#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d6p s LEU 3 N 0.00 3.92 0.12 0.00 1.43 -1.26 -4.41 118.68 118.48 2d6p s LEU 3 Ca 0.00 0.17 0.07 0.00 -1.03 0.00 0.00 54.13 53.34 2d6p s LEU 3 Cb 0.00 -1.97 -0.04 0.00 0.03 0.00 0.00 46.19 44.21 2d6p s LEU 3 CO 0.00 0.25 -0.06 -0.36 0.23 0.00 0.00 176.35 176.41 2d6p s PHE 4 N -0.06 2.81 -0.20 0.29 0.08 -1.21 -4.88 117.98 114.80 2d6p s PHE 4 Ca 0.07 -0.13 -0.13 0.00 0.12 0.00 0.00 56.93 56.87 2d6p s PHE 4 Cb -0.12 -1.44 -0.05 0.00 -0.57 0.00 0.00 43.02 40.85 2d6p s PHE 4 CO 0.01 0.46 0.25 -1.54 -0.10 0.00 0.00 175.22 174.30 2d6p s SER 5 N -2.40 6.30 -0.21 1.36 1.04 -1.26 -0.21 113.70 118.32 2d6p s SER 5 Ca 0.24 0.35 -0.21 0.00 0.48 0.00 0.00 55.95 56.80 2d6p s SER 5 Cb -0.11 -2.16 -0.19 0.00 0.10 0.00 0.00 66.02 63.66 2d6p s SER 5 CO 0.16 0.06 0.22 0.00 0.98 0.00 0.00 173.24 174.65 2d6p h ALA 6 N 7.09 0.27 -2.69 5.32 0.00 -1.93 -3.48 119.26 123.84 2d6p h ALA 6 Ca -0.39 -1.22 -0.64 0.00 0.00 0.00 0.00 54.91 52.66 2d6p h ALA 6 Cb 1.16 0.75 -0.06 0.00 0.00 0.00 0.00 17.79 19.64 2d6p h ALA 6 CO 0.72 0.72 -0.41 -1.14 0.00 0.00 0.00 179.25 179.14 2d6p s GLN 7 N -2.37 3.56 0.52 0.00 0.74 -1.26 -5.09 119.66 115.76 2d6p s GLN 7 Ca -0.29 -0.04 -0.21 0.00 0.05 0.00 0.00 55.36 54.87 2d6p s GLN 7 Cb 0.06 -3.15 -0.06 0.00 1.10 0.00 0.00 33.01 30.96 2d6p s GLN 7 CO 0.60 0.72 1.18 -1.12 -0.55 0.00 0.00 175.29 176.11 2d6p s SER 8 N -1.32 5.77 0.71 6.67 0.01 -1.26 -4.51 113.70 119.77 2d6p s SER 8 Ca 0.21 2.31 -0.11 0.00 1.31 0.00 0.00 55.95 59.68 2d6p s SER 8 Cb -0.13 -2.60 0.02 0.00 0.21 0.00 0.00 66.02 63.52 2d6p s SER 8 CO 0.10 -1.19 1.07 -2.16 0.41 0.00 0.00 173.24 171.47 2d6p s PRO 9 N -3.03 2.80 -0.25 12.44 0.04 -1.26 -4.88 135.00 140.86 2d6p s PRO 9 Ca 0.70 0.94 -0.18 0.00 0.04 0.00 0.00 61.00 62.50 2d6p s PRO 9 Cb -0.28 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.26 2d6p s PRO 9 CO 0.33 -1.19 0.53 0.71 0.04 0.00 0.00 177.00 177.41 2d6p s TYR 10 N -3.04 3.29 -0.19 0.56 1.51 -0.91 -4.96 117.35 113.60 2d6p s TYR 10 Ca 0.59 0.68 -0.08 0.00 -1.01 0.00 0.00 57.07 57.25 2d6p s TYR 10 Cb -0.14 -2.73 -0.04 0.00 -0.11 0.00 0.00 41.96 38.94 2d6p s TYR 10 CO 0.55 -0.26 0.08 0.42 -1.11 0.00 0.00 175.55 175.23 2d6p s ILE 11 N 2.22 4.87 -1.26 2.71 -1.09 -1.26 -1.52 121.20 125.86 2d6p s ILE 11 Ca 0.22 -0.00 -0.20 0.00 -2.23 0.00 0.00 60.65 58.44 2d6p s ILE 11 Cb -0.16 -3.21 0.01 0.00 -1.58 0.00 0.00 42.46 37.53 2d6p s ILE 11 CO 0.09 0.44 0.60 0.59 -1.23 0.00 0.00 174.94 175.44 2d6p n ASN 12 N 3.67 -3.36 -4.78 3.58 5.03 0.11 -4.89 115.26 114.61 2d6p n ASN 12 Ca -0.16 -1.15 -0.36 0.00 0.87 0.00 0.00 54.58 53.78 2d6p n ASN 12 Cb 0.52 -2.50 -0.02 0.00 -1.02 0.00 0.00 39.78 36.76 2d6p n ASN 12 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 2d6p s PRO 13 N -6.77 3.77 -0.13 3.52 0.04 -1.26 -4.98 135.00 129.20 2d6p s PRO 13 Ca 0.35 1.63 -0.28 0.00 0.04 0.00 0.00 61.00 62.74 2d6p s PRO 13 Cb -0.16 -2.31 -0.01 0.00 0.04 0.00 0.00 34.50 32.05 2d6p s PRO 13 CO 0.92 -0.50 0.94 0.42 0.04 0.00 0.00 177.00 178.82 2d6p s ILE 14 N -1.68 4.82 -0.07 0.56 1.01 -1.26 -4.52 121.20 120.06 2d6p s ILE 14 Ca 0.65 1.89 -0.26 0.00 0.00 0.00 0.00 60.65 62.93 2d6p s ILE 14 Cb -0.24 -4.25 -0.03 0.00 0.01 0.00 0.00 42.46 37.95 2d6p s ILE 14 CO 0.29 0.02 0.82 -0.63 0.00 0.00 0.00 174.94 175.45 2d6p s ILE 15 N 2.03 4.94 0.16 2.92 -1.09 -1.26 -2.82 121.20 126.08 2d6p s ILE 15 Ca 0.45 1.69 -0.30 0.00 -2.23 0.00 0.00 60.65 60.26 2d6p s ILE 15 Cb -0.18 -4.15 -0.07 0.00 -1.58 0.00 0.00 42.46 36.48 2d6p s ILE 15 CO 0.16 0.16 1.10 -2.16 -1.23 0.00 0.00 174.94 172.97 2d6p s PRO 16 N 1.24 4.58 -0.03 2.79 0.04 -1.26 -5.01 135.00 137.35 2d6p s PRO 16 Ca 0.42 1.71 0.04 0.00 0.04 0.00 0.00 61.00 63.21 2d6p s PRO 16 Cb -0.18 -3.29 -0.03 0.00 0.04 0.00 0.00 34.50 31.04 2d6p s PRO 16 CO 0.19 0.05 -0.13 0.12 0.04 0.00 0.00 177.00 177.28 2d6p s PHE 17 N -0.10 2.74 -0.04 0.56 5.36 0.69 -4.99 117.98 122.20 2d6p s PHE 17 Ca 0.50 -0.13 -0.00 0.00 -0.96 0.00 0.00 56.93 56.34 2d6p s PHE 17 Cb -0.29 -1.61 0.03 0.00 -0.34 0.00 0.00 43.02 40.81 2d6p s PHE 17 CO 0.34 0.24 0.00 0.99 -1.46 0.00 0.00 175.22 175.34 2d6p s THR 18 N -0.81 0.25 -0.01 0.12 2.01 -1.26 -1.07 115.64 114.86 2d6p s THR 18 Ca 0.13 0.11 -0.17 0.00 0.31 0.00 0.00 61.69 62.06 2d6p s THR 18 Cb -0.11 -0.37 0.03 0.00 0.01 0.00 0.00 72.50 72.07 2d6p s THR 18 CO 0.02 0.19 0.37 -0.83 -0.69 0.00 0.00 174.62 173.68 2d6p s GLY 19 N 1.39 -0.22 0.41 4.40 0.00 -0.94 -5.05 107.32 107.32 2d6p s GLY 19 Ca -0.04 0.45 -0.23 0.00 0.00 0.00 0.00 44.72 44.89 2d6p s GLY 19 CO -0.02 0.21 1.00 2.56 0.00 0.00 0.00 173.10 176.85 2d6p s PRO 20 N -1.46 4.18 -0.37 2.90 0.04 -1.26 -1.44 135.00 137.59 2d6p s PRO 20 Ca -0.12 1.35 -0.11 0.00 0.04 0.00 0.00 61.00 62.15 2d6p s PRO 20 Cb -0.04 -2.40 0.02 0.00 0.04 0.00 0.00 34.50 32.12 2d6p s PRO 20 CO 0.04 -0.10 0.21 0.42 0.04 0.00 0.00 177.00 177.62 2d6p s ILE 21 N -1.85 4.72 0.20 0.56 1.01 -0.44 -4.82 121.20 120.58 2d6p s ILE 21 Ca 0.59 -0.73 -0.32 0.00 0.00 0.00 0.00 60.65 60.19 2d6p s ILE 21 Cb -0.17 -3.59 -0.13 0.00 0.01 0.00 0.00 42.46 38.59 2d6p s ILE 21 CO 0.21 -0.19 1.64 1.67 0.00 0.00 0.00 174.94 178.28 2d6p n GLN 22 N 5.03 2.51 -0.79 2.79 7.27 -1.26 -1.33 117.38 131.60 2d6p n GLN 22 Ca -0.12 0.90 0.00 0.00 0.07 0.00 0.00 57.00 57.85 2d6p n GLN 22 Cb 0.47 -2.71 0.00 0.00 2.41 0.00 0.00 30.24 30.41 2d6p n GLN 22 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2d6p n GLY 23 N 3.52 0.61 0.62 1.69 0.00 -1.26 -4.76 105.19 105.60 2d6p n GLY 23 Ca 0.15 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.25 2d6p n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d6p n GLY 24 N -2.00 -2.15 3.57 -0.02 0.00 -0.44 -4.87 105.19 99.29 2d6p n GLY 24 Ca 0.00 -1.34 -0.40 0.00 0.00 0.00 0.00 46.02 44.28 2d6p n GLY 24 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2d6p n LEU 25 N -3.15 2.27 -4.08 0.99 4.77 -0.48 -5.00 117.00 112.32 2d6p n LEU 25 Ca -0.01 0.92 -0.10 0.00 -0.03 0.00 0.00 56.01 56.79 2d6p n LEU 25 Cb 0.29 -1.31 -0.11 0.00 -2.33 0.00 0.00 43.42 39.97 2d6p n LEU 25 CO 0.01 -1.98 -0.38 -1.10 -1.33 0.00 0.00 177.39 172.62 2d6p s GLN 26 N -2.15 0.59 0.16 3.23 -1.52 -1.26 -4.50 119.66 114.22 2d6p s GLN 26 Ca 0.67 -1.02 -0.31 0.00 -1.95 0.00 0.00 55.36 52.75 2d6p s GLN 26 Cb -0.51 -0.04 -0.10 0.00 -0.22 0.00 0.00 33.01 32.15 2d6p s GLN 26 CO 0.54 -0.04 1.54 -2.00 -0.25 0.00 0.00 175.29 175.08 2d6p s GLU 27 N -2.84 4.23 0.00 2.91 2.12 -1.26 -2.04 118.70 121.82 2d6p s GLU 27 Ca -0.00 2.32 0.00 0.00 0.36 0.00 0.00 54.97 57.65 2d6p s GLU 27 Cb -0.01 -3.16 0.00 0.00 0.26 0.00 0.00 34.13 31.22 2d6p s GLU 27 CO -0.04 -0.58 0.00 0.41 -0.54 0.00 0.00 175.26 174.51 2d6p n GLY 28 N 3.63 1.41 3.75 -1.50 0.00 0.11 -4.99 105.19 107.59 2d6p n GLY 28 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 2d6p n GLY 28 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2d6p s LEU 29 N 0.00 4.41 -0.15 0.99 2.96 -0.86 -4.20 118.68 121.83 2d6p s LEU 29 Ca 0.00 2.53 0.01 0.00 -0.22 0.00 0.00 54.13 56.46 2d6p s LEU 29 Cb 0.00 -3.62 0.01 0.00 0.50 0.00 0.00 46.19 43.08 2d6p s LEU 29 CO 0.00 -0.58 -0.19 -1.58 -1.32 0.00 0.00 176.35 172.68 2d6p s GLN 30 N -0.48 3.10 -0.30 1.98 0.74 0.25 -1.43 119.66 123.53 2d6p s GLN 30 Ca 0.56 -0.81 -0.00 0.00 0.05 0.00 0.00 55.36 55.16 2d6p s GLN 30 Cb -0.39 -2.54 0.06 0.00 1.10 0.00 0.00 33.01 31.24 2d6p s GLN 30 CO 0.42 -0.03 -0.02 0.08 -0.55 0.00 0.00 175.29 175.20 2d6p s VAL 31 N 0.88 2.78 -0.15 1.34 1.01 -0.08 -1.09 120.40 125.10 2d6p s VAL 31 Ca -0.05 -1.51 -0.03 0.00 0.00 0.00 0.00 61.98 60.39 2d6p s VAL 31 Cb -0.15 -2.64 -0.03 0.00 0.00 0.00 0.00 36.38 33.56 2d6p s VAL 31 CO -0.02 -0.13 -0.04 -0.89 0.00 0.00 0.00 175.10 174.01 2d6p s THR 32 N 1.20 3.90 -0.24 3.92 2.01 -0.80 -1.15 115.64 124.48 2d6p s THR 32 Ca -0.05 -0.36 -0.02 0.00 0.31 0.00 0.00 61.69 61.57 2d6p s THR 32 Cb -0.20 -2.70 0.02 0.00 0.01 0.00 0.00 72.50 69.63 2d6p s THR 32 CO -0.02 0.51 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.60 2d6p s LEU 33 N 0.21 3.09 -0.20 4.42 1.02 0.11 -0.57 118.68 126.76 2d6p s LEU 33 Ca -0.02 -0.73 -0.08 0.00 0.02 0.00 0.00 54.13 53.31 2d6p s LEU 33 Cb -0.14 -1.68 -0.04 0.00 0.02 0.00 0.00 46.19 44.35 2d6p s LEU 33 CO 0.03 -0.10 0.09 -1.58 0.02 0.00 0.00 176.35 174.81 2d6p s GLN 34 N 1.37 4.01 0.00 1.70 2.00 -0.69 -0.93 119.66 127.12 2d6p s GLN 34 Ca 0.02 -0.32 0.00 0.00 -2.00 0.00 0.00 55.36 53.06 2d6p s GLN 34 Cb -0.16 -3.31 0.00 0.00 0.80 0.00 0.00 33.01 30.34 2d6p s GLN 34 CO -0.04 0.21 0.00 0.41 -0.50 0.00 0.00 175.29 175.36 2d6p n GLY 35 N 3.76 0.91 2.95 2.59 0.00 -1.09 0.18 105.19 114.49 2d6p n GLY 35 Ca -0.16 -0.82 -0.16 0.00 0.00 0.00 0.00 46.02 44.87 2d6p n GLY 35 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2d6p s THR 36 N -2.28 0.41 -0.06 2.61 2.01 0.18 -0.73 115.64 117.77 2d6p s THR 36 Ca 0.00 -0.20 -0.26 0.00 0.31 0.00 0.00 61.69 61.54 2d6p s THR 36 Cb 0.00 -0.36 -0.03 0.00 0.01 0.00 0.00 72.50 72.12 2d6p s THR 36 CO 0.00 0.12 0.81 -0.89 -0.69 0.00 0.00 174.62 173.98 2d6p s THR 37 N -0.00 4.96 0.92 -0.82 2.01 -1.12 -0.87 115.64 120.72 2d6p s THR 37 Ca 0.01 1.68 -0.10 0.00 0.31 0.00 0.00 61.69 63.58 2d6p s THR 37 Cb -0.03 -4.15 0.15 0.00 0.01 0.00 0.00 72.50 68.47 2d6p s THR 37 CO -0.00 0.18 1.13 -0.54 -0.69 0.00 0.00 174.62 174.70 2d6p s LYS 38 N 1.11 1.00 0.45 4.92 1.02 -0.93 -0.61 119.74 126.70 2d6p s LYS 38 Ca 0.42 1.42 0.25 0.00 0.02 0.00 0.00 55.97 58.08 2d6p s LYS 38 Cb -0.19 -1.74 0.98 0.00 -0.52 0.00 0.00 37.83 36.37 2d6p s LYS 38 CO 0.20 -2.60 1.85 0.77 -0.92 0.00 0.00 175.35 174.66 2d6p h SER 39 N -1.84 0.00 0.00 2.83 0.02 -1.91 -2.35 113.55 110.30 2d6p h SER 39 Ca -0.45 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.47 2d6p h SER 39 Cb 1.27 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.75 2d6p h SER 39 CO 0.44 0.20 -0.52 0.49 -1.14 0.00 0.00 176.83 176.30 2d6p n PHE 40 N -3.39 0.00 -1.65 3.45 3.01 -1.26 -4.57 117.46 113.05 2d6p n PHE 40 Ca 0.00 -1.24 -0.47 0.00 1.01 0.00 0.00 57.45 56.75 2d6p n PHE 40 Cb 0.41 -0.22 -0.04 0.00 -0.01 0.00 0.00 39.48 39.62 2d6p n PHE 40 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2d6p n ALA 41 N -0.88 0.65 -0.13 4.37 0.00 -1.09 -4.91 120.51 118.51 2d6p n ALA 41 Ca 0.16 0.45 -0.27 0.00 0.00 0.00 0.00 53.44 53.78 2d6p n ALA 41 Cb 0.76 -2.24 -0.10 0.00 0.00 0.00 0.00 19.45 17.86 2d6p n ALA 41 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2d6p n GLN 42 N 2.61 0.58 -3.82 0.00 1.13 -1.26 -4.71 117.38 111.91 2d6p n GLN 42 Ca 0.15 0.24 -0.11 0.00 -1.94 0.00 0.00 57.00 55.34 2d6p n GLN 42 Cb 0.28 -1.46 -0.08 0.00 0.11 0.00 0.00 30.24 29.09 2d6p n GLN 42 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 2d6p s ARG 43 N -2.49 0.74 0.16 -1.09 0.52 -1.26 -0.24 118.95 115.28 2d6p s ARG 43 Ca -0.37 -0.62 -0.06 0.00 -0.52 0.00 0.00 55.73 54.16 2d6p s ARG 43 Cb 0.14 0.31 -0.02 0.00 0.52 0.00 0.00 34.95 35.89 2d6p s ARG 43 CO 0.49 -0.22 0.20 -0.59 0.02 0.00 0.00 175.30 175.19 2d6p s PHE 44 N -2.66 0.62 -0.04 -0.53 -0.12 -1.20 -0.28 117.98 113.77 2d6p s PHE 44 Ca -0.04 -0.97 0.01 0.00 -0.05 0.00 0.00 56.93 55.87 2d6p s PHE 44 Cb -0.01 -0.24 0.02 0.00 -0.63 0.00 0.00 43.02 42.17 2d6p s PHE 44 CO -0.04 -0.65 -0.04 0.08 -0.05 0.00 0.00 175.22 174.52 2d6p s VAL 45 N -4.01 0.50 -0.18 -2.49 1.01 0.34 -3.44 120.40 112.12 2d6p s VAL 45 Ca 0.21 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.09 2d6p s VAL 45 Cb 0.05 -0.52 0.01 0.00 0.00 0.00 0.00 36.38 35.92 2d6p s VAL 45 CO 0.02 0.21 -0.17 -0.69 0.00 0.00 0.00 175.10 174.46 2d6p s VAL 46 N 0.86 2.31 -0.09 2.92 1.01 -0.24 -1.47 120.40 125.68 2d6p s VAL 46 Ca -0.11 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.04 2d6p s VAL 46 Cb -0.14 -1.98 -0.01 0.00 0.00 0.00 0.00 36.38 34.25 2d6p s VAL 46 CO 0.00 0.52 -0.22 0.20 0.00 0.00 0.00 175.10 175.60 2d6p s ASN 47 N 1.23 3.29 -0.21 3.32 0.02 0.72 -0.42 114.94 122.89 2d6p s ASN 47 Ca 0.03 -0.49 -0.07 0.00 -1.02 0.00 0.00 52.86 51.31 2d6p s ASN 47 Cb -0.14 -1.26 -0.03 0.00 0.02 0.00 0.00 41.25 39.84 2d6p s ASN 47 CO -0.09 0.19 0.05 -0.36 0.02 0.00 0.00 177.10 176.91 2d6p s PHE 48 N 0.15 3.13 0.00 2.20 0.08 -0.42 -0.75 117.98 122.37 2d6p s PHE 48 Ca -0.12 -0.24 0.00 0.00 0.12 0.00 0.00 56.93 56.70 2d6p s PHE 48 Cb -0.16 -2.14 0.00 0.00 -0.57 0.00 0.00 43.02 40.15 2d6p s PHE 48 CO 0.07 -0.14 0.00 0.00 -0.10 0.00 0.00 175.22 175.05 2d6p n GLN 49 N 4.25 0.00 0.05 0.44 10.64 -0.24 -0.54 117.38 131.97 2d6p n GLN 49 Ca -0.16 0.00 -0.02 0.00 -1.83 0.00 0.00 57.00 54.99 2d6p n GLN 49 Cb 0.52 0.00 -0.01 0.00 -0.86 0.00 0.00 30.24 29.89 2d6p n GLN 49 CO 0.00 0.00 0.00 0.78 -1.83 0.00 0.00 177.06 176.01 2d6p h GLY 54 N 0.00 -0.13 -3.52 2.61 0.00 -2.04 -2.55 103.07 97.44 2d6p h GLY 54 Ca 0.00 0.05 -0.41 0.00 0.00 0.00 0.00 47.33 46.97 2d6p h GLY 54 CO 0.00 -0.05 0.53 1.16 0.00 0.00 0.00 176.54 178.18 2d6p n ASN 55 N -2.36 5.17 -4.01 0.19 0.23 -1.26 -4.84 115.26 108.37 2d6p n ASN 55 Ca -0.01 -3.23 -0.31 0.00 -0.53 0.00 0.00 54.58 50.50 2d6p n ASN 55 Cb 0.05 -0.87 -0.15 0.00 -2.08 0.00 0.00 39.78 36.72 2d6p n ASN 55 CO 0.00 0.00 0.00 -1.81 -0.93 0.00 0.00 177.26 174.52 2d6p s ASP 56 N -0.60 4.40 -0.45 0.53 -0.00 -1.26 -4.19 116.67 115.09 2d6p s ASP 56 Ca 0.42 -1.59 -0.19 0.00 -0.00 0.00 0.00 52.55 51.19 2d6p s ASP 56 Cb 0.34 -1.46 0.04 0.00 -0.00 0.00 0.00 42.92 41.83 2d6p s ASP 56 CO 0.04 -0.27 0.54 -0.63 -0.00 0.00 0.00 175.17 174.85 2d6p s ILE 57 N 1.13 4.97 0.17 0.77 1.01 -0.64 -4.53 121.20 124.09 2d6p s ILE 57 Ca -0.02 -0.31 -0.12 0.00 0.00 0.00 0.00 60.65 60.20 2d6p s ILE 57 Cb -0.19 -4.16 0.08 0.00 0.01 0.00 0.00 42.46 38.19 2d6p s ILE 57 CO -0.07 -0.59 1.75 0.00 0.00 0.00 0.00 174.94 176.04 2d6p h ALA 58 N 8.84 0.77 -3.09 9.38 0.00 -1.04 0.27 119.26 134.40 2d6p h ALA 58 Ca -0.27 -0.14 -0.30 0.00 0.00 0.00 0.00 54.91 54.20 2d6p h ALA 58 Cb 1.10 -0.24 -0.36 0.00 0.00 0.00 0.00 17.79 18.30 2d6p h ALA 58 CO 0.87 0.34 -0.65 0.12 0.00 0.00 0.00 179.25 179.94 2d6p s PHE 59 N -5.67 -0.16 -0.27 0.00 5.36 -1.02 -4.55 117.98 111.67 2d6p s PHE 59 Ca -0.13 0.56 -0.05 0.00 -0.96 0.00 0.00 56.93 56.35 2d6p s PHE 59 Cb 0.13 -0.29 0.01 0.00 -0.34 0.00 0.00 43.02 42.53 2d6p s PHE 59 CO 0.79 -0.28 0.03 -1.58 -1.46 0.00 0.00 175.22 172.72 2d6p s HIS 60 N 2.28 3.10 -0.34 10.12 5.65 0.56 -1.30 115.29 135.37 2d6p s HIS 60 Ca 0.03 -1.05 -0.06 0.00 0.25 0.00 0.00 55.06 54.23 2d6p s HIS 60 Cb -0.12 -2.19 0.04 0.00 -1.18 0.00 0.00 32.58 29.13 2d6p s HIS 60 CO -0.06 -0.59 0.11 0.12 -0.65 0.00 0.00 174.74 173.68 2d6p s PHE 61 N 1.47 3.27 -0.40 3.88 5.36 0.44 -1.85 117.98 130.14 2d6p s PHE 61 Ca 0.03 -1.45 0.01 0.00 -0.96 0.00 0.00 56.93 54.56 2d6p s PHE 61 Cb -0.17 -2.33 0.14 0.00 -0.34 0.00 0.00 43.02 40.32 2d6p s PHE 61 CO 0.00 -0.74 0.22 1.21 -1.46 0.00 0.00 175.22 174.46 2d6p s ASN 62 N 1.45 3.36 0.42 6.13 2.47 0.07 -1.08 114.94 127.75 2d6p s ASN 62 Ca -0.01 -2.42 -0.25 0.00 0.42 0.00 0.00 52.86 50.60 2d6p s ASN 62 Cb -0.20 -0.76 -0.08 0.00 -1.45 0.00 0.00 41.25 38.77 2d6p s ASN 62 CO 0.03 -0.29 1.25 -2.84 -3.72 0.00 0.00 177.10 171.52 2d6p s PRO 63 N 0.68 3.91 -0.06 0.43 0.02 -1.22 -0.29 135.00 138.47 2d6p s PRO 63 Ca 0.18 2.01 -0.02 0.00 0.02 0.00 0.00 61.00 63.18 2d6p s PRO 63 Cb -0.24 -2.65 0.03 0.00 0.02 0.00 0.00 34.50 31.66 2d6p s PRO 63 CO 0.01 -0.49 0.06 1.03 -0.33 0.00 0.00 177.00 177.27 2d6p s ARG 64 N -2.36 0.05 -1.20 5.54 0.52 0.11 -3.23 118.95 118.37 2d6p s ARG 64 Ca 0.59 0.27 -0.06 0.00 -0.52 0.00 0.00 55.73 56.00 2d6p s ARG 64 Cb -0.35 -0.78 0.03 0.00 0.52 0.00 0.00 34.95 34.38 2d6p s ARG 64 CO 0.44 -0.38 2.68 1.19 0.02 0.00 0.00 175.30 179.25 2d6p n PHE 65 N 5.27 2.24 -4.05 -0.53 3.72 0.67 -1.98 117.46 122.80 2d6p n PHE 65 Ca -0.04 -2.69 -0.09 0.00 -0.05 0.00 0.00 57.45 54.58 2d6p n PHE 65 Cb 0.50 -1.94 -0.11 0.00 -0.94 0.00 0.00 39.48 36.99 2d6p n PHE 65 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 2d6p s GLU 66 N -0.17 0.49 -1.37 -1.08 2.02 -1.26 -4.85 118.70 112.47 2d6p s GLU 66 Ca 0.60 -0.92 -0.10 0.00 0.02 0.00 0.00 54.97 54.57 2d6p s GLU 66 Cb 0.22 0.09 0.07 0.00 0.10 0.00 0.00 34.13 34.61 2d6p s GLU 66 CO -0.10 -0.06 0.58 0.39 0.02 0.00 0.00 175.26 176.09 2d6p n GLU 67 N 0.87 -3.82 0.00 1.61 1.02 -1.26 -0.54 120.64 118.52 2d6p n GLU 67 Ca -0.19 0.54 0.00 0.00 -0.02 0.00 0.00 57.16 57.49 2d6p n GLU 67 Cb 0.58 -5.29 0.00 0.00 -0.02 0.00 0.00 31.44 26.71 2d6p n GLU 67 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2d6p n GLY 68 N -1.29 2.02 0.15 0.62 0.00 -1.26 -4.85 105.19 100.58 2d6p n GLY 68 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2d6p n GLY 68 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d6p n GLY 69 N -1.49 0.24 3.58 -0.02 0.00 0.29 -4.75 105.19 103.05 2d6p n GLY 69 Ca 0.00 -1.00 -0.09 0.00 0.00 0.00 0.00 46.02 44.93 2d6p n GLY 69 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2d6p s TYR 70 N 0.00 0.33 -0.08 1.61 -0.85 -0.84 -3.01 117.35 114.51 2d6p s TYR 70 Ca 0.00 -0.69 0.03 0.00 -0.52 0.00 0.00 57.07 55.89 2d6p s TYR 70 Cb 0.00 0.20 0.01 0.00 0.38 0.00 0.00 41.96 42.55 2d6p s TYR 70 CO 0.00 -0.99 -0.16 0.08 -1.52 0.00 0.00 175.55 172.96 2d6p s VAL 71 N -4.01 1.46 -0.13 -3.49 1.01 -0.73 0.04 120.40 114.54 2d6p s VAL 71 Ca 0.21 -0.67 -0.19 0.00 0.00 0.00 0.00 61.98 61.34 2d6p s VAL 71 Cb -0.01 -1.30 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 2d6p s VAL 71 CO 0.08 0.43 0.50 -0.69 0.00 0.00 0.00 175.10 175.42 2d6p s VAL 72 N 0.57 5.16 -0.10 2.92 1.01 0.60 -1.77 120.40 128.79 2d6p s VAL 72 Ca -0.16 0.99 0.01 0.00 0.00 0.00 0.00 61.98 62.82 2d6p s VAL 72 Cb -0.16 -3.84 -0.02 0.00 0.00 0.00 0.00 36.38 32.36 2d6p s VAL 72 CO 0.05 0.29 -0.12 0.00 0.00 0.00 0.00 175.10 175.32 2d6p s ASN 74 N -0.09 -0.01 -0.03 0.00 3.84 -0.77 -1.44 114.94 116.43 2d6p s ASN 74 Ca -0.01 -1.08 0.01 0.00 0.21 0.00 0.00 52.86 51.98 2d6p s ASN 74 Cb -0.14 0.83 0.02 0.00 -0.55 0.00 0.00 41.25 41.42 2d6p s ASN 74 CO 0.03 -1.64 -0.01 -0.89 -2.79 0.00 0.00 177.10 171.81 2d6p s THR 75 N -2.53 0.20 -0.25 -5.21 2.01 -1.26 -0.32 115.64 108.28 2d6p s THR 75 Ca 0.15 0.05 -0.08 0.00 0.31 0.00 0.00 61.69 62.12 2d6p s THR 75 Cb -0.05 -0.28 -0.03 0.00 0.01 0.00 0.00 72.50 72.15 2d6p s THR 75 CO 0.11 0.14 0.10 -0.75 -0.69 0.00 0.00 174.62 173.53 2d6p s LYS 76 N 0.87 3.75 -0.12 4.92 2.20 0.96 -1.43 119.74 130.89 2d6p s LYS 76 Ca -0.09 -0.43 0.01 0.00 -0.36 0.00 0.00 55.97 55.10 2d6p s LYS 76 Cb -0.12 -3.39 0.02 0.00 -1.51 0.00 0.00 37.83 32.82 2d6p s LYS 76 CO -0.01 -0.15 -0.13 -0.65 -0.36 0.00 0.00 175.35 174.04 2d6p s GLN 77 N 1.54 2.09 -1.42 4.03 -0.21 -0.29 -1.62 119.66 123.79 2d6p s GLN 77 Ca 0.06 -0.50 -0.06 0.00 0.02 0.00 0.00 55.36 54.88 2d6p s GLN 77 Cb -0.15 -1.87 0.04 0.00 1.00 0.00 0.00 33.01 32.03 2d6p s GLN 77 CO 0.05 -0.15 0.80 0.09 -2.12 0.00 0.00 175.29 173.97 2d6p n ASN 78 N 4.48 -2.69 -0.44 5.90 5.03 -1.26 -0.95 115.26 125.34 2d6p n ASN 78 Ca -0.18 -0.82 -0.06 0.00 0.87 0.00 0.00 54.58 54.40 2d6p n ASN 78 Cb 0.51 -3.89 -0.02 0.00 -1.02 0.00 0.00 39.78 35.35 2d6p n ASN 78 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2d6p n GLY 79 N -1.66 0.76 3.19 7.41 0.00 -1.26 -5.00 105.19 108.63 2d6p n GLY 79 Ca -0.15 -0.28 -0.32 0.00 0.00 0.00 0.00 46.02 45.27 2d6p n GLY 79 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2d6p s GLN 80 N -2.03 3.04 0.07 1.61 -1.52 -0.12 -5.11 119.66 115.61 2d6p s GLN 80 Ca 0.00 -0.85 -0.30 0.00 -1.95 0.00 0.00 55.36 52.26 2d6p s GLN 80 Cb 0.00 -2.43 -0.05 0.00 -0.22 0.00 0.00 33.01 30.31 2d6p s GLN 80 CO 0.00 0.03 1.05 -1.58 -0.25 0.00 0.00 175.29 174.54 2d6p s TRP 81 N 0.72 3.63 0.17 0.91 0.52 -1.26 -1.14 118.94 122.49 2d6p s TRP 81 Ca -0.09 1.61 -0.03 0.00 0.02 0.00 0.00 56.10 57.61 2d6p s TRP 81 Cb -0.16 -3.20 0.04 0.00 -1.15 0.00 0.00 33.47 29.00 2d6p s TRP 81 CO 0.00 -0.37 0.18 0.41 0.02 0.00 0.00 176.95 177.19 2d6p n GLY 82 N 2.68 -1.94 3.77 0.98 0.00 -0.52 -5.00 105.19 105.16 2d6p n GLY 82 Ca 0.05 -1.55 -0.39 0.00 0.00 0.00 0.00 46.02 44.14 2d6p n GLY 82 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d6p s PRO 83 N -3.40 4.05 0.21 1.61 0.04 -1.26 -4.86 135.00 131.39 2d6p s PRO 83 Ca 0.11 1.97 -0.22 0.00 0.04 0.00 0.00 61.00 62.91 2d6p s PRO 83 Cb -0.01 -2.74 -0.08 0.00 0.04 0.00 0.00 34.50 31.71 2d6p s PRO 83 CO 0.08 -0.36 0.75 -1.21 0.04 0.00 0.00 177.00 176.30 2d6p s GLU 84 N -2.22 4.36 -0.45 4.56 2.02 -1.26 -4.77 118.70 120.94 2d6p s GLU 84 Ca 0.56 0.98 -0.08 0.00 0.02 0.00 0.00 54.97 56.46 2d6p s GLU 84 Cb -0.34 -2.99 0.11 0.00 0.10 0.00 0.00 34.13 31.01 2d6p s GLU 84 CO 0.43 0.45 0.30 -1.21 0.02 0.00 0.00 175.26 175.24 2d6p s GLU 85 N -1.71 2.41 -0.25 1.61 2.02 -0.52 -5.00 118.70 117.25 2d6p s GLU 85 Ca 0.41 -1.71 -0.12 0.00 0.02 0.00 0.00 54.97 53.57 2d6p s GLU 85 Cb -0.19 -3.82 -0.05 0.00 0.10 0.00 0.00 34.13 30.18 2d6p s GLU 85 CO 0.23 -1.11 0.25 1.03 0.02 0.00 0.00 175.26 175.67 2d6p s ARG 86 N 1.33 4.03 -0.35 1.61 0.52 -1.26 -1.73 118.95 123.10 2d6p s ARG 86 Ca 0.05 -0.16 -0.19 0.00 -0.52 0.00 0.00 55.73 54.92 2d6p s ARG 86 Cb -0.25 -3.60 -0.00 0.00 0.52 0.00 0.00 34.95 31.62 2d6p s ARG 86 CO -0.01 -0.11 0.54 0.21 0.02 0.00 0.00 175.30 175.95 2d6p s LYS 87 N 1.55 3.62 -1.07 3.54 2.47 -0.73 -4.97 119.74 124.15 2d6p s LYS 87 Ca 0.10 -0.13 -0.08 0.00 -1.56 0.00 0.00 55.97 54.30 2d6p s LYS 87 Cb -0.15 -3.81 -0.09 0.00 -1.46 0.00 0.00 37.83 32.31 2d6p s LYS 87 CO 0.08 -0.67 3.04 -1.33 0.16 0.00 0.00 175.35 176.63 2d6p n MET 88 N 5.80 3.30 -3.63 4.03 2.81 -1.26 -1.77 117.12 126.40 2d6p n MET 88 Ca -0.04 -2.09 -0.11 0.00 -1.81 0.00 0.00 57.70 53.65 2d6p n MET 88 Cb 0.49 -2.52 -0.07 0.00 -0.71 0.00 0.00 33.22 30.41 2d6p n MET 88 CO 0.00 0.00 0.00 -1.14 1.51 0.00 0.00 175.97 176.34 2d6p s GLN 89 N 1.07 0.78 -0.40 0.03 0.74 -1.16 -4.88 119.66 115.84 2d6p s GLN 89 Ca 0.66 1.09 -0.13 0.00 0.05 0.00 0.00 55.36 57.02 2d6p s GLN 89 Cb 0.23 0.30 0.03 0.00 1.10 0.00 0.00 33.01 34.67 2d6p s GLN 89 CO -0.06 -0.12 0.26 1.41 -0.55 0.00 0.00 175.29 176.23 2d6p s MET 90 N 0.89 2.88 0.00 1.67 -2.45 -1.20 -4.20 119.30 116.90 2d6p s MET 90 Ca -0.04 -1.09 0.26 0.00 -1.25 0.00 0.00 55.69 53.57 2d6p s MET 90 Cb -0.05 -3.87 0.68 0.00 1.25 0.00 0.00 34.83 32.84 2d6p s MET 90 CO -0.08 -0.75 1.53 -0.35 1.05 0.00 0.00 175.02 176.42 2d6p n PRO 91 N 5.08 0.21 -3.21 4.11 -0.04 -1.26 -4.89 135.00 135.00 2d6p n PRO 91 Ca -0.11 -0.11 -0.18 0.00 -0.04 0.00 0.00 63.50 63.05 2d6p n PRO 91 Cb 0.46 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.43 2d6p n PRO 91 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2d6p s PHE 92 N -2.86 2.98 -0.03 0.54 0.08 -1.26 -4.97 117.98 112.45 2d6p s PHE 92 Ca 0.15 -0.26 -0.02 0.00 0.12 0.00 0.00 56.93 56.93 2d6p s PHE 92 Cb 0.18 -2.21 0.02 0.00 -0.57 0.00 0.00 43.02 40.44 2d6p s PHE 92 CO 0.63 -0.24 0.07 -0.65 -0.10 0.00 0.00 175.22 174.93 2d6p s GLN 93 N -4.30 0.04 0.04 0.44 -0.21 -1.26 -5.11 119.66 109.31 2d6p s GLN 93 Ca 0.50 0.19 -0.34 0.00 0.02 0.00 0.00 55.36 55.73 2d6p s GLN 93 Cb -0.10 -0.11 -0.13 0.00 1.00 0.00 0.00 33.01 33.67 2d6p s GLN 93 CO 0.33 -0.10 1.69 1.63 -2.12 0.00 0.00 175.29 176.71 2d6p n LYS 94 N 3.71 2.06 0.00 2.91 5.02 -1.26 -1.32 118.16 129.28 2d6p n LYS 94 Ca -0.21 0.75 0.00 0.00 -2.02 0.00 0.00 58.31 56.83 2d6p n LYS 94 Cb 0.55 -2.54 0.00 0.00 -0.02 0.00 0.00 35.03 33.02 2d6p n LYS 94 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2d6p n GLY 95 N 3.78 2.61 3.87 0.72 0.00 0.22 -4.83 105.19 111.55 2d6p n GLY 95 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 2d6p n GLY 95 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2d6p s MET 96 N -0.43 3.59 0.77 1.61 -1.94 -0.43 -4.75 119.30 117.72 2d6p s MET 96 Ca 0.00 0.03 -0.13 0.00 -1.71 0.00 0.00 55.69 53.89 2d6p s MET 96 Cb 0.00 -3.20 0.06 0.00 2.01 0.00 0.00 34.83 33.70 2d6p s MET 96 CO 0.00 0.75 1.15 -1.25 -0.01 0.00 0.00 175.02 175.66 2d6p s PRO 97 N -1.04 2.00 0.04 2.03 0.04 -1.26 -2.81 135.00 134.01 2d6p s PRO 97 Ca 0.18 1.50 -0.07 0.00 0.04 0.00 0.00 61.00 62.64 2d6p s PRO 97 Cb -0.13 -1.84 -0.00 0.00 0.04 0.00 0.00 34.50 32.56 2d6p s PRO 97 CO 0.07 -1.89 0.15 -0.59 0.04 0.00 0.00 177.00 174.78 2d6p s PHE 98 N -2.43 0.14 -0.15 0.56 -0.12 0.09 -4.93 117.98 111.14 2d6p s PHE 98 Ca 0.68 -0.42 0.00 0.00 -0.05 0.00 0.00 56.93 57.14 2d6p s PHE 98 Cb -0.23 -0.09 -0.01 0.00 -0.63 0.00 0.00 43.02 42.07 2d6p s PHE 98 CO 0.50 -0.41 -0.15 -2.00 -0.05 0.00 0.00 175.22 173.11 2d6p s GLU 99 N -2.73 3.26 -0.17 1.99 2.12 -1.26 -2.68 118.70 119.22 2d6p s GLU 99 Ca -0.04 -0.73 0.01 0.00 0.36 0.00 0.00 54.97 54.57 2d6p s GLU 99 Cb -0.00 -2.63 0.02 0.00 0.26 0.00 0.00 34.13 31.78 2d6p s GLU 99 CO -0.05 0.06 -0.18 -1.17 -0.54 0.00 0.00 175.26 173.39 2d6p s LEU 100 N 0.70 2.01 -0.14 2.70 2.96 -0.11 0.57 118.68 127.38 2d6p s LEU 100 Ca -0.07 -0.62 0.02 0.00 -0.22 0.00 0.00 54.13 53.24 2d6p s LEU 100 Cb -0.16 -1.37 0.01 0.00 0.50 0.00 0.00 46.19 45.17 2d6p s LEU 100 CO 0.02 -0.03 -0.20 0.00 -1.32 0.00 0.00 176.35 174.82 2d6p s PHE 102 N 0.91 3.07 -0.21 0.00 0.08 -0.30 -0.34 117.98 121.19 2d6p s PHE 102 Ca -0.06 -0.45 -0.04 0.00 0.12 0.00 0.00 56.93 56.50 2d6p s PHE 102 Cb -0.15 -2.16 -0.02 0.00 -0.57 0.00 0.00 43.02 40.12 2d6p s PHE 102 CO -0.03 -0.30 -0.03 -1.17 -0.10 0.00 0.00 175.22 173.59 2d6p s LEU 103 N 1.31 3.06 -0.51 -0.37 2.96 0.43 -0.91 118.68 124.64 2d6p s LEU 103 Ca 0.04 -0.30 -0.24 0.00 -0.22 0.00 0.00 54.13 53.42 2d6p s LEU 103 Cb -0.15 -1.77 0.04 0.00 0.50 0.00 0.00 46.19 44.81 2d6p s LEU 103 CO 0.02 0.03 0.90 -0.69 -1.32 0.00 0.00 176.35 175.29 2d6p s VAL 104 N 1.19 4.47 0.46 1.68 1.01 -0.51 -0.32 120.40 128.38 2d6p s VAL 104 Ca 0.03 0.37 0.07 0.00 0.00 0.00 0.00 61.98 62.45 2d6p s VAL 104 Cb -0.14 -4.47 0.01 0.00 0.00 0.00 0.00 36.38 31.77 2d6p s VAL 104 CO -0.00 -0.98 0.45 -1.10 0.00 0.00 0.00 175.10 173.47 2d6p s GLN 105 N 3.75 2.46 0.22 2.72 -0.21 0.05 0.08 119.66 128.74 2d6p s GLN 105 Ca 0.31 -1.64 -0.07 0.00 0.02 0.00 0.00 55.36 53.98 2d6p s GLN 105 Cb -0.12 -2.37 0.33 0.00 1.00 0.00 0.00 33.01 31.85 2d6p s GLN 105 CO 0.21 -0.38 1.77 -0.09 -2.12 0.00 0.00 175.29 174.69 2d6p h ARG 106 N 0.84 0.56 0.00 2.91 2.43 -1.98 -3.21 114.38 115.93 2d6p h ARG 106 Ca -0.39 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.75 2d6p h ARG 106 Cb 1.28 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.70 2d6p h ARG 106 CO 0.55 0.37 0.00 -1.13 -1.51 0.00 0.00 179.97 178.24 2d6p n SER 107 N -4.88 1.24 -3.54 -3.80 3.41 -1.26 -4.99 113.62 99.80 2d6p n SER 107 Ca 0.11 -1.49 -0.12 0.00 -0.26 0.00 0.00 58.87 57.11 2d6p n SER 107 Cb 0.28 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.19 2d6p n SER 107 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 2d6p s GLU 108 N -0.49 1.14 0.05 4.33 1.03 -1.21 -2.13 118.70 121.41 2d6p s GLU 108 Ca 0.00 -0.51 -0.25 0.00 0.03 0.00 0.00 54.97 54.24 2d6p s GLU 108 Cb 0.00 0.51 -0.05 0.00 -0.80 0.00 0.00 34.13 33.79 2d6p s GLU 108 CO 0.00 -0.46 0.78 -0.06 -1.33 0.00 0.00 175.26 174.19 2d6p s PHE 109 N -3.45 3.74 -0.23 4.83 0.08 -0.39 -0.77 117.98 121.78 2d6p s PHE 109 Ca 0.00 1.50 -0.10 0.00 0.12 0.00 0.00 56.93 58.45 2d6p s PHE 109 Cb 0.00 -2.84 -0.05 0.00 -0.57 0.00 0.00 43.02 39.56 2d6p s PHE 109 CO -0.10 0.26 0.15 0.15 -0.10 0.00 0.00 175.22 175.58 2d6p s LYS 110 N -0.03 4.08 -0.22 0.44 1.02 0.57 -1.91 119.74 123.69 2d6p s LYS 110 Ca 0.39 -0.27 -0.06 0.00 0.02 0.00 0.00 55.97 56.05 2d6p s LYS 110 Cb -0.21 -3.49 -0.03 0.00 -0.52 0.00 0.00 37.83 33.59 2d6p s LYS 110 CO 0.23 0.12 0.04 0.08 -0.92 0.00 0.00 175.35 174.90 2d6p s VAL 111 N 0.89 4.18 -0.08 3.17 1.01 0.15 -0.43 120.40 129.28 2d6p s VAL 111 Ca 0.07 -0.23 0.02 0.00 0.00 0.00 0.00 61.98 61.85 2d6p s VAL 111 Cb -0.13 -2.92 -0.02 0.00 0.00 0.00 0.00 36.38 33.31 2d6p s VAL 111 CO 0.03 0.39 -0.15 -0.04 0.00 0.00 0.00 175.10 175.33 2d6p s MET 112 N 1.24 2.86 -0.14 2.72 1.00 0.54 0.06 119.30 127.58 2d6p s MET 112 Ca 0.04 -0.72 0.01 0.00 0.00 0.00 0.00 55.69 55.02 2d6p s MET 112 Cb -0.15 -2.45 0.02 0.00 0.00 0.00 0.00 34.83 32.26 2d6p s MET 112 CO 0.02 0.43 -0.15 0.08 0.00 0.00 0.00 175.02 175.41 2d6p s VAL 113 N -0.23 1.57 -1.30 -6.03 1.01 -0.39 0.22 120.40 115.25 2d6p s VAL 113 Ca 0.00 -0.64 -0.01 0.00 0.00 0.00 0.00 61.98 61.33 2d6p s VAL 113 Cb -0.13 -1.46 -0.00 0.00 0.00 0.00 0.00 36.38 34.78 2d6p s VAL 113 CO 0.03 0.46 0.69 0.59 0.00 0.00 0.00 175.10 176.87 2d6p n ASN 114 N 4.64 -1.43 0.00 3.32 3.02 0.19 -2.48 115.26 122.53 2d6p n ASN 114 Ca -0.17 -0.84 0.00 0.00 -0.03 0.00 0.00 54.58 53.54 2d6p n ASN 114 Cb 0.50 -4.01 0.00 0.00 -0.61 0.00 0.00 39.78 35.66 2d6p n ASN 114 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2d6p n LYS 115 N -4.24 -1.54 -5.02 3.52 5.02 -1.26 -4.98 118.16 109.65 2d6p n LYS 115 Ca -0.29 0.38 -0.29 0.00 -2.02 0.00 0.00 58.31 56.10 2d6p n LYS 115 Cb 0.67 -4.54 -0.16 0.00 -0.02 0.00 0.00 35.03 30.98 2d6p n LYS 115 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2d6p s LYS 116 N -1.54 2.28 0.23 1.97 1.02 -1.03 -5.11 119.74 117.56 2d6p s LYS 116 Ca 0.00 -0.74 -0.31 0.00 0.02 0.00 0.00 55.97 54.94 2d6p s LYS 116 Cb 0.00 -1.88 -0.14 0.00 -0.52 0.00 0.00 37.83 35.28 2d6p s LYS 116 CO 0.00 0.25 1.22 0.34 -0.92 0.00 0.00 175.35 176.23 2d6p n PHE 117 N 3.24 1.64 -0.00 3.18 7.35 -1.26 -1.26 117.46 130.34 2d6p n PHE 117 Ca -0.19 0.60 -0.00 0.00 -0.76 0.00 0.00 57.45 57.10 2d6p n PHE 117 Cb 0.52 -2.34 -0.00 0.00 0.35 0.00 0.00 39.48 38.01 2d6p n PHE 117 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 2d6p n PHE 118 N 1.26 0.00 -3.46 -5.13 7.35 0.11 -4.81 117.46 112.78 2d6p n PHE 118 Ca 0.12 0.00 -0.14 0.00 -0.76 0.00 0.00 57.45 56.67 2d6p n PHE 118 Cb 0.29 -0.01 -0.04 0.00 0.35 0.00 0.00 39.48 40.07 2d6p n PHE 118 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2d6p s VAL 119 N -2.01 0.00 0.21 -2.13 0.11 -1.05 -5.03 120.40 110.51 2d6p s VAL 119 Ca -0.00 -0.00 0.11 0.00 -2.93 0.00 0.00 61.98 59.16 2d6p s VAL 119 Cb 0.00 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.81 2d6p s VAL 119 CO 0.01 -0.00 -0.22 0.00 -3.33 0.00 0.00 175.10 171.55 2d6p s GLN 120 N -2.72 1.58 -0.15 1.54 -2.07 -1.26 0.29 119.66 116.87 2d6p s GLN 120 Ca -0.04 -1.55 -0.04 0.00 -1.82 0.00 0.00 55.36 51.91 2d6p s GLN 120 Cb -0.01 -1.86 0.06 0.00 -1.09 0.00 0.00 33.01 30.12 2d6p s GLN 120 CO -0.04 0.39 0.11 -0.47 -1.32 0.00 0.00 175.29 173.97 2d6p s TYR 121 N -1.81 0.06 0.34 9.60 5.04 -0.80 -4.98 117.35 124.80 2d6p s TYR 121 Ca 0.23 -0.07 -0.27 0.00 -2.44 0.00 0.00 57.07 54.52 2d6p s TYR 121 Cb -0.07 -0.57 -0.09 0.00 0.35 0.00 0.00 41.96 41.57 2d6p s TYR 121 CO 0.11 -0.46 1.07 1.14 -1.34 0.00 0.00 175.55 176.07 2d6p s GLN 122 N 2.19 4.41 0.17 4.97 -2.07 -1.26 -1.27 119.66 126.79 2d6p s GLN 122 Ca 0.03 1.65 -0.32 0.00 -1.82 0.00 0.00 55.36 54.90 2d6p s GLN 122 Cb -0.15 -2.87 -0.11 0.00 -1.09 0.00 0.00 33.01 28.79 2d6p s GLN 122 CO -0.08 0.04 1.78 -1.01 -1.32 0.00 0.00 175.29 174.70 2d6p s HIS 123 N -1.41 2.55 -0.16 9.60 3.76 -0.91 -4.90 115.29 123.83 2d6p s HIS 123 Ca 0.51 0.17 0.09 0.00 -0.15 0.00 0.00 55.06 55.68 2d6p s HIS 123 Cb -0.27 -4.16 -0.23 0.00 1.11 0.00 0.00 32.58 29.03 2d6p s HIS 123 CO 0.34 -4.59 0.22 0.54 -0.85 0.00 0.00 174.74 170.39 2d6p n ARG 124 N 4.77 0.68 -4.38 1.40 1.74 -1.26 -4.92 116.66 114.69 2d6p n ARG 124 Ca 0.17 0.15 -0.23 0.00 -0.77 0.00 0.00 57.85 57.16 2d6p n ARG 124 Cb 0.36 -1.62 -0.11 0.00 -1.02 0.00 0.00 32.46 30.07 2d6p n ARG 124 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2d6p s VAL 125 N -2.54 2.06 0.67 1.55 -7.23 -1.26 -5.13 120.40 108.53 2d6p s VAL 125 Ca -0.16 -2.02 -0.16 0.00 -1.81 0.00 0.00 61.98 57.83 2d6p s VAL 125 Cb 0.07 -1.99 0.01 0.00 0.56 0.00 0.00 36.38 35.03 2d6p s VAL 125 CO 0.77 -0.27 1.18 -2.84 -0.31 0.00 0.00 175.10 173.63 2d6p s PRO 126 N -2.87 2.53 0.28 4.82 0.02 -1.26 -4.92 135.00 133.61 2d6p s PRO 126 Ca 0.19 1.69 0.13 0.00 0.02 0.00 0.00 61.00 63.03 2d6p s PRO 126 Cb -0.06 -1.89 0.33 0.00 0.02 0.00 0.00 34.50 32.90 2d6p s PRO 126 CO 0.09 -1.52 1.58 0.10 -0.33 0.00 0.00 177.00 176.92 2d6p h TYR 127 N 0.13 0.00 -0.47 6.54 -0.00 -1.96 -3.27 116.97 117.93 2d6p h TYR 127 Ca -0.48 0.00 0.14 0.00 0.00 0.00 0.00 58.73 58.39 2d6p h TYR 127 Cb 1.28 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 38.00 2d6p h TYR 127 CO 0.49 0.59 0.35 0.45 -0.00 0.00 0.00 178.16 180.04 2d6p h HIS 128 N 0.00 0.00 -0.05 0.10 -0.00 -1.91 -0.03 115.15 113.26 2d6p h HIS 128 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.36 2d6p h HIS 128 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.59 2d6p h HIS 128 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.93 179.21 2d6p n LEU 129 N -4.33 0.95 -4.58 2.43 4.77 -1.23 -4.60 117.00 110.39 2d6p n LEU 129 Ca 0.08 -0.35 -0.40 0.00 -0.03 0.00 0.00 56.01 55.31 2d6p n LEU 129 Cb 0.56 -0.03 -0.09 0.00 -2.33 0.00 0.00 43.42 41.54 2d6p n LEU 129 CO 0.36 0.18 0.11 -0.69 -1.33 0.00 0.00 177.39 176.02 2d6p s VAL 130 N -1.94 5.13 -0.06 4.08 1.01 -0.02 -4.91 120.40 123.69 2d6p s VAL 130 Ca 0.37 0.42 0.14 0.00 0.00 0.00 0.00 61.98 62.91 2d6p s VAL 130 Cb 0.19 -3.80 0.27 0.00 0.00 0.00 0.00 36.38 33.04 2d6p s VAL 130 CO 0.30 0.01 1.12 -0.90 0.00 0.00 0.00 175.10 175.63 2d6p n ASP 131 N 5.46 1.01 -3.67 3.32 5.68 -0.99 -1.38 116.55 125.97 2d6p n ASP 131 Ca -0.07 -2.50 -0.10 0.00 -0.50 0.00 0.00 54.79 51.62 2d6p n ASP 131 Cb 0.50 -0.33 -0.10 0.00 -1.14 0.00 0.00 41.12 40.05 2d6p n ASP 131 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 2d6p s THR 132 N -1.00 -0.43 0.10 2.12 2.01 -1.03 -1.32 115.64 116.08 2d6p s THR 132 Ca 0.23 0.16 -0.09 0.00 0.31 0.00 0.00 61.69 62.30 2d6p s THR 132 Cb 0.24 -0.63 -0.06 0.00 0.01 0.00 0.00 72.50 72.07 2d6p s THR 132 CO -0.07 0.06 0.41 -0.51 -0.69 0.00 0.00 174.62 173.83 2d6p s ILE 133 N 2.21 5.09 -0.11 1.82 -1.16 -0.52 -1.08 121.20 127.44 2d6p s ILE 133 Ca -0.04 0.40 -0.05 0.00 -0.51 0.00 0.00 60.65 60.45 2d6p s ILE 133 Cb -0.11 -3.64 0.05 0.00 0.61 0.00 0.00 42.46 39.37 2d6p s ILE 133 CO -0.12 0.23 0.25 0.00 -2.81 0.00 0.00 174.94 172.49 2d6p s ALA 134 N -1.46 -0.54 -0.04 1.50 0.00 0.07 -2.20 121.76 119.09 2d6p s ALA 134 Ca 0.35 0.95 0.04 0.00 0.00 0.00 0.00 51.96 53.31 2d6p s ALA 134 Cb -0.14 -0.81 -0.00 0.00 0.00 0.00 0.00 23.12 22.18 2d6p s ALA 134 CO 0.19 -0.40 -0.17 0.08 0.00 0.00 0.00 175.76 175.46 2d6p s VAL 135 N 1.80 1.45 0.32 0.00 1.01 -0.23 -0.20 120.40 124.54 2d6p s VAL 135 Ca -0.04 -0.73 -0.10 0.00 0.00 0.00 0.00 61.98 61.11 2d6p s VAL 135 Cb -0.11 -1.24 0.01 0.00 0.00 0.00 0.00 36.38 35.04 2d6p s VAL 135 CO -0.08 0.42 0.55 -0.94 0.00 0.00 0.00 175.10 175.04 2d6p s SER 136 N 0.03 0.33 0.00 3.32 1.04 -0.54 -0.22 113.70 117.65 2d6p s SER 136 Ca -0.04 -1.19 0.00 0.00 0.48 0.00 0.00 55.95 55.20 2d6p s SER 136 Cb -0.12 0.68 0.00 0.00 0.10 0.00 0.00 66.02 66.68 2d6p s SER 136 CO 0.02 -1.33 0.00 0.61 0.98 0.00 0.00 173.24 173.52 2d6p n GLY 137 N -0.49 -1.81 2.54 7.32 0.00 -1.26 -0.51 105.19 110.98 2d6p n GLY 137 Ca -0.02 -1.97 -0.41 0.00 0.00 0.00 0.00 46.02 43.62 2d6p n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d6p s LEU 139 N 0.88 0.90 0.09 0.00 2.34 -1.26 -2.20 118.68 119.43 2d6p s LEU 139 Ca 0.57 -0.36 0.09 0.00 0.06 0.00 0.00 54.13 54.49 2d6p s LEU 139 Cb 0.16 1.40 -0.04 0.00 -0.56 0.00 0.00 46.19 47.15 2d6p s LEU 139 CO -0.07 -0.71 -0.21 -1.59 -1.06 0.00 0.00 176.35 172.70 2d6p s LYS 140 N -3.27 1.77 -0.08 1.48 -2.85 -0.05 -4.85 119.74 111.89 2d6p s LYS 140 Ca 0.00 -1.16 0.01 0.00 -1.00 0.00 0.00 55.97 53.83 2d6p s LYS 140 Cb 0.02 -2.07 -0.02 0.00 -2.06 0.00 0.00 37.83 33.69 2d6p s LYS 140 CO -0.08 0.49 -0.11 -0.51 0.10 0.00 0.00 175.35 175.24 2d6p s LEU 141 N -1.82 2.91 -0.07 2.77 1.43 -1.26 0.50 118.68 123.14 2d6p s LEU 141 Ca 0.15 -0.16 -0.14 0.00 -1.03 0.00 0.00 54.13 52.95 2d6p s LEU 141 Cb -0.10 -1.63 -0.30 0.00 0.03 0.00 0.00 46.19 44.19 2d6p s LEU 141 CO 0.07 0.30 0.65 0.28 0.23 0.00 0.00 176.35 177.88 2d6p h SER 142 N 5.70 0.53 -5.11 2.29 0.02 -0.61 -3.35 113.55 113.02 2d6p h SER 142 Ca -0.42 -0.91 0.11 0.00 -0.84 0.00 0.00 61.79 59.73 2d6p h SER 142 Cb 1.17 -0.17 -0.06 0.00 0.14 0.00 0.00 62.40 63.48 2d6p h SER 142 CO 0.53 1.70 0.32 0.72 -1.14 0.00 0.00 176.83 178.97 2d6p s PHE 143 N -2.53 -0.18 -0.07 3.45 -0.12 -0.71 -0.71 117.98 117.11 2d6p s PHE 143 Ca -0.17 -0.22 -0.02 0.00 -0.05 0.00 0.00 56.93 56.47 2d6p s PHE 143 Cb 0.05 0.68 0.03 0.00 -0.63 0.00 0.00 43.02 43.15 2d6p s PHE 143 CO 0.82 -1.08 0.03 0.42 -0.05 0.00 0.00 175.22 175.36 2d6p s ILE 144 N -3.68 0.18 0.22 -4.49 1.01 -0.58 -1.70 121.20 112.16 2d6p s ILE 144 Ca 0.11 0.20 0.07 0.00 0.00 0.00 0.00 60.65 61.03 2d6p s ILE 144 Cb -0.04 -0.41 -0.04 0.00 0.01 0.00 0.00 42.46 41.98 2d6p s ILE 144 CO 0.05 0.19 0.08 0.42 0.00 0.00 0.00 174.94 175.68 2d6p s THR 145 N 2.05 4.01 -0.14 2.92 -4.23 0.26 -2.14 115.64 118.37 2d6p s THR 145 Ca 0.05 -1.47 -0.00 0.00 -1.18 0.00 0.00 61.69 59.08 2d6p s THR 145 Cb -0.13 -3.09 0.03 0.00 1.34 0.00 0.00 72.50 70.65 2d6p s THR 145 CO -0.05 -0.24 -0.09 -0.36 -0.54 0.00 0.00 174.62 173.35 2d6p s PHE 146 N -1.99 1.71 -0.01 3.99 0.08 -1.26 -1.91 117.98 118.59 2d6p s PHE 146 Ca 0.31 -0.95 0.00 0.00 0.12 0.00 0.00 56.93 56.41 2d6p s PHE 146 Cb -0.08 -1.34 0.02 0.00 -0.57 0.00 0.00 43.02 41.04 2d6p s PHE 146 CO 0.22 -0.58 0.00 -0.65 -0.10 0.00 0.00 175.22 174.11 2d6p s GLN 147 N 1.63 0.12 -0.11 0.44 -0.21 -0.25 -3.85 119.66 117.44 2d6p s GLN 147 Ca 0.04 0.05 -0.02 0.00 0.02 0.00 0.00 55.36 55.45 2d6p s GLN 147 Cb -0.13 -0.25 0.04 0.00 1.00 0.00 0.00 33.01 33.67 2d6p s GLN 147 CO -0.09 -0.07 0.02 -0.08 -2.12 0.00 0.00 175.29 172.96 2d6p s THR 148 N 0.56 0.33 -1.98 -0.19 -1.32 0.70 0.87 115.64 114.60 2d6p s THR 148 Ca -0.05 -0.03 0.00 0.00 -1.21 0.00 0.00 61.69 60.40 2d6p s THR 148 Cb -0.08 -0.62 0.00 0.00 -1.51 0.00 0.00 72.50 70.30 2d6p s THR 148 CO -0.01 0.10 0.50 0.00 -2.21 0.00 0.00 174.62 172.99