#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w0s s ARG 3 N 0.00 -1.96 0.91 -1.46 1.70 -1.26 -4.71 118.95 112.18 2w0s s ARG 3 Ca 0.00 0.01 -0.12 0.00 -0.47 0.00 0.00 55.73 55.15 2w0s s ARG 3 Cb 0.00 -1.50 0.14 0.00 -0.57 0.00 0.00 34.95 33.02 2w0s s ARG 3 CO 0.00 -4.21 1.11 0.20 -1.08 0.00 0.00 175.30 171.32 2w0s s GLY 4 N -3.59 1.59 -0.05 3.88 0.00 -0.50 -4.85 107.32 103.80 2w0s s GLY 4 Ca 0.70 -0.37 -0.06 0.00 0.00 0.00 0.00 44.72 44.99 2w0s s GLY 4 CO 0.57 0.18 0.20 0.00 0.00 0.00 0.00 173.10 174.04 2w0s s ALA 5 N -3.12 3.88 -0.54 3.20 0.00 -1.26 -4.85 121.76 119.07 2w0s s ALA 5 Ca 0.64 -0.63 -0.20 0.00 0.00 0.00 0.00 51.96 51.77 2w0s s ALA 5 Cb -0.16 -2.00 0.07 0.00 0.00 0.00 0.00 23.12 21.02 2w0s s ALA 5 CO 0.55 0.65 0.70 -1.17 0.00 0.00 0.00 175.76 176.49 2w0s s LEU 6 N -1.43 4.91 -0.22 0.00 2.96 -1.26 -0.05 118.68 123.59 2w0s s LEU 6 Ca 0.22 -0.95 -0.05 0.00 -0.22 0.00 0.00 54.13 53.12 2w0s s LEU 6 Cb -0.13 -2.46 -0.02 0.00 0.50 0.00 0.00 46.19 44.08 2w0s s LEU 6 CO 0.11 -1.01 -0.00 -0.63 -1.32 0.00 0.00 176.35 173.50 2w0s s ILE 7 N 2.89 3.80 -0.10 6.68 1.01 0.91 -0.78 121.20 135.61 2w0s s ILE 7 Ca 0.17 -0.35 0.01 0.00 0.00 0.00 0.00 60.65 60.47 2w0s s ILE 7 Cb -0.19 -2.74 -0.02 0.00 0.01 0.00 0.00 42.46 39.52 2w0s s ILE 7 CO 0.12 0.41 -0.13 -0.69 0.00 0.00 0.00 174.94 174.65 2w0s s VAL 8 N 1.31 3.14 -0.21 2.92 1.01 -0.69 -0.72 120.40 127.16 2w0s s VAL 8 Ca 0.04 -0.65 -0.12 0.00 0.00 0.00 0.00 61.98 61.25 2w0s s VAL 8 Cb -0.15 -2.29 -0.05 0.00 0.00 0.00 0.00 36.38 33.90 2w0s s VAL 8 CO 0.00 0.55 0.21 -0.36 0.00 0.00 0.00 175.10 175.50 2w0s s PHE 9 N -0.03 3.37 0.33 5.22 0.40 0.82 0.05 117.98 128.14 2w0s s PHE 9 Ca -0.03 0.37 0.04 0.00 -0.60 0.00 0.00 56.93 56.72 2w0s s PHE 9 Cb -0.14 -2.30 -0.07 0.00 0.51 0.00 0.00 43.02 41.03 2w0s s PHE 9 CO 0.04 0.13 0.05 -1.21 0.70 0.00 0.00 175.22 174.93 2w0s s GLU 10 N 0.84 1.68 0.00 0.44 0.41 -0.30 -0.84 118.70 120.92 2w0s s GLU 10 Ca 0.11 -1.93 0.00 0.00 -0.41 0.00 0.00 54.97 52.74 2w0s s GLU 10 Cb -0.13 -0.97 0.00 0.00 -1.78 0.00 0.00 34.13 31.25 2w0s s GLU 10 CO 0.03 -0.16 0.00 0.41 -0.49 0.00 0.00 175.26 175.06 2w0s n GLY 11 N -0.71 1.97 3.56 -1.39 0.00 -1.26 -1.42 105.19 105.94 2w0s n GLY 11 Ca -0.03 -1.48 -0.29 0.00 0.00 0.00 0.00 46.02 44.22 2w0s n GLY 11 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2w0s s LEU 12 N 0.00 0.70 0.45 0.99 1.43 -1.26 -4.95 118.68 116.04 2w0s s LEU 12 Ca 0.00 0.94 -0.24 0.00 -1.03 0.00 0.00 54.13 53.80 2w0s s LEU 12 Cb 0.00 -2.78 -0.07 0.00 0.03 0.00 0.00 46.19 43.37 2w0s s LEU 12 CO 0.00 -4.04 1.26 -1.81 0.23 0.00 0.00 176.35 171.99 2w0s s ASP 13 N -3.47 6.06 -0.60 2.29 1.01 -1.26 -3.03 116.67 117.66 2w0s s ASP 13 Ca 0.69 2.54 0.00 0.00 0.71 0.00 0.00 52.55 56.48 2w0s s ASP 13 Cb -0.15 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.16 2w0s s ASP 13 CO 0.58 -1.01 0.00 0.29 0.21 0.00 0.00 175.17 175.24 2w0s n LYS 14 N -0.33 -0.92 0.00 8.23 4.76 -1.26 -4.83 118.16 123.81 2w0s n LYS 14 Ca 0.06 0.58 0.16 0.00 -2.87 0.00 0.00 58.31 56.24 2w0s n LYS 14 Cb 0.46 -4.47 0.88 0.00 -1.84 0.00 0.00 35.03 30.06 2w0s n LYS 14 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 2w0s n SER 15 N -0.17 0.01 -0.34 4.39 3.41 -1.17 -4.83 113.62 114.91 2w0s n SER 15 Ca -0.06 -0.71 -0.04 0.00 -0.26 0.00 0.00 58.87 57.80 2w0s n SER 15 Cb 0.32 -0.10 -0.02 0.00 -0.26 0.00 0.00 64.21 64.15 2w0s n SER 15 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2w0s n GLY 16 N 1.10 0.71 0.27 5.00 0.00 -1.26 -4.90 105.19 106.10 2w0s n GLY 16 Ca 0.21 -0.86 0.13 0.00 0.00 0.00 0.00 46.02 45.50 2w0s n GLY 16 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2w0s h LYS 17 N 0.00 0.00 -0.17 1.61 2.10 -1.91 -1.90 116.57 116.30 2w0s h LYS 17 Ca -0.09 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.54 2w0s h LYS 17 Cb 0.31 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.63 2w0s h LYS 17 CO 0.13 0.09 0.05 1.15 -2.00 0.00 0.00 179.45 178.87 2w0s h THR 18 N 0.00 1.19 -0.13 0.07 2.02 -1.99 -1.25 112.91 112.82 2w0s h THR 18 Ca -0.00 -0.60 0.04 0.00 0.77 0.00 0.00 66.41 66.62 2w0s h THR 18 Cb 0.26 1.27 -0.07 0.00 -1.74 0.00 0.00 68.15 67.87 2w0s h THR 18 CO 0.01 0.18 -0.48 0.74 0.37 0.00 0.00 175.52 176.35 2w0s h THR 19 N 0.09 0.08 -0.58 3.16 2.02 -1.77 -0.68 112.91 115.23 2w0s h THR 19 Ca 0.05 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.31 2w0s h THR 19 Cb 0.24 0.08 -0.03 0.00 -1.74 0.00 0.00 68.15 66.69 2w0s h THR 19 CO -0.00 0.00 0.38 1.56 0.37 0.00 0.00 175.52 177.83 2w0s h GLN 20 N -0.54 0.45 -0.73 6.66 1.08 -1.43 0.19 115.11 120.80 2w0s h GLN 20 Ca 0.06 -0.03 -0.06 0.00 -1.45 0.00 0.00 58.65 57.17 2w0s h GLN 20 Cb 0.66 -0.10 -0.03 0.00 -0.05 0.00 0.00 27.48 27.95 2w0s h GLN 20 CO -0.42 0.30 0.23 0.00 -0.95 0.00 0.00 178.83 177.99 2w0s h MET 22 N 1.08 0.64 0.25 0.00 2.86 0.86 -2.16 114.93 118.45 2w0s h MET 22 Ca 0.23 -0.04 0.01 0.00 -2.06 0.00 0.00 59.70 57.84 2w0s h MET 22 Cb 0.30 -0.14 -0.04 0.00 0.06 0.00 0.00 31.60 31.78 2w0s h MET 22 CO -0.01 0.42 -0.44 -0.91 1.06 0.00 0.00 176.91 177.04 2w0s h ASN 23 N 0.66 -1.25 -0.94 1.22 2.35 -0.89 -2.30 115.58 114.44 2w0s h ASN 23 Ca 0.21 0.12 0.17 0.00 -0.55 0.00 0.00 56.30 56.26 2w0s h ASN 23 Cb -0.00 0.45 -0.08 0.00 0.05 0.00 0.00 38.32 38.74 2w0s h ASN 23 CO -0.08 -0.54 0.60 0.40 -1.65 0.00 0.00 177.43 176.16 2w0s h ILE 24 N -0.76 0.76 0.00 2.81 5.03 -1.28 0.17 117.51 124.24 2w0s h ILE 24 Ca -0.01 -0.22 -0.08 0.00 -0.12 0.00 0.00 64.86 64.43 2w0s h ILE 24 Cb 0.73 0.05 -0.01 0.00 -3.03 0.00 0.00 36.82 34.56 2w0s h ILE 24 CO -0.17 0.12 -0.38 0.24 -0.68 0.00 0.00 178.15 177.28 2w0s h MET 25 N 0.65 0.00 0.01 2.37 2.86 -0.98 -2.72 114.93 117.13 2w0s h MET 25 Ca 0.50 0.00 -0.27 0.00 -2.06 0.00 0.00 59.70 57.86 2w0s h MET 25 Cb 0.89 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.51 2w0s h MET 25 CO -0.25 0.38 -1.51 0.93 1.06 0.00 0.00 176.91 177.52 2w0s h GLU 26 N 0.00 0.03 0.00 1.72 5.08 -0.47 -3.35 114.58 117.59 2w0s h GLU 26 Ca -0.00 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2w0s h GLU 26 Cb 0.74 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.01 2w0s h GLU 26 CO 0.05 0.71 0.00 0.43 -1.00 0.00 0.00 179.01 179.20 2w0s n SER 27 N -3.18 0.00 -3.94 1.42 7.64 0.40 -4.85 113.62 111.12 2w0s n SER 27 Ca -0.13 0.13 -0.12 0.00 1.01 0.00 0.00 58.87 59.76 2w0s n SER 27 Cb 1.02 -0.37 -0.13 0.00 -1.01 0.00 0.00 64.21 63.72 2w0s n SER 27 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2w0s s ILE 28 N -2.73 0.17 0.18 0.44 1.01 -1.06 -5.06 121.20 114.14 2w0s s ILE 28 Ca 0.21 -0.42 -0.31 0.00 0.00 0.00 0.00 60.65 60.12 2w0s s ILE 28 Cb 0.18 -0.21 -0.10 0.00 0.01 0.00 0.00 42.46 42.34 2w0s s ILE 28 CO 0.44 -0.16 1.56 -2.84 0.00 0.00 0.00 174.94 173.94 2w0s s PRO 29 N -0.62 4.21 0.19 2.79 0.02 -1.26 -4.85 135.00 135.49 2w0s s PRO 29 Ca -0.05 2.37 0.22 0.00 0.02 0.00 0.00 61.00 63.55 2w0s s PRO 29 Cb -0.04 -3.15 0.90 0.00 0.02 0.00 0.00 34.50 32.23 2w0s s PRO 29 CO -0.00 -0.60 1.66 0.00 -0.33 0.00 0.00 177.00 177.73 2w0s n ALA 30 N 3.81 1.71 1.22 -1.55 0.00 -1.26 -2.44 120.51 122.00 2w0s n ALA 30 Ca 0.13 0.05 0.11 0.00 0.00 0.00 0.00 53.44 53.73 2w0s n ALA 30 Cb 0.38 -1.36 0.60 0.00 0.00 0.00 0.00 19.45 19.08 2w0s n ALA 30 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2w0s n ASN 31 N -2.06 0.00 0.00 0.00 4.13 -1.26 -3.39 115.26 112.67 2w0s n ASN 31 Ca 0.03 -0.42 0.00 0.00 1.68 0.00 0.00 54.58 55.87 2w0s n ASN 31 Cb 0.23 -0.11 0.00 0.00 -1.54 0.00 0.00 39.78 38.36 2w0s n ASN 31 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 2w0s n THR 32 N -1.11 0.00 -4.07 3.41 -2.24 -1.02 -4.99 114.28 104.26 2w0s n THR 32 Ca 0.14 -0.29 -0.13 0.00 -2.27 0.00 0.00 64.05 61.50 2w0s n THR 32 Cb 0.11 1.26 -0.11 0.00 -2.10 0.00 0.00 70.33 69.49 2w0s n THR 32 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 2w0s s ILE 33 N -0.22 0.56 -0.03 2.28 2.07 -1.22 -1.24 121.20 123.40 2w0s s ILE 33 Ca 0.00 -1.10 -0.00 0.00 -1.41 0.00 0.00 60.65 58.13 2w0s s ILE 33 Cb 0.00 -0.64 0.03 0.00 0.13 0.00 0.00 42.46 41.98 2w0s s ILE 33 CO 0.00 -0.39 0.03 -0.75 -1.91 0.00 0.00 174.94 171.92 2w0s s LYS 34 N -1.63 0.00 -0.16 3.50 2.47 -0.37 -4.83 119.74 118.72 2w0s s LYS 34 Ca -0.09 0.22 -0.16 0.00 -1.56 0.00 0.00 55.97 54.38 2w0s s LYS 34 Cb -0.10 -0.35 -0.04 0.00 -1.46 0.00 0.00 37.83 35.88 2w0s s LYS 34 CO 0.00 -0.21 0.39 -0.47 0.16 0.00 0.00 175.35 175.23 2w0s s TYR 35 N 1.34 3.44 -0.21 4.03 5.04 -1.26 -1.48 117.35 128.25 2w0s s TYR 35 Ca -0.06 0.69 -0.00 0.00 -2.44 0.00 0.00 57.07 55.27 2w0s s TYR 35 Cb -0.13 -2.48 0.06 0.00 0.35 0.00 0.00 41.96 39.76 2w0s s TYR 35 CO -0.03 0.12 -0.04 -1.17 -1.34 0.00 0.00 175.55 173.09 2w0s s LEU 36 N 0.85 2.14 0.02 6.97 0.20 0.21 -4.98 118.68 124.09 2w0s s LEU 36 Ca 0.20 -1.00 -0.18 0.00 0.69 0.00 0.00 54.13 53.85 2w0s s LEU 36 Cb -0.14 -1.04 -0.06 0.00 -0.43 0.00 0.00 46.19 44.52 2w0s s LEU 36 CO 0.07 -0.23 0.51 0.21 -0.29 0.00 0.00 176.35 176.62 2w0s s ASN 37 N 1.51 6.93 -0.02 3.68 3.84 -1.26 -0.88 114.94 128.74 2w0s s ASN 37 Ca -0.03 1.10 0.06 0.00 0.21 0.00 0.00 52.86 54.20 2w0s s ASN 37 Cb -0.18 -2.32 -0.02 0.00 -0.55 0.00 0.00 41.25 38.19 2w0s s ASN 37 CO -0.07 0.24 -0.22 -0.36 -2.79 0.00 0.00 177.10 173.90 2w0s s PHE 38 N -0.77 1.97 0.59 0.43 0.40 -0.07 -3.69 117.98 116.85 2w0s s PHE 38 Ca 0.27 -0.40 -0.13 0.00 -0.60 0.00 0.00 56.93 56.07 2w0s s PHE 38 Cb -0.18 -1.27 -0.05 0.00 0.51 0.00 0.00 43.02 42.03 2w0s s PHE 38 CO 0.16 -0.06 1.02 -1.25 0.70 0.00 0.00 175.22 175.79 2w0s s PRO 39 N -0.44 3.67 -1.05 0.24 0.05 -1.26 -4.57 135.00 131.63 2w0s s PRO 39 Ca 0.07 0.82 -0.16 0.00 0.05 0.00 0.00 61.00 61.78 2w0s s PRO 39 Cb -0.09 -2.09 0.15 0.00 0.05 0.00 0.00 34.50 32.52 2w0s s PRO 39 CO -0.00 -0.51 1.25 -1.14 0.05 0.00 0.00 177.00 176.64 2w0s s GLN 40 N -4.84 3.82 0.00 4.56 2.00 -1.24 -4.85 119.66 119.10 2w0s s GLN 40 Ca 0.56 -2.16 0.15 0.00 -2.00 0.00 0.00 55.36 51.92 2w0s s GLN 40 Cb -0.11 -4.96 0.86 0.00 0.80 0.00 0.00 33.01 29.60 2w0s s GLN 40 CO 0.47 -1.75 1.34 0.54 -0.50 0.00 0.00 175.29 175.39 2w0s n ARG 41 N 6.02 0.40 0.05 1.67 1.74 -1.26 -3.01 116.66 122.28 2w0s n ARG 41 Ca 0.29 0.04 -0.10 0.00 -0.77 0.00 0.00 57.85 57.30 2w0s n ARG 41 Cb 0.46 -1.50 -0.13 0.00 -1.02 0.00 0.00 32.46 30.27 2w0s n ARG 41 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2w0s h SER 42 N 0.00 0.14 -1.76 0.55 4.64 -1.89 -2.84 113.55 112.39 2w0s h SER 42 Ca 0.00 -0.17 -0.08 0.00 -0.47 0.00 0.00 61.79 61.06 2w0s h SER 42 Cb 0.03 -0.05 0.04 0.00 -0.31 0.00 0.00 62.40 62.12 2w0s h SER 42 CO 0.00 1.14 0.01 0.35 -0.87 0.00 0.00 176.83 177.46 2w0s n THR 43 N -3.34 0.00 -0.04 2.95 -2.24 -1.16 -4.57 114.28 105.87 2w0s n THR 43 Ca -0.07 -0.07 -0.15 0.00 -2.27 0.00 0.00 64.05 61.48 2w0s n THR 43 Cb 0.99 -0.79 -0.08 0.00 -2.10 0.00 0.00 70.33 68.35 2w0s n THR 43 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2w0s h VAL 44 N -1.95 1.35 0.00 2.28 2.07 -1.91 -0.95 116.25 117.13 2w0s h VAL 44 Ca -0.09 -1.72 -0.02 0.00 0.82 0.00 0.00 66.70 65.69 2w0s h VAL 44 Cb 0.28 2.06 -0.00 0.00 -1.52 0.00 0.00 31.29 32.11 2w0s h VAL 44 CO 0.06 0.52 -0.09 0.71 0.02 0.00 0.00 177.57 178.79 2w0s h THR 45 N 0.17 0.18 0.08 2.57 1.35 -1.92 -3.16 112.91 112.19 2w0s h THR 45 Ca -0.02 -1.05 -0.00 0.00 -0.55 0.00 0.00 66.41 64.79 2w0s h THR 45 Cb 1.06 1.91 0.00 0.00 -1.73 0.00 0.00 68.15 69.39 2w0s h THR 45 CO 0.09 0.09 -0.04 1.23 -0.25 0.00 0.00 175.52 176.64 2w0s h GLY 46 N 3.22 -0.12 1.44 5.82 0.00 -1.64 -1.22 103.07 110.58 2w0s h GLY 46 Ca -0.00 0.04 -0.03 0.00 0.00 0.00 0.00 47.33 47.34 2w0s h GLY 46 CO 0.01 -0.04 0.17 0.50 0.00 0.00 0.00 176.54 177.18 2w0s h LYS 47 N -0.51 0.72 -0.15 4.80 1.57 -0.92 0.35 116.57 122.43 2w0s h LYS 47 Ca -0.01 -0.11 -0.03 0.00 -1.87 0.00 0.00 60.65 58.63 2w0s h LYS 47 Cb 0.43 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 2w0s h LYS 47 CO 0.02 0.61 -0.01 0.52 -0.57 0.00 0.00 179.45 180.02 2w0s h MET 48 N 0.71 0.27 -0.98 3.15 2.86 -1.59 -1.48 114.93 117.87 2w0s h MET 48 Ca 0.17 -0.09 0.10 0.00 -2.06 0.00 0.00 59.70 57.82 2w0s h MET 48 Cb 0.18 -0.02 -0.08 0.00 0.06 0.00 0.00 31.60 31.74 2w0s h MET 48 CO -0.01 0.51 0.62 0.82 1.06 0.00 0.00 176.91 179.91 2w0s h ILE 49 N 0.01 0.97 -0.55 -1.22 2.04 0.05 -1.64 117.51 117.17 2w0s h ILE 49 Ca 0.04 -0.35 0.02 0.00 1.00 0.00 0.00 64.86 65.57 2w0s h ILE 49 Cb 0.39 -0.15 -0.04 0.00 -0.74 0.00 0.00 36.82 36.29 2w0s h ILE 49 CO 0.01 0.19 0.33 -0.78 0.00 0.00 0.00 178.15 177.90 2w0s h ASP 50 N 1.03 0.54 -0.84 1.72 3.58 0.03 -1.59 116.42 120.89 2w0s h ASP 50 Ca 0.47 0.00 0.01 0.00 0.42 0.00 0.00 57.03 57.93 2w0s h ASP 50 Cb 0.38 -0.11 -0.04 0.00 1.72 0.00 0.00 39.33 41.27 2w0s h ASP 50 CO -0.24 0.38 0.55 0.44 -2.88 0.00 0.00 179.24 177.50 2w0s h ASP 51 N 0.66 0.95 -0.17 2.28 3.32 -0.35 -1.61 116.42 121.50 2w0s h ASP 51 Ca 0.22 -0.02 -0.19 0.00 0.02 0.00 0.00 57.03 57.05 2w0s h ASP 51 Cb 0.02 -0.24 0.01 0.00 0.22 0.00 0.00 39.33 39.34 2w0s h ASP 51 CO -0.09 0.68 -0.65 0.22 -1.72 0.00 0.00 179.24 177.69 2w0s h TYR 52 N 1.12 0.98 -0.09 4.55 3.20 -0.90 -0.06 116.97 125.78 2w0s h TYR 52 Ca 0.31 -0.41 -0.14 0.00 3.14 0.00 0.00 58.73 61.63 2w0s h TYR 52 Cb -0.11 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 37.99 2w0s h TYR 52 CO -0.00 1.23 -0.55 -0.07 -1.64 0.00 0.00 178.16 177.12 2w0s h LEU 53 N 0.45 0.28 -1.72 2.82 3.38 -1.09 -2.97 115.31 116.47 2w0s h LEU 53 Ca -0.03 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.79 2w0s h LEU 53 Cb 1.27 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.94 2w0s h LEU 53 CO 0.14 0.78 0.00 0.35 0.09 0.00 0.00 178.44 179.80 2w0s n THR 54 N -3.91 0.83 -2.28 0.22 -2.24 -0.62 -1.17 114.28 105.10 2w0s n THR 54 Ca -0.02 -0.58 -0.19 0.00 -2.27 0.00 0.00 64.05 60.98 2w0s n THR 54 Cb 0.58 0.03 -0.02 0.00 -2.10 0.00 0.00 70.33 68.82 2w0s n THR 54 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2w0s n ARG 55 N 0.51 -1.52 -0.51 -0.78 1.74 -1.03 -4.88 116.66 110.18 2w0s n ARG 55 Ca 0.13 0.97 0.05 0.00 -0.77 0.00 0.00 57.85 58.23 2w0s n ARG 55 Cb 0.47 -5.51 0.24 0.00 -1.02 0.00 0.00 32.46 26.63 2w0s n ARG 55 CO 0.00 0.00 0.00 0.36 -1.52 0.00 0.00 177.63 176.47 2w0s n LYS 56 N -2.81 2.57 -3.64 5.56 2.85 -0.06 -4.96 118.16 117.66 2w0s n LYS 56 Ca -0.23 -2.91 -0.03 0.00 -1.05 0.00 0.00 58.31 54.10 2w0s n LYS 56 Cb 0.67 -1.82 -0.06 0.00 -0.65 0.00 0.00 35.03 33.17 2w0s n LYS 56 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 2w0s s LYS 57 N -2.94 0.08 0.36 -1.58 1.02 -1.18 -4.92 119.74 110.59 2w0s s LYS 57 Ca 0.42 0.06 0.09 0.00 0.02 0.00 0.00 55.97 56.56 2w0s s LYS 57 Cb 0.35 0.04 -0.06 0.00 -0.52 0.00 0.00 37.83 37.64 2w0s s LYS 57 CO 0.06 -0.02 -0.03 0.95 -0.92 0.00 0.00 175.35 175.40 2w0s s THR 58 N -0.41 2.29 0.15 2.17 -4.23 -1.26 -4.15 115.64 110.20 2w0s s THR 58 Ca 0.08 -2.07 -0.10 0.00 -1.18 0.00 0.00 61.69 58.42 2w0s s THR 58 Cb -0.03 -2.78 -0.00 0.00 1.34 0.00 0.00 72.50 71.02 2w0s s THR 58 CO -0.12 -0.14 0.28 -0.31 -0.54 0.00 0.00 174.62 173.79 2w0s s TYR 59 N -2.61 0.29 0.49 3.99 1.51 -1.26 -5.07 117.35 114.69 2w0s s TYR 59 Ca 0.34 -0.67 -0.21 0.00 -1.01 0.00 0.00 57.07 55.52 2w0s s TYR 59 Cb 0.04 -0.02 -0.10 0.00 -0.11 0.00 0.00 41.96 41.77 2w0s s TYR 59 CO 0.18 -0.70 0.74 0.09 -1.11 0.00 0.00 175.55 174.75 2w0s n ASN 60 N -0.19 -0.06 -0.13 2.29 4.13 -1.26 -4.84 115.26 115.20 2w0s n ASN 60 Ca -0.09 0.89 0.11 0.00 1.68 0.00 0.00 54.58 57.17 2w0s n ASN 60 Cb 0.63 -1.24 0.46 0.00 -1.54 0.00 0.00 39.78 38.09 2w0s n ASN 60 CO 0.00 0.00 0.00 0.44 0.28 0.00 0.00 177.26 177.98 2w0s h ASP 61 N 0.82 0.45 -0.02 6.41 3.32 -2.00 0.15 116.42 125.54 2w0s h ASP 61 Ca -0.44 0.01 -0.04 0.00 0.02 0.00 0.00 57.03 56.58 2w0s h ASP 61 Cb 1.38 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.83 2w0s h ASP 61 CO 0.52 0.27 -0.08 0.45 -1.72 0.00 0.00 179.24 178.67 2w0s h HIS 62 N 0.50 0.25 0.09 4.55 3.86 -2.01 -2.30 115.15 120.09 2w0s h HIS 62 Ca 0.31 -0.02 -0.29 0.00 -1.16 0.00 0.00 60.37 59.21 2w0s h HIS 62 Cb 0.55 -0.08 -0.01 0.00 1.06 0.00 0.00 27.41 28.93 2w0s h HIS 62 CO -0.00 0.34 -1.46 0.82 0.86 0.00 0.00 177.93 178.48 2w0s h ILE 63 N 0.24 1.22 -0.10 2.45 5.03 -1.08 -3.24 117.51 122.03 2w0s h ILE 63 Ca 0.05 -2.88 -0.22 0.00 -0.12 0.00 0.00 64.86 61.69 2w0s h ILE 63 Cb 0.30 2.75 0.01 0.00 -3.03 0.00 0.00 36.82 36.86 2w0s h ILE 63 CO 0.01 0.81 -0.79 -0.37 -0.68 0.00 0.00 178.15 177.14 2w0s h VAL 64 N 0.05 1.30 -0.91 1.67 -1.51 -1.21 -1.34 116.25 114.30 2w0s h VAL 64 Ca -0.21 -2.02 0.15 0.00 -1.23 0.00 0.00 66.70 63.39 2w0s h VAL 64 Cb 1.98 2.15 -0.09 0.00 -2.13 0.00 0.00 31.29 33.20 2w0s h VAL 64 CO 0.15 0.63 0.52 0.78 -1.23 0.00 0.00 177.57 178.43 2w0s h ASN 65 N 0.40 0.69 1.17 4.19 4.21 -1.52 -1.96 115.58 122.77 2w0s h ASN 65 Ca -0.07 0.08 -0.01 0.00 1.21 0.00 0.00 56.30 57.50 2w0s h ASN 65 Cb 1.43 -0.04 -0.00 0.00 -1.12 0.00 0.00 38.32 38.59 2w0s h ASN 65 CO 0.16 0.31 -0.84 0.17 -1.29 0.00 0.00 177.43 175.95 2w0s h LEU 66 N 0.75 0.00 -0.43 1.61 8.10 -1.56 -2.96 115.31 120.83 2w0s h LEU 66 Ca 0.49 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 58.47 2w0s h LEU 66 Cb 0.64 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.84 2w0s h LEU 66 CO -0.33 0.05 0.23 -0.07 -4.11 0.00 0.00 178.44 174.21 2w0s h LEU 67 N 0.00 0.54 -0.33 0.17 3.38 -0.50 -0.08 115.31 118.49 2w0s h LEU 67 Ca -0.01 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 2w0s h LEU 67 Cb 1.05 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 2w0s h LEU 67 CO 0.00 0.48 0.13 -0.26 0.09 0.00 0.00 178.44 178.89 2w0s h PHE 68 N 0.56 0.51 0.93 1.13 0.04 -1.49 0.14 116.94 118.75 2w0s h PHE 68 Ca 0.15 -0.04 -0.04 0.00 2.80 0.00 0.00 57.97 60.84 2w0s h PHE 68 Cb 0.07 -0.15 0.01 0.00 2.20 0.00 0.00 35.95 38.07 2w0s h PHE 68 CO -0.02 0.48 -0.47 0.00 -0.60 0.00 0.00 178.31 177.70 2w0s h ALA 70 N -1.23 1.94 -0.74 0.00 0.00 -0.97 0.50 119.26 118.75 2w0s h ALA 70 Ca -0.13 0.02 0.11 0.00 0.00 0.00 0.00 54.91 54.92 2w0s h ALA 70 Cb 0.99 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.64 2w0s h ALA 70 CO 0.19 -0.20 0.49 -0.97 0.00 0.00 0.00 179.25 178.76 2w0s h ASN 71 N 0.60 0.53 -0.00 0.00 -0.73 -0.41 -2.47 115.58 113.11 2w0s h ASN 71 Ca 0.47 0.02 -0.01 0.00 1.87 0.00 0.00 56.30 58.64 2w0s h ASN 71 Cb 0.87 -0.09 0.00 0.00 0.27 0.00 0.00 38.32 39.38 2w0s h ASN 71 CO -0.21 0.30 -0.06 0.03 -0.37 0.00 0.00 177.43 177.12 2w0s h ARG 72 N 0.58 0.04 -0.81 6.67 3.08 0.56 -3.34 114.38 121.16 2w0s h ARG 72 Ca 0.35 -0.04 0.18 0.00 0.07 0.00 0.00 59.98 60.54 2w0s h ARG 72 Cb 0.58 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.59 2w0s h ARG 72 CO -0.13 0.81 0.54 -1.49 -1.07 0.00 0.00 179.97 178.64 2w0s h TRP 73 N -0.72 0.41 -1.21 3.04 4.06 -0.91 0.25 115.95 120.87 2w0s h TRP 73 Ca -0.01 0.01 0.35 0.00 2.06 0.00 0.00 58.89 61.30 2w0s h TRP 73 Cb 0.83 -0.13 -0.09 0.00 -1.00 0.00 0.00 29.16 28.78 2w0s h TRP 73 CO 0.20 0.13 0.82 0.93 -3.56 0.00 0.00 178.44 176.95 2w0s h GLU 74 N 0.33 0.17 -0.02 0.49 5.08 -1.57 -2.03 114.58 117.03 2w0s h GLU 74 Ca 0.40 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.75 2w0s h GLU 74 Cb 1.09 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.30 2w0s h GLU 74 CO -0.12 0.11 -0.20 1.19 -1.00 0.00 0.00 179.01 179.00 2w0s n PHE 75 N -4.45 0.00 -0.27 4.33 3.01 0.86 -4.44 117.46 116.50 2w0s n PHE 75 Ca 0.29 0.00 0.03 0.00 1.01 0.00 0.00 57.45 58.78 2w0s n PHE 75 Cb 1.19 0.00 0.24 0.00 -0.01 0.00 0.00 39.48 40.90 2w0s n PHE 75 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2w0s h ALA 76 N 3.06 1.50 0.37 4.37 0.00 -1.19 0.10 119.26 127.48 2w0s h ALA 76 Ca 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2w0s h ALA 76 Cb 0.62 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2w0s h ALA 76 CO 0.00 0.40 -0.18 0.77 0.00 0.00 0.00 179.25 180.24 2w0s h SER 77 N 1.03 -0.43 -0.60 0.00 0.02 -1.78 -2.51 113.55 109.28 2w0s h SER 77 Ca 0.35 0.01 0.09 0.00 -0.84 0.00 0.00 61.79 61.40 2w0s h SER 77 Cb 0.08 0.11 -0.07 0.00 0.14 0.00 0.00 62.40 62.66 2w0s h SER 77 CO -0.11 -0.30 0.23 0.15 -1.14 0.00 0.00 176.83 175.66 2w0s h PHE 78 N -0.51 0.40 0.50 3.45 3.57 -1.68 -0.76 116.94 121.91 2w0s h PHE 78 Ca -0.05 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.46 2w0s h PHE 78 Cb 0.39 -0.09 -0.00 0.00 2.79 0.00 0.00 35.95 39.04 2w0s h PHE 78 CO -0.05 0.11 -0.33 0.82 -2.23 0.00 0.00 178.31 176.63 2w0s h ILE 79 N 0.42 0.00 -0.99 1.41 2.04 -0.77 -1.77 117.51 117.85 2w0s h ILE 79 Ca 0.30 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.31 2w0s h ILE 79 Cb 0.36 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 36.28 2w0s h ILE 79 CO -0.29 0.00 -0.39 1.67 0.00 0.00 0.00 178.15 179.13 2w0s n GLN 80 N -4.44 -0.24 -0.14 2.37 -0.06 -0.95 -1.81 117.38 112.11 2w0s n GLN 80 Ca -0.10 1.52 -0.04 0.00 -2.00 0.00 0.00 57.00 56.37 2w0s n GLN 80 Cb 0.33 -2.25 0.04 0.00 -4.06 0.00 0.00 30.24 24.31 2w0s n GLN 80 CO 0.00 0.00 0.00 0.93 -0.20 0.00 0.00 177.06 177.79 2w0s h GLU 81 N 0.00 0.35 -0.09 3.69 5.08 -0.97 -2.11 114.58 120.54 2w0s h GLU 81 Ca 0.33 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.67 2w0s h GLU 81 Cb 0.58 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 2w0s h GLU 81 CO -0.98 0.23 0.04 1.96 -1.00 0.00 0.00 179.01 179.27 2w0s h GLN 82 N 0.36 0.12 -0.13 2.33 1.08 -0.53 -0.46 115.11 117.89 2w0s h GLN 82 Ca 0.21 -0.02 0.03 0.00 -1.45 0.00 0.00 58.65 57.42 2w0s h GLN 82 Cb 0.18 -0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.56 2w0s h GLN 82 CO -0.20 0.19 -0.06 -0.07 -0.95 0.00 0.00 178.83 177.75 2w0s h LEU 83 N 0.03 -0.19 -0.96 1.46 3.38 -1.24 -0.23 115.31 117.56 2w0s h LEU 83 Ca 0.03 0.05 0.09 0.00 0.09 0.00 0.00 57.88 58.14 2w0s h LEU 83 Cb 0.11 0.11 -0.07 0.00 0.09 0.00 0.00 40.66 40.89 2w0s h LEU 83 CO -0.00 -0.08 0.60 -0.33 0.09 0.00 0.00 178.44 178.72 2w0s h GLU 84 N -0.04 1.00 0.00 1.13 5.08 -1.25 0.89 114.58 121.40 2w0s h GLU 84 Ca 0.07 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2w0s h GLU 84 Cb 0.14 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.17 2w0s h GLU 84 CO -0.16 0.66 0.00 1.04 -1.00 0.00 0.00 179.01 179.56 2w0s n GLN 85 N -4.59 0.58 -0.89 2.33 6.02 -0.19 -4.81 117.38 115.83 2w0s n GLN 85 Ca 0.16 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.15 2w0s n GLN 85 Cb 0.25 -1.08 0.00 0.00 1.02 0.00 0.00 30.24 30.44 2w0s n GLN 85 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2w0s n GLY 86 N 0.09 0.80 3.74 1.08 0.00 0.19 -4.94 105.19 106.15 2w0s n GLY 86 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 2w0s n GLY 86 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2w0s s ILE 87 N -3.13 4.77 0.11 -0.61 1.09 -0.23 -3.85 121.20 119.36 2w0s s ILE 87 Ca 0.00 1.66 -0.22 0.00 -1.10 0.00 0.00 60.65 60.99 2w0s s ILE 87 Cb 0.00 -4.13 -0.07 0.00 -1.06 0.00 0.00 42.46 37.19 2w0s s ILE 87 CO 0.00 0.33 0.67 -0.89 -0.10 0.00 0.00 174.94 174.95 2w0s s THR 88 N 0.14 4.57 -0.19 2.92 2.01 -0.38 -3.59 115.64 121.13 2w0s s THR 88 Ca 0.40 1.45 -0.06 0.00 0.31 0.00 0.00 61.69 63.79 2w0s s THR 88 Cb -0.20 -4.01 -0.03 0.00 0.01 0.00 0.00 72.50 68.26 2w0s s THR 88 CO 0.23 0.54 0.03 -0.76 -0.69 0.00 0.00 174.62 173.96 2w0s s LEU 89 N -1.10 3.52 -0.30 4.42 1.43 0.93 -1.24 118.68 126.34 2w0s s LEU 89 Ca 0.32 -0.06 -0.04 0.00 -1.03 0.00 0.00 54.13 53.32 2w0s s LEU 89 Cb -0.21 -1.89 0.03 0.00 0.03 0.00 0.00 46.19 44.15 2w0s s LEU 89 CO 0.22 0.13 0.04 -0.63 0.23 0.00 0.00 176.35 176.34 2w0s s ILE 90 N 0.63 3.42 -0.20 -0.59 -1.09 -0.55 -0.07 121.20 122.77 2w0s s ILE 90 Ca 0.01 -1.08 0.01 0.00 -2.23 0.00 0.00 60.65 57.36 2w0s s ILE 90 Cb -0.14 -2.87 0.03 0.00 -1.58 0.00 0.00 42.46 37.90 2w0s s ILE 90 CO 0.02 -0.03 -0.18 -0.69 -1.23 0.00 0.00 174.94 172.83 2w0s s VAL 91 N 1.37 2.05 -0.34 2.92 1.01 0.11 -0.62 120.40 126.89 2w0s s VAL 91 Ca -0.01 -1.07 -0.29 0.00 0.00 0.00 0.00 61.98 60.61 2w0s s VAL 91 Cb -0.18 -1.92 0.02 0.00 0.00 0.00 0.00 36.38 34.29 2w0s s VAL 91 CO 0.00 0.41 1.09 -0.62 0.00 0.00 0.00 175.10 175.98 2w0s s ASP 92 N 1.26 6.88 0.61 3.32 -1.08 -0.06 -0.13 116.67 127.48 2w0s s ASP 92 Ca 0.02 0.97 0.00 0.00 -0.52 0.00 0.00 52.55 53.02 2w0s s ASP 92 Cb -0.14 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 38.77 2w0s s ASP 92 CO -0.11 -0.94 0.00 0.54 0.52 0.00 0.00 175.17 175.18 2w0s n ARG 93 N 7.02 -4.31 0.00 4.34 1.74 -0.02 -0.89 116.66 124.54 2w0s n ARG 93 Ca 0.12 3.33 0.00 0.00 -0.77 0.00 0.00 57.85 60.53 2w0s n ARG 93 Cb 0.47 -4.14 0.00 0.00 -1.02 0.00 0.00 32.46 27.78 2w0s n ARG 93 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09 2w0s n TYR 94 N -2.52 0.00 -0.28 -1.55 9.36 -1.26 -4.41 117.16 116.49 2w0s n TYR 94 Ca 0.00 0.00 0.13 0.00 3.32 0.00 0.00 57.90 61.35 2w0s n TYR 94 Cb 0.46 0.00 0.25 0.00 -0.63 0.00 0.00 39.34 39.43 2w0s n TYR 94 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2w0s n ALA 95 N -3.00 0.44 -0.09 2.98 0.00 -1.26 -0.87 120.51 118.71 2w0s n ALA 95 Ca 0.00 0.88 -0.10 0.00 0.00 0.00 0.00 53.44 54.22 2w0s n ALA 95 Cb 0.00 -0.65 0.05 0.00 0.00 0.00 0.00 19.45 18.85 2w0s n ALA 95 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 2w0s h PHE 96 N 0.00 0.94 -0.88 0.00 0.04 -1.99 -0.84 116.94 114.21 2w0s h PHE 96 Ca 0.51 -0.25 0.15 0.00 2.80 0.00 0.00 57.97 61.19 2w0s h PHE 96 Cb 1.07 -0.21 -0.10 0.00 2.20 0.00 0.00 35.95 38.91 2w0s h PHE 96 CO -0.40 1.00 0.47 0.77 -0.60 0.00 0.00 178.31 179.55 2w0s h SER 97 N 0.68 0.57 0.51 2.17 0.02 -1.39 -0.47 113.55 115.65 2w0s h SER 97 Ca 0.08 0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 61.10 2w0s h SER 97 Cb 0.84 -0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.38 2w0s h SER 97 CO 0.07 0.23 -0.30 1.23 -1.14 0.00 0.00 176.83 176.93 2w0s h GLY 98 N 0.65 -0.91 0.98 -3.77 0.00 -0.88 -2.42 103.07 96.72 2w0s h GLY 98 Ca 0.48 0.37 0.01 0.00 0.00 0.00 0.00 47.33 48.19 2w0s h GLY 98 CO -0.36 -0.32 0.44 -2.08 0.00 0.00 0.00 176.54 174.21 2w0s h VAL 99 N -0.75 1.16 -0.43 4.60 2.07 -1.11 0.11 116.25 121.90 2w0s h VAL 99 Ca -0.07 -0.30 -0.13 0.00 0.82 0.00 0.00 66.70 67.02 2w0s h VAL 99 Cb 0.59 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 2w0s h VAL 99 CO 0.08 0.16 -0.23 0.00 0.02 0.00 0.00 177.57 177.60 2w0s h ALA 100 N 1.25 0.78 0.17 1.67 0.00 -1.16 0.19 119.26 122.16 2w0s h ALA 100 Ca 0.25 -0.39 -0.31 0.00 0.00 0.00 0.00 54.91 54.46 2w0s h ALA 100 Cb -0.08 -0.16 0.03 0.00 0.00 0.00 0.00 17.79 17.58 2w0s h ALA 100 CO -0.06 0.66 -1.34 1.88 0.00 0.00 0.00 179.25 180.39 2w0s h TYR 101 N 0.76 1.01 -0.49 0.00 -1.99 -1.27 -1.24 116.97 113.75 2w0s h TYR 101 Ca 0.10 -0.67 -0.04 0.00 2.00 0.00 0.00 58.73 60.12 2w0s h TYR 101 Cb 0.78 -0.07 -0.02 0.00 2.00 0.00 0.00 36.73 39.42 2w0s h TYR 101 CO 0.05 1.51 0.16 0.00 -0.00 0.00 0.00 178.16 179.88 2w0s h ALA 102 N 0.24 0.64 -0.15 3.88 0.00 -0.73 -2.94 119.26 120.19 2w0s h ALA 102 Ca -0.21 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.40 2w0s h ALA 102 Cb 2.01 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.60 2w0s h ALA 102 CO 0.25 0.28 -0.42 0.00 0.00 0.00 0.00 179.25 179.36 2w0s h ALA 103 N 1.02 1.00 -0.05 0.00 0.00 -0.67 -2.35 119.26 118.21 2w0s h ALA 103 Ca 0.16 -0.43 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 2w0s h ALA 103 Cb 0.26 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2w0s h ALA 103 CO -0.01 0.62 -0.10 0.00 0.00 0.00 0.00 179.25 179.76 2w0s h ALA 104 N 1.27 1.75 -0.19 0.00 0.00 -1.14 -1.54 119.26 119.41 2w0s h ALA 104 Ca 0.02 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2w0s h ALA 104 Cb 0.87 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2w0s h ALA 104 CO 0.07 0.19 0.00 1.63 0.00 0.00 0.00 179.25 181.14 2w0s n LYS 105 N -4.38 1.96 -0.45 0.00 5.02 -0.93 -4.88 118.16 114.51 2w0s n LYS 105 Ca -0.02 -0.90 0.00 0.00 -2.02 0.00 0.00 58.31 55.37 2w0s n LYS 105 Cb 0.20 -1.55 0.00 0.00 -0.02 0.00 0.00 35.03 33.66 2w0s n LYS 105 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2w0s n GLY 106 N 0.40 0.76 3.89 0.72 0.00 -0.58 -5.06 105.19 105.31 2w0s n GLY 106 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 2w0s n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w0s s ALA 107 N -2.35 3.10 -0.08 4.61 0.00 -0.95 -5.00 121.76 121.09 2w0s s ALA 107 Ca 0.00 -0.35 -0.30 0.00 0.00 0.00 0.00 51.96 51.32 2w0s s ALA 107 Cb 0.00 -2.91 -0.03 0.00 0.00 0.00 0.00 23.12 20.18 2w0s s ALA 107 CO 0.00 -0.83 1.20 0.45 0.00 0.00 0.00 175.76 176.58 2w0s s SER 108 N -4.26 7.04 0.27 0.00 0.15 -1.26 -4.39 113.70 111.24 2w0s s SER 108 Ca 0.55 1.77 -0.04 0.00 0.70 0.00 0.00 55.95 58.93 2w0s s SER 108 Cb -0.11 -2.55 0.34 0.00 -1.71 0.00 0.00 66.02 61.99 2w0s s SER 108 CO 0.50 -0.62 1.91 -0.03 1.20 0.00 0.00 173.24 176.21 2w0s h MET 109 N 7.59 1.15 -0.06 5.44 4.05 -1.93 0.13 114.93 131.31 2w0s h MET 109 Ca -0.32 -0.11 -0.17 0.00 -0.28 0.00 0.00 59.70 58.83 2w0s h MET 109 Cb 1.15 -0.24 -0.01 0.00 -0.80 0.00 0.00 31.60 31.70 2w0s h MET 109 CO 0.90 0.81 -0.69 1.79 0.23 0.00 0.00 176.91 179.95 2w0s h THR 110 N 1.17 1.41 -0.20 -0.77 1.35 -1.99 -2.56 112.91 111.31 2w0s h THR 110 Ca 0.30 -2.16 -0.17 0.00 -0.55 0.00 0.00 66.41 63.84 2w0s h THR 110 Cb -0.04 2.12 0.00 0.00 -1.73 0.00 0.00 68.15 68.51 2w0s h THR 110 CO -0.06 0.64 -0.53 0.25 -0.25 0.00 0.00 175.52 175.57 2w0s h LEU 111 N 0.19 0.81 -1.10 3.87 5.85 -1.87 -2.12 115.31 120.93 2w0s h LEU 111 Ca -0.02 -0.58 0.04 0.00 0.84 0.00 0.00 57.88 58.17 2w0s h LEU 111 Cb 1.24 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 41.98 2w0s h LEU 111 CO 0.11 1.24 0.61 0.28 -0.34 0.00 0.00 178.44 180.34 2w0s h SER 112 N 0.42 0.99 0.17 1.25 0.02 -0.75 -2.78 113.55 112.87 2w0s h SER 112 Ca -0.01 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.92 2w0s h SER 112 Cb 1.15 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 63.46 2w0s h SER 112 CO 0.11 0.67 -0.08 0.11 -1.14 0.00 0.00 176.83 176.51 2w0s h LYS 113 N 1.15 -0.22 -0.98 3.45 1.57 -1.36 -2.88 116.57 117.30 2w0s h LYS 113 Ca 0.37 0.01 0.33 0.00 -1.87 0.00 0.00 60.65 59.50 2w0s h LYS 113 Cb 0.05 0.05 -0.18 0.00 0.08 0.00 0.00 32.23 32.22 2w0s h LYS 113 CO -0.12 0.07 0.25 -1.13 -0.57 0.00 0.00 179.45 177.95 2w0s n SER 114 N -5.06 0.09 -0.07 0.86 3.41 -0.81 -0.43 113.62 111.61 2w0s n SER 114 Ca -0.09 1.65 -0.05 0.00 -0.26 0.00 0.00 58.87 60.13 2w0s n SER 114 Cb 0.21 -0.69 0.16 0.00 -0.26 0.00 0.00 64.21 63.63 2w0s n SER 114 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 2w0s h TYR 115 N 0.00 0.77 0.00 7.33 0.99 -1.41 -2.29 116.97 122.37 2w0s h TYR 115 Ca 0.70 -0.13 -0.04 0.00 2.00 0.00 0.00 58.73 61.26 2w0s h TYR 115 Cb 1.67 -0.20 -0.01 0.00 1.00 0.00 0.00 36.73 39.19 2w0s h TYR 115 CO -0.28 0.77 -0.19 0.93 -0.00 0.00 0.00 178.16 179.39 2w0s h GLU 116 N 0.66 0.00 -6.11 4.88 4.39 -0.74 -3.46 114.58 114.19 2w0s h GLU 116 Ca 0.12 0.00 -0.63 0.00 0.34 0.00 0.00 59.36 59.18 2w0s h GLU 116 Cb 0.53 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.18 2w0s h GLU 116 CO 0.03 0.19 1.28 0.45 -1.16 0.00 0.00 179.01 179.81 2w0s n SER 117 N -3.20 2.94 0.00 1.42 2.88 -0.28 -1.74 113.62 115.64 2w0s n SER 117 Ca 0.02 0.63 0.00 0.00 -1.33 0.00 0.00 58.87 58.19 2w0s n SER 117 Cb 0.54 -1.37 0.00 0.00 -0.75 0.00 0.00 64.21 62.63 2w0s n SER 117 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2w0s n GLY 118 N 5.40 1.10 3.69 0.46 0.00 -0.62 -4.99 105.19 110.23 2w0s n GLY 118 Ca 0.30 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.00 2w0s n GLY 118 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2w0s s LEU 119 N 0.00 3.07 0.09 0.99 1.43 -0.71 -4.38 118.68 119.16 2w0s s LEU 119 Ca 0.00 2.30 -0.36 0.00 -1.03 0.00 0.00 54.13 55.03 2w0s s LEU 119 Cb 0.00 -4.58 -0.17 0.00 0.03 0.00 0.00 46.19 41.47 2w0s s LEU 119 CO 0.00 -2.74 1.24 -2.65 0.23 0.00 0.00 176.35 172.43 2w0s n PRO 120 N -3.52 0.90 -3.35 1.29 -0.02 -1.26 0.11 135.00 129.14 2w0s n PRO 120 Ca 0.13 0.32 -0.38 0.00 -2.02 0.00 0.00 63.50 61.55 2w0s n PRO 120 Cb 0.51 -1.90 -0.07 0.00 -0.02 0.00 0.00 33.50 32.02 2w0s n PRO 120 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2w0s s LYS 121 N 0.20 4.20 0.66 -0.52 2.20 0.26 -4.55 119.74 122.19 2w0s s LYS 121 Ca 0.83 0.27 -0.17 0.00 -0.36 0.00 0.00 55.97 56.54 2w0s s LYS 121 Cb -1.00 -3.53 0.00 0.00 -1.51 0.00 0.00 37.83 31.79 2w0s s LYS 121 CO 0.50 -0.04 1.26 -2.14 -0.36 0.00 0.00 175.35 174.57 2w0s s PRO 122 N 1.30 2.48 -0.01 4.03 0.02 -1.26 -4.27 135.00 137.29 2w0s s PRO 122 Ca 0.21 1.96 0.20 0.00 0.02 0.00 0.00 61.00 63.39 2w0s s PRO 122 Cb -0.15 -1.85 -0.25 0.00 0.02 0.00 0.00 34.50 32.27 2w0s s PRO 122 CO 0.08 -1.63 0.73 -0.25 -0.33 0.00 0.00 177.00 175.61 2w0s n ASP 123 N -2.09 0.75 -3.64 2.53 8.00 0.04 -4.72 116.55 117.41 2w0s n ASP 123 Ca 0.15 -0.69 -0.05 0.00 0.71 0.00 0.00 54.79 54.91 2w0s n ASP 123 Cb 0.49 1.27 -0.07 0.00 -0.02 0.00 0.00 41.12 42.79 2w0s n ASP 123 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2w0s s LEU 124 N -3.37 -0.79 -0.24 0.64 2.96 -1.22 -4.61 118.68 112.04 2w0s s LEU 124 Ca 0.03 1.27 0.01 0.00 -0.22 0.00 0.00 54.13 55.22 2w0s s LEU 124 Cb 0.15 2.16 0.06 0.00 0.50 0.00 0.00 46.19 49.06 2w0s s LEU 124 CO 0.83 -0.20 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.91 2w0s s VAL 125 N 1.53 1.60 -0.36 1.68 1.01 0.47 -1.70 120.40 124.63 2w0s s VAL 125 Ca -0.10 -1.26 -0.18 0.00 0.00 0.00 0.00 61.98 60.45 2w0s s VAL 125 Cb -0.05 -1.85 0.00 0.00 0.00 0.00 0.00 36.38 34.49 2w0s s VAL 125 CO -0.18 -0.08 0.49 -0.63 0.00 0.00 0.00 175.10 174.70 2w0s s ILE 126 N 1.36 5.03 -0.24 2.22 1.01 0.11 -1.17 121.20 129.52 2w0s s ILE 126 Ca -0.06 0.19 -0.11 0.00 0.00 0.00 0.00 60.65 60.67 2w0s s ILE 126 Cb -0.19 -3.97 -0.05 0.00 0.01 0.00 0.00 42.46 38.26 2w0s s ILE 126 CO -0.06 -0.26 0.17 0.12 0.00 0.00 0.00 174.94 174.92 2w0s s PHE 127 N 2.34 3.31 -0.37 3.97 5.36 -0.45 -1.15 117.98 130.99 2w0s s PHE 127 Ca 0.17 0.24 -0.16 0.00 -0.96 0.00 0.00 56.93 56.22 2w0s s PHE 127 Cb -0.16 -2.29 0.00 0.00 -0.34 0.00 0.00 43.02 40.23 2w0s s PHE 127 CO 0.14 0.05 0.40 -0.51 -1.46 0.00 0.00 175.22 173.83 2w0s s LEU 128 N 1.11 4.59 0.42 6.12 1.02 -0.51 -0.38 118.68 131.06 2w0s s LEU 128 Ca 0.08 -0.38 -0.25 0.00 0.02 0.00 0.00 54.13 53.60 2w0s s LEU 128 Cb -0.14 -2.37 -0.08 0.00 0.02 0.00 0.00 46.19 43.62 2w0s s LEU 128 CO 0.05 -0.43 1.25 -1.61 0.02 0.00 0.00 176.35 175.63 2w0s s GLU 129 N 2.08 3.90 -0.21 1.70 2.02 -0.68 -4.37 118.70 123.13 2w0s s GLU 129 Ca 0.12 2.02 -0.05 0.00 0.02 0.00 0.00 54.97 57.09 2w0s s GLU 129 Cb -0.17 -2.65 -0.02 0.00 0.10 0.00 0.00 34.13 31.40 2w0s s GLU 129 CO 0.12 -0.51 -0.01 -1.12 0.02 0.00 0.00 175.26 173.76 2w0s s SER 130 N -0.95 4.62 0.00 -0.19 0.01 -1.26 -4.19 113.70 111.74 2w0s s SER 130 Ca 0.59 -0.29 0.00 0.00 1.31 0.00 0.00 55.95 57.56 2w0s s SER 130 Cb -0.35 -1.79 0.00 0.00 0.21 0.00 0.00 66.02 64.09 2w0s s SER 130 CO 0.44 0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.72 2w0s n GLY 131 N 4.53 1.36 0.00 3.44 0.00 -1.26 -4.66 105.19 108.60 2w0s n GLY 131 Ca -0.17 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.22 2w0s n GLY 131 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2w0s n SER 132 N 0.00 0.00 0.00 1.61 2.88 -1.26 -2.36 113.62 114.49 2w0s n SER 132 Ca 0.00 0.87 0.01 0.00 -1.33 0.00 0.00 58.87 58.42 2w0s n SER 132 Cb 0.00 -0.39 0.07 0.00 -0.75 0.00 0.00 64.21 63.15 2w0s n SER 132 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2w0s n LYS 133 N -1.66 0.25 -0.07 -1.46 3.00 -1.26 -2.59 118.16 114.37 2w0s n LYS 133 Ca 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 58.31 58.16 2w0s n LYS 133 Cb 0.00 -1.15 -0.05 0.00 0.00 0.00 0.00 35.03 33.82 2w0s n LYS 133 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2w0s n GLU 134 N -0.65 0.31 -0.07 1.64 4.71 -1.21 -4.25 120.64 121.12 2w0s n GLU 134 Ca 0.02 0.13 -0.09 0.00 -0.01 0.00 0.00 57.16 57.21 2w0s n GLU 134 Cb 0.01 -1.05 -0.02 0.00 -1.01 0.00 0.00 31.44 29.37 2w0s n GLU 134 CO 0.00 0.00 0.00 0.82 0.09 0.00 0.00 177.13 178.04 2w0s h ILE 135 N -0.47 1.04 0.00 -3.67 2.04 -1.27 -1.59 117.51 113.60 2w0s h ILE 135 Ca -0.36 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.38 2w0s h ILE 135 Cb 1.34 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 38.09 2w0s h ILE 135 CO -0.21 0.06 0.00 0.59 0.00 0.00 0.00 178.15 178.60 2w0s n ASN 136 N -4.92 0.17 0.17 1.72 4.13 -1.07 -1.50 115.26 113.97 2w0s n ASN 136 Ca -0.02 -1.39 0.12 0.00 1.68 0.00 0.00 54.58 54.97 2w0s n ASN 136 Cb 0.04 -0.09 0.18 0.00 -1.54 0.00 0.00 39.78 38.37 2w0s n ASN 136 CO 0.00 0.00 0.00 0.03 0.28 0.00 0.00 177.26 177.57 2w0s h ARG 137 N 0.08 0.00 -6.22 3.52 2.47 -1.46 -3.45 114.38 109.32 2w0s h ARG 137 Ca 0.00 0.00 -0.53 0.00 -1.26 0.00 0.00 59.98 58.19 2w0s h ARG 137 Cb 0.09 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 28.36 2w0s h ARG 137 CO 0.00 0.00 1.21 -0.80 0.56 0.00 0.00 179.97 180.94 2w0s s ASN 138 N -5.70 5.77 -0.22 7.04 0.01 -0.56 -4.86 114.94 116.43 2w0s s ASN 138 Ca 0.06 0.26 0.14 0.00 -0.71 0.00 0.00 52.86 52.61 2w0s s ASN 138 Cb 0.07 -2.54 0.46 0.00 0.41 0.00 0.00 41.25 39.66 2w0s s ASN 138 CO 0.68 -2.00 1.36 1.33 -1.51 0.00 0.00 177.10 176.96 2w0s n VAL 139 N 6.96 2.30 -2.40 1.60 0.24 -1.26 -4.47 118.33 121.32 2w0s n VAL 139 Ca 0.15 -2.45 -0.21 0.00 -2.04 0.00 0.00 64.34 59.79 2w0s n VAL 139 Cb 0.50 -0.28 -0.01 0.00 -1.47 0.00 0.00 33.84 32.59 2w0s n VAL 139 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2w0s n GLY 140 N -1.00 -0.49 0.21 7.63 0.00 0.35 -4.85 105.19 107.05 2w0s n GLY 140 Ca 0.25 -0.01 0.07 0.00 0.00 0.00 0.00 46.02 46.33 2w0s n GLY 140 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2w0s h GLU 141 N -0.00 0.00 -5.61 1.61 4.11 -1.94 -3.44 114.58 109.30 2w0s h GLU 141 Ca -0.49 0.00 -0.59 0.00 0.07 0.00 0.00 59.36 58.34 2w0s h GLU 141 Cb 1.37 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.48 2w0s h GLU 141 CO 0.58 0.28 -0.62 -1.21 0.07 0.00 0.00 179.01 178.12 2w0s s GLU 142 N -4.00 1.86 0.09 1.06 2.02 -1.26 -4.87 118.70 113.60 2w0s s GLU 142 Ca -0.02 -2.03 -0.21 0.00 0.02 0.00 0.00 54.97 52.73 2w0s s GLU 142 Cb 0.13 -1.48 -0.10 0.00 0.10 0.00 0.00 34.13 32.77 2w0s s GLU 142 CO 0.66 -0.04 1.68 0.97 0.02 0.00 0.00 175.26 178.55 2w0s h ILE 143 N 1.90 1.10 -0.00 -1.63 2.10 -1.43 -2.09 117.51 117.46 2w0s h ILE 143 Ca -0.43 -0.28 0.00 0.00 1.08 0.00 0.00 64.86 65.23 2w0s h ILE 143 Cb 1.24 1.04 0.00 0.00 -1.09 0.00 0.00 36.82 38.01 2w0s h ILE 143 CO 0.77 0.09 -0.02 -1.22 -1.08 0.00 0.00 178.15 176.69 2w0s n TYR 144 N -4.94 0.00 -1.18 2.19 4.01 -1.26 -4.58 117.16 111.40 2w0s n TYR 144 Ca -0.05 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.34 2w0s n TYR 144 Cb 0.08 -0.07 -0.03 0.00 -0.31 0.00 0.00 39.34 39.01 2w0s n TYR 144 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 2w0s n GLU 145 N -0.79 2.44 -3.84 -0.72 1.02 -0.79 -4.59 120.64 113.36 2w0s n GLU 145 Ca 0.20 -1.96 -0.23 0.00 -0.02 0.00 0.00 57.16 55.15 2w0s n GLU 145 Cb 0.21 -2.83 -0.17 0.00 -0.02 0.00 0.00 31.44 28.62 2w0s n GLU 145 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2w0s s ASP 146 N 3.53 1.49 0.26 1.62 2.15 -1.26 -0.49 116.67 123.96 2w0s s ASP 146 Ca 0.52 -0.10 -0.07 0.00 0.43 0.00 0.00 52.55 53.33 2w0s s ASP 146 Cb 0.14 -0.46 0.46 0.00 -0.30 0.00 0.00 42.92 42.76 2w0s s ASP 146 CO -0.01 -0.16 1.59 0.58 -0.17 0.00 0.00 175.17 177.00 2w0s h VAL 147 N 6.29 0.17 -0.21 1.11 2.07 -1.87 0.11 116.25 123.91 2w0s h VAL 147 Ca -0.24 -0.01 -0.09 0.00 0.82 0.00 0.00 66.70 67.19 2w0s h VAL 147 Cb 1.13 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 2w0s h VAL 147 CO 0.31 0.00 -0.24 0.71 0.02 0.00 0.00 177.57 178.37 2w0s h THR 148 N 0.03 1.26 -0.00 2.57 1.35 -1.97 -2.54 112.91 113.60 2w0s h THR 148 Ca 0.45 -1.20 -0.14 0.00 -0.55 0.00 0.00 66.41 64.97 2w0s h THR 148 Cb 0.77 1.36 0.01 0.00 -1.73 0.00 0.00 68.15 68.56 2w0s h THR 148 CO -0.84 0.38 -0.54 0.15 -0.25 0.00 0.00 175.52 174.41 2w0s h PHE 149 N 0.36 0.55 -0.87 4.73 3.57 -1.21 -3.24 116.94 120.83 2w0s h PHE 149 Ca 0.06 -0.30 0.12 0.00 3.53 0.00 0.00 57.97 61.38 2w0s h PHE 149 Cb 0.62 -0.06 -0.08 0.00 2.79 0.00 0.00 35.95 39.22 2w0s h PHE 149 CO 0.02 1.12 0.49 1.96 -2.23 0.00 0.00 178.31 179.66 2w0s h GLN 150 N -0.17 0.73 -0.60 1.11 1.08 -1.05 0.33 115.11 116.55 2w0s h GLN 150 Ca -0.07 -0.04 0.15 0.00 -1.45 0.00 0.00 58.65 57.24 2w0s h GLN 150 Cb 1.26 -0.17 -0.03 0.00 -0.05 0.00 0.00 27.48 28.50 2w0s h GLN 150 CO 0.11 0.48 0.42 0.37 -0.95 0.00 0.00 178.83 179.26 2w0s h GLN 151 N 0.75 0.14 0.03 1.46 5.75 -1.50 -1.03 115.11 120.70 2w0s h GLN 151 Ca 0.45 -0.01 -0.25 0.00 -0.15 0.00 0.00 58.65 58.68 2w0s h GLN 151 Cb 0.52 -0.03 0.02 0.00 1.07 0.00 0.00 27.48 29.06 2w0s h GLN 151 CO -0.30 0.09 -1.01 0.87 -2.65 0.00 0.00 178.83 175.83 2w0s h LYS 152 N 0.14 0.64 -0.81 1.69 1.79 -0.40 -3.13 116.57 116.49 2w0s h LYS 152 Ca 0.29 -0.72 0.01 0.00 -2.18 0.00 0.00 60.65 58.05 2w0s h LYS 152 Cb 0.94 0.21 -0.04 0.00 -1.58 0.00 0.00 32.23 31.76 2w0s h LYS 152 CO -0.04 1.31 0.53 0.28 -1.08 0.00 0.00 179.45 180.45 2w0s h VAL 153 N 0.28 1.19 -0.76 0.50 2.07 -0.33 -2.75 116.25 116.44 2w0s h VAL 153 Ca -0.13 -0.37 0.03 0.00 0.82 0.00 0.00 66.70 67.05 2w0s h VAL 153 Cb 1.68 0.01 -0.04 0.00 -1.52 0.00 0.00 31.29 31.42 2w0s h VAL 153 CO 0.20 0.20 0.50 0.25 0.02 0.00 0.00 177.57 178.74 2w0s h LEU 154 N 1.08 0.81 -0.95 2.57 5.85 -1.25 0.13 115.31 123.55 2w0s h LEU 154 Ca 0.30 -0.01 0.07 0.00 0.84 0.00 0.00 57.88 59.08 2w0s h LEU 154 Cb -0.09 -0.19 -0.07 0.00 0.37 0.00 0.00 40.66 40.68 2w0s h LEU 154 CO -0.08 0.56 0.61 1.56 -0.34 0.00 0.00 178.44 180.75 2w0s h GLN 155 N 0.95 1.06 0.01 1.25 1.08 -1.43 -0.99 115.11 117.04 2w0s h GLN 155 Ca 0.30 -0.06 -0.20 0.00 -1.45 0.00 0.00 58.65 57.24 2w0s h GLN 155 Cb 0.03 -0.24 -0.01 0.00 -0.05 0.00 0.00 27.48 27.21 2w0s h GLN 155 CO -0.08 0.70 -0.90 0.93 -0.95 0.00 0.00 178.83 178.53 2w0s h GLU 156 N 1.09 0.20 0.46 1.46 4.39 -0.78 -2.76 114.58 118.64 2w0s h GLU 156 Ca 0.42 -0.22 -0.02 0.00 0.34 0.00 0.00 59.36 59.87 2w0s h GLU 156 Cb 0.19 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.91 2w0s h GLU 156 CO -0.18 0.97 -0.22 1.88 -1.16 0.00 0.00 179.01 180.30 2w0s h TYR 157 N 0.10 -0.58 -0.78 4.33 0.99 -0.72 -2.87 116.97 117.45 2w0s h TYR 157 Ca -0.05 -0.01 0.17 0.00 2.00 0.00 0.00 58.73 60.84 2w0s h TYR 157 Cb 1.54 0.19 -0.11 0.00 1.00 0.00 0.00 36.73 39.35 2w0s h TYR 157 CO 0.03 -0.27 0.25 0.87 -0.00 0.00 0.00 178.16 179.05 2w0s h LYS 158 N -0.85 0.32 -0.50 4.88 1.79 -1.25 -0.63 116.57 120.34 2w0s h LYS 158 Ca -0.06 -0.02 0.09 0.00 -2.18 0.00 0.00 60.65 58.48 2w0s h LYS 158 Cb 0.57 -0.07 -0.08 0.00 -1.58 0.00 0.00 32.23 31.07 2w0s h LYS 158 CO 0.10 0.21 0.04 0.87 -1.08 0.00 0.00 179.45 179.60 2w0s h LYS 159 N 0.33 0.15 -0.28 3.15 1.57 -1.42 -1.96 116.57 118.13 2w0s h LYS 159 Ca 0.45 -0.01 -0.14 0.00 -1.87 0.00 0.00 60.65 59.08 2w0s h LYS 159 Cb 0.78 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.04 2w0s h LYS 159 CO -0.50 0.10 -0.39 0.52 -0.57 0.00 0.00 179.45 178.62 2w0s h MET 160 N 0.16 0.65 0.09 3.15 2.86 -0.92 -2.89 114.93 118.02 2w0s h MET 160 Ca 0.25 -0.32 0.01 0.00 -2.06 0.00 0.00 59.70 57.58 2w0s h MET 160 Cb 0.37 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.01 2w0s h MET 160 CO -0.38 0.92 -0.16 0.82 1.06 0.00 0.00 176.91 179.17 2w0s h ILE 161 N 0.53 0.63 0.00 -1.22 2.04 -1.03 -2.51 117.51 115.96 2w0s h ILE 161 Ca 0.05 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.91 2w0s h ILE 161 Cb 0.90 0.63 0.00 0.00 -0.74 0.00 0.00 36.82 37.62 2w0s h ILE 161 CO 0.08 0.00 0.06 -0.33 0.00 0.00 0.00 178.15 177.96 2w0s h GLU 162 N -0.31 0.00 -0.00 2.37 5.08 -1.16 0.36 114.58 120.93 2w0s h GLU 162 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2w0s h GLU 162 Cb 0.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.58 2w0s h GLU 162 CO -0.09 0.00 -0.09 0.39 -1.00 0.00 0.00 179.01 178.22 2w0s n GLU 163 N -2.39 0.71 -0.03 2.33 1.02 -0.94 -4.98 120.64 116.35 2w0s n GLU 163 Ca -0.02 -0.22 -0.01 0.00 -0.02 0.00 0.00 57.16 56.90 2w0s n GLU 163 Cb 0.10 -1.50 -0.00 0.00 -0.02 0.00 0.00 31.44 30.02 2w0s n GLU 163 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2w0s n GLY 164 N 1.26 -0.01 0.42 0.62 0.00 0.13 -4.71 105.19 102.90 2w0s n GLY 164 Ca 0.15 0.01 0.05 0.00 0.00 0.00 0.00 46.02 46.23 2w0s n GLY 164 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2w0s n ASP 165 N 0.15 1.94 -4.45 1.61 3.85 -1.26 -4.97 116.55 113.42 2w0s n ASP 165 Ca 0.01 -1.48 -0.33 0.00 -0.71 0.00 0.00 54.79 52.29 2w0s n ASP 165 Cb 0.00 -0.02 -0.13 0.00 -1.35 0.00 0.00 41.12 39.62 2w0s n ASP 165 CO 0.00 0.00 0.00 -0.63 -1.01 0.00 0.00 177.20 175.56 2w0s s ILE 166 N -0.86 3.08 -0.54 2.12 -1.09 -1.26 -5.07 121.20 117.57 2w0s s ILE 166 Ca 0.13 -0.70 -0.28 0.00 -2.23 0.00 0.00 60.65 57.57 2w0s s ILE 166 Cb 0.09 -2.23 0.00 0.00 -1.58 0.00 0.00 42.46 38.74 2w0s s ILE 166 CO 0.13 0.57 1.54 -2.28 -1.23 0.00 0.00 174.94 173.67 2w0s s HIS 167 N -0.41 2.11 -0.11 3.97 5.65 -1.26 -4.99 115.29 120.25 2w0s s HIS 167 Ca 0.05 0.54 -0.04 0.00 0.25 0.00 0.00 55.06 55.86 2w0s s HIS 167 Cb -0.12 -4.31 -0.04 0.00 -1.18 0.00 0.00 32.58 26.94 2w0s s HIS 167 CO 0.02 -2.17 0.05 -1.58 -0.65 0.00 0.00 174.74 170.42 2w0s s TRP 168 N 6.71 3.32 -0.24 3.88 0.52 -1.26 -0.40 118.94 131.48 2w0s s TRP 168 Ca 0.58 0.30 0.02 0.00 0.02 0.00 0.00 56.10 57.03 2w0s s TRP 168 Cb -0.13 -1.86 0.05 0.00 -1.15 0.00 0.00 33.47 30.38 2w0s s TRP 168 CO 0.25 0.54 -0.12 -0.65 0.02 0.00 0.00 176.95 176.99 2w0s s GLN 169 N -0.84 2.32 -0.38 4.98 -1.52 -0.32 -4.90 119.66 119.00 2w0s s GLN 169 Ca 0.13 -1.17 -0.19 0.00 -1.95 0.00 0.00 55.36 52.18 2w0s s GLN 169 Cb -0.12 -2.76 0.01 0.00 -0.22 0.00 0.00 33.01 29.92 2w0s s GLN 169 CO 0.03 -0.49 0.58 0.42 -0.25 0.00 0.00 175.29 175.58 2w0s s ILE 170 N 1.19 4.93 -0.28 1.08 1.01 -1.26 -1.34 121.20 126.52 2w0s s ILE 170 Ca -0.05 0.33 -0.13 0.00 0.00 0.00 0.00 60.65 60.80 2w0s s ILE 170 Cb -0.18 -4.06 -0.04 0.00 0.01 0.00 0.00 42.46 38.19 2w0s s ILE 170 CO -0.07 -0.35 0.29 -0.63 0.00 0.00 0.00 174.94 174.18 2w0s s ILE 171 N 2.58 5.23 0.61 2.92 -1.09 0.49 -4.98 121.20 126.97 2w0s s ILE 171 Ca 0.21 0.32 -0.18 0.00 -2.23 0.00 0.00 60.65 58.77 2w0s s ILE 171 Cb -0.15 -3.64 -0.05 0.00 -1.58 0.00 0.00 42.46 37.04 2w0s s ILE 171 CO 0.15 0.16 0.93 -0.24 -1.23 0.00 0.00 174.94 174.71 2w0s n SER 172 N 5.22 0.59 0.21 3.58 2.88 -1.26 -1.69 113.62 123.14 2w0s n SER 172 Ca -0.11 0.79 0.07 0.00 -1.33 0.00 0.00 58.87 58.29 2w0s n SER 172 Cb 0.51 -1.37 0.44 0.00 -0.75 0.00 0.00 64.21 63.04 2w0s n SER 172 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 2w0s h SER 173 N 0.42 0.00 0.26 -3.46 4.64 -1.94 -3.32 113.55 110.15 2w0s h SER 173 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 2w0s h SER 173 Cb 1.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.46 2w0s h SER 173 CO 0.50 0.30 -0.08 -0.62 -0.87 0.00 0.00 176.83 176.07 2w0s n GLU 174 N -3.63 0.85 -1.21 4.77 1.02 -1.26 -4.84 120.64 116.35 2w0s n GLU 174 Ca -0.01 -0.28 -0.30 0.00 -0.02 0.00 0.00 57.16 56.55 2w0s n GLU 174 Cb 0.42 -1.49 0.13 0.00 -0.02 0.00 0.00 31.44 30.48 2w0s n GLU 174 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 2w0s s PHE 175 N -2.34 2.37 0.07 -0.32 0.40 -1.25 -5.02 117.98 111.88 2w0s s PHE 175 Ca 0.33 1.35 -0.18 0.00 -0.60 0.00 0.00 56.93 57.84 2w0s s PHE 175 Cb 0.20 -3.13 -0.07 0.00 0.51 0.00 0.00 43.02 40.54 2w0s s PHE 175 CO 0.44 -2.24 0.53 -2.00 0.70 0.00 0.00 175.22 172.66 2w0s s GLU 176 N -4.92 4.12 0.14 0.44 2.56 -1.26 -4.86 118.70 114.92 2w0s s GLU 176 Ca 0.63 0.64 -0.23 0.00 0.00 0.00 0.00 54.97 56.01 2w0s s GLU 176 Cb -0.18 -3.20 -0.01 0.00 2.00 0.00 0.00 34.13 32.75 2w0s s GLU 176 CO 0.57 0.63 1.26 0.39 -0.56 0.00 0.00 175.26 177.55 2w0s n GLU 177 N 1.63 -0.33 0.19 4.30 -0.58 -1.26 -0.07 120.64 124.52 2w0s n GLU 177 Ca -0.10 1.24 0.04 0.00 -0.42 0.00 0.00 57.16 57.91 2w0s n GLU 177 Cb 0.51 -1.82 0.44 0.00 -0.57 0.00 0.00 31.44 30.00 2w0s n GLU 177 CO 0.00 0.00 0.00 0.38 -0.48 0.00 0.00 177.13 177.03 2w0s h ASP 178 N 0.00 0.05 0.11 1.62 2.03 -1.99 -0.49 116.42 117.76 2w0s h ASP 178 Ca 0.16 -0.01 -0.29 0.00 -0.73 0.00 0.00 57.03 56.16 2w0s h ASP 178 Cb 0.36 -0.01 0.03 0.00 -0.83 0.00 0.00 39.33 38.88 2w0s h ASP 178 CO -0.78 0.27 -1.22 0.58 -1.03 0.00 0.00 179.24 177.07 2w0s h VAL 179 N 0.05 1.29 0.28 4.15 2.07 -1.13 -2.05 116.25 120.91 2w0s h VAL 179 Ca 0.01 -2.44 -0.01 0.00 0.82 0.00 0.00 66.70 65.08 2w0s h VAL 179 Cb 0.42 2.69 0.00 0.00 -1.52 0.00 0.00 31.29 32.88 2w0s h VAL 179 CO 0.03 0.74 -0.14 0.50 0.02 0.00 0.00 177.57 178.72 2w0s h LYS 180 N 0.26 -0.37 -0.69 1.57 3.64 -0.31 0.40 116.57 121.07 2w0s h LYS 180 Ca -0.18 0.03 0.15 0.00 -1.27 0.00 0.00 60.65 59.37 2w0s h LYS 180 Cb 1.89 0.08 -0.12 0.00 -0.41 0.00 0.00 32.23 33.67 2w0s h LYS 180 CO 0.23 -0.23 -0.02 -0.22 -2.27 0.00 0.00 179.45 176.94 2w0s h LYS 181 N -0.40 0.09 -0.21 1.90 1.63 -1.14 -0.48 116.57 117.96 2w0s h LYS 181 Ca -0.04 -0.01 -0.03 0.00 -0.85 0.00 0.00 60.65 59.73 2w0s h LYS 181 Cb 0.31 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.91 2w0s h LYS 181 CO 0.06 0.06 0.01 0.93 -3.45 0.00 0.00 179.45 177.07 2w0s h GLU 182 N 0.09 0.37 0.08 1.90 4.39 -1.13 -2.18 114.58 118.11 2w0s h GLU 182 Ca 0.37 -0.11 -0.00 0.00 0.34 0.00 0.00 59.36 59.95 2w0s h GLU 182 Cb 0.61 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 29.22 2w0s h GLU 182 CO -0.62 0.54 -0.05 1.25 -1.16 0.00 0.00 179.01 178.97 2w0s h LEU 183 N 0.14 -0.13 0.31 1.33 6.46 -0.18 -1.52 115.31 121.72 2w0s h LEU 183 Ca 0.06 0.01 -0.00 0.00 -0.12 0.00 0.00 57.88 57.83 2w0s h LEU 183 Cb 0.37 0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 40.32 2w0s h LEU 183 CO 0.01 -0.09 -0.27 0.40 -0.62 0.00 0.00 178.44 177.87 2w0s h ILE 184 N -0.13 0.42 -1.32 4.05 2.04 -1.17 -2.16 117.51 119.24 2w0s h ILE 184 Ca -0.01 0.00 0.41 0.00 1.00 0.00 0.00 64.86 66.26 2w0s h ILE 184 Cb 0.12 0.42 -0.11 0.00 -0.74 0.00 0.00 36.82 36.51 2w0s h ILE 184 CO 0.00 0.00 0.87 0.50 0.00 0.00 0.00 178.15 179.52 2w0s h LYS 185 N -0.60 0.12 0.08 2.37 3.11 -1.22 0.18 116.57 120.61 2w0s h LYS 185 Ca -0.02 -0.01 -0.26 0.00 -2.81 0.00 0.00 60.65 57.55 2w0s h LYS 185 Cb 0.54 -0.03 0.02 0.00 -1.00 0.00 0.00 32.23 31.77 2w0s h LYS 185 CO -0.04 0.08 -1.07 -0.91 -2.81 0.00 0.00 179.45 174.70 2w0s h ASN 186 N 0.13 0.81 0.43 4.20 2.35 -0.66 -2.80 115.58 120.03 2w0s h ASN 186 Ca 0.77 -0.81 -0.13 0.00 -0.55 0.00 0.00 56.30 55.58 2w0s h ASN 186 Cb 2.46 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 40.57 2w0s h ASN 186 CO -0.33 1.52 -0.57 0.16 -1.65 0.00 0.00 177.43 176.56 2w0s h ILE 187 N 0.19 1.39 0.52 2.81 3.07 -0.62 -2.68 117.51 122.18 2w0s h ILE 187 Ca -0.16 -1.91 -0.03 0.00 1.55 0.00 0.00 64.86 64.31 2w0s h ILE 187 Cb 1.76 1.98 0.01 0.00 -0.27 0.00 0.00 36.82 40.30 2w0s h ILE 187 CO 0.21 0.56 -0.25 0.58 -1.05 0.00 0.00 178.15 178.20 2w0s h VAL 188 N 0.11 0.44 -0.00 0.16 2.07 -0.78 0.46 116.25 118.70 2w0s h VAL 188 Ca -0.00 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.25 2w0s h VAL 188 Cb 1.03 0.55 -0.00 0.00 -1.52 0.00 0.00 31.29 31.35 2w0s h VAL 188 CO 0.08 0.04 0.00 0.16 0.02 0.00 0.00 177.57 177.88 2w0s h ILE 189 N -0.87 0.84 -0.08 4.57 3.07 -1.55 -1.78 117.51 121.71 2w0s h ILE 189 Ca -0.07 0.00 -0.05 0.00 1.55 0.00 0.00 64.86 66.29 2w0s h ILE 189 Cb 0.60 1.00 -0.00 0.00 -0.27 0.00 0.00 36.82 38.15 2w0s h ILE 189 CO 0.12 0.00 -0.14 -0.08 -1.05 0.00 0.00 178.15 177.00 2w0s h GLU 190 N 0.00 0.24 -1.09 0.16 4.81 -1.13 -2.56 114.58 115.00 2w0s h GLU 190 Ca 0.00 -0.15 0.31 0.00 -0.13 0.00 0.00 59.36 59.39 2w0s h GLU 190 Cb 0.01 0.01 -0.11 0.00 0.63 0.00 0.00 28.75 29.29 2w0s h GLU 190 CO -0.00 0.72 0.70 0.00 -0.73 0.00 0.00 179.01 179.69 2w0s h ALA 191 N 0.52 2.29 0.06 2.92 0.00 -0.07 -0.96 119.26 124.01 2w0s h ALA 191 Ca 0.01 0.09 -0.25 0.00 0.00 0.00 0.00 54.91 54.75 2w0s h ALA 191 Cb 0.70 0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.57 2w0s h ALA 191 CO 0.03 -0.77 -1.08 0.82 0.00 0.00 0.00 179.25 178.26 2w0s h ILE 192 N 0.33 1.41 0.00 0.00 2.04 -1.19 -3.11 117.51 117.00 2w0s h ILE 192 Ca 0.66 -2.64 -0.23 0.00 1.00 0.00 0.00 64.86 63.65 2w0s h ILE 192 Cb 1.74 2.62 -0.03 0.00 -0.74 0.00 0.00 36.82 40.40 2w0s h ILE 192 CO -0.36 0.78 -1.14 0.45 0.00 0.00 0.00 178.15 177.88 2w0s h HIS 193 N 0.19 0.01 -0.31 1.37 3.86 -1.00 -3.34 115.15 115.93 2w0s h HIS 193 Ca -0.11 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.09 2w0s h HIS 193 Cb 1.75 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.22 2w0s h HIS 193 CO 0.07 1.01 0.00 0.25 0.86 0.00 0.00 177.93 180.12 2w0s n THR 194 N -3.30 0.55 -2.99 2.45 -2.24 -0.42 -4.94 114.28 103.40 2w0s n THR 194 Ca -0.03 -0.46 -0.40 0.00 -2.27 0.00 0.00 64.05 60.89 2w0s n THR 194 Cb 0.96 0.12 -0.06 0.00 -2.10 0.00 0.00 70.33 69.26 2w0s n THR 194 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2w0s s VAL 195 N -1.60 4.53 0.03 2.28 1.01 -1.18 -5.03 120.40 120.44 2w0s s VAL 195 Ca 0.22 1.67 -0.10 0.00 0.00 0.00 0.00 61.98 63.77 2w0s s VAL 195 Cb 0.12 -4.13 0.01 0.00 0.00 0.00 0.00 36.38 32.38 2w0s s VAL 195 CO 0.14 0.46 0.21 0.42 0.00 0.00 0.00 175.10 176.32 2w0s s THR 196 N -0.69 0.10 0.00 3.92 -4.23 -1.26 -4.69 115.64 108.79 2w0s s THR 196 Ca 0.37 -0.82 0.00 0.00 -1.18 0.00 0.00 61.69 60.05 2w0s s THR 196 Cb -0.22 -0.85 0.00 0.00 1.34 0.00 0.00 72.50 72.77 2w0s s THR 196 CO 0.25 -0.45 0.00 0.61 -0.54 0.00 0.00 174.62 174.48 2w0s n GLY 197 N 0.79 -1.81 3.85 3.99 0.00 -1.26 -4.94 105.19 105.81 2w0s n GLY 197 Ca -0.19 -1.82 -0.32 0.00 0.00 0.00 0.00 46.02 43.68 2w0s n GLY 197 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2w0s s PRO 198 N 0.00 3.95 0.17 1.61 0.04 -1.26 -4.69 135.00 134.82 2w0s s PRO 198 Ca 0.00 0.78 -0.32 0.00 0.04 0.00 0.00 61.00 61.50 2w0s s PRO 198 Cb 0.00 -2.28 -0.11 0.00 0.04 0.00 0.00 34.50 32.15 2w0s s PRO 198 CO 0.00 -0.08 1.78 0.28 0.04 0.00 0.00 177.00 179.02 2w0s n VAL 199 N -1.13 0.16 -1.60 -0.36 0.31 -1.26 -4.99 118.33 109.46 2w0s n VAL 199 Ca 0.05 -0.03 -0.31 0.00 -0.01 0.00 0.00 64.34 64.04 2w0s n VAL 199 Cb 0.54 -2.06 0.05 0.00 -0.91 0.00 0.00 33.84 31.47 2w0s n VAL 199 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2w0s s GLY 200 N 1.86 1.66 -0.15 2.92 0.00 -1.26 -4.86 107.32 107.49 2w0s s GLY 200 Ca 0.78 0.00 -0.04 0.00 0.00 0.00 0.00 44.72 45.46 2w0s s GLY 200 CO 0.34 0.33 -0.03 1.20 0.00 0.00 0.00 173.10 174.95 2w0s s GLN 201 N -5.09 3.67 0.25 2.90 -0.21 -1.26 0.90 119.66 120.83 2w0s s GLN 201 Ca 0.58 -0.50 -0.30 0.00 0.02 0.00 0.00 55.36 55.17 2w0s s GLN 201 Cb -0.14 -2.94 -0.09 0.00 1.00 0.00 0.00 33.01 30.84 2w0s s GLN 201 CO 0.55 0.27 1.26 -1.17 -2.12 0.00 0.00 175.29 174.08 2w0s s LEU 202 N 0.30 4.45 -1.56 2.90 2.96 0.31 -3.80 118.68 124.23 2w0s s LEU 202 Ca -0.03 2.44 -0.07 0.00 -0.22 0.00 0.00 54.13 56.25 2w0s s LEU 202 Cb -0.14 -3.62 0.07 0.00 0.50 0.00 0.00 46.19 42.99 2w0s s LEU 202 CO 0.03 -0.45 0.47 0.79 -1.32 0.00 0.00 176.35 175.87 2w0s n TRP 203 N 1.87 -1.57 -0.10 5.38 8.01 -1.26 -1.60 117.44 128.17 2w0s n TRP 203 Ca 0.03 0.73 0.00 0.00 -1.31 0.00 0.00 57.50 56.95 2w0s n TRP 203 Cb 0.43 -3.19 0.00 0.00 -2.01 0.00 0.00 31.31 26.54 2w0s n TRP 203 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.69 175.35