#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x9s n LEU 6 N 0.00 0.00 0.36 -2.67 -0.00 -1.26 -5.07 117.00 108.36 2x9s n LEU 6 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 56.01 55.85 2x9s n LEU 6 Cb 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 43.42 43.34 2x9s n LEU 6 CO 0.00 0.00 0.49 0.03 -0.00 0.00 0.00 177.39 177.91 2x9s h ARG 7 N 0.00 -0.88 -7.28 1.47 2.47 -2.09 -3.42 114.38 104.64 2x9s h ARG 7 Ca 0.00 0.06 -0.52 0.00 -1.26 0.00 0.00 59.98 58.26 2x9s h ARG 7 Cb 0.00 0.20 0.14 0.00 -1.65 0.00 0.00 29.97 28.66 2x9s h ARG 7 CO 0.00 -0.56 0.32 -1.25 0.56 0.00 0.00 179.97 179.04 2x9s s PRO 8 N -5.16 2.14 -0.06 0.04 0.04 -1.26 -4.11 135.00 126.63 2x9s s PRO 8 Ca -0.16 1.30 0.00 0.00 0.04 0.00 0.00 61.00 62.18 2x9s s PRO 8 Cb 0.02 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.68 2x9s s PRO 8 CO 0.51 -1.75 0.00 -1.71 0.04 0.00 0.00 177.00 174.10 2x9s n ASN 9 N -3.41 -0.95 0.01 6.66 5.15 -1.26 -4.69 115.26 116.77 2x9s n ASN 9 Ca 0.10 0.38 0.13 0.00 -0.60 0.00 0.00 54.58 54.59 2x9s n ASN 9 Cb 0.53 -1.02 0.57 0.00 -0.53 0.00 0.00 39.78 39.33 2x9s n ASN 9 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 2x9s n PRO 10 N -2.19 0.02 -0.23 1.20 -0.04 -1.26 -4.90 135.00 127.60 2x9s n PRO 10 Ca -0.01 0.04 -0.08 0.00 -0.04 0.00 0.00 63.50 63.42 2x9s n PRO 10 Cb 0.40 -1.52 0.01 0.00 -0.04 0.00 0.00 33.50 32.34 2x9s n PRO 10 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2x9s n GLY 11 N 1.32 -0.83 3.69 0.55 0.00 -1.26 -4.84 105.19 103.83 2x9s n GLY 11 Ca 0.07 -0.11 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 2x9s n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x9s n ALA 12 N -0.42 1.22 -1.98 4.61 0.00 -1.26 -5.01 120.51 117.68 2x9s n ALA 12 Ca 0.01 0.28 -0.24 0.00 0.00 0.00 0.00 53.44 53.49 2x9s n ALA 12 Cb 0.11 -2.25 0.10 0.00 0.00 0.00 0.00 19.45 17.40 2x9s n ALA 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2x9s s ASN 13 N -0.51 4.49 0.00 0.00 6.03 -1.26 -4.93 114.94 118.76 2x9s s ASN 13 Ca 0.60 -0.18 0.00 0.00 -1.03 0.00 0.00 52.86 52.25 2x9s s ASN 13 Cb -0.52 -0.30 0.00 0.00 -3.03 0.00 0.00 41.25 37.40 2x9s s ASN 13 CO 0.59 -1.76 0.00 0.29 -2.03 0.00 0.00 177.10 174.19 2x9s n LYS 14 N -2.81 0.00 -3.45 3.55 5.02 -1.26 -4.05 118.16 115.17 2x9s n LYS 14 Ca 0.13 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.99 2x9s n LYS 14 Cb 0.60 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 35.53 2x9s n LYS 14 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2x9s s ARG 15 N 0.00 2.84 -0.06 1.97 0.52 -1.26 -4.77 118.95 118.19 2x9s s ARG 15 Ca 0.00 -1.47 0.01 0.00 -0.52 0.00 0.00 55.73 53.75 2x9s s ARG 15 Cb 0.00 -4.05 -0.04 0.00 0.52 0.00 0.00 34.95 31.38 2x9s s ARG 15 CO 0.00 -1.07 -0.04 2.89 0.02 0.00 0.00 175.30 177.10 2x9s n ARG 16 N 5.11 0.55 0.00 3.54 -4.01 -1.26 -5.00 116.66 115.59 2x9s n ARG 16 Ca -0.12 0.03 0.00 0.00 -1.04 0.00 0.00 57.85 56.72 2x9s n ARG 16 Cb 0.43 -1.12 0.00 0.00 -3.04 0.00 0.00 32.46 28.73 2x9s n ARG 16 CO 0.00 0.00 0.00 1.17 -3.04 0.00 0.00 177.63 175.76 2x9s n LYS 17 N -2.61 -1.09 0.00 2.89 4.81 -1.26 -4.75 118.16 116.14 2x9s n LYS 17 Ca -0.10 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.34 2x9s n LYS 17 Cb 0.62 -1.71 0.00 0.00 0.02 0.00 0.00 35.03 33.95 2x9s n LYS 17 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2x9s n ARG 18 N 0.35 0.00 -1.26 1.64 5.12 -1.26 -4.32 116.66 116.92 2x9s n ARG 18 Ca 0.00 0.00 -0.23 0.00 -1.93 0.00 0.00 57.85 55.69 2x9s n ARG 18 Cb 0.00 0.00 -0.17 0.00 -1.16 0.00 0.00 32.46 31.13 2x9s n ARG 18 CO 0.00 0.00 0.00 1.33 -1.93 0.00 0.00 177.63 177.03 2x9s n VAL 19 N -2.43 0.00 0.00 1.55 0.24 -1.26 -4.87 118.33 111.56 2x9s n VAL 19 Ca 0.00 -0.30 0.00 0.00 -2.04 0.00 0.00 64.34 62.00 2x9s n VAL 19 Cb 0.00 -0.12 0.00 0.00 -1.47 0.00 0.00 33.84 32.25 2x9s n VAL 19 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2x9s n GLY 20 N 4.87 -1.55 2.89 7.63 0.00 -1.26 -5.03 105.19 112.75 2x9s n GLY 20 Ca 0.57 -1.27 -0.29 0.00 0.00 0.00 0.00 46.02 45.03 2x9s n GLY 20 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2x9s s ARG 21 N 0.00 1.43 -0.12 1.61 3.52 -1.26 -5.12 118.95 119.01 2x9s s ARG 21 Ca 0.00 -0.72 -0.06 0.00 -0.13 0.00 0.00 55.73 54.82 2x9s s ARG 21 Cb 0.00 -2.29 -0.04 0.00 -1.56 0.00 0.00 34.95 31.06 2x9s s ARG 21 CO 0.00 -0.53 0.11 0.20 -0.81 0.00 0.00 175.30 174.27 2x9s s GLY 22 N 1.56 2.10 -0.67 8.12 0.00 -1.26 -5.07 107.32 112.09 2x9s s GLY 22 Ca -0.02 -0.67 -0.01 0.00 0.00 0.00 0.00 44.72 44.01 2x9s s GLY 22 CO -0.07 -0.37 0.49 -4.14 0.00 0.00 0.00 173.10 169.00 2x9s s PRO 23 N -0.89 2.61 -0.29 2.90 0.02 -1.26 -4.72 135.00 133.37 2x9s s PRO 23 Ca 0.14 -2.77 0.01 0.00 0.02 0.00 0.00 61.00 58.40 2x9s s PRO 23 Cb -0.12 -3.69 0.19 0.00 0.02 0.00 0.00 34.50 30.91 2x9s s PRO 23 CO 0.03 -1.19 0.67 0.20 -0.33 0.00 0.00 177.00 176.38 2x9s s GLY 24 N 0.17 -1.11 0.00 0.52 0.00 -1.21 -4.75 107.32 100.94 2x9s s GLY 24 Ca 0.20 1.48 0.00 0.00 0.00 0.00 0.00 44.72 46.39 2x9s s GLY 24 CO -0.06 3.67 0.00 -1.14 0.00 0.00 0.00 173.10 175.57 2x9s n SER 25 N 5.39 0.00 -0.32 1.64 3.41 -1.26 -4.96 113.62 117.52 2x9s n SER 25 Ca 0.03 0.00 0.16 0.00 -0.26 0.00 0.00 58.87 58.81 2x9s n SER 25 Cb 0.54 0.00 0.36 0.00 -0.26 0.00 0.00 64.21 64.84 2x9s n SER 25 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2x9s h GLY 26 N 0.00 1.71 -7.56 5.00 0.00 -2.00 -3.28 103.07 96.94 2x9s h GLY 26 Ca 0.00 -0.20 -0.68 0.00 0.00 0.00 0.00 47.33 46.45 2x9s h GLY 26 CO 0.00 -0.31 -0.54 -1.58 0.00 0.00 0.00 176.54 174.11 2x9s s HIS 27 N -5.82 3.19 0.00 5.60 5.65 -1.26 -4.79 115.29 117.86 2x9s s HIS 27 Ca -0.11 -0.57 0.00 0.00 0.25 0.00 0.00 55.06 54.63 2x9s s HIS 27 Cb 0.27 -2.38 0.00 0.00 -1.18 0.00 0.00 32.58 29.29 2x9s s HIS 27 CO 0.78 -0.47 0.00 0.41 -0.65 0.00 0.00 174.74 174.82 2x9s n GLY 28 N 5.00 1.54 2.34 1.59 0.00 -1.26 -4.90 105.19 109.49 2x9s n GLY 28 Ca -0.13 -0.69 -0.26 0.00 0.00 0.00 0.00 46.02 44.94 2x9s n GLY 28 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2x9s n LYS 29 N 0.00 1.82 0.00 1.61 4.01 -1.26 -4.85 118.16 119.50 2x9s n LYS 29 Ca 0.00 -4.10 0.00 0.00 -0.51 0.00 0.00 58.31 53.70 2x9s n LYS 29 Cb 0.00 -1.85 0.00 0.00 -0.51 0.00 0.00 35.03 32.67 2x9s n LYS 29 CO 0.00 0.00 0.00 2.41 -1.11 0.00 0.00 177.40 178.70 2x9s n THR 30 N 1.04 0.00 0.00 -0.18 -1.04 -1.24 -3.31 114.28 109.55 2x9s n THR 30 Ca 0.26 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.27 2x9s n THR 30 Cb 0.46 -1.98 0.00 0.00 -1.82 0.00 0.00 70.33 66.99 2x9s n THR 30 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2x9s n ALA 31 N -3.00 0.00 -0.28 2.41 0.00 -1.26 -0.06 120.51 118.33 2x9s n ALA 31 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.52 2x9s n ALA 31 Cb 0.00 0.00 0.16 0.00 0.00 0.00 0.00 19.45 19.61 2x9s n ALA 31 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2x9s n THR 32 N 0.00 -0.33 0.00 0.00 -2.24 -1.26 -4.89 114.28 105.56 2x9s n THR 32 Ca 0.00 1.75 0.00 0.00 -2.27 0.00 0.00 64.05 63.53 2x9s n THR 32 Cb 0.00 -2.48 0.00 0.00 -2.10 0.00 0.00 70.33 65.75 2x9s n THR 32 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2x9s n ARG 33 N -5.19 0.00 -2.56 -0.78 3.00 0.92 -4.78 116.66 107.27 2x9s n ARG 33 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.00 2x9s n ARG 33 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.94 2x9s n ARG 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2x9s n GLY 34 N 0.51 0.00 0.00 5.14 0.00 -1.25 -4.28 105.19 105.31 2x9s n GLY 34 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2x9s n GLY 34 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2x9s n HIS 35 N -0.76 0.00 -1.25 1.61 8.25 -1.26 -5.11 115.22 116.70 2x9s n HIS 35 Ca 0.00 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.51 2x9s n HIS 35 Cb 0.00 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.10 2x9s n HIS 35 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2x9s n LYS 36 N -1.70 -0.69 0.00 -0.41 5.02 -1.26 -4.80 118.16 114.32 2x9s n LYS 36 Ca 0.00 0.46 0.00 0.00 -2.02 0.00 0.00 58.31 56.75 2x9s n LYS 36 Cb 0.00 -0.84 0.00 0.00 -0.02 0.00 0.00 35.03 34.17 2x9s n LYS 36 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2x9s n GLY 37 N -1.56 -0.96 0.00 0.72 0.00 -1.26 -4.89 105.19 97.23 2x9s n GLY 37 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2x9s n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x9s n GLN 38 N 0.00 0.00 0.00 1.61 10.64 -1.26 -5.13 117.38 123.24 2x9s n GLN 38 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 2x9s n GLN 38 Cb 0.00 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.38 2x9s n GLN 38 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 2x9s n LYS 39 N 0.00 0.00 -0.64 2.61 4.76 -1.26 -4.99 118.16 118.64 2x9s n LYS 39 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2x9s n LYS 39 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 2x9s n LYS 39 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2x9s n SER 40 N 0.00 -0.49 -3.51 4.39 2.88 -1.26 -5.03 113.62 110.60 2x9s n SER 40 Ca 0.00 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.25 2x9s n SER 40 Cb 0.00 -0.13 -0.12 0.00 -0.75 0.00 0.00 64.21 63.21 2x9s n SER 40 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2x9s s ARG 41 N -1.40 0.88 0.06 -1.46 1.81 -1.26 -4.65 118.95 112.93 2x9s s ARG 41 Ca 0.00 -1.76 0.00 0.00 -1.72 0.00 0.00 55.73 52.25 2x9s s ARG 41 Cb 0.00 -1.63 0.00 0.00 -0.45 0.00 0.00 34.95 32.87 2x9s s ARG 41 CO 0.00 -1.25 0.00 -1.13 -0.68 0.00 0.00 175.30 172.24 2x9s n SER 42 N 3.53 -0.57 0.00 0.23 3.41 -1.26 -4.95 113.62 114.01 2x9s n SER 42 Ca 0.17 0.12 0.00 0.00 -0.26 0.00 0.00 58.87 58.90 2x9s n SER 42 Cb 0.39 0.95 0.00 0.00 -0.26 0.00 0.00 64.21 65.29 2x9s n SER 42 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2x9s n GLY 43 N -1.45 1.00 0.00 5.00 0.00 -1.26 -5.15 105.19 103.33 2x9s n GLY 43 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2x9s n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x9s n GLY 44 N 0.00 1.83 0.00 -0.02 0.00 -1.26 -5.10 105.19 100.63 2x9s n GLY 44 Ca 0.00 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 44.09 2x9s n GLY 44 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2x9s n LEU 45 N 0.00 0.00 -0.00 0.99 4.77 -1.26 -4.75 117.00 116.75 2x9s n LEU 45 Ca 0.00 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 56.02 2x9s n LEU 45 Cb 0.00 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.04 2x9s n LEU 45 CO 0.00 0.00 -0.13 0.29 -1.33 0.00 0.00 177.39 176.22 2x9s n LYS 46 N 0.00 3.64 0.00 3.23 5.02 -1.26 -5.07 118.16 123.72 2x9s n LYS 46 Ca 0.00 -0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 2x9s n LYS 46 Cb 0.00 -0.92 0.00 0.00 -0.02 0.00 0.00 35.03 34.09 2x9s n LYS 46 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2x9s n ASP 47 N -1.30 0.00 -0.08 4.39 8.00 -1.26 -4.77 116.55 121.54 2x9s n ASP 47 Ca 0.01 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.35 2x9s n ASP 47 Cb 0.14 0.00 -0.12 0.00 -0.02 0.00 0.00 41.12 41.11 2x9s n ASP 47 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 2x9s h PRO 48 N 0.00 0.00 0.00 -0.24 0.13 -1.98 -3.49 132.00 126.42 2x9s h PRO 48 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2x9s h PRO 48 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2x9s h PRO 48 CO 0.00 0.98 0.00 0.54 -0.23 0.00 0.00 178.00 179.29 2x9s n ARG 49 N -4.57 0.00 -0.07 0.86 1.74 -1.26 0.00 116.66 113.35 2x9s n ARG 49 Ca -0.15 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 56.87 2x9s n ARG 49 Cb 0.51 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.93 2x9s n ARG 49 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 2x9s n ARG 50 N 0.00 0.44 -0.78 5.56 1.85 -1.26 -5.04 116.66 117.43 2x9s n ARG 50 Ca 0.00 0.34 -0.30 0.00 -1.00 0.00 0.00 57.85 56.88 2x9s n ARG 50 Cb 0.00 -1.46 0.10 0.00 -1.05 0.00 0.00 32.46 30.05 2x9s n ARG 50 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 2x9s n PHE 51 N -4.32 -1.49 -1.29 2.89 3.72 0.10 -4.83 117.46 112.24 2x9s n PHE 51 Ca -0.10 0.37 0.09 0.00 -0.05 0.00 0.00 57.45 57.76 2x9s n PHE 51 Cb 0.36 -1.45 -0.05 0.00 -0.94 0.00 0.00 39.48 37.40 2x9s n PHE 51 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2x9s n GLU 52 N 0.06 -2.67 0.00 -1.08 -0.58 -1.26 -4.81 120.64 110.30 2x9s n GLU 52 Ca 0.00 2.14 0.00 0.00 -0.42 0.00 0.00 57.16 58.89 2x9s n GLU 52 Cb 0.59 -3.06 0.00 0.00 -0.57 0.00 0.00 31.44 28.40 2x9s n GLU 52 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2x9s n GLY 53 N -3.52 2.31 0.00 0.62 0.00 -1.26 -4.60 105.19 98.73 2x9s n GLY 53 Ca -0.05 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.66 2x9s n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x9s n GLY 54 N 0.00 1.26 0.00 -0.02 0.00 -1.26 -5.06 105.19 100.11 2x9s n GLY 54 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2x9s n GLY 54 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2x9s n ARG 55 N -0.33 0.00 0.00 1.61 0.63 -1.26 -5.01 116.66 112.30 2x9s n ARG 55 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2x9s n ARG 55 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 2x9s n ARG 55 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 2x9s n SER 56 N 0.00 0.64 0.00 6.15 7.64 -1.26 -5.06 113.62 121.74 2x9s n SER 56 Ca 0.00 -1.27 0.00 0.00 1.01 0.00 0.00 58.87 58.61 2x9s n SER 56 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2x9s n SER 56 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2x9s n THR 57 N -0.14 0.00 -2.65 0.44 -2.24 -1.26 -2.33 114.28 106.09 2x9s n THR 57 Ca 0.00 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.75 2x9s n THR 57 Cb 0.34 0.00 0.10 0.00 -2.10 0.00 0.00 70.33 68.67 2x9s n THR 57 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2x9s n THR 58 N 0.00 0.00 -0.85 4.28 -1.04 -1.26 -4.89 114.28 110.52 2x9s n THR 58 Ca 0.00 -0.56 0.08 0.00 -2.04 0.00 0.00 64.05 61.53 2x9s n THR 58 Cb 0.00 0.97 0.18 0.00 -1.82 0.00 0.00 70.33 69.67 2x9s n THR 58 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 2x9s n LEU 59 N 0.38 3.09 0.08 -4.42 7.94 -0.99 -4.25 117.00 118.83 2x9s n LEU 59 Ca -0.10 -2.85 -0.02 0.00 -1.11 0.00 0.00 56.01 51.94 2x9s n LEU 59 Cb 0.75 -0.43 -0.05 0.00 0.53 0.00 0.00 43.42 44.22 2x9s n LEU 59 CO -0.12 0.68 0.13 0.24 -1.11 0.00 0.00 177.39 177.21 2x9s h MET 60 N 1.04 0.00 -6.88 1.96 2.86 -1.91 -3.45 114.93 108.56 2x9s h MET 60 Ca 0.00 0.00 -0.53 0.00 -2.06 0.00 0.00 59.70 57.11 2x9s h MET 60 Cb 1.13 0.00 0.08 0.00 0.06 0.00 0.00 31.60 32.87 2x9s h MET 60 CO 0.10 0.60 0.72 -0.98 1.06 0.00 0.00 176.91 178.41 2x9s s ARG 61 N -2.85 4.24 0.20 1.72 1.04 -1.26 -4.99 118.95 117.05 2x9s s ARG 61 Ca 0.01 2.38 -0.08 0.00 -1.04 0.00 0.00 55.73 57.00 2x9s s ARG 61 Cb 0.08 -3.04 -0.07 0.00 -2.04 0.00 0.00 34.95 29.89 2x9s s ARG 61 CO 0.79 -0.37 0.49 -0.48 -0.04 0.00 0.00 175.30 175.69 2x9s s LEU 62 N -1.63 4.20 -1.03 -1.89 2.34 -1.26 -5.05 118.68 114.35 2x9s s LEU 62 Ca 0.53 0.81 -0.07 0.00 0.06 0.00 0.00 54.13 55.46 2x9s s LEU 62 Cb -0.43 -3.57 0.26 0.00 -0.56 0.00 0.00 46.19 41.89 2x9s s LEU 62 CO 0.55 -0.03 0.99 -2.16 -1.06 0.00 0.00 176.35 174.64 2x9s s PRO 63 N -2.77 3.88 0.00 1.48 0.04 -1.26 -4.72 135.00 131.64 2x9s s PRO 63 Ca 0.45 -3.20 0.19 0.00 0.04 0.00 0.00 61.00 58.48 2x9s s PRO 63 Cb -0.11 -4.36 0.86 0.00 0.04 0.00 0.00 34.50 30.92 2x9s s PRO 63 CO 0.22 -1.25 1.59 1.17 0.04 0.00 0.00 177.00 178.77 2x9s n LYS 64 N 2.65 0.11 -1.10 4.56 0.00 -1.26 -3.81 118.16 119.31 2x9s n LYS 64 Ca 0.22 0.15 -0.40 0.00 0.00 0.00 0.00 58.31 58.29 2x9s n LYS 64 Cb 0.39 -1.50 -0.05 0.00 0.00 0.00 0.00 35.03 33.87 2x9s n LYS 64 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 2x9s n ARG 65 N -1.41 1.63 -1.56 1.64 0.63 -1.26 -4.86 116.66 111.46 2x9s n ARG 65 Ca 0.06 -1.80 -0.30 0.00 -0.92 0.00 0.00 57.85 54.89 2x9s n ARG 65 Cb 0.19 -2.85 0.20 0.00 0.45 0.00 0.00 32.46 30.45 2x9s n ARG 65 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 2x9s s GLY 66 N 4.69 1.68 -0.06 5.14 0.00 -1.25 -4.68 107.32 112.83 2x9s s GLY 66 Ca 0.54 -1.03 -0.00 0.00 0.00 0.00 0.00 44.72 44.23 2x9s s GLY 66 CO 0.09 -0.24 0.06 -0.13 0.00 0.00 0.00 173.10 172.88 2x9s n MET 67 N -4.14 -0.13 -0.03 2.90 0.00 -1.26 -5.00 117.12 109.46 2x9s n MET 67 Ca 0.13 0.39 -0.14 0.00 -0.00 0.00 0.00 57.70 58.08 2x9s n MET 67 Cb 0.59 -1.83 -0.11 0.00 0.00 0.00 0.00 33.22 31.88 2x9s n MET 67 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 175.97 177.93 2x9s h GLN 68 N -0.01 0.11 0.00 2.12 4.20 -2.01 -3.50 115.11 116.02 2x9s h GLN 68 Ca -0.02 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.59 2x9s h GLN 68 Cb 1.01 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.81 2x9s h GLN 68 CO 0.03 0.82 0.00 0.41 -0.67 0.00 0.00 178.83 179.42 2x9s n GLY 69 N 0.92 4.88 3.92 3.46 0.00 -1.26 -5.08 105.19 112.02 2x9s n GLY 69 Ca -0.09 -0.97 -0.27 0.00 0.00 0.00 0.00 46.02 44.69 2x9s n GLY 69 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2x9s s GLN 70 N -4.56 2.85 0.20 1.61 2.00 -1.26 -5.02 119.66 115.48 2x9s s GLN 70 Ca 0.00 -0.02 -0.11 0.00 -2.00 0.00 0.00 55.36 53.23 2x9s s GLN 70 Cb 0.00 -2.26 0.15 0.00 0.80 0.00 0.00 33.01 31.70 2x9s s GLN 70 CO 0.00 -0.76 1.85 -0.24 -0.50 0.00 0.00 175.29 175.64 2x9s h VAL 71 N -0.22 1.12 -0.38 1.34 3.04 -2.04 -2.79 116.25 116.33 2x9s h VAL 71 Ca -0.45 -0.29 0.11 0.00 -1.01 0.00 0.00 66.70 65.06 2x9s h VAL 71 Cb 1.26 0.20 -0.02 0.00 -2.01 0.00 0.00 31.29 30.72 2x9s h VAL 71 CO 0.61 0.16 0.53 -0.65 -1.01 0.00 0.00 177.57 177.20 2x9s h PRO 72 N 0.85 0.00 0.00 4.17 0.11 -2.07 -3.47 132.00 131.60 2x9s h PRO 72 Ca 0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.37 2x9s h PRO 72 Cb -0.03 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.08 2x9s h PRO 72 CO -0.08 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.12 2x9s n GLY 73 N -1.46 0.72 3.75 -0.55 0.00 -1.05 -5.05 105.19 101.55 2x9s n GLY 73 Ca 0.07 -2.32 -0.33 0.00 0.00 0.00 0.00 46.02 43.44 2x9s n GLY 73 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2x9s s GLU 74 N -0.97 2.42 -0.16 1.61 -1.05 -1.26 -4.65 118.70 114.65 2x9s s GLU 74 Ca 0.00 1.43 -0.20 0.00 -0.15 0.00 0.00 54.97 56.05 2x9s s GLU 74 Cb 0.00 -1.90 -0.03 0.00 -0.44 0.00 0.00 34.13 31.76 2x9s s GLU 74 CO 0.00 -1.55 0.58 0.42 0.95 0.00 0.00 175.26 175.66 2x9s s ILE 75 N -2.40 5.08 -0.34 1.83 1.09 -1.26 -5.00 121.20 120.21 2x9s s ILE 75 Ca 0.67 1.12 -0.28 0.00 -1.10 0.00 0.00 60.65 61.07 2x9s s ILE 75 Cb -0.22 -3.91 -0.03 0.00 -1.06 0.00 0.00 42.46 37.24 2x9s s ILE 75 CO 0.46 0.20 1.97 -0.75 -0.10 0.00 0.00 174.94 176.73 2x9s s LYS 76 N 1.34 3.11 -0.00 2.79 2.47 -1.26 -4.95 119.74 123.24 2x9s s LYS 76 Ca 0.29 1.52 -0.02 0.00 -1.56 0.00 0.00 55.97 56.20 2x9s s LYS 76 Cb -0.16 -4.29 -0.00 0.00 -1.46 0.00 0.00 37.83 31.91 2x9s s LYS 76 CO 0.11 -2.12 0.04 -0.98 0.16 0.00 0.00 175.35 172.56 2x9s s ARG 77 N 6.19 0.23 -0.00 4.03 1.70 -1.26 -5.12 118.95 124.72 2x9s s ARG 77 Ca 0.86 -0.26 -0.30 0.00 -0.47 0.00 0.00 55.73 55.56 2x9s s ARG 77 Cb -0.24 0.09 -0.09 0.00 -0.57 0.00 0.00 34.95 34.14 2x9s s ARG 77 CO 0.32 -0.04 1.99 -0.35 -1.08 0.00 0.00 175.30 176.14 2x9s n PRO 78 N 2.23 2.71 -3.75 3.89 -0.04 -1.26 -4.98 135.00 133.80 2x9s n PRO 78 Ca -0.18 0.98 -0.37 0.00 -0.04 0.00 0.00 63.50 63.88 2x9s n PRO 78 Cb 0.57 -2.99 -0.06 0.00 -0.04 0.00 0.00 33.50 30.98 2x9s n PRO 78 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 2x9s s ARG 79 N 4.60 3.68 -0.03 0.54 1.70 -1.26 -5.08 118.95 123.11 2x9s s ARG 79 Ca 0.91 0.02 -0.03 0.00 -0.47 0.00 0.00 55.73 56.16 2x9s s ARG 79 Cb -0.46 -3.23 -0.04 0.00 -0.57 0.00 0.00 34.95 30.65 2x9s s ARG 79 CO 0.43 0.68 0.16 0.71 -1.08 0.00 0.00 175.30 176.20 2x9s s TYR 80 N -0.83 3.52 -0.09 5.89 2.02 -1.26 -3.66 117.35 122.94 2x9s s TYR 80 Ca 0.17 0.36 0.01 0.00 -0.37 0.00 0.00 57.07 57.24 2x9s s TYR 80 Cb -0.13 -1.83 0.02 0.00 -0.40 0.00 0.00 41.96 39.61 2x9s s TYR 80 CO 0.06 0.65 -0.12 -1.14 -1.57 0.00 0.00 175.55 173.43 2x9s s GLN 81 N -1.77 1.84 1.17 -0.62 0.74 0.16 -5.02 119.66 116.15 2x9s s GLN 81 Ca 0.25 -0.42 -0.20 0.00 0.05 0.00 0.00 55.36 55.04 2x9s s GLN 81 Cb -0.12 -1.63 0.29 0.00 1.10 0.00 0.00 33.01 32.64 2x9s s GLN 81 CO 0.16 -0.09 1.12 0.41 -0.55 0.00 0.00 175.29 176.34 2x9s n GLY 82 N 4.27 -2.55 0.00 2.59 0.00 -1.26 -1.41 105.19 106.83 2x9s n GLY 82 Ca -0.19 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.30 2x9s n GLY 82 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2x9s n VAL 83 N -4.66 0.00 -0.94 1.61 3.14 -1.00 -4.72 118.33 111.76 2x9s n VAL 83 Ca 0.15 0.00 -0.29 0.00 -2.96 0.00 0.00 64.34 61.24 2x9s n VAL 83 Cb 0.58 0.00 0.18 0.00 -1.06 0.00 0.00 33.84 33.54 2x9s n VAL 83 CO 0.00 0.00 0.00 0.20 -6.46 0.00 0.00 176.83 170.57 2x9s s ASN 84 N 0.00 2.54 0.11 6.55 0.02 -1.26 -2.24 114.94 120.67 2x9s s ASN 84 Ca 0.00 1.55 -0.18 0.00 -1.02 0.00 0.00 52.86 53.21 2x9s s ASN 84 Cb 0.00 -2.22 -0.05 0.00 0.02 0.00 0.00 41.25 39.00 2x9s s ASN 84 CO 0.00 -3.23 1.65 -0.07 0.02 0.00 0.00 177.10 175.47 2x9s h LEU 85 N -1.96 0.39 -0.67 0.60 3.38 -0.71 -2.71 115.31 113.63 2x9s h LEU 85 Ca -0.53 -0.17 0.25 0.00 0.09 0.00 0.00 57.88 57.52 2x9s h LEU 85 Cb 1.30 -0.10 -0.12 0.00 0.09 0.00 0.00 40.66 41.83 2x9s h LEU 85 CO 0.52 0.45 0.23 0.29 0.09 0.00 0.00 178.44 180.02 2x9s n LYS 86 N -4.75 -0.05 0.00 1.13 5.02 -0.71 -0.80 118.16 118.01 2x9s n LYS 86 Ca -0.02 0.96 0.00 0.00 -2.02 0.00 0.00 58.31 57.23 2x9s n LYS 86 Cb 0.13 -1.65 0.00 0.00 -0.02 0.00 0.00 35.03 33.50 2x9s n LYS 86 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2x9s n ASP 87 N -4.67 0.00 -0.07 4.39 8.00 -1.02 -3.85 116.55 119.33 2x9s n ASP 87 Ca 0.22 0.40 0.05 0.00 0.71 0.00 0.00 54.79 56.17 2x9s n ASP 87 Cb 0.74 -0.02 0.09 0.00 -0.02 0.00 0.00 41.12 41.91 2x9s n ASP 87 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2x9s n LEU 88 N -0.57 0.02 -0.23 0.64 4.32 0.02 -1.19 117.00 120.01 2x9s n LEU 88 Ca 0.00 0.37 0.11 0.00 -0.02 0.00 0.00 56.01 56.46 2x9s n LEU 88 Cb 0.00 -0.15 0.21 0.00 -1.62 0.00 0.00 43.42 41.86 2x9s n LEU 88 CO 0.00 -0.39 0.54 0.00 -1.22 0.00 0.00 177.39 176.32 2x9s n ALA 89 N -3.23 0.36 -0.17 -1.18 0.00 -0.99 -1.22 120.51 114.08 2x9s n ALA 89 Ca 0.07 0.71 0.09 0.00 0.00 0.00 0.00 53.44 54.31 2x9s n ALA 89 Cb 0.22 -0.53 0.17 0.00 0.00 0.00 0.00 19.45 19.31 2x9s n ALA 89 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2x9s n ARG 90 N -4.86 -0.04 -4.20 0.00 0.63 -0.33 -4.53 116.66 103.34 2x9s n ARG 90 Ca 0.16 0.74 -0.17 0.00 -0.92 0.00 0.00 57.85 57.67 2x9s n ARG 90 Cb 0.54 -1.21 -0.11 0.00 0.45 0.00 0.00 32.46 32.13 2x9s n ARG 90 CO 0.00 0.00 0.00 -0.59 -2.51 0.00 0.00 177.63 174.53 2x9s s PHE 91 N -5.24 1.22 0.58 -0.14 -0.71 -0.35 -5.15 117.98 108.18 2x9s s PHE 91 Ca -0.06 -0.56 0.09 0.00 -1.04 0.00 0.00 56.93 55.36 2x9s s PHE 91 Cb 0.15 -0.66 0.09 0.00 -1.21 0.00 0.00 43.02 41.39 2x9s s PHE 91 CO 0.39 0.07 0.79 -2.00 -1.34 0.00 0.00 175.22 173.14 2x9s s GLU 92 N -2.43 2.29 1.04 1.99 2.56 -1.26 -4.95 118.70 117.94 2x9s s GLU 92 Ca 0.04 -1.60 0.00 0.00 0.00 0.00 0.00 54.97 53.42 2x9s s GLU 92 Cb -0.06 -2.64 0.00 0.00 2.00 0.00 0.00 34.13 33.44 2x9s s GLU 92 CO 0.02 -0.87 0.00 0.41 -0.56 0.00 0.00 175.26 174.26 2x9s n GLY 93 N -2.26 0.15 3.25 -1.50 0.00 -1.26 -4.79 105.19 98.77 2x9s n GLY 93 Ca 0.15 -1.55 -0.36 0.00 0.00 0.00 0.00 46.02 44.27 2x9s n GLY 93 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2x9s s GLU 94 N 0.00 2.71 0.29 1.61 2.12 -1.26 -3.80 118.70 120.38 2x9s s GLU 94 Ca 0.00 -1.09 -0.26 0.00 0.36 0.00 0.00 54.97 53.97 2x9s s GLU 94 Cb 0.00 -3.28 -0.10 0.00 0.26 0.00 0.00 34.13 31.01 2x9s s GLU 94 CO 0.00 -0.56 0.92 0.14 -0.54 0.00 0.00 175.26 175.23 2x9s s VAL 95 N 1.37 4.21 0.17 3.70 -7.23 -0.68 -4.98 120.40 116.97 2x9s s VAL 95 Ca -0.01 1.85 -0.12 0.00 -1.81 0.00 0.00 61.98 61.89 2x9s s VAL 95 Cb -0.19 -4.07 0.00 0.00 0.56 0.00 0.00 36.38 32.68 2x9s s VAL 95 CO 0.00 0.23 0.36 0.42 -0.31 0.00 0.00 175.10 175.81 2x9s s THR 96 N -1.50 0.05 1.23 5.32 -4.23 -1.26 -1.86 115.64 113.39 2x9s s THR 96 Ca 0.47 -1.19 -0.18 0.00 -1.18 0.00 0.00 61.69 59.61 2x9s s THR 96 Cb -0.20 -1.76 0.30 0.00 1.34 0.00 0.00 72.50 72.17 2x9s s THR 96 CO 0.25 -0.24 1.04 -2.84 -0.54 0.00 0.00 174.62 172.30 2x9s s PRO 97 N -3.94 -1.44 0.00 3.99 0.02 -1.26 -1.79 135.00 130.59 2x9s s PRO 97 Ca 0.15 0.20 0.00 0.00 0.02 0.00 0.00 61.00 61.37 2x9s s PRO 97 Cb 0.02 -1.55 0.00 0.00 0.02 0.00 0.00 34.50 32.99 2x9s s PRO 97 CO -0.01 -3.91 0.00 -1.91 -0.33 0.00 0.00 177.00 170.84 2x9s n GLU 98 N -4.95 0.00 0.17 5.54 4.07 -1.26 -4.05 120.64 120.16 2x9s n GLU 98 Ca 0.10 0.00 0.04 0.00 -0.06 0.00 0.00 57.16 57.24 2x9s n GLU 98 Cb 0.59 -0.03 0.28 0.00 -0.06 0.00 0.00 31.44 32.22 2x9s n GLU 98 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 2x9s h LEU 99 N 0.00 0.00 0.00 4.31 6.46 -1.83 0.19 115.31 124.44 2x9s h LEU 99 Ca 0.00 0.00 -0.27 0.00 -0.12 0.00 0.00 57.88 57.49 2x9s h LEU 99 Cb 0.00 0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 39.89 2x9s h LEU 99 CO 0.00 0.43 -1.47 -0.07 -0.62 0.00 0.00 178.44 176.72 2x9s h LEU 100 N 0.00 0.02 -0.05 2.25 3.38 -1.49 -3.33 115.31 116.08 2x9s h LEU 100 Ca -0.00 -0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.83 2x9s h LEU 100 Cb 0.98 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.73 2x9s h LEU 100 CO 0.06 1.02 -0.39 -0.37 0.09 0.00 0.00 178.44 178.85 2x9s h VAL 101 N 0.00 1.43 0.00 1.22 -1.51 -1.48 -2.08 116.25 113.84 2x9s h VAL 101 Ca -0.19 -1.84 -0.06 0.00 -1.23 0.00 0.00 66.70 63.38 2x9s h VAL 101 Cb 1.93 2.42 -0.02 0.00 -2.13 0.00 0.00 31.29 33.49 2x9s h VAL 101 CO 0.10 0.53 -0.04 -1.14 -1.23 0.00 0.00 177.57 175.79 2x9s n ARG 102 N -4.37 0.97 0.00 5.19 0.63 0.65 -4.15 116.66 115.57 2x9s n ARG 102 Ca -0.09 -0.31 0.00 0.00 -0.92 0.00 0.00 57.85 56.53 2x9s n ARG 102 Cb 0.55 -1.48 0.00 0.00 0.45 0.00 0.00 32.46 31.98 2x9s n ARG 102 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2x9s n ALA 103 N 2.14 0.00 -2.00 5.13 0.00 -1.15 -4.91 120.51 119.72 2x9s n ALA 103 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.57 2x9s n ALA 103 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 2x9s n ALA 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x9s n GLY 104 N 0.00 -0.07 2.70 0.00 0.00 -0.79 -5.09 105.19 101.94 2x9s n GLY 104 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 2x9s n GLY 104 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2x9s n LEU 105 N 0.00 0.00 0.00 0.99 4.32 -1.24 -4.66 117.00 116.41 2x9s n LEU 105 Ca 0.00 -0.96 0.00 0.00 -0.02 0.00 0.00 56.01 55.03 2x9s n LEU 105 Cb 0.00 -0.74 0.00 0.00 -1.62 0.00 0.00 43.42 41.06 2x9s n LEU 105 CO 0.00 -1.52 0.00 -0.11 -1.22 0.00 0.00 177.39 174.54 2x9s n LEU 106 N 0.00 0.00 -1.77 2.23 7.94 -1.26 -3.19 117.00 120.95 2x9s n LEU 106 Ca 0.12 0.00 -0.01 0.00 -1.11 0.00 0.00 56.01 55.01 2x9s n LEU 106 Cb 0.43 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.38 2x9s n LEU 106 CO 0.30 0.00 -0.23 2.29 -1.11 0.00 0.00 177.39 178.64 2x9s n LYS 107 N 0.00 -0.14 0.00 1.96 2.85 -1.26 -0.71 118.16 120.86 2x9s n LYS 107 Ca 0.00 0.36 0.00 0.00 -1.05 0.00 0.00 58.31 57.62 2x9s n LYS 107 Cb 0.00 -0.47 0.00 0.00 -0.65 0.00 0.00 35.03 33.91 2x9s n LYS 107 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2x9s n LYS 108 N 0.84 0.00 0.00 -1.58 4.01 -1.26 -4.70 118.16 115.47 2x9s n LYS 108 Ca -0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 2x9s n LYS 108 Cb 0.24 -3.38 0.00 0.00 -0.51 0.00 0.00 35.03 31.38 2x9s n LYS 108 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2x9s n GLY 109 N -1.50 -0.19 1.13 0.72 0.00 0.12 -4.86 105.19 100.61 2x9s n GLY 109 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2x9s n GLY 109 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2x9s n TYR 110 N -1.16 -3.12 -2.61 1.61 9.36 -1.26 -4.68 117.16 115.30 2x9s n TYR 110 Ca 0.00 1.67 -0.02 0.00 3.32 0.00 0.00 57.90 62.87 2x9s n TYR 110 Cb 0.26 -2.78 -0.01 0.00 -0.63 0.00 0.00 39.34 36.17 2x9s n TYR 110 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 2x9s n ARG 111 N -1.11 -2.52 -2.64 2.98 1.74 -1.24 -3.52 116.66 110.35 2x9s n ARG 111 Ca 0.00 1.97 -0.40 0.00 -0.77 0.00 0.00 57.85 58.64 2x9s n ARG 111 Cb 0.05 -2.49 -0.05 0.00 -1.02 0.00 0.00 32.46 28.95 2x9s n ARG 111 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2x9s s LEU 112 N -0.27 4.57 -0.32 0.55 1.98 -1.26 -0.67 118.68 123.26 2x9s s LEU 112 Ca -0.08 2.01 -0.02 0.00 -2.89 0.00 0.00 54.13 53.15 2x9s s LEU 112 Cb 0.01 -3.61 0.12 0.00 0.66 0.00 0.00 46.19 43.37 2x9s s LEU 112 CO 0.21 -0.02 0.18 -0.75 -1.89 0.00 0.00 176.35 174.07 2x9s s LYS 113 N -0.83 0.37 0.67 1.98 2.20 -0.50 -1.99 119.74 121.64 2x9s s LYS 113 Ca 0.45 -0.91 -0.14 0.00 -0.36 0.00 0.00 55.97 55.00 2x9s s LYS 113 Cb -0.27 -1.21 0.00 0.00 -1.51 0.00 0.00 37.83 34.84 2x9s s LYS 113 CO 0.34 -1.11 1.10 -1.50 -0.36 0.00 0.00 175.35 173.81 2x9s s ILE 114 N 1.60 3.35 -0.57 5.43 1.10 -1.01 -2.38 121.20 128.71 2x9s s ILE 114 Ca 0.13 0.60 0.00 0.00 -0.51 0.00 0.00 60.65 60.87 2x9s s ILE 114 Cb -0.19 -3.12 0.00 0.00 0.15 0.00 0.00 42.46 39.29 2x9s s ILE 114 CO -0.18 -0.42 0.00 0.00 -2.11 0.00 0.00 174.94 172.23 2x9s n LEU 115 N -2.52 0.00 0.00 8.50 -0.00 -0.95 -3.42 117.00 118.61 2x9s n LEU 115 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.11 2x9s n LEU 115 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.94 2x9s n LEU 115 CO 0.49 0.00 0.00 0.61 -0.00 0.00 0.00 177.39 178.49 2x9s n GLY 116 N 0.00 0.51 3.71 1.47 0.00 -1.26 -1.98 105.19 107.63 2x9s n GLY 116 Ca 0.00 -0.57 -0.32 0.00 0.00 0.00 0.00 46.02 45.13 2x9s n GLY 116 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2x9s s GLU 117 N 0.00 1.69 0.00 1.61 2.02 -1.26 -4.34 118.70 118.42 2x9s s GLU 117 Ca 0.00 1.57 0.00 0.00 0.02 0.00 0.00 54.97 56.56 2x9s s GLU 117 Cb 0.00 -1.80 0.00 0.00 0.10 0.00 0.00 34.13 32.43 2x9s s GLU 117 CO 0.00 -2.14 0.00 0.41 0.02 0.00 0.00 175.26 173.55 2x9s n GLY 118 N 0.04 2.59 3.84 -1.39 0.00 -1.26 -1.73 105.19 107.28 2x9s n GLY 118 Ca 0.12 -2.02 -0.37 0.00 0.00 0.00 0.00 46.02 43.76 2x9s n GLY 118 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2x9s s GLU 119 N -2.57 3.97 0.90 1.61 0.41 -1.26 -4.67 118.70 117.08 2x9s s GLU 119 Ca 0.00 0.47 -0.12 0.00 -0.41 0.00 0.00 54.97 54.90 2x9s s GLU 119 Cb 0.00 -3.09 0.13 0.00 -1.78 0.00 0.00 34.13 29.39 2x9s s GLU 119 CO 0.00 0.59 1.12 0.00 -0.49 0.00 0.00 175.26 176.48 2x9s s ALA 120 N -1.27 1.78 -0.06 5.21 0.00 -1.26 -4.69 121.76 121.47 2x9s s ALA 120 Ca 0.31 -0.42 -0.13 0.00 0.00 0.00 0.00 51.96 51.72 2x9s s ALA 120 Cb -0.16 -3.06 0.03 0.00 0.00 0.00 0.00 23.12 19.92 2x9s s ALA 120 CO 0.17 -2.23 0.30 0.15 0.00 0.00 0.00 175.76 174.16 2x9s s LYS 121 N -5.21 0.51 -0.95 0.00 1.02 -1.26 -5.03 119.74 108.82 2x9s s LYS 121 Ca 0.63 0.10 -0.26 0.00 0.02 0.00 0.00 55.97 56.46 2x9s s LYS 121 Cb -0.15 0.23 -0.17 0.00 -0.52 0.00 0.00 37.83 37.22 2x9s s LYS 121 CO 0.54 -0.11 2.23 -2.14 -0.92 0.00 0.00 175.35 174.95 2x9s s PRO 122 N -0.61 1.49 -0.28 -1.68 0.02 -1.21 -4.46 135.00 128.27 2x9s s PRO 122 Ca -0.07 -0.06 -0.22 0.00 0.02 0.00 0.00 61.00 60.67 2x9s s PRO 122 Cb -0.04 -4.91 0.10 0.00 0.02 0.00 0.00 34.50 29.67 2x9s s PRO 122 CO 0.02 -4.88 0.85 -0.48 -0.33 0.00 0.00 177.00 172.18 2x9s s LEU 123 N 15.45 -0.67 0.38 -5.54 0.05 -1.26 -4.81 118.68 122.28 2x9s s LEU 123 Ca 0.85 1.19 -0.27 0.00 0.05 0.00 0.00 54.13 55.96 2x9s s LEU 123 Cb -0.08 2.16 -0.09 0.00 -2.05 0.00 0.00 46.19 46.13 2x9s s LEU 123 CO 0.12 -0.20 1.25 -0.54 -0.55 0.00 0.00 176.35 176.44 2x9s s LYS 124 N 0.78 4.14 -0.20 1.48 -0.14 -1.25 -1.12 119.74 123.44 2x9s s LYS 124 Ca -0.03 2.06 -0.02 0.00 -1.36 0.00 0.00 55.97 56.62 2x9s s LYS 124 Cb -0.05 -2.85 0.06 0.00 -1.68 0.00 0.00 37.83 33.31 2x9s s LYS 124 CO -0.08 -0.31 0.03 0.14 -0.76 0.00 0.00 175.35 174.36 2x9s s VAL 125 N -1.26 0.64 -0.33 3.17 -7.23 -1.26 -1.68 120.40 112.44 2x9s s VAL 125 Ca 0.54 -0.63 -0.23 0.00 -1.81 0.00 0.00 61.98 59.85 2x9s s VAL 125 Cb -0.36 -1.12 0.00 0.00 0.56 0.00 0.00 36.38 35.47 2x9s s VAL 125 CO 0.47 -0.19 0.77 -0.69 -0.31 0.00 0.00 175.10 175.14 2x9s s VAL 126 N 1.81 4.79 0.00 1.32 1.01 -0.77 -2.38 120.40 126.17 2x9s s VAL 126 Ca -0.01 1.03 0.00 0.00 0.00 0.00 0.00 61.98 62.99 2x9s s VAL 126 Cb -0.17 -4.15 0.00 0.00 0.00 0.00 0.00 36.38 32.06 2x9s s VAL 126 CO -0.08 -0.31 0.00 0.00 0.00 0.00 0.00 175.10 174.72 2x9s n ALA 127 N 6.25 0.00 0.00 5.51 0.00 0.32 -4.02 120.51 128.56 2x9s n ALA 127 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2x9s n ALA 127 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 2x9s n ALA 127 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2x9s n HIS 128 N 0.00 0.00 -3.63 0.00 8.25 -0.84 -4.34 115.22 114.66 2x9s n HIS 128 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.31 2x9s n HIS 128 Cb 0.00 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.04 2x9s n HIS 128 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2x9s s ALA 129 N -1.90 -1.24 -0.03 -1.41 0.00 -1.13 -4.51 121.76 111.53 2x9s s ALA 129 Ca 0.00 0.68 -0.01 0.00 0.00 0.00 0.00 51.96 52.63 2x9s s ALA 129 Cb 0.00 0.17 0.03 0.00 0.00 0.00 0.00 23.12 23.33 2x9s s ALA 129 CO 0.00 -0.39 0.06 -0.06 0.00 0.00 0.00 175.76 175.37 2x9s s PHE 130 N -1.76 -0.00 0.89 0.00 0.08 -1.26 -2.41 117.98 113.52 2x9s s PHE 130 Ca -0.09 0.23 -0.11 0.00 0.12 0.00 0.00 56.93 57.08 2x9s s PHE 130 Cb -0.02 -0.26 0.13 0.00 -0.57 0.00 0.00 43.02 42.30 2x9s s PHE 130 CO 0.03 -0.13 1.09 -1.54 -0.10 0.00 0.00 175.22 174.58 2x9s s SER 131 N 1.36 3.44 0.02 1.36 1.04 -1.22 -4.68 113.70 115.02 2x9s s SER 131 Ca -0.06 1.62 -0.09 0.00 0.48 0.00 0.00 55.95 57.90 2x9s s SER 131 Cb -0.13 -2.28 -0.04 0.00 0.10 0.00 0.00 66.02 63.67 2x9s s SER 131 CO -0.04 -2.68 1.14 0.11 0.98 0.00 0.00 173.24 172.76 2x9s h LYS 132 N -1.58 -0.23 -0.61 4.02 6.56 -1.99 0.52 116.57 123.26 2x9s h LYS 132 Ca -0.49 0.02 0.18 0.00 -1.06 0.00 0.00 60.65 59.30 2x9s h LYS 132 Cb 1.28 0.05 -0.02 0.00 -0.57 0.00 0.00 32.23 32.96 2x9s h LYS 132 CO 0.52 -0.15 0.68 1.03 -2.06 0.00 0.00 179.45 179.47 2x9s h SER 133 N -0.24 0.00 0.20 0.86 0.87 -1.99 -1.68 113.55 111.58 2x9s h SER 133 Ca -0.01 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.54 2x9s h SER 133 Cb 0.21 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.18 2x9s h SER 133 CO -0.04 0.00 -0.10 0.00 -0.53 0.00 0.00 176.83 176.17 2x9s h ALA 134 N 1.22 -0.29 -1.29 6.23 0.00 -1.61 -2.97 119.26 120.55 2x9s h ALA 134 Ca 0.29 -0.06 0.41 0.00 0.00 0.00 0.00 54.91 55.55 2x9s h ALA 134 Cb 1.64 0.10 -0.12 0.00 0.00 0.00 0.00 17.79 19.42 2x9s h ALA 134 CO -0.00 -0.27 0.83 1.25 0.00 0.00 0.00 179.25 181.06 2x9s h LEU 135 N -0.96 0.26 0.00 0.00 7.12 -0.06 -2.02 115.31 119.65 2x9s h LEU 135 Ca -0.03 0.12 0.00 0.00 0.13 0.00 0.00 57.88 58.10 2x9s h LEU 135 Cb 0.20 0.10 0.00 0.00 -0.53 0.00 0.00 40.66 40.44 2x9s h LEU 135 CO 0.04 -0.13 0.00 -0.62 -0.13 0.00 0.00 178.44 177.61 2x9s n GLU 136 N -4.65 0.00 -0.24 1.25 -0.58 -0.76 -1.61 120.64 114.05 2x9s n GLU 136 Ca 0.35 0.00 0.17 0.00 -0.42 0.00 0.00 57.16 57.26 2x9s n GLU 136 Cb 1.35 -0.87 0.33 0.00 -0.57 0.00 0.00 31.44 31.67 2x9s n GLU 136 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2x9s n LYS 137 N -0.38 -0.05 0.17 3.49 5.02 -0.89 0.25 118.16 125.76 2x9s n LYS 137 Ca 0.00 1.05 0.03 0.00 -2.02 0.00 0.00 58.31 57.36 2x9s n LYS 137 Cb 0.00 -1.77 0.30 0.00 -0.02 0.00 0.00 35.03 33.54 2x9s n LYS 137 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2x9s h LEU 138 N 0.00 0.00 -1.30 -0.35 5.85 -1.43 -2.90 115.31 115.19 2x9s h LEU 138 Ca 0.53 0.00 0.09 0.00 0.84 0.00 0.00 57.88 59.34 2x9s h LEU 138 Cb 1.29 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 42.26 2x9s h LEU 138 CO -0.62 0.45 0.53 0.50 -0.34 0.00 0.00 178.44 178.97 2x9s h LYS 139 N 0.00 0.77 -4.55 1.25 3.64 0.43 -3.23 116.57 114.89 2x9s h LYS 139 Ca -0.00 -0.05 -0.63 0.00 -1.27 0.00 0.00 60.65 58.70 2x9s h LYS 139 Cb 0.89 -0.17 0.01 0.00 -0.41 0.00 0.00 32.23 32.54 2x9s h LYS 139 CO 0.06 0.51 2.36 0.00 -2.27 0.00 0.00 179.45 180.12 2x9s n ALA 140 N -2.43 3.70 -1.35 5.00 0.00 -1.09 -4.52 120.51 119.82 2x9s n ALA 140 Ca 0.13 -3.45 -0.00 0.00 0.00 0.00 0.00 53.44 50.12 2x9s n ALA 140 Cb 0.29 -3.60 -0.00 0.00 0.00 0.00 0.00 19.45 16.15 2x9s n ALA 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2x9s n ALA 141 N 7.95 -2.92 0.00 0.00 0.00 -1.22 -4.86 120.51 119.46 2x9s n ALA 141 Ca 0.50 0.17 0.00 0.00 0.00 0.00 0.00 53.44 54.11 2x9s n ALA 141 Cb 0.41 -0.40 0.00 0.00 0.00 0.00 0.00 19.45 19.46 2x9s n ALA 141 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x9s n GLY 142 N 0.30 3.22 0.00 0.00 0.00 -1.23 -3.34 105.19 104.14 2x9s n GLY 142 Ca -0.02 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.33 2x9s n GLY 142 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x9s n GLY 143 N -1.93 -3.03 0.00 -0.02 0.00 -0.27 -4.80 105.19 95.15 2x9s n GLY 143 Ca 0.00 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 44.75 2x9s n GLY 143 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2x9s n GLU 144 N -0.41 0.00 -1.41 1.61 0.00 -1.26 -4.72 120.64 114.45 2x9s n GLU 144 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 57.16 56.66 2x9s n GLU 144 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 31.44 31.35 2x9s n GLU 144 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.13 174.83 2x9s n PRO 145 N 0.00 0.63 0.00 5.31 -0.02 -1.00 -4.85 135.00 135.06 2x9s n PRO 145 Ca 0.00 0.14 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 2x9s n PRO 145 Cb 0.00 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.32 2x9s n PRO 145 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 2x9s n VAL 146 N 7.16 0.00 0.00 -1.45 3.14 -1.26 -0.52 118.33 125.39 2x9s n VAL 146 Ca 0.48 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.86 2x9s n VAL 146 Cb 0.16 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.94 2x9s n VAL 146 CO 0.00 0.00 0.00 -0.11 -6.46 0.00 0.00 176.83 170.26 2x9s n LEU 147 N 0.00 0.00 0.00 6.55 7.94 -1.26 -4.73 117.00 125.50 2x9s n LEU 147 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 2x9s n LEU 147 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 2x9s n LEU 147 CO 0.00 0.00 0.00 0.18 -1.11 0.00 0.00 177.39 176.46 2x9s n LEU 148 N 0.00 0.00 -2.52 -1.96 4.77 -1.26 -4.74 117.00 111.28 2x9s n LEU 148 Ca 0.00 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 55.97 2x9s n LEU 148 Cb 0.00 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.10 2x9s n LEU 148 CO 0.00 0.00 0.20 -0.62 -1.33 0.00 0.00 177.39 175.64 2x9s n GLU 149 N 0.02 -0.93 0.00 3.23 -0.58 -1.26 -5.15 120.64 115.97 2x9s n GLU 149 Ca 0.00 1.07 0.00 0.00 -0.42 0.00 0.00 57.16 57.81 2x9s n GLU 149 Cb 0.00 -4.26 0.00 0.00 -0.57 0.00 0.00 31.44 26.61 2x9s n GLU 149 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65