#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oio s VAL 2 N 0.00 0.06 0.05 0.00 0.11 -1.26 -1.32 120.40 118.03 1oio s VAL 2 Ca 0.00 -0.48 -0.12 0.00 -2.93 0.00 0.00 61.98 58.45 1oio s VAL 2 Cb 0.00 -0.38 0.01 0.00 -1.53 0.00 0.00 36.38 34.48 1oio s VAL 2 CO 0.00 -0.26 0.26 -0.94 -3.33 0.00 0.00 175.10 170.82 1oio s SER 3 N -0.94 -0.05 -0.19 3.54 1.04 -0.38 -4.94 113.70 111.78 1oio s SER 3 Ca -0.10 -0.31 -0.14 0.00 0.48 0.00 0.00 55.95 55.87 1oio s SER 3 Cb -0.06 0.34 -0.04 0.00 0.10 0.00 0.00 66.02 66.36 1oio s SER 3 CO 0.01 -0.62 0.33 0.12 0.98 0.00 0.00 173.24 174.06 1oio s PHE 4 N -2.77 3.40 -0.00 5.02 5.36 -1.26 -0.68 117.98 127.04 1oio s PHE 4 Ca -0.03 0.56 0.01 0.00 -0.96 0.00 0.00 56.93 56.50 1oio s PHE 4 Cb -0.00 -2.42 0.01 0.00 -0.34 0.00 0.00 43.02 40.27 1oio s PHE 4 CO -0.05 0.10 0.77 0.44 -1.46 0.00 0.00 175.22 175.02 1oio n ILE 5 N 4.03 0.52 -1.18 3.12 -5.35 0.13 -4.92 119.36 115.71 1oio n ILE 5 Ca -0.10 -0.53 0.00 0.00 -0.27 0.00 0.00 62.75 61.84 1oio n ILE 5 Cb 0.51 0.71 0.00 0.00 -1.74 0.00 0.00 39.64 39.13 1oio n ILE 5 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1oio n GLY 6 N -0.28 2.37 3.37 3.28 0.00 -0.60 -4.76 105.19 108.58 1oio n GLY 6 Ca 0.01 -1.89 -0.31 0.00 0.00 0.00 0.00 46.02 43.82 1oio n GLY 6 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1oio s SER 7 N -0.71 3.36 0.08 1.61 0.01 -1.26 -5.04 113.70 111.74 1oio s SER 7 Ca 0.00 -0.47 -0.15 0.00 1.31 0.00 0.00 55.95 56.64 1oio s SER 7 Cb 0.00 -0.44 -0.18 0.00 0.21 0.00 0.00 66.02 65.62 1oio s SER 7 CO 0.00 0.29 1.26 0.74 0.41 0.00 0.00 173.24 175.94 1oio h THR 8 N 4.28 1.31 -3.34 1.44 2.02 -1.92 -3.44 112.91 113.25 1oio h THR 8 Ca -0.46 -1.97 -0.64 0.00 0.77 0.00 0.00 66.41 64.11 1oio h THR 8 Cb 1.14 2.12 -0.23 0.00 -1.74 0.00 0.00 68.15 69.43 1oio h THR 8 CO 0.46 0.61 -0.69 -1.61 0.37 0.00 0.00 175.52 174.67 1oio s GLU 9 N -3.65 3.59 -0.03 6.66 0.41 -1.26 0.11 118.70 124.52 1oio s GLU 9 Ca -0.11 -0.56 0.02 0.00 -0.41 0.00 0.00 54.97 53.91 1oio s GLU 9 Cb 0.07 -2.91 0.01 0.00 -1.78 0.00 0.00 34.13 29.52 1oio s GLU 9 CO 0.88 0.15 -0.07 -0.80 -0.49 0.00 0.00 175.26 174.93 1oio s ASN 10 N 0.59 1.10 0.13 -0.19 -0.87 -0.41 -4.97 114.94 110.33 1oio s ASN 10 Ca -0.03 -0.17 -0.19 0.00 -1.57 0.00 0.00 52.86 50.90 1oio s ASN 10 Cb -0.15 -0.38 -0.07 0.00 -0.02 0.00 0.00 41.25 40.64 1oio s ASN 10 CO 0.03 0.03 0.62 -1.81 -2.57 0.00 0.00 177.10 173.39 1oio s ASP 11 N 0.42 7.04 -0.24 -1.22 1.01 -1.26 -0.34 116.67 122.08 1oio s ASP 11 Ca -0.06 1.29 -0.06 0.00 0.71 0.00 0.00 52.55 54.43 1oio s ASP 11 Cb -0.10 -2.37 -0.02 0.00 1.01 0.00 0.00 42.92 41.44 1oio s ASP 11 CO 0.01 0.17 0.02 -0.69 0.21 0.00 0.00 175.17 174.89 1oio s VAL 12 N -1.29 3.82 0.00 -1.27 1.01 0.49 -4.52 120.40 118.64 1oio s VAL 12 Ca 0.35 -0.37 0.00 0.00 0.00 0.00 0.00 61.98 61.96 1oio s VAL 12 Cb -0.18 -2.78 0.00 0.00 0.00 0.00 0.00 36.38 33.42 1oio s VAL 12 CO 0.20 0.36 0.00 0.61 0.00 0.00 0.00 175.10 176.27 1oio n GLY 13 N 4.86 -1.77 3.77 4.51 0.00 -0.57 -1.82 105.19 114.17 1oio n GLY 13 Ca -0.17 -1.53 -0.40 0.00 0.00 0.00 0.00 46.02 43.92 1oio n GLY 13 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1oio s PRO 14 N -2.97 4.24 0.09 1.61 0.04 -1.26 -4.65 135.00 132.10 1oio s PRO 14 Ca 0.00 2.02 -0.31 0.00 0.04 0.00 0.00 61.00 62.75 1oio s PRO 14 Cb 0.00 -2.91 -0.09 0.00 0.04 0.00 0.00 34.50 31.53 1oio s PRO 14 CO 0.00 -0.21 1.76 0.45 0.04 0.00 0.00 177.00 179.03 1oio s SER 15 N -0.80 6.51 -1.50 6.66 0.15 -1.26 -2.77 113.70 120.69 1oio s SER 15 Ca 0.52 2.62 -0.12 0.00 0.70 0.00 0.00 55.95 59.67 1oio s SER 15 Cb -0.35 -2.56 0.07 0.00 -1.71 0.00 0.00 66.02 61.47 1oio s SER 15 CO 0.46 -0.95 0.98 0.00 1.20 0.00 0.00 173.24 174.92 1oio n GLN 16 N 5.80 -5.70 -1.86 5.44 6.02 0.65 -4.95 117.38 122.78 1oio n GLN 16 Ca 0.17 0.62 -0.32 0.00 -0.01 0.00 0.00 57.00 57.46 1oio n GLN 16 Cb 0.39 -5.50 0.02 0.00 1.02 0.00 0.00 30.24 26.18 1oio n GLN 16 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1oio s GLY 17 N -3.40 1.87 -0.05 1.08 0.00 -1.11 -4.78 107.32 100.92 1oio s GLY 17 Ca 0.60 0.18 0.05 0.00 0.00 0.00 0.00 44.72 45.56 1oio s GLY 17 CO 0.82 0.49 -0.21 -0.56 0.00 0.00 0.00 173.10 173.63 1oio s SER 18 N -3.41 3.40 -0.05 1.64 0.01 -1.26 -1.17 113.70 112.86 1oio s SER 18 Ca 0.60 -0.40 0.03 0.00 1.31 0.00 0.00 55.95 57.48 1oio s SER 18 Cb -0.14 -0.79 0.01 0.00 0.21 0.00 0.00 66.02 65.31 1oio s SER 18 CO 0.46 0.28 -0.13 -0.31 0.41 0.00 0.00 173.24 173.95 1oio s TYR 19 N -0.37 1.40 0.04 2.43 1.51 0.02 -4.95 117.35 117.42 1oio s TYR 19 Ca 0.03 -0.44 0.05 0.00 -1.01 0.00 0.00 57.07 55.70 1oio s TYR 19 Cb -0.12 -0.99 -0.03 0.00 -0.11 0.00 0.00 41.96 40.70 1oio s TYR 19 CO 0.02 -0.19 -0.11 -1.12 -1.11 0.00 0.00 175.55 173.03 1oio s SER 20 N 0.34 4.31 0.19 2.29 0.01 -1.26 -0.46 113.70 119.13 1oio s SER 20 Ca -0.08 -0.30 -0.19 0.00 1.31 0.00 0.00 55.95 56.69 1oio s SER 20 Cb -0.13 -0.87 0.04 0.00 0.21 0.00 0.00 66.02 65.27 1oio s SER 20 CO 0.02 0.24 0.55 -0.55 0.41 0.00 0.00 173.24 173.92 1oio s SER 21 N -1.65 -0.34 -0.03 2.44 0.15 -0.94 -4.95 113.70 108.38 1oio s SER 21 Ca 0.18 -0.35 0.02 0.00 0.70 0.00 0.00 55.95 56.49 1oio s SER 21 Cb -0.11 0.59 0.01 0.00 -1.71 0.00 0.00 66.02 64.80 1oio s SER 21 CO 0.09 -1.04 -0.08 -0.89 1.20 0.00 0.00 173.24 172.51 1oio s THR 22 N -3.84 0.76 0.07 6.45 2.01 -1.26 -1.35 115.64 118.47 1oio s THR 22 Ca 0.07 -0.32 -0.15 0.00 0.31 0.00 0.00 61.69 61.59 1oio s THR 22 Cb -0.01 -0.69 0.03 0.00 0.01 0.00 0.00 72.50 71.83 1oio s THR 22 CO -0.05 0.25 0.35 -1.38 -0.69 0.00 0.00 174.62 173.09 1oio s HIS 23 N 0.36 -0.15 0.41 4.92 -3.43 -0.63 -4.98 115.29 111.79 1oio s HIS 23 Ca -0.06 -0.03 -0.24 0.00 -0.80 0.00 0.00 55.06 53.94 1oio s HIS 23 Cb -0.10 0.15 -0.09 0.00 -1.43 0.00 0.00 32.58 31.12 1oio s HIS 23 CO 0.01 -0.57 1.07 0.00 -2.00 0.00 0.00 174.74 173.25 1oio s ALA 24 N -2.95 3.07 0.48 -1.38 0.00 -1.26 -1.38 121.76 118.34 1oio s ALA 24 Ca -0.02 0.75 0.14 0.00 0.00 0.00 0.00 51.96 52.83 1oio s ALA 24 Cb 0.00 -3.29 1.12 0.00 0.00 0.00 0.00 23.12 20.95 1oio s ALA 24 CO -0.06 -0.30 2.09 1.98 0.00 0.00 0.00 175.76 179.47 1oio h MET 25 N 2.42 0.09 0.00 0.00 4.05 -1.50 -0.98 114.93 119.00 1oio h MET 25 Ca -0.48 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 58.93 1oio h MET 25 Cb 1.22 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 32.00 1oio h MET 25 CO 0.62 0.12 0.00 -0.25 0.23 0.00 0.00 176.91 177.63 1oio n ASP 26 N -4.47 0.00 -4.06 1.39 8.00 -1.26 -4.28 116.55 111.87 1oio n ASP 26 Ca -0.02 -0.29 -0.43 0.00 0.71 0.00 0.00 54.79 54.76 1oio n ASP 26 Cb 0.13 -0.22 0.01 0.00 -0.02 0.00 0.00 41.12 41.02 1oio n ASP 26 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1oio n ASN 27 N -1.22 6.18 -4.10 -2.24 4.05 -0.37 -4.98 115.26 112.58 1oio n ASN 27 Ca 0.15 -3.32 -0.18 0.00 0.45 0.00 0.00 54.58 51.68 1oio n ASN 27 Cb 0.20 -1.31 -0.13 0.00 1.23 0.00 0.00 39.78 39.77 1oio n ASN 27 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 1oio s LEU 28 N -2.32 2.15 0.46 1.20 1.43 -1.26 -3.69 118.68 116.65 1oio s LEU 28 Ca 0.32 -0.40 -0.24 0.00 -1.03 0.00 0.00 54.13 52.78 1oio s LEU 28 Cb 0.02 -0.48 -0.07 0.00 0.03 0.00 0.00 46.19 45.69 1oio s LEU 28 CO 0.07 0.00 1.21 -2.16 0.23 0.00 0.00 176.35 175.71 1oio s PRO 29 N -0.99 3.74 -0.19 1.29 0.04 -1.26 -5.14 135.00 132.48 1oio s PRO 29 Ca -0.00 1.91 -0.03 0.00 0.04 0.00 0.00 61.00 62.91 1oio s PRO 29 Cb -0.07 -2.48 -0.01 0.00 0.04 0.00 0.00 34.50 31.98 1oio s PRO 29 CO 0.01 -0.60 -0.05 0.12 0.04 0.00 0.00 177.00 176.51 1oio s PHE 30 N -1.45 2.95 -0.24 0.56 5.36 -0.94 -4.93 117.98 119.30 1oio s PHE 30 Ca 0.63 -0.71 -0.15 0.00 -0.96 0.00 0.00 56.93 55.74 1oio s PHE 30 Cb -0.32 -2.03 -0.04 0.00 -0.34 0.00 0.00 43.02 40.29 1oio s PHE 30 CO 0.39 -0.36 0.36 0.08 -1.46 0.00 0.00 175.22 174.23 1oio s VAL 31 N 1.02 5.21 0.32 3.12 1.01 -1.26 -0.52 120.40 129.29 1oio s VAL 31 Ca 0.00 0.57 -0.29 0.00 0.00 0.00 0.00 61.98 62.27 1oio s VAL 31 Cb -0.15 -3.68 -0.10 0.00 0.00 0.00 0.00 36.38 32.45 1oio s VAL 31 CO 0.00 0.22 1.29 -0.31 0.00 0.00 0.00 175.10 176.30 1oio s TYR 32 N 1.64 3.11 -1.15 5.22 1.51 -0.28 -4.93 117.35 122.47 1oio s TYR 32 Ca 0.16 1.41 -0.16 0.00 -1.01 0.00 0.00 57.07 57.47 1oio s TYR 32 Cb -0.15 -3.65 0.14 0.00 -0.11 0.00 0.00 41.96 38.19 1oio s TYR 32 CO 0.08 -1.78 1.42 1.21 -1.11 0.00 0.00 175.55 175.37 1oio s ASN 33 N -0.43 6.90 0.00 2.29 2.47 -1.26 -4.60 114.94 120.31 1oio s ASN 33 Ca 0.49 -2.61 0.16 0.00 0.42 0.00 0.00 52.86 51.33 1oio s ASN 33 Cb -0.39 -2.44 0.39 0.00 -1.45 0.00 0.00 41.25 37.36 1oio s ASN 33 CO 0.51 -0.93 1.31 0.35 -3.72 0.00 0.00 177.10 174.61 1oio n THR 34 N 5.23 0.78 -0.24 -5.21 -2.24 -1.26 -5.06 114.28 106.28 1oio n THR 34 Ca 0.36 -0.89 0.00 0.00 -2.27 0.00 0.00 64.05 61.25 1oio n THR 34 Cb 0.45 0.69 0.00 0.00 -2.10 0.00 0.00 70.33 69.37 1oio n THR 34 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1oio n GLY 35 N 1.02 3.31 1.05 3.38 0.00 -1.26 -1.17 105.19 111.52 1oio n GLY 35 Ca 0.16 -0.09 0.08 0.00 0.00 0.00 0.00 46.02 46.17 1oio n GLY 35 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1oio n TYR 36 N 14.00 0.90 -0.00 1.61 0.53 -1.26 -4.63 117.16 128.30 1oio n TYR 36 Ca 0.00 -0.59 0.00 0.00 -1.02 0.00 0.00 57.90 56.29 1oio n TYR 36 Cb 0.00 -0.13 0.31 0.00 -1.03 0.00 0.00 39.34 38.49 1oio n TYR 36 CO 0.00 0.00 0.00 -0.91 -1.02 0.00 0.00 176.86 174.93 1oio h ASN 37 N 2.89 0.50 -2.62 7.72 2.35 -1.49 -3.24 115.58 121.69 1oio h ASN 37 Ca 0.00 -0.08 -0.77 0.00 -0.55 0.00 0.00 56.30 54.89 1oio h ASN 37 Cb 1.08 -0.13 -0.22 0.00 0.05 0.00 0.00 38.32 39.10 1oio h ASN 37 CO 0.10 0.55 1.08 -0.38 -1.65 0.00 0.00 177.43 177.13 1oio n ILE 38 N -4.30 4.55 -3.56 2.81 5.41 -1.26 -4.37 119.36 118.64 1oio n ILE 38 Ca 0.02 -5.08 -0.05 0.00 1.00 0.00 0.00 62.75 58.64 1oio n ILE 38 Cb 0.23 -2.43 -0.00 0.00 -0.71 0.00 0.00 39.64 36.72 1oio n ILE 38 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1oio n GLY 39 N 2.99 2.26 3.04 7.39 0.00 -1.22 -1.16 105.19 118.48 1oio n GLY 39 Ca 0.31 -1.31 -0.12 0.00 0.00 0.00 0.00 46.02 44.90 1oio n GLY 39 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1oio s TYR 40 N -5.15 -0.09 -0.11 1.61 5.04 0.66 -1.51 117.35 117.80 1oio s TYR 40 Ca 0.09 0.22 -0.15 0.00 -2.44 0.00 0.00 57.07 54.79 1oio s TYR 40 Cb -0.01 0.02 0.04 0.00 0.35 0.00 0.00 41.96 42.35 1oio s TYR 40 CO 0.07 -0.13 0.39 -1.14 -1.34 0.00 0.00 175.55 173.39 1oio s GLN 41 N -0.35 0.55 -0.26 4.97 0.74 -1.26 -1.06 119.66 122.98 1oio s GLN 41 Ca -0.04 0.34 -0.07 0.00 0.05 0.00 0.00 55.36 55.63 1oio s GLN 41 Cb -0.03 0.26 0.13 0.00 1.10 0.00 0.00 33.01 34.47 1oio s GLN 41 CO 0.00 -0.10 0.54 1.21 -0.55 0.00 0.00 175.29 176.39 1oio s ASN 42 N -0.28 -0.77 0.13 6.67 3.84 -0.82 -5.02 114.94 118.69 1oio s ASN 42 Ca -0.04 1.16 0.23 0.00 0.21 0.00 0.00 52.86 54.42 1oio s ASN 42 Cb -0.03 1.87 0.91 0.00 -0.55 0.00 0.00 41.25 43.45 1oio s ASN 42 CO 0.02 -0.24 1.72 0.00 -2.79 0.00 0.00 177.10 175.81 1oio n ALA 43 N 5.42 1.97 -3.75 1.71 0.00 -1.26 -1.23 120.51 123.37 1oio n ALA 43 Ca -0.08 -0.02 -0.29 0.00 0.00 0.00 0.00 53.44 53.05 1oio n ALA 43 Cb 0.50 -1.39 -0.13 0.00 0.00 0.00 0.00 19.45 18.43 1oio n ALA 43 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1oio s ASN 44 N -3.76 3.74 -0.12 0.00 0.01 -1.26 -2.99 114.94 110.57 1oio s ASN 44 Ca 0.09 -2.98 0.05 0.00 -0.71 0.00 0.00 52.86 49.31 1oio s ASN 44 Cb 0.12 -1.18 -0.11 0.00 0.41 0.00 0.00 41.25 40.49 1oio s ASN 44 CO 0.45 -0.21 -0.04 0.52 -1.51 0.00 0.00 177.10 176.31 1oio n VAL 45 N 3.09 0.75 -4.27 1.60 0.31 -0.40 -4.02 118.33 115.40 1oio n VAL 45 Ca 0.13 -0.38 -0.18 0.00 -0.01 0.00 0.00 64.34 63.90 1oio n VAL 45 Cb 0.36 -0.84 -0.13 0.00 -0.91 0.00 0.00 33.84 32.31 1oio n VAL 45 CO 0.00 0.00 0.00 0.26 -1.32 0.00 0.00 176.83 175.77 1oio s TRP 46 N -2.26 0.90 -0.18 3.52 0.51 -0.63 0.18 118.94 120.98 1oio s TRP 46 Ca -0.11 -0.30 -0.08 0.00 -2.12 0.00 0.00 56.10 53.48 1oio s TRP 46 Cb 0.04 -0.55 -0.04 0.00 -0.81 0.00 0.00 33.47 32.11 1oio s TRP 46 CO 0.38 -0.01 0.09 0.50 -0.51 0.00 0.00 176.95 177.40 1oio s ARG 47 N -0.87 4.01 0.11 4.98 3.52 0.14 -0.46 118.95 130.39 1oio s ARG 47 Ca -0.00 -0.29 0.05 0.00 -0.13 0.00 0.00 55.73 55.35 1oio s ARG 47 Cb -0.06 -3.27 -0.04 0.00 -1.56 0.00 0.00 34.95 30.01 1oio s ARG 47 CO 0.00 0.31 -0.12 0.96 -0.81 0.00 0.00 175.30 175.64 1oio s ILE 48 N 0.29 1.17 0.29 4.11 -4.36 -0.61 -1.25 121.20 120.84 1oio s ILE 48 Ca 0.05 -1.67 -0.19 0.00 -0.26 0.00 0.00 60.65 58.58 1oio s ILE 48 Cb -0.12 -1.44 0.06 0.00 1.25 0.00 0.00 42.46 42.21 1oio s ILE 48 CO -0.00 -0.47 0.89 -0.94 0.24 0.00 0.00 174.94 174.66 1oio s SER 49 N -2.42 -0.01 -1.22 4.36 1.04 -0.44 -0.77 113.70 114.24 1oio s SER 49 Ca 0.07 -0.92 -0.27 0.00 0.48 0.00 0.00 55.95 55.31 1oio s SER 49 Cb -0.04 0.70 0.03 0.00 0.10 0.00 0.00 66.02 66.80 1oio s SER 49 CO 0.02 -1.38 0.67 0.61 0.98 0.00 0.00 173.24 174.14 1oio n GLY 50 N -0.59 -0.82 2.83 7.32 0.00 -0.97 -1.09 105.19 111.85 1oio n GLY 50 Ca -0.06 0.36 0.00 0.00 0.00 0.00 0.00 46.02 46.32 1oio n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oio n GLY 51 N -1.99 0.61 3.75 -0.02 0.00 -0.33 -4.31 105.19 102.90 1oio n GLY 51 Ca -0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 1oio n GLY 51 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1oio s PHE 52 N -2.67 2.78 -0.15 1.61 5.36 -0.84 -4.61 117.98 119.48 1oio s PHE 52 Ca 0.00 0.81 -0.01 0.00 -0.96 0.00 0.00 56.93 56.77 1oio s PHE 52 Cb 0.00 -4.04 -0.02 0.00 -0.34 0.00 0.00 43.02 38.62 1oio s PHE 52 CO 0.00 -3.49 -0.10 0.00 -1.46 0.00 0.00 175.22 170.17 1oio s VAL 54 N 0.49 0.03 0.00 0.00 0.11 -0.26 -1.83 120.40 118.94 1oio s VAL 54 Ca -0.08 -0.26 0.00 0.00 -2.93 0.00 0.00 61.98 58.71 1oio s VAL 54 Cb -0.15 -0.44 0.00 0.00 -1.53 0.00 0.00 36.38 34.26 1oio s VAL 54 CO 0.04 -0.15 0.00 0.61 -3.33 0.00 0.00 175.10 172.27 1oio n GLY 55 N 2.22 5.22 2.90 6.54 0.00 -0.10 -1.64 105.19 120.35 1oio n GLY 55 Ca -0.17 -1.87 -0.13 0.00 0.00 0.00 0.00 46.02 43.85 1oio n GLY 55 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1oio s LEU 56 N 0.00 2.01 0.09 0.99 1.43 -0.62 -0.68 118.68 121.89 1oio s LEU 56 Ca 0.00 -0.05 0.09 0.00 -1.03 0.00 0.00 54.13 53.14 1oio s LEU 56 Cb 0.00 -0.08 -0.04 0.00 0.03 0.00 0.00 46.19 46.11 1oio s LEU 56 CO 0.00 0.01 -0.20 -1.81 0.23 0.00 0.00 176.35 174.58 1oio s ASP 57 N -0.10 3.73 0.06 2.29 1.01 0.10 0.06 116.67 123.82 1oio s ASP 57 Ca -0.00 -0.54 0.06 0.00 0.71 0.00 0.00 52.55 52.78 1oio s ASP 57 Cb -0.01 -0.51 -0.03 0.00 1.01 0.00 0.00 42.92 43.39 1oio s ASP 57 CO -0.00 0.21 -0.17 -0.83 0.21 0.00 0.00 175.17 174.59 1oio s GLY 58 N -1.82 0.98 -0.02 0.21 0.00 0.24 -0.72 107.32 106.19 1oio s GLY 58 Ca 0.16 -1.02 0.00 0.00 0.00 0.00 0.00 44.72 43.87 1oio s GLY 58 CO 0.07 -1.00 0.00 1.25 0.00 0.00 0.00 173.10 173.42 1oio s LYS 59 N -1.47 0.23 -0.16 2.90 2.20 0.23 -0.49 119.74 123.18 1oio s LYS 59 Ca 0.03 0.07 -0.05 0.00 -0.36 0.00 0.00 55.97 55.66 1oio s LYS 59 Cb -0.09 -0.40 -0.03 0.00 -1.51 0.00 0.00 37.83 35.80 1oio s LYS 59 CO 0.02 -0.11 -0.00 0.08 -0.36 0.00 0.00 175.35 174.98 1oio s VAL 60 N 0.87 4.19 -1.37 4.02 1.01 -1.26 -0.45 120.40 127.41 1oio s VAL 60 Ca -0.08 -0.25 0.22 0.00 0.00 0.00 0.00 61.98 61.87 1oio s VAL 60 Cb -0.12 -2.86 -0.10 0.00 0.00 0.00 0.00 36.38 33.30 1oio s VAL 60 CO -0.02 0.48 1.06 0.47 0.00 0.00 0.00 175.10 177.10 1oio n ASP 61 N 3.51 1.26 -4.76 3.32 8.00 0.39 -4.25 116.55 124.02 1oio n ASP 61 Ca -0.17 -1.07 -0.36 0.00 0.71 0.00 0.00 54.79 53.90 1oio n ASP 61 Cb 0.52 0.70 0.02 0.00 -0.02 0.00 0.00 41.12 42.34 1oio n ASP 61 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1oio s LEU 62 N -2.81 3.71 0.50 0.64 1.43 -1.23 -4.96 118.68 115.97 1oio s LEU 62 Ca 0.13 2.33 -0.21 0.00 -1.03 0.00 0.00 54.13 55.34 1oio s LEU 62 Cb 0.17 -4.57 -0.07 0.00 0.03 0.00 0.00 46.19 41.75 1oio s LEU 62 CO 0.74 -1.45 1.15 -2.84 0.23 0.00 0.00 176.35 174.18 1oio s PRO 63 N -3.28 3.55 -0.25 1.29 0.02 -1.26 -4.80 135.00 130.27 1oio s PRO 63 Ca 0.75 1.70 -0.24 0.00 0.02 0.00 0.00 61.00 63.24 1oio s PRO 63 Cb -0.28 -2.21 -0.01 0.00 0.02 0.00 0.00 34.50 32.02 1oio s PRO 63 CO 0.31 -0.71 0.80 0.08 -0.33 0.00 0.00 177.00 177.15 1oio s VAL 64 N -1.65 4.85 -0.96 3.83 1.01 -1.26 -0.62 120.40 125.59 1oio s VAL 64 Ca 0.68 1.45 0.08 0.00 0.00 0.00 0.00 61.98 64.19 1oio s VAL 64 Cb -0.26 -4.10 0.10 0.00 0.00 0.00 0.00 36.38 32.12 1oio s VAL 64 CO 0.31 -0.09 0.85 1.33 0.00 0.00 0.00 175.10 177.50 1oio n VAL 65 N 5.30 0.21 -1.38 2.92 0.24 -0.04 -4.89 118.33 120.68 1oio n VAL 65 Ca 0.04 -0.60 0.00 0.00 -2.04 0.00 0.00 64.34 61.74 1oio n VAL 65 Cb 0.48 1.03 0.00 0.00 -1.47 0.00 0.00 33.84 33.88 1oio n VAL 65 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1oio n GLY 66 N 0.42 -1.31 3.00 7.63 0.00 -1.04 -4.97 105.19 108.93 1oio n GLY 66 Ca 0.06 -0.97 -0.11 0.00 0.00 0.00 0.00 46.02 45.00 1oio n GLY 66 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1oio s SER 67 N -1.76 0.05 -0.11 1.61 0.15 -1.26 -0.75 113.70 111.63 1oio s SER 67 Ca 0.00 -0.15 -0.04 0.00 0.70 0.00 0.00 55.95 56.46 1oio s SER 67 Cb 0.00 0.15 0.06 0.00 -1.71 0.00 0.00 66.02 64.52 1oio s SER 67 CO 0.00 -0.21 0.22 -0.22 1.20 0.00 0.00 173.24 174.23 1oio s LEU 68 N -0.82 -0.20 -1.56 3.45 2.96 0.16 -4.84 118.68 117.83 1oio s LEU 68 Ca -0.09 0.46 -0.12 0.00 -0.22 0.00 0.00 54.13 54.16 1oio s LEU 68 Cb -0.05 0.52 0.09 0.00 0.50 0.00 0.00 46.19 47.24 1oio s LEU 68 CO 0.00 -0.25 0.75 0.47 -1.32 0.00 0.00 176.35 176.01 1oio n ASP 69 N 5.34 -2.88 0.00 3.68 8.00 -1.26 -1.33 116.55 128.10 1oio n ASP 69 Ca -0.05 -0.93 0.00 0.00 0.71 0.00 0.00 54.79 54.52 1oio n ASP 69 Cb 0.50 -3.25 0.00 0.00 -0.02 0.00 0.00 41.12 38.35 1oio n ASP 69 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1oio n GLY 70 N -1.64 0.75 3.27 0.44 0.00 -1.26 -5.04 105.19 101.72 1oio n GLY 70 Ca -0.05 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.80 1oio n GLY 70 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1oio s GLN 71 N -0.15 1.12 0.45 1.61 -2.07 -0.44 -4.90 119.66 115.28 1oio s GLN 71 Ca 0.00 -1.40 -0.21 0.00 -1.82 0.00 0.00 55.36 51.92 1oio s GLN 71 Cb 0.00 -0.89 -0.09 0.00 -1.09 0.00 0.00 33.01 30.94 1oio s GLN 71 CO 0.00 0.15 1.02 -1.12 -1.32 0.00 0.00 175.29 174.02 1oio s SER 72 N -2.91 6.60 -0.32 12.60 0.01 -0.90 0.39 113.70 129.17 1oio s SER 72 Ca 0.15 1.89 -0.09 0.00 1.31 0.00 0.00 55.95 59.21 1oio s SER 72 Cb -0.02 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.65 1oio s SER 72 CO 0.03 -0.60 0.14 -0.63 0.41 0.00 0.00 173.24 172.59 1oio s ILE 73 N -1.95 4.46 0.14 1.44 1.01 0.08 -4.56 121.20 121.81 1oio s ILE 73 Ca 0.64 -0.54 -0.13 0.00 0.00 0.00 0.00 60.65 60.62 1oio s ILE 73 Cb -0.16 -3.31 -0.07 0.00 0.01 0.00 0.00 42.46 38.94 1oio s ILE 73 CO 0.20 0.03 0.51 -0.31 0.00 0.00 0.00 174.94 175.37 1oio s TYR 74 N 1.58 3.58 0.01 3.97 1.51 -0.08 -0.86 117.35 127.06 1oio s TYR 74 Ca 0.04 0.97 -0.18 0.00 -1.01 0.00 0.00 57.07 56.89 1oio s TYR 74 Cb -0.17 -2.31 -0.06 0.00 -0.11 0.00 0.00 41.96 39.31 1oio s TYR 74 CO 0.05 0.43 0.52 0.20 -1.11 0.00 0.00 175.55 175.64 1oio s GLY 75 N -1.80 2.57 0.05 0.71 0.00 0.21 -0.62 107.32 108.44 1oio s GLY 75 Ca 0.38 -0.07 -0.01 0.00 0.00 0.00 0.00 44.72 45.02 1oio s GLY 75 CO 0.19 0.49 -0.03 1.04 0.00 0.00 0.00 173.10 174.79 1oio n LEU 76 N 2.26 0.91 -4.35 0.66 4.77 -0.96 -4.44 117.00 115.84 1oio n LEU 76 Ca -0.10 0.12 -0.20 0.00 -0.03 0.00 0.00 56.01 55.80 1oio n LEU 76 Cb 0.51 -0.29 -0.09 0.00 -2.33 0.00 0.00 43.42 41.23 1oio n LEU 76 CO 0.41 -0.52 -0.17 0.42 -1.33 0.00 0.00 177.39 176.21 1oio s THR 77 N -2.06 0.25 0.47 -5.08 -4.23 -0.49 -4.98 115.64 99.52 1oio s THR 77 Ca -0.02 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 58.65 1oio s THR 77 Cb 0.01 -2.47 0.22 0.00 1.34 0.00 0.00 72.50 71.60 1oio s THR 77 CO 0.03 0.00 2.05 -0.08 -0.54 0.00 0.00 174.62 176.09 1oio h GLU 78 N 2.11 0.00 0.00 3.99 4.81 -2.01 -3.05 114.58 120.43 1oio h GLU 78 Ca -0.31 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 58.86 1oio h GLU 78 Cb 1.25 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.62 1oio h GLU 78 CO 0.47 0.12 -2.06 -0.85 -0.73 0.00 0.00 179.01 175.96 1oio n GLU 79 N -4.33 0.67 -5.16 1.92 0.00 -1.26 -4.50 120.64 107.97 1oio n GLU 79 Ca -0.03 -0.16 -0.31 0.00 0.00 0.00 0.00 57.16 56.66 1oio n GLU 79 Cb 0.19 -1.51 -0.17 0.00 0.00 0.00 0.00 31.44 29.95 1oio n GLU 79 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1oio s VAL 80 N -3.32 1.96 0.25 3.84 1.01 -1.15 -0.03 120.40 122.97 1oio s VAL 80 Ca -0.08 -0.97 0.01 0.00 0.00 0.00 0.00 61.98 60.93 1oio s VAL 80 Cb 0.12 -1.69 0.01 0.00 0.00 0.00 0.00 36.38 34.82 1oio s VAL 80 CO 0.89 0.54 0.06 0.61 0.00 0.00 0.00 175.10 177.19 1oio n GLY 81 N 3.43 3.61 3.26 4.51 0.00 0.16 -1.39 105.19 118.76 1oio n GLY 81 Ca -0.19 -2.27 -0.12 0.00 0.00 0.00 0.00 46.02 43.43 1oio n GLY 81 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1oio s LEU 82 N 0.00 0.41 -0.13 0.99 2.96 0.21 -0.92 118.68 122.20 1oio s LEU 82 Ca 0.04 0.78 -0.06 0.00 -0.22 0.00 0.00 54.13 54.67 1oio s LEU 82 Cb -0.00 1.28 -0.04 0.00 0.50 0.00 0.00 46.19 47.93 1oio s LEU 82 CO 0.03 -0.15 0.09 -0.76 -1.32 0.00 0.00 176.35 174.24 1oio s LEU 83 N 0.51 4.07 0.02 -0.68 1.43 -0.21 -0.90 118.68 122.92 1oio s LEU 83 Ca -0.03 0.30 0.05 0.00 -1.03 0.00 0.00 54.13 53.42 1oio s LEU 83 Cb -0.04 -1.99 -0.02 0.00 0.03 0.00 0.00 46.19 44.18 1oio s LEU 83 CO -0.03 0.35 -0.14 -0.63 0.23 0.00 0.00 176.35 176.13 1oio s ILE 84 N -0.68 1.09 -0.03 -0.59 1.01 -1.26 -1.44 121.20 119.30 1oio s ILE 84 Ca 0.12 -0.80 0.03 0.00 0.00 0.00 0.00 60.65 60.00 1oio s ILE 84 Cb -0.12 -0.95 0.00 0.00 0.01 0.00 0.00 42.46 41.40 1oio s ILE 84 CO 0.02 0.14 -0.10 0.26 0.00 0.00 0.00 174.94 175.26 1oio s TRP 85 N -0.60 1.02 0.02 3.97 0.51 -0.27 -0.69 118.94 122.89 1oio s TRP 85 Ca 0.03 -0.25 0.02 0.00 -2.12 0.00 0.00 56.10 53.78 1oio s TRP 85 Cb -0.07 -0.72 -0.01 0.00 -0.81 0.00 0.00 33.47 31.86 1oio s TRP 85 CO 0.00 -0.10 -0.06 -1.64 -0.51 0.00 0.00 176.95 174.64 1oio s MET 86 N 0.14 0.47 0.00 4.98 -1.94 -0.43 -1.78 119.30 120.74 1oio s MET 86 Ca -0.03 -0.45 0.00 0.00 -1.71 0.00 0.00 55.69 53.50 1oio s MET 86 Cb -0.08 -0.35 0.00 0.00 2.01 0.00 0.00 34.83 36.41 1oio s MET 86 CO 0.01 0.08 0.00 0.41 -0.01 0.00 0.00 175.02 175.51 1oio n GLY 87 N 2.26 -0.60 3.49 -0.03 0.00 -0.50 0.66 105.19 110.46 1oio n GLY 87 Ca -0.17 -0.61 -0.29 0.00 0.00 0.00 0.00 46.02 44.94 1oio n GLY 87 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1oio s ASP 88 N -4.00 0.71 0.20 1.61 2.15 -1.26 -0.93 116.67 115.15 1oio s ASP 88 Ca 0.00 1.15 -0.20 0.00 0.43 0.00 0.00 52.55 53.93 1oio s ASP 88 Cb 0.00 -1.75 0.16 0.00 -0.30 0.00 0.00 42.92 41.03 1oio s ASP 88 CO 0.00 -4.31 1.57 0.74 -0.17 0.00 0.00 175.17 173.00 1oio h THR 89 N -2.70 0.10 -2.85 1.71 2.02 -1.72 -3.08 112.91 106.39 1oio h THR 89 Ca -0.54 0.00 -0.54 0.00 0.77 0.00 0.00 66.41 66.10 1oio h THR 89 Cb 1.33 0.10 0.01 0.00 -1.74 0.00 0.00 68.15 67.86 1oio h THR 89 CO 0.45 0.00 0.87 0.20 0.37 0.00 0.00 175.52 177.41 1oio s ASN 90 N -5.24 6.76 0.43 4.18 0.01 -1.26 -4.38 114.94 115.44 1oio s ASN 90 Ca -0.14 2.28 0.19 0.00 -0.71 0.00 0.00 52.86 54.48 1oio s ASN 90 Cb 0.17 -2.57 1.13 0.00 0.41 0.00 0.00 41.25 40.39 1oio s ASN 90 CO 0.70 -0.77 1.84 1.88 -1.51 0.00 0.00 177.10 179.24 1oio h TYR 91 N 7.80 0.51 0.00 2.20 0.99 -1.96 0.27 116.97 126.78 1oio h TYR 91 Ca -0.40 0.02 -0.00 0.00 2.00 0.00 0.00 58.73 60.34 1oio h TYR 91 Cb 1.19 -0.15 -0.00 0.00 1.00 0.00 0.00 36.73 38.77 1oio h TYR 91 CO 0.74 0.11 -0.01 0.66 -0.00 0.00 0.00 178.16 179.67 1oio h SER 92 N 0.36 0.00 -0.25 3.88 4.64 -1.92 -0.13 113.55 120.13 1oio h SER 92 Ca 0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.81 1oio h SER 92 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 1oio h SER 92 CO -0.18 0.01 0.00 0.54 -0.87 0.00 0.00 176.83 176.33 1oio n ARG 93 N -3.21 1.84 -1.81 4.77 1.74 0.93 -4.94 116.66 115.99 1oio n ARG 93 Ca -0.02 -1.28 -0.41 0.00 -0.77 0.00 0.00 57.85 55.36 1oio n ARG 93 Cb 0.12 -1.38 -0.01 0.00 -1.02 0.00 0.00 32.46 30.18 1oio n ARG 93 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1oio s GLY 94 N -1.39 2.64 -0.22 -0.13 0.00 -0.06 -4.22 107.32 103.94 1oio s GLY 94 Ca 0.31 1.56 -0.09 0.00 0.00 0.00 0.00 44.72 46.50 1oio s GLY 94 CO 0.24 2.36 0.12 -1.59 0.00 0.00 0.00 173.10 174.23 1oio s THR 95 N -0.70 5.14 0.16 0.90 2.01 0.21 -4.77 115.64 118.59 1oio s THR 95 Ca 0.57 0.10 -0.32 0.00 0.31 0.00 0.00 61.69 62.35 1oio s THR 95 Cb -0.47 -3.36 -0.11 0.00 0.01 0.00 0.00 72.50 68.57 1oio s THR 95 CO 0.57 0.40 1.70 0.00 -0.69 0.00 0.00 174.62 176.60 1oio s ALA 96 N 0.74 3.83 0.02 7.40 0.00 -1.26 -1.31 121.76 131.18 1oio s ALA 96 Ca 0.06 1.46 -0.17 0.00 0.00 0.00 0.00 51.96 53.31 1oio s ALA 96 Cb -0.13 -3.69 -0.06 0.00 0.00 0.00 0.00 23.12 19.24 1oio s ALA 96 CO 0.02 -0.97 0.48 -1.64 0.00 0.00 0.00 175.76 173.64 1oio s MET 97 N 1.68 4.07 0.00 0.00 -1.94 0.13 -4.94 119.30 118.30 1oio s MET 97 Ca 0.75 0.55 0.00 0.00 -1.71 0.00 0.00 55.69 55.28 1oio s MET 97 Cb -0.46 -3.25 -0.00 0.00 2.01 0.00 0.00 34.83 33.13 1oio s MET 97 CO 0.33 0.62 -0.02 -1.12 -0.01 0.00 0.00 175.02 174.82 1oio s SER 98 N -0.94 0.19 0.17 3.03 0.01 -1.26 -2.12 113.70 112.78 1oio s SER 98 Ca 0.26 -0.07 0.00 0.00 1.31 0.00 0.00 55.95 57.45 1oio s SER 98 Cb -0.18 -0.01 0.00 0.00 0.21 0.00 0.00 66.02 66.04 1oio s SER 98 CO 0.15 -0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.40 1oio n GLY 99 N 2.91 -1.96 0.10 3.44 0.00 -1.26 -4.60 105.19 103.82 1oio n GLY 99 Ca -0.13 -1.37 0.07 0.00 0.00 0.00 0.00 46.02 44.58 1oio n GLY 99 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1oio n ASN 100 N -0.47 2.33 -4.94 1.61 5.03 -1.26 -4.37 115.26 113.19 1oio n ASN 100 Ca 0.00 -2.74 -0.19 0.00 0.87 0.00 0.00 54.58 52.52 1oio n ASN 100 Cb 0.05 -0.30 -0.01 0.00 -1.02 0.00 0.00 39.78 38.49 1oio n ASN 100 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 1oio s SER 101 N -2.24 5.61 -0.11 6.41 0.01 -1.26 -4.65 113.70 117.48 1oio s SER 101 Ca 0.23 -0.39 -0.29 0.00 1.31 0.00 0.00 55.95 56.81 1oio s SER 101 Cb 0.20 -0.96 -0.04 0.00 0.21 0.00 0.00 66.02 65.43 1oio s SER 101 CO 0.03 -0.51 1.48 0.26 0.41 0.00 0.00 173.24 174.91 1oio s TRP 102 N -2.28 2.35 0.07 2.43 0.52 -1.26 -4.46 118.94 116.31 1oio s TRP 102 Ca 0.46 0.55 0.08 0.00 0.02 0.00 0.00 56.10 57.22 1oio s TRP 102 Cb -0.08 -3.74 -0.03 0.00 -1.15 0.00 0.00 33.47 28.47 1oio s TRP 102 CO 0.30 -2.90 -0.20 -1.21 0.02 0.00 0.00 176.95 172.95 1oio s GLU 103 N 3.82 1.89 -0.21 4.98 0.41 0.35 -4.88 118.70 125.07 1oio s GLU 103 Ca 0.65 -1.08 -0.29 0.00 -0.41 0.00 0.00 54.97 53.84 1oio s GLU 103 Cb -0.28 -2.11 -0.03 0.00 -1.78 0.00 0.00 34.13 29.94 1oio s GLU 103 CO 0.23 0.51 1.61 1.21 -0.49 0.00 0.00 175.26 178.33 1oio s ASN 104 N -1.63 6.41 0.00 -0.19 3.84 -1.26 0.80 114.94 122.90 1oio s ASN 104 Ca 0.15 1.64 0.09 0.00 0.21 0.00 0.00 52.86 54.95 1oio s ASN 104 Cb -0.10 -2.53 0.04 0.00 -0.55 0.00 0.00 41.25 38.10 1oio s ASN 104 CO 0.06 -1.23 0.70 1.33 -2.79 0.00 0.00 177.10 175.16 1oio n VAL 105 N 6.34 0.00 -3.34 -5.21 0.24 0.11 -4.88 118.33 111.59 1oio n VAL 105 Ca 0.19 -0.46 -0.02 0.00 -2.04 0.00 0.00 64.34 62.01 1oio n VAL 105 Cb 0.45 1.15 -0.04 0.00 -1.47 0.00 0.00 33.84 33.93 1oio n VAL 105 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 1oio s PHE 106 N -1.01 -1.26 0.55 6.34 5.36 -0.87 -4.29 117.98 122.79 1oio s PHE 106 Ca 0.09 1.54 0.27 0.00 -0.96 0.00 0.00 56.93 57.87 1oio s PHE 106 Cb 0.07 0.42 1.45 0.00 -0.34 0.00 0.00 43.02 44.62 1oio s PHE 106 CO 0.17 -0.76 1.97 0.66 -1.46 0.00 0.00 175.22 175.80 1oio h SER 107 N 8.07 0.00 -5.00 6.13 4.64 -1.91 -1.66 113.55 123.83 1oio h SER 107 Ca -0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 1oio h SER 107 Cb 1.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1oio h SER 107 CO 0.23 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.80 1oio n GLY 108 N -1.62 1.07 3.51 -0.77 0.00 -1.26 -4.63 105.19 101.49 1oio n GLY 108 Ca 0.11 -2.06 -0.10 0.00 0.00 0.00 0.00 46.02 43.97 1oio n GLY 108 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1oio s TRP 109 N -1.64 -0.08 -0.13 1.61 1.48 -0.65 -4.94 118.94 114.59 1oio s TRP 109 Ca 0.00 -0.26 0.03 0.00 -1.06 0.00 0.00 56.10 54.81 1oio s TRP 109 Cb 0.00 0.36 0.00 0.00 -1.16 0.00 0.00 33.47 32.67 1oio s TRP 109 CO 0.00 -0.90 -0.22 0.00 -4.06 0.00 0.00 176.95 171.77 1oio s VAL 111 N 0.63 3.92 0.00 0.00 0.11 -0.20 -4.96 120.40 119.90 1oio s VAL 111 Ca -0.11 0.62 0.00 0.00 -2.93 0.00 0.00 61.98 59.56 1oio s VAL 111 Cb -0.16 -3.40 0.00 0.00 -1.53 0.00 0.00 36.38 31.29 1oio s VAL 111 CO 0.02 -0.81 0.00 0.61 -3.33 0.00 0.00 175.10 171.59 1oio n GLY 112 N -2.11 2.17 2.39 6.54 0.00 -1.26 -2.85 105.19 110.07 1oio n GLY 112 Ca 0.07 -1.75 -0.39 0.00 0.00 0.00 0.00 46.02 43.95 1oio n GLY 112 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1oio n ASN 113 N 0.00 8.41 -3.52 1.61 5.15 -1.26 -1.18 115.26 124.46 1oio n ASN 113 Ca 0.00 -2.85 -0.05 0.00 -0.60 0.00 0.00 54.58 51.08 1oio n ASN 113 Cb 0.00 -1.46 0.00 0.00 -0.53 0.00 0.00 39.78 37.79 1oio n ASN 113 CO 0.00 0.00 0.00 -0.72 1.40 0.00 0.00 177.26 177.94 1oio s TYR 114 N 0.51 -0.04 -0.12 1.20 -0.85 -1.26 -4.91 117.35 111.88 1oio s TYR 114 Ca 0.62 -0.39 -0.05 0.00 -0.52 0.00 0.00 57.07 56.74 1oio s TYR 114 Cb 0.18 0.71 -0.04 0.00 0.38 0.00 0.00 41.96 43.20 1oio s TYR 114 CO -0.08 -1.08 0.05 0.08 -1.52 0.00 0.00 175.55 173.00 1oio s VAL 115 N -2.95 4.74 0.00 -3.49 1.01 -1.26 -3.13 120.40 115.31 1oio s VAL 115 Ca 0.15 -0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.05 1oio s VAL 115 Cb -0.03 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.29 1oio s VAL 115 CO 0.06 0.57 0.00 -0.24 0.00 0.00 0.00 175.10 175.49 1oio n SER 116 N 2.50 0.00 -4.16 3.32 2.88 0.05 -5.01 113.62 113.20 1oio n SER 116 Ca -0.18 -0.34 -0.10 0.00 -1.33 0.00 0.00 58.87 56.91 1oio n SER 116 Cb 0.54 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.90 1oio n SER 116 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1oio s THR 117 N -1.93 0.25 -0.10 2.46 -4.23 -1.26 -1.57 115.64 109.26 1oio s THR 117 Ca 0.00 -1.91 0.02 0.00 -1.18 0.00 0.00 61.69 58.62 1oio s THR 117 Cb 0.00 -1.99 0.01 0.00 1.34 0.00 0.00 72.50 71.86 1oio s THR 117 CO 0.00 -0.54 -0.17 -1.58 -0.54 0.00 0.00 174.62 171.80 1oio s GLN 118 N -4.00 2.35 0.00 3.99 2.00 0.39 -4.88 119.66 119.51 1oio s GLN 118 Ca 0.22 -0.62 0.00 0.00 -2.00 0.00 0.00 55.36 52.96 1oio s GLN 118 Cb 0.07 -1.94 0.00 0.00 0.80 0.00 0.00 33.01 31.95 1oio s GLN 118 CO 0.01 -0.01 0.00 0.41 -0.50 0.00 0.00 175.29 175.20 1oio n GLY 119 N 4.03 5.73 3.78 2.59 0.00 -1.16 -1.27 105.19 118.89 1oio n GLY 119 Ca -0.20 -2.07 -0.03 0.00 0.00 0.00 0.00 46.02 43.72 1oio n GLY 119 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1oio s LEU 120 N 0.00 -0.12 0.02 0.99 0.05 -0.37 -4.16 118.68 115.09 1oio s LEU 120 Ca 0.00 -0.47 -0.25 0.00 0.05 0.00 0.00 54.13 53.46 1oio s LEU 120 Cb 0.00 2.12 0.06 0.00 -2.05 0.00 0.00 46.19 46.32 1oio s LEU 120 CO 0.00 -0.92 0.56 -0.94 -0.55 0.00 0.00 176.35 174.51 1oio s SER 121 N -3.05 -0.50 -0.07 1.48 1.04 -0.11 -1.94 113.70 110.55 1oio s SER 121 Ca 0.15 0.32 -0.05 0.00 0.48 0.00 0.00 55.95 56.85 1oio s SER 121 Cb -0.01 0.50 0.03 0.00 0.10 0.00 0.00 66.02 66.64 1oio s SER 121 CO 0.03 -0.69 0.17 -0.69 0.98 0.00 0.00 173.24 173.04 1oio s VAL 122 N -2.08 -0.02 -0.02 5.02 1.01 -0.22 -1.42 120.40 122.66 1oio s VAL 122 Ca -0.07 0.08 -0.12 0.00 0.00 0.00 0.00 61.98 61.86 1oio s VAL 122 Cb -0.01 -0.26 0.02 0.00 0.00 0.00 0.00 36.38 36.13 1oio s VAL 122 CO 0.01 0.03 0.26 -1.38 0.00 0.00 0.00 175.10 174.03 1oio s HIS 123 N 0.60 -0.14 0.16 5.22 -3.43 -0.73 -0.25 115.29 116.72 1oio s HIS 123 Ca -0.04 0.24 0.01 0.00 -0.80 0.00 0.00 55.06 54.46 1oio s HIS 123 Cb -0.06 0.06 -0.04 0.00 -1.43 0.00 0.00 32.58 31.11 1oio s HIS 123 CO -0.03 -0.33 0.03 0.14 -2.00 0.00 0.00 174.74 172.55 1oio s VAL 124 N -1.14 0.44 -0.02 -5.38 -7.23 -0.31 -1.11 120.40 105.65 1oio s VAL 124 Ca -0.12 -1.95 0.00 0.00 -1.81 0.00 0.00 61.98 58.10 1oio s VAL 124 Cb -0.05 -2.13 0.02 0.00 0.56 0.00 0.00 36.38 34.78 1oio s VAL 124 CO 0.03 -0.44 -0.00 -0.13 -0.31 0.00 0.00 175.10 174.25 1oio s ARG 125 N -3.98 0.21 0.58 4.82 0.52 -0.52 -4.47 118.95 116.12 1oio s ARG 125 Ca 0.25 0.04 -0.19 0.00 -0.52 0.00 0.00 55.73 55.31 1oio s ARG 125 Cb 0.07 -0.35 -0.04 0.00 0.52 0.00 0.00 34.95 35.15 1oio s ARG 125 CO 0.04 -0.08 1.17 -2.14 0.02 0.00 0.00 175.30 174.31 1oio s PRO 126 N 0.68 3.07 -0.07 3.54 0.02 -1.26 -1.04 135.00 139.94 1oio s PRO 126 Ca -0.06 1.72 0.01 0.00 0.02 0.00 0.00 61.00 62.68 1oio s PRO 126 Cb -0.09 -1.95 0.02 0.00 0.02 0.00 0.00 34.50 32.49 1oio s PRO 126 CO -0.01 -1.10 -0.05 0.08 -0.33 0.00 0.00 177.00 175.58 1oio s VAL 127 N -1.72 0.69 -0.04 3.83 1.01 -0.10 -1.13 120.40 122.95 1oio s VAL 127 Ca 0.75 -0.16 -0.27 0.00 0.00 0.00 0.00 61.98 62.30 1oio s VAL 127 Cb -0.27 -0.72 -0.03 0.00 0.00 0.00 0.00 36.38 35.35 1oio s VAL 127 CO 0.32 0.28 0.86 -0.63 0.00 0.00 0.00 175.10 175.92 1oio s ILE 128 N 1.22 4.94 -0.22 2.22 -1.09 0.32 0.36 121.20 128.95 1oio s ILE 128 Ca -0.06 1.78 0.07 0.00 -2.23 0.00 0.00 60.65 60.21 1oio s ILE 128 Cb -0.14 -4.19 -0.18 0.00 -1.58 0.00 0.00 42.46 36.37 1oio s ILE 128 CO -0.02 0.18 -0.12 0.18 -1.23 0.00 0.00 174.94 173.93 1oio n LEU 129 N 4.00 2.03 -4.55 2.97 4.77 0.96 -2.21 117.00 124.97 1oio n LEU 129 Ca 0.03 -0.09 -0.28 0.00 -0.03 0.00 0.00 56.01 55.64 1oio n LEU 129 Cb 0.51 -0.43 -0.10 0.00 -2.33 0.00 0.00 43.42 41.07 1oio n LEU 129 CO 0.50 0.77 -0.43 -0.54 -1.33 0.00 0.00 177.39 176.35 1oio s LYS 130 N -2.47 2.00 0.26 3.23 1.02 -1.26 -4.81 119.74 117.70 1oio s LYS 130 Ca -0.25 -1.20 -0.29 0.00 0.02 0.00 0.00 55.97 54.25 1oio s LYS 130 Cb 0.07 -2.18 -0.09 0.00 -0.52 0.00 0.00 37.83 35.12 1oio s LYS 130 CO 0.62 0.46 1.17 -0.98 -0.92 0.00 0.00 175.35 175.71 1oio s ARG 131 N -2.52 4.54 -0.03 1.68 1.70 -1.26 -4.97 118.95 118.08 1oio s ARG 131 Ca 0.22 1.91 -0.30 0.00 -0.47 0.00 0.00 55.73 57.09 1oio s ARG 131 Cb -0.10 -3.18 0.11 0.00 -0.57 0.00 0.00 34.95 31.21 1oio s ARG 131 CO 0.14 0.04 1.06 1.21 -1.08 0.00 0.00 175.30 176.66 1oio s ASN 132 N -0.47 -0.21 1.02 -2.89 2.47 -1.26 -5.17 114.94 108.43 1oio s ASN 132 Ca 0.48 -0.10 -0.17 0.00 0.42 0.00 0.00 52.86 53.49 1oio s ASN 132 Cb -0.34 0.30 0.22 0.00 -1.45 0.00 0.00 41.25 39.98 1oio s ASN 132 CO 0.42 -0.51 1.26 -0.94 -3.72 0.00 0.00 177.10 173.61 1oio s SER 133 N -2.56 2.56 0.23 -4.21 1.04 -1.26 -4.87 113.70 104.63 1oio s SER 133 Ca 0.09 0.38 -0.31 0.00 0.48 0.00 0.00 55.95 56.59 1oio s SER 133 Cb -0.00 -0.48 -0.14 0.00 0.10 0.00 0.00 66.02 65.50 1oio s SER 133 CO -0.05 -3.09 1.26 -1.20 0.98 0.00 0.00 173.24 171.14 1oio n SER 134 N -4.02 2.08 -3.69 7.02 7.64 -1.26 -4.78 113.62 116.61 1oio n SER 134 Ca 0.14 1.15 -0.08 0.00 1.01 0.00 0.00 58.87 61.10 1oio n SER 134 Cb 0.59 -1.34 -0.02 0.00 -1.01 0.00 0.00 64.21 62.43 1oio n SER 134 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1oio s ALA 135 N -0.33 -1.48 -0.14 -0.43 0.00 -0.18 -4.95 121.76 114.25 1oio s ALA 135 Ca 0.67 0.13 -0.03 0.00 0.00 0.00 0.00 51.96 52.74 1oio s ALA 135 Cb -0.72 0.77 -0.03 0.00 0.00 0.00 0.00 23.12 23.14 1oio s ALA 135 CO 0.53 -0.93 -0.05 -1.14 0.00 0.00 0.00 175.76 174.17 1oio s GLN 136 N -3.65 3.55 -0.04 0.00 0.74 -1.26 -1.12 119.66 117.88 1oio s GLN 136 Ca 0.08 -0.54 0.05 0.00 0.05 0.00 0.00 55.36 55.01 1oio s GLN 136 Cb -0.03 -2.85 -0.02 0.00 1.10 0.00 0.00 33.01 31.20 1oio s GLN 136 CO -0.01 0.29 -0.20 0.71 -0.55 0.00 0.00 175.29 175.53 1oio s TYR 137 N 0.23 2.53 -0.07 1.67 1.51 0.02 -4.96 117.35 118.28 1oio s TYR 137 Ca -0.03 -0.33 0.02 0.00 -1.01 0.00 0.00 57.07 55.72 1oio s TYR 137 Cb -0.14 -1.58 -0.03 0.00 -0.11 0.00 0.00 41.96 40.10 1oio s TYR 137 CO 0.03 0.05 -0.10 -1.12 -1.11 0.00 0.00 175.55 173.31 1oio s SER 138 N -0.61 4.38 -0.09 2.29 0.01 -1.26 -0.47 113.70 117.95 1oio s SER 138 Ca 0.09 -0.11 0.04 0.00 1.31 0.00 0.00 55.95 57.29 1oio s SER 138 Cb -0.11 -1.11 -0.00 0.00 0.21 0.00 0.00 66.02 65.01 1oio s SER 138 CO 0.00 0.33 -0.24 -0.69 0.41 0.00 0.00 173.24 173.06 1oio s VAL 139 N -0.65 2.04 0.71 3.43 1.01 -0.53 -5.02 120.40 121.39 1oio s VAL 139 Ca 0.10 -1.02 -0.11 0.00 0.00 0.00 0.00 61.98 60.94 1oio s VAL 139 Cb -0.11 -1.76 0.01 0.00 0.00 0.00 0.00 36.38 34.52 1oio s VAL 139 CO 0.01 0.56 1.08 -1.10 0.00 0.00 0.00 175.10 175.65 1oio s GLN 140 N 0.24 2.86 0.09 2.72 -1.52 -1.26 -2.34 119.66 120.46 1oio s GLN 140 Ca -0.16 0.60 -0.31 0.00 -1.95 0.00 0.00 55.36 53.54 1oio s GLN 140 Cb -0.17 -2.01 -0.08 0.00 -0.22 0.00 0.00 33.01 30.52 1oio s GLN 140 CO 0.08 -1.06 1.61 0.21 -0.25 0.00 0.00 175.29 175.87 1oio s LYS 141 N -5.26 4.21 -0.02 2.91 2.20 -1.26 -4.46 119.74 118.06 1oio s LYS 141 Ca 0.58 2.30 0.00 0.00 -0.36 0.00 0.00 55.97 58.50 1oio s LYS 141 Cb -0.12 -3.48 0.02 0.00 -1.51 0.00 0.00 37.83 32.74 1oio s LYS 141 CO 0.53 -0.68 0.00 0.99 -0.36 0.00 0.00 175.35 175.83 1oio s THR 142 N 2.20 0.08 0.22 3.43 2.01 -0.48 -4.96 115.64 118.14 1oio s THR 142 Ca 0.72 0.08 -0.30 0.00 0.31 0.00 0.00 61.69 62.50 1oio s THR 142 Cb -0.40 -0.16 -0.09 0.00 0.01 0.00 0.00 72.50 71.86 1oio s THR 142 CO 0.32 0.09 1.38 -0.44 -0.69 0.00 0.00 174.62 175.27 1oio s SER 143 N 0.70 6.77 -0.27 3.53 0.01 -1.26 0.30 113.70 123.48 1oio s SER 143 Ca -0.06 2.53 -0.15 0.00 1.31 0.00 0.00 55.95 59.58 1oio s SER 143 Cb -0.09 -2.62 -0.13 0.00 0.21 0.00 0.00 66.02 63.39 1oio s SER 143 CO -0.02 -0.61 -0.28 -0.38 0.41 0.00 0.00 173.24 172.36 1oio n ILE 144 N 2.49 1.53 -0.74 1.44 2.08 0.71 -4.72 119.36 122.15 1oio n ILE 144 Ca 0.06 -0.35 0.00 0.00 0.56 0.00 0.00 62.75 63.03 1oio n ILE 144 Cb 0.41 -1.89 0.00 0.00 -0.75 0.00 0.00 39.64 37.41 1oio n ILE 144 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1oio n GLY 145 N 1.29 -0.61 3.44 7.39 0.00 -1.21 -0.46 105.19 115.04 1oio n GLY 145 Ca -0.52 -0.63 -0.12 0.00 0.00 0.00 0.00 46.02 44.75 1oio n GLY 145 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1oio s SER 146 N -4.00 0.33 -0.02 1.61 0.01 0.40 -1.27 113.70 110.76 1oio s SER 146 Ca 0.00 -1.24 0.01 0.00 1.31 0.00 0.00 55.95 56.03 1oio s SER 146 Cb 0.00 0.55 0.01 0.00 0.21 0.00 0.00 66.02 66.79 1oio s SER 146 CO 0.00 -1.10 -0.04 -0.63 0.41 0.00 0.00 173.24 171.88 1oio s ILE 147 N -3.76 0.38 0.05 1.44 1.01 -0.57 -0.60 121.20 119.16 1oio s ILE 147 Ca 0.30 -0.13 0.09 0.00 0.00 0.00 0.00 60.65 60.91 1oio s ILE 147 Cb 0.02 -0.38 -0.03 0.00 0.01 0.00 0.00 42.46 42.08 1oio s ILE 147 CO 0.14 0.15 -0.24 0.00 0.00 0.00 0.00 174.94 174.99 1oio s ARG 148 N 0.37 1.55 0.40 2.79 1.70 0.11 -1.32 118.95 124.55 1oio s ARG 148 Ca -0.04 -1.06 -0.19 0.00 -0.47 0.00 0.00 55.73 53.97 1oio s ARG 148 Cb -0.08 -1.74 -0.10 0.00 -0.57 0.00 0.00 34.95 32.46 1oio s ARG 148 CO -0.00 0.44 0.89 0.00 -1.08 0.00 0.00 175.30 175.55 1oio s MET 149 N -1.32 4.16 -0.24 3.89 0.23 0.36 -0.73 119.30 125.66 1oio s MET 149 Ca 0.10 0.98 -0.03 0.00 -1.03 0.00 0.00 55.69 55.72 1oio s MET 149 Cb -0.09 -2.25 0.08 0.00 -1.53 0.00 0.00 34.83 31.03 1oio s MET 149 CO 0.02 0.02 0.07 -0.98 -2.03 0.00 0.00 175.02 172.12 1oio s ARG 150 N -3.15 0.57 0.58 3.16 1.70 0.14 -4.81 118.95 117.14 1oio s ARG 150 Ca 0.60 -0.58 -0.19 0.00 -0.47 0.00 0.00 55.73 55.08 1oio s ARG 150 Cb -0.09 -1.93 -0.04 0.00 -0.57 0.00 0.00 34.95 32.31 1oio s ARG 150 CO 0.15 -0.78 1.23 -2.14 -1.08 0.00 0.00 175.30 172.67 1oio s PRO 151 N 1.85 3.03 0.33 3.89 0.02 -1.26 -0.92 135.00 141.94 1oio s PRO 151 Ca 0.03 1.89 -0.04 0.00 0.02 0.00 0.00 61.00 62.91 1oio s PRO 151 Cb -0.17 -2.01 0.00 0.00 0.02 0.00 0.00 34.50 32.35 1oio s PRO 151 CO -0.16 -1.17 0.47 1.52 -0.33 0.00 0.00 177.00 177.33 1oio s TYR 152 N -1.53 0.98 -1.74 6.54 -0.85 -0.76 -4.84 117.35 115.15 1oio s TYR 152 Ca 0.76 -1.23 0.00 0.00 -0.52 0.00 0.00 57.07 56.07 1oio s TYR 152 Cb -0.32 -0.05 0.00 0.00 0.38 0.00 0.00 41.96 41.97 1oio s TYR 152 CO 0.35 -1.12 0.00 0.09 -1.52 0.00 0.00 175.55 173.35 1oio n ASN 153 N -1.29 -5.68 0.00 -0.18 3.02 -1.26 -1.38 115.26 108.49 1oio n ASN 153 Ca 0.00 0.02 0.00 0.00 -0.03 0.00 0.00 54.58 54.57 1oio n ASN 153 Cb 0.62 -4.72 0.00 0.00 -0.61 0.00 0.00 39.78 35.06 1oio n ASN 153 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1oio n GLY 154 N -0.98 1.31 3.73 7.41 0.00 -1.26 -5.00 105.19 110.40 1oio n GLY 154 Ca -0.23 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.45 1oio n GLY 154 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1oio s SER 155 N -3.03 4.41 -0.01 1.61 0.01 -0.48 -5.02 113.70 111.19 1oio s SER 155 Ca 0.00 2.24 0.02 0.00 1.31 0.00 0.00 55.95 59.52 1oio s SER 155 Cb 0.00 -2.58 -0.00 0.00 0.21 0.00 0.00 66.02 63.65 1oio s SER 155 CO 0.00 -2.11 -0.06 -0.55 0.41 0.00 0.00 173.24 170.93 1oio s SER 156 N -2.23 0.73 0.40 2.44 0.15 -1.26 -4.29 113.70 109.64 1oio s SER 156 Ca 0.72 -0.11 0.21 0.00 0.70 0.00 0.00 55.95 57.47 1oio s SER 156 Cb -0.26 -0.10 0.38 0.00 -1.71 0.00 0.00 66.02 64.33 1oio s SER 156 CO 0.45 0.07 1.61 0.00 1.20 0.00 0.00 173.24 176.56 1oio h ALA 157 N 6.08 0.90 -0.81 5.45 0.00 -1.95 -3.46 119.26 125.46 1oio h ALA 157 Ca -0.29 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1oio h ALA 157 Cb 1.19 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1oio h ALA 157 CO 0.50 0.23 0.00 0.41 0.00 0.00 0.00 179.25 180.39 1oio n GLY 158 N 0.97 3.19 0.51 0.00 0.00 -1.26 -0.73 105.19 107.87 1oio n GLY 158 Ca 0.03 -0.16 0.14 0.00 0.00 0.00 0.00 46.02 46.02 1oio n GLY 158 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1oio n SER 159 N 3.06 1.58 -4.75 1.61 3.41 -1.26 -4.94 113.62 112.33 1oio n SER 159 Ca 0.00 -1.53 -0.41 0.00 -0.26 0.00 0.00 58.87 56.67 1oio n SER 159 Cb 0.00 -0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 63.92 1oio n SER 159 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1oio s VAL 160 N -1.99 2.72 0.10 -3.33 1.01 0.10 -4.92 120.40 114.08 1oio s VAL 160 Ca 0.37 0.62 -0.34 0.00 0.00 0.00 0.00 61.98 62.64 1oio s VAL 160 Cb 0.21 -3.40 -0.13 0.00 0.00 0.00 0.00 36.38 33.06 1oio s VAL 160 CO 0.33 0.11 1.69 1.67 0.00 0.00 0.00 175.10 178.89 1oio n GLN 161 N 2.12 2.25 -0.01 2.72 7.27 -1.26 -4.87 117.38 125.59 1oio n GLN 161 Ca 0.06 0.82 0.07 0.00 0.07 0.00 0.00 57.00 58.01 1oio n GLN 161 Cb 0.41 -2.62 -0.12 0.00 2.41 0.00 0.00 30.24 30.32 1oio n GLN 161 CO 0.00 0.00 0.00 0.25 0.07 0.00 0.00 177.06 177.38 1oio n THR 162 N 4.00 0.08 -5.14 1.69 -2.24 -1.26 -4.74 114.28 106.66 1oio n THR 162 Ca 0.18 -0.38 -0.31 0.00 -2.27 0.00 0.00 64.05 61.28 1oio n THR 162 Cb 0.30 0.08 -0.15 0.00 -2.10 0.00 0.00 70.33 68.46 1oio n THR 162 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1oio s THR 163 N -3.02 2.25 0.14 4.28 2.01 -1.26 -0.49 115.64 119.55 1oio s THR 163 Ca -0.06 -1.11 0.06 0.00 0.31 0.00 0.00 61.69 60.89 1oio s THR 163 Cb 0.10 -1.82 -0.04 0.00 0.01 0.00 0.00 72.50 70.74 1oio s THR 163 CO 0.64 0.53 -0.14 0.68 -0.69 0.00 0.00 174.62 175.64 1oio s VAL 164 N -0.68 1.43 0.28 3.82 -7.23 -0.44 -4.88 120.40 112.70 1oio s VAL 164 Ca 0.11 -1.84 0.10 0.00 -1.81 0.00 0.00 61.98 58.54 1oio s VAL 164 Cb -0.10 -1.67 -0.05 0.00 0.56 0.00 0.00 36.38 35.13 1oio s VAL 164 CO 0.00 -0.46 -0.07 0.20 -0.31 0.00 0.00 175.10 174.47 1oio s ASN 165 N -2.65 4.19 -0.06 4.85 0.01 0.30 -1.50 114.94 120.08 1oio s ASN 165 Ca 0.12 -0.80 0.02 0.00 -0.71 0.00 0.00 52.86 51.49 1oio s ASN 165 Cb -0.04 -0.64 0.01 0.00 0.41 0.00 0.00 41.25 41.00 1oio s ASN 165 CO 0.04 -0.00 -0.11 -0.36 -1.51 0.00 0.00 177.10 175.16 1oio s PHE 166 N -2.40 1.28 -0.13 2.20 0.40 -0.40 -1.29 117.98 117.65 1oio s PHE 166 Ca 0.31 -0.44 0.02 0.00 -0.60 0.00 0.00 56.93 56.21 1oio s PHE 166 Cb -0.06 -0.96 -0.00 0.00 0.51 0.00 0.00 43.02 42.52 1oio s PHE 166 CO 0.18 -0.24 -0.19 0.45 0.70 0.00 0.00 175.22 176.12 1oio s SER 167 N 0.65 3.45 -0.16 1.36 0.15 0.54 -0.21 113.70 119.48 1oio s SER 167 Ca -0.13 -0.50 -0.29 0.00 0.70 0.00 0.00 55.95 55.73 1oio s SER 167 Cb -0.15 -1.50 -0.01 0.00 -1.71 0.00 0.00 66.02 62.65 1oio s SER 167 CO 0.03 0.12 1.21 -0.22 1.20 0.00 0.00 173.24 175.57 1oio s LEU 168 N 0.61 4.18 0.56 3.45 2.96 0.15 -0.38 118.68 130.21 1oio s LEU 168 Ca -0.10 1.65 -0.19 0.00 -0.22 0.00 0.00 54.13 55.26 1oio s LEU 168 Cb -0.16 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 42.94 1oio s LEU 168 CO 0.03 -0.72 1.13 0.20 -1.32 0.00 0.00 176.35 175.67 1oio s ASN 169 N 1.75 5.61 0.58 3.68 0.01 -0.75 -1.39 114.94 124.43 1oio s ASN 169 Ca 0.53 2.15 -0.20 0.00 -0.71 0.00 0.00 52.86 54.63 1oio s ASN 169 Cb -0.21 -2.58 -0.04 0.00 0.41 0.00 0.00 41.25 38.84 1oio s ASN 169 CO 0.14 -1.29 1.32 -2.84 -1.51 0.00 0.00 177.10 172.91 1oio s PRO 170 N -3.42 2.97 0.22 -0.60 0.02 -1.26 -4.77 135.00 128.17 1oio s PRO 170 Ca 0.72 2.12 -0.15 0.00 0.02 0.00 0.00 61.00 63.72 1oio s PRO 170 Cb -0.23 -2.11 0.01 0.00 0.02 0.00 0.00 34.50 32.19 1oio s PRO 170 CO 0.29 -1.29 0.49 -0.59 -0.33 0.00 0.00 177.00 175.58 1oio s PHE 171 N -1.37 0.13 -0.01 6.54 -0.12 -0.99 -0.25 117.98 121.91 1oio s PHE 171 Ca 0.75 -0.50 0.06 0.00 -0.05 0.00 0.00 56.93 57.19 1oio s PHE 171 Cb -0.38 0.28 -0.02 0.00 -0.63 0.00 0.00 43.02 42.28 1oio s PHE 171 CO 0.43 -0.95 -0.20 0.99 -0.05 0.00 0.00 175.22 175.44 1oio s THR 172 N -3.95 1.60 -0.20 -4.49 2.01 -0.32 -1.45 115.64 108.84 1oio s THR 172 Ca 0.16 -0.87 -0.03 0.00 0.31 0.00 0.00 61.69 61.25 1oio s THR 172 Cb -0.01 -1.33 -0.01 0.00 0.01 0.00 0.00 72.50 71.17 1oio s THR 172 CO 0.03 0.44 -0.07 -0.76 -0.69 0.00 0.00 174.62 173.58 1oio s LEU 173 N -0.49 2.83 -0.72 4.42 1.02 0.38 -0.80 118.68 125.32 1oio s LEU 173 Ca 0.08 -0.39 -0.11 0.00 0.02 0.00 0.00 54.13 53.73 1oio s LEU 173 Cb -0.08 -1.70 0.19 0.00 0.02 0.00 0.00 46.19 44.61 1oio s LEU 173 CO -0.01 0.02 0.63 0.20 0.02 0.00 0.00 176.35 177.21 1oio s ASN 174 N 1.25 6.28 -0.27 2.29 0.01 0.40 -0.80 114.94 124.09 1oio s ASN 174 Ca 0.03 -2.54 -0.18 0.00 -0.71 0.00 0.00 52.86 49.46 1oio s ASN 174 Cb -0.14 -2.12 -0.02 0.00 0.41 0.00 0.00 41.25 39.37 1oio s ASN 174 CO -0.02 -0.58 0.52 -0.62 -1.51 0.00 0.00 177.10 174.89 1oio s ASP 175 N 2.08 6.43 -0.17 -1.22 2.15 -0.28 -2.21 116.67 123.46 1oio s ASP 175 Ca 0.15 0.49 -0.06 0.00 0.43 0.00 0.00 52.55 53.55 1oio s ASP 175 Cb -0.16 -2.28 -0.04 0.00 -0.30 0.00 0.00 42.92 40.14 1oio s ASP 175 CO -0.05 -0.31 0.05 -0.89 -0.17 0.00 0.00 175.17 173.79 1oio s THR 176 N 2.34 4.65 -0.10 1.71 2.01 -0.46 -1.01 115.64 124.79 1oio s THR 176 Ca 0.21 -0.09 0.02 0.00 0.31 0.00 0.00 61.69 62.14 1oio s THR 176 Cb -0.16 -3.07 -0.02 0.00 0.01 0.00 0.00 72.50 69.27 1oio s THR 176 CO 0.10 0.49 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.67 1oio s VAL 177 N 0.17 2.85 -0.48 3.82 1.01 -1.26 -1.60 120.40 124.91 1oio s VAL 177 Ca 0.04 -0.75 0.04 0.00 0.00 0.00 0.00 61.98 61.30 1oio s VAL 177 Cb -0.12 -2.16 0.03 0.00 0.00 0.00 0.00 36.38 34.13 1oio s VAL 177 CO 0.01 0.55 0.62 0.35 0.00 0.00 0.00 175.10 176.63