tvm h PHE 94 CO 0.04 1.05 -0.11 0.28 -2.23 0.00 0.00 178.31 177.34 1tvm h VAL 95 N 0.43 0.26 -0.95 1.41 2.07 -0.82 -3.14 116.25 115.51 1tvm h VAL 95 Ca -0.01 -0.88 0.16 0.00 0.82 0.00 0.00 66.70 66.79 1tvm h VAL 95 Cb 1.19 1.71 -0.08 0.00 -1.52 0.00 0.00 31.29 32.58 1tvm h VAL 95 CO 0.12 0.11 0.60 -1.28 0.02 0.00 0.00 177.57 177.14 1tvm h SER 96 N 0.00 0.71 0.00 0.57 0.87 -1.36 -3.46 113.55 110.89 1tvm h SER 96 Ca -0.00 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.62 1tvm h SER 96 Cb 0.70 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.58 1tvm h SER 96 CO 0.01 0.33 0.00 0.61 -0.53 0.00 0.00 176.83 177.25 1tvm n GLY 97 N -1.40 1.03 0.30 5.77 0.00 -1.19 -4.85 105.19 104.86 1tvm n GLY 97 Ca 0.20 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.27 1tvm n GLY 97 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1tvm n VAL 98 N -2.00 0.00 -0.32 1.61 0.31 -1.26 -4.51 118.33 112.15 1tvm n VAL 98 Ca 0.00 -0.43 0.02 0.00 -0.01 0.00 0.00 64.34 63.92 1tvm n VAL 98 Cb 0.00 1.16 0.03 0.00 -0.91 0.00 0.00 33.84 34.12 1tvm n VAL 98 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1tvm n GLY 99 N 0.79 3.10 0.06 2.92 0.00 -1.26 -4.76 105.19 106.05 1tvm n GLY 99 Ca 0.05 -0.26 -0.13 0.00 0.00 0.00 0.00 46.02 45.68 1tvm n GLY 99 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1tvm h ILE 100 N 0.25 1.14 -0.70 -0.61 2.04 -1.80 -0.38 117.51 117.46 1tvm h ILE 100 Ca 0.00 -0.54 0.15 0.00 1.00 0.00 0.00 64.86 65.47 1tvm h ILE 100 Cb 0.65 1.50 -0.11 0.00 -0.74 0.00 0.00 36.82 38.13 1tvm h ILE 100 CO 0.00 0.14 0.12 -0.33 0.00 0.00 0.00 178.15 178.08 1tvm h GLU 101 N -0.27 0.21 -0.09 2.37 3.07 -1.91 1.13 114.58 119.09 1tvm h GLU 101 Ca -0.00 -0.01 -0.12 0.00 -0.50 0.00 0.00 59.36 58.72 1tvm h GLU 101 Cb 0.25 -0.05 0.01 0.00 -0.84 0.00 0.00 28.75 28.12 1tvm h GLU 101 CO 0.01 0.14 -0.43 0.00 -1.40 0.00 0.00 179.01 177.33 1tvm h ALA 102 N 1.60 0.17 -0.52 3.43 0.00 -1.89 -3.19 119.26 118.86 1tvm h ALA 102 Ca 0.39 -0.48 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1tvm h ALA 102 Cb 0.66 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1tvm h ALA 102 CO -0.52 0.30 0.16 1.25 0.00 0.00 0.00 179.25 180.44 1tvm h LEU 103 N 0.00 0.76 -0.36 0.00 5.85 -0.24 -3.04 115.31 118.29 1tvm h LEU 103 Ca -0.03 -0.21 0.07 0.00 0.84 0.00 0.00 57.88 58.55 1tvm h LEU 103 Cb 1.08 -0.20 -0.09 0.00 0.37 0.00 0.00 40.66 41.82 1tvm h LEU 103 CO 0.09 0.77 -0.34 -0.61 -0.34 0.00 0.00 178.44 178.01 1tvm h GLN 104 N 0.72 -0.27 -0.90 1.25 4.15 0.12 0.81 115.11 120.98 1tvm h GLN 104 Ca 0.17 0.02 0.13 0.00 0.77 0.00 0.00 58.65 59.73 1tvm h GLN 104 Cb 0.28 0.06 -0.07 0.00 0.21 0.00 0.00 27.48 27.97 1tvm h GLN 104 CO -0.00 -0.18 0.58 -0.91 -1.93 0.00 0.00 178.83 176.38 1tvm h ASN 105 N -0.29 0.73 -0.45 -0.69 2.35 -1.53 -0.91 115.58 114.80 1tvm h ASN 105 Ca 0.16 0.04 -0.13 0.00 -0.55 0.00 0.00 56.30 55.81 1tvm h ASN 105 Cb 0.55 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.79 1tvm h ASN 105 CO -0.51 0.39 -0.23 0.11 -1.65 0.00 0.00 177.43 175.54 1tvm h LYS 106 N 0.79 0.97 0.71 0.81 6.56 -0.83 -2.68 116.57 122.89 1tvm h LYS 106 Ca 0.44 -0.42 -0.03 0.00 -1.06 0.00 0.00 60.65 59.58 1tvm h LYS 106 Cb 0.59 -0.03 0.01 0.00 -0.57 0.00 0.00 32.23 32.23 1tvm h LYS 106 CO -0.21 1.09 -0.34 0.82 -2.06 0.00 0.00 179.45 178.75 1tvm h ILE 107 N 0.84 0.24 -0.80 1.86 1.08 0.38 -2.62 117.51 118.48 1tvm h ILE 107 Ca 0.11 -0.14 0.13 0.00 -0.39 0.00 0.00 64.86 64.57 1tvm h ILE 107 Cb 0.81 0.28 -0.09 0.00 -3.07 0.00 0.00 36.82 34.74 1tvm h ILE 107 CO 0.07 0.01 0.39 0.17 -0.69 0.00 0.00 178.15 178.11 1tvm h LEU 108 N -1.06 0.47 -0.84 1.44 8.10 -1.42 0.89 115.31 122.89 1tvm h LEU 108 Ca -0.10 0.09 0.09 0.00 0.11 0.00 0.00 57.88 58.07 1tvm h LEU 108 Cb 0.75 0.02 -0.07 0.00 -0.44 0.00 0.00 40.66 40.92 1tvm h LEU 108 CO 0.16 0.21 0.49 0.74 -4.11 0.00 0.00 178.44 175.93 1tvm h THR 109 N 0.58 0.92 0.13 0.15 2.02 -1.38 0.77 112.91 116.09 1tvm h THR 109 Ca 0.43 -0.28 -0.30 0.00 0.77 0.00 0.00 66.41 67.03 1tvm h THR 109 Cb 0.59 0.03 -0.00 0.00 -1.74 0.00 0.00 68.15 67.03 1tvm h THR 109 CO -0.35 0.15 -1.43 0.40 0.37 0.00 0.00 175.52 174.66 1tvm h ILE 110 N 0.82 1.28 0.00 3.11 2.04 -0.73 -3.27 117.51 120.76 1tvm h ILE 110 Ca 0.40 -2.89 0.00 0.00 1.00 0.00 0.00 64.86 63.38 1tvm h ILE 110 Cb 0.35 2.83 0.00 0.00 -0.74 0.00 0.00 36.82 39.27 1tvm h ILE 110 CO -0.24 0.84 0.00 0.18 0.00 0.00 0.00 178.15 178.93 1tvm n LEU 111 N -3.49 0.03 -0.56 1.44 7.99 0.29 -2.72 117.00 119.98 1tvm n LEU 111 Ca -0.14 0.50 0.12 0.00 -0.01 0.00 0.00 56.01 56.48 1tvm n LEU 111 Cb 1.04 -0.50 0.07 0.00 -0.11 0.00 0.00 43.42 43.92 1tvm n LEU 111 CO 0.52 -0.09 0.42 0.00 -1.51 0.00 0.00 177.39 176.73 1tvm n GLN 112 N -1.53 1.40 0.00 3.23 6.02 0.26 -5.00 117.38 121.76 1tvm n GLN 112 Ca 0.06 -1.13 0.00 0.00 -0.01 0.00 0.00 57.00 55.92 1tvm n GLN 112 Cb 0.29 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 30.07 1tvm n GLN 112 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46