#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 -2.72 0.96 -1.46 1.70 -1.26 -4.72 118.95 111.45 2w0s s ARG 3 Ca 0.00 0.14 -0.14 0.00 -0.47 0.00 0.00 55.73 55.26 2w0s s ARG 3 Cb 0.00 -1.40 0.17 0.00 -0.57 0.00 0.00 34.95 33.15 2w0s s ARG 3 CO 0.00 -4.74 1.17 0.20 -1.08 0.00 0.00 175.30 170.86 2w0s s GLY 4 N -3.19 1.62 -0.03 3.88 0.00 -0.51 -4.85 107.32 104.23 2w0s s GLY 4 Ca 0.69 -0.75 -0.02 0.00 0.00 0.00 0.00 44.72 44.64 2w0s s GLY 4 CO 0.58 -0.09 0.12 0.00 0.00 0.00 0.00 173.10 173.71 2w0s s ALA 5 N -3.38 3.75 -0.48 3.20 0.00 -1.26 -4.84 121.76 118.75 2w0s s ALA 5 Ca 0.67 -0.79 -0.18 0.00 0.00 0.00 0.00 51.96 51.66 2w0s s ALA 5 Cb -0.11 -1.75 0.05 0.00 0.00 0.00 0.00 23.12 21.31 2w0s s ALA 5 CO 0.53 0.69 0.53 -1.17 0.00 0.00 0.00 175.76 176.35 2w0s s LEU 6 N -1.64 5.11 -0.21 0.00 2.96 -1.26 -0.23 118.68 123.42 2w0s s LEU 6 Ca 0.23 -0.96 -0.04 0.00 -0.22 0.00 0.00 54.13 53.14 2w0s s LEU 6 Cb -0.12 -2.37 -0.02 0.00 0.50 0.00 0.00 46.19 44.18 2w0s s LEU 6 CO 0.13 -0.76 -0.03 -0.63 -1.32 0.00 0.00 176.35 173.74 2w0s s ILE 7 N 2.28 3.58 -0.10 6.68 1.01 0.77 -0.71 121.20 134.70 2w0s s ILE 7 Ca 0.12 -0.43 0.02 0.00 0.00 0.00 0.00 60.65 60.35 2w0s s ILE 7 Cb -0.20 -2.61 -0.02 0.00 0.01 0.00 0.00 42.46 39.64 2w0s s ILE 7 CO 0.11 0.43 -0.15 -0.69 0.00 0.00 0.00 174.94 174.64 2w0s s VAL 8 N 1.21 2.88 -0.16 2.92 1.01 -0.55 -1.05 120.40 126.65 2w0s s VAL 8 Ca 0.03 -0.74 -0.14 0.00 0.00 0.00 0.00 61.98 61.13 2w0s s VAL 8 Cb -0.14 -2.17 -0.05 0.00 0.00 0.00 0.00 36.38 34.02 2w0s s VAL 8 CO -0.00 0.55 0.28 -0.36 0.00 0.00 0.00 175.10 175.57 2w0s s PHE 9 N 0.08 3.45 0.35 5.22 0.40 0.12 0.01 117.98 127.61 2w0s s PHE 9 Ca -0.07 0.58 0.03 0.00 -0.60 0.00 0.00 56.93 56.88 2w0s s PHE 9 Cb -0.15 -2.33 -0.05 0.00 0.51 0.00 0.00 43.02 41.00 2w0s s PHE 9 CO 0.05 0.23 0.08 -1.21 0.70 0.00 0.00 175.22 175.07 2w0s s GLU 10 N 0.48 1.72 0.00 0.44 0.41 0.12 -1.14 118.70 120.73 2w0s s GLU 10 Ca 0.16 -1.99 0.00 0.00 -0.41 0.00 0.00 54.97 52.73 2w0s s GLU 10 Cb -0.13 -0.75 0.00 0.00 -1.78 0.00 0.00 34.13 31.47 2w0s s GLU 10 CO 0.03 -0.28 0.00 0.41 -0.49 0.00 0.00 175.26 174.93 2w0s n GLY 11 N -0.74 2.17 3.62 -1.39 0.00 -1.26 -1.48 105.19 106.10 2w0s n GLY 11 Ca -0.03 -1.56 -0.29 0.00 0.00 0.00 0.00 46.02 44.13 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 1.04 0.47 0.99 1.43 -1.26 -4.95 118.68 116.40 2w0s s LEU 12 Ca 0.00 0.91 -0.23 0.00 -1.03 0.00 0.00 54.13 53.78 2w0s s LEU 12 Cb 0.00 -2.84 -0.07 0.00 0.03 0.00 0.00 46.19 43.31 2w0s s LEU 12 CO 0.00 -3.73 1.26 -1.81 0.23 0.00 0.00 176.35 172.30 2w0s s ASP 13 N -3.63 5.93 -0.79 2.29 1.01 -1.26 -3.04 116.67 117.18 2w0s s ASP 13 Ca 0.68 2.53 0.00 0.00 0.71 0.00 0.00 52.55 56.47 2w0s s ASP 13 Cb -0.14 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.16 2w0s s ASP 13 CO 0.57 -1.10 0.00 0.29 0.21 0.00 0.00 175.17 175.14 2w0s n LYS 14 N -0.50 -0.91 0.00 8.23 4.76 -1.26 -4.84 118.16 123.64 2w0s n LYS 14 Ca 0.07 0.68 0.15 0.00 -2.87 0.00 0.00 58.31 56.35 2w0s n LYS 14 Cb 0.46 -4.61 0.79 0.00 -1.84 0.00 0.00 35.03 29.82 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 -0.11 0.25 -0.25 4.39 3.41 -1.17 -4.82 113.62 115.32 2w0s n SER 15 Ca -0.07 -0.75 -0.03 0.00 -0.26 0.00 0.00 58.87 57.76 2w0s n SER 15 Cb 0.34 -0.09 -0.01 0.00 -0.26 0.00 0.00 64.21 64.20 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 1.15 0.58 0.24 5.00 0.00 -1.26 -4.91 105.19 105.99 2w0s n GLY 16 Ca 0.19 -0.92 0.10 0.00 0.00 0.00 0.00 46.02 45.38 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 -0.30 1.61 2.10 -1.91 -2.07 116.57 116.00 2w0s h LYS 17 Ca -0.06 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.56 2w0s h LYS 17 Cb 0.29 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.60 2w0s h LYS 17 CO 0.09 0.17 0.10 1.15 -2.00 0.00 0.00 179.45 178.96 2w0s h THR 18 N 0.00 1.20 0.05 0.07 2.02 -1.99 -0.66 112.91 113.60 2w0s h THR 18 Ca -0.00 -0.64 0.02 0.00 0.77 0.00 0.00 66.41 66.56 2w0s h THR 18 Cb 0.39 1.06 -0.05 0.00 -1.74 0.00 0.00 68.15 67.80 2w0s h THR 18 CO 0.02 0.22 -0.47 0.74 0.37 0.00 0.00 175.52 176.40 2w0s h THR 19 N 0.33 0.09 -0.44 3.16 2.02 -1.80 -0.91 112.91 115.35 2w0s h THR 19 Ca 0.10 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.30 2w0s h THR 19 Cb 0.24 0.09 -0.02 0.00 -1.74 0.00 0.00 68.15 66.71 2w0s h THR 19 CO -0.00 0.00 0.29 1.56 0.37 0.00 0.00 175.52 177.74 2w0s h GLN 20 N -0.65 0.52 -0.85 6.66 1.08 -1.33 0.24 115.11 120.79 2w0s h GLN 20 Ca 0.03 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2w0s h GLN 20 Cb 0.70 -0.12 -0.04 0.00 -0.05 0.00 0.00 27.48 27.97 2w0s h GLN 20 CO -0.31 0.35 0.54 0.00 -0.95 0.00 0.00 178.83 178.46 2w0s h MET 22 N 1.15 0.72 0.13 0.00 2.86 0.86 -2.04 114.93 118.61 2w0s h MET 22 Ca 0.31 -0.04 0.02 0.00 -2.06 0.00 0.00 59.70 57.92 2w0s h MET 22 Cb -0.10 -0.16 -0.03 0.00 0.06 0.00 0.00 31.60 31.36 2w0s h MET 22 CO -0.06 0.48 -0.27 -0.91 1.06 0.00 0.00 176.91 177.20 2w0s h ASN 23 N 0.74 -0.77 -0.94 1.22 2.35 -0.91 -2.38 115.58 114.90 2w0s h ASN 23 Ca 0.26 0.09 0.12 0.00 -0.55 0.00 0.00 56.30 56.22 2w0s h ASN 23 Cb 0.04 0.29 -0.07 0.00 0.05 0.00 0.00 38.32 38.63 2w0s h ASN 23 CO -0.11 -0.36 0.60 0.40 -1.65 0.00 0.00 177.43 176.30 2w0s h ILE 24 N -0.49 0.91 0.00 2.81 5.03 -1.20 0.21 117.51 124.77 2w0s h ILE 24 Ca 0.03 -0.30 -0.07 0.00 -0.12 0.00 0.00 64.86 64.40 2w0s h ILE 24 Cb 0.51 -0.04 -0.01 0.00 -3.03 0.00 0.00 36.82 34.25 2w0s h ILE 24 CO -0.15 0.16 -0.34 0.24 -0.68 0.00 0.00 178.15 177.38 2w0s h MET 25 N 0.87 0.00 0.02 2.37 2.86 -1.01 -2.73 114.93 117.31 2w0s h MET 25 Ca 0.46 0.00 -0.28 0.00 -2.06 0.00 0.00 59.70 57.82 2w0s h MET 25 Cb 0.54 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.16 2w0s h MET 25 CO -0.22 0.34 -1.55 0.93 1.06 0.00 0.00 176.91 177.46 2w0s h GLU 26 N 0.00 0.05 0.00 1.72 5.08 -0.60 -3.36 114.58 117.47 2w0s h GLU 26 Ca -0.00 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2w0s h GLU 26 Cb 0.64 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.92 2w0s h GLU 26 CO 0.04 0.72 0.00 0.43 -1.00 0.00 0.00 179.01 179.21 2w0s n SER 27 N -3.19 0.00 -4.03 1.42 7.64 0.56 -4.85 113.62 111.17 2w0s n SER 27 Ca -0.14 0.27 -0.15 0.00 1.01 0.00 0.00 58.87 59.85 2w0s n SER 27 Cb 1.03 -0.42 -0.13 0.00 -1.01 0.00 0.00 64.21 63.68 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 -2.83 0.58 0.18 0.44 1.01 -1.05 -5.06 121.20 114.46 2w0s s ILE 28 Ca 0.18 -0.71 -0.31 0.00 0.00 0.00 0.00 60.65 59.81 2w0s s ILE 28 Cb 0.18 -0.56 -0.10 0.00 0.01 0.00 0.00 42.46 41.99 2w0s s ILE 28 CO 0.46 -0.11 1.53 -2.84 0.00 0.00 0.00 174.94 173.97 2w0s s PRO 29 N -0.90 4.23 0.07 2.79 0.02 -1.26 -4.85 135.00 135.10 2w0s s PRO 29 Ca -0.03 2.33 0.21 0.00 0.02 0.00 0.00 61.00 63.52 2w0s s PRO 29 Cb -0.06 -3.15 0.86 0.00 0.02 0.00 0.00 34.50 32.17 2w0s s PRO 29 CO 0.00 -0.55 1.66 0.00 -0.33 0.00 0.00 177.00 177.78 2w0s n ALA 30 N 3.58 1.89 1.34 -1.55 0.00 -1.26 -2.18 120.51 122.33 2w0s n ALA 30 Ca 0.12 -0.04 0.11 0.00 0.00 0.00 0.00 53.44 53.64 2w0s n ALA 30 Cb 0.39 -1.34 0.65 0.00 0.00 0.00 0.00 19.45 19.15 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 -1.71 0.00 0.00 0.00 3.02 -1.26 -3.41 115.26 111.91 2w0s n ASN 31 Ca 0.04 -0.54 0.00 0.00 -0.03 0.00 0.00 54.58 54.05 2w0s n ASN 31 Cb 0.25 -0.08 0.00 0.00 -0.61 0.00 0.00 39.78 39.34 2w0s n ASN 31 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2w0s n THR 32 N -1.08 0.00 -4.13 3.41 -2.24 -0.93 -4.98 114.28 104.33 2w0s n THR 32 Ca 0.16 -0.35 -0.15 0.00 -2.27 0.00 0.00 64.05 61.44 2w0s n THR 32 Cb 0.10 1.06 -0.12 0.00 -2.10 0.00 0.00 70.33 69.27 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 -0.57 0.66 -0.05 2.28 2.07 -1.22 -1.38 121.20 122.99 2w0s s ILE 33 Ca 0.00 -0.95 0.00 0.00 -1.41 0.00 0.00 60.65 58.30 2w0s s ILE 33 Cb 0.00 -0.67 0.02 0.00 0.13 0.00 0.00 42.46 41.94 2w0s s ILE 33 CO 0.00 -0.23 -0.03 -0.75 -1.91 0.00 0.00 174.94 172.02 2w0s s LYS 34 N -1.29 0.77 -0.10 3.50 2.47 -0.30 -4.81 119.74 119.98 2w0s s LYS 34 Ca -0.05 -0.04 -0.19 0.00 -1.56 0.00 0.00 55.97 54.12 2w0s s LYS 34 Cb -0.08 -0.88 -0.04 0.00 -1.46 0.00 0.00 37.83 35.36 2w0s s LYS 34 CO 0.01 -0.15 0.54 -0.47 0.16 0.00 0.00 175.35 175.43 2w0s s TYR 35 N 1.23 3.54 -0.18 4.03 5.04 -1.26 -1.26 117.35 128.49 2w0s s TYR 35 Ca -0.06 1.00 -0.01 0.00 -2.44 0.00 0.00 57.07 55.56 2w0s s TYR 35 Cb -0.14 -2.61 0.05 0.00 0.35 0.00 0.00 41.96 39.61 2w0s s TYR 35 CO -0.02 0.17 -0.03 -1.17 -1.34 0.00 0.00 175.55 173.16 2w0s s LEU 36 N 0.57 1.71 0.05 6.97 0.20 0.44 -4.97 118.68 123.65 2w0s s LEU 36 Ca 0.29 -0.79 -0.16 0.00 0.69 0.00 0.00 54.13 54.15 2w0s s LEU 36 Cb -0.16 -0.89 -0.06 0.00 -0.43 0.00 0.00 46.19 44.65 2w0s s LEU 36 CO 0.13 -0.22 0.49 0.21 -0.29 0.00 0.00 176.35 176.66 2w0s s ASN 37 N 1.64 6.91 -0.03 3.68 3.84 -1.26 -0.73 114.94 128.98 2w0s s ASN 37 Ca -0.01 1.09 0.04 0.00 0.21 0.00 0.00 52.86 54.20 2w0s s ASN 37 Cb -0.16 -2.30 -0.00 0.00 -0.55 0.00 0.00 41.25 38.24 2w0s s ASN 37 CO -0.07 0.27 -0.16 -0.36 -2.79 0.00 0.00 177.10 173.99 2w0s s PHE 38 N -1.15 1.57 0.63 0.43 0.40 0.04 -3.77 117.98 116.14 2w0s s PHE 38 Ca 0.28 -0.41 -0.11 0.00 -0.60 0.00 0.00 56.93 56.09 2w0s s PHE 38 Cb -0.18 -1.05 -0.03 0.00 0.51 0.00 0.00 43.02 42.27 2w0s s PHE 38 CO 0.17 -0.12 1.03 -1.25 0.70 0.00 0.00 175.22 175.75 2w0s s PRO 39 N -0.06 3.51 -1.07 0.24 0.05 -1.26 -4.57 135.00 131.84 2w0s s PRO 39 Ca -0.01 0.78 -0.14 0.00 0.05 0.00 0.00 61.00 61.67 2w0s s PRO 39 Cb -0.10 -2.07 0.18 0.00 0.05 0.00 0.00 34.50 32.57 2w0s s PRO 39 CO 0.01 -0.64 1.22 -1.14 0.05 0.00 0.00 177.00 176.50 2w0s s GLN 40 N -5.16 3.92 0.00 4.56 2.00 -1.25 -4.86 119.66 118.86 2w0s s GLN 40 Ca 0.55 -2.44 0.17 0.00 -2.00 0.00 0.00 55.36 51.64 2w0s s GLN 40 Cb -0.11 -4.87 0.95 0.00 0.80 0.00 0.00 33.01 29.78 2w0s s GLN 40 CO 0.54 -1.63 1.42 0.54 -0.50 0.00 0.00 175.29 175.66 2w0s n ARG 41 N 5.24 0.44 0.10 1.67 1.74 -1.26 -2.87 116.66 121.71 2w0s n ARG 41 Ca 0.28 0.04 -0.16 0.00 -0.77 0.00 0.00 57.85 57.24 2w0s n ARG 41 Cb 0.44 -1.50 -0.14 0.00 -1.02 0.00 0.00 32.46 30.24 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 0.41 -2.10 0.55 4.64 -1.89 -2.72 113.55 112.44 2w0s h SER 42 Ca 0.00 -0.45 -0.17 0.00 -0.47 0.00 0.00 61.79 60.69 2w0s h SER 42 Cb 0.04 -0.13 0.09 0.00 -0.31 0.00 0.00 62.40 62.09 2w0s h SER 42 CO 0.00 1.36 -0.02 0.35 -0.87 0.00 0.00 176.83 177.65 2w0s n THR 43 N -3.52 0.00 -0.11 2.95 -2.24 -1.14 -4.50 114.28 105.73 2w0s n THR 43 Ca -0.09 -0.10 -0.12 0.00 -2.27 0.00 0.00 64.05 61.46 2w0s n THR 43 Cb 1.03 -0.76 -0.03 0.00 -2.10 0.00 0.00 70.33 68.46 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 -2.43 1.29 0.00 2.28 2.07 -1.91 -0.69 116.25 116.86 2w0s h VAL 44 Ca -0.18 -1.28 0.00 0.00 0.82 0.00 0.00 66.70 66.05 2w0s h VAL 44 Cb 0.59 1.45 0.00 0.00 -1.52 0.00 0.00 31.29 31.81 2w0s h VAL 44 CO 0.11 0.41 0.00 0.71 0.02 0.00 0.00 177.57 178.83 2w0s h THR 45 N 0.43 0.00 0.12 2.57 1.35 -1.92 -3.16 112.91 112.31 2w0s h THR 45 Ca 0.07 -0.68 -0.01 0.00 -0.55 0.00 0.00 66.41 65.24 2w0s h THR 45 Cb 0.70 1.66 0.00 0.00 -1.73 0.00 0.00 68.15 68.78 2w0s h THR 45 CO 0.05 0.00 -0.06 1.23 -0.25 0.00 0.00 175.52 176.49 2w0s h GLY 46 N 3.78 -0.17 1.10 5.82 0.00 -1.62 -1.82 103.07 110.16 2w0s h GLY 46 Ca 0.00 0.06 0.05 0.00 0.00 0.00 0.00 47.33 47.44 2w0s h GLY 46 CO 0.00 -0.06 0.48 0.50 0.00 0.00 0.00 176.54 177.46 2w0s h LYS 47 N -0.79 0.80 -0.23 4.80 1.57 -0.79 0.45 116.57 122.38 2w0s h LYS 47 Ca -0.02 -0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 58.66 2w0s h LYS 47 Cb 0.55 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 2w0s h LYS 47 CO 0.03 0.53 -0.07 0.52 -0.57 0.00 0.00 179.45 179.88 2w0s h MET 48 N 0.82 0.45 -0.95 3.15 2.86 -1.62 -1.53 114.93 118.11 2w0s h MET 48 Ca 0.30 -0.18 0.08 0.00 -2.06 0.00 0.00 59.70 57.84 2w0s h MET 48 Cb 0.15 -0.02 -0.07 0.00 0.06 0.00 0.00 31.60 31.72 2w0s h MET 48 CO -0.09 0.70 0.60 0.82 1.06 0.00 0.00 176.91 180.00 2w0s h ILE 49 N 0.17 1.03 -0.62 -1.22 2.04 -0.18 -2.17 117.51 116.56 2w0s h ILE 49 Ca 0.05 -0.36 0.01 0.00 1.00 0.00 0.00 64.86 65.56 2w0s h ILE 49 Cb 0.55 -0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 36.47 2w0s h ILE 49 CO 0.03 0.19 0.41 -0.78 0.00 0.00 0.00 178.15 178.00 2w0s h ASP 50 N 1.06 0.69 -0.85 1.72 3.58 0.21 -1.40 116.42 121.43 2w0s h ASP 50 Ca 0.43 -0.01 0.01 0.00 0.42 0.00 0.00 57.03 57.88 2w0s h ASP 50 Cb 0.25 -0.17 -0.04 0.00 1.72 0.00 0.00 39.33 41.09 2w0s h ASP 50 CO -0.20 0.50 0.56 0.44 -2.88 0.00 0.00 179.24 177.66 2w0s h ASP 51 N 0.82 0.97 -0.12 2.28 3.32 -0.68 -1.43 116.42 121.58 2w0s h ASP 51 Ca 0.23 -0.02 -0.21 0.00 0.02 0.00 0.00 57.03 57.05 2w0s h ASP 51 Cb -0.06 -0.24 0.01 0.00 0.22 0.00 0.00 39.33 39.25 2w0s h ASP 51 CO -0.06 0.70 -0.72 0.22 -1.72 0.00 0.00 179.24 177.65 2w0s h TYR 52 N 1.14 1.01 -0.09 4.55 3.20 -0.93 0.51 116.97 126.35 2w0s h TYR 52 Ca 0.31 -0.42 -0.17 0.00 3.14 0.00 0.00 58.73 61.59 2w0s h TYR 52 Cb -0.12 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 37.98 2w0s h TYR 52 CO -0.00 1.25 -0.67 -0.07 -1.64 0.00 0.00 178.16 177.02 2w0s h LEU 53 N 0.54 0.46 -1.74 2.82 3.38 -1.04 -2.98 115.31 116.74 2w0s h LEU 53 Ca -0.03 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.65 2w0s h LEU 53 Cb 1.33 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.95 2w0s h LEU 53 CO 0.15 1.00 0.00 0.35 0.09 0.00 0.00 178.44 180.03 2w0s n THR 54 N -3.87 0.90 -2.06 0.22 -2.24 -0.56 -1.19 114.28 105.47 2w0s n THR 54 Ca -0.04 -0.53 -0.20 0.00 -2.27 0.00 0.00 64.05 61.02 2w0s n THR 54 Cb 0.67 -0.19 -0.04 0.00 -2.10 0.00 0.00 70.33 68.67 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 0.32 -1.52 -0.59 -0.78 1.74 -1.07 -4.86 116.66 109.90 2w0s n ARG 55 Ca 0.11 1.07 0.03 0.00 -0.77 0.00 0.00 57.85 58.29 2w0s n ARG 55 Cb 0.51 -5.58 0.22 0.00 -1.02 0.00 0.00 32.46 26.60 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 -2.73 2.34 -3.65 5.56 2.85 0.15 -4.94 118.16 117.74 2w0s n LYS 56 Ca -0.22 -2.98 -0.02 0.00 -1.05 0.00 0.00 58.31 54.04 2w0s n LYS 56 Cb 0.67 -1.82 -0.06 0.00 -0.65 0.00 0.00 35.03 33.18 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 -3.02 0.02 0.33 -1.58 1.02 -1.16 -4.91 119.74 110.44 2w0s s LYS 57 Ca 0.43 0.02 0.10 0.00 0.02 0.00 0.00 55.97 56.54 2w0s s LYS 57 Cb 0.37 0.01 -0.06 0.00 -0.52 0.00 0.00 37.83 37.63 2w0s s LYS 57 CO 0.05 -0.00 -0.12 0.95 -0.92 0.00 0.00 175.35 175.31 2w0s s THR 58 N -0.36 2.29 0.13 2.17 -4.23 -1.26 -4.16 115.64 110.22 2w0s s THR 58 Ca 0.08 -2.24 -0.10 0.00 -1.18 0.00 0.00 61.69 58.25 2w0s s THR 58 Cb -0.04 -2.58 -0.00 0.00 1.34 0.00 0.00 72.50 71.22 2w0s s THR 58 CO -0.14 -0.24 0.26 -0.31 -0.54 0.00 0.00 174.62 173.65 2w0s s TYR 59 N -2.59 0.24 0.12 3.99 1.51 -1.26 -5.08 117.35 114.27 2w0s s TYR 59 Ca 0.32 -0.62 -0.35 0.00 -1.01 0.00 0.00 57.07 55.41 2w0s s TYR 59 Cb 0.01 -0.02 -0.17 0.00 -0.11 0.00 0.00 41.96 41.67 2w0s s TYR 59 CO 0.16 -0.65 1.09 0.09 -1.11 0.00 0.00 175.55 175.13 2w0s n ASN 60 N -0.15 0.70 -0.29 2.29 4.13 -1.26 -4.83 115.26 115.85 2w0s n ASN 60 Ca -0.11 1.14 0.11 0.00 1.68 0.00 0.00 54.58 57.40 2w0s n ASN 60 Cb 0.63 -1.10 0.26 0.00 -1.54 0.00 0.00 39.78 38.03 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 3.16 -0.02 0.11 6.41 3.32 -2.00 -0.60 116.42 126.81 2w0s h ASP 61 Ca -0.44 0.19 -0.08 0.00 0.02 0.00 0.00 57.03 56.72 2w0s h ASP 61 Cb 1.38 0.26 -0.01 0.00 0.22 0.00 0.00 39.33 41.18 2w0s h ASP 61 CO 0.68 -0.14 -0.26 0.45 -1.72 0.00 0.00 179.24 178.25 2w0s h HIS 62 N 0.21 0.28 -0.05 4.55 3.86 -2.00 -1.85 115.15 120.16 2w0s h HIS 62 Ca 0.52 -0.05 -0.05 0.00 -1.16 0.00 0.00 60.37 59.63 2w0s h HIS 62 Cb 1.02 -0.07 0.00 0.00 1.06 0.00 0.00 27.41 29.42 2w0s h HIS 62 CO -0.28 0.50 -0.14 0.97 0.86 0.00 0.00 177.93 179.84 2w0s h ILE 63 N 0.23 1.44 -1.00 2.45 2.10 -1.51 -3.07 117.51 118.15 2w0s h ILE 63 Ca 0.04 -1.53 0.13 0.00 1.08 0.00 0.00 64.86 64.57 2w0s h ILE 63 Cb 0.59 2.32 -0.09 0.00 -1.09 0.00 0.00 36.82 38.56 2w0s h ILE 63 CO 0.04 0.42 0.63 -0.37 -1.08 0.00 0.00 178.15 177.79 2w0s h VAL 64 N -0.34 0.90 -0.78 2.19 -1.51 -0.96 0.21 116.25 115.96 2w0s h VAL 64 Ca -0.00 -0.33 0.16 0.00 -1.23 0.00 0.00 66.70 65.29 2w0s h VAL 64 Cb 0.76 -0.16 -0.10 0.00 -2.13 0.00 0.00 31.29 29.66 2w0s h VAL 64 CO 0.03 0.18 0.30 0.78 -1.23 0.00 0.00 177.57 177.63 2w0s h ASN 65 N 0.97 0.24 1.31 4.19 4.21 -1.30 -1.84 115.58 123.37 2w0s h ASN 65 Ca 0.50 0.12 0.00 0.00 1.21 0.00 0.00 56.30 58.14 2w0s h ASN 65 Cb 0.52 0.11 0.00 0.00 -1.12 0.00 0.00 38.32 37.83 2w0s h ASN 65 CO -0.28 0.06 -0.55 0.17 -1.29 0.00 0.00 177.43 175.55 2w0s h LEU 66 N 0.41 0.00 -0.53 1.61 8.10 -0.59 -2.89 115.31 121.42 2w0s h LEU 66 Ca 0.44 -0.04 -0.02 0.00 0.11 0.00 0.00 57.88 58.37 2w0s h LEU 66 Cb 0.72 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.91 2w0s h LEU 66 CO -0.45 0.02 0.25 -0.07 -4.11 0.00 0.00 178.44 174.09 2w0s h LEU 67 N 0.00 0.70 -0.35 0.17 3.38 -0.20 -1.06 115.31 117.95 2w0s h LEU 67 Ca 0.00 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.77 2w0s h LEU 67 Cb 0.93 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 2w0s h LEU 67 CO 0.00 0.64 -0.05 -0.26 0.09 0.00 0.00 178.44 178.85 2w0s h PHE 68 N 0.71 0.73 0.75 1.13 0.04 -1.42 -0.09 116.94 118.79 2w0s h PHE 68 Ca 0.18 -0.15 -0.04 0.00 2.80 0.00 0.00 57.97 60.77 2w0s h PHE 68 Cb 0.12 -0.18 0.01 0.00 2.20 0.00 0.00 35.95 38.10 2w0s h PHE 68 CO -0.00 0.79 -0.36 0.00 -0.60 0.00 0.00 178.31 178.14 2w0s h ALA 70 N -0.78 1.76 -0.85 0.00 0.00 -1.15 0.36 119.26 118.60 2w0s h ALA 70 Ca -0.10 -0.01 0.12 0.00 0.00 0.00 0.00 54.91 54.91 2w0s h ALA 70 Cb 0.78 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.34 2w0s h ALA 70 CO 0.17 0.09 0.55 -0.97 0.00 0.00 0.00 179.25 179.09 2w0s h ASN 71 N 0.73 0.67 -0.01 0.00 -0.73 -0.79 -2.59 115.58 112.86 2w0s h ASN 71 Ca 0.36 0.03 -0.03 0.00 1.87 0.00 0.00 56.30 58.52 2w0s h ASN 71 Cb 0.42 -0.11 0.00 0.00 0.27 0.00 0.00 38.32 38.90 2w0s h ASN 71 CO -0.13 0.37 -0.11 0.03 -0.37 0.00 0.00 177.43 177.22 2w0s h ARG 72 N 0.73 0.10 -0.91 6.67 3.08 0.17 -3.33 114.38 120.88 2w0s h ARG 72 Ca 0.41 -0.09 0.22 0.00 0.07 0.00 0.00 59.98 60.59 2w0s h ARG 72 Cb 0.57 0.02 -0.06 0.00 0.08 0.00 0.00 29.97 30.58 2w0s h ARG 72 CO -0.17 0.79 0.61 -1.49 -1.07 0.00 0.00 179.97 178.64 2w0s h TRP 73 N -0.56 0.42 -0.84 3.04 4.06 -1.11 -0.20 115.95 120.75 2w0s h TRP 73 Ca -0.01 0.01 0.24 0.00 2.06 0.00 0.00 58.89 61.20 2w0s h TRP 73 Cb 0.82 -0.13 -0.03 0.00 -1.00 0.00 0.00 29.16 28.82 2w0s h TRP 73 CO 0.17 0.10 0.67 0.93 -3.56 0.00 0.00 178.44 176.75 2w0s h GLU 74 N 0.30 0.00 -0.01 0.49 5.08 -1.58 -2.11 114.58 116.75 2w0s h GLU 74 Ca 0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.83 2w0s h GLU 74 Cb 1.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.58 2w0s h GLU 74 CO -0.15 0.00 -0.17 1.19 -1.00 0.00 0.00 179.01 178.88 2w0s n PHE 75 N -4.05 0.00 -0.20 4.33 3.01 -0.10 -4.48 117.46 115.97 2w0s n PHE 75 Ca 0.17 0.00 0.02 0.00 1.01 0.00 0.00 57.45 58.65 2w0s n PHE 75 Cb 0.97 0.00 0.27 0.00 -0.01 0.00 0.00 39.48 40.71 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 2.26 1.51 0.18 4.37 0.00 -1.20 0.10 119.26 126.48 2w0s h ALA 76 Ca 0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2w0s h ALA 76 Cb 0.46 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2w0s h ALA 76 CO 0.00 0.44 -0.09 0.77 0.00 0.00 0.00 179.25 180.37 2w0s h SER 77 N 0.96 -0.20 -0.28 0.00 0.02 -1.78 -2.61 113.55 109.64 2w0s h SER 77 Ca 0.28 -0.03 0.04 0.00 -0.84 0.00 0.00 61.79 61.24 2w0s h SER 77 Cb -0.06 0.05 -0.04 0.00 0.14 0.00 0.00 62.40 62.50 2w0s h SER 77 CO -0.07 -0.11 0.06 0.15 -1.14 0.00 0.00 176.83 175.73 2w0s h PHE 78 N -0.28 0.10 0.35 3.45 3.57 -1.64 -0.94 116.94 121.55 2w0s h PHE 78 Ca -0.02 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 2w0s h PHE 78 Cb 0.22 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.93 2w0s h PHE 78 CO -0.05 0.03 -0.44 0.82 -2.23 0.00 0.00 178.31 176.44 2w0s h ILE 79 N 0.17 0.00 -0.84 1.41 2.04 -0.82 -1.51 117.51 117.96 2w0s h ILE 79 Ca 0.13 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.13 2w0s h ILE 79 Cb 0.13 0.00 -0.14 0.00 -0.74 0.00 0.00 36.82 36.07 2w0s h ILE 79 CO -0.17 0.00 -0.37 -0.61 0.00 0.00 0.00 178.15 177.01 2w0s h GLN 80 N -0.81 -0.06 -0.28 2.37 5.75 -1.37 -1.73 115.11 118.98 2w0s h GLN 80 Ca -0.04 0.00 0.04 0.00 -0.15 0.00 0.00 58.65 58.50 2w0s h GLN 80 Cb 0.73 0.01 -0.03 0.00 1.07 0.00 0.00 27.48 29.26 2w0s h GLN 80 CO -0.10 -0.04 0.06 0.93 -2.65 0.00 0.00 178.83 177.03 2w0s h GLU 81 N -0.06 0.16 0.08 1.69 5.08 -0.86 -2.16 114.58 118.51 2w0s h GLU 81 Ca 0.30 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.65 2w0s h GLU 81 Cb 0.58 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2w0s h GLU 81 CO -0.87 0.11 -0.04 1.96 -1.00 0.00 0.00 179.01 179.17 2w0s h GLN 82 N 0.17 -0.10 -0.30 2.33 1.08 -0.74 -1.09 115.11 116.45 2w0s h GLN 82 Ca 0.13 0.01 0.06 0.00 -1.45 0.00 0.00 58.65 57.39 2w0s h GLN 82 Cb 0.13 0.02 -0.06 0.00 -0.05 0.00 0.00 27.48 27.52 2w0s h GLN 82 CO -0.16 -0.05 -0.08 -0.07 -0.95 0.00 0.00 178.83 177.52 2w0s h LEU 83 N -0.13 -0.30 -1.11 1.46 3.38 -1.22 -0.30 115.31 117.10 2w0s h LEU 83 Ca -0.01 0.09 0.10 0.00 0.09 0.00 0.00 57.88 58.15 2w0s h LEU 83 Cb 0.10 0.19 -0.07 0.00 0.09 0.00 0.00 40.66 40.97 2w0s h LEU 83 CO 0.02 -0.11 0.61 -0.33 0.09 0.00 0.00 178.44 178.72 2w0s h GLU 84 N -0.01 0.95 -0.10 1.13 5.08 -1.28 0.72 114.58 121.07 2w0s h GLU 84 Ca 0.14 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2w0s h GLU 84 Cb 0.23 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2w0s h GLU 84 CO -0.31 0.63 0.00 1.04 -1.00 0.00 0.00 179.01 179.36 2w0s n GLN 85 N -4.55 0.87 -0.82 2.33 6.02 -0.23 -4.81 117.38 116.18 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 0.30 -1.05 0.00 0.00 1.02 0.00 0.00 30.24 30.51 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 0.33 0.91 3.73 1.08 0.00 0.13 -4.95 105.19 106.43 2w0s n GLY 86 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 -3.63 4.73 0.21 -0.61 1.09 -0.56 -3.83 121.20 118.61 2w0s s ILE 87 Ca 0.00 1.76 -0.22 0.00 -1.10 0.00 0.00 60.65 61.09 2w0s s ILE 87 Cb 0.00 -4.18 -0.08 0.00 -1.06 0.00 0.00 42.46 37.14 2w0s s ILE 87 CO 0.00 0.32 0.76 -0.89 -0.10 0.00 0.00 174.94 175.03 2w0s s THR 88 N 0.19 4.46 -0.19 2.92 2.01 -0.48 -3.51 115.64 121.05 2w0s s THR 88 Ca 0.42 1.49 -0.03 0.00 0.31 0.00 0.00 61.69 63.88 2w0s s THR 88 Cb -0.21 -3.97 -0.02 0.00 0.01 0.00 0.00 72.50 68.31 2w0s s THR 88 CO 0.25 0.32 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.68 2w0s s LEU 89 N -1.68 3.00 -0.35 4.42 1.43 0.68 -1.15 118.68 125.03 2w0s s LEU 89 Ca 0.41 -0.29 -0.07 0.00 -1.03 0.00 0.00 54.13 53.15 2w0s s LEU 89 Cb -0.19 -1.74 0.05 0.00 0.03 0.00 0.00 46.19 44.34 2w0s s LEU 89 CO 0.23 0.07 0.14 -0.63 0.23 0.00 0.00 176.35 176.39 2w0s s ILE 90 N 0.94 3.86 -0.18 -0.59 -1.09 -0.39 -0.16 121.20 123.59 2w0s s ILE 90 Ca -0.00 -1.20 -0.00 0.00 -2.23 0.00 0.00 60.65 57.22 2w0s s ILE 90 Cb -0.15 -3.23 0.01 0.00 -1.58 0.00 0.00 42.46 37.51 2w0s s ILE 90 CO 0.01 -0.25 -0.16 -0.69 -1.23 0.00 0.00 174.94 172.62 2w0s s VAL 91 N 1.40 2.47 -0.42 2.92 1.01 -0.22 -0.42 120.40 127.14 2w0s s VAL 91 Ca -0.00 -0.81 -0.28 0.00 0.00 0.00 0.00 61.98 60.88 2w0s s VAL 91 Cb -0.20 -2.06 0.02 0.00 0.00 0.00 0.00 36.38 34.14 2w0s s VAL 91 CO 0.03 0.51 1.08 -0.62 0.00 0.00 0.00 175.10 176.09 2w0s s ASP 92 N 1.22 6.70 0.50 3.32 -1.08 0.09 0.11 116.67 127.53 2w0s s ASP 92 Ca 0.03 0.59 0.00 0.00 -0.52 0.00 0.00 52.55 52.64 2w0s s ASP 92 Cb -0.14 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.79 2w0s s ASP 92 CO -0.08 -1.10 0.00 0.54 0.52 0.00 0.00 175.17 175.06 2w0s n ARG 93 N 7.41 -3.71 0.00 4.34 1.74 -0.30 -0.78 116.66 125.36 2w0s n ARG 93 Ca 0.11 2.85 0.00 0.00 -0.77 0.00 0.00 57.85 60.04 2w0s n ARG 93 Cb 0.48 -3.46 0.00 0.00 -1.02 0.00 0.00 32.46 28.46 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 -2.04 0.00 -0.33 -1.55 9.36 -1.26 -4.37 117.16 116.96 2w0s n TYR 94 Ca 0.00 0.00 0.19 0.00 3.32 0.00 0.00 57.90 61.41 2w0s n TYR 94 Cb 0.30 0.00 0.36 0.00 -0.63 0.00 0.00 39.34 39.37 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 0.62 -0.11 2.98 0.00 -1.26 -0.88 120.51 118.86 2w0s n ALA 95 Ca 0.00 1.04 -0.10 0.00 0.00 0.00 0.00 53.44 54.38 2w0s n ALA 95 Cb 0.00 -0.82 0.04 0.00 0.00 0.00 0.00 19.45 18.66 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 1.01 -1.00 0.00 0.04 -1.99 -1.09 116.94 113.91 2w0s h PHE 96 Ca 0.65 -0.26 0.16 0.00 2.80 0.00 0.00 57.97 61.33 2w0s h PHE 96 Cb 1.46 -0.23 -0.10 0.00 2.20 0.00 0.00 35.95 39.28 2w0s h PHE 96 CO -0.38 1.04 0.62 0.77 -0.60 0.00 0.00 178.31 179.75 2w0s h SER 97 N 0.74 0.82 0.48 2.17 0.02 -1.39 -0.58 113.55 115.82 2w0s h SER 97 Ca 0.09 0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 61.09 2w0s h SER 97 Cb 0.83 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.29 2w0s h SER 97 CO 0.07 0.35 -0.24 1.23 -1.14 0.00 0.00 176.83 177.11 2w0s h GLY 98 N 0.83 -0.70 0.70 -3.77 0.00 -0.96 -2.47 103.07 96.70 2w0s h GLY 98 Ca 0.54 0.26 0.04 0.00 0.00 0.00 0.00 47.33 48.18 2w0s h GLY 98 CO -0.32 -0.25 0.21 -2.08 0.00 0.00 0.00 176.54 174.09 2w0s h VAL 99 N -0.65 0.93 -0.59 4.60 2.07 -1.07 0.15 116.25 121.68 2w0s h VAL 99 Ca -0.07 -0.14 -0.09 0.00 0.82 0.00 0.00 66.70 67.23 2w0s h VAL 99 Cb 0.50 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 2w0s h VAL 99 CO 0.10 0.08 0.03 0.00 0.02 0.00 0.00 177.57 177.80 2w0s h ALA 100 N 1.26 0.79 -0.06 1.67 0.00 -1.19 0.36 119.26 122.09 2w0s h ALA 100 Ca 0.20 -0.29 -0.20 0.00 0.00 0.00 0.00 54.91 54.62 2w0s h ALA 100 Cb 0.14 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 17.73 2w0s h ALA 100 CO -0.17 0.61 -0.74 1.88 0.00 0.00 0.00 179.25 180.83 2w0s h TYR 101 N 0.92 0.87 -0.61 0.00 -1.99 -1.31 -1.58 116.97 113.27 2w0s h TYR 101 Ca 0.17 -0.43 -0.03 0.00 2.00 0.00 0.00 58.73 60.45 2w0s h TYR 101 Cb 0.51 -0.12 -0.03 0.00 2.00 0.00 0.00 36.73 39.10 2w0s h TYR 101 CO 0.04 1.25 0.28 0.00 -0.00 0.00 0.00 178.16 179.72 2w0s h ALA 102 N 0.43 0.79 -0.02 3.88 0.00 -0.57 -2.81 119.26 120.96 2w0s h ALA 102 Ca -0.08 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.57 2w0s h ALA 102 Cb 1.40 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 2w0s h ALA 102 CO 0.15 0.37 -0.54 0.00 0.00 0.00 0.00 179.25 179.23 2w0s h ALA 103 N 1.11 1.07 -0.06 0.00 0.00 -0.33 -2.25 119.26 118.79 2w0s h ALA 103 Ca 0.21 -0.49 -0.07 0.00 0.00 0.00 0.00 54.91 54.56 2w0s h ALA 103 Cb 0.15 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2w0s h ALA 103 CO -0.02 0.67 -0.29 0.00 0.00 0.00 0.00 179.25 179.61 2w0s h ALA 104 N 1.41 1.40 -0.11 0.00 0.00 -1.05 -1.98 119.26 118.93 2w0s h ALA 104 Ca -0.00 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2w0s h ALA 104 Cb 0.96 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2w0s h ALA 104 CO 0.07 0.43 0.00 1.63 0.00 0.00 0.00 179.25 181.38 2w0s n LYS 105 N -4.16 1.64 -0.60 0.00 5.02 -1.04 -4.87 118.16 114.15 2w0s n LYS 105 Ca -0.02 -0.56 0.00 0.00 -2.02 0.00 0.00 58.31 55.72 2w0s n LYS 105 Cb 0.36 -1.54 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 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 0.22 0.76 3.86 0.72 0.00 -0.74 -5.07 105.19 104.94 2w0s n GLY 106 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.72 2.75 -0.07 4.61 0.00 -0.88 -4.99 121.76 120.45 2w0s s ALA 107 Ca 0.00 -0.30 -0.30 0.00 0.00 0.00 0.00 51.96 51.37 2w0s s ALA 107 Cb 0.00 -3.05 -0.03 0.00 0.00 0.00 0.00 23.12 20.04 2w0s s ALA 107 CO 0.00 -1.26 1.17 0.45 0.00 0.00 0.00 175.76 176.11 2w0s s SER 108 N -4.24 7.08 0.28 0.00 0.15 -1.26 -4.45 113.70 111.25 2w0s s SER 108 Ca 0.59 1.75 -0.03 0.00 0.70 0.00 0.00 55.95 58.95 2w0s s SER 108 Cb -0.12 -2.56 0.37 0.00 -1.71 0.00 0.00 66.02 62.00 2w0s s SER 108 CO 0.52 -0.57 1.92 -0.03 1.20 0.00 0.00 173.24 176.29 2w0s h MET 109 N 7.44 1.12 -0.02 5.44 4.05 -1.93 0.10 114.93 131.14 2w0s h MET 109 Ca -0.33 -0.10 -0.19 0.00 -0.28 0.00 0.00 59.70 58.80 2w0s h MET 109 Cb 1.15 -0.24 -0.01 0.00 -0.80 0.00 0.00 31.60 31.71 2w0s h MET 109 CO 0.88 0.78 -0.83 1.79 0.23 0.00 0.00 176.91 179.77 2w0s h THR 110 N 1.14 1.45 -0.18 -0.77 1.35 -1.99 -2.39 112.91 111.52 2w0s h THR 110 Ca 0.30 -2.45 -0.14 0.00 -0.55 0.00 0.00 66.41 63.57 2w0s h THR 110 Cb -0.05 2.35 0.00 0.00 -1.73 0.00 0.00 68.15 68.73 2w0s h THR 110 CO -0.06 0.72 -0.44 0.25 -0.25 0.00 0.00 175.52 175.75 2w0s h LEU 111 N 0.15 0.70 -0.96 3.87 5.85 -1.89 -2.07 115.31 120.97 2w0s h LEU 111 Ca -0.04 -0.57 0.07 0.00 0.84 0.00 0.00 57.88 58.18 2w0s h LEU 111 Cb 1.44 -0.20 -0.07 0.00 0.37 0.00 0.00 40.66 42.19 2w0s h LEU 111 CO 0.13 1.14 0.61 0.28 -0.34 0.00 0.00 178.44 180.26 2w0s h SER 112 N 0.29 0.96 0.20 1.25 0.02 -0.78 -2.66 113.55 112.83 2w0s h SER 112 Ca -0.00 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 2w0s h SER 112 Cb 1.05 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.40 2w0s h SER 112 CO 0.10 0.60 -0.10 0.11 -1.14 0.00 0.00 176.83 176.40 2w0s h LYS 113 N 1.09 -0.26 -0.99 3.45 1.57 -1.35 -2.87 116.57 117.21 2w0s h LYS 113 Ca 0.42 0.02 0.31 0.00 -1.87 0.00 0.00 60.65 59.52 2w0s h LYS 113 Cb 0.21 0.06 -0.18 0.00 0.08 0.00 0.00 32.23 32.40 2w0s h LYS 113 CO -0.19 -0.02 0.17 0.66 -0.57 0.00 0.00 179.45 179.50 2w0s h SER 114 N -0.48 -0.25 -0.70 0.86 4.64 -1.02 0.20 113.55 116.80 2w0s h SER 114 Ca -0.03 0.27 -0.03 0.00 -0.47 0.00 0.00 61.79 61.53 2w0s h SER 114 Cb 0.36 0.42 -0.03 0.00 -0.31 0.00 0.00 62.40 62.84 2w0s h SER 114 CO 0.05 -0.36 0.34 1.88 -0.87 0.00 0.00 176.83 177.86 2w0s h TYR 115 N 0.02 1.03 0.00 4.77 0.99 -1.36 -2.39 116.97 120.03 2w0s h TYR 115 Ca 0.66 -0.05 -0.08 0.00 2.00 0.00 0.00 58.73 61.27 2w0s h TYR 115 Cb 1.47 -0.32 -0.01 0.00 1.00 0.00 0.00 36.73 38.87 2w0s h TYR 115 CO -0.36 0.76 -0.37 0.93 -0.00 0.00 0.00 178.16 179.12 2w0s h GLU 116 N 1.02 0.00 -6.09 4.88 4.39 -0.70 -3.46 114.58 114.62 2w0s h GLU 116 Ca 0.25 0.00 -0.69 0.00 0.34 0.00 0.00 59.36 59.26 2w0s h GLU 116 Cb 0.12 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.77 2w0s h GLU 116 CO -0.03 0.37 1.18 0.45 -1.16 0.00 0.00 179.01 179.81 2w0s n SER 117 N -3.29 2.39 0.00 1.42 2.88 0.19 -1.81 113.62 115.41 2w0s n SER 117 Ca 0.01 0.75 0.00 0.00 -1.33 0.00 0.00 58.87 58.31 2w0s n SER 117 Cb 0.61 -1.22 0.00 0.00 -0.75 0.00 0.00 64.21 62.85 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 5.39 1.14 3.74 0.46 0.00 -0.53 -4.99 105.19 110.40 2w0s n GLY 118 Ca 0.33 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.02 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 3.29 0.18 0.99 1.43 -0.75 -4.44 118.68 119.38 2w0s s LEU 119 Ca 0.00 2.17 -0.32 0.00 -1.03 0.00 0.00 54.13 54.95 2w0s s LEU 119 Cb 0.00 -4.57 -0.16 0.00 0.03 0.00 0.00 46.19 41.49 2w0s s LEU 119 CO 0.00 -2.07 1.04 -2.65 0.23 0.00 0.00 176.35 172.90 2w0s n PRO 120 N -2.78 0.96 -3.54 1.29 -0.02 -1.26 0.12 135.00 129.76 2w0s n PRO 120 Ca 0.12 0.34 -0.37 0.00 -2.02 0.00 0.00 63.50 61.57 2w0s n PRO 120 Cb 0.51 -1.75 -0.09 0.00 -0.02 0.00 0.00 33.50 32.16 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 -0.64 4.12 0.62 -0.52 2.20 0.11 -4.50 119.74 121.13 2w0s s LYS 121 Ca 0.71 -0.06 -0.19 0.00 -0.36 0.00 0.00 55.97 56.07 2w0s s LYS 121 Cb -0.87 -3.53 -0.02 0.00 -1.51 0.00 0.00 37.83 31.90 2w0s s LYS 121 CO 0.54 0.03 1.29 -2.14 -0.36 0.00 0.00 175.35 174.71 2w0s s PRO 122 N 1.14 2.70 -0.00 4.03 0.02 -1.26 -4.25 135.00 137.38 2w0s s PRO 122 Ca 0.13 2.06 0.22 0.00 0.02 0.00 0.00 61.00 63.42 2w0s s PRO 122 Cb -0.14 -1.92 -0.22 0.00 0.02 0.00 0.00 34.50 32.23 2w0s s PRO 122 CO 0.06 -1.48 0.77 -0.25 -0.33 0.00 0.00 177.00 175.77 2w0s n ASP 123 N -1.72 0.58 -3.64 2.53 8.00 0.11 -4.72 116.55 117.69 2w0s n ASP 123 Ca 0.15 -0.52 -0.06 0.00 0.71 0.00 0.00 54.79 55.07 2w0s n ASP 123 Cb 0.48 1.32 -0.07 0.00 -0.02 0.00 0.00 41.12 42.84 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 -3.69 -0.95 -0.24 0.64 2.96 -1.22 -4.59 118.68 111.60 2w0s s LEU 124 Ca 0.02 1.50 0.02 0.00 -0.22 0.00 0.00 54.13 55.44 2w0s s LEU 124 Cb 0.15 2.33 0.06 0.00 0.50 0.00 0.00 46.19 49.23 2w0s s LEU 124 CO 0.87 -0.24 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.89 2w0s s VAL 125 N 1.84 1.78 -0.39 1.68 1.01 0.34 -1.49 120.40 125.18 2w0s s VAL 125 Ca -0.09 -1.33 -0.18 0.00 0.00 0.00 0.00 61.98 60.37 2w0s s VAL 125 Cb -0.06 -1.96 0.01 0.00 0.00 0.00 0.00 36.38 34.37 2w0s s VAL 125 CO -0.20 -0.02 0.51 -0.63 0.00 0.00 0.00 175.10 174.76 2w0s s ILE 126 N 1.29 5.00 -0.23 2.22 1.01 0.10 -1.10 121.20 129.50 2w0s s ILE 126 Ca -0.06 0.09 -0.13 0.00 0.00 0.00 0.00 60.65 60.55 2w0s s ILE 126 Cb -0.19 -4.03 -0.04 0.00 0.01 0.00 0.00 42.46 38.21 2w0s s ILE 126 CO -0.06 -0.35 0.29 0.12 0.00 0.00 0.00 174.94 174.94 2w0s s PHE 127 N 2.40 3.33 -0.38 3.97 5.36 -0.44 -0.70 117.98 131.52 2w0s s PHE 127 Ca 0.17 0.41 -0.16 0.00 -0.96 0.00 0.00 56.93 56.40 2w0s s PHE 127 Cb -0.16 -2.42 0.01 0.00 -0.34 0.00 0.00 43.02 40.11 2w0s s PHE 127 CO 0.15 -0.00 0.39 -0.51 -1.46 0.00 0.00 175.22 173.78 2w0s s LEU 128 N 1.29 4.68 0.38 6.12 1.02 -0.55 -0.59 118.68 131.03 2w0s s LEU 128 Ca 0.13 -0.48 -0.27 0.00 0.02 0.00 0.00 54.13 53.53 2w0s s LEU 128 Cb -0.14 -2.35 -0.09 0.00 0.02 0.00 0.00 46.19 43.63 2w0s s LEU 128 CO 0.07 -0.46 1.32 -1.61 0.02 0.00 0.00 176.35 175.69 2w0s s GLU 129 N 2.05 4.11 -0.23 1.70 2.02 -0.67 -4.38 118.70 123.30 2w0s s GLU 129 Ca 0.11 2.22 -0.06 0.00 0.02 0.00 0.00 54.97 57.26 2w0s s GLU 129 Cb -0.17 -2.88 -0.02 0.00 0.10 0.00 0.00 34.13 31.16 2w0s s GLU 129 CO 0.12 -0.40 0.01 -1.12 0.02 0.00 0.00 175.26 173.90 2w0s s SER 130 N -0.60 4.78 0.00 -0.19 0.01 -1.26 -4.13 113.70 112.31 2w0s s SER 130 Ca 0.54 -0.27 0.00 0.00 1.31 0.00 0.00 55.95 57.53 2w0s s SER 130 Cb -0.39 -1.84 0.00 0.00 0.21 0.00 0.00 66.02 64.00 2w0s s SER 130 CO 0.52 -0.00 0.00 0.61 0.41 0.00 0.00 173.24 174.77 2w0s n GLY 131 N 4.71 1.24 0.00 3.44 0.00 -1.26 -4.65 105.19 108.66 2w0s n GLY 131 Ca -0.17 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.26 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 -2.45 113.62 114.40 2w0s n SER 132 Ca 0.00 0.86 0.01 0.00 -1.33 0.00 0.00 58.87 58.42 2w0s n SER 132 Cb 0.00 -0.37 0.08 0.00 -0.75 0.00 0.00 64.21 63.17 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 -1.60 0.24 -0.06 -1.46 3.00 -1.26 -2.66 118.16 114.36 2w0s n LYS 133 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 58.31 58.19 2w0s n LYS 133 Cb 0.00 -1.17 -0.05 0.00 0.00 0.00 0.00 35.03 33.81 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 -0.67 0.29 -0.05 1.64 4.71 -1.21 -4.25 120.64 121.09 2w0s n GLU 134 Ca 0.02 0.10 -0.10 0.00 -0.01 0.00 0.00 57.16 57.17 2w0s n GLU 134 Cb 0.01 -1.07 -0.03 0.00 -1.01 0.00 0.00 31.44 29.33 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 -0.29 1.08 0.00 -3.67 2.04 -1.25 -2.06 117.51 113.36 2w0s h ILE 135 Ca -0.31 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.36 2w0s h ILE 135 Cb 1.34 0.83 0.00 0.00 -0.74 0.00 0.00 36.82 38.25 2w0s h ILE 135 CO -0.14 0.08 0.00 0.59 0.00 0.00 0.00 178.15 178.68 2w0s n ASN 136 N -4.92 0.18 0.11 1.72 4.13 -1.09 -1.36 115.26 114.04 2w0s n ASN 136 Ca -0.03 -1.33 0.12 0.00 1.68 0.00 0.00 54.58 55.02 2w0s n ASN 136 Cb 0.05 -0.09 0.23 0.00 -1.54 0.00 0.00 39.78 38.43 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 0.09 0.00 -6.36 3.52 2.47 -1.54 -3.45 114.38 109.11 2w0s h ARG 137 Ca 0.00 0.00 -0.54 0.00 -1.26 0.00 0.00 59.98 58.18 2w0s h ARG 137 Cb 0.09 0.00 -0.06 0.00 -1.65 0.00 0.00 29.97 28.35 2w0s h ARG 137 CO 0.00 0.00 1.13 -0.80 0.56 0.00 0.00 179.97 180.86 2w0s s ASN 138 N -4.84 6.04 -0.19 7.04 0.01 -0.46 -4.87 114.94 117.67 2w0s s ASN 138 Ca 0.07 0.30 0.15 0.00 -0.71 0.00 0.00 52.86 52.67 2w0s s ASN 138 Cb 0.11 -2.54 0.43 0.00 0.41 0.00 0.00 41.25 39.65 2w0s s ASN 138 CO 0.68 -1.77 1.31 1.33 -1.51 0.00 0.00 177.10 177.13 2w0s n VAL 139 N 6.89 2.20 -1.91 1.60 0.24 -1.26 -4.47 118.33 121.62 2w0s n VAL 139 Ca 0.13 -2.41 -0.16 0.00 -2.04 0.00 0.00 64.34 59.87 2w0s n VAL 139 Cb 0.49 -0.26 -0.03 0.00 -1.47 0.00 0.00 33.84 32.57 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 -1.05 0.57 0.26 7.63 0.00 0.08 -4.86 105.19 107.82 2w0s n GLY 140 Ca 0.22 -0.25 0.13 0.00 0.00 0.00 0.00 46.02 46.11 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 -5.34 1.61 4.11 -1.94 -3.44 114.58 109.58 2w0s h GLU 141 Ca -0.35 0.00 -0.53 0.00 0.07 0.00 0.00 59.36 58.56 2w0s h GLU 141 Cb 1.16 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.27 2w0s h GLU 141 CO 0.45 0.14 -0.60 -1.21 0.07 0.00 0.00 179.01 177.86 2w0s s GLU 142 N -3.99 1.77 0.13 1.06 2.02 -1.26 -4.88 118.70 113.54 2w0s s GLU 142 Ca -0.02 -2.00 -0.16 0.00 0.02 0.00 0.00 54.97 52.82 2w0s s GLU 142 Cb 0.12 -1.09 -0.01 0.00 0.10 0.00 0.00 34.13 33.24 2w0s s GLU 142 CO 0.59 -0.17 1.64 0.97 0.02 0.00 0.00 175.26 178.32 2w0s h ILE 143 N 1.98 1.22 -0.01 -1.63 2.10 -1.44 -2.03 117.51 117.70 2w0s h ILE 143 Ca -0.42 -0.73 0.00 0.00 1.08 0.00 0.00 64.86 64.80 2w0s h ILE 143 Cb 1.25 0.94 0.00 0.00 -1.09 0.00 0.00 36.82 37.92 2w0s h ILE 143 CO 0.72 0.25 -0.04 -1.22 -1.08 0.00 0.00 178.15 176.79 2w0s n TYR 144 N -4.59 0.00 -1.22 2.19 4.01 -1.26 -4.60 117.16 111.69 2w0s n TYR 144 Ca -0.00 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.37 2w0s n TYR 144 Cb 0.18 -0.07 -0.03 0.00 -0.31 0.00 0.00 39.34 39.12 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 -0.66 2.52 -3.82 -0.72 1.02 -0.76 -4.62 120.64 113.60 2w0s n GLU 145 Ca 0.19 -2.01 -0.25 0.00 -0.02 0.00 0.00 57.16 55.07 2w0s n GLU 145 Cb 0.24 -2.86 -0.17 0.00 -0.02 0.00 0.00 31.44 28.64 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 3.45 1.93 0.20 1.62 2.15 -1.26 -0.74 116.67 124.02 2w0s s ASP 146 Ca 0.53 -0.23 -0.12 0.00 0.43 0.00 0.00 52.55 53.15 2w0s s ASP 146 Cb 0.14 -0.60 0.25 0.00 -0.30 0.00 0.00 42.92 42.41 2w0s s ASP 146 CO -0.02 -0.18 1.29 0.52 -0.17 0.00 0.00 175.17 176.62 2w0s n VAL 147 N 5.06 -0.41 0.12 1.11 0.31 -1.26 -0.46 118.33 122.80 2w0s n VAL 147 Ca -0.09 1.93 0.02 0.00 -0.01 0.00 0.00 64.34 66.19 2w0s n VAL 147 Cb 0.50 -2.59 0.37 0.00 -0.91 0.00 0.00 33.84 31.21 2w0s n VAL 147 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 2w0s h THR 148 N 0.00 1.20 0.08 2.52 1.35 -1.97 -2.11 112.91 113.98 2w0s h THR 148 Ca 0.32 -0.90 -0.27 0.00 -0.55 0.00 0.00 66.41 65.00 2w0s h THR 148 Cb 0.53 1.31 0.03 0.00 -1.73 0.00 0.00 68.15 68.28 2w0s h THR 148 CO -0.83 0.28 -1.12 0.15 -0.25 0.00 0.00 175.52 173.74 2w0s h PHE 149 N 0.20 0.98 -0.99 4.73 3.57 -1.11 -3.27 116.94 121.05 2w0s h PHE 149 Ca 0.04 -0.59 0.01 0.00 3.53 0.00 0.00 57.97 60.96 2w0s h PHE 149 Cb 0.45 -0.09 -0.05 0.00 2.79 0.00 0.00 35.95 39.05 2w0s h PHE 149 CO 0.01 1.43 0.65 1.96 -2.23 0.00 0.00 178.31 180.13 2w0s h GLN 150 N 0.26 1.29 -0.66 1.11 1.08 -0.98 0.36 115.11 117.57 2w0s h GLN 150 Ca -0.16 -0.08 0.17 0.00 -1.45 0.00 0.00 58.65 57.13 2w0s h GLN 150 Cb 1.80 -0.29 -0.03 0.00 -0.05 0.00 0.00 27.48 28.90 2w0s h GLN 150 CO 0.22 0.85 0.46 0.37 -0.95 0.00 0.00 178.83 179.78 2w0s h GLN 151 N 1.33 0.11 0.04 1.46 5.75 -1.46 -1.36 115.11 120.98 2w0s h GLN 151 Ca 0.37 -0.01 -0.26 0.00 -0.15 0.00 0.00 58.65 58.60 2w0s h GLN 151 Cb -0.13 -0.03 0.02 0.00 1.07 0.00 0.00 27.48 28.42 2w0s h GLN 151 CO -0.09 0.08 -1.03 0.87 -2.65 0.00 0.00 178.83 176.01 2w0s h LYS 152 N 0.12 0.63 -0.70 1.69 1.79 -1.01 -3.19 116.57 115.90 2w0s h LYS 152 Ca 0.32 -0.73 0.00 0.00 -2.18 0.00 0.00 60.65 58.06 2w0s h LYS 152 Cb 1.09 0.22 -0.03 0.00 -1.58 0.00 0.00 32.23 31.92 2w0s h LYS 152 CO -0.04 1.31 0.46 0.28 -1.08 0.00 0.00 179.45 180.38 2w0s h VAL 153 N 0.26 1.19 -0.98 0.50 2.07 -0.53 -2.79 116.25 115.96 2w0s h VAL 153 Ca -0.14 -0.35 0.10 0.00 0.82 0.00 0.00 66.70 67.13 2w0s h VAL 153 Cb 1.70 0.17 -0.08 0.00 -1.52 0.00 0.00 31.29 31.56 2w0s h VAL 153 CO 0.20 0.18 0.61 0.25 0.02 0.00 0.00 177.57 178.83 2w0s h LEU 154 N 0.95 0.92 -0.89 2.57 5.85 -1.35 0.37 115.31 123.74 2w0s h LEU 154 Ca 0.26 0.04 0.10 0.00 0.84 0.00 0.00 57.88 59.12 2w0s h LEU 154 Cb -0.09 -0.15 -0.08 0.00 0.37 0.00 0.00 40.66 40.71 2w0s h LEU 154 CO -0.05 0.52 0.52 1.56 -0.34 0.00 0.00 178.44 180.65 2w0s h GLN 155 N 1.01 0.83 0.01 1.25 1.08 -1.48 -0.44 115.11 117.37 2w0s h GLN 155 Ca 0.47 -0.05 -0.21 0.00 -1.45 0.00 0.00 58.65 57.40 2w0s h GLN 155 Cb 0.38 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 27.62 2w0s h GLN 155 CO -0.24 0.55 -0.93 0.93 -0.95 0.00 0.00 178.83 178.18 2w0s h GLU 156 N 0.85 0.27 0.48 1.46 4.39 -1.00 -2.61 114.58 118.41 2w0s h GLU 156 Ca 0.43 -0.30 -0.02 0.00 0.34 0.00 0.00 59.36 59.80 2w0s h GLU 156 Cb 0.41 0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.16 2w0s h GLU 156 CO -0.26 1.03 -0.23 1.88 -1.16 0.00 0.00 179.01 180.27 2w0s h TYR 157 N 0.14 -0.60 -0.63 4.33 0.99 -0.62 -2.97 116.97 117.61 2w0s h TYR 157 Ca -0.06 -0.01 0.12 0.00 2.00 0.00 0.00 58.73 60.78 2w0s h TYR 157 Cb 1.58 0.20 -0.09 0.00 1.00 0.00 0.00 36.73 39.41 2w0s h TYR 157 CO 0.04 -0.33 0.13 0.87 -0.00 0.00 0.00 178.16 178.87 2w0s h LYS 158 N -0.73 0.24 -0.55 4.88 1.79 -1.12 -0.72 116.57 120.36 2w0s h LYS 158 Ca -0.07 -0.01 0.11 0.00 -2.18 0.00 0.00 60.65 58.50 2w0s h LYS 158 Cb 0.54 -0.05 -0.10 0.00 -1.58 0.00 0.00 32.23 31.03 2w0s h LYS 158 CO 0.11 0.16 -0.15 0.87 -1.08 0.00 0.00 179.45 179.36 2w0s h LYS 159 N 0.25 -0.01 -0.15 3.15 1.57 -1.45 -1.95 116.57 117.98 2w0s h LYS 159 Ca 0.34 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.99 2w0s h LYS 159 Cb 0.53 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 2w0s h LYS 159 CO -0.44 -0.01 -0.45 0.52 -0.57 0.00 0.00 179.45 178.51 2w0s h MET 160 N -0.01 0.36 0.28 3.15 2.86 -0.99 -2.85 114.93 117.72 2w0s h MET 160 Ca 0.26 -0.19 -0.01 0.00 -2.06 0.00 0.00 59.70 57.70 2w0s h MET 160 Cb 0.41 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.08 2w0s h MET 160 CO -0.57 0.74 -0.13 0.82 1.06 0.00 0.00 176.91 178.83 2w0s h ILE 161 N 0.29 0.73 0.00 -1.22 2.04 -0.98 -2.78 117.51 115.60 2w0s h ILE 161 Ca 0.02 -0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.88 2w0s h ILE 161 Cb 0.91 0.73 0.00 0.00 -0.74 0.00 0.00 36.82 37.71 2w0s h ILE 161 CO 0.08 0.00 0.13 -0.33 0.00 0.00 0.00 178.15 178.03 2w0s h GLU 162 N -0.37 0.00 -0.00 2.37 5.08 -1.13 0.15 114.58 120.67 2w0s h GLU 162 Ca -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2w0s h GLU 162 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 2w0s h GLU 162 CO 0.06 0.00 -0.04 0.39 -1.00 0.00 0.00 179.01 178.42 2w0s n GLU 163 N -2.61 0.57 0.00 2.33 1.02 -1.05 -4.98 120.64 115.92 2w0s n GLU 163 Ca -0.02 -0.09 0.00 0.00 -0.02 0.00 0.00 57.16 57.03 2w0s n GLU 163 Cb 0.18 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.10 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 0.00 0.58 0.62 0.00 0.52 -4.71 105.19 103.46 2w0s n GLY 164 Ca 0.15 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.24 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 0.00 2.28 -4.50 1.61 3.85 -1.26 -4.96 116.55 113.58 2w0s n ASP 165 Ca 0.00 -1.63 -0.33 0.00 -0.71 0.00 0.00 54.79 52.12 2w0s n ASP 165 Cb 0.00 -0.04 -0.13 0.00 -1.35 0.00 0.00 41.12 39.60 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 -1.12 3.35 -0.57 2.12 -1.09 -1.26 -5.07 121.20 117.55 2w0s s ILE 166 Ca 0.18 -0.60 -0.27 0.00 -2.23 0.00 0.00 60.65 57.73 2w0s s ILE 166 Cb 0.12 -2.36 -0.00 0.00 -1.58 0.00 0.00 42.46 38.64 2w0s s ILE 166 CO 0.17 0.57 1.64 -2.28 -1.23 0.00 0.00 174.94 173.81 2w0s s HIS 167 N -0.48 1.96 -0.11 3.97 5.65 -1.26 -4.99 115.29 120.02 2w0s s HIS 167 Ca 0.07 0.57 -0.05 0.00 0.25 0.00 0.00 55.06 55.89 2w0s s HIS 167 Cb -0.12 -4.26 -0.04 0.00 -1.18 0.00 0.00 32.58 26.99 2w0s s HIS 167 CO 0.02 -2.25 0.07 -1.58 -0.65 0.00 0.00 174.74 170.35 2w0s s TRP 168 N 7.40 3.36 -0.23 3.88 0.52 -1.26 -0.50 118.94 132.11 2w0s s TRP 168 Ca 0.60 0.32 0.02 0.00 0.02 0.00 0.00 56.10 57.06 2w0s s TRP 168 Cb -0.13 -1.90 0.05 0.00 -1.15 0.00 0.00 33.47 30.34 2w0s s TRP 168 CO 0.23 0.54 -0.14 -0.65 0.02 0.00 0.00 176.95 176.95 2w0s s GLN 169 N -0.76 2.48 -0.36 4.98 -1.52 -0.25 -4.91 119.66 119.32 2w0s s GLN 169 Ca 0.12 -1.16 -0.20 0.00 -1.95 0.00 0.00 55.36 52.17 2w0s s GLN 169 Cb -0.12 -2.77 0.00 0.00 -0.22 0.00 0.00 33.01 29.90 2w0s s GLN 169 CO 0.03 -0.45 0.60 0.42 -0.25 0.00 0.00 175.29 175.64 2w0s s ILE 170 N 1.17 4.93 -0.30 1.08 1.01 -1.26 -1.32 121.20 126.51 2w0s s ILE 170 Ca -0.04 0.49 -0.11 0.00 0.00 0.00 0.00 60.65 60.99 2w0s s ILE 170 Cb -0.18 -4.05 -0.04 0.00 0.01 0.00 0.00 42.46 38.21 2w0s s ILE 170 CO -0.08 -0.29 0.20 -0.63 0.00 0.00 0.00 174.94 174.14 2w0s s ILE 171 N 2.61 5.25 0.57 2.92 -1.09 0.24 -4.98 121.20 126.72 2w0s s ILE 171 Ca 0.23 0.02 -0.19 0.00 -2.23 0.00 0.00 60.65 58.47 2w0s s ILE 171 Cb -0.15 -3.57 -0.06 0.00 -1.58 0.00 0.00 42.46 37.10 2w0s s ILE 171 CO 0.14 0.16 0.88 -0.24 -1.23 0.00 0.00 174.94 174.65 2w0s n SER 172 N 5.07 0.44 0.23 3.58 2.88 -1.26 -1.67 113.62 122.88 2w0s n SER 172 Ca -0.14 0.82 0.08 0.00 -1.33 0.00 0.00 58.87 58.30 2w0s n SER 172 Cb 0.51 -1.34 0.53 0.00 -0.75 0.00 0.00 64.21 63.17 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 0.55 0.00 0.13 -3.46 4.64 -1.94 -3.32 113.55 110.15 2w0s h SER 173 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 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 0.51 0.23 -0.07 -0.62 -0.87 0.00 0.00 176.83 176.01 2w0s n GLU 174 N -3.77 1.14 -1.19 4.77 1.02 -1.26 -4.84 120.64 116.51 2w0s n GLU 174 Ca -0.01 -0.50 -0.30 0.00 -0.02 0.00 0.00 57.16 56.32 2w0s n GLU 174 Cb 0.34 -1.49 0.12 0.00 -0.02 0.00 0.00 31.44 30.39 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 -2.21 2.36 0.05 -0.32 0.40 -1.25 -5.03 117.98 111.99 2w0s s PHE 175 Ca 0.35 1.38 -0.15 0.00 -0.60 0.00 0.00 56.93 57.92 2w0s s PHE 175 Cb 0.21 -3.13 -0.06 0.00 0.51 0.00 0.00 43.02 40.55 2w0s s PHE 175 CO 0.41 -2.23 0.46 -2.00 0.70 0.00 0.00 175.22 172.56 2w0s s GLU 176 N -4.90 3.95 0.22 0.44 2.56 -1.26 -4.86 118.70 114.85 2w0s s GLU 176 Ca 0.63 0.44 -0.17 0.00 0.00 0.00 0.00 54.97 55.87 2w0s s GLU 176 Cb -0.18 -3.13 0.24 0.00 2.00 0.00 0.00 34.13 33.05 2w0s s GLU 176 CO 0.57 0.62 1.57 0.93 -0.56 0.00 0.00 175.26 178.39 2w0s h GLU 177 N 4.30 -0.05 -0.08 4.30 4.39 -1.97 0.34 114.58 125.80 2w0s h GLU 177 Ca -0.50 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.12 2w0s h GLU 177 Cb 1.21 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.86 2w0s h GLU 177 CO 0.63 -0.03 -0.32 0.38 -1.16 0.00 0.00 179.01 178.51 2w0s h ASP 178 N -0.05 0.16 0.09 1.42 2.03 -1.99 -0.77 116.42 117.31 2w0s h ASP 178 Ca 0.33 -0.05 -0.29 0.00 -0.73 0.00 0.00 57.03 56.29 2w0s h ASP 178 Cb 0.59 -0.04 0.03 0.00 -0.83 0.00 0.00 39.33 39.08 2w0s h ASP 178 CO -0.88 0.48 -1.17 0.58 -1.03 0.00 0.00 179.24 177.22 2w0s h VAL 179 N 0.14 1.28 0.44 4.15 2.07 -0.91 -1.46 116.25 121.96 2w0s h VAL 179 Ca 0.02 -2.39 -0.02 0.00 0.82 0.00 0.00 66.70 65.13 2w0s h VAL 179 Cb 0.64 2.58 0.00 0.00 -1.52 0.00 0.00 31.29 32.98 2w0s h VAL 179 CO 0.05 0.73 -0.22 0.50 0.02 0.00 0.00 177.57 178.64 2w0s h LYS 180 N 0.32 -0.59 -0.70 1.57 3.64 -0.50 -0.14 116.57 120.17 2w0s h LYS 180 Ca -0.17 0.04 0.14 0.00 -1.27 0.00 0.00 60.65 59.40 2w0s h LYS 180 Cb 1.84 0.13 -0.13 0.00 -0.41 0.00 0.00 32.23 33.66 2w0s h LYS 180 CO 0.23 -0.39 -0.15 -0.22 -2.27 0.00 0.00 179.45 176.64 2w0s h LYS 181 N -0.61 0.01 -0.23 1.90 1.63 -1.17 -0.69 116.57 117.41 2w0s h LYS 181 Ca -0.06 -0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.73 2w0s h LYS 181 Cb 0.48 -0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.09 2w0s h LYS 181 CO 0.09 0.01 0.11 0.93 -3.45 0.00 0.00 179.45 177.14 2w0s h GLU 182 N 0.01 0.34 0.17 1.90 4.39 -1.08 -1.93 114.58 118.37 2w0s h GLU 182 Ca 0.34 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.99 2w0s h GLU 182 Cb 0.53 -0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 29.12 2w0s h GLU 182 CO -0.70 0.34 -0.11 1.25 -1.16 0.00 0.00 179.01 178.63 2w0s h LEU 183 N 0.25 -0.27 -0.15 1.33 6.46 -0.23 -1.38 115.31 121.32 2w0s h LEU 183 Ca 0.08 0.02 0.01 0.00 -0.12 0.00 0.00 57.88 57.87 2w0s h LEU 183 Cb 0.11 0.08 -0.01 0.00 -0.73 0.00 0.00 40.66 40.11 2w0s h LEU 183 CO -0.01 -0.17 0.07 0.40 -0.62 0.00 0.00 178.44 178.11 2w0s h ILE 184 N -0.27 1.00 -1.04 4.05 2.04 -1.19 -1.61 117.51 120.48 2w0s h ILE 184 Ca -0.01 -0.06 0.26 0.00 1.00 0.00 0.00 64.86 66.05 2w0s h ILE 184 Cb 0.23 0.82 -0.10 0.00 -0.74 0.00 0.00 36.82 37.03 2w0s h ILE 184 CO 0.01 0.03 0.66 0.50 0.00 0.00 0.00 178.15 179.35 2w0s h LYS 185 N 0.16 0.42 -0.09 2.37 3.11 -1.12 0.48 116.57 121.90 2w0s h LYS 185 Ca 0.06 -0.03 -0.21 0.00 -2.81 0.00 0.00 60.65 57.67 2w0s h LYS 185 Cb 0.01 -0.09 0.01 0.00 -1.00 0.00 0.00 32.23 31.16 2w0s h LYS 185 CO -0.04 0.28 -0.76 -0.91 -2.81 0.00 0.00 179.45 175.21 2w0s h ASN 186 N 0.43 0.82 0.19 4.20 2.35 -0.31 -2.71 115.58 120.54 2w0s h ASN 186 Ca 0.61 -0.67 -0.13 0.00 -0.55 0.00 0.00 56.30 55.55 2w0s h ASN 186 Cb 1.45 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 39.57 2w0s h ASN 186 CO -0.33 1.37 -0.50 0.16 -1.65 0.00 0.00 177.43 176.47 2w0s h ILE 187 N 0.33 1.34 0.62 2.81 3.07 -0.69 -2.86 117.51 122.14 2w0s h ILE 187 Ca -0.07 -1.74 -0.03 0.00 1.55 0.00 0.00 64.86 64.57 2w0s h ILE 187 Cb 1.40 1.78 0.01 0.00 -0.27 0.00 0.00 36.82 39.74 2w0s h ILE 187 CO 0.15 0.53 -0.30 0.58 -1.05 0.00 0.00 178.15 178.06 2w0s h VAL 188 N 0.28 0.32 -0.21 0.16 2.07 -0.96 0.11 116.25 118.03 2w0s h VAL 188 Ca 0.01 -0.19 0.06 0.00 0.82 0.00 0.00 66.70 67.40 2w0s h VAL 188 Cb 0.98 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 2w0s h VAL 188 CO 0.08 0.02 0.16 0.16 0.02 0.00 0.00 177.57 178.02 2w0s h ILE 189 N -0.98 0.79 -0.04 4.57 3.07 -1.54 -1.46 117.51 121.93 2w0s h ILE 189 Ca -0.09 0.00 -0.04 0.00 1.55 0.00 0.00 64.86 66.28 2w0s h ILE 189 Cb 0.68 0.88 0.00 0.00 -0.27 0.00 0.00 36.82 38.12 2w0s h ILE 189 CO 0.14 0.00 -0.13 -0.08 -1.05 0.00 0.00 178.15 177.03 2w0s h GLU 190 N 0.00 0.16 -1.11 0.16 4.81 -1.20 -2.35 114.58 115.05 2w0s h GLU 190 Ca 0.10 -0.12 0.34 0.00 -0.13 0.00 0.00 59.36 59.55 2w0s h GLU 190 Cb 0.43 0.02 -0.13 0.00 0.63 0.00 0.00 28.75 29.70 2w0s h GLU 190 CO -0.00 0.75 0.69 0.00 -0.73 0.00 0.00 179.01 179.72 2w0s h ALA 191 N 0.41 2.28 0.03 2.92 0.00 0.19 -0.98 119.26 124.11 2w0s h ALA 191 Ca -0.01 0.13 -0.23 0.00 0.00 0.00 0.00 54.91 54.80 2w0s h ALA 191 Cb 0.77 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2w0s h ALA 191 CO 0.03 -0.84 -0.99 0.82 0.00 0.00 0.00 179.25 178.27 2w0s h ILE 192 N 0.27 1.43 0.00 0.00 2.04 -0.94 -3.15 117.51 117.17 2w0s h ILE 192 Ca 0.72 -2.58 -0.23 0.00 1.00 0.00 0.00 64.86 63.76 2w0s h ILE 192 Cb 1.90 2.53 -0.03 0.00 -0.74 0.00 0.00 36.82 40.48 2w0s h ILE 192 CO -0.45 0.77 -1.19 0.45 0.00 0.00 0.00 178.15 177.72 2w0s h HIS 193 N 0.19 0.02 -0.33 1.37 3.86 -0.89 -3.34 115.15 116.02 2w0s h HIS 193 Ca -0.09 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.11 2w0s h HIS 193 Cb 1.65 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.12 2w0s h HIS 193 CO 0.06 1.01 0.00 0.25 0.86 0.00 0.00 177.93 180.11 2w0s n THR 194 N -3.28 1.06 -3.13 2.45 -2.24 -0.43 -4.93 114.28 103.78 2w0s n THR 194 Ca -0.05 -0.64 -0.39 0.00 -2.27 0.00 0.00 64.05 60.70 2w0s n THR 194 Cb 0.97 -0.13 -0.06 0.00 -2.10 0.00 0.00 70.33 69.02 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 -1.74 4.65 0.04 2.28 1.01 -1.19 -5.02 120.40 120.42 2w0s s VAL 195 Ca 0.27 1.44 -0.12 0.00 0.00 0.00 0.00 61.98 63.57 2w0s s VAL 195 Cb 0.18 -4.01 0.01 0.00 0.00 0.00 0.00 36.38 32.56 2w0s s VAL 195 CO 0.12 0.50 0.25 0.42 0.00 0.00 0.00 175.10 176.39 2w0s s THR 196 N -0.82 0.09 0.00 3.92 -4.23 -1.26 -4.70 115.64 108.64 2w0s s THR 196 Ca 0.33 -0.75 0.00 0.00 -1.18 0.00 0.00 61.69 60.09 2w0s s THR 196 Cb -0.21 -0.88 0.00 0.00 1.34 0.00 0.00 72.50 72.76 2w0s s THR 196 CO 0.22 -0.41 0.00 0.61 -0.54 0.00 0.00 174.62 174.49 2w0s n GLY 197 N 0.72 -1.82 3.85 3.99 0.00 -1.26 -4.94 105.19 105.73 2w0s n GLY 197 Ca -0.19 -1.85 -0.32 0.00 0.00 0.00 0.00 46.02 43.67 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 3.97 0.15 1.61 0.04 -1.26 -4.70 135.00 134.80 2w0s s PRO 198 Ca 0.00 0.74 -0.32 0.00 0.04 0.00 0.00 61.00 61.46 2w0s s PRO 198 Cb 0.00 -2.32 -0.12 0.00 0.04 0.00 0.00 34.50 32.10 2w0s s PRO 198 CO 0.00 -0.01 1.75 0.28 0.04 0.00 0.00 177.00 179.06 2w0s n VAL 199 N -0.90 0.18 -1.43 -0.36 0.31 -1.26 -4.98 118.33 109.88 2w0s n VAL 199 Ca 0.04 -0.03 -0.31 0.00 -0.01 0.00 0.00 64.34 64.03 2w0s n VAL 199 Cb 0.54 -1.96 0.08 0.00 -0.91 0.00 0.00 33.84 31.59 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 1.91 1.66 -0.13 2.92 0.00 -1.26 -4.86 107.32 107.56 2w0s s GLY 200 Ca 0.79 0.07 -0.02 0.00 0.00 0.00 0.00 44.72 45.56 2w0s s GLY 200 CO 0.36 0.43 -0.04 1.20 0.00 0.00 0.00 173.10 175.05 2w0s s GLN 201 N -5.01 3.38 0.21 2.90 -0.21 -1.26 0.08 119.66 119.74 2w0s s GLN 201 Ca 0.60 -0.52 -0.30 0.00 0.02 0.00 0.00 55.36 55.17 2w0s s GLN 201 Cb -0.15 -2.82 -0.08 0.00 1.00 0.00 0.00 33.01 30.95 2w0s s GLN 201 CO 0.55 0.39 1.21 -1.17 -2.12 0.00 0.00 175.29 174.16 2w0s s LEU 202 N -0.05 4.45 -1.49 2.90 2.96 0.32 -3.80 118.68 123.97 2w0s s LEU 202 Ca 0.01 2.29 -0.02 0.00 -0.22 0.00 0.00 54.13 56.20 2w0s s LEU 202 Cb -0.13 -3.61 0.01 0.00 0.50 0.00 0.00 46.19 42.96 2w0s s LEU 202 CO 0.03 -0.38 0.29 0.79 -1.32 0.00 0.00 176.35 175.75 2w0s n TRP 203 N 2.29 -1.50 -0.19 5.38 8.01 -1.26 -1.46 117.44 128.72 2w0s n TRP 203 Ca 0.04 0.70 0.00 0.00 -1.31 0.00 0.00 57.50 56.93 2w0s n TRP 203 Cb 0.44 -3.31 0.00 0.00 -2.01 0.00 0.00 31.31 26.43 2w0s n TRP 203 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.69 175.35