#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oqu s VAL 2 N 0.00 4.91 -1.33 2.52 1.01 0.05 -4.14 120.40 123.42 2oqu s VAL 2 Ca 0.00 1.11 0.00 0.00 0.00 0.00 0.00 61.98 63.09 2oqu s VAL 2 Cb 0.00 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 32.52 2oqu s VAL 2 CO 0.00 0.49 0.00 0.61 0.00 0.00 0.00 175.10 176.20 2oqu n GLY 3 N 2.16 0.29 3.97 4.51 0.00 -1.25 -1.70 105.19 113.17 2oqu n GLY 3 Ca -0.10 -0.30 -0.27 0.00 0.00 0.00 0.00 46.02 45.36 2oqu n GLY 3 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2oqu s GLY 4 N -2.50 1.77 0.17 -0.02 0.00 -1.26 -4.79 107.32 100.70 2oqu s GLY 4 Ca 0.00 -1.52 0.08 0.00 0.00 0.00 0.00 44.72 43.28 2oqu s GLY 4 CO 0.00 -0.84 -0.16 -0.51 0.00 0.00 0.00 173.10 171.59 2oqu s THR 5 N -3.51 1.73 0.08 0.90 -4.23 0.04 -4.92 115.64 105.74 2oqu s THR 5 Ca 0.70 -2.00 -0.31 0.00 -1.18 0.00 0.00 61.69 58.91 2oqu s THR 5 Cb -0.04 -1.87 -0.08 0.00 1.34 0.00 0.00 72.50 71.84 2oqu s THR 5 CO 0.49 -0.43 1.59 -0.70 -0.54 0.00 0.00 174.62 175.03 2oqu s GLU 6 N -3.08 4.22 0.42 3.99 2.12 -1.26 -0.76 118.70 124.35 2oqu s GLU 6 Ca 0.17 2.27 -0.25 0.00 0.36 0.00 0.00 54.97 57.52 2oqu s GLU 6 Cb -0.04 -3.51 -0.08 0.00 0.26 0.00 0.00 34.13 30.76 2oqu s GLU 6 CO 0.06 -0.68 1.28 0.00 -0.54 0.00 0.00 175.26 175.39 2oqu s ALA 7 N 2.31 3.19 0.58 6.30 0.00 -0.05 -4.84 121.76 129.24 2oqu s ALA 7 Ca 0.71 1.19 -0.19 0.00 0.00 0.00 0.00 51.96 53.67 2oqu s ALA 7 Cb -0.39 -3.47 -0.04 0.00 0.00 0.00 0.00 23.12 19.21 2oqu s ALA 7 CO 0.31 -0.82 1.17 -1.14 0.00 0.00 0.00 175.76 175.27 2oqu s GLN 8 N -2.34 3.11 0.37 0.00 2.00 -1.26 -4.89 119.66 116.65 2oqu s GLN 8 Ca 0.59 1.71 0.15 0.00 -2.00 0.00 0.00 55.36 55.80 2oqu s GLN 8 Cb -0.37 -1.96 1.00 0.00 0.80 0.00 0.00 33.01 32.49 2oqu s GLN 8 CO 0.46 -1.06 1.76 -0.09 -0.50 0.00 0.00 175.29 175.86 2oqu h ARG 9 N 0.95 0.47 -0.35 1.67 2.43 -1.98 -2.44 114.38 115.13 2oqu h ARG 9 Ca -0.50 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.64 2oqu h ARG 9 Cb 1.28 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 2oqu h ARG 9 CO 0.56 0.31 0.00 0.27 -1.51 0.00 0.00 179.97 179.60 2oqu n ASN 10 N -4.71 4.40 0.08 -3.80 0.23 -1.26 -4.68 115.26 105.52 2oqu n ASN 10 Ca 0.25 -3.00 -0.20 0.00 -0.53 0.00 0.00 54.58 51.10 2oqu n ASN 10 Cb 0.80 -0.58 -0.11 0.00 -2.08 0.00 0.00 39.78 37.80 2oqu n ASN 10 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 2oqu h SER 11 N 2.41 0.81 -2.12 0.53 0.02 -1.77 -3.40 113.55 110.03 2oqu h SER 11 Ca 0.00 -0.72 -0.56 0.00 -0.84 0.00 0.00 61.79 59.67 2oqu h SER 11 Cb 1.60 -0.25 -0.41 0.00 0.14 0.00 0.00 62.40 63.48 2oqu h SER 11 CO 0.30 1.53 -0.88 0.79 -1.14 0.00 0.00 176.83 177.43 2oqu n TRP 12 N -3.78 1.87 0.46 3.45 7.02 -1.26 -4.94 117.44 120.26 2oqu n TRP 12 Ca -0.12 -3.88 0.06 0.00 -1.02 0.00 0.00 57.50 52.54 2oqu n TRP 12 Cb 0.95 -0.46 0.28 0.00 -2.42 0.00 0.00 31.31 29.67 2oqu n TRP 12 CO 0.00 0.00 0.00 -0.35 -2.02 0.00 0.00 177.69 175.32 2oqu n PRO 13 N 0.61 0.00 0.00 -0.99 -0.04 -1.26 -1.86 135.00 131.46 2oqu n PRO 13 Ca 0.27 0.27 0.12 0.00 -0.04 0.00 0.00 63.50 64.12 2oqu n PRO 13 Cb 0.50 -1.50 0.32 0.00 -0.04 0.00 0.00 33.50 32.78 2oqu n PRO 13 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2oqu n SER 14 N -1.49 0.49 -4.73 3.54 3.41 -1.22 -1.91 113.62 111.70 2oqu n SER 14 Ca 0.03 -0.24 -0.42 0.00 -0.26 0.00 0.00 58.87 57.99 2oqu n SER 14 Cb 0.15 0.14 -0.03 0.00 -0.26 0.00 0.00 64.21 64.21 2oqu n SER 14 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 2oqu s GLN 15 N -2.93 4.27 0.20 4.33 2.00 -0.77 -0.92 119.66 125.84 2oqu s GLN 15 Ca 0.13 2.26 0.09 0.00 -2.00 0.00 0.00 55.36 55.84 2oqu s GLN 15 Cb 0.18 -3.16 -0.05 0.00 0.80 0.00 0.00 33.01 30.79 2oqu s GLN 15 CO 0.65 -0.47 -0.17 0.96 -0.50 0.00 0.00 175.29 175.76 2oqu s ILE 16 N 0.56 1.92 -0.23 -2.34 -5.25 -0.68 -4.51 121.20 110.67 2oqu s ILE 16 Ca 0.63 -2.13 -0.07 0.00 -0.99 0.00 0.00 60.65 58.10 2oqu s ILE 16 Cb -0.41 -2.01 -0.03 0.00 2.95 0.00 0.00 42.46 42.96 2oqu s ILE 16 CO 0.37 -0.44 0.06 -0.55 -1.79 0.00 0.00 174.94 172.59 2oqu s SER 17 N -3.08 5.23 -0.23 4.36 0.15 -0.61 -2.39 113.70 117.14 2oqu s SER 17 Ca 0.21 -0.13 -0.14 0.00 0.70 0.00 0.00 55.95 56.58 2oqu s SER 17 Cb -0.04 -1.92 -0.04 0.00 -1.71 0.00 0.00 66.02 62.31 2oqu s SER 17 CO 0.08 0.03 0.34 -0.22 1.20 0.00 0.00 173.24 174.67 2oqu s LEU 18 N 1.23 4.11 0.09 3.45 2.96 0.56 -0.74 118.68 130.34 2oqu s LEU 18 Ca 0.05 0.36 0.07 0.00 -0.22 0.00 0.00 54.13 54.38 2oqu s LEU 18 Cb -0.14 -2.40 -0.03 0.00 0.50 0.00 0.00 46.19 44.11 2oqu s LEU 18 CO 0.03 -0.08 -0.18 -1.10 -1.32 0.00 0.00 176.35 173.70 2oqu s GLN 19 N 1.48 1.00 0.23 1.98 -0.21 0.03 -0.61 119.66 123.56 2oqu s GLN 19 Ca 0.15 -1.08 0.10 0.00 0.02 0.00 0.00 55.36 54.55 2oqu s GLN 19 Cb -0.15 -1.15 -0.05 0.00 1.00 0.00 0.00 33.01 32.66 2oqu s GLN 19 CO 0.08 0.26 -0.17 1.52 -2.12 0.00 0.00 175.29 174.86 2oqu s TYR 20 N -1.22 1.95 -0.08 0.91 1.13 -0.30 -0.59 117.35 119.15 2oqu s TYR 20 Ca 0.03 -0.47 -0.30 0.00 -1.41 0.00 0.00 57.07 54.92 2oqu s TYR 20 Cb -0.10 -0.88 -0.02 0.00 -1.10 0.00 0.00 41.96 39.86 2oqu s TYR 20 CO 0.03 0.51 1.11 0.50 -2.51 0.00 0.00 175.55 175.19 2oqu s ARG 21 N -3.56 4.38 -0.21 -3.49 6.06 -0.90 -0.96 118.95 120.27 2oqu s ARG 21 Ca 0.25 1.54 -0.02 0.00 -2.50 0.00 0.00 55.73 55.00 2oqu s ARG 21 Cb -0.03 -3.55 0.06 0.00 0.06 0.00 0.00 34.95 31.49 2oqu s ARG 21 CO 0.10 -0.39 0.01 -1.12 -2.50 0.00 0.00 175.30 171.40 2oqu s SER 22 N 1.30 3.27 1.34 -2.12 0.01 0.30 -4.85 113.70 112.95 2oqu s SER 22 Ca 0.52 -0.97 0.00 0.00 1.31 0.00 0.00 55.95 56.81 2oqu s SER 22 Cb -0.21 -0.80 0.00 0.00 0.21 0.00 0.00 66.02 65.22 2oqu s SER 22 CO 0.20 -0.29 0.00 0.61 0.41 0.00 0.00 173.24 174.17 2oqu n GLY 23 N 4.92 1.91 1.46 3.44 0.00 -1.26 -1.85 105.19 113.81 2oqu n GLY 23 Ca -0.10 -0.44 0.02 0.00 0.00 0.00 0.00 46.02 45.50 2oqu n GLY 23 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2oqu n SER 24 N 5.42 4.31 -4.71 1.61 3.41 -1.26 -4.98 113.62 117.43 2oqu n SER 24 Ca 0.00 -3.18 -0.27 0.00 -0.26 0.00 0.00 58.87 55.16 2oqu n SER 24 Cb 0.00 -0.65 -0.08 0.00 -0.26 0.00 0.00 64.21 63.22 2oqu n SER 24 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2oqu s SER 25 N -1.54 4.23 -0.00 4.04 0.01 -0.77 -5.15 113.70 114.51 2oqu s SER 25 Ca 0.49 -1.26 0.07 0.00 1.31 0.00 0.00 55.95 56.56 2oqu s SER 25 Cb 0.40 -0.27 -0.03 0.00 0.21 0.00 0.00 66.02 66.33 2oqu s SER 25 CO 0.10 -0.59 -0.20 0.26 0.41 0.00 0.00 173.24 173.22 2oqu s TRP 26 N -2.68 2.50 -0.03 2.43 0.52 -1.26 -0.53 118.94 119.89 2oqu s TRP 26 Ca 0.34 -0.30 0.04 0.00 0.02 0.00 0.00 56.10 56.20 2oqu s TRP 26 Cb 0.05 -1.51 -0.00 0.00 -1.15 0.00 0.00 33.47 30.86 2oqu s TRP 26 CO 0.19 0.14 -0.15 0.00 0.02 0.00 0.00 176.95 177.14 2oqu s ALA 27 N -0.77 1.29 0.23 0.98 0.00 -0.14 -4.90 121.76 118.46 2oqu s ALA 27 Ca 0.12 -0.60 -0.31 0.00 0.00 0.00 0.00 51.96 51.17 2oqu s ALA 27 Cb -0.10 -0.41 -0.11 0.00 0.00 0.00 0.00 23.12 22.50 2oqu s ALA 27 CO 0.02 0.26 1.63 -1.58 0.00 0.00 0.00 175.76 176.08 2oqu s HIS 28 N -0.05 2.90 -0.04 0.00 2.46 -1.26 -1.15 115.29 118.14 2oqu s HIS 28 Ca -0.01 0.59 0.01 0.00 0.47 0.00 0.00 55.06 56.12 2oqu s HIS 28 Cb -0.09 -4.05 -0.03 0.00 -0.13 0.00 0.00 32.58 28.28 2oqu s HIS 28 CO 0.01 -3.78 -0.03 -2.37 -2.47 0.00 0.00 174.74 166.09 2oqu n THR 29 N 3.28 0.25 -3.95 0.89 5.66 0.22 -4.90 114.28 115.73 2oqu n THR 29 Ca 0.12 -0.10 -0.09 0.00 -3.05 0.00 0.00 64.05 60.93 2oqu n THR 29 Cb 0.37 -0.69 -0.07 0.00 -1.55 0.00 0.00 70.33 68.39 2oqu n THR 29 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2oqu s GLY 31 N -2.94 1.77 0.18 0.00 0.00 0.65 -0.33 107.32 106.66 2oqu s GLY 31 Ca 0.14 -1.52 -0.24 0.00 0.00 0.00 0.00 44.72 43.10 2oqu s GLY 31 CO -0.03 -1.04 0.92 -0.32 0.00 0.00 0.00 173.10 172.63 2oqu s GLY 32 N -4.64 -0.16 -0.10 0.20 0.00 -1.00 -3.28 107.32 98.33 2oqu s GLY 32 Ca 0.63 -0.01 0.02 0.00 0.00 0.00 0.00 44.72 45.36 2oqu s GLY 32 CO 0.43 0.14 -0.15 -1.59 0.00 0.00 0.00 173.10 171.93 2oqu s THR 33 N -3.27 1.44 -0.07 0.90 2.01 0.30 -1.69 115.64 115.25 2oqu s THR 33 Ca 0.13 -0.61 -0.30 0.00 0.31 0.00 0.00 61.69 61.22 2oqu s THR 33 Cb -0.02 -1.32 -0.04 0.00 0.01 0.00 0.00 72.50 71.13 2oqu s THR 33 CO 0.04 0.43 1.46 -0.22 -0.69 0.00 0.00 174.62 175.64 2oqu s LEU 34 N 0.99 4.28 -0.00 4.42 2.96 -0.09 -0.40 118.68 130.83 2oqu s LEU 34 Ca -0.07 2.03 0.02 0.00 -0.22 0.00 0.00 54.13 55.89 2oqu s LEU 34 Cb -0.15 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 42.97 2oqu s LEU 34 CO -0.01 -0.82 0.04 2.30 -1.32 0.00 0.00 176.35 176.54 2oqu n ILE 35 N 5.23 0.02 -4.26 6.68 -5.35 -0.34 0.21 119.36 121.54 2oqu n ILE 35 Ca 0.15 -0.05 -0.14 0.00 -0.27 0.00 0.00 62.75 62.43 2oqu n ILE 35 Cb 0.44 0.30 -0.10 0.00 -1.74 0.00 0.00 39.64 38.53 2oqu n ILE 35 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 2oqu s ARG 36 N -2.14 1.19 0.65 6.28 1.81 -0.94 -4.77 118.95 121.03 2oqu s ARG 36 Ca -0.01 -1.59 0.38 0.00 -1.72 0.00 0.00 55.73 52.79 2oqu s ARG 36 Cb 0.01 -0.26 2.08 0.00 -0.45 0.00 0.00 34.95 36.33 2oqu s ARG 36 CO 0.09 -0.17 2.21 1.96 -0.68 0.00 0.00 175.30 178.71 2oqu h GLN 37 N 2.62 0.00 0.00 3.54 4.20 -1.95 -2.40 115.11 121.11 2oqu h GLN 37 Ca -0.37 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.31 2oqu h GLN 37 Cb 1.22 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.94 2oqu h GLN 37 CO 0.62 0.00 -0.39 0.27 -0.67 0.00 0.00 178.83 178.66 2oqu n ASN 38 N -3.18 1.39 -3.94 1.46 6.94 -1.26 -1.10 115.26 115.58 2oqu n ASN 38 Ca -0.02 -2.81 -0.15 0.00 -0.02 0.00 0.00 54.58 51.58 2oqu n ASN 38 Cb 0.19 -0.37 -0.14 0.00 -2.36 0.00 0.00 39.78 37.10 2oqu n ASN 38 CO 0.00 0.00 0.00 0.26 -1.03 0.00 0.00 177.26 176.49 2oqu s TRP 39 N -1.77 0.36 -0.03 -2.53 0.52 -0.91 -0.73 118.94 113.86 2oqu s TRP 39 Ca 0.25 -0.07 0.06 0.00 0.02 0.00 0.00 56.10 56.36 2oqu s TRP 39 Cb 0.24 -0.23 -0.01 0.00 -1.15 0.00 0.00 33.47 32.31 2oqu s TRP 39 CO -0.03 -0.01 -0.21 0.08 0.02 0.00 0.00 176.95 176.81 2oqu s VAL 40 N -0.10 1.66 -0.22 4.03 1.01 -0.38 -1.20 120.40 125.21 2oqu s VAL 40 Ca 0.02 -0.88 -0.10 0.00 0.00 0.00 0.00 61.98 61.02 2oqu s VAL 40 Cb -0.02 -1.39 -0.05 0.00 0.00 0.00 0.00 36.38 34.93 2oqu s VAL 40 CO -0.00 0.47 0.13 -0.32 0.00 0.00 0.00 175.10 175.38 2oqu s MET 41 N -0.33 4.07 0.03 2.72 1.75 0.47 -0.46 119.30 127.54 2oqu s MET 41 Ca 0.04 -0.28 0.01 0.00 -1.25 0.00 0.00 55.69 54.21 2oqu s MET 41 Cb -0.10 -3.43 -0.00 0.00 2.84 0.00 0.00 34.83 34.14 2oqu s MET 41 CO 0.00 0.16 0.03 -2.37 -0.65 0.00 0.00 175.02 172.20 2oqu n THR 42 N 3.93 0.00 -3.43 10.11 5.66 0.01 -0.54 114.28 130.02 2oqu n THR 42 Ca -0.16 -0.22 -0.38 0.00 -3.05 0.00 0.00 64.05 60.24 2oqu n THR 42 Cb 0.52 0.12 -0.06 0.00 -1.55 0.00 0.00 70.33 69.36 2oqu n THR 42 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2oqu s ALA 43 N -2.07 3.66 0.25 1.79 0.00 -1.26 -0.90 121.76 123.24 2oqu s ALA 43 Ca 0.04 -0.14 -0.03 0.00 0.00 0.00 0.00 51.96 51.82 2oqu s ALA 43 Cb 0.00 -2.46 0.44 0.00 0.00 0.00 0.00 23.12 21.10 2oqu s ALA 43 CO 0.03 0.46 1.80 0.00 0.00 0.00 0.00 175.76 178.04 2oqu h ALA 44 N 4.60 1.22 0.00 0.00 0.00 -1.68 -2.07 119.26 121.33 2oqu h ALA 44 Ca -0.51 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 2oqu h ALA 44 Cb 1.22 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 2oqu h ALA 44 CO 0.62 0.06 -0.01 1.12 0.00 0.00 0.00 179.25 181.04 2oqu h HIS 45 N 0.76 0.00 0.00 0.00 2.07 -1.92 -0.72 115.15 115.34 2oqu h HIS 45 Ca 0.42 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.93 2oqu h HIS 45 Cb 0.44 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.42 2oqu h HIS 45 CO -0.06 0.01 -0.07 0.00 -3.07 0.00 0.00 177.93 174.73 2oqu n VAL 47 N -3.16 1.84 -0.05 0.00 0.24 -0.28 -4.63 118.33 112.29 2oqu n VAL 47 Ca 0.01 -2.58 -0.14 0.00 -2.04 0.00 0.00 64.34 59.60 2oqu n VAL 47 Cb 0.41 -0.13 -0.08 0.00 -1.47 0.00 0.00 33.84 32.57 2oqu n VAL 47 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 2oqu h ASP 48 N 0.57 0.49 -3.51 -1.34 3.32 -1.60 -3.45 116.42 110.90 2oqu h ASP 48 Ca -0.01 -0.56 -0.53 0.00 0.02 0.00 0.00 57.03 55.95 2oqu h ASP 48 Cb 1.08 -0.14 0.06 0.00 0.22 0.00 0.00 39.33 40.54 2oqu h ASP 48 CO 0.01 0.96 0.72 -0.60 -1.72 0.00 0.00 179.24 178.61 2oqu s ARG 49 N -3.99 4.30 -0.71 3.56 3.00 -1.26 -4.85 118.95 118.99 2oqu s ARG 49 Ca -0.14 2.26 -0.05 0.00 -1.00 0.00 0.00 55.73 56.80 2oqu s ARG 49 Cb 0.05 -3.11 -0.05 0.00 0.00 0.00 0.00 34.95 31.84 2oqu s ARG 49 CO 0.79 -0.35 1.96 0.39 0.00 0.00 0.00 175.30 178.09 2oqu n GLU 50 N 1.98 1.72 -4.12 5.12 -0.58 -1.26 -4.89 120.64 118.61 2oqu n GLU 50 Ca 0.05 -1.24 -0.22 0.00 -0.42 0.00 0.00 57.16 55.33 2oqu n GLU 50 Cb 0.41 -2.32 -0.04 0.00 -0.57 0.00 0.00 31.44 28.91 2oqu n GLU 50 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2oqu s LEU 51 N 0.07 3.81 -0.10 -4.62 1.43 -1.26 -5.08 118.68 112.93 2oqu s LEU 51 Ca 0.34 -0.25 -0.29 0.00 -1.03 0.00 0.00 54.13 52.90 2oqu s LEU 51 Cb 0.09 -2.34 -0.01 0.00 0.03 0.00 0.00 46.19 43.96 2oqu s LEU 51 CO -0.03 -0.03 0.99 -0.89 0.23 0.00 0.00 176.35 176.62 2oqu s THR 52 N -2.12 4.80 0.03 5.49 2.01 -1.26 -5.03 115.64 119.57 2oqu s THR 52 Ca 0.33 2.02 0.07 0.00 0.31 0.00 0.00 61.69 64.42 2oqu s THR 52 Cb -0.08 -4.30 -0.03 0.00 0.01 0.00 0.00 72.50 68.10 2oqu s THR 52 CO 0.25 0.03 -0.20 -0.36 -0.69 0.00 0.00 174.62 173.64 2oqu s PHE 53 N 1.88 2.50 0.16 4.92 0.08 -1.26 -2.13 117.98 124.13 2oqu s PHE 53 Ca 0.48 -0.30 0.06 0.00 0.12 0.00 0.00 56.93 57.29 2oqu s PHE 53 Cb -0.18 -1.46 -0.04 0.00 -0.57 0.00 0.00 43.02 40.76 2oqu s PHE 53 CO 0.19 0.21 -0.12 -0.98 -0.10 0.00 0.00 175.22 174.41 2oqu s ARG 54 N -1.31 1.15 -0.09 0.44 1.70 0.24 -2.45 118.95 118.63 2oqu s ARG 54 Ca 0.13 -1.48 0.03 0.00 -0.47 0.00 0.00 55.73 53.94 2oqu s ARG 54 Cb -0.10 -0.81 -0.02 0.00 -0.57 0.00 0.00 34.95 33.45 2oqu s ARG 54 CO 0.04 0.12 -0.17 0.08 -1.08 0.00 0.00 175.30 174.29 2oqu s VAL 55 N -3.12 2.72 -0.23 4.99 1.01 0.46 -0.79 120.40 125.45 2oqu s VAL 55 Ca 0.18 -0.81 -0.04 0.00 0.00 0.00 0.00 61.98 61.31 2oqu s VAL 55 Cb 0.01 -2.08 -0.00 0.00 0.00 0.00 0.00 36.38 34.31 2oqu s VAL 55 CO 0.03 0.56 -0.04 -0.69 0.00 0.00 0.00 175.10 174.95 2oqu s VAL 56 N -0.08 3.31 0.17 2.92 1.01 0.08 -0.87 120.40 126.94 2oqu s VAL 56 Ca -0.04 -0.60 0.03 0.00 0.00 0.00 0.00 61.98 61.38 2oqu s VAL 56 Cb -0.14 -2.54 -0.03 0.00 0.00 0.00 0.00 36.38 33.66 2oqu s VAL 56 CO 0.04 0.37 0.27 0.68 0.00 0.00 0.00 175.10 176.46 2oqu s VAL 57 N 1.45 5.13 -1.55 2.92 -7.23 -0.66 -1.58 120.40 118.89 2oqu s VAL 57 Ca 0.05 -0.83 -0.02 0.00 -1.81 0.00 0.00 61.98 59.37 2oqu s VAL 57 Cb -0.15 -3.67 0.00 0.00 0.56 0.00 0.00 36.38 33.13 2oqu s VAL 57 CO -0.03 -0.14 0.25 0.61 -0.31 0.00 0.00 175.10 175.47 2oqu n GLY 58 N -0.66 -0.42 3.80 2.32 0.00 -1.24 -1.10 105.19 107.87 2oqu n GLY 58 Ca -0.08 -0.02 -0.38 0.00 0.00 0.00 0.00 46.02 45.55 2oqu n GLY 58 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2oqu s GLU 59 N -5.24 4.06 0.04 1.61 2.56 -1.26 -3.03 118.70 117.42 2oqu s GLU 59 Ca 0.12 0.38 0.00 0.00 0.00 0.00 0.00 54.97 55.48 2oqu s GLU 59 Cb -0.05 -3.29 0.00 0.00 2.00 0.00 0.00 34.13 32.78 2oqu s GLU 59 CO 0.15 0.51 0.00 1.58 -0.56 0.00 0.00 175.26 176.95 2oqu n HIS 60 N 2.46 -0.17 -3.81 5.30 -0.00 -1.26 -4.92 115.22 112.81 2oqu n HIS 60 Ca -0.12 0.03 -0.36 0.00 -0.00 0.00 0.00 57.72 57.27 2oqu n HIS 60 Cb 0.52 0.14 -0.13 0.00 -0.00 0.00 0.00 29.99 30.52 2oqu n HIS 60 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 2oqu s ASN 61 N -5.17 4.85 0.55 0.26 3.84 -1.26 -1.33 114.94 116.67 2oqu s ASN 61 Ca 0.00 -0.56 0.21 0.00 0.21 0.00 0.00 52.86 52.72 2oqu s ASN 61 Cb 0.00 -1.83 1.47 0.00 -0.55 0.00 0.00 41.25 40.34 2oqu s ASN 61 CO 0.00 -0.12 2.18 -0.07 -2.79 0.00 0.00 177.10 176.31 2oqu h LEU 62 N 8.18 0.00 -3.03 3.21 3.38 -1.46 -3.12 115.31 122.47 2oqu h LEU 62 Ca -0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.62 2oqu h LEU 62 Cb 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 2oqu h LEU 62 CO 0.60 0.00 0.00 -0.46 0.09 0.00 0.00 178.44 178.67 2oqu n ASN 63 N -4.28 2.81 -3.99 -0.43 6.94 -1.26 -5.02 115.26 110.02 2oqu n ASN 63 Ca -0.03 -2.48 -0.10 0.00 -0.02 0.00 0.00 54.58 51.95 2oqu n ASN 63 Cb 0.10 -0.29 -0.11 0.00 -2.36 0.00 0.00 39.78 37.12 2oqu n ASN 63 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 2oqu s GLN 64 N -1.84 0.35 -0.32 -3.83 -0.21 -1.18 -5.11 119.66 107.51 2oqu s GLN 64 Ca 0.24 -0.59 -0.29 0.00 0.02 0.00 0.00 55.36 54.74 2oqu s GLN 64 Cb 0.18 -0.01 -0.01 0.00 1.00 0.00 0.00 33.01 34.17 2oqu s GLN 64 CO 0.07 -0.02 1.57 1.21 -2.12 0.00 0.00 175.29 176.00 2oqu s ASN 65 N -1.35 6.25 0.32 5.90 2.47 -1.26 -4.65 114.94 122.62 2oqu s ASN 65 Ca -0.13 1.22 0.23 0.00 0.42 0.00 0.00 52.86 54.61 2oqu s ASN 65 Cb -0.09 -2.53 0.34 0.00 -1.45 0.00 0.00 41.25 37.51 2oqu s ASN 65 CO -0.01 -1.43 1.48 0.44 -3.72 0.00 0.00 177.10 173.86 2oqu h ASP 66 N 11.19 0.00 0.00 -4.21 5.19 -1.93 -3.48 116.42 123.19 2oqu h ASP 66 Ca -0.31 -0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.08 2oqu h ASP 66 Cb 1.14 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.65 2oqu h ASP 66 CO 1.04 0.01 0.00 0.61 -3.12 0.00 0.00 179.24 177.78 2oqu n GLY 67 N 1.18 0.63 0.00 2.75 0.00 -1.26 -4.87 105.19 103.62 2oqu n GLY 67 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2oqu n GLY 67 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2oqu n THR 68 N -2.54 0.00 -2.42 2.61 -2.24 -1.26 -5.08 114.28 103.34 2oqu n THR 68 Ca 0.00 -0.32 -0.38 0.00 -2.27 0.00 0.00 64.05 61.08 2oqu n THR 68 Cb 0.03 1.13 -0.03 0.00 -2.10 0.00 0.00 70.33 69.36 2oqu n THR 68 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2oqu s GLU 69 N -0.41 4.24 -0.07 -0.78 8.01 -1.17 -4.46 118.70 124.06 2oqu s GLU 69 Ca 0.00 1.72 0.04 0.00 0.01 0.00 0.00 54.97 56.74 2oqu s GLU 69 Cb 0.00 -2.75 -0.00 0.00 -4.31 0.00 0.00 34.13 27.06 2oqu s GLU 69 CO 0.00 -0.13 -0.21 -0.65 0.01 0.00 0.00 175.26 174.29 2oqu s GLN 70 N -2.16 2.35 -0.19 1.61 -0.21 -0.26 -5.00 119.66 115.81 2oqu s GLN 70 Ca 0.54 -0.74 -0.03 0.00 0.02 0.00 0.00 55.36 55.15 2oqu s GLN 70 Cb -0.28 -1.92 -0.02 0.00 1.00 0.00 0.00 33.01 31.80 2oqu s GLN 70 CO 0.35 0.23 -0.05 0.71 -2.12 0.00 0.00 175.29 174.41 2oqu s TYR 71 N 0.17 2.95 -0.03 0.91 1.51 -1.26 -1.65 117.35 119.96 2oqu s TYR 71 Ca -0.10 -0.69 0.01 0.00 -1.01 0.00 0.00 57.07 55.27 2oqu s TYR 71 Cb -0.15 -2.03 0.02 0.00 -0.11 0.00 0.00 41.96 39.70 2oqu s TYR 71 CO 0.05 -0.35 -0.01 0.54 -1.11 0.00 0.00 175.55 174.68 2oqu s VAL 72 N 1.00 0.21 0.53 0.71 0.11 -0.05 -5.00 120.40 117.91 2oqu s VAL 72 Ca 0.00 0.04 -0.21 0.00 -2.93 0.00 0.00 61.98 58.89 2oqu s VAL 72 Cb -0.15 -0.28 -0.06 0.00 -1.53 0.00 0.00 36.38 34.36 2oqu s VAL 72 CO 0.00 0.14 1.17 -0.83 -3.33 0.00 0.00 175.10 172.25 2oqu s GLY 73 N 0.85 2.72 -0.24 6.54 0.00 -1.26 -0.40 107.32 115.52 2oqu s GLY 73 Ca -0.09 0.93 -0.23 0.00 0.00 0.00 0.00 44.72 45.34 2oqu s GLY 73 CO -0.01 1.33 0.74 0.14 0.00 0.00 0.00 173.10 175.30 2oqu s VAL 74 N -1.63 4.91 -0.15 1.40 1.01 -1.02 -0.66 120.40 124.25 2oqu s VAL 74 Ca 0.71 1.38 0.09 0.00 0.00 0.00 0.00 61.98 64.16 2oqu s VAL 74 Cb -0.28 -4.04 -0.23 0.00 0.00 0.00 0.00 36.38 31.84 2oqu s VAL 74 CO 0.32 -0.01 0.22 1.67 0.00 0.00 0.00 175.10 177.30 2oqu n GLN 75 N 5.77 0.68 -3.74 2.72 7.27 0.28 -4.84 117.38 125.52 2oqu n GLN 75 Ca 0.03 0.15 -0.13 0.00 0.07 0.00 0.00 57.00 57.12 2oqu n GLN 75 Cb 0.48 -1.63 -0.10 0.00 2.41 0.00 0.00 30.24 31.40 2oqu n GLN 75 CO 0.00 0.00 0.00 0.21 0.07 0.00 0.00 177.06 177.34 2oqu s LYS 76 N -2.54 0.43 -0.17 3.69 2.20 -1.06 -4.99 119.74 117.30 2oqu s LYS 76 Ca -0.16 0.54 0.00 0.00 -0.36 0.00 0.00 55.97 56.00 2oqu s LYS 76 Cb 0.07 0.19 0.01 0.00 -1.51 0.00 0.00 37.83 36.58 2oqu s LYS 76 CO 0.77 -0.06 -0.16 0.42 -0.36 0.00 0.00 175.35 175.96 2oqu s ILE 77 N 0.32 2.51 -0.41 5.43 1.01 -1.26 -0.75 121.20 128.05 2oqu s ILE 77 Ca -0.01 -0.81 -0.00 0.00 0.00 0.00 0.00 60.65 59.83 2oqu s ILE 77 Cb -0.03 -2.07 0.11 0.00 0.01 0.00 0.00 42.46 40.48 2oqu s ILE 77 CO -0.01 0.51 0.17 -0.69 0.00 0.00 0.00 174.94 174.93 2oqu s VAL 78 N 1.06 2.97 0.29 2.92 1.01 0.51 -5.00 120.40 124.16 2oqu s VAL 78 Ca -0.01 -2.26 -0.18 0.00 0.00 0.00 0.00 61.98 59.53 2oqu s VAL 78 Cb -0.14 -3.07 -0.09 0.00 0.00 0.00 0.00 36.38 33.08 2oqu s VAL 78 CO -0.05 -0.68 0.75 0.54 0.00 0.00 0.00 175.10 175.67 2oqu s VAL 79 N 0.92 4.60 0.03 2.92 0.11 -1.26 -1.34 120.40 126.38 2oqu s VAL 79 Ca 0.10 1.15 -0.37 0.00 -2.93 0.00 0.00 61.98 59.93 2oqu s VAL 79 Cb -0.22 -3.72 -0.16 0.00 -1.53 0.00 0.00 36.38 30.75 2oqu s VAL 79 CO -0.05 -0.03 1.49 1.57 -3.33 0.00 0.00 175.10 174.75 2oqu n HIS 80 N 0.08 1.80 0.34 1.54 -0.00 -0.73 -4.82 115.22 113.42 2oqu n HIS 80 Ca 0.01 0.51 0.22 0.00 0.46 0.00 0.00 57.72 58.93 2oqu n HIS 80 Cb 0.52 -2.42 1.20 0.00 -0.12 0.00 0.00 29.99 29.18 2oqu n HIS 80 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 2oqu h PRO 81 N 5.58 0.00 -0.01 1.57 0.13 -1.93 -1.74 132.00 135.60 2oqu h PRO 81 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2oqu h PRO 81 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 2oqu h PRO 81 CO 0.84 0.00 -0.44 0.66 -0.23 0.00 0.00 178.00 178.83 2oqu n TYR 82 N -3.06 0.00 -1.94 1.56 4.01 -1.26 -4.95 117.16 111.51 2oqu n TYR 82 Ca -0.03 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.30 2oqu n TYR 82 Cb 0.09 -0.10 -0.02 0.00 -0.31 0.00 0.00 39.34 39.00 2oqu n TYR 82 CO 0.00 0.00 0.00 -0.46 -0.46 0.00 0.00 176.86 175.94 2oqu s TRP 83 N -2.64 2.89 -0.18 -0.72 -0.11 -0.66 -4.92 118.94 112.60 2oqu s TRP 83 Ca 0.19 1.06 -0.01 0.00 1.22 0.00 0.00 56.10 58.56 2oqu s TRP 83 Cb 0.18 -3.89 0.05 0.00 -1.50 0.00 0.00 33.47 28.32 2oqu s TRP 83 CO 0.60 -2.79 -0.03 1.21 -4.62 0.00 0.00 176.95 171.33 2oqu s ASN 84 N 0.16 3.02 0.57 5.86 2.47 -1.26 -5.03 114.94 120.72 2oqu s ASN 84 Ca 0.57 -0.79 0.26 0.00 0.42 0.00 0.00 52.86 53.33 2oqu s ASN 84 Cb -0.44 -0.88 1.55 0.00 -1.45 0.00 0.00 41.25 40.03 2oqu s ASN 84 CO 0.49 -0.22 2.09 0.74 -3.72 0.00 0.00 177.10 176.48 2oqu h THR 85 N 6.47 0.61 -0.45 -5.21 2.02 -1.98 -1.45 112.91 112.93 2oqu h THR 85 Ca -0.21 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.97 2oqu h THR 85 Cb 1.11 0.85 0.00 0.00 -1.74 0.00 0.00 68.15 68.37 2oqu h THR 85 CO 0.38 0.00 0.00 0.47 0.37 0.00 0.00 175.52 176.74 2oqu n ASP 86 N -4.05 2.50 -2.97 4.18 8.00 -1.26 -4.46 116.55 118.49 2oqu n ASP 86 Ca 0.02 -1.98 -0.15 0.00 0.71 0.00 0.00 54.79 53.39 2oqu n ASP 86 Cb 0.33 -0.30 0.00 0.00 -0.02 0.00 0.00 41.12 41.14 2oqu n ASP 86 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2oqu n ASP 87 N 0.86 -1.16 0.23 -2.24 -0.08 -0.54 -4.96 116.55 108.66 2oqu n ASP 87 Ca 0.16 -3.11 0.08 0.00 -1.51 0.00 0.00 54.79 50.41 2oqu n ASP 87 Cb 0.40 0.61 0.55 0.00 2.34 0.00 0.00 41.12 45.02 2oqu n ASP 87 CO 0.00 0.00 0.00 -0.37 0.12 0.00 0.00 177.20 176.95 2oqu h VAL 88 N 2.34 0.84 0.00 5.18 -1.51 -1.78 -2.24 116.25 119.08 2oqu h VAL 88 Ca -0.03 -0.87 0.00 0.00 -1.23 0.00 0.00 66.70 64.57 2oqu h VAL 88 Cb 0.98 1.52 0.00 0.00 -2.13 0.00 0.00 31.29 31.66 2oqu h VAL 88 CO 0.37 0.22 0.00 0.00 -1.23 0.00 0.00 177.57 176.93 2oqu h ALA 89 N 1.78 1.00 0.00 5.19 0.00 -1.92 -1.87 119.26 123.44 2oqu h ALA 89 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2oqu h ALA 89 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2oqu h ALA 89 CO 0.03 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.28 2oqu h ALA 90 N 2.27 1.00 0.00 0.00 0.00 -1.69 -3.44 119.26 117.40 2oqu h ALA 90 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2oqu h ALA 90 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2oqu h ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 2oqu n GLY 91 N 0.51 -1.13 2.36 0.00 0.00 -0.71 -4.98 105.19 101.23 2oqu n GLY 91 Ca 0.03 -1.53 -0.13 0.00 0.00 0.00 0.00 46.02 44.39 2oqu n GLY 91 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2oqu n TYR 92 N 0.00 -0.14 -2.07 1.61 4.01 -1.26 -4.62 117.16 114.69 2oqu n TYR 92 Ca 0.00 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.32 2oqu n TYR 92 Cb 0.00 -2.51 0.00 0.00 -0.31 0.00 0.00 39.34 36.52 2oqu n TYR 92 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 2oqu n ASP 93 N -0.24 4.31 -3.67 7.72 2.03 -1.26 -4.45 116.55 120.99 2oqu n ASP 93 Ca -0.14 -2.88 -0.15 0.00 0.52 0.00 0.00 54.79 52.15 2oqu n ASP 93 Cb 0.48 -1.69 -0.08 0.00 -0.72 0.00 0.00 41.12 39.11 2oqu n ASP 93 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2oqu s ILE 94 N 3.46 0.01 0.01 5.18 2.07 -1.26 -3.83 121.20 126.85 2oqu s ILE 94 Ca 0.49 -0.11 -0.21 0.00 -1.41 0.00 0.00 60.65 59.41 2oqu s ILE 94 Cb 0.10 -0.77 0.04 0.00 0.13 0.00 0.00 42.46 41.96 2oqu s ILE 94 CO -0.03 -0.06 0.47 0.00 -1.91 0.00 0.00 174.94 173.42 2oqu s ALA 95 N -0.46 -1.20 -0.06 1.50 0.00 -0.08 -1.78 121.76 119.68 2oqu s ALA 95 Ca -0.06 0.60 0.05 0.00 0.00 0.00 0.00 51.96 52.56 2oqu s ALA 95 Cb -0.03 0.22 -0.02 0.00 0.00 0.00 0.00 23.12 23.29 2oqu s ALA 95 CO 0.04 -0.41 -0.22 -0.51 0.00 0.00 0.00 175.76 174.66 2oqu s LEU 96 N -1.67 2.25 -0.21 0.00 1.43 -0.45 -0.81 118.68 119.22 2oqu s LEU 96 Ca -0.08 -0.43 -0.02 0.00 -1.03 0.00 0.00 54.13 52.57 2oqu s LEU 96 Cb -0.02 -1.42 0.01 0.00 0.03 0.00 0.00 46.19 44.79 2oqu s LEU 96 CO 0.02 0.27 -0.10 -0.76 0.23 0.00 0.00 176.35 176.01 2oqu s LEU 97 N -0.31 2.64 -0.05 1.79 1.43 0.39 -0.36 118.68 124.21 2oqu s LEU 97 Ca 0.01 -0.53 -0.27 0.00 -1.03 0.00 0.00 54.13 52.31 2oqu s LEU 97 Cb -0.13 -1.64 -0.03 0.00 0.03 0.00 0.00 46.19 44.43 2oqu s LEU 97 CO 0.02 -0.02 0.86 -0.60 0.23 0.00 0.00 176.35 176.84 2oqu s ARG 98 N 1.40 4.47 0.36 1.70 3.52 0.07 -1.24 118.95 129.22 2oqu s ARG 98 Ca 0.05 1.17 -0.13 0.00 -0.13 0.00 0.00 55.73 56.69 2oqu s ARG 98 Cb -0.14 -3.47 -0.08 0.00 -1.56 0.00 0.00 34.95 29.70 2oqu s ARG 98 CO -0.07 -0.06 0.74 -0.51 -0.81 0.00 0.00 175.30 174.59 2oqu s LEU 99 N 1.14 3.96 0.43 -0.88 1.43 0.09 -0.55 118.68 124.29 2oqu s LEU 99 Ca 0.45 1.19 0.23 0.00 -1.03 0.00 0.00 54.13 54.97 2oqu s LEU 99 Cb -0.19 -4.03 0.89 0.00 0.03 0.00 0.00 46.19 42.89 2oqu s LEU 99 CO 0.22 -0.29 1.81 0.00 0.23 0.00 0.00 176.35 178.32 2oqu h ALA 100 N 1.79 1.02 -2.50 4.21 0.00 -1.22 -3.43 119.26 119.13 2oqu h ALA 100 Ca -0.47 -0.22 -0.29 0.00 0.00 0.00 0.00 54.91 53.93 2oqu h ALA 100 Cb 1.18 -0.04 -0.16 0.00 0.00 0.00 0.00 17.79 18.77 2oqu h ALA 100 CO 0.65 0.31 -0.72 -1.14 0.00 0.00 0.00 179.25 178.35 2oqu s GLN 101 N -3.65 0.87 -0.21 0.00 0.74 -1.26 -5.04 119.66 111.10 2oqu s GLN 101 Ca 0.00 -1.25 -0.22 0.00 0.05 0.00 0.00 55.36 53.94 2oqu s GLN 101 Cb 0.10 -0.43 -0.02 0.00 1.10 0.00 0.00 33.01 33.76 2oqu s GLN 101 CO 0.64 0.05 0.71 -1.12 -0.55 0.00 0.00 175.29 175.02 2oqu s SER 102 N -2.72 6.75 0.64 6.67 0.01 -1.26 -4.63 113.70 119.16 2oqu s SER 102 Ca 0.09 0.92 -0.15 0.00 1.31 0.00 0.00 55.95 58.12 2oqu s SER 102 Cb 0.00 -2.39 -0.01 0.00 0.21 0.00 0.00 66.02 63.84 2oqu s SER 102 CO -0.01 -0.37 1.10 0.68 0.41 0.00 0.00 173.24 175.05 2oqu s VAL 103 N 2.27 3.34 -0.14 3.43 -7.23 -0.26 -4.98 120.40 116.84 2oqu s VAL 103 Ca 0.31 0.63 -0.18 0.00 -1.81 0.00 0.00 61.98 60.94 2oqu s VAL 103 Cb -0.16 -3.16 -0.04 0.00 0.56 0.00 0.00 36.38 33.58 2oqu s VAL 103 CO 0.10 -0.38 0.47 -0.89 -0.31 0.00 0.00 175.10 174.09 2oqu s THR 104 N -2.33 5.18 0.18 5.32 2.01 -1.26 -4.86 115.64 119.88 2oqu s THR 104 Ca 0.67 0.92 -0.26 0.00 0.31 0.00 0.00 61.69 63.33 2oqu s THR 104 Cb -0.20 -3.81 -0.08 0.00 0.01 0.00 0.00 72.50 68.42 2oqu s THR 104 CO 0.40 0.30 0.80 -0.76 -0.69 0.00 0.00 174.62 174.67 2oqu s LEU 105 N 0.80 4.60 0.00 4.42 1.02 -1.26 -4.79 118.68 123.48 2oqu s LEU 105 Ca 0.25 1.68 0.00 0.00 0.02 0.00 0.00 54.13 56.08 2oqu s LEU 105 Cb -0.15 -3.34 0.00 0.00 0.02 0.00 0.00 46.19 42.72 2oqu s LEU 105 CO 0.10 0.20 0.00 -0.46 0.02 0.00 0.00 176.35 176.21 2oqu n ASN 106 N 1.56 0.00 0.24 2.29 0.23 -0.50 -4.96 115.26 114.13 2oqu n ASN 106 Ca -0.05 -0.88 0.17 0.00 -0.53 0.00 0.00 54.58 53.29 2oqu n ASN 106 Cb 0.48 0.00 0.85 0.00 -2.08 0.00 0.00 39.78 39.03 2oqu n ASN 106 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 2oqu h SER 107 N 0.00 0.00 0.00 0.53 4.64 -2.00 -2.29 113.55 114.43 2oqu h SER 107 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2oqu h SER 107 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2oqu h SER 107 CO 0.00 0.00 -1.16 -1.22 -0.87 0.00 0.00 176.83 173.58 2oqu n TYR 108 N -2.69 0.00 -3.61 4.77 4.01 -1.26 -4.73 117.16 113.65 2oqu n TYR 108 Ca -0.01 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.45 2oqu n TYR 108 Cb 0.10 -0.09 -0.16 0.00 -0.31 0.00 0.00 39.34 38.88 2oqu n TYR 108 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 2oqu s VAL 109 N -3.06 0.06 0.05 -0.72 1.01 -0.86 -3.68 120.40 113.20 2oqu s VAL 109 Ca 0.05 -0.48 -0.03 0.00 0.00 0.00 0.00 61.98 61.53 2oqu s VAL 109 Cb 0.15 -0.83 -0.03 0.00 0.00 0.00 0.00 36.38 35.68 2oqu s VAL 109 CO 0.86 -0.43 0.02 -1.10 0.00 0.00 0.00 175.10 174.45 2oqu s GLN 110 N 2.06 0.58 0.25 2.72 -1.52 -0.80 -1.41 119.66 121.53 2oqu s GLN 110 Ca 0.04 -0.99 -0.30 0.00 -1.95 0.00 0.00 55.36 52.17 2oqu s GLN 110 Cb -0.16 0.21 -0.09 0.00 -0.22 0.00 0.00 33.01 32.75 2oqu s GLN 110 CO -0.18 -0.12 1.22 -0.51 -0.25 0.00 0.00 175.29 175.44 2oqu s LEU 111 N -2.50 4.47 0.16 2.90 1.43 -1.26 -3.41 118.68 120.47 2oqu s LEU 111 Ca 0.00 2.39 -0.30 0.00 -1.03 0.00 0.00 54.13 55.19 2oqu s LEU 111 Cb 0.03 -3.62 -0.07 0.00 0.03 0.00 0.00 46.19 42.55 2oqu s LEU 111 CO -0.07 -0.37 1.07 -0.83 0.23 0.00 0.00 176.35 176.37 2oqu s GLY 112 N -0.28 2.87 0.03 -3.19 0.00 0.13 -4.83 107.32 102.06 2oqu s GLY 112 Ca 0.50 0.76 -0.19 0.00 0.00 0.00 0.00 44.72 45.78 2oqu s GLY 112 CO 0.42 1.62 0.56 0.14 0.00 0.00 0.00 173.10 175.84 2oqu s VAL 113 N -0.14 4.85 0.17 1.40 1.01 -1.26 -4.77 120.40 121.65 2oqu s VAL 113 Ca 0.49 1.18 0.04 0.00 0.00 0.00 0.00 61.98 63.70 2oqu s VAL 113 Cb -0.28 -3.89 -0.04 0.00 0.00 0.00 0.00 36.38 32.18 2oqu s VAL 113 CO 0.33 0.50 0.20 -0.76 0.00 0.00 0.00 175.10 175.37 2oqu s LEU 114 N -0.70 3.99 0.80 3.92 1.43 -1.26 -0.82 118.68 126.03 2oqu s LEU 114 Ca 0.29 -0.04 -0.11 0.00 -1.03 0.00 0.00 54.13 53.24 2oqu s LEU 114 Cb -0.19 -2.57 0.07 0.00 0.03 0.00 0.00 46.19 43.53 2oqu s LEU 114 CO 0.17 0.05 1.09 -2.84 0.23 0.00 0.00 176.35 175.05 2oqu s PRO 115 N -3.25 2.07 0.43 1.29 0.02 -1.26 -4.88 135.00 129.42 2oqu s PRO 115 Ca 0.32 0.96 -0.26 0.00 0.02 0.00 0.00 61.00 62.05 2oqu s PRO 115 Cb -0.10 -1.89 -0.09 0.00 0.02 0.00 0.00 34.50 32.44 2oqu s PRO 115 CO 0.25 -1.71 1.37 1.03 -0.33 0.00 0.00 177.00 177.61 2oqu s ARG 116 N -4.97 3.84 0.20 5.54 1.81 -1.26 -4.78 118.95 119.33 2oqu s ARG 116 Ca 0.61 2.30 -0.32 0.00 -1.72 0.00 0.00 55.73 56.60 2oqu s ARG 116 Cb -0.16 -2.72 -0.15 0.00 -0.45 0.00 0.00 34.95 31.47 2oqu s ARG 116 CO 0.56 -0.65 1.28 0.00 -0.68 0.00 0.00 175.30 175.81 2oqu n ALA 117 N -0.01 0.08 -0.23 2.13 0.00 -1.26 -2.28 120.51 118.95 2oqu n ALA 117 Ca 0.04 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.92 2oqu n ALA 117 Cb 0.42 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.73 2oqu n ALA 117 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oqu n GLY 118 N 2.10 1.78 3.71 0.00 0.00 0.13 -5.01 105.19 107.90 2oqu n GLY 118 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 2oqu n GLY 118 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2oqu s THR 119 N -2.95 2.47 -0.10 2.61 2.01 -0.97 -5.00 115.64 113.71 2oqu s THR 119 Ca 0.00 0.21 0.04 0.00 0.31 0.00 0.00 61.69 62.24 2oqu s THR 119 Cb 0.00 -3.13 0.00 0.00 0.01 0.00 0.00 72.50 69.38 2oqu s THR 119 CO 0.00 0.01 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.09 2oqu s ILE 120 N 1.83 1.95 0.27 1.82 -1.09 -1.26 -4.77 121.20 119.94 2oqu s ILE 120 Ca 0.75 -0.95 -0.28 0.00 -2.23 0.00 0.00 60.65 57.94 2oqu s ILE 120 Cb -0.46 -1.69 -0.09 0.00 -1.58 0.00 0.00 42.46 38.64 2oqu s ILE 120 CO 0.33 0.53 0.93 -0.76 -1.23 0.00 0.00 174.94 174.75 2oqu s LEU 121 N 0.45 4.53 0.60 2.97 1.43 -1.26 -5.02 118.68 122.38 2oqu s LEU 121 Ca -0.17 1.89 -0.20 0.00 -1.03 0.00 0.00 54.13 54.63 2oqu s LEU 121 Cb -0.17 -3.75 -0.03 0.00 0.03 0.00 0.00 46.19 42.27 2oqu s LEU 121 CO 0.07 0.08 1.31 0.00 0.23 0.00 0.00 176.35 178.04 2oqu s ALA 122 N -1.34 2.59 0.26 4.21 0.00 -1.26 -4.89 121.76 121.33 2oqu s ALA 122 Ca 0.44 1.25 -0.27 0.00 0.00 0.00 0.00 51.96 53.38 2oqu s ALA 122 Cb -0.23 -3.55 -0.16 0.00 0.00 0.00 0.00 23.12 19.18 2oqu s ALA 122 CO 0.29 -1.45 0.67 -1.71 0.00 0.00 0.00 175.76 173.55 2oqu n ASN 123 N -1.48 -0.42 -1.25 0.00 5.15 -1.26 -2.13 115.26 113.87 2oqu n ASN 123 Ca 0.13 1.11 -0.14 0.00 -0.60 0.00 0.00 54.58 55.08 2oqu n ASN 123 Cb 0.47 -1.08 -0.05 0.00 -0.53 0.00 0.00 39.78 38.60 2oqu n ASN 123 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2oqu n ASN 124 N 1.69 -4.64 -4.73 1.20 5.15 -0.13 -4.95 115.26 108.85 2oqu n ASN 124 Ca 0.14 0.25 -0.42 0.00 -0.60 0.00 0.00 54.58 53.96 2oqu n ASN 124 Cb 0.29 -3.51 -0.03 0.00 -0.53 0.00 0.00 39.78 36.00 2oqu n ASN 124 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 2oqu s SER 125 N -2.71 6.82 0.19 1.20 0.01 -0.90 -4.60 113.70 113.71 2oqu s SER 125 Ca 0.00 2.42 -0.30 0.00 1.31 0.00 0.00 55.95 59.38 2oqu s SER 125 Cb 0.00 -2.60 -0.08 0.00 0.21 0.00 0.00 66.02 63.55 2oqu s SER 125 CO 0.00 -0.62 1.06 -2.16 0.41 0.00 0.00 173.24 171.93 2oqu s PRO 126 N 0.42 4.65 0.07 12.44 0.04 -1.26 -0.81 135.00 150.55 2oqu s PRO 126 Ca 0.61 1.66 -0.08 0.00 0.04 0.00 0.00 61.00 63.24 2oqu s PRO 126 Cb -0.38 -3.28 -0.01 0.00 0.04 0.00 0.00 34.50 30.88 2oqu s PRO 126 CO 0.35 0.17 0.15 0.00 0.04 0.00 0.00 177.00 177.71 2oqu s TYR 128 N -3.55 2.64 0.18 0.00 2.02 0.11 -0.42 117.35 118.32 2oqu s TYR 128 Ca 0.03 -0.76 -0.17 0.00 -0.37 0.00 0.00 57.07 55.80 2oqu s TYR 128 Cb 0.04 -1.73 -0.07 0.00 -0.40 0.00 0.00 41.96 39.80 2oqu s TYR 128 CO -0.09 -0.25 0.63 -1.50 -1.57 0.00 0.00 175.55 172.77 2oqu s ILE 129 N 0.14 4.72 0.09 2.71 2.07 -0.44 -0.79 121.20 129.71 2oqu s ILE 129 Ca -0.10 1.06 0.06 0.00 -1.41 0.00 0.00 60.65 60.25 2oqu s ILE 129 Cb -0.16 -3.80 -0.03 0.00 0.13 0.00 0.00 42.46 38.60 2oqu s ILE 129 CO 0.06 0.25 -0.15 0.42 -1.91 0.00 0.00 174.94 173.61 2oqu s THR 130 N -1.47 1.28 0.00 4.00 -4.23 -1.17 -1.30 115.64 112.75 2oqu s THR 130 Ca 0.40 -1.49 0.00 0.00 -1.18 0.00 0.00 61.69 59.41 2oqu s THR 130 Cb -0.16 -1.31 0.00 0.00 1.34 0.00 0.00 72.50 72.37 2oqu s THR 130 CO 0.20 -0.27 0.00 0.61 -0.54 0.00 0.00 174.62 174.61 2oqu n GLY 131 N 0.97 0.53 1.15 3.99 0.00 -0.58 -4.46 105.19 106.80 2oqu n GLY 131 Ca -0.19 -1.16 0.10 0.00 0.00 0.00 0.00 46.02 44.77 2oqu n GLY 131 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2oqu n TRP 132 N -0.85 0.85 -0.47 1.61 8.01 -1.26 -1.92 117.44 123.41 2oqu n TRP 132 Ca 0.00 -0.51 -0.29 0.00 -1.31 0.00 0.00 57.50 55.39 2oqu n TRP 132 Cb 0.00 -0.02 0.24 0.00 -2.01 0.00 0.00 31.31 29.52 2oqu n TRP 132 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2oqu n GLY 133 N 1.26 -2.60 3.52 6.99 0.00 -1.25 -1.02 105.19 112.10 2oqu n GLY 133 Ca 0.21 -1.18 -0.47 0.00 0.00 0.00 0.00 46.02 44.58 2oqu n GLY 133 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2oqu n LEU 134 N -4.12 0.65 -0.04 0.99 4.77 0.28 -2.03 117.00 117.50 2oqu n LEU 134 Ca 0.04 1.16 0.12 0.00 -0.03 0.00 0.00 56.01 57.29 2oqu n LEU 134 Cb 0.56 -1.15 0.15 0.00 -2.33 0.00 0.00 43.42 40.65 2oqu n LEU 134 CO 0.51 -1.94 0.33 0.35 -1.33 0.00 0.00 177.39 175.31 2oqu n THR 135 N 0.38 0.00 -3.91 -5.08 -2.24 -0.76 -0.57 114.28 102.10 2oqu n THR 135 Ca 0.14 -0.02 -0.10 0.00 -2.27 0.00 0.00 64.05 61.79 2oqu n THR 135 Cb 0.28 0.51 -0.10 0.00 -2.10 0.00 0.00 70.33 68.92 2oqu n THR 135 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2oqu s ARG 136 N -2.93 0.54 0.15 -0.78 1.81 -1.26 -4.28 118.95 112.19 2oqu s ARG 136 Ca 0.12 -0.61 -0.34 0.00 -1.72 0.00 0.00 55.73 53.17 2oqu s ARG 136 Cb 0.17 0.22 -0.15 0.00 -0.45 0.00 0.00 34.95 34.74 2oqu s ARG 136 CO 0.72 -0.13 1.45 2.41 -0.68 0.00 0.00 175.30 179.07 2oqu n THR 137 N 1.06 0.16 -2.31 0.02 -1.04 -1.26 -0.61 114.28 110.30 2oqu n THR 137 Ca -0.21 -0.04 -0.18 0.00 -2.04 0.00 0.00 64.05 61.58 2oqu n THR 137 Cb 0.57 -1.25 -0.02 0.00 -1.82 0.00 0.00 70.33 67.82 2oqu n THR 137 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2oqu n ASN 138 N 2.89 -5.21 -0.03 8.00 5.03 -1.26 -4.95 115.26 119.73 2oqu n ASN 138 Ca 0.17 0.10 0.00 0.00 0.87 0.00 0.00 54.58 55.71 2oqu n ASN 138 Cb 0.26 -4.39 0.00 0.00 -1.02 0.00 0.00 39.78 34.63 2oqu n ASN 138 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2oqu n GLY 139 N -0.88 1.85 3.19 7.41 0.00 0.22 -5.14 105.19 111.84 2oqu n GLY 139 Ca -0.21 -1.75 -0.17 0.00 0.00 0.00 0.00 46.02 43.89 2oqu n GLY 139 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2oqu s GLN 140 N 4.55 0.89 0.47 1.61 0.74 -1.26 -4.93 119.66 121.73 2oqu s GLN 140 Ca 0.00 -1.11 -0.23 0.00 0.05 0.00 0.00 55.36 54.07 2oqu s GLN 140 Cb 0.00 -0.75 -0.08 0.00 1.10 0.00 0.00 33.01 33.28 2oqu s GLN 140 CO 0.00 0.15 1.11 1.28 -0.55 0.00 0.00 175.29 177.28 2oqu n LEU 141 N 0.81 3.57 -4.76 3.68 4.77 -1.26 -1.82 117.00 121.99 2oqu n LEU 141 Ca -0.18 1.00 -0.37 0.00 -0.03 0.00 0.00 56.01 56.43 2oqu n LEU 141 Cb 0.56 -1.43 0.02 0.00 -2.33 0.00 0.00 43.42 40.24 2oqu n LEU 141 CO 0.25 -1.22 0.89 0.00 -1.33 0.00 0.00 177.39 175.97 2oqu s ALA 142 N -1.31 2.83 0.05 -1.18 0.00 -0.19 -4.82 121.76 117.14 2oqu s ALA 142 Ca 0.66 1.10 -0.16 0.00 0.00 0.00 0.00 51.96 53.56 2oqu s ALA 142 Cb -0.50 -3.47 -0.27 0.00 0.00 0.00 0.00 23.12 18.89 2oqu s ALA 142 CO 0.54 -1.03 1.11 1.96 0.00 0.00 0.00 175.76 178.35 2oqu h GLN 143 N 1.59 0.61 -6.47 0.00 4.20 -1.93 -3.46 115.11 109.65 2oqu h GLN 143 Ca -0.50 -0.76 -0.67 0.00 0.06 0.00 0.00 58.65 56.78 2oqu h GLN 143 Cb 1.28 0.24 -0.17 0.00 0.30 0.00 0.00 27.48 29.13 2oqu h GLN 143 CO 0.58 1.33 -0.74 0.95 -0.67 0.00 0.00 178.83 180.29 2oqu s THR 144 N -3.06 3.38 0.05 -0.54 -4.23 -1.26 -1.16 115.64 108.81 2oqu s THR 144 Ca -0.10 -1.09 -0.36 0.00 -1.18 0.00 0.00 61.69 58.96 2oqu s THR 144 Cb 0.05 -2.52 -0.16 0.00 1.34 0.00 0.00 72.50 71.22 2oqu s THR 144 CO 0.91 0.24 1.47 -0.11 -0.54 0.00 0.00 174.62 176.59 2oqu n LEU 145 N 1.11 2.15 -4.68 4.79 7.94 -0.45 -4.82 117.00 123.04 2oqu n LEU 145 Ca -0.14 1.10 -0.27 0.00 -1.11 0.00 0.00 56.01 55.58 2oqu n LEU 145 Cb 0.52 -1.25 -0.07 0.00 0.53 0.00 0.00 43.42 43.15 2oqu n LEU 145 CO 0.31 -0.75 -0.32 -1.10 -1.11 0.00 0.00 177.39 174.42 2oqu s GLN 146 N 1.10 2.49 0.05 1.96 -1.52 -0.81 -0.87 119.66 122.06 2oqu s GLN 146 Ca 0.85 -1.03 0.05 0.00 -1.95 0.00 0.00 55.36 53.28 2oqu s GLN 146 Cb -0.89 -2.43 -0.03 0.00 -0.22 0.00 0.00 33.01 29.45 2oqu s GLN 146 CO 0.47 0.47 -0.14 1.14 -0.25 0.00 0.00 175.29 176.99 2oqu s GLN 147 N -2.85 0.84 -0.00 2.91 -2.07 0.06 -1.52 119.66 117.04 2oqu s GLN 147 Ca 0.27 -0.85 0.02 0.00 -1.82 0.00 0.00 55.36 52.99 2oqu s GLN 147 Cb -0.10 -0.84 -0.01 0.00 -1.09 0.00 0.00 33.01 30.98 2oqu s GLN 147 CO 0.19 0.20 -0.06 0.00 -1.32 0.00 0.00 175.29 174.30 2oqu s ALA 148 N -1.08 0.49 -0.41 2.60 0.00 -0.42 -0.78 121.76 122.17 2oqu s ALA 148 Ca -0.01 -0.28 -0.28 0.00 0.00 0.00 0.00 51.96 51.40 2oqu s ALA 148 Cb -0.09 -0.11 0.02 0.00 0.00 0.00 0.00 23.12 22.94 2oqu s ALA 148 CO 0.02 0.11 1.03 -0.47 0.00 0.00 0.00 175.76 176.45 2oqu s TYR 149 N -0.21 2.98 -0.27 0.00 5.04 -1.26 -1.32 117.35 122.31 2oqu s TYR 149 Ca 0.02 0.79 -0.00 0.00 -2.44 0.00 0.00 57.07 55.43 2oqu s TYR 149 Cb -0.03 -3.98 0.08 0.00 0.35 0.00 0.00 41.96 38.39 2oqu s TYR 149 CO -0.00 -1.01 0.04 -0.51 -1.34 0.00 0.00 175.55 172.73 2oqu s LEU 150 N 3.89 2.46 0.39 6.97 1.02 0.44 -4.97 118.68 128.88 2oqu s LEU 150 Ca 0.43 -1.42 -0.25 0.00 0.02 0.00 0.00 54.13 52.92 2oqu s LEU 150 Cb -0.10 -1.00 -0.09 0.00 0.02 0.00 0.00 46.19 45.02 2oqu s LEU 150 CO 0.24 -0.34 1.05 -2.16 0.02 0.00 0.00 176.35 175.16 2oqu s PRO 151 N 1.51 4.21 0.73 1.29 0.04 -1.26 -3.23 135.00 138.29 2oqu s PRO 151 Ca 0.03 1.54 -0.14 0.00 0.04 0.00 0.00 61.00 62.47 2oqu s PRO 151 Cb -0.18 -2.61 0.04 0.00 0.04 0.00 0.00 34.50 31.79 2oqu s PRO 151 CO -0.14 -0.10 1.16 0.95 0.04 0.00 0.00 177.00 178.90 2oqu s THR 152 N -1.61 2.64 -0.18 1.26 -4.23 0.01 -0.48 115.64 113.05 2oqu s THR 152 Ca 0.56 0.29 0.01 0.00 -1.18 0.00 0.00 61.69 61.37 2oqu s THR 152 Cb -0.23 -2.77 0.04 0.00 1.34 0.00 0.00 72.50 70.88 2oqu s THR 152 CO 0.29 -0.20 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.37 2oqu s VAL 153 N -2.25 1.60 0.92 2.29 1.01 -0.30 -0.95 120.40 122.72 2oqu s VAL 153 Ca 0.70 -0.89 -0.11 0.00 0.00 0.00 0.00 61.98 61.68 2oqu s VAL 153 Cb -0.25 -1.63 0.14 0.00 0.00 0.00 0.00 36.38 34.64 2oqu s VAL 153 CO 0.46 0.24 1.09 1.51 0.00 0.00 0.00 175.10 178.41 2oqu s ASP 154 N 1.43 3.18 0.21 3.32 1.47 -1.26 -4.04 116.67 120.97 2oqu s ASP 154 Ca 0.00 1.64 -0.09 0.00 1.18 0.00 0.00 52.55 55.28 2oqu s ASP 154 Cb -0.15 -2.29 0.30 0.00 -0.34 0.00 0.00 42.92 40.44 2oqu s ASP 154 CO -0.09 -2.85 1.74 0.22 0.68 0.00 0.00 175.17 174.87 2oqu h TYR 155 N -1.69 0.39 -0.46 2.11 3.20 -1.94 0.32 116.97 118.89 2oqu h TYR 155 Ca -0.49 0.03 0.08 0.00 3.14 0.00 0.00 58.73 61.49 2oqu h TYR 155 Cb 1.28 -0.08 -0.07 0.00 1.54 0.00 0.00 36.73 39.41 2oqu h TYR 155 CO 0.43 0.08 0.08 0.00 -1.64 0.00 0.00 178.16 177.11 2oqu h ALA 156 N 1.44 0.50 -0.03 1.82 0.00 -1.97 0.45 119.26 121.46 2oqu h ALA 156 Ca 0.32 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.28 2oqu h ALA 156 Cb 0.41 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2oqu h ALA 156 CO -0.33 -0.33 -0.19 0.82 0.00 0.00 0.00 179.25 179.23 2oqu h ILE 157 N 0.21 1.50 -0.13 0.00 2.04 -1.76 -3.17 117.51 116.20 2oqu h ILE 157 Ca 0.23 -1.73 -0.02 0.00 1.00 0.00 0.00 64.86 64.34 2oqu h ILE 157 Cb 0.30 2.55 -0.01 0.00 -0.74 0.00 0.00 36.82 38.92 2oqu h ILE 157 CO -0.31 0.47 -0.02 0.00 0.00 0.00 0.00 178.15 178.29 2oqu n SER 159 N -4.41 2.04 -4.79 0.00 3.41 0.13 -0.65 113.62 109.36 2oqu n SER 159 Ca -0.01 -1.71 -0.31 0.00 -0.26 0.00 0.00 58.87 56.58 2oqu n SER 159 Cb 0.16 -0.06 0.08 0.00 -0.26 0.00 0.00 64.21 64.13 2oqu n SER 159 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2oqu s SER 160 N -1.80 4.73 0.29 4.04 1.04 -0.73 -3.53 113.70 117.75 2oqu s SER 160 Ca 0.35 1.65 0.01 0.00 0.48 0.00 0.00 55.95 58.43 2oqu s SER 160 Cb 0.20 -2.42 0.43 0.00 0.10 0.00 0.00 66.02 64.34 2oqu s SER 160 CO 0.30 -1.86 1.79 0.77 0.98 0.00 0.00 173.24 175.23 2oqu h SER 161 N -1.01 0.63 0.13 7.02 4.64 -1.91 -1.84 113.55 121.22 2oqu h SER 161 Ca -0.45 -0.15 -0.02 0.00 -0.47 0.00 0.00 61.79 60.70 2oqu h SER 161 Cb 1.23 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 63.15 2oqu h SER 161 CO 0.55 0.72 -0.12 0.28 -0.87 0.00 0.00 176.83 177.39 2oqu h SER 162 N 0.62 0.00 0.00 4.97 0.02 -1.93 -3.41 113.55 113.82 2oqu h SER 162 Ca 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 2oqu h SER 162 Cb 0.43 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.97 2oqu h SER 162 CO 0.02 0.12 0.00 -1.22 -1.14 0.00 0.00 176.83 174.61 2oqu n TYR 163 N -4.33 0.00 1.00 3.45 4.02 -0.75 -4.82 117.16 115.73 2oqu n TYR 163 Ca -0.03 0.00 0.11 0.00 -0.01 0.00 0.00 57.90 57.98 2oqu n TYR 163 Cb 0.19 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.54 2oqu n TYR 163 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 176.86 176.76 2oqu n TRP 164 N 0.00 0.00 -2.57 -0.72 7.02 0.18 -4.86 117.44 116.49 2oqu n TRP 164 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 2oqu n TRP 164 Cb 0.00 -0.00 0.00 0.00 -2.42 0.00 0.00 31.31 28.89 2oqu n TRP 164 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2oqu n GLY 165 N 1.40 2.77 0.00 6.99 0.00 -0.85 -2.10 105.19 113.41 2oqu n GLY 165 Ca 0.10 -0.26 0.10 0.00 0.00 0.00 0.00 46.02 45.96 2oqu n GLY 165 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2oqu n SER 166 N 1.30 0.00 -0.23 1.61 3.41 -1.26 -3.55 113.62 114.90 2oqu n SER 166 Ca 0.00 0.41 -0.07 0.00 -0.26 0.00 0.00 58.87 58.94 2oqu n SER 166 Cb 0.00 -0.46 0.03 0.00 -0.26 0.00 0.00 64.21 63.52 2oqu n SER 166 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2oqu h THR 167 N 0.00 1.24 -3.86 6.66 2.02 -1.78 -3.43 112.91 113.76 2oqu h THR 167 Ca 0.00 -0.80 -0.47 0.00 0.77 0.00 0.00 66.41 65.91 2oqu h THR 167 Cb 0.33 0.57 -0.02 0.00 -1.74 0.00 0.00 68.15 67.29 2oqu h THR 167 CO 0.00 0.31 0.31 0.68 0.37 0.00 0.00 175.52 177.19 2oqu s VAL 168 N -5.47 4.28 0.33 3.16 -7.23 -1.23 -4.73 120.40 109.51 2oqu s VAL 168 Ca -0.13 1.71 0.08 0.00 -1.81 0.00 0.00 61.98 61.83 2oqu s VAL 168 Cb 0.13 -3.94 -0.06 0.00 0.56 0.00 0.00 36.38 33.07 2oqu s VAL 168 CO 0.81 0.09 -0.06 -0.54 -0.31 0.00 0.00 175.10 175.10 2oqu s LYS 169 N -2.18 1.74 0.29 4.82 -0.14 -1.26 -4.93 119.74 118.07 2oqu s LYS 169 Ca 0.51 -1.91 0.24 0.00 -1.36 0.00 0.00 55.97 53.44 2oqu s LYS 169 Cb -0.17 -1.45 1.06 0.00 -1.68 0.00 0.00 37.83 35.58 2oqu s LYS 169 CO 0.22 0.06 1.72 -0.97 -0.76 0.00 0.00 175.35 175.62 2oqu h ASN 170 N 2.08 0.00 -0.01 2.83 -0.00 -1.98 -1.87 115.58 116.62 2oqu h ASN 170 Ca -0.42 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 55.88 2oqu h ASN 170 Cb 1.24 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.56 2oqu h ASN 170 CO 0.71 0.00 0.00 -1.54 -0.00 0.00 0.00 177.43 176.60 2oqu n SER 171 N -2.29 0.08 -4.39 1.15 3.41 -1.26 -4.87 113.62 105.45 2oqu n SER 171 Ca 0.01 -1.73 -0.21 0.00 -0.26 0.00 0.00 58.87 56.68 2oqu n SER 171 Cb 0.19 -0.01 -0.10 0.00 -0.26 0.00 0.00 64.21 64.03 2oqu n SER 171 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2oqu s MET 172 N -1.98 1.45 -0.11 4.33 -1.94 -0.70 -0.57 119.30 119.76 2oqu s MET 172 Ca 0.14 -1.62 0.03 0.00 -1.71 0.00 0.00 55.69 52.53 2oqu s MET 172 Cb 0.07 -1.41 -0.00 0.00 2.01 0.00 0.00 34.83 35.49 2oqu s MET 172 CO 0.11 0.26 -0.21 0.08 -0.01 0.00 0.00 175.02 175.24 2oqu s VAL 173 N -2.61 2.28 -0.01 -6.03 1.01 0.11 -4.68 120.40 110.46 2oqu s VAL 173 Ca 0.24 -0.93 -0.06 0.00 0.00 0.00 0.00 61.98 61.22 2oqu s VAL 173 Cb -0.03 -1.90 -0.05 0.00 0.00 0.00 0.00 36.38 34.40 2oqu s VAL 173 CO 0.10 0.55 0.24 0.00 0.00 0.00 0.00 175.10 175.99 2oqu s ALA 175 N -1.26 -0.71 0.00 0.00 0.00 -0.18 -1.15 121.76 118.46 2oqu s ALA 175 Ca 0.26 0.81 0.00 0.00 0.00 0.00 0.00 51.96 53.03 2oqu s ALA 175 Cb -0.13 -0.47 0.00 0.00 0.00 0.00 0.00 23.12 22.52 2oqu s ALA 175 CO 0.15 -0.14 0.00 0.41 0.00 0.00 0.00 175.76 176.18 2oqu n GLY 176 N 2.92 0.98 2.13 0.00 0.00 0.37 -1.36 105.19 110.22 2oqu n GLY 176 Ca -0.13 -1.10 -0.05 0.00 0.00 0.00 0.00 46.02 44.74 2oqu n GLY 176 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oqu n GLY 177 N 0.00 0.59 0.01 -0.02 0.00 -1.26 -4.63 105.19 99.87 2oqu n GLY 177 Ca 0.00 -0.79 0.15 0.00 0.00 0.00 0.00 46.02 45.38 2oqu n GLY 177 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2oqu n ASP 178 N 1.13 0.03 0.00 1.61 3.85 -1.26 -1.23 116.55 120.68 2oqu n ASP 178 Ca -0.05 -0.15 0.00 0.00 -0.71 0.00 0.00 54.79 53.87 2oqu n ASP 178 Cb 0.28 -0.28 0.00 0.00 -1.35 0.00 0.00 41.12 39.77 2oqu n ASP 178 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2oqu n GLY 179 N 1.29 0.93 0.39 6.12 0.00 -1.26 -4.74 105.19 107.92 2oqu n GLY 179 Ca 0.14 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.13 2oqu n GLY 179 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2oqu n VAL 180 N -2.05 0.21 -5.14 1.61 0.31 -1.26 -4.61 118.33 107.39 2oqu n VAL 180 Ca 0.00 -0.07 -0.30 0.00 -0.01 0.00 0.00 64.34 63.96 2oqu n VAL 180 Cb 0.00 -1.02 -0.15 0.00 -0.91 0.00 0.00 33.84 31.75 2oqu n VAL 180 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2oqu s ARG 181 N -2.07 1.97 0.04 5.55 0.52 -1.26 -3.75 118.95 119.94 2oqu s ARG 181 Ca -0.05 -0.99 -0.28 0.00 -0.52 0.00 0.00 55.73 53.88 2oqu s ARG 181 Cb 0.02 -1.99 0.10 0.00 0.52 0.00 0.00 34.95 33.59 2oqu s ARG 181 CO 0.08 0.54 1.07 -1.54 0.02 0.00 0.00 175.30 175.46 2oqu s SER 182 N -0.85 -0.17 0.99 0.23 1.04 -0.69 -4.36 113.70 109.89 2oqu s SER 182 Ca 0.11 -0.21 -0.12 0.00 0.48 0.00 0.00 55.95 56.20 2oqu s SER 182 Cb -0.10 0.34 0.19 0.00 0.10 0.00 0.00 66.02 66.54 2oqu s SER 182 CO 0.00 -0.60 1.09 -0.83 0.98 0.00 0.00 173.24 173.87 2oqu s GLY 183 N -2.78 1.58 0.34 7.32 0.00 -1.26 -0.77 107.32 111.74 2oqu s GLY 183 Ca 0.11 -0.24 -0.15 0.00 0.00 0.00 0.00 44.72 44.45 2oqu s GLY 183 CO -0.02 0.36 0.69 0.00 0.00 0.00 0.00 173.10 174.12 2oqu n GLN 185 N -0.50 2.08 0.00 0.00 3.00 -1.26 -1.23 117.38 119.47 2oqu n GLN 185 Ca -0.05 0.74 0.00 0.00 -0.01 0.00 0.00 57.00 57.68 2oqu n GLN 185 Cb 0.60 -2.39 0.00 0.00 0.00 0.00 0.00 30.24 28.45 2oqu n GLN 185 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2oqu n GLY 186 N 1.91 1.21 0.11 1.08 0.00 -1.26 -0.55 105.19 107.69 2oqu n GLY 186 Ca 0.10 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.24 2oqu n GLY 186 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2oqu h ASP 187 N 0.00 0.00 -1.80 1.61 3.32 -1.44 -3.29 116.42 114.81 2oqu h ASP 187 Ca 0.00 -0.06 -0.65 0.00 0.02 0.00 0.00 57.03 56.34 2oqu h ASP 187 Cb 0.00 0.00 0.10 0.00 0.22 0.00 0.00 39.33 39.65 2oqu h ASP 187 CO 0.00 0.03 -0.02 -1.20 -1.72 0.00 0.00 179.24 176.33 2oqu n SER 188 N -2.57 0.50 0.00 6.45 7.64 -1.26 -1.47 113.62 122.91 2oqu n SER 188 Ca 0.01 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.05 2oqu n SER 188 Cb 0.52 -1.15 0.00 0.00 -1.01 0.00 0.00 64.21 62.57 2oqu n SER 188 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2oqu n GLY 189 N 1.69 3.21 3.81 0.23 0.00 0.61 -0.25 105.19 114.49 2oqu n GLY 189 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.87 2oqu n GLY 189 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2oqu s GLY 190 N -1.95 1.67 0.40 -0.02 0.00 -0.55 -3.34 107.32 103.53 2oqu s GLY 190 Ca 0.00 -0.93 -0.16 0.00 0.00 0.00 0.00 44.72 43.63 2oqu s GLY 190 CO 0.00 -0.21 0.84 2.56 0.00 0.00 0.00 173.10 176.29 2oqu s PRO 191 N -5.60 4.00 -0.24 2.90 0.04 -1.26 -0.52 135.00 134.31 2oqu s PRO 191 Ca 0.70 0.78 -0.04 0.00 0.04 0.00 0.00 61.00 62.48 2oqu s PRO 191 Cb -0.08 -2.31 0.01 0.00 0.04 0.00 0.00 34.50 32.15 2oqu s PRO 191 CO 0.53 -0.01 -0.03 -1.17 0.04 0.00 0.00 177.00 176.37 2oqu s LEU 192 N -3.42 3.16 -0.24 -3.56 2.96 -0.49 -3.07 118.68 114.02 2oqu s LEU 192 Ca 0.56 -0.59 -0.10 0.00 -0.22 0.00 0.00 54.13 53.77 2oqu s LEU 192 Cb -0.10 -1.74 -0.05 0.00 0.50 0.00 0.00 46.19 44.80 2oqu s LEU 192 CO 0.22 -0.08 0.16 -1.00 -1.32 0.00 0.00 176.35 174.32 2oqu s HIS 193 N 1.44 3.29 -0.05 5.38 3.76 0.03 -0.65 115.29 128.49 2oqu s HIS 193 Ca 0.04 0.18 0.03 0.00 -0.15 0.00 0.00 55.06 55.15 2oqu s HIS 193 Cb -0.15 -2.28 0.01 0.00 1.11 0.00 0.00 32.58 31.26 2oqu s HIS 193 CO -0.03 0.02 -0.12 0.00 -0.85 0.00 0.00 174.74 173.76 2oqu s LEU 195 N 0.33 4.17 -0.09 0.00 2.96 -1.25 -1.73 118.68 123.08 2oqu s LEU 195 Ca -0.08 1.61 -0.00 0.00 -0.22 0.00 0.00 54.13 55.44 2oqu s LEU 195 Cb -0.12 -3.54 0.02 0.00 0.50 0.00 0.00 46.19 43.05 2oqu s LEU 195 CO 0.02 -0.70 -0.06 -0.69 -1.32 0.00 0.00 176.35 173.60 2oqu s VAL 196 N 3.19 0.83 -1.46 1.68 1.01 0.21 -4.83 120.40 121.03 2oqu s VAL 196 Ca 0.51 -0.20 -0.04 0.00 0.00 0.00 0.00 61.98 62.25 2oqu s VAL 196 Cb -0.20 -0.86 0.03 0.00 0.00 0.00 0.00 36.38 35.35 2oqu s VAL 196 CO 0.13 0.32 0.55 0.59 0.00 0.00 0.00 175.10 176.70 2oqu n ASN 197 N 4.71 -1.26 0.00 3.32 5.03 -1.26 -2.41 115.26 123.40 2oqu n ASN 197 Ca -0.14 -0.97 0.00 0.00 0.87 0.00 0.00 54.58 54.34 2oqu n ASN 197 Cb 0.50 -3.18 0.00 0.00 -1.02 0.00 0.00 39.78 36.09 2oqu n ASN 197 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2oqu n GLY 198 N -1.82 1.77 3.21 7.41 0.00 -1.26 -5.01 105.19 109.48 2oqu n GLY 198 Ca -0.22 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.53 2oqu n GLY 198 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2oqu s GLN 199 N -0.22 1.78 0.29 1.61 0.74 -1.01 -5.08 119.66 117.76 2oqu s GLN 199 Ca 0.00 -0.74 -0.29 0.00 0.05 0.00 0.00 55.36 54.38 2oqu s GLN 199 Cb 0.00 -1.67 -0.10 0.00 1.10 0.00 0.00 33.01 32.35 2oqu s GLN 199 CO 0.00 0.41 1.11 0.71 -0.55 0.00 0.00 175.29 176.97 2oqu s TYR 200 N -0.38 3.52 0.10 1.67 2.02 -1.26 -0.62 117.35 122.40 2oqu s TYR 200 Ca 0.05 1.67 0.04 0.00 -0.37 0.00 0.00 57.07 58.46 2oqu s TYR 200 Cb -0.09 -3.31 -0.04 0.00 -0.40 0.00 0.00 41.96 38.12 2oqu s TYR 200 CO 0.00 -0.66 -0.10 0.00 -1.57 0.00 0.00 175.55 173.22 2oqu s ALA 201 N -1.18 1.11 -0.68 3.71 0.00 -0.70 -4.70 121.76 119.32 2oqu s ALA 201 Ca 0.45 -1.20 -0.24 0.00 0.00 0.00 0.00 51.96 50.98 2oqu s ALA 201 Cb -0.32 0.03 0.06 0.00 0.00 0.00 0.00 23.12 22.89 2oqu s ALA 201 CO 0.41 -0.04 1.05 0.08 0.00 0.00 0.00 175.76 177.26 2oqu s VAL 202 N -2.48 4.16 -0.21 0.00 1.01 -0.00 -0.93 120.40 121.95 2oqu s VAL 202 Ca 0.06 -0.11 0.20 0.00 0.00 0.00 0.00 61.98 62.13 2oqu s VAL 202 Cb -0.03 -4.74 -0.01 0.00 0.00 0.00 0.00 36.38 31.60 2oqu s VAL 202 CO -0.00 -1.55 1.05 0.45 0.00 0.00 0.00 175.10 175.05 2oqu h HIS 203 N 9.68 0.00 -3.85 5.22 3.86 -1.21 -3.37 115.15 125.48 2oqu h HIS 203 Ca -0.28 0.00 -0.36 0.00 -1.16 0.00 0.00 60.37 58.57 2oqu h HIS 203 Cb 1.06 0.00 -0.20 0.00 1.06 0.00 0.00 27.41 29.34 2oqu h HIS 203 CO 1.01 0.25 -0.75 0.20 0.86 0.00 0.00 177.93 179.50 2oqu s GLY 204 N -4.51 0.81 -0.29 2.45 0.00 -1.13 -1.45 107.32 103.20 2oqu s GLY 204 Ca -0.00 -1.04 -0.03 0.00 0.00 0.00 0.00 44.72 43.65 2oqu s GLY 204 CO 0.78 -1.09 -0.00 0.14 0.00 0.00 0.00 173.10 172.93 2oqu s VAL 205 N -1.74 3.12 0.04 1.40 1.01 -0.65 -1.39 120.40 122.18 2oqu s VAL 205 Ca -0.00 -1.18 -0.35 0.00 0.00 0.00 0.00 61.98 60.46 2oqu s VAL 205 Cb -0.07 -2.71 -0.14 0.00 0.00 0.00 0.00 36.38 33.46 2oqu s VAL 205 CO 0.01 0.00 1.66 0.41 0.00 0.00 0.00 175.10 177.19 2oqu n THR 206 N 4.68 0.22 0.02 3.92 -1.04 0.32 -0.51 114.28 121.89 2oqu n THR 206 Ca -0.14 -0.04 -0.01 0.00 -2.04 0.00 0.00 64.05 61.81 2oqu n THR 206 Cb 0.45 -1.54 -0.00 0.00 -1.82 0.00 0.00 70.33 67.41 2oqu n THR 206 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 2oqu n SER 207 N 4.54 0.81 -3.68 8.00 2.88 0.31 -0.28 113.62 126.20 2oqu n SER 207 Ca 0.20 0.11 -0.10 0.00 -1.33 0.00 0.00 58.87 57.75 2oqu n SER 207 Cb 0.27 -0.26 -0.04 0.00 -0.75 0.00 0.00 64.21 63.42 2oqu n SER 207 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 2oqu s PHE 208 N -2.06 -0.16 0.39 0.66 -0.71 -0.64 -4.94 117.98 110.51 2oqu s PHE 208 Ca -0.03 -0.16 0.04 0.00 -1.04 0.00 0.00 56.93 55.74 2oqu s PHE 208 Cb 0.01 0.33 -0.03 0.00 -1.21 0.00 0.00 43.02 42.12 2oqu s PHE 208 CO 0.04 -0.82 0.14 0.14 -1.34 0.00 0.00 175.22 173.38 2oqu s VAL 209 N -3.84 0.55 0.56 -2.49 -7.23 -1.26 -1.26 120.40 105.42 2oqu s VAL 209 Ca 0.07 -2.00 -0.21 0.00 -1.81 0.00 0.00 61.98 58.03 2oqu s VAL 209 Cb 0.00 -2.39 -0.04 0.00 0.56 0.00 0.00 36.38 34.51 2oqu s VAL 209 CO -0.07 0.00 1.28 -0.55 -0.31 0.00 0.00 175.10 175.45 2oqu s SER 210 N -3.57 5.30 0.48 4.85 0.15 -1.23 -4.90 113.70 114.79 2oqu s SER 210 Ca 0.26 2.59 0.32 0.00 0.70 0.00 0.00 55.95 59.82 2oqu s SER 210 Cb 0.03 -2.62 1.34 0.00 -1.71 0.00 0.00 66.02 63.06 2oqu s SER 210 CO 0.16 -1.53 1.94 0.08 1.20 0.00 0.00 173.24 175.08 2oqu h ARG 211 N 1.30 0.00 0.00 5.44 0.11 -2.00 -2.80 114.38 116.43 2oqu h ARG 211 Ca -0.51 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.57 2oqu h ARG 211 Cb 1.30 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.38 2oqu h ARG 211 CO 0.57 0.00 0.00 -0.07 0.10 0.00 0.00 179.97 180.57 2oqu h LEU 212 N 0.00 0.00 0.00 0.08 3.38 -2.04 -3.49 115.31 113.24 2oqu h LEU 212 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2oqu h LEU 212 Cb 0.43 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.18 2oqu h LEU 212 CO 0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 2oqu n GLY 213 N 0.48 3.03 0.24 0.83 0.00 -1.06 -5.04 105.19 103.68 2oqu n GLY 213 Ca 0.02 -1.21 -0.10 0.00 0.00 0.00 0.00 46.02 44.74 2oqu n GLY 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oqu s ASN 215 N -4.97 6.87 -0.10 0.00 4.22 -1.26 -4.68 114.94 115.02 2oqu s ASN 215 Ca -0.09 -2.66 0.03 0.00 -2.14 0.00 0.00 52.86 48.00 2oqu s ASN 215 Cb 0.01 -2.33 0.01 0.00 1.28 0.00 0.00 41.25 40.22 2oqu s ASN 215 CO 0.30 -0.75 -0.20 -0.69 -2.04 0.00 0.00 177.10 173.72 2oqu s VAL 216 N 1.23 1.82 0.25 3.54 1.01 -1.26 -4.58 120.40 122.41 2oqu s VAL 216 Ca 0.31 -0.87 -0.30 0.00 0.00 0.00 0.00 61.98 61.12 2oqu s VAL 216 Cb -0.06 -1.60 -0.10 0.00 0.00 0.00 0.00 36.38 34.61 2oqu s VAL 216 CO -0.07 0.51 1.51 -0.89 0.00 0.00 0.00 175.10 176.16 2oqu s THR 217 N 0.56 2.46 -0.82 3.92 2.01 -1.26 -1.02 115.64 121.49 2oqu s THR 217 Ca -0.15 0.38 0.00 0.00 0.31 0.00 0.00 61.69 62.23 2oqu s THR 217 Cb -0.17 -3.24 0.00 0.00 0.01 0.00 0.00 72.50 69.10 2oqu s THR 217 CO 0.05 0.05 0.00 0.54 -0.69 0.00 0.00 174.62 174.57 2oqu n ARG 218 N 2.62 -1.23 -3.54 4.92 1.74 -0.36 -4.92 116.66 115.88 2oqu n ARG 218 Ca 0.09 0.70 -0.27 0.00 -0.77 0.00 0.00 57.85 57.60 2oqu n ARG 218 Cb 0.39 -4.80 -0.09 0.00 -1.02 0.00 0.00 32.46 26.93 2oqu n ARG 218 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2oqu n LYS 219 N -1.39 2.10 -1.21 5.56 4.01 -0.19 -4.20 118.16 122.84 2oqu n LYS 219 Ca -0.08 -4.45 -0.33 0.00 -0.51 0.00 0.00 58.31 52.93 2oqu n LYS 219 Cb 0.43 -2.16 0.12 0.00 -0.51 0.00 0.00 35.03 32.90 2oqu n LYS 219 CO 0.00 0.00 0.00 -1.25 -1.11 0.00 0.00 177.40 175.04 2oqu s PRO 220 N -2.00 1.81 0.37 1.97 0.04 -1.26 -4.42 135.00 131.51 2oqu s PRO 220 Ca 0.35 1.71 -0.28 0.00 0.04 0.00 0.00 61.00 62.82 2oqu s PRO 220 Cb 0.09 -1.80 -0.11 0.00 0.04 0.00 0.00 34.50 32.73 2oqu s PRO 220 CO -0.07 -2.08 1.45 0.99 0.04 0.00 0.00 177.00 177.33 2oqu s THR 221 N -2.17 2.17 -0.07 1.26 2.01 -0.46 -4.76 115.64 113.61 2oqu s THR 221 Ca 0.72 0.18 0.02 0.00 0.31 0.00 0.00 61.69 62.92 2oqu s THR 221 Cb -0.28 -3.11 -0.02 0.00 0.01 0.00 0.00 72.50 69.10 2oqu s THR 221 CO 0.49 0.04 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.65 2oqu s VAL 222 N -1.13 3.22 0.03 3.82 1.01 -0.39 -1.01 120.40 125.96 2oqu s VAL 222 Ca 0.53 -0.65 0.05 0.00 0.00 0.00 0.00 61.98 61.91 2oqu s VAL 222 Cb -0.45 -2.30 -0.02 0.00 0.00 0.00 0.00 36.38 33.61 2oqu s VAL 222 CO 0.61 0.57 -0.15 -0.36 0.00 0.00 0.00 175.10 175.77 2oqu s PHE 223 N -0.48 1.35 0.17 5.22 0.08 0.36 -0.53 117.98 124.15 2oqu s PHE 223 Ca 0.06 -0.35 -0.31 0.00 0.12 0.00 0.00 56.93 56.45 2oqu s PHE 223 Cb -0.12 -0.81 -0.10 0.00 -0.57 0.00 0.00 43.02 41.42 2oqu s PHE 223 CO 0.02 0.04 1.56 0.99 -0.10 0.00 0.00 175.22 177.73 2oqu s THR 224 N -0.79 2.61 -0.58 0.64 2.01 0.34 0.06 115.64 119.94 2oqu s THR 224 Ca 0.03 0.45 -0.28 0.00 0.31 0.00 0.00 61.69 62.20 2oqu s THR 224 Cb -0.08 -3.29 0.02 0.00 0.01 0.00 0.00 72.50 69.17 2oqu s THR 224 CO 0.01 0.04 1.29 -0.60 -0.69 0.00 0.00 174.62 174.67 2oqu s ARG 225 N 0.98 3.42 0.28 4.92 3.52 0.26 -1.64 118.95 130.69 2oqu s ARG 225 Ca 0.69 0.32 0.01 0.00 -0.13 0.00 0.00 55.73 56.62 2oqu s ARG 225 Cb -0.44 -4.07 0.57 0.00 -1.56 0.00 0.00 34.95 29.46 2oqu s ARG 225 CO 0.32 -1.80 1.81 0.28 -0.81 0.00 0.00 175.30 175.11 2oqu h VAL 226 N 6.24 0.86 0.00 7.11 2.07 -1.55 -1.66 116.25 129.33 2oqu h VAL 226 Ca -0.26 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 66.95 2oqu h VAL 226 Cb 1.07 -0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 2oqu h VAL 226 CO 1.19 0.16 0.00 -1.54 0.02 0.00 0.00 177.57 177.40 2oqu n SER 227 N -4.68 0.00 0.03 0.57 3.41 -1.26 -0.92 113.62 110.77 2oqu n SER 227 Ca 0.19 0.48 0.13 0.00 -0.26 0.00 0.00 58.87 59.41 2oqu n SER 227 Cb 0.39 -0.49 0.38 0.00 -0.26 0.00 0.00 64.21 64.24 2oqu n SER 227 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2oqu n ALA 228 N -1.49 2.80 -0.01 7.33 0.00 -0.62 -0.69 120.51 127.82 2oqu n ALA 228 Ca 0.03 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.28 2oqu n ALA 228 Cb 0.12 -1.31 0.01 0.00 0.00 0.00 0.00 19.45 18.27 2oqu n ALA 228 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2oqu n TYR 229 N -1.76 0.04 -0.09 0.00 4.02 -0.10 -4.80 117.16 114.48 2oqu n TYR 229 Ca 0.06 -0.49 -0.06 0.00 -0.01 0.00 0.00 57.90 57.39 2oqu n TYR 229 Cb 0.37 -0.05 0.00 0.00 -0.02 0.00 0.00 39.34 39.65 2oqu n TYR 229 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 176.86 176.67 2oqu h ILE 230 N 0.16 0.75 -0.24 -0.72 1.08 -1.74 0.59 117.51 117.39 2oqu h ILE 230 Ca 0.00 -0.03 -0.15 0.00 -0.39 0.00 0.00 64.86 64.29 2oqu h ILE 230 Cb 0.51 0.67 -0.01 0.00 -3.07 0.00 0.00 36.82 34.92 2oqu h ILE 230 CO 0.00 0.01 -0.48 0.77 -0.69 0.00 0.00 178.15 177.76 2oqu h SER 231 N 0.08 0.70 -0.14 1.72 4.64 -1.93 -1.71 113.55 116.92 2oqu h SER 231 Ca 0.15 -0.35 0.05 0.00 -0.47 0.00 0.00 61.79 61.17 2oqu h SER 231 Cb 0.21 -0.20 -0.06 0.00 -0.31 0.00 0.00 62.40 62.05 2oqu h SER 231 CO -0.27 1.07 -0.22 -0.25 -0.87 0.00 0.00 176.83 176.29 2oqu h TRP 232 N 0.51 -0.57 -0.01 4.77 7.01 -1.78 0.61 115.95 126.49 2oqu h TRP 232 Ca 0.03 0.03 0.03 0.00 2.11 0.00 0.00 58.89 61.08 2oqu h TRP 232 Cb 1.03 0.27 -0.04 0.00 -2.10 0.00 0.00 29.16 28.32 2oqu h TRP 232 CO 0.05 -0.30 -0.22 0.82 -2.79 0.00 0.00 178.44 176.00 2oqu h ILE 233 N -0.27 0.49 -0.88 2.65 2.04 -0.78 -0.79 117.51 119.97 2oqu h ILE 233 Ca 0.10 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.96 2oqu h ILE 233 Cb 0.42 0.49 -0.04 0.00 -0.74 0.00 0.00 36.82 36.95 2oqu h ILE 233 CO -0.29 0.00 0.56 0.78 0.00 0.00 0.00 178.15 179.19 2oqu h ASN 234 N -0.34 1.04 -0.39 1.72 -0.26 -1.11 -1.88 115.58 114.36 2oqu h ASN 234 Ca 0.06 -0.05 0.00 0.00 -0.56 0.00 0.00 56.30 55.76 2oqu h ASN 234 Cb 0.42 -0.26 -0.02 0.00 -1.06 0.00 0.00 38.32 37.40 2oqu h ASN 234 CO -0.20 0.78 0.25 0.78 -1.06 0.00 0.00 177.43 177.97 2oqu h ASN 235 N 1.21 0.46 -0.24 5.81 -0.26 -0.53 0.04 115.58 122.06 2oqu h ASN 235 Ca 0.32 -0.03 -0.01 0.00 -0.56 0.00 0.00 56.30 56.03 2oqu h ASN 235 Cb -0.09 -0.11 -0.01 0.00 -1.06 0.00 0.00 38.32 37.04 2oqu h ASN 235 CO -0.06 0.35 0.12 0.58 -1.06 0.00 0.00 177.43 177.36 2oqu h VAL 236 N 0.52 1.12 -0.49 2.81 2.07 -0.89 -2.12 116.25 119.28 2oqu h VAL 236 Ca 0.14 -0.34 -0.13 0.00 0.82 0.00 0.00 66.70 67.20 2oqu h VAL 236 Cb -0.04 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 2oqu h VAL 236 CO -0.03 0.12 -0.19 0.40 0.02 0.00 0.00 177.57 177.90 2oqu h ILE 237 N 0.26 1.27 0.00 4.57 2.04 -1.18 -1.32 117.51 123.15 2oqu h ILE 237 Ca 0.08 -1.35 -0.05 0.00 1.00 0.00 0.00 64.86 64.55 2oqu h ILE 237 Cb 0.08 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.24 2oqu h ILE 237 CO -0.01 0.47 -0.23 0.00 0.00 0.00 0.00 178.15 178.37 2oqu h ALA 238 N 0.92 1.24 0.00 1.87 0.00 -0.90 -3.00 119.26 119.39 2oqu h ALA 238 Ca 0.12 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2oqu h ALA 238 Cb 0.76 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2oqu h ALA 238 CO 0.06 0.29 -0.94 -1.13 0.00 0.00 0.00 179.25 177.53 2oqu n SER 239 N -3.72 0.69 -0.40 0.00 3.41 -0.80 -5.09 113.62 107.71 2oqu n SER 239 Ca -0.01 -0.48 0.05 0.00 -0.26 0.00 0.00 58.87 58.17 2oqu n SER 239 Cb 0.35 0.80 0.04 0.00 -0.26 0.00 0.00 64.21 65.13 2oqu n SER 239 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47