#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s0r s VAL 2 N 0.00 5.33 -0.07 1.39 1.01 0.42 -4.00 120.40 124.48 1s0r s VAL 2 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.14 1s0r s VAL 2 Cb 0.00 -3.42 0.00 0.00 0.00 0.00 0.00 36.38 32.96 1s0r s VAL 2 CO 0.00 0.45 0.00 0.61 0.00 0.00 0.00 175.10 176.16 1s0r n GLY 3 N 3.47 0.47 0.00 4.51 0.00 -1.23 -1.50 105.19 110.91 1s0r n GLY 3 Ca -0.16 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.24 1s0r n GLY 3 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s0r n GLY 4 N -2.82 1.80 3.12 -0.02 0.00 -1.26 -4.85 105.19 101.16 1s0r n GLY 4 Ca -0.01 -1.93 -0.08 0.00 0.00 0.00 0.00 46.02 44.01 1s0r n GLY 4 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1s0r s TYR 5 N 2.41 0.41 -0.08 1.61 1.13 0.01 -4.95 117.35 117.89 1s0r s TYR 5 Ca 0.00 -0.91 -0.30 0.00 -1.41 0.00 0.00 57.07 54.46 1s0r s TYR 5 Cb 0.00 -0.29 -0.05 0.00 -1.10 0.00 0.00 41.96 40.52 1s0r s TYR 5 CO 0.00 -0.42 1.56 0.99 -2.51 0.00 0.00 175.55 175.17 1s0r s THR 6 N -3.79 3.74 0.17 -3.49 2.01 -1.26 -0.65 115.64 112.37 1s0r s THR 6 Ca 0.05 0.91 -0.14 0.00 0.31 0.00 0.00 61.69 62.82 1s0r s THR 6 Cb 0.06 -3.59 0.06 0.00 0.01 0.00 0.00 72.50 69.05 1s0r s THR 6 CO -0.10 -0.08 1.82 0.00 -0.69 0.00 0.00 174.62 175.57 1s0r n GLY 8 N -1.18 2.66 3.70 0.00 0.00 -1.26 -4.84 105.19 104.27 1s0r n GLY 8 Ca 0.03 -1.56 -0.42 0.00 0.00 0.00 0.00 46.02 44.06 1s0r n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s0r s ALA 9 N -1.03 3.80 -1.82 4.61 0.00 -1.26 -2.29 121.76 123.77 1s0r s ALA 9 Ca 0.00 1.46 0.00 0.00 0.00 0.00 0.00 51.96 53.42 1s0r s ALA 9 Cb 0.00 -3.73 0.00 0.00 0.00 0.00 0.00 23.12 19.39 1s0r s ALA 9 CO 0.00 -1.12 0.00 0.09 0.00 0.00 0.00 175.76 174.73 1s0r n ASN 10 N 5.19 -5.35 -0.07 0.00 4.13 -1.26 -4.86 115.26 113.04 1s0r n ASN 10 Ca 0.17 0.24 0.13 0.00 1.68 0.00 0.00 54.58 56.81 1s0r n ASN 10 Cb 0.38 -4.45 0.51 0.00 -1.54 0.00 0.00 39.78 34.67 1s0r n ASN 10 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1s0r n THR 11 N -3.18 0.00 -3.54 3.41 -2.24 -0.97 -4.26 114.28 103.50 1s0r n THR 11 Ca -0.20 -0.04 -0.27 0.00 -2.27 0.00 0.00 64.05 61.27 1s0r n THR 11 Cb 0.64 -0.06 -0.10 0.00 -2.10 0.00 0.00 70.33 68.71 1s0r n THR 11 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1s0r n VAL 12 N -1.19 0.96 0.77 2.28 0.31 -1.26 -4.99 118.33 115.20 1s0r n VAL 12 Ca 0.10 -4.58 0.12 0.00 -0.01 0.00 0.00 64.34 59.97 1s0r n VAL 12 Cb 0.31 -2.02 0.49 0.00 -0.91 0.00 0.00 33.84 31.71 1s0r n VAL 12 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1s0r n PRO 13 N 1.67 0.04 0.00 5.55 -0.04 -1.26 -1.55 135.00 139.40 1s0r n PRO 13 Ca 0.25 0.13 0.12 0.00 -0.04 0.00 0.00 63.50 63.96 1s0r n PRO 13 Cb 0.42 -1.56 0.26 0.00 -0.04 0.00 0.00 33.50 32.59 1s0r n PRO 13 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1s0r n TYR 14 N -1.63 0.00 -2.44 0.54 0.18 -1.12 -2.04 117.16 110.65 1s0r n TYR 14 Ca 0.05 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.41 1s0r n TYR 14 Cb 0.29 -0.20 -0.03 0.00 -0.38 0.00 0.00 39.34 39.02 1s0r n TYR 14 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1s0r s GLN 15 N -2.87 4.41 0.21 -3.48 2.00 -0.60 -1.01 119.66 118.32 1s0r s GLN 15 Ca 0.14 1.73 0.10 0.00 -2.00 0.00 0.00 55.36 55.33 1s0r s GLN 15 Cb 0.18 -3.42 -0.04 0.00 0.80 0.00 0.00 33.01 30.53 1s0r s GLN 15 CO 0.66 -0.30 -0.12 0.14 -0.50 0.00 0.00 175.29 175.17 1s0r s VAL 16 N 1.40 2.97 -0.15 1.34 -7.23 -0.27 -4.47 120.40 113.99 1s0r s VAL 16 Ca 0.58 -1.86 -0.03 0.00 -1.81 0.00 0.00 61.98 58.85 1s0r s VAL 16 Cb -0.28 -2.49 -0.03 0.00 0.56 0.00 0.00 36.38 34.14 1s0r s VAL 16 CO 0.27 -0.19 -0.04 -0.55 -0.31 0.00 0.00 175.10 174.28 1s0r s SER 17 N -3.01 4.77 -0.16 4.85 0.15 -0.50 -2.34 113.70 117.46 1s0r s SER 17 Ca 0.26 -0.13 -0.18 0.00 0.70 0.00 0.00 55.95 56.60 1s0r s SER 17 Cb -0.08 -1.74 -0.04 0.00 -1.71 0.00 0.00 66.02 62.46 1s0r s SER 17 CO 0.15 0.18 0.51 -0.76 1.20 0.00 0.00 173.24 174.52 1s0r s LEU 18 N 0.27 4.21 -0.07 3.45 1.43 0.15 -0.61 118.68 127.50 1s0r s LEU 18 Ca -0.03 0.75 0.03 0.00 -1.03 0.00 0.00 54.13 53.85 1s0r s LEU 18 Cb -0.14 -2.72 0.01 0.00 0.03 0.00 0.00 46.19 43.37 1s0r s LEU 18 CO 0.03 -0.10 -0.16 0.21 0.23 0.00 0.00 176.35 176.56 1s0r s ASN 19 N 0.91 2.22 -0.34 2.29 3.84 -0.07 -1.17 114.94 122.62 1s0r s ASN 19 Ca 0.25 -0.38 0.13 0.00 0.21 0.00 0.00 52.86 53.07 1s0r s ASN 19 Cb -0.15 -0.98 0.46 0.00 -0.55 0.00 0.00 41.25 40.03 1s0r s ASN 19 CO 0.10 0.09 1.09 -1.54 -2.79 0.00 0.00 177.10 174.04 1s0r n SER 20 N 3.65 3.22 0.00 -4.21 3.41 -1.26 -0.82 113.62 117.61 1s0r n SER 20 Ca -0.21 -3.10 0.00 0.00 -0.26 0.00 0.00 58.87 55.30 1s0r n SER 20 Cb 0.52 -0.46 0.00 0.00 -0.26 0.00 0.00 64.21 64.02 1s0r n SER 20 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1s0r n GLY 21 N -0.44 1.09 3.55 5.00 0.00 -1.26 -5.02 105.19 108.11 1s0r n GLY 21 Ca 0.25 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.19 1s0r n GLY 21 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1s0r s TYR 22 N -2.16 -0.30 0.24 1.61 1.13 -1.26 -5.14 117.35 111.46 1s0r s TYR 22 Ca 0.00 0.34 -0.31 0.00 -1.41 0.00 0.00 57.07 55.69 1s0r s TYR 22 Cb 0.00 0.50 -0.11 0.00 -1.10 0.00 0.00 41.96 41.25 1s0r s TYR 22 CO 0.00 -0.38 1.54 -1.58 -2.51 0.00 0.00 175.55 172.62 1s0r s HIS 23 N -2.13 2.95 0.00 -3.49 5.65 -1.26 -4.20 115.29 112.80 1s0r s HIS 23 Ca 0.03 0.80 0.00 0.00 0.25 0.00 0.00 55.06 56.15 1s0r s HIS 23 Cb -0.01 -3.94 0.00 0.00 -1.18 0.00 0.00 32.58 27.45 1s0r s HIS 23 CO -0.04 -3.25 0.00 1.97 -0.65 0.00 0.00 174.74 172.77 1s0r n PHE 24 N 2.83 0.00 -3.49 3.88 -1.74 -0.32 -4.95 117.46 113.66 1s0r n PHE 24 Ca 0.10 0.00 -0.11 0.00 -0.56 0.00 0.00 57.45 56.88 1s0r n PHE 24 Cb 0.39 0.00 -0.03 0.00 1.52 0.00 0.00 39.48 41.36 1s0r n PHE 24 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1s0r n GLY 26 N -0.03 0.55 3.77 0.00 0.00 0.57 -0.68 105.19 109.38 1s0r n GLY 26 Ca -0.12 -2.02 -0.01 0.00 0.00 0.00 0.00 46.02 43.87 1s0r n GLY 26 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1s0r s GLY 27 N -5.10 -0.20 -0.06 -0.02 0.00 -0.99 -3.69 107.32 97.26 1s0r s GLY 27 Ca 0.66 0.19 0.02 0.00 0.00 0.00 0.00 44.72 45.59 1s0r s GLY 27 CO 0.44 1.29 -0.12 -0.56 0.00 0.00 0.00 173.10 174.15 1s0r s SER 28 N -3.17 1.72 -0.13 1.64 0.01 -0.06 -1.12 113.70 112.59 1s0r s SER 28 Ca 0.17 -0.29 -0.29 0.00 1.31 0.00 0.00 55.95 56.85 1s0r s SER 28 Cb 0.00 -0.78 -0.02 0.00 0.21 0.00 0.00 66.02 65.44 1s0r s SER 28 CO 0.01 0.03 1.14 -0.22 0.41 0.00 0.00 173.24 174.61 1s0r s LEU 29 N 0.63 4.21 -0.00 2.44 2.96 -0.18 -0.81 118.68 127.93 1s0r s LEU 29 Ca -0.14 1.64 0.08 0.00 -0.22 0.00 0.00 54.13 55.49 1s0r s LEU 29 Cb -0.15 -3.55 -0.10 0.00 0.50 0.00 0.00 46.19 42.89 1s0r s LEU 29 CO 0.03 -0.61 0.33 2.30 -1.32 0.00 0.00 176.35 177.08 1s0r n ILE 30 N 4.92 0.00 -3.58 6.68 -5.35 -0.35 -0.91 119.36 120.76 1s0r n ILE 30 Ca 0.11 -0.29 -0.04 0.00 -0.27 0.00 0.00 62.75 62.26 1s0r n ILE 30 Cb 0.46 0.90 0.02 0.00 -1.74 0.00 0.00 39.64 39.28 1s0r n ILE 30 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1s0r n ASN 31 N -1.29 -1.32 0.21 7.28 0.23 -1.20 -4.61 115.26 114.57 1s0r n ASN 31 Ca 0.01 -1.84 0.15 0.00 -0.53 0.00 0.00 54.58 52.36 1s0r n ASN 31 Cb 0.14 2.18 0.71 0.00 -2.08 0.00 0.00 39.78 40.73 1s0r n ASN 31 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1s0r h SER 32 N 1.25 0.00 0.00 0.53 4.64 -1.97 -3.14 113.55 114.86 1s0r h SER 32 Ca -0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 1s0r h SER 32 Cb 0.77 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 1s0r h SER 32 CO 0.25 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.21 1s0r n GLN 33 N -2.53 1.46 -4.21 4.77 6.02 -1.26 -0.47 117.38 121.15 1s0r n GLN 33 Ca -0.01 -0.29 -0.17 0.00 -0.01 0.00 0.00 57.00 56.53 1s0r n GLN 33 Cb 0.13 -0.77 -0.14 0.00 1.02 0.00 0.00 30.24 30.47 1s0r n GLN 33 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1s0r s TRP 34 N -0.29 0.56 -0.01 1.08 0.52 -1.19 -0.73 118.94 118.87 1s0r s TRP 34 Ca 0.00 -0.11 0.08 0.00 0.02 0.00 0.00 56.10 56.10 1s0r s TRP 34 Cb 0.00 -0.36 -0.02 0.00 -1.15 0.00 0.00 33.47 31.94 1s0r s TRP 34 CO 0.00 -0.01 -0.26 0.08 0.02 0.00 0.00 176.95 176.78 1s0r s VAL 35 N -0.13 2.04 -0.16 4.03 1.01 0.03 -1.22 120.40 126.01 1s0r s VAL 35 Ca 0.02 -1.13 -0.07 0.00 0.00 0.00 0.00 61.98 60.81 1s0r s VAL 35 Cb -0.03 -1.70 -0.04 0.00 0.00 0.00 0.00 36.38 34.62 1s0r s VAL 35 CO -0.00 0.55 0.07 0.54 0.00 0.00 0.00 175.10 176.26 1s0r s VAL 36 N -0.63 4.84 0.00 2.92 0.11 0.01 -0.59 120.40 127.07 1s0r s VAL 36 Ca 0.10 -0.02 0.00 0.00 -2.93 0.00 0.00 61.98 59.13 1s0r s VAL 36 Cb -0.10 -3.15 0.00 0.00 -1.53 0.00 0.00 36.38 31.60 1s0r s VAL 36 CO -0.01 0.51 0.00 -0.24 -3.33 0.00 0.00 175.10 172.03 1s0r n SER 37 N 3.09 0.00 -4.82 3.54 2.88 -0.16 -0.89 113.62 117.26 1s0r n SER 37 Ca -0.17 -0.95 -0.38 0.00 -1.33 0.00 0.00 58.87 56.04 1s0r n SER 37 Cb 0.53 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.93 1s0r n SER 37 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1s0r s ALA 38 N -1.90 3.60 0.52 -1.46 0.00 -1.26 -1.16 121.76 120.10 1s0r s ALA 38 Ca 0.00 -0.04 0.16 0.00 0.00 0.00 0.00 51.96 52.09 1s0r s ALA 38 Cb 0.00 -2.58 1.27 0.00 0.00 0.00 0.00 23.12 21.81 1s0r s ALA 38 CO 0.00 0.42 2.14 0.00 0.00 0.00 0.00 175.76 178.32 1s0r h ALA 39 N 4.33 2.03 0.00 0.00 0.00 -1.68 -1.14 119.26 122.80 1s0r h ALA 39 Ca -0.50 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1s0r h ALA 39 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1s0r h ALA 39 CO 0.64 -0.04 0.00 -2.39 0.00 0.00 0.00 179.25 177.46 1s0r n HIS 40 N -4.53 0.00 1.69 0.00 1.44 -1.26 -1.24 115.22 111.33 1s0r n HIS 40 Ca -0.02 0.00 0.15 0.00 -2.01 0.00 0.00 57.72 55.84 1s0r n HIS 40 Cb 0.12 -0.39 0.69 0.00 0.12 0.00 0.00 29.99 30.54 1s0r n HIS 40 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1s0r n TYR 42 N -0.30 2.66 -3.48 0.00 9.36 -0.37 -4.99 117.16 120.04 1s0r n TYR 42 Ca 0.21 0.38 -0.10 0.00 3.32 0.00 0.00 57.90 61.72 1s0r n TYR 42 Cb 0.26 -2.53 -0.02 0.00 -0.63 0.00 0.00 39.34 36.42 1s0r n TYR 42 CO 0.00 0.00 0.00 -1.59 0.22 0.00 0.00 176.86 175.49 1s0r s LYS 43 N -1.11 1.04 0.67 2.98 -2.85 -1.26 -5.14 119.74 114.07 1s0r s LYS 43 Ca 0.61 -0.39 -0.11 0.00 -1.00 0.00 0.00 55.97 55.07 1s0r s LYS 43 Cb -0.53 0.47 -0.01 0.00 -2.06 0.00 0.00 37.83 35.70 1s0r s LYS 43 CO 0.55 -0.46 1.06 -1.54 0.10 0.00 0.00 175.35 175.07 1s0r s SER 44 N -2.61 5.73 -0.57 0.03 1.04 -1.26 -4.46 113.70 111.59 1s0r s SER 44 Ca 0.04 1.31 -0.03 0.00 0.48 0.00 0.00 55.95 57.75 1s0r s SER 44 Cb -0.01 -2.23 0.00 0.00 0.10 0.00 0.00 66.02 63.89 1s0r s SER 44 CO -0.10 -1.18 0.33 0.61 0.98 0.00 0.00 173.24 173.88 1s0r n GLY 45 N -2.75 0.28 3.74 7.32 0.00 -1.26 -5.01 105.19 107.52 1s0r n GLY 45 Ca 0.07 -0.38 -0.40 0.00 0.00 0.00 0.00 46.02 45.31 1s0r n GLY 45 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s0r s ILE 46 N -2.92 4.82 -0.19 -0.61 1.01 -1.26 -4.58 121.20 117.47 1s0r s ILE 46 Ca 0.16 1.56 -0.05 0.00 0.00 0.00 0.00 60.65 62.32 1s0r s ILE 46 Cb -0.07 -4.08 -0.03 0.00 0.01 0.00 0.00 42.46 38.29 1s0r s ILE 46 CO 0.20 0.34 0.01 -1.58 0.00 0.00 0.00 174.94 173.91 1s0r s GLN 47 N 0.13 3.72 -0.09 2.79 0.74 0.00 -1.14 119.66 125.81 1s0r s GLN 47 Ca 0.38 -0.48 -0.21 0.00 0.05 0.00 0.00 55.36 55.10 1s0r s GLN 47 Cb -0.20 -3.08 -0.04 0.00 1.10 0.00 0.00 33.01 30.80 1s0r s GLN 47 CO 0.21 0.13 0.61 0.08 -0.55 0.00 0.00 175.29 175.77 1s0r s VAL 48 N 0.70 5.11 -0.29 1.34 1.01 0.16 -0.89 120.40 127.54 1s0r s VAL 48 Ca 0.00 1.24 -0.01 0.00 0.00 0.00 0.00 61.98 63.22 1s0r s VAL 48 Cb -0.14 -3.95 0.05 0.00 0.00 0.00 0.00 36.38 32.34 1s0r s VAL 48 CO 0.02 0.28 -0.03 -0.13 0.00 0.00 0.00 175.10 175.24 1s0r s ARG 49 N 0.74 2.42 0.21 2.72 0.52 0.22 -0.95 118.95 124.83 1s0r s ARG 49 Ca 0.33 -1.26 0.03 0.00 -0.52 0.00 0.00 55.73 54.31 1s0r s ARG 49 Cb -0.17 -3.10 -0.03 0.00 0.52 0.00 0.00 34.95 32.17 1s0r s ARG 49 CO 0.15 -0.59 0.35 -0.51 0.02 0.00 0.00 175.30 174.72 1s0r s LEU 50 N 1.22 4.29 -0.83 2.53 1.43 0.10 -1.41 118.68 126.01 1s0r s LEU 50 Ca -0.06 0.18 0.00 0.00 -1.03 0.00 0.00 54.13 53.22 1s0r s LEU 50 Cb -0.20 -2.95 0.00 0.00 0.03 0.00 0.00 46.19 43.07 1s0r s LEU 50 CO -0.02 -0.04 0.00 0.61 0.23 0.00 0.00 176.35 177.12 1s0r n GLY 51 N -1.05 0.98 3.81 -3.19 0.00 -1.26 -1.17 105.19 103.31 1s0r n GLY 51 Ca -0.07 -0.61 -0.36 0.00 0.00 0.00 0.00 46.02 44.97 1s0r n GLY 51 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1s0r s GLU 52 N -2.58 4.26 0.00 1.61 0.41 -1.26 -3.71 118.70 117.42 1s0r s GLU 52 Ca 0.00 0.86 0.00 0.00 -0.41 0.00 0.00 54.97 55.42 1s0r s GLU 52 Cb 0.00 -2.93 0.00 0.00 -1.78 0.00 0.00 34.13 29.42 1s0r s GLU 52 CO 0.00 0.43 0.00 -3.47 -0.49 0.00 0.00 175.26 171.73 1s0r n ASP 53 N 0.85 0.00 -4.62 -0.19 2.03 -1.26 -4.56 116.55 108.80 1s0r n ASP 53 Ca -0.03 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.85 1s0r n ASP 53 Cb 0.51 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.89 1s0r n ASP 53 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1s0r s ASN 54 N 1.00 6.44 0.00 1.67 3.84 -1.25 -3.57 114.94 123.06 1s0r s ASN 54 Ca 0.00 1.20 0.23 0.00 0.21 0.00 0.00 52.86 54.50 1s0r s ASN 54 Cb 0.00 -2.54 1.19 0.00 -0.55 0.00 0.00 41.25 39.36 1s0r s ASN 54 CO 0.00 -1.28 1.77 2.30 -2.79 0.00 0.00 177.10 177.10 1s0r n ILE 55 N 6.62 0.25 0.49 -5.21 -5.35 -0.35 -2.89 119.36 112.92 1s0r n ILE 55 Ca 0.17 0.06 0.08 0.00 -0.27 0.00 0.00 62.75 62.79 1s0r n ILE 55 Cb 0.47 -0.68 0.09 0.00 -1.74 0.00 0.00 39.64 37.77 1s0r n ILE 55 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1s0r n ASN 56 N -1.26 2.41 -3.91 7.28 3.02 -1.26 -4.97 115.26 116.56 1s0r n ASN 56 Ca 0.12 -1.68 -0.18 0.00 -0.03 0.00 0.00 54.58 52.80 1s0r n ASN 56 Cb 0.18 -0.05 -0.15 0.00 -0.61 0.00 0.00 39.78 39.14 1s0r n ASN 56 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1s0r s VAL 57 N -1.21 0.43 -0.41 2.41 1.01 -1.14 -5.10 120.40 116.38 1s0r s VAL 57 Ca 0.20 -0.14 -0.27 0.00 0.00 0.00 0.00 61.98 61.77 1s0r s VAL 57 Cb 0.13 -0.42 0.02 0.00 0.00 0.00 0.00 36.38 36.11 1s0r s VAL 57 CO 0.19 0.16 1.00 -0.69 0.00 0.00 0.00 175.10 175.77 1s0r s VAL 58 N 0.44 4.45 -0.42 2.92 1.01 -1.26 -4.69 120.40 122.84 1s0r s VAL 58 Ca -0.05 1.19 0.15 0.00 0.00 0.00 0.00 61.98 63.26 1s0r s VAL 58 Cb -0.09 -4.44 -0.19 0.00 0.00 0.00 0.00 36.38 31.67 1s0r s VAL 58 CO -0.00 -0.72 0.51 -0.62 0.00 0.00 0.00 175.10 174.27 1s0r n GLU 59 N 7.15 1.48 0.00 2.72 1.02 -1.26 -5.02 120.64 126.72 1s0r n GLU 59 Ca 0.09 -0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 1s0r n GLU 59 Cb 0.48 -1.26 0.00 0.00 -0.02 0.00 0.00 31.44 30.64 1s0r n GLU 59 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1s0r n GLY 60 N 1.46 1.27 0.20 0.62 0.00 -1.26 -4.98 105.19 102.51 1s0r n GLY 60 Ca 0.01 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 1s0r n GLY 60 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1s0r n ASN 61 N 0.00 2.09 -4.78 1.61 3.02 -1.26 -5.05 115.26 110.88 1s0r n ASN 61 Ca 0.00 -1.81 -0.35 0.00 -0.03 0.00 0.00 54.58 52.39 1s0r n ASN 61 Cb 0.00 -0.06 -0.01 0.00 -0.61 0.00 0.00 39.78 39.10 1s0r n ASN 61 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1s0r s GLU 62 N -0.84 3.59 -0.11 3.52 8.01 -1.24 -4.30 118.70 127.32 1s0r s GLU 62 Ca 0.07 1.57 -0.00 0.00 0.01 0.00 0.00 54.97 56.62 1s0r s GLU 62 Cb 0.04 -2.13 0.02 0.00 -4.31 0.00 0.00 34.13 27.75 1s0r s GLU 62 CO 0.05 -0.64 -0.08 -0.65 0.01 0.00 0.00 175.26 173.94 1s0r s GLN 63 N -3.12 1.55 -0.26 1.61 -0.21 -0.32 -4.96 119.66 113.96 1s0r s GLN 63 Ca 0.69 -0.28 -0.08 0.00 0.02 0.00 0.00 55.36 55.71 1s0r s GLN 63 Cb -0.23 -1.57 -0.03 0.00 1.00 0.00 0.00 33.01 32.19 1s0r s GLN 63 CO 0.26 -0.23 0.09 -0.06 -2.12 0.00 0.00 175.29 173.24 1s0r s PHE 64 N 1.56 3.11 -0.04 0.91 0.08 -1.26 -0.72 117.98 121.62 1s0r s PHE 64 Ca 0.02 -0.42 -0.00 0.00 0.12 0.00 0.00 56.93 56.65 1s0r s PHE 64 Cb -0.13 -2.26 0.03 0.00 -0.57 0.00 0.00 43.02 40.08 1s0r s PHE 64 CO -0.07 -0.36 0.00 0.42 -0.10 0.00 0.00 175.22 175.11 1s0r s ILE 65 N 1.62 0.23 0.49 0.64 1.01 -0.13 -4.99 121.20 120.09 1s0r s ILE 65 Ca 0.06 0.12 -0.21 0.00 0.00 0.00 0.00 60.65 60.62 1s0r s ILE 65 Cb -0.15 -0.36 -0.07 0.00 0.01 0.00 0.00 42.46 41.88 1s0r s ILE 65 CO 0.04 0.19 1.12 -0.44 0.00 0.00 0.00 174.94 175.86 1s0r s SER 66 N 1.43 6.07 0.28 3.58 0.01 -1.26 -0.66 113.70 123.14 1s0r s SER 66 Ca -0.04 2.17 -0.29 0.00 1.31 0.00 0.00 55.95 59.10 1s0r s SER 66 Cb -0.13 -2.59 -0.09 0.00 0.21 0.00 0.00 66.02 63.42 1s0r s SER 66 CO -0.03 -0.98 1.16 0.00 0.41 0.00 0.00 173.24 173.81 1s0r s ALA 67 N -1.71 3.43 -0.12 1.44 0.00 -0.29 -0.90 121.76 123.61 1s0r s ALA 67 Ca 0.67 0.99 0.17 0.00 0.00 0.00 0.00 51.96 53.79 1s0r s ALA 67 Cb -0.24 -3.37 -0.21 0.00 0.00 0.00 0.00 23.12 19.29 1s0r s ALA 67 CO 0.29 -0.30 0.52 -1.13 0.00 0.00 0.00 175.76 175.14 1s0r n SER 68 N 1.33 0.49 -3.65 0.00 3.41 0.36 -4.74 113.62 110.81 1s0r n SER 68 Ca 0.00 0.22 -0.14 0.00 -0.26 0.00 0.00 58.87 58.69 1s0r n SER 68 Cb 0.44 0.61 -0.08 0.00 -0.26 0.00 0.00 64.21 64.93 1s0r n SER 68 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1s0r s LYS 69 N -2.81 0.77 0.03 4.33 2.20 -1.23 -5.01 119.74 118.02 1s0r s LYS 69 Ca -0.06 0.75 0.08 0.00 -0.36 0.00 0.00 55.97 56.38 1s0r s LYS 69 Cb 0.08 0.37 -0.02 0.00 -1.51 0.00 0.00 37.83 36.75 1s0r s LYS 69 CO 0.83 -0.12 -0.23 -1.12 -0.36 0.00 0.00 175.35 174.35 1s0r s SER 70 N 0.08 2.78 -0.27 1.43 0.01 -1.26 -0.78 113.70 115.69 1s0r s SER 70 Ca -0.02 -0.52 -0.01 0.00 1.31 0.00 0.00 55.95 56.71 1s0r s SER 70 Cb -0.04 -0.26 0.09 0.00 0.21 0.00 0.00 66.02 66.02 1s0r s SER 70 CO 0.02 0.23 0.06 -0.63 0.41 0.00 0.00 173.24 173.33 1s0r s ILE 71 N -0.74 0.88 0.36 1.44 1.01 0.52 -5.00 121.20 119.67 1s0r s ILE 71 Ca 0.09 -1.18 -0.26 0.00 0.00 0.00 0.00 60.65 59.31 1s0r s ILE 71 Cb -0.09 -1.53 -0.09 0.00 0.01 0.00 0.00 42.46 40.75 1s0r s ILE 71 CO 0.01 -0.49 1.09 -0.69 0.00 0.00 0.00 174.94 174.86 1s0r s VAL 72 N 1.64 3.55 0.30 2.92 1.01 -1.26 -0.98 120.40 127.58 1s0r s VAL 72 Ca 0.05 1.32 -0.29 0.00 0.00 0.00 0.00 61.98 63.06 1s0r s VAL 72 Cb -0.17 -3.75 -0.13 0.00 0.00 0.00 0.00 36.38 32.33 1s0r s VAL 72 CO -0.18 0.14 1.19 1.57 0.00 0.00 0.00 175.10 177.81 1s0r n HIS 73 N 0.36 1.80 -0.03 5.22 -0.00 -0.57 -4.83 115.22 117.17 1s0r n HIS 73 Ca 0.03 0.60 0.16 0.00 0.46 0.00 0.00 57.72 58.97 1s0r n HIS 73 Cb 0.47 -2.35 0.60 0.00 -0.12 0.00 0.00 29.99 28.60 1s0r n HIS 73 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1s0r h PRO 74 N 2.62 0.18 -0.53 1.57 0.13 -1.93 -2.10 132.00 131.93 1s0r h PRO 74 Ca -0.43 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1s0r h PRO 74 Cb 1.31 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1s0r h PRO 74 CO 0.64 0.12 0.00 0.43 -0.23 0.00 0.00 178.00 178.96 1s0r n SER 75 N -4.43 3.94 -4.74 1.44 7.64 -1.26 -5.00 113.62 111.20 1s0r n SER 75 Ca 0.09 -2.29 -0.42 0.00 1.01 0.00 0.00 58.87 57.27 1s0r n SER 75 Cb 0.48 -0.45 -0.02 0.00 -1.01 0.00 0.00 64.21 63.21 1s0r n SER 75 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1s0r s TYR 76 N -1.53 2.80 -0.24 1.43 5.04 -0.79 -4.68 117.35 119.38 1s0r s TYR 76 Ca 0.41 0.59 0.02 0.00 -2.44 0.00 0.00 57.07 55.65 1s0r s TYR 76 Cb 0.25 -4.11 0.05 0.00 0.35 0.00 0.00 41.96 38.50 1s0r s TYR 76 CO 0.22 -3.94 -0.12 1.21 -1.34 0.00 0.00 175.55 171.58 1s0r s ASN 77 N 0.78 4.18 0.23 4.32 3.84 -0.74 -5.01 114.94 122.54 1s0r s ASN 77 Ca 0.68 -1.21 0.25 0.00 0.21 0.00 0.00 52.86 52.79 1s0r s ASN 77 Cb -0.49 -1.55 0.91 0.00 -0.55 0.00 0.00 41.25 39.57 1s0r s ASN 77 CO 0.42 -0.15 1.74 -1.54 -2.79 0.00 0.00 177.10 174.78 1s0r n SER 78 N 4.49 0.70 0.05 -4.21 3.41 -1.26 -0.14 113.62 116.66 1s0r n SER 78 Ca -0.16 0.62 -0.20 0.00 -0.26 0.00 0.00 58.87 58.87 1s0r n SER 78 Cb 0.44 -0.79 -0.13 0.00 -0.26 0.00 0.00 64.21 63.47 1s0r n SER 78 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1s0r h ASN 79 N 0.00 0.64 0.27 4.04 2.35 -1.97 -3.36 115.58 117.55 1s0r h ASN 79 Ca 0.00 -0.84 0.00 0.00 -0.55 0.00 0.00 56.30 54.91 1s0r h ASN 79 Cb 0.53 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.70 1s0r h ASN 79 CO 0.00 1.41 -1.28 0.35 -1.65 0.00 0.00 177.43 176.26 1s0r n THR 80 N -4.04 0.12 -1.55 2.81 -2.24 -1.18 -4.97 114.28 103.24 1s0r n THR 80 Ca -0.13 -0.29 -0.16 0.00 -2.27 0.00 0.00 64.05 61.20 1s0r n THR 80 Cb 0.83 0.26 -0.07 0.00 -2.10 0.00 0.00 70.33 69.26 1s0r n THR 80 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1s0r n LEU 81 N -2.00 -1.25 -4.74 3.22 4.77 0.80 -4.99 117.00 112.81 1s0r n LEU 81 Ca 0.01 0.37 -0.41 0.00 -0.03 0.00 0.00 56.01 55.95 1s0r n LEU 81 Cb 0.46 -2.37 -0.03 0.00 -2.33 0.00 0.00 43.42 39.15 1s0r n LEU 81 CO 0.42 -0.81 1.04 0.21 -1.33 0.00 0.00 177.39 176.93 1s0r s ASN 82 N -2.78 6.78 -1.03 -1.43 2.47 -1.20 -2.92 114.94 114.83 1s0r s ASN 82 Ca 0.00 2.55 -0.01 0.00 0.42 0.00 0.00 52.86 55.81 1s0r s ASN 82 Cb 0.00 -2.62 0.00 0.00 -1.45 0.00 0.00 41.25 37.18 1s0r s ASN 82 CO 0.00 -0.61 0.87 0.59 -3.72 0.00 0.00 177.10 174.23 1s0r n ASN 83 N 2.34 -2.71 -4.21 -4.21 3.02 -1.26 -1.80 115.26 106.43 1s0r n ASN 83 Ca 0.06 -0.51 -0.43 0.00 -0.03 0.00 0.00 54.58 53.67 1s0r n ASN 83 Cb 0.41 -4.37 0.00 0.00 -0.61 0.00 0.00 39.78 35.21 1s0r n ASN 83 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1s0r n ASP 84 N -2.70 4.69 -3.75 6.41 2.03 -1.15 -4.26 116.55 117.81 1s0r n ASP 84 Ca -0.20 -2.93 -0.13 0.00 0.52 0.00 0.00 54.79 52.05 1s0r n ASP 84 Cb 0.63 -1.66 -0.10 0.00 -0.72 0.00 0.00 41.12 39.27 1s0r n ASP 84 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1s0r s ILE 85 N 2.96 0.02 -0.00 5.18 2.07 -1.26 -3.81 121.20 126.36 1s0r s ILE 85 Ca 0.48 -0.19 -0.12 0.00 -1.41 0.00 0.00 60.65 59.41 1s0r s ILE 85 Cb 0.07 -0.54 0.02 0.00 0.13 0.00 0.00 42.46 42.13 1s0r s ILE 85 CO 0.01 -0.11 0.25 0.00 -1.91 0.00 0.00 174.94 173.18 1s0r s MET 86 N -0.44 0.61 -0.07 3.50 0.23 -0.31 -1.51 119.30 121.31 1s0r s MET 86 Ca -0.06 -0.28 0.01 0.00 -1.03 0.00 0.00 55.69 54.33 1s0r s MET 86 Cb -0.04 0.27 -0.03 0.00 -1.53 0.00 0.00 34.83 33.50 1s0r s MET 86 CO 0.02 -0.16 -0.06 -0.51 -2.03 0.00 0.00 175.02 172.28 1s0r s LEU 87 N -1.39 3.21 -0.12 0.18 1.43 -0.15 -0.99 118.68 120.85 1s0r s LEU 87 Ca -0.14 -0.01 0.01 0.00 -1.03 0.00 0.00 54.13 52.97 1s0r s LEU 87 Cb -0.06 -1.71 0.02 0.00 0.03 0.00 0.00 46.19 44.47 1s0r s LEU 87 CO 0.03 0.36 -0.15 -0.63 0.23 0.00 0.00 176.35 176.19 1s0r s ILE 88 N -0.83 1.52 -0.09 -0.59 1.01 0.25 -0.36 121.20 122.11 1s0r s ILE 88 Ca 0.13 -0.64 -0.12 0.00 0.00 0.00 0.00 60.65 60.02 1s0r s ILE 88 Cb -0.11 -1.40 -0.05 0.00 0.01 0.00 0.00 42.46 40.91 1s0r s ILE 88 CO 0.02 0.45 0.29 -0.75 0.00 0.00 0.00 174.94 174.95 1s0r s LYS 89 N 1.15 3.90 0.21 2.79 2.20 0.04 -0.79 119.74 129.24 1s0r s LYS 89 Ca -0.03 0.15 -0.23 0.00 -0.36 0.00 0.00 55.97 55.50 1s0r s LYS 89 Cb -0.14 -3.28 -0.08 0.00 -1.51 0.00 0.00 37.83 32.81 1s0r s LYS 89 CO -0.04 0.56 0.78 -0.51 -0.36 0.00 0.00 175.35 175.77 1s0r s LEU 90 N -0.52 4.46 0.48 5.43 1.43 0.09 -0.49 118.68 129.56 1s0r s LEU 90 Ca 0.19 1.58 0.16 0.00 -1.03 0.00 0.00 54.13 55.02 1s0r s LEU 90 Cb -0.14 -3.50 1.12 0.00 0.03 0.00 0.00 46.19 43.69 1s0r s LEU 90 CO 0.07 0.10 2.05 0.11 0.23 0.00 0.00 176.35 178.92 1s0r h LYS 91 N 3.81 0.00 -4.28 1.70 1.57 -1.31 -3.43 116.57 114.62 1s0r h LYS 91 Ca -0.47 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.14 1s0r h LYS 91 Cb 1.20 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 33.34 1s0r h LYS 91 CO 0.65 0.12 -0.69 -1.54 -0.57 0.00 0.00 179.45 177.42 1s0r s SER 92 N -6.98 0.58 0.19 0.86 1.04 -1.26 -5.01 113.70 103.13 1s0r s SER 92 Ca -0.04 -0.86 -0.30 0.00 0.48 0.00 0.00 55.95 55.23 1s0r s SER 92 Cb 0.16 0.15 -0.08 0.00 0.10 0.00 0.00 66.02 66.35 1s0r s SER 92 CO 0.68 -0.48 1.19 0.00 0.98 0.00 0.00 173.24 175.61 1s0r s ALA 93 N -3.12 3.43 0.55 5.32 0.00 -1.26 -4.85 121.76 121.83 1s0r s ALA 93 Ca 0.01 0.95 -0.21 0.00 0.00 0.00 0.00 51.96 52.71 1s0r s ALA 93 Cb 0.02 -3.41 -0.05 0.00 0.00 0.00 0.00 23.12 19.69 1s0r s ALA 93 CO -0.06 -0.36 1.25 0.00 0.00 0.00 0.00 175.76 176.60 1s0r s ALA 94 N -0.15 2.71 -0.32 0.00 0.00 0.38 -5.00 121.76 119.38 1s0r s ALA 94 Ca 0.52 1.12 -0.24 0.00 0.00 0.00 0.00 51.96 53.36 1s0r s ALA 94 Cb -0.32 -3.48 0.01 0.00 0.00 0.00 0.00 23.12 19.32 1s0r s ALA 94 CO 0.37 -1.16 0.82 0.45 0.00 0.00 0.00 175.76 176.24 1s0r s SER 95 N -1.32 6.66 -0.11 0.00 0.15 -1.26 -4.84 113.70 112.98 1s0r s SER 95 Ca 0.73 0.63 -0.13 0.00 0.70 0.00 0.00 55.95 57.88 1s0r s SER 95 Cb -0.34 -2.42 -0.05 0.00 -1.71 0.00 0.00 66.02 61.50 1s0r s SER 95 CO 0.39 -0.68 0.29 -0.76 1.20 0.00 0.00 173.24 173.68 1s0r s LEU 96 N 3.09 4.34 0.00 3.45 1.43 -1.26 -4.79 118.68 124.94 1s0r s LEU 96 Ca 0.34 0.63 -0.10 0.00 -1.03 0.00 0.00 54.13 53.97 1s0r s LEU 96 Cb -0.14 -2.37 0.04 0.00 0.03 0.00 0.00 46.19 43.75 1s0r s LEU 96 CO 0.14 0.22 0.52 -0.46 0.23 0.00 0.00 176.35 177.01 1s0r n ASN 97 N 2.76 -1.51 0.25 2.29 6.94 -0.43 -5.01 115.26 120.55 1s0r n ASN 97 Ca -0.14 -2.06 0.13 0.00 -0.02 0.00 0.00 54.58 52.49 1s0r n ASN 97 Cb 0.53 2.52 0.61 0.00 -2.36 0.00 0.00 39.78 41.08 1s0r n ASN 97 CO 0.00 0.00 0.00 0.77 -1.03 0.00 0.00 177.26 177.00 1s0r h SER 98 N 1.31 0.00 0.31 0.53 4.64 -1.99 -3.02 113.55 115.32 1s0r h SER 98 Ca -0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 1s0r h SER 98 Cb 0.82 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 1s0r h SER 98 CO 0.28 0.14 -1.29 0.54 -0.87 0.00 0.00 176.83 175.63 1s0r n ARG 99 N -3.38 0.38 -3.88 4.77 1.74 -1.26 -4.72 116.66 110.31 1s0r n ARG 99 Ca -0.00 -0.05 -0.29 0.00 -0.77 0.00 0.00 57.85 56.74 1s0r n ARG 99 Cb 0.34 -1.58 -0.16 0.00 -1.02 0.00 0.00 32.46 30.03 1s0r n ARG 99 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1s0r s VAL 100 N -3.28 1.17 -0.02 1.55 1.01 -1.14 -4.51 120.40 115.19 1s0r s VAL 100 Ca 0.01 -0.83 -0.16 0.00 0.00 0.00 0.00 61.98 61.00 1s0r s VAL 100 Cb 0.14 -1.43 0.03 0.00 0.00 0.00 0.00 36.38 35.12 1s0r s VAL 100 CO 0.84 -0.00 0.34 0.00 0.00 0.00 0.00 175.10 176.28 1s0r s ALA 101 N 1.58 -0.86 0.66 5.51 0.00 -0.87 -1.32 121.76 126.47 1s0r s ALA 101 Ca -0.02 0.42 -0.11 0.00 0.00 0.00 0.00 51.96 52.25 1s0r s ALA 101 Cb -0.17 0.05 -0.02 0.00 0.00 0.00 0.00 23.12 22.98 1s0r s ALA 101 CO -0.07 -0.26 1.05 -1.54 0.00 0.00 0.00 175.76 174.93 1s0r s SER 102 N -1.26 5.79 -0.08 0.00 1.04 -1.26 -2.79 113.70 115.13 1s0r s SER 102 Ca -0.13 1.53 0.01 0.00 0.48 0.00 0.00 55.95 57.84 1s0r s SER 102 Cb -0.05 -2.48 -0.03 0.00 0.10 0.00 0.00 66.02 63.56 1s0r s SER 102 CO 0.05 -1.17 -0.09 -0.51 0.98 0.00 0.00 173.24 172.49 1s0r s ILE 103 N -3.10 3.46 0.47 -1.02 1.10 -0.09 -4.85 121.20 117.17 1s0r s ILE 103 Ca 0.57 -0.56 -0.23 0.00 -0.51 0.00 0.00 60.65 59.92 1s0r s ILE 103 Cb -0.13 -2.42 -0.07 0.00 0.15 0.00 0.00 42.46 40.00 1s0r s ILE 103 CO 0.54 0.58 1.20 -0.44 -2.11 0.00 0.00 174.94 174.71 1s0r s SER 104 N -0.52 6.06 0.52 4.50 0.01 -1.25 -4.58 113.70 118.45 1s0r s SER 104 Ca 0.07 2.38 -0.17 0.00 1.31 0.00 0.00 55.95 59.54 1s0r s SER 104 Cb -0.12 -2.61 -0.07 0.00 0.21 0.00 0.00 66.02 63.43 1s0r s SER 104 CO 0.02 -0.99 1.00 -0.76 0.41 0.00 0.00 173.24 172.91 1s0r s LEU 105 N -3.05 3.65 0.53 2.44 1.43 -1.26 -1.05 118.68 121.37 1s0r s LEU 105 Ca 0.64 1.66 -0.19 0.00 -1.03 0.00 0.00 54.13 55.21 1s0r s LEU 105 Cb -0.31 -4.52 -0.06 0.00 0.03 0.00 0.00 46.19 41.33 1s0r s LEU 105 CO 0.37 -0.69 1.09 -2.16 0.23 0.00 0.00 176.35 175.18 1s0r s PRO 106 N -3.91 3.50 -0.02 1.29 0.04 -1.26 -4.78 135.00 129.86 1s0r s PRO 106 Ca 0.61 1.47 0.18 0.00 0.04 0.00 0.00 61.00 63.30 1s0r s PRO 106 Cb -0.11 -2.04 -0.26 0.00 0.04 0.00 0.00 34.50 32.13 1s0r s PRO 106 CO 0.30 -0.70 0.52 0.25 0.04 0.00 0.00 177.00 177.41 1s0r n THR 107 N -1.28 0.00 -3.94 1.26 -2.24 -1.26 -4.96 114.28 101.86 1s0r n THR 107 Ca 0.10 -0.31 -0.10 0.00 -2.27 0.00 0.00 64.05 61.47 1s0r n THR 107 Cb 0.52 0.38 -0.12 0.00 -2.10 0.00 0.00 70.33 69.01 1s0r n THR 107 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1s0r s SER 108 N -3.66 0.16 0.65 3.42 0.01 -1.26 -5.15 113.70 107.86 1s0r s SER 108 Ca -0.02 -0.33 -0.16 0.00 1.31 0.00 0.00 55.95 56.75 1s0r s SER 108 Cb 0.12 0.08 -0.00 0.00 0.21 0.00 0.00 66.02 66.43 1s0r s SER 108 CO 0.76 -0.21 1.13 0.00 0.41 0.00 0.00 173.24 175.33 1s0r s ALA 110 N -2.16 3.53 0.14 0.00 0.00 -1.26 -5.10 121.76 116.91 1s0r s ALA 110 Ca 0.69 -0.31 0.02 0.00 0.00 0.00 0.00 51.96 52.36 1s0r s ALA 110 Cb -0.23 -2.46 -0.04 0.00 0.00 0.00 0.00 23.12 20.39 1s0r s ALA 110 CO 0.39 0.35 0.28 -1.12 0.00 0.00 0.00 175.76 175.67 1s0r s SER 111 N -2.68 6.34 0.24 0.00 0.01 -1.26 -5.04 113.70 111.31 1s0r s SER 111 Ca 0.48 0.19 -0.30 0.00 1.31 0.00 0.00 55.95 57.62 1s0r s SER 111 Cb -0.11 -1.92 -0.15 0.00 0.21 0.00 0.00 66.02 64.06 1s0r s SER 111 CO 0.25 0.06 1.13 0.00 0.41 0.00 0.00 173.24 175.09 1s0r n ALA 112 N -0.48 -0.20 0.00 1.44 0.00 -1.26 -1.61 120.51 118.40 1s0r n ALA 112 Ca -0.07 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.79 1s0r n ALA 112 Cb 0.54 -2.07 0.00 0.00 0.00 0.00 0.00 19.45 17.92 1s0r n ALA 112 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s0r n GLY 113 N 1.66 2.49 3.72 0.00 0.00 0.35 -4.97 105.19 108.45 1s0r n GLY 113 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1s0r n GLY 113 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1s0r n THR 114 N -2.00 0.49 -3.04 2.61 -1.04 -0.63 -4.68 114.28 105.99 1s0r n THR 114 Ca 0.00 -0.12 -0.40 0.00 -2.04 0.00 0.00 64.05 61.49 1s0r n THR 114 Cb 0.00 -1.91 -0.05 0.00 -1.82 0.00 0.00 70.33 66.55 1s0r n THR 114 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 1s0r s GLN 115 N 0.35 4.46 0.20 -2.82 -1.52 -1.26 -1.25 119.66 117.81 1s0r s GLN 115 Ca 0.70 1.00 0.02 0.00 -1.95 0.00 0.00 55.36 55.13 1s0r s GLN 115 Cb -0.53 -3.33 -0.05 0.00 -0.22 0.00 0.00 33.01 28.88 1s0r s GLN 115 CO 0.41 0.37 0.03 0.00 -0.25 0.00 0.00 175.29 175.84 1s0r s LEU 117 N -3.22 2.55 -0.07 0.00 2.96 0.65 -1.20 118.68 120.36 1s0r s LEU 117 Ca 0.28 -0.48 0.02 0.00 -0.22 0.00 0.00 54.13 53.73 1s0r s LEU 117 Cb 0.06 -1.61 -0.03 0.00 0.50 0.00 0.00 46.19 45.12 1s0r s LEU 117 CO 0.07 0.03 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.38 1s0r s ILE 118 N 1.17 3.30 0.06 6.68 1.01 0.10 -1.25 121.20 132.27 1s0r s ILE 118 Ca 0.01 -0.62 -0.08 0.00 0.00 0.00 0.00 60.65 59.96 1s0r s ILE 118 Cb -0.14 -2.33 -0.00 0.00 0.01 0.00 0.00 42.46 39.99 1s0r s ILE 118 CO -0.05 0.58 0.18 -0.94 0.00 0.00 0.00 174.94 174.71 1s0r s SER 119 N -0.52 0.10 0.00 3.58 1.04 -1.20 -0.67 113.70 116.03 1s0r s SER 119 Ca 0.07 -0.54 0.00 0.00 0.48 0.00 0.00 55.95 55.96 1s0r s SER 119 Cb -0.12 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.31 1s0r s SER 119 CO 0.02 -0.64 0.00 0.61 0.98 0.00 0.00 173.24 174.21 1s0r n GLY 120 N 0.32 -0.61 1.24 7.32 0.00 -0.38 -4.37 105.19 108.71 1s0r n GLY 120 Ca -0.17 -1.20 0.06 0.00 0.00 0.00 0.00 46.02 44.71 1s0r n GLY 120 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1s0r n TRP 121 N -0.69 1.35 -1.45 1.61 8.01 -1.26 -1.85 117.44 123.15 1s0r n TRP 121 Ca 0.00 -0.95 -0.30 0.00 -1.31 0.00 0.00 57.50 54.94 1s0r n TRP 121 Cb 0.00 -0.41 0.21 0.00 -2.01 0.00 0.00 31.31 29.09 1s0r n TRP 121 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1s0r s GLY 122 N -1.67 1.65 0.30 6.99 0.00 -1.25 -4.37 107.32 108.98 1s0r s GLY 122 Ca 0.46 -0.98 -0.29 0.00 0.00 0.00 0.00 44.72 43.92 1s0r s GLY 122 CO 0.10 -0.18 1.20 -2.01 0.00 0.00 0.00 173.10 172.20 1s0r n ASN 123 N -4.26 2.16 -0.88 1.64 5.15 -0.14 -2.92 115.26 116.01 1s0r n ASN 123 Ca 0.13 1.19 0.11 0.00 -0.60 0.00 0.00 54.58 55.40 1s0r n ASN 123 Cb 0.59 -1.39 0.10 0.00 -0.53 0.00 0.00 39.78 38.55 1s0r n ASN 123 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1s0r n THR 124 N 0.54 0.03 -4.22 -0.44 -2.24 -0.04 -0.99 114.28 106.92 1s0r n THR 124 Ca 0.08 -0.52 -0.29 0.00 -2.27 0.00 0.00 64.05 61.05 1s0r n THR 124 Cb 0.33 1.42 -0.09 0.00 -2.10 0.00 0.00 70.33 69.89 1s0r n THR 124 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1s0r s LYS 125 N -1.79 2.19 0.00 -0.78 -0.14 -1.26 -4.40 119.74 113.56 1s0r s LYS 125 Ca 0.26 -1.03 0.00 0.00 -1.36 0.00 0.00 55.97 53.84 1s0r s LYS 125 Cb 0.18 -2.32 0.00 0.00 -1.68 0.00 0.00 37.83 34.01 1s0r s LYS 125 CO 0.27 0.50 0.70 0.43 -0.76 0.00 0.00 175.35 176.49 1s0r n SER 126 N 0.57 0.00 -2.69 2.83 7.64 -1.26 -4.73 113.62 115.98 1s0r n SER 126 Ca -0.13 0.70 -0.05 0.00 1.01 0.00 0.00 58.87 60.40 1s0r n SER 126 Cb 0.53 -0.20 0.08 0.00 -1.01 0.00 0.00 64.21 63.61 1s0r n SER 126 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1s0r n SER 127 N -1.38 -1.71 -2.03 6.43 3.41 -1.26 -4.49 113.62 112.60 1s0r n SER 127 Ca 0.00 -2.32 0.00 0.00 -0.26 0.00 0.00 58.87 56.29 1s0r n SER 127 Cb 0.00 1.18 0.00 0.00 -0.26 0.00 0.00 64.21 65.13 1s0r n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1s0r n GLY 128 N 1.14 -3.88 2.66 5.00 0.00 -1.26 -5.16 105.19 103.68 1s0r n GLY 128 Ca 0.01 -0.08 -0.22 0.00 0.00 0.00 0.00 46.02 45.74 1s0r n GLY 128 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1s0r s THR 129 N -0.39 -0.07 -0.21 2.61 2.01 -1.26 -4.46 115.64 113.87 1s0r s THR 129 Ca 0.00 0.25 -0.08 0.00 0.31 0.00 0.00 61.69 62.17 1s0r s THR 129 Cb 0.00 -0.29 0.09 0.00 0.01 0.00 0.00 72.50 72.31 1s0r s THR 129 CO 0.00 0.06 0.45 -0.55 -0.69 0.00 0.00 174.62 173.90 1s0r s SER 130 N 2.15 -0.40 -0.20 3.53 0.15 -1.26 -4.96 113.70 112.71 1s0r s SER 130 Ca 0.04 1.07 -0.05 0.00 0.70 0.00 0.00 55.95 57.71 1s0r s SER 130 Cb -0.13 1.42 -0.03 0.00 -1.71 0.00 0.00 66.02 65.57 1s0r s SER 130 CO -0.05 -0.23 0.01 -0.31 1.20 0.00 0.00 173.24 173.87 1s0r s TYR 131 N 2.53 3.07 0.57 3.44 1.51 -1.26 -0.86 117.35 126.35 1s0r s TYR 131 Ca -0.03 -0.35 -0.10 0.00 -1.01 0.00 0.00 57.07 55.58 1s0r s TYR 131 Cb -0.12 -2.08 -0.04 0.00 -0.11 0.00 0.00 41.96 39.61 1s0r s TYR 131 CO -0.14 -0.16 0.96 -1.25 -1.11 0.00 0.00 175.55 173.86 1s0r s PRO 132 N 0.86 3.62 -0.13 -1.71 0.04 -1.26 -5.00 135.00 131.42 1s0r s PRO 132 Ca 0.01 0.63 0.04 0.00 0.04 0.00 0.00 61.00 61.71 1s0r s PRO 132 Cb -0.14 -2.16 -0.24 0.00 0.04 0.00 0.00 34.50 32.00 1s0r s PRO 132 CO 0.02 -0.44 0.32 -0.25 0.04 0.00 0.00 177.00 176.69 1s0r n ASP 133 N -2.50 1.46 -4.96 6.66 8.00 -1.26 -4.92 116.55 119.04 1s0r n ASP 133 Ca 0.05 0.19 -0.22 0.00 0.71 0.00 0.00 54.79 55.51 1s0r n ASP 133 Cb 0.54 -0.32 -0.01 0.00 -0.02 0.00 0.00 41.12 41.31 1s0r n ASP 133 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1s0r s VAL 134 N -2.56 4.95 0.21 2.53 -7.23 -1.26 -1.21 120.40 115.84 1s0r s VAL 134 Ca -0.18 -0.67 -0.30 0.00 -1.81 0.00 0.00 61.98 59.02 1s0r s VAL 134 Cb 0.07 -3.79 -0.09 0.00 0.56 0.00 0.00 36.38 33.14 1s0r s VAL 134 CO 0.77 -0.43 1.26 -0.22 -0.31 0.00 0.00 175.10 176.16 1s0r s LEU 135 N -4.23 4.44 0.15 1.32 2.96 -1.23 -4.82 118.68 117.26 1s0r s LEU 135 Ca 0.39 2.35 0.06 0.00 -0.22 0.00 0.00 54.13 56.72 1s0r s LEU 135 Cb -0.09 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.94 1s0r s LEU 135 CO 0.34 -0.45 0.03 -0.54 -1.32 0.00 0.00 176.35 174.41 1s0r s LYS 136 N -0.36 2.55 0.08 1.98 -0.14 -0.77 -1.80 119.74 121.28 1s0r s LYS 136 Ca 0.54 -0.99 0.04 0.00 -1.36 0.00 0.00 55.97 54.20 1s0r s LYS 136 Cb -0.35 -2.46 -0.03 0.00 -1.68 0.00 0.00 37.83 33.31 1s0r s LYS 136 CO 0.39 0.48 -0.11 0.00 -0.76 0.00 0.00 175.35 175.35 1s0r s LEU 138 N -2.02 0.13 -0.11 0.00 2.96 0.15 -0.81 118.68 118.98 1s0r s LEU 138 Ca -0.00 0.58 -0.21 0.00 -0.22 0.00 0.00 54.13 54.28 1s0r s LEU 138 Cb -0.07 0.77 -0.04 0.00 0.50 0.00 0.00 46.19 47.35 1s0r s LEU 138 CO 0.01 -0.19 0.59 -0.54 -1.32 0.00 0.00 176.35 174.90 1s0r s LYS 139 N 1.66 4.37 -0.04 1.98 1.02 -1.26 -0.72 119.74 126.75 1s0r s LYS 139 Ca -0.06 0.66 -0.19 0.00 0.02 0.00 0.00 55.97 56.40 1s0r s LYS 139 Cb -0.11 -3.46 0.04 0.00 -0.52 0.00 0.00 37.83 33.78 1s0r s LYS 139 CO -0.09 0.07 0.42 0.00 -0.92 0.00 0.00 175.35 174.83 1s0r s ALA 140 N 0.86 -1.06 0.24 5.17 0.00 -0.34 -4.96 121.76 121.66 1s0r s ALA 140 Ca 0.31 0.68 -0.08 0.00 0.00 0.00 0.00 51.96 52.88 1s0r s ALA 140 Cb -0.16 -0.04 -0.06 0.00 0.00 0.00 0.00 23.12 22.86 1s0r s ALA 140 CO 0.14 -0.28 0.53 -1.25 0.00 0.00 0.00 175.76 174.90 1s0r s PRO 141 N -1.11 3.72 0.26 0.00 0.04 -1.26 -0.65 135.00 136.00 1s0r s PRO 141 Ca -0.11 0.15 -0.30 0.00 0.04 0.00 0.00 61.00 60.78 1s0r s PRO 141 Cb -0.04 -2.67 -0.10 0.00 0.04 0.00 0.00 34.50 31.74 1s0r s PRO 141 CO 0.05 0.29 1.34 0.42 0.04 0.00 0.00 177.00 179.15 1s0r s ILE 142 N -1.89 2.88 0.23 0.56 1.01 -0.38 -1.38 121.20 122.22 1s0r s ILE 142 Ca 0.46 0.79 -0.01 0.00 0.00 0.00 0.00 60.65 61.88 1s0r s ILE 142 Cb -0.11 -3.50 -0.04 0.00 0.01 0.00 0.00 42.46 38.81 1s0r s ILE 142 CO 0.25 0.15 0.42 -0.76 0.00 0.00 0.00 174.94 175.00 1s0r s LEU 143 N -0.85 4.19 0.59 2.97 1.43 0.10 -0.49 118.68 126.62 1s0r s LEU 143 Ca 0.54 0.43 -0.20 0.00 -1.03 0.00 0.00 54.13 53.87 1s0r s LEU 143 Cb -0.39 -3.22 -0.03 0.00 0.03 0.00 0.00 46.19 42.58 1s0r s LEU 143 CO 0.45 -0.08 1.28 -1.54 0.23 0.00 0.00 176.35 176.69 1s0r n SER 144 N -0.81 2.20 -0.27 2.29 3.41 -1.26 -4.56 113.62 114.62 1s0r n SER 144 Ca -0.04 0.90 0.02 0.00 -0.26 0.00 0.00 58.87 59.49 1s0r n SER 144 Cb 0.54 -1.54 0.15 0.00 -0.26 0.00 0.00 64.21 63.10 1s0r n SER 144 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 1s0r h ASP 145 N 0.97 0.58 -0.62 4.04 -0.00 -1.97 -0.77 116.42 118.65 1s0r h ASP 145 Ca -0.50 0.05 -0.07 0.00 -0.00 0.00 0.00 57.03 56.51 1s0r h ASP 145 Cb 1.33 -0.05 -0.02 0.00 -0.00 0.00 0.00 39.33 40.58 1s0r h ASP 145 CO 0.55 0.33 0.12 0.77 -0.00 0.00 0.00 179.24 181.01 1s0r h SER 146 N 0.71 0.96 -0.01 2.28 4.64 -1.99 -0.43 113.55 119.71 1s0r h SER 146 Ca 0.38 -0.25 -0.11 0.00 -0.47 0.00 0.00 61.79 61.34 1s0r h SER 146 Cb 0.36 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.19 1s0r h SER 146 CO -0.25 0.96 -0.31 0.28 -0.87 0.00 0.00 176.83 176.64 1s0r h SER 147 N 0.92 0.47 -0.03 4.97 0.02 -1.80 -1.05 113.55 117.05 1s0r h SER 147 Ca 0.19 -0.18 -0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1s0r h SER 147 Cb 0.40 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 62.81 1s0r h SER 147 CO 0.01 0.77 0.02 0.00 -1.14 0.00 0.00 176.83 176.48 1s0r h LYS 149 N -0.05 0.92 -0.30 0.00 1.57 -1.02 -2.10 116.57 115.59 1s0r h LYS 149 Ca 0.01 -0.20 -0.08 0.00 -1.87 0.00 0.00 60.65 58.51 1s0r h LYS 149 Cb 0.09 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 1s0r h LYS 149 CO -0.00 0.83 -0.16 1.03 -0.57 0.00 0.00 179.45 180.57 1s0r h SER 150 N 0.88 0.52 0.04 0.86 0.87 -1.00 -2.51 113.55 113.20 1s0r h SER 150 Ca 0.19 -0.15 -0.12 0.00 -1.23 0.00 0.00 61.79 60.48 1s0r h SER 150 Cb 0.34 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.15 1s0r h SER 150 CO 0.00 0.70 -0.38 0.00 -0.53 0.00 0.00 176.83 176.62 1s0r h ALA 151 N 1.35 0.97 -2.12 6.23 0.00 -0.73 -3.37 119.26 121.59 1s0r h ALA 151 Ca 0.08 -0.42 -0.58 0.00 0.00 0.00 0.00 54.91 54.00 1s0r h ALA 151 Cb 0.56 -0.11 -0.40 0.00 0.00 0.00 0.00 17.79 17.85 1s0r h ALA 151 CO 0.04 0.61 -0.90 0.66 0.00 0.00 0.00 179.25 179.66 1s0r n TYR 152 N -4.04 1.14 -1.67 0.00 4.01 -0.84 -4.89 117.16 110.86 1s0r n TYR 152 Ca -0.01 -3.78 -0.44 0.00 -0.16 0.00 0.00 57.90 53.50 1s0r n TYR 152 Cb 0.49 -0.40 -0.02 0.00 -0.31 0.00 0.00 39.34 39.09 1s0r n TYR 152 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1s0r n PRO 153 N 1.31 2.03 -0.96 -0.72 -0.02 -0.96 -1.97 135.00 133.71 1s0r n PRO 153 Ca 0.25 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.45 1s0r n PRO 153 Cb 0.48 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 1s0r n PRO 153 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1s0r n GLY 154 N 1.99 0.43 0.00 -1.23 0.00 -1.26 -4.84 105.19 100.28 1s0r n GLY 154 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1s0r n GLY 154 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1s0r n GLN 155 N -1.80 3.15 -3.40 1.61 6.02 -0.83 -5.00 117.38 117.12 1s0r n GLN 155 Ca 0.00 0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.59 1s0r n GLN 155 Cb 0.12 -0.73 -0.09 0.00 1.02 0.00 0.00 30.24 30.55 1s0r n GLN 155 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1s0r s ILE 156 N -1.42 5.17 0.65 5.09 -1.09 -1.25 -5.02 121.20 123.32 1s0r s ILE 156 Ca 0.00 0.21 0.03 0.00 -2.23 0.00 0.00 60.65 58.66 1s0r s ILE 156 Cb 0.00 -3.78 0.10 0.00 -1.58 0.00 0.00 42.46 37.20 1s0r s ILE 156 CO 0.00 -0.01 0.89 0.42 -1.23 0.00 0.00 174.94 175.01 1s0r s THR 157 N 2.04 2.23 -0.92 2.92 -4.23 -1.26 -4.98 115.64 111.44 1s0r s THR 157 Ca 0.13 -0.74 0.12 0.00 -1.18 0.00 0.00 61.69 60.02 1s0r s THR 157 Cb -0.16 -2.49 0.11 0.00 1.34 0.00 0.00 72.50 71.29 1s0r s THR 157 CO 0.11 0.00 1.38 -1.54 -0.54 0.00 0.00 174.62 174.03 1s0r n SER 158 N -2.57 0.09 -1.43 3.99 3.41 -1.26 -2.01 113.62 113.83 1s0r n SER 158 Ca 0.14 0.53 0.10 0.00 -0.26 0.00 0.00 58.87 59.38 1s0r n SER 158 Cb 0.61 -0.54 0.33 0.00 -0.26 0.00 0.00 64.21 64.35 1s0r n SER 158 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1s0r n ASN 159 N -1.60 4.21 -4.13 4.04 3.02 -1.26 -4.92 115.26 114.62 1s0r n ASN 159 Ca 0.02 -2.22 -0.15 0.00 -0.03 0.00 0.00 54.58 52.21 1s0r n ASN 159 Cb 0.13 -0.52 -0.11 0.00 -0.61 0.00 0.00 39.78 38.66 1s0r n ASN 159 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1s0r s MET 160 N -1.46 0.72 0.06 3.52 -1.94 -0.85 -1.13 119.30 118.21 1s0r s MET 160 Ca 0.48 -0.95 -0.02 0.00 -1.71 0.00 0.00 55.69 53.49 1s0r s MET 160 Cb 0.28 -0.51 -0.03 0.00 2.01 0.00 0.00 34.83 36.58 1s0r s MET 160 CO 0.28 0.10 0.01 -0.59 -0.01 0.00 0.00 175.02 174.81 1s0r s PHE 161 N -1.73 0.44 0.04 -0.03 -0.12 -0.20 -4.78 117.98 111.60 1s0r s PHE 161 Ca -0.02 -0.95 -0.00 0.00 -0.05 0.00 0.00 56.93 55.91 1s0r s PHE 161 Cb -0.07 -0.32 -0.04 0.00 -0.63 0.00 0.00 43.02 41.96 1s0r s PHE 161 CO 0.01 -0.40 0.18 0.00 -0.05 0.00 0.00 175.22 174.95 1s0r s ALA 163 N -1.44 -0.62 0.00 0.00 0.00 -0.59 -0.72 121.76 118.38 1s0r s ALA 163 Ca 0.32 0.19 0.00 0.00 0.00 0.00 0.00 51.96 52.47 1s0r s ALA 163 Cb -0.13 0.07 0.00 0.00 0.00 0.00 0.00 23.12 23.06 1s0r s ALA 163 CO 0.25 -0.24 0.00 0.41 0.00 0.00 0.00 175.76 176.18 1s0r n GLY 164 N 1.40 0.27 2.65 0.00 0.00 -0.48 -2.62 105.19 106.41 1s0r n GLY 164 Ca -0.22 -1.64 -0.23 0.00 0.00 0.00 0.00 46.02 43.94 1s0r n GLY 164 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1s0r s TYR 165 N -1.87 0.11 0.41 1.61 2.02 -1.26 -4.33 117.35 114.04 1s0r s TYR 165 Ca 0.00 0.01 0.27 0.00 -0.37 0.00 0.00 57.07 56.98 1s0r s TYR 165 Cb 0.00 -0.57 1.42 0.00 -0.40 0.00 0.00 41.96 42.41 1s0r s TYR 165 CO 0.00 -0.34 2.06 -0.07 -1.57 0.00 0.00 175.55 175.63 1s0r h LEU 166 N 8.43 0.00 -1.14 -1.29 3.38 -1.95 -2.41 115.31 120.34 1s0r h LEU 166 Ca -0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1s0r h LEU 166 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1s0r h LEU 166 CO 0.21 0.12 0.00 1.05 0.09 0.00 0.00 178.44 179.92 1s0r h GLU 167 N 0.00 0.00 0.00 1.13 9.09 -1.96 0.29 114.58 123.14 1s0r h GLU 167 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1s0r h GLU 167 Cb 0.34 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.44 1s0r h GLU 167 CO 0.02 0.00 0.00 0.41 0.05 0.00 0.00 179.01 179.49 1s0r n GLY 168 N -0.15 -0.19 0.35 1.06 0.00 -0.91 -4.47 105.19 100.88 1s0r n GLY 168 Ca 0.01 -1.79 0.00 0.00 0.00 0.00 0.00 46.02 44.24 1s0r n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s0r n GLY 169 N -0.12 2.94 2.64 -0.02 0.00 -0.08 -4.96 105.19 105.59 1s0r n GLY 169 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1s0r n GLY 169 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s0r s LYS 170 N -0.91 0.00 0.13 1.61 1.02 -1.26 -3.57 119.74 116.76 1s0r s LYS 170 Ca 0.00 0.13 -0.26 0.00 0.02 0.00 0.00 55.97 55.87 1s0r s LYS 170 Cb 0.00 -1.21 0.07 0.00 -0.52 0.00 0.00 37.83 36.17 1s0r s LYS 170 CO 0.00 -0.51 0.97 0.34 -0.92 0.00 0.00 175.35 175.24 1s0r s ASP 171 N 2.15 -0.18 0.79 2.83 2.15 -0.56 -4.26 116.67 119.59 1s0r s ASP 171 Ca 0.03 -0.36 -0.10 0.00 0.43 0.00 0.00 52.55 52.56 1s0r s ASP 171 Cb -0.14 0.46 0.10 0.00 -0.30 0.00 0.00 42.92 43.04 1s0r s ASP 171 CO -0.06 -0.85 1.12 -0.94 -0.17 0.00 0.00 175.17 174.27 1s0r s SER 172 N -2.91 4.36 0.38 -0.34 1.04 -1.26 -0.44 113.70 114.52 1s0r s SER 172 Ca 0.12 0.46 -0.10 0.00 0.48 0.00 0.00 55.95 56.91 1s0r s SER 172 Cb -0.01 -0.93 0.04 0.00 0.10 0.00 0.00 66.02 65.22 1s0r s SER 172 CO 0.01 -1.93 0.68 0.00 0.98 0.00 0.00 173.24 172.98 1s0r n GLN 174 N -0.55 1.93 0.00 0.00 7.27 -1.26 -0.94 117.38 123.84 1s0r n GLN 174 Ca -0.05 0.69 0.00 0.00 0.07 0.00 0.00 57.00 57.71 1s0r n GLN 174 Cb 0.59 -2.35 0.00 0.00 2.41 0.00 0.00 30.24 30.89 1s0r n GLN 174 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1s0r n GLY 175 N 2.34 2.87 0.15 1.69 0.00 -1.26 -0.97 105.19 110.01 1s0r n GLY 175 Ca 0.13 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.27 1s0r n GLY 175 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1s0r h ASP 176 N 0.00 0.00 -1.05 1.61 3.32 -1.35 -3.32 116.42 115.64 1s0r h ASP 176 Ca 0.00 -0.03 -0.73 0.00 0.02 0.00 0.00 57.03 56.29 1s0r h ASP 176 Cb 0.00 0.00 0.08 0.00 0.22 0.00 0.00 39.33 39.63 1s0r h ASP 176 CO 0.00 0.02 -0.20 -1.20 -1.72 0.00 0.00 179.24 176.13 1s0r n SER 177 N -2.68 -0.52 0.00 6.45 7.64 -1.25 -1.35 113.62 121.91 1s0r n SER 177 Ca 0.03 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.06 1s0r n SER 177 Cb 0.50 -0.95 0.00 0.00 -1.01 0.00 0.00 64.21 62.75 1s0r n SER 177 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1s0r n GLY 178 N 1.76 2.48 3.94 0.23 0.00 -0.11 -0.32 105.19 113.17 1s0r n GLY 178 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 1s0r n GLY 178 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1s0r s GLY 179 N -1.92 1.80 0.35 -0.02 0.00 -0.46 -3.24 107.32 103.83 1s0r s GLY 179 Ca 0.00 -1.32 -0.17 0.00 0.00 0.00 0.00 44.72 43.23 1s0r s GLY 179 CO 0.00 -0.55 0.80 2.56 0.00 0.00 0.00 173.10 175.91 1s0r s PRO 180 N -5.83 4.08 -0.27 2.90 0.04 -1.26 -0.96 135.00 133.69 1s0r s PRO 180 Ca 0.74 0.81 0.03 0.00 0.04 0.00 0.00 61.00 62.62 1s0r s PRO 180 Cb -0.03 -2.36 0.07 0.00 0.04 0.00 0.00 34.50 32.22 1s0r s PRO 180 CO 0.52 0.10 -0.07 0.08 0.04 0.00 0.00 177.00 177.68 1s0r s VAL 181 N -2.04 2.02 -0.11 -0.36 1.01 -0.31 -3.25 120.40 117.35 1s0r s VAL 181 Ca 0.56 -1.65 0.01 0.00 0.00 0.00 0.00 61.98 60.90 1s0r s VAL 181 Cb -0.10 -2.22 -0.02 0.00 0.00 0.00 0.00 36.38 34.04 1s0r s VAL 181 CO 0.16 -0.15 -0.13 -0.69 0.00 0.00 0.00 175.10 174.29 1s0r s VAL 182 N 1.15 3.05 -0.09 2.92 1.01 -0.38 -1.02 120.40 127.03 1s0r s VAL 182 Ca -0.05 -0.68 -0.01 0.00 0.00 0.00 0.00 61.98 61.24 1s0r s VAL 182 Cb -0.20 -2.26 0.03 0.00 0.00 0.00 0.00 36.38 33.95 1s0r s VAL 182 CO -0.06 0.54 -0.02 0.00 0.00 0.00 0.00 175.10 175.55 1s0r n SER 184 N 5.08 -4.46 0.00 0.00 7.64 -1.26 -1.69 113.62 118.93 1s0r n SER 184 Ca -0.09 -0.77 0.00 0.00 1.01 0.00 0.00 58.87 59.02 1s0r n SER 184 Cb 0.50 -3.58 0.00 0.00 -1.01 0.00 0.00 64.21 60.12 1s0r n SER 184 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1s0r n GLY 185 N -1.57 0.66 3.28 0.23 0.00 -1.26 -5.02 105.19 101.51 1s0r n GLY 185 Ca 0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 1s0r n GLY 185 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s0r s LYS 186 N -0.11 1.94 -0.72 1.61 -0.14 -0.68 -3.88 119.74 117.75 1s0r s LYS 186 Ca 0.00 -0.88 -0.27 0.00 -1.36 0.00 0.00 55.97 53.46 1s0r s LYS 186 Cb 0.00 -1.89 0.02 0.00 -1.68 0.00 0.00 37.83 34.28 1s0r s LYS 186 CO 0.00 0.52 1.34 -1.17 -0.76 0.00 0.00 175.35 175.28 1s0r s LEU 187 N -0.62 3.18 -0.04 3.17 2.96 -0.21 -0.97 118.68 126.14 1s0r s LEU 187 Ca 0.09 -0.36 0.20 0.00 -0.22 0.00 0.00 54.13 53.85 1s0r s LEU 187 Cb -0.09 -2.57 -0.25 0.00 0.50 0.00 0.00 46.19 43.78 1s0r s LEU 187 CO -0.01 -1.89 0.48 0.00 -1.32 0.00 0.00 176.35 173.61 1s0r n GLN 188 N 9.34 0.66 -4.05 1.98 1.13 -0.19 -4.18 117.38 122.06 1s0r n GLN 188 Ca 0.05 -0.05 -0.08 0.00 -1.94 0.00 0.00 57.00 54.97 1s0r n GLN 188 Cb 0.49 -1.59 -0.09 0.00 0.11 0.00 0.00 30.24 29.16 1s0r n GLN 188 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1s0r s GLY 189 N -4.81 0.55 -0.08 1.08 0.00 -0.78 -1.61 107.32 101.67 1s0r s GLY 189 Ca -0.07 -1.14 0.03 0.00 0.00 0.00 0.00 44.72 43.54 1s0r s GLY 189 CO 0.86 -1.18 -0.17 -0.42 0.00 0.00 0.00 173.10 172.19 1s0r s ILE 190 N -3.95 1.48 -0.04 0.90 1.01 -1.05 -1.16 121.20 118.38 1s0r s ILE 190 Ca 0.13 -0.68 -0.32 0.00 0.00 0.00 0.00 60.65 59.78 1s0r s ILE 190 Cb 0.07 -1.31 -0.10 0.00 0.01 0.00 0.00 42.46 41.13 1s0r s ILE 190 CO -0.06 0.43 1.97 0.52 0.00 0.00 0.00 174.94 177.81 1s0r n VAL 191 N 3.69 0.65 0.03 2.92 0.31 -0.14 -1.22 118.33 124.57 1s0r n VAL 191 Ca -0.21 -0.16 -0.00 0.00 -0.01 0.00 0.00 64.34 63.95 1s0r n VAL 191 Cb 0.52 -2.17 -0.00 0.00 -0.91 0.00 0.00 33.84 31.28 1s0r n VAL 191 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1s0r n SER 192 N 7.69 0.73 -3.21 4.52 2.88 -0.94 -0.93 113.62 124.36 1s0r n SER 192 Ca 0.23 0.09 -0.07 0.00 -1.33 0.00 0.00 58.87 57.79 1s0r n SER 192 Cb 0.37 -0.24 0.01 0.00 -0.75 0.00 0.00 64.21 63.60 1s0r n SER 192 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1s0r s TRP 193 N -1.66 0.05 0.00 0.66 1.48 -0.66 -4.93 118.94 113.87 1s0r s TRP 193 Ca -0.01 -0.61 0.00 0.00 -1.06 0.00 0.00 56.10 54.41 1s0r s TRP 193 Cb 0.00 0.78 0.00 0.00 -1.16 0.00 0.00 33.47 33.09 1s0r s TRP 193 CO 0.02 -1.35 0.00 0.41 -4.06 0.00 0.00 176.95 171.97 1s0r n GLY 194 N -0.55 0.85 3.53 3.67 0.00 -1.26 -0.66 105.19 110.77 1s0r n GLY 194 Ca -0.06 -0.82 -0.43 0.00 0.00 0.00 0.00 46.02 44.71 1s0r n GLY 194 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1s0r s SER 195 N 0.00 6.37 0.99 1.61 0.01 -1.26 -4.87 113.70 116.55 1s0r s SER 195 Ca 0.00 -0.25 0.00 0.00 1.31 0.00 0.00 55.95 57.01 1s0r s SER 195 Cb 0.00 -2.43 0.00 0.00 0.21 0.00 0.00 66.02 63.80 1s0r s SER 195 CO 0.00 -1.16 0.00 0.61 0.41 0.00 0.00 173.24 173.10 1s0r n GLY 196 N 5.07 1.03 2.88 3.44 0.00 -1.26 -4.59 105.19 111.78 1s0r n GLY 196 Ca 0.02 -0.61 -0.13 0.00 0.00 0.00 0.00 46.02 45.31 1s0r n GLY 196 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s0r n ALA 198 N 3.45 -0.46 -2.18 0.00 0.00 -1.26 -4.58 120.51 115.48 1s0r n ALA 198 Ca -0.17 0.20 -0.35 0.00 0.00 0.00 0.00 53.44 53.12 1s0r n ALA 198 Cb 0.57 -1.96 -0.06 0.00 0.00 0.00 0.00 19.45 18.00 1s0r n ALA 198 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1s0r s GLN 199 N -4.47 4.12 0.22 0.00 -1.52 -1.26 -0.90 119.66 115.85 1s0r s GLN 199 Ca 0.00 0.72 -0.32 0.00 -1.95 0.00 0.00 55.36 53.81 1s0r s GLN 199 Cb 0.00 -2.78 -0.13 0.00 -0.22 0.00 0.00 33.01 29.88 1s0r s GLN 199 CO 0.00 0.35 1.45 1.17 -0.25 0.00 0.00 175.29 178.01 1s0r n LYS 200 N 0.45 2.06 -1.52 2.91 4.81 -1.26 -1.88 118.16 123.74 1s0r n LYS 200 Ca -0.01 0.74 -0.18 0.00 -0.87 0.00 0.00 58.31 57.99 1s0r n LYS 200 Cb 0.52 -2.42 -0.08 0.00 0.02 0.00 0.00 35.03 33.07 1s0r n LYS 200 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1s0r n ASN 201 N 2.41 -5.13 -3.37 3.14 5.03 0.10 -4.91 115.26 112.54 1s0r n ASN 201 Ca 0.13 0.44 -0.26 0.00 0.87 0.00 0.00 54.58 55.75 1s0r n ASN 201 Cb 0.31 -4.19 -0.09 0.00 -1.02 0.00 0.00 39.78 34.79 1s0r n ASN 201 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1s0r n LYS 202 N -2.49 0.83 -1.34 3.52 4.76 -0.79 -4.73 118.16 117.92 1s0r n LYS 202 Ca -0.18 -3.50 -0.29 0.00 -2.87 0.00 0.00 58.31 51.48 1s0r n LYS 202 Cb 0.58 -1.62 0.16 0.00 -1.84 0.00 0.00 35.03 32.31 1s0r n LYS 202 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1s0r s PRO 203 N -0.88 0.70 0.44 1.97 0.04 -1.26 -4.30 135.00 131.72 1s0r s PRO 203 Ca 0.34 0.38 -0.24 0.00 0.04 0.00 0.00 61.00 61.52 1s0r s PRO 203 Cb 0.10 -1.78 -0.08 0.00 0.04 0.00 0.00 34.50 32.78 1s0r s PRO 203 CO -0.14 -2.52 1.18 0.20 0.04 0.00 0.00 177.00 175.76 1s0r s GLY 204 N -3.74 2.81 -0.09 0.56 0.00 -1.08 -4.69 107.32 101.09 1s0r s GLY 204 Ca 0.65 0.97 0.01 0.00 0.00 0.00 0.00 44.72 46.35 1s0r s GLY 204 CO 0.56 1.45 -0.12 0.14 0.00 0.00 0.00 173.10 175.13 1s0r s VAL 205 N -1.49 3.20 0.02 1.40 1.01 0.17 -1.54 120.40 123.16 1s0r s VAL 205 Ca 0.62 -0.64 0.04 0.00 0.00 0.00 0.00 61.98 61.99 1s0r s VAL 205 Cb -0.30 -2.31 -0.02 0.00 0.00 0.00 0.00 36.38 33.76 1s0r s VAL 205 CO 0.37 0.56 -0.11 -0.31 0.00 0.00 0.00 175.10 175.60 1s0r s TYR 206 N -0.21 1.00 0.17 5.22 2.02 0.67 -1.65 117.35 124.58 1s0r s TYR 206 Ca 0.01 -0.29 -0.30 0.00 -0.37 0.00 0.00 57.07 56.11 1s0r s TYR 206 Cb -0.13 -0.61 -0.08 0.00 -0.40 0.00 0.00 41.96 40.73 1s0r s TYR 206 CO 0.03 0.00 1.33 0.99 -1.57 0.00 0.00 175.55 176.33 1s0r s THR 207 N -0.67 3.27 -0.99 -0.71 2.01 -0.36 -1.03 115.64 117.16 1s0r s THR 207 Ca 0.01 1.00 -0.20 0.00 0.31 0.00 0.00 61.69 62.80 1s0r s THR 207 Cb -0.06 -3.64 0.10 0.00 0.01 0.00 0.00 72.50 68.90 1s0r s THR 207 CO 0.00 0.13 1.30 -0.75 -0.69 0.00 0.00 174.62 174.61 1s0r s LYS 208 N 0.25 3.63 0.37 4.92 2.20 -0.28 -2.52 119.74 128.31 1s0r s LYS 208 Ca 0.59 -1.53 0.07 0.00 -0.36 0.00 0.00 55.97 54.74 1s0r s LYS 208 Cb -0.36 -5.14 0.79 0.00 -1.51 0.00 0.00 37.83 31.61 1s0r s LYS 208 CO 0.36 -1.98 1.96 0.28 -0.36 0.00 0.00 175.35 175.61 1s0r h VAL 209 N 6.19 1.00 -0.10 4.02 2.07 -1.59 -1.97 116.25 125.86 1s0r h VAL 209 Ca 0.19 -0.24 0.03 0.00 0.82 0.00 0.00 66.70 67.50 1s0r h VAL 209 Cb 1.01 0.24 -0.00 0.00 -1.52 0.00 0.00 31.29 31.01 1s0r h VAL 209 CO 1.26 0.13 0.13 0.00 0.02 0.00 0.00 177.57 179.11 1s0r n ASN 211 N -3.72 0.71 -0.39 0.00 3.02 -0.74 -3.61 115.26 110.52 1s0r n ASN 211 Ca -0.00 0.66 0.05 0.00 -0.03 0.00 0.00 54.58 55.25 1s0r n ASN 211 Cb 0.23 -0.81 0.04 0.00 -0.61 0.00 0.00 39.78 38.62 1s0r n ASN 211 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1s0r n TYR 212 N -2.26 0.00 -0.34 3.10 4.01 0.16 -4.69 117.16 117.14 1s0r n TYR 212 Ca 0.03 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.73 1s0r n TYR 212 Cb 0.26 0.00 0.09 0.00 -0.31 0.00 0.00 39.34 39.38 1s0r n TYR 212 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1s0r h VAL 213 N 1.93 1.25 -0.42 -0.72 2.07 -1.61 0.77 116.25 119.52 1s0r h VAL 213 Ca 0.00 -0.54 -0.03 0.00 0.82 0.00 0.00 66.70 66.95 1s0r h VAL 213 Cb 0.43 -0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.15 1s0r h VAL 213 CO 0.00 0.26 0.16 0.77 0.02 0.00 0.00 177.57 178.78 1s0r h SER 214 N 1.25 0.58 -0.63 0.57 4.64 -1.86 -0.20 113.55 117.89 1s0r h SER 214 Ca 0.33 -0.17 -0.01 0.00 -0.47 0.00 0.00 61.79 61.46 1s0r h SER 214 Cb -0.06 -0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 61.85 1s0r h SER 214 CO -0.06 0.60 0.35 -0.25 -0.87 0.00 0.00 176.83 176.59 1s0r h TRP 215 N 0.53 0.87 -0.05 4.77 7.01 -1.75 -1.17 115.95 126.16 1s0r h TRP 215 Ca 0.14 -0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.12 1s0r h TRP 215 Cb 0.20 -0.28 -0.00 0.00 -2.10 0.00 0.00 29.16 26.98 1s0r h TRP 215 CO 0.00 0.62 0.03 0.82 -2.79 0.00 0.00 178.44 177.13 1s0r h ILE 216 N 0.86 1.03 -0.47 2.65 2.04 -0.55 -0.02 117.51 123.05 1s0r h ILE 216 Ca 0.22 -0.08 -0.02 0.00 1.00 0.00 0.00 64.86 65.98 1s0r h ILE 216 Cb 0.04 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 1s0r h ILE 216 CO -0.04 0.03 0.21 0.11 0.00 0.00 0.00 178.15 178.46 1s0r h LYS 217 N 0.04 0.69 -0.09 2.37 1.57 -0.91 -0.85 116.57 119.41 1s0r h LYS 217 Ca 0.02 -0.12 -0.14 0.00 -1.87 0.00 0.00 60.65 58.54 1s0r h LYS 217 Cb 0.02 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 1s0r h LYS 217 CO -0.00 0.61 -0.56 -0.56 -0.57 0.00 0.00 179.45 178.37 1s0r h GLN 218 N 0.62 0.26 -0.22 3.15 -0.00 -1.10 -1.59 115.11 116.22 1s0r h GLN 218 Ca 0.16 -0.17 -0.02 0.00 -0.00 0.00 0.00 58.65 58.62 1s0r h GLN 218 Cb 0.16 0.02 -0.01 0.00 -0.00 0.00 0.00 27.48 27.65 1s0r h GLN 218 CO -0.02 0.75 0.07 1.15 -0.00 0.00 0.00 178.83 180.78 1s0r h THR 219 N 0.20 1.20 -0.89 1.86 2.02 -0.74 -2.73 112.91 113.83 1s0r h THR 219 Ca 0.00 -0.62 -0.01 0.00 0.77 0.00 0.00 66.41 66.55 1s0r h THR 219 Cb 1.04 1.19 -0.04 0.00 -1.74 0.00 0.00 68.15 68.60 1s0r h THR 219 CO 0.09 0.20 0.53 0.40 0.37 0.00 0.00 175.52 177.11 1s0r h ILE 220 N 0.19 1.25 0.00 3.11 2.04 -1.02 -2.19 117.51 120.89 1s0r h ILE 220 Ca 0.07 -0.55 -0.01 0.00 1.00 0.00 0.00 64.86 65.37 1s0r h ILE 220 Cb 0.24 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.32 1s0r h ILE 220 CO -0.00 0.26 -0.06 0.00 0.00 0.00 0.00 178.15 178.35 1s0r h ALA 221 N 1.29 1.29 -0.11 1.87 0.00 -1.00 -2.94 119.26 119.66 1s0r h ALA 221 Ca 0.32 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1s0r h ALA 221 Cb -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1s0r h ALA 221 CO -0.06 0.08 0.00 0.43 0.00 0.00 0.00 179.25 179.70 1s0r n SER 222 N -3.57 2.29 0.00 0.00 7.64 -0.98 -5.10 113.62 113.90 1s0r n SER 222 Ca -0.02 -2.01 0.00 0.00 1.01 0.00 0.00 58.87 57.84 1s0r n SER 222 Cb 0.17 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.30 1s0r n SER 222 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62