#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k5u n LEU 3 N 0.00 -0.77 -3.47 0.99 7.94 -1.26 -4.84 117.00 115.59 2k5u n LEU 3 Ca 0.00 1.74 -0.29 0.00 -1.11 0.00 0.00 56.01 56.35 2k5u n LEU 3 Cb 0.00 -4.37 -0.12 0.00 0.53 0.00 0.00 43.42 39.46 2k5u n LEU 3 CO 0.00 -3.31 -0.32 0.12 -1.11 0.00 0.00 177.39 172.77 2k5u s PHE 4 N -2.74 0.72 0.17 1.96 5.36 -1.26 -4.91 117.98 117.28 2k5u s PHE 4 Ca 0.00 -1.61 0.00 0.00 -0.96 0.00 0.00 56.93 54.36 2k5u s PHE 4 Cb 0.00 -0.93 0.00 0.00 -0.34 0.00 0.00 43.02 41.75 2k5u s PHE 4 CO 0.00 -0.83 0.00 0.00 -1.46 0.00 0.00 175.22 172.93 2k5u n ALA 5 N 4.07 0.00 -2.76 11.12 0.00 -1.26 -5.16 120.51 126.52 2k5u n ALA 5 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.22 2k5u n ALA 5 Cb 0.37 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.75 2k5u n ALA 5 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2k5u s SER 6 N -2.00 4.16 0.37 0.00 0.01 -1.26 -5.06 113.70 109.92 2k5u s SER 6 Ca 0.00 -1.66 0.00 0.00 1.31 0.00 0.00 55.95 55.60 2k5u s SER 6 Cb 0.00 0.57 0.00 0.00 0.21 0.00 0.00 66.02 66.80 2k5u s SER 6 CO 0.00 -0.88 0.00 0.29 0.41 0.00 0.00 173.24 173.06 2k5u n LYS 7 N -1.29 -4.31 -0.11 12.44 4.01 -1.26 -4.97 118.16 122.66 2k5u n LYS 7 Ca -0.19 3.15 -0.16 0.00 -0.51 0.00 0.00 58.31 60.59 2k5u n LYS 7 Cb 0.67 -3.49 -0.10 0.00 -0.51 0.00 0.00 35.03 31.60 2k5u n LYS 7 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 2k5u n LEU 8 N -0.07 2.87 -4.56 -0.35 4.77 -1.26 -4.83 117.00 113.58 2k5u n LEU 8 Ca 0.00 -0.09 -0.35 0.00 -0.03 0.00 0.00 56.01 55.55 2k5u n LEU 8 Cb 0.00 -0.78 -0.04 0.00 -2.33 0.00 0.00 43.42 40.27 2k5u n LEU 8 CO 0.00 0.85 1.41 0.72 -1.33 0.00 0.00 177.39 179.04 2k5u s PHE 9 N -2.45 2.02 0.00 -1.77 -0.71 -1.26 -4.74 117.98 109.07 2k5u s PHE 9 Ca -0.31 0.21 0.00 0.00 -1.04 0.00 0.00 56.93 55.79 2k5u s PHE 9 Cb 0.08 -4.30 0.00 0.00 -1.21 0.00 0.00 43.02 37.60 2k5u s PHE 9 CO 0.51 -1.96 0.00 -1.13 -1.34 0.00 0.00 175.22 171.30 2k5u n SER 10 N 11.83 0.00 -0.57 1.98 3.41 -1.26 -4.91 113.62 124.10 2k5u n SER 10 Ca 0.29 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 58.90 2k5u n SER 10 Cb 0.49 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.44 2k5u n SER 10 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2k5u n ASN 11 N 0.00 0.01 -4.55 4.04 0.23 -1.26 -5.06 115.26 108.66 2k5u n ASN 11 Ca 0.00 -1.59 -0.36 0.00 -0.53 0.00 0.00 54.58 52.10 2k5u n ASN 11 Cb 0.00 -0.10 -0.04 0.00 -2.08 0.00 0.00 39.78 37.56 2k5u n ASN 11 CO 0.00 0.00 0.00 -1.48 -0.93 0.00 0.00 177.26 174.85 2k5u s LEU 12 N 0.00 3.25 0.11 -4.53 2.34 -1.26 -4.44 118.68 114.15 2k5u s LEU 12 Ca 0.02 -0.21 0.00 0.00 0.06 0.00 0.00 54.13 54.00 2k5u s LEU 12 Cb 0.02 -2.55 0.00 0.00 -0.56 0.00 0.00 46.19 43.10 2k5u s LEU 12 CO -0.01 -2.34 0.00 2.22 -1.06 0.00 0.00 176.35 175.16 2k5u n PHE 13 N 12.34 -1.28 -1.79 3.48 1.16 -1.26 -4.93 117.46 125.18 2k5u n PHE 13 Ca 0.25 0.23 -0.35 0.00 -1.87 0.00 0.00 57.45 55.70 2k5u n PHE 13 Cb 0.50 0.73 0.05 0.00 -1.61 0.00 0.00 39.48 39.15 2k5u n PHE 13 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2k5u n GLY 14 N 1.01 5.78 0.00 4.97 0.00 -1.26 -4.78 105.19 110.91 2k5u n GLY 14 Ca 0.00 -2.47 0.00 0.00 0.00 0.00 0.00 46.02 43.55 2k5u n GLY 14 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2k5u n ASN 15 N -0.68 0.00 -4.58 1.61 3.02 -1.26 -5.02 115.26 108.36 2k5u n ASN 15 Ca 0.55 0.00 -0.34 0.00 -0.03 0.00 0.00 54.58 54.75 2k5u n ASN 15 Cb 0.49 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.63 2k5u n ASN 15 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2k5u s LYS 16 N 2.26 3.12 0.62 3.52 -0.14 -1.26 -4.95 119.74 122.91 2k5u s LYS 16 Ca 0.00 -1.37 -0.18 0.00 -1.36 0.00 0.00 55.97 53.06 2k5u s LYS 16 Cb 0.00 -5.34 -0.05 0.00 -1.68 0.00 0.00 37.83 30.76 2k5u s LYS 16 CO 0.00 -3.17 0.84 0.39 -0.76 0.00 0.00 175.35 172.65 2k5u n GLU 17 N 8.43 0.70 -4.99 1.68 1.02 -1.26 -4.96 120.64 121.26 2k5u n GLU 17 Ca 0.45 0.28 -0.28 0.00 -0.02 0.00 0.00 57.16 57.59 2k5u n GLU 17 Cb 0.47 -2.05 -0.16 0.00 -0.02 0.00 0.00 31.44 29.67 2k5u n GLU 17 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2k5u s MET 18 N -2.71 2.05 -0.29 3.49 0.23 -1.26 -4.75 119.30 116.06 2k5u s MET 18 Ca 0.74 -0.72 -0.03 0.00 -1.03 0.00 0.00 55.69 54.66 2k5u s MET 18 Cb -0.40 -1.77 0.11 0.00 -1.53 0.00 0.00 34.83 31.24 2k5u s MET 18 CO 0.49 0.30 0.19 1.03 -2.03 0.00 0.00 175.02 175.00 2k5u s ARG 19 N -0.05 0.25 0.35 3.16 3.00 -1.26 -2.84 118.95 121.56 2k5u s ARG 19 Ca -0.03 -0.42 -0.25 0.00 0.00 0.00 0.00 55.73 55.03 2k5u s ARG 19 Cb -0.12 -0.98 -0.10 0.00 0.00 0.00 0.00 34.95 33.75 2k5u s ARG 19 CO 0.03 -1.03 0.97 0.42 0.00 0.00 0.00 175.30 175.68 2k5u s ILE 20 N 2.16 4.14 -0.04 1.52 -1.09 0.26 0.18 121.20 128.33 2k5u s ILE 20 Ca 0.09 1.70 0.03 0.00 -2.23 0.00 0.00 60.65 60.24 2k5u s ILE 20 Cb -0.15 -3.91 0.01 0.00 -1.58 0.00 0.00 42.46 36.82 2k5u s ILE 20 CO -0.34 0.07 -0.11 -0.22 -1.23 0.00 0.00 174.94 173.11 2k5u s LEU 21 N -2.26 1.73 -0.45 2.97 0.20 -0.42 -2.26 118.68 118.18 2k5u s LEU 21 Ca 0.53 -0.25 -0.19 0.00 0.69 0.00 0.00 54.13 54.90 2k5u s LEU 21 Cb -0.18 -0.71 0.03 0.00 -0.43 0.00 0.00 46.19 44.89 2k5u s LEU 21 CO 0.23 0.06 0.59 -0.04 -0.29 0.00 0.00 176.35 176.90 2k5u s MET 22 N 0.37 3.19 0.07 1.98 -1.94 0.14 -1.95 119.30 121.16 2k5u s MET 22 Ca -0.08 -0.60 0.05 0.00 -1.71 0.00 0.00 55.69 53.36 2k5u s MET 22 Cb -0.12 -3.99 -0.03 0.00 2.01 0.00 0.00 34.83 32.70 2k5u s MET 22 CO 0.02 -1.02 -0.13 0.08 -0.01 0.00 0.00 175.02 173.96 2k5u s VAL 23 N 2.60 1.03 -5.00 -6.03 1.01 -1.12 -0.74 120.40 112.15 2k5u s VAL 23 Ca 0.18 -1.30 0.00 0.00 0.00 0.00 0.00 61.98 60.86 2k5u s VAL 23 Cb -0.16 -1.04 0.00 0.00 0.00 0.00 0.00 36.38 35.18 2k5u s VAL 23 CO 0.16 -0.27 0.00 0.61 0.00 0.00 0.00 175.10 175.60 2k5u n GLY 24 N 1.25 0.60 3.69 4.51 0.00 -1.26 -2.61 105.19 111.37 2k5u n GLY 24 Ca -0.21 -1.69 -0.42 0.00 0.00 0.00 0.00 46.02 43.70 2k5u n GLY 24 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k5u s LEU 25 N 0.00 4.38 0.75 0.99 1.43 -1.22 -1.06 118.68 123.94 2k5u s LEU 25 Ca 0.00 2.56 -0.13 0.00 -1.03 0.00 0.00 54.13 55.54 2k5u s LEU 25 Cb 0.00 -3.56 0.05 0.00 0.03 0.00 0.00 46.19 42.71 2k5u s LEU 25 CO 0.00 -0.92 1.12 1.51 0.23 0.00 0.00 176.35 178.29 2k5u s ASP 26 N 2.56 4.43 0.00 2.29 -4.77 -1.26 -2.77 116.67 117.14 2k5u s ASP 26 Ca 0.76 2.01 0.00 0.00 -3.30 0.00 0.00 52.55 52.03 2k5u s ASP 26 Cb -0.41 -2.55 0.00 0.00 -1.09 0.00 0.00 42.92 38.87 2k5u s ASP 26 CO 0.34 -2.09 0.00 0.61 0.70 0.00 0.00 175.17 174.72 2k5u n GLY 27 N -0.54 1.79 0.00 2.12 0.00 -1.26 -4.94 105.19 102.37 2k5u n GLY 27 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2k5u n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k5u n ALA 28 N 0.48 0.00 -2.48 4.61 0.00 -1.12 -4.88 120.51 117.13 2k5u n ALA 28 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2k5u n ALA 28 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.47 2k5u n ALA 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k5u n GLY 29 N 0.24 1.16 0.16 0.00 0.00 -1.26 -4.88 105.19 100.61 2k5u n GLY 29 Ca 0.00 -0.65 0.02 0.00 0.00 0.00 0.00 46.02 45.40 2k5u n GLY 29 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k5u h LYS 30 N 1.13 0.00 0.07 1.61 6.56 -1.91 -1.92 116.57 122.11 2k5u h LYS 30 Ca -0.30 0.00 -0.12 0.00 -1.06 0.00 0.00 60.65 59.16 2k5u h LYS 30 Cb 1.60 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 33.27 2k5u h LYS 30 CO 0.01 0.50 -0.52 1.15 -2.06 0.00 0.00 179.45 178.53 2k5u h THR 31 N 0.00 1.57 -0.46 -0.16 2.02 -1.96 -2.44 112.91 111.48 2k5u h THR 31 Ca -0.01 -2.34 -0.07 0.00 0.77 0.00 0.00 66.41 64.77 2k5u h THR 31 Cb 1.08 3.09 -0.02 0.00 -1.74 0.00 0.00 68.15 70.56 2k5u h THR 31 CO 0.07 0.65 0.01 0.74 0.37 0.00 0.00 175.52 177.35 2k5u h THR 32 N -0.49 1.26 -0.25 3.16 2.02 -1.92 -2.98 112.91 113.72 2k5u h THR 32 Ca -0.08 -1.04 -0.13 0.00 0.77 0.00 0.00 66.41 65.93 2k5u h THR 32 Cb 1.36 1.02 -0.01 0.00 -1.74 0.00 0.00 68.15 68.77 2k5u h THR 32 CO 0.10 0.36 -0.37 1.62 0.37 0.00 0.00 175.52 177.59 2k5u h VAL 33 N 0.66 1.29 -0.20 3.16 3.04 -1.47 -2.85 116.25 119.88 2k5u h VAL 33 Ca 0.13 -1.52 0.04 0.00 -1.01 0.00 0.00 66.70 64.35 2k5u h VAL 33 Cb 0.49 1.51 -0.04 0.00 -2.01 0.00 0.00 31.29 31.23 2k5u h VAL 33 CO 0.02 0.48 -0.08 0.25 -1.01 0.00 0.00 177.57 177.23 2k5u h LEU 34 N 0.47 -0.27 -1.04 3.16 7.12 -1.29 0.40 115.31 123.86 2k5u h LEU 34 Ca 0.05 0.07 -0.03 0.00 0.13 0.00 0.00 57.88 58.10 2k5u h LEU 34 Cb 0.86 0.16 -0.03 0.00 -0.53 0.00 0.00 40.66 41.12 2k5u h LEU 34 CO 0.07 -0.11 0.35 1.88 -0.13 0.00 0.00 178.44 180.51 2k5u h TYR 35 N -0.05 1.02 -0.33 1.25 -1.99 -1.49 -2.52 116.97 112.86 2k5u h TYR 35 Ca 0.11 -0.04 -0.13 0.00 2.00 0.00 0.00 58.73 60.66 2k5u h TYR 35 Cb 0.21 -0.32 -0.01 0.00 2.00 0.00 0.00 36.73 38.60 2k5u h TYR 35 CO -0.24 0.74 -0.33 0.87 -0.00 0.00 0.00 178.16 179.20 2k5u h LYS 36 N 1.03 0.73 -0.07 4.88 1.79 -1.08 -2.69 116.57 121.16 2k5u h LYS 36 Ca 0.25 -0.35 0.02 0.00 -2.18 0.00 0.00 60.65 58.39 2k5u h LYS 36 Cb 0.10 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 30.74 2k5u h LYS 36 CO -0.03 0.96 0.15 1.25 -1.08 0.00 0.00 179.45 180.69 2k5u h LEU 37 N 0.62 0.00 -2.27 2.94 5.85 0.22 -3.47 115.31 119.20 2k5u h LEU 37 Ca 0.07 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.79 2k5u h LEU 37 Cb 0.86 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.89 2k5u h LEU 37 CO 0.07 0.00 -0.82 1.17 -0.34 0.00 0.00 178.44 178.53 2k5u n LYS 38 N -3.37 -2.96 0.00 1.25 0.00 -1.01 -5.02 118.16 107.04 2k5u n LYS 38 Ca -0.01 2.45 0.00 0.00 0.00 0.00 0.00 58.31 60.75 2k5u n LYS 38 Cb 0.23 -4.88 0.00 0.00 0.00 0.00 0.00 35.03 30.38 2k5u n LYS 38 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 2k5u n LEU 39 N 0.51 0.00 0.00 3.14 4.77 -1.26 -5.12 117.00 119.04 2k5u n LEU 39 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 2k5u n LEU 39 Cb 0.05 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 2k5u n LEU 39 CO 0.39 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 2k5u n GLY 40 N 1.97 1.78 2.82 -0.72 0.00 -1.26 -4.96 105.19 104.82 2k5u n GLY 40 Ca 0.00 -0.79 -0.16 0.00 0.00 0.00 0.00 46.02 45.07 2k5u n GLY 40 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2k5u s GLU 41 N 0.00 0.02 -0.01 1.61 2.56 -1.26 -5.10 118.70 116.51 2k5u s GLU 41 Ca 0.00 0.42 -0.13 0.00 0.00 0.00 0.00 54.97 55.26 2k5u s GLU 41 Cb 0.00 -0.29 -0.05 0.00 2.00 0.00 0.00 34.13 35.78 2k5u s GLU 41 CO 0.00 -0.25 0.37 0.54 -0.56 0.00 0.00 175.26 175.36 2k5u s VAL 42 N 1.79 5.09 0.02 3.70 0.11 -1.26 -4.93 120.40 124.92 2k5u s VAL 42 Ca -0.02 0.74 -0.21 0.00 -2.93 0.00 0.00 61.98 59.56 2k5u s VAL 42 Cb -0.12 -3.67 -0.06 0.00 -1.53 0.00 0.00 36.38 31.01 2k5u s VAL 42 CO -0.05 0.57 0.62 -0.63 -3.33 0.00 0.00 175.10 172.28 2k5u s ILE 43 N -1.09 4.84 -0.11 7.04 -1.09 -1.11 -4.90 121.20 124.78 2k5u s ILE 43 Ca 0.23 1.30 -0.09 0.00 -2.23 0.00 0.00 60.65 59.86 2k5u s ILE 43 Cb -0.16 -3.95 -0.04 0.00 -1.58 0.00 0.00 42.46 36.72 2k5u s ILE 43 CO 0.12 0.44 0.20 0.28 -1.23 0.00 0.00 174.94 174.75 2k5u s THR 44 N -0.36 5.39 -0.08 2.92 -1.32 -1.26 -2.39 115.64 118.55 2k5u s THR 44 Ca 0.32 0.36 -0.11 0.00 -1.21 0.00 0.00 61.69 61.05 2k5u s THR 44 Cb -0.19 -3.49 0.02 0.00 -1.51 0.00 0.00 72.50 67.34 2k5u s THR 44 CO 0.18 0.57 0.27 0.42 -2.21 0.00 0.00 174.62 173.86 2k5u s THR 45 N -0.72 0.02 -0.35 5.08 -4.23 -0.27 -4.99 115.64 110.18 2k5u s THR 45 Ca 0.16 -0.18 -0.14 0.00 -1.18 0.00 0.00 61.69 60.35 2k5u s THR 45 Cb -0.13 -0.45 -0.01 0.00 1.34 0.00 0.00 72.50 73.25 2k5u s THR 45 CO 0.05 -0.10 0.30 -0.63 -0.54 0.00 0.00 174.62 173.70 2k5u s ILE 46 N -0.33 5.23 0.14 2.99 1.09 -1.26 0.36 121.20 129.42 2k5u s ILE 46 Ca -0.05 -0.18 -0.13 0.00 -1.10 0.00 0.00 60.65 59.20 2k5u s ILE 46 Cb -0.03 -3.79 -0.01 0.00 -1.06 0.00 0.00 42.46 37.57 2k5u s ILE 46 CO 0.01 -0.09 1.57 1.55 -0.10 0.00 0.00 174.94 177.88 2k5u h PRO 47 N 8.51 0.82 -1.76 2.79 0.13 -1.92 -3.47 132.00 137.08 2k5u h PRO 47 Ca -0.30 -0.28 0.09 0.00 -0.87 0.00 0.00 66.00 64.64 2k5u h PRO 47 Cb 1.15 -0.06 -0.21 0.00 0.13 0.00 0.00 31.00 32.01 2k5u h PRO 47 CO 0.67 0.90 0.53 -0.08 -0.23 0.00 0.00 178.00 179.80 2k5u s THR 48 N -4.91 0.00 0.00 1.56 -1.32 -1.26 -5.06 115.64 104.65 2k5u s THR 48 Ca -0.12 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.36 2k5u s THR 48 Cb 0.11 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.10 2k5u s THR 48 CO 0.82 0.00 0.00 -0.38 -2.21 0.00 0.00 174.62 172.85 2k5u n ILE 49 N 0.44 0.00 -2.89 5.08 2.08 -1.26 -1.60 119.36 121.21 2k5u n ILE 49 Ca -0.10 0.00 -0.31 0.00 0.56 0.00 0.00 62.75 62.90 2k5u n ILE 49 Cb 0.59 0.00 -0.03 0.00 -0.75 0.00 0.00 39.64 39.45 2k5u n ILE 49 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2k5u n GLY 50 N 0.00 5.71 3.43 7.39 0.00 -1.26 -5.03 105.19 115.42 2k5u n GLY 50 Ca 0.00 -2.73 -0.24 0.00 0.00 0.00 0.00 46.02 43.05 2k5u n GLY 50 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2k5u s PHE 51 N -3.64 2.17 -0.03 1.61 0.40 -0.63 -5.10 117.98 112.76 2k5u s PHE 51 Ca 0.46 -0.38 0.02 0.00 -0.60 0.00 0.00 56.93 56.42 2k5u s PHE 51 Cb 0.25 -0.99 0.01 0.00 0.51 0.00 0.00 43.02 42.79 2k5u s PHE 51 CO -0.13 0.58 -0.07 -0.80 0.70 0.00 0.00 175.22 175.50 2k5u s ASN 52 N -3.18 1.03 -0.02 1.36 -0.87 -1.26 -3.99 114.94 108.01 2k5u s ASN 52 Ca 0.25 -0.15 0.02 0.00 -1.57 0.00 0.00 52.86 51.41 2k5u s ASN 52 Cb -0.05 -0.37 0.01 0.00 -0.02 0.00 0.00 41.25 40.81 2k5u s ASN 52 CO 0.12 0.01 -0.07 -0.69 -2.57 0.00 0.00 177.10 173.90 2k5u s VAL 53 N 0.48 0.64 0.10 1.60 1.01 0.16 -4.41 120.40 119.97 2k5u s VAL 53 Ca -0.07 -0.28 0.04 0.00 0.00 0.00 0.00 61.98 61.67 2k5u s VAL 53 Cb -0.11 -0.59 -0.04 0.00 0.00 0.00 0.00 36.38 35.65 2k5u s VAL 53 CO 0.00 0.21 0.08 -1.61 0.00 0.00 0.00 175.10 173.79 2k5u s GLU 54 N 0.25 2.86 -0.06 2.72 2.02 -1.02 -1.11 118.70 124.36 2k5u s GLU 54 Ca -0.03 -0.74 -0.02 0.00 0.02 0.00 0.00 54.97 54.19 2k5u s GLU 54 Cb -0.08 -2.69 0.04 0.00 0.10 0.00 0.00 34.13 31.49 2k5u s GLU 54 CO 0.00 0.55 0.11 0.95 0.02 0.00 0.00 175.26 176.89 2k5u s THR 55 N -1.46 -0.14 0.01 3.63 -4.23 -1.01 -0.03 115.64 112.41 2k5u s THR 55 Ca 0.29 0.30 0.04 0.00 -1.18 0.00 0.00 61.69 61.14 2k5u s THR 55 Cb -0.12 -0.21 -0.01 0.00 1.34 0.00 0.00 72.50 73.50 2k5u s THR 55 CO 0.22 0.12 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.60 2k5u s VAL 56 N 1.74 1.06 -0.07 2.29 1.01 0.31 -2.75 120.40 123.99 2k5u s VAL 56 Ca -0.02 -0.71 0.05 0.00 0.00 0.00 0.00 61.98 61.30 2k5u s VAL 56 Cb -0.12 -0.91 -0.01 0.00 0.00 0.00 0.00 36.38 35.34 2k5u s VAL 56 CO -0.05 0.20 -0.24 0.00 0.00 0.00 0.00 175.10 175.00 2k5u s GLN 57 N -0.59 2.64 -0.32 2.72 -2.07 -1.26 -0.00 119.66 120.78 2k5u s GLN 57 Ca 0.04 -0.88 -0.02 0.00 -1.82 0.00 0.00 55.36 52.68 2k5u s GLN 57 Cb -0.06 -2.17 0.12 0.00 -1.09 0.00 0.00 33.01 29.81 2k5u s GLN 57 CO 0.00 0.32 0.16 -0.47 -1.32 0.00 0.00 175.29 173.98 2k5u s TYR 58 N -0.02 0.62 -0.10 9.60 6.14 -0.10 -5.01 117.35 128.48 2k5u s TYR 58 Ca -0.08 -1.27 -0.09 0.00 0.64 0.00 0.00 57.07 56.27 2k5u s TYR 58 Cb -0.15 -0.99 0.01 0.00 0.42 0.00 0.00 41.96 41.26 2k5u s TYR 58 CO 0.05 -0.83 0.15 1.63 0.64 0.00 0.00 175.55 177.19 2k5u n LYS 59 N 4.70 -0.57 0.00 4.97 4.01 -1.26 -1.37 118.16 128.64 2k5u n LYS 59 Ca 0.02 0.73 0.00 0.00 -0.51 0.00 0.00 58.31 58.55 2k5u n LYS 59 Cb 0.40 -0.98 0.00 0.00 -0.51 0.00 0.00 35.03 33.94 2k5u n LYS 59 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 2k5u n ASN 60 N 0.97 0.00 -4.68 4.39 4.13 -1.26 -4.90 115.26 113.91 2k5u n ASN 60 Ca -0.02 0.00 -0.45 0.00 1.68 0.00 0.00 54.58 55.79 2k5u n ASN 60 Cb 0.43 0.00 -0.04 0.00 -1.54 0.00 0.00 39.78 38.63 2k5u n ASN 60 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 2k5u n ILE 61 N 0.00 0.24 -4.03 2.41 5.41 -0.47 -4.86 119.36 118.05 2k5u n ILE 61 Ca 0.00 -0.04 -0.33 0.00 1.00 0.00 0.00 62.75 63.38 2k5u n ILE 61 Cb 0.00 -1.83 -0.06 0.00 -0.71 0.00 0.00 39.64 37.04 2k5u n ILE 61 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 2k5u s SER 62 N 2.17 5.90 -0.02 4.38 0.15 -1.13 -0.92 113.70 124.22 2k5u s SER 62 Ca 0.82 0.20 0.02 0.00 0.70 0.00 0.00 55.95 57.69 2k5u s SER 62 Cb -0.61 -1.74 0.01 0.00 -1.71 0.00 0.00 66.02 61.97 2k5u s SER 62 CO 0.40 0.26 -0.05 -0.36 1.20 0.00 0.00 173.24 174.68 2k5u s PHE 63 N -1.26 0.62 -0.10 3.44 0.08 1.00 -0.57 117.98 121.18 2k5u s PHE 63 Ca 0.25 -0.14 -0.05 0.00 0.12 0.00 0.00 56.93 57.12 2k5u s PHE 63 Cb -0.12 -0.49 0.05 0.00 -0.57 0.00 0.00 43.02 41.89 2k5u s PHE 63 CO 0.17 -0.09 0.23 0.99 -0.10 0.00 0.00 175.22 176.41 2k5u s THR 64 N 0.35 -0.18 -0.15 0.64 2.01 -0.96 -0.53 115.64 116.82 2k5u s THR 64 Ca -0.04 0.22 -0.08 0.00 0.31 0.00 0.00 61.69 62.10 2k5u s THR 64 Cb -0.08 -0.37 -0.04 0.00 0.01 0.00 0.00 72.50 72.02 2k5u s THR 64 CO -0.00 0.09 0.13 -0.69 -0.69 0.00 0.00 174.62 173.46 2k5u s VAL 65 N 1.73 5.40 -0.19 3.82 1.01 0.96 0.25 120.40 133.39 2k5u s VAL 65 Ca -0.05 0.18 -0.04 0.00 0.00 0.00 0.00 61.98 62.07 2k5u s VAL 65 Cb -0.11 -3.40 0.09 0.00 0.00 0.00 0.00 36.38 32.96 2k5u s VAL 65 CO -0.08 0.55 0.24 0.26 0.00 0.00 0.00 175.10 176.07 2k5u s TRP 66 N -0.47 -0.36 -0.12 5.22 0.52 0.08 -2.42 118.94 121.40 2k5u s TRP 66 Ca 0.12 0.41 -0.29 0.00 0.02 0.00 0.00 56.10 56.36 2k5u s TRP 66 Cb -0.12 -0.27 -0.05 0.00 -1.15 0.00 0.00 33.47 31.88 2k5u s TRP 66 CO 0.02 -0.57 1.80 -0.51 0.02 0.00 0.00 176.95 177.71 2k5u s ASP 67 N 2.36 6.32 -0.35 2.95 1.01 -1.26 -4.01 116.67 123.69 2k5u s ASP 67 Ca 0.07 2.06 -0.21 0.00 0.71 0.00 0.00 52.55 55.17 2k5u s ASP 67 Cb -0.15 -2.53 0.03 0.00 1.01 0.00 0.00 42.92 41.28 2k5u s ASP 67 CO -0.12 -1.24 0.44 1.33 0.21 0.00 0.00 175.17 175.79 2k5u n VAL 68 N 6.19 -2.47 -0.27 -1.27 0.24 -0.22 -4.81 118.33 115.73 2k5u n VAL 68 Ca 0.20 0.04 -0.13 0.00 -2.04 0.00 0.00 64.34 62.40 2k5u n VAL 68 Cb 0.44 -2.24 0.09 0.00 -1.47 0.00 0.00 33.84 30.66 2k5u n VAL 68 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2k5u n GLY 69 N -0.35 3.43 0.67 7.63 0.00 -1.26 -4.52 105.19 110.79 2k5u n GLY 69 Ca -0.09 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.28 2k5u n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k5u n GLY 70 N -0.34 1.31 0.71 -0.02 0.00 -1.26 -2.83 105.19 102.76 2k5u n GLY 70 Ca 0.33 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.31 2k5u n GLY 70 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2k5u n GLN 71 N 0.28 0.00 -1.67 1.61 6.02 -1.26 -4.91 117.38 117.45 2k5u n GLN 71 Ca 0.00 -0.44 -0.50 0.00 -0.01 0.00 0.00 57.00 56.05 2k5u n GLN 71 Cb 0.26 0.23 -0.05 0.00 1.02 0.00 0.00 30.24 31.70 2k5u n GLN 71 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 2k5u n ASP 72 N 0.00 2.80 -0.02 1.08 9.92 -1.13 -4.85 116.55 124.34 2k5u n ASP 72 Ca -0.12 1.05 -0.03 0.00 -0.53 0.00 0.00 54.79 55.16 2k5u n ASP 72 Cb 0.58 -1.31 -0.03 0.00 -0.64 0.00 0.00 41.12 39.72 2k5u n ASP 72 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2k5u n ARG 73 N 4.66 1.18 -1.64 -1.24 1.74 -1.26 -5.04 116.66 115.07 2k5u n ARG 73 Ca 0.21 0.02 -0.40 0.00 -0.77 0.00 0.00 57.85 56.91 2k5u n ARG 73 Cb 0.24 -1.10 0.03 0.00 -1.02 0.00 0.00 32.46 30.61 2k5u n ARG 73 CO 0.00 0.00 0.00 1.51 -1.52 0.00 0.00 177.63 177.62 2k5u n ILE 74 N -2.48 2.92 -4.13 0.55 3.06 -1.26 -5.02 119.36 113.00 2k5u n ILE 74 Ca -0.08 -0.50 -0.06 0.00 -2.50 0.00 0.00 62.75 59.61 2k5u n ILE 74 Cb 0.60 -1.27 -0.01 0.00 0.54 0.00 0.00 39.64 39.50 2k5u n ILE 74 CO 0.00 0.00 0.00 -2.11 -2.50 0.00 0.00 176.55 171.94 2k5u n ARG 75 N -0.29 1.58 0.00 9.51 1.85 -1.26 -4.58 116.66 123.47 2k5u n ARG 75 Ca 0.10 -0.67 0.00 0.00 -1.00 0.00 0.00 57.85 56.28 2k5u n ARG 75 Cb 0.42 0.22 0.00 0.00 -1.05 0.00 0.00 32.46 32.05 2k5u n ARG 75 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 2k5u n SER 76 N -1.25 0.00 0.18 2.89 3.41 -1.26 -4.18 113.62 113.41 2k5u n SER 76 Ca -0.03 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.49 2k5u n SER 76 Cb 0.12 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.02 2k5u n SER 76 CO 0.00 0.00 0.00 0.17 -0.16 0.00 0.00 175.04 175.05 2k5u h LEU 77 N 0.00 -0.46 -1.73 1.04 8.10 -2.01 -2.95 115.31 117.30 2k5u h LEU 77 Ca 0.00 -0.01 0.13 0.00 0.11 0.00 0.00 57.88 58.11 2k5u h LEU 77 Cb 0.00 0.12 -0.04 0.00 -0.44 0.00 0.00 40.66 40.30 2k5u h LEU 77 CO 0.00 -0.02 0.43 -0.25 -4.11 0.00 0.00 178.44 174.49 2k5u h TRP 78 N -1.13 0.31 0.31 0.17 -0.00 -1.81 -2.04 115.95 111.77 2k5u h TRP 78 Ca -0.06 0.01 -0.02 0.00 -0.00 0.00 0.00 58.89 58.83 2k5u h TRP 78 Cb 0.44 -0.10 0.00 0.00 -0.00 0.00 0.00 29.16 29.50 2k5u h TRP 78 CO 0.01 0.13 -0.15 -0.09 -0.00 0.00 0.00 178.44 178.34 2k5u h ARG 79 N 0.28 -0.40 -0.27 2.65 9.65 -1.85 0.63 114.38 125.07 2k5u h ARG 79 Ca 0.30 0.03 0.07 0.00 -1.10 0.00 0.00 59.98 59.27 2k5u h ARG 79 Cb 0.80 0.09 -0.07 0.00 -1.39 0.00 0.00 29.97 29.39 2k5u h ARG 79 CO -0.07 -0.23 -0.25 0.45 2.80 0.00 0.00 179.97 182.67 2k5u h HIS 80 N -0.47 -0.68 0.00 2.20 3.86 -1.19 0.22 115.15 119.09 2k5u h HIS 80 Ca -0.04 0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2k5u h HIS 80 Cb 0.36 0.34 0.00 0.00 1.06 0.00 0.00 27.41 29.17 2k5u h HIS 80 CO -0.04 -0.33 0.00 1.88 0.86 0.00 0.00 177.93 180.30 2k5u h TYR 81 N -0.25 0.00 0.00 2.45 -1.99 -1.42 -2.91 116.97 112.86 2k5u h TYR 81 Ca 0.15 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.88 2k5u h TYR 81 Cb 0.47 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.20 2k5u h TYR 81 CO -0.42 0.00 0.00 0.98 -0.00 0.00 0.00 178.16 178.72 2k5u n TYR 82 N -2.99 0.00 -0.33 4.88 9.36 0.22 -0.14 117.16 128.16 2k5u n TYR 82 Ca 0.01 0.00 -0.02 0.00 3.32 0.00 0.00 57.90 61.21 2k5u n TYR 82 Cb 0.31 -0.48 0.14 0.00 -0.63 0.00 0.00 39.34 38.68 2k5u n TYR 82 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2k5u h ARG 83 N 0.00 1.23 -0.70 2.98 3.08 -1.60 -2.27 114.38 117.10 2k5u h ARG 83 Ca 0.00 -0.10 0.09 0.00 0.07 0.00 0.00 59.98 60.04 2k5u h ARG 83 Cb 0.00 -0.26 -0.04 0.00 0.08 0.00 0.00 29.97 29.74 2k5u h ARG 83 CO 0.00 0.84 0.46 -0.97 -1.07 0.00 0.00 179.97 179.23 2k5u h ASN 84 N 1.25 0.54 -2.62 7.04 -0.73 -1.39 -3.41 115.58 116.26 2k5u h ASN 84 Ca 0.33 0.01 -0.53 0.00 1.87 0.00 0.00 56.30 57.98 2k5u h ASN 84 Cb -0.09 -0.10 0.02 0.00 0.27 0.00 0.00 38.32 38.42 2k5u h ASN 84 CO -0.07 0.33 1.05 -0.89 -0.37 0.00 0.00 177.43 177.49 2k5u s THR 85 N -5.56 2.92 0.00 -3.57 2.01 0.80 -4.50 115.64 107.75 2k5u s THR 85 Ca -0.09 0.34 0.00 0.00 0.31 0.00 0.00 61.69 62.25 2k5u s THR 85 Cb 0.20 -3.22 0.00 0.00 0.01 0.00 0.00 72.50 69.49 2k5u s THR 85 CO 0.76 -0.00 0.70 -0.62 -0.69 0.00 0.00 174.62 174.77 2k5u n GLU 86 N 5.84 1.06 -3.80 4.92 -0.58 -0.06 -4.82 120.64 123.20 2k5u n GLU 86 Ca 0.17 -0.94 -0.13 0.00 -0.42 0.00 0.00 57.16 55.84 2k5u n GLU 86 Cb 0.40 -0.92 -0.11 0.00 -0.57 0.00 0.00 31.44 30.24 2k5u n GLU 86 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 2k5u s GLY 87 N -0.48 -0.15 -0.17 0.62 0.00 0.49 -4.13 107.32 103.50 2k5u s GLY 87 Ca 0.00 0.56 -0.02 0.00 0.00 0.00 0.00 44.72 45.26 2k5u s GLY 87 CO 0.00 0.46 0.02 0.14 0.00 0.00 0.00 173.10 173.71 2k5u s VAL 88 N -0.15 0.57 -0.23 1.40 1.01 -1.14 -1.30 120.40 120.56 2k5u s VAL 88 Ca -0.03 -0.45 -0.01 0.00 0.00 0.00 0.00 61.98 61.50 2k5u s VAL 88 Cb -0.03 -0.97 0.02 0.00 0.00 0.00 0.00 36.38 35.40 2k5u s VAL 88 CO 0.01 -0.09 -0.10 -0.63 0.00 0.00 0.00 175.10 174.29 2k5u s ILE 89 N 1.85 2.67 -0.22 2.22 -1.09 -0.82 -2.42 121.20 123.39 2k5u s ILE 89 Ca 0.00 -0.97 -0.10 0.00 -2.23 0.00 0.00 60.65 57.35 2k5u s ILE 89 Cb -0.16 -2.29 -0.05 0.00 -1.58 0.00 0.00 42.46 38.38 2k5u s ILE 89 CO -0.07 0.31 0.14 0.12 -1.23 0.00 0.00 174.94 174.21 2k5u s PHE 90 N 1.32 3.34 -0.17 3.97 2.19 0.26 -2.81 117.98 126.08 2k5u s PHE 90 Ca 0.02 0.24 0.01 0.00 0.33 0.00 0.00 56.93 57.52 2k5u s PHE 90 Cb -0.16 -2.22 0.03 0.00 -1.31 0.00 0.00 43.02 39.36 2k5u s PHE 90 CO -0.07 0.14 -0.12 0.08 1.83 0.00 0.00 175.22 177.08 2k5u s VAL 91 N 0.80 1.59 0.28 3.12 1.01 -1.07 -0.08 120.40 126.05 2k5u s VAL 91 Ca 0.07 -0.80 0.09 0.00 0.00 0.00 0.00 61.98 61.34 2k5u s VAL 91 Cb -0.13 -1.58 -0.04 0.00 0.00 0.00 0.00 36.38 34.63 2k5u s VAL 91 CO 0.02 0.32 0.05 0.54 0.00 0.00 0.00 175.10 176.03 2k5u s VAL 92 N 1.45 3.53 -0.26 2.92 0.11 -0.99 -3.45 120.40 123.71 2k5u s VAL 92 Ca 0.02 -1.80 -0.26 0.00 -2.93 0.00 0.00 61.98 57.00 2k5u s VAL 92 Cb -0.14 -2.95 0.00 0.00 -1.53 0.00 0.00 36.38 31.76 2k5u s VAL 92 CO -0.10 -0.34 0.92 -0.62 -3.33 0.00 0.00 175.10 171.63 2k5u s ASP 93 N -3.73 6.90 0.40 3.54 2.15 -1.26 -2.66 116.67 122.01 2k5u s ASP 93 Ca 0.33 1.09 0.20 0.00 0.43 0.00 0.00 52.55 54.59 2k5u s ASP 93 Cb -0.06 -2.48 0.80 0.00 -0.30 0.00 0.00 42.92 40.89 2k5u s ASP 93 CO 0.21 -0.62 1.79 -1.28 -0.17 0.00 0.00 175.17 175.10 2k5u h SER 94 N 7.72 0.00 -0.53 -0.34 0.87 -1.85 -2.65 113.55 116.78 2k5u h SER 94 Ca -0.22 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.34 2k5u h SER 94 Cb 1.08 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.04 2k5u h SER 94 CO 0.93 0.33 0.00 -3.20 -0.53 0.00 0.00 176.83 174.35 2k5u n ASN 95 N -3.58 2.98 -3.25 6.23 4.05 -1.26 -2.01 115.26 118.42 2k5u n ASN 95 Ca -0.01 -1.98 -0.27 0.00 0.45 0.00 0.00 54.58 52.77 2k5u n ASN 95 Cb 0.46 -0.35 -0.07 0.00 1.23 0.00 0.00 39.78 41.05 2k5u n ASN 95 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 177.26 173.54 2k5u n ASP 96 N 1.13 4.01 -0.15 1.20 2.03 -1.00 -4.86 116.55 118.92 2k5u n ASP 96 Ca 0.19 -3.53 -0.03 0.00 0.52 0.00 0.00 54.79 51.93 2k5u n ASP 96 Cb 0.48 -0.63 0.17 0.00 -0.72 0.00 0.00 41.12 40.42 2k5u n ASP 96 CO 0.00 0.00 0.00 -0.09 -1.92 0.00 0.00 177.20 175.19 2k5u h ARG 97 N 3.75 0.87 0.00 -0.67 2.43 -1.78 -2.02 114.38 116.96 2k5u h ARG 97 Ca 0.17 -0.18 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2k5u h ARG 97 Cb 0.61 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 2k5u h ARG 97 CO 0.83 0.78 0.22 0.77 -1.51 0.00 0.00 179.97 181.06 2k5u h SER 98 N 0.84 0.00 -0.08 -3.80 0.02 -1.96 0.28 113.55 108.86 2k5u h SER 98 Ca 0.19 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 2k5u h SER 98 Cb 0.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.83 2k5u h SER 98 CO -0.00 0.00 0.00 0.54 -1.14 0.00 0.00 176.83 176.23 2k5u n ARG 99 N -2.93 1.07 -0.32 3.45 3.00 -0.78 -4.58 116.66 115.57 2k5u n ARG 99 Ca -0.02 -1.38 0.08 0.00 -0.01 0.00 0.00 57.85 56.52 2k5u n ARG 99 Cb 0.27 -1.25 0.29 0.00 0.00 0.00 0.00 32.46 31.77 2k5u n ARG 99 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.63 178.60 2k5u h ILE 100 N 2.40 0.91 -0.40 0.55 6.09 -0.22 0.34 117.51 127.17 2k5u h ILE 100 Ca 0.00 -0.31 -0.06 0.00 -1.37 0.00 0.00 64.86 63.12 2k5u h ILE 100 Cb 0.55 -0.06 -0.02 0.00 0.47 0.00 0.00 36.82 37.76 2k5u h ILE 100 CO 0.00 0.16 -0.01 1.23 -3.07 0.00 0.00 178.15 176.46 2k5u h GLY 101 N 0.89 0.68 1.24 8.18 0.00 -1.81 0.59 103.07 112.85 2k5u h GLY 101 Ca 0.47 -0.43 -0.16 0.00 0.00 0.00 0.00 47.33 47.21 2k5u h GLY 101 CO -0.23 0.40 -0.42 -2.09 0.00 0.00 0.00 176.54 174.20 2k5u h GLU 102 N 0.60 0.82 -0.27 4.80 4.81 -0.81 -1.49 114.58 123.05 2k5u h GLU 102 Ca 0.12 -0.45 -0.06 0.00 -0.13 0.00 0.00 59.36 58.85 2k5u h GLU 102 Cb 0.40 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 2k5u h GLU 102 CO 0.02 1.08 -0.06 0.00 -0.73 0.00 0.00 179.01 179.32 2k5u h ALA 103 N 0.85 0.37 -0.25 2.92 0.00 -0.06 -1.83 119.26 121.26 2k5u h ALA 103 Ca 0.05 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.59 2k5u h ALA 103 Cb 1.00 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2k5u h ALA 103 CO 0.10 0.17 -0.28 0.07 0.00 0.00 0.00 179.25 179.31 2k5u h ARG 104 N 0.26 0.49 -0.33 0.00 0.11 -0.87 -1.49 114.38 112.55 2k5u h ARG 104 Ca 0.07 -0.19 -0.12 0.00 0.10 0.00 0.00 59.98 59.83 2k5u h ARG 104 Cb 0.53 -0.02 -0.01 0.00 1.11 0.00 0.00 29.97 31.58 2k5u h ARG 104 CO 0.03 0.72 -0.28 1.49 0.10 0.00 0.00 179.97 182.03 2k5u h GLU 105 N 0.43 0.78 -0.46 0.08 4.57 -1.20 0.18 114.58 118.96 2k5u h GLU 105 Ca 0.06 -0.39 -0.09 0.00 -1.18 0.00 0.00 59.36 57.75 2k5u h GLU 105 Cb 0.70 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.28 2k5u h GLU 105 CO 0.05 1.02 -0.09 -0.24 -1.18 0.00 0.00 179.01 178.58 2k5u h VAL 106 N 0.55 1.27 -0.29 0.32 3.04 -1.23 -2.12 116.25 117.79 2k5u h VAL 106 Ca 0.06 -1.19 -0.13 0.00 -1.01 0.00 0.00 66.70 64.43 2k5u h VAL 106 Cb 0.85 1.11 -0.01 0.00 -2.01 0.00 0.00 31.29 31.23 2k5u h VAL 106 CO 0.07 0.41 -0.33 0.00 -1.01 0.00 0.00 177.57 176.71 2k5u h MET 107 N 0.70 0.64 -0.73 4.17 -0.00 -1.24 -2.07 114.93 116.40 2k5u h MET 107 Ca 0.12 -0.30 -0.03 0.00 -0.00 0.00 0.00 59.70 59.49 2k5u h MET 107 Cb 0.62 -0.01 -0.03 0.00 -0.00 0.00 0.00 31.60 32.18 2k5u h MET 107 CO 0.04 0.89 0.34 0.37 -0.00 0.00 0.00 176.91 178.55 2k5u h GLN 108 N 0.54 1.05 -0.13 -0.10 5.75 -0.79 -0.74 115.11 120.68 2k5u h GLN 108 Ca 0.06 -0.16 -0.16 0.00 -0.15 0.00 0.00 58.65 58.24 2k5u h GLN 108 Cb 0.84 -0.19 -0.01 0.00 1.07 0.00 0.00 27.48 29.19 2k5u h GLN 108 CO 0.07 0.83 -0.58 0.00 -2.65 0.00 0.00 178.83 176.50 2k5u h ARG 109 N 1.02 0.43 -0.45 1.69 2.47 -1.28 -2.93 114.38 115.33 2k5u h ARG 109 Ca 0.25 -0.28 -0.10 0.00 -1.26 0.00 0.00 59.98 58.58 2k5u h ARG 109 Cb 0.13 0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 28.48 2k5u h ARG 109 CO -0.03 0.89 -0.12 1.98 0.56 0.00 0.00 179.97 183.25 2k5u h MET 110 N 0.33 0.87 0.00 0.04 4.05 -1.00 -2.68 114.93 116.54 2k5u h MET 110 Ca -0.00 -0.34 0.00 0.00 -0.28 0.00 0.00 59.70 59.08 2k5u h MET 110 Cb 1.11 -0.05 0.00 0.00 -0.80 0.00 0.00 31.60 31.86 2k5u h MET 110 CO 0.10 0.98 0.00 1.47 0.23 0.00 0.00 176.91 179.69 2k5u n LEU 111 N -4.26 0.10 -0.00 3.39 -0.00 -0.32 -2.56 117.00 113.35 2k5u n LEU 111 Ca -0.00 0.52 0.11 0.00 -0.00 0.00 0.00 56.01 56.63 2k5u n LEU 111 Cb 0.39 -0.50 0.65 0.00 -0.00 0.00 0.00 43.42 43.95 2k5u n LEU 111 CO 0.44 -0.21 0.92 -3.20 -0.00 0.00 0.00 177.39 175.34 2k5u n ASN 112 N -1.60 0.01 -4.61 1.45 5.15 -1.01 -4.66 115.26 109.98 2k5u n ASN 112 Ca 0.04 -1.32 -0.43 0.00 -0.60 0.00 0.00 54.58 52.27 2k5u n ASN 112 Cb 0.23 -0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.46 2k5u n ASN 112 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2k5u s GLU 113 N -2.00 3.77 0.39 1.20 0.41 -1.06 -4.89 118.70 116.51 2k5u s GLU 113 Ca 0.33 0.92 0.12 0.00 -0.41 0.00 0.00 54.97 55.92 2k5u s GLU 113 Cb 0.15 -3.92 0.92 0.00 -1.78 0.00 0.00 34.13 29.51 2k5u s GLU 113 CO 0.25 -1.31 1.89 -0.44 -0.49 0.00 0.00 175.26 175.16 2k5u h ASP 114 N 9.56 0.54 0.74 -0.19 3.32 -1.92 0.39 116.42 128.86 2k5u h ASP 114 Ca -0.25 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.83 2k5u h ASP 114 Cb 1.08 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.56 2k5u h ASP 114 CO 1.08 0.27 0.00 -0.62 -1.72 0.00 0.00 179.24 178.25 2k5u n GLU 115 N -4.53 0.08 0.00 3.56 -0.58 -1.26 -2.61 120.64 115.30 2k5u n GLU 115 Ca 0.16 0.25 0.00 0.00 -0.42 0.00 0.00 57.16 57.16 2k5u n GLU 115 Cb 0.50 -1.63 0.00 0.00 -0.57 0.00 0.00 31.44 29.74 2k5u n GLU 115 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2k5u n LEU 116 N -1.78 1.79 0.30 -4.62 4.77 0.11 -4.69 117.00 112.88 2k5u n LEU 116 Ca 0.04 -1.79 0.19 0.00 -0.03 0.00 0.00 56.01 54.42 2k5u n LEU 116 Cb 0.24 0.00 0.99 0.00 -2.33 0.00 0.00 43.42 42.32 2k5u n LEU 116 CO 0.19 0.45 1.16 0.03 -1.33 0.00 0.00 177.39 177.89 2k5u h ARG 117 N 0.00 0.00 -0.31 3.23 3.08 -0.62 0.11 114.38 119.86 2k5u h ARG 117 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2k5u h ARG 117 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.46 2k5u h ARG 117 CO 0.00 0.00 0.00 0.09 -1.07 0.00 0.00 179.97 178.99 2k5u n ASN 118 N -3.24 4.03 -4.85 7.04 5.03 -1.26 -5.00 115.26 117.01 2k5u n ASN 118 Ca -0.02 -2.91 -0.34 0.00 0.87 0.00 0.00 54.58 52.18 2k5u n ASN 118 Cb 0.23 -0.53 -0.06 0.00 -1.02 0.00 0.00 39.78 38.40 2k5u n ASN 118 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2k5u s ALA 119 N -2.64 3.54 -0.18 5.41 0.00 0.38 -5.05 121.76 123.22 2k5u s ALA 119 Ca 0.42 -0.12 -0.26 0.00 0.00 0.00 0.00 51.96 52.00 2k5u s ALA 119 Cb 0.33 -2.55 -0.01 0.00 0.00 0.00 0.00 23.12 20.89 2k5u s ALA 119 CO 0.11 0.44 0.88 0.00 0.00 0.00 0.00 175.76 177.19 2k5u s ALA 120 N -1.60 3.54 -0.08 0.00 0.00 -1.26 -4.95 121.76 117.41 2k5u s ALA 120 Ca 0.42 0.07 -0.02 0.00 0.00 0.00 0.00 51.96 52.43 2k5u s ALA 120 Cb -0.14 -3.30 -0.03 0.00 0.00 0.00 0.00 23.12 19.65 2k5u s ALA 120 CO 0.20 -0.73 0.03 -1.58 0.00 0.00 0.00 175.76 173.67 2k5u s TRP 121 N 2.35 3.23 -0.06 0.00 0.52 -1.00 -2.90 118.94 121.09 2k5u s TRP 121 Ca 0.40 0.24 0.02 0.00 0.02 0.00 0.00 56.10 56.78 2k5u s TRP 121 Cb -0.16 -1.80 0.02 0.00 -1.15 0.00 0.00 33.47 30.37 2k5u s TRP 121 CO 0.12 0.51 -0.09 -1.17 0.02 0.00 0.00 176.95 176.34 2k5u s LEU 122 N -0.97 1.52 -0.41 2.99 1.98 -1.01 -2.57 118.68 120.20 2k5u s LEU 122 Ca 0.14 -0.23 -0.10 0.00 -2.89 0.00 0.00 54.13 51.05 2k5u s LEU 122 Cb -0.11 -0.68 0.07 0.00 0.66 0.00 0.00 46.19 46.13 2k5u s LEU 122 CO 0.03 -0.00 0.26 -0.69 -1.89 0.00 0.00 176.35 174.06 2k5u s VAL 123 N 0.77 4.40 -0.27 1.68 1.01 0.96 0.92 120.40 129.88 2k5u s VAL 123 Ca -0.13 -1.25 -0.13 0.00 0.00 0.00 0.00 61.98 60.47 2k5u s VAL 123 Cb -0.15 -3.64 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 2k5u s VAL 123 CO 0.02 -0.45 0.30 -0.36 0.00 0.00 0.00 175.10 174.61 2k5u s PHE 124 N 1.48 3.25 -0.14 5.22 0.08 0.89 -1.83 117.98 126.93 2k5u s PHE 124 Ca 0.03 0.32 -0.22 0.00 0.12 0.00 0.00 56.93 57.17 2k5u s PHE 124 Cb -0.22 -2.49 -0.03 0.00 -0.57 0.00 0.00 43.02 39.71 2k5u s PHE 124 CO 0.04 -0.17 0.68 0.00 -0.10 0.00 0.00 175.22 175.66 2k5u s ALA 125 N 1.85 3.46 -0.26 5.36 0.00 -0.32 -2.34 121.76 129.51 2k5u s ALA 125 Ca 0.12 -0.06 0.02 0.00 0.00 0.00 0.00 51.96 52.04 2k5u s ALA 125 Cb -0.16 -2.99 0.06 0.00 0.00 0.00 0.00 23.12 20.04 2k5u s ALA 125 CO 0.10 -0.36 -0.08 -0.80 0.00 0.00 0.00 175.76 174.62 2k5u s ASN 126 N 1.00 4.25 0.00 0.00 0.02 -1.09 -1.90 114.94 117.22 2k5u s ASN 126 Ca 0.33 -1.37 0.00 0.00 -1.02 0.00 0.00 52.86 50.81 2k5u s ASN 126 Cb -0.17 -1.41 0.00 0.00 0.02 0.00 0.00 41.25 39.69 2k5u s ASN 126 CO 0.13 -0.22 0.00 0.29 0.02 0.00 0.00 177.10 177.32 2k5u n LYS 127 N 4.51 0.00 0.06 -0.60 5.02 -1.16 -2.79 118.16 123.20 2k5u n LYS 127 Ca -0.12 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.29 2k5u n LYS 127 Cb 0.43 0.00 0.47 0.00 -0.02 0.00 0.00 35.03 35.90 2k5u n LYS 127 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2k5u n GLN 128 N 0.00 0.12 0.23 1.97 1.13 0.08 -2.81 117.38 118.09 2k5u n GLN 128 Ca 0.00 0.20 0.11 0.00 -1.94 0.00 0.00 57.00 55.38 2k5u n GLN 128 Cb 0.00 -1.67 0.42 0.00 0.11 0.00 0.00 30.24 29.10 2k5u n GLN 128 CO 0.00 0.00 0.00 0.38 -1.44 0.00 0.00 177.06 176.00 2k5u h ASP 129 N 0.00 0.00 -3.03 1.08 3.04 -1.95 -3.44 116.42 112.12 2k5u h ASP 129 Ca 0.00 0.00 -0.53 0.00 -3.24 0.00 0.00 57.03 53.26 2k5u h ASP 129 Cb 0.49 0.00 0.01 0.00 -1.04 0.00 0.00 39.33 38.80 2k5u h ASP 129 CO 0.00 0.17 0.71 -0.22 -2.04 0.00 0.00 179.24 177.86 2k5u s LEU 130 N -6.52 4.36 0.37 0.15 2.96 -1.12 -4.90 118.68 113.98 2k5u s LEU 130 Ca 0.02 2.21 0.26 0.00 -0.22 0.00 0.00 54.13 56.40 2k5u s LEU 130 Cb 0.09 -3.58 1.30 0.00 0.50 0.00 0.00 46.19 44.50 2k5u s LEU 130 CO 0.63 -0.62 1.79 1.55 -1.32 0.00 0.00 176.35 178.38 2k5u h PRO 131 N 7.01 0.00 -0.24 0.98 0.13 -1.90 -1.76 132.00 136.22 2k5u h PRO 131 Ca -0.41 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.64 2k5u h PRO 131 Cb 1.20 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.29 2k5u h PRO 131 CO 0.86 0.00 -0.07 -0.85 -0.23 0.00 0.00 178.00 177.71 2k5u n GLU 132 N -2.42 2.12 -3.25 0.86 0.28 -1.26 -5.02 120.64 111.96 2k5u n GLU 132 Ca -0.01 -2.98 -0.35 0.00 -0.16 0.00 0.00 57.16 53.67 2k5u n GLU 132 Cb 0.11 -1.76 -0.06 0.00 1.43 0.00 0.00 31.44 31.15 2k5u n GLU 132 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2k5u s ALA 133 N -3.04 3.49 0.35 -1.84 0.00 -0.67 -4.85 121.76 115.19 2k5u s ALA 133 Ca 0.41 -0.02 -0.27 0.00 0.00 0.00 0.00 51.96 52.08 2k5u s ALA 133 Cb 0.36 -2.65 -0.09 0.00 0.00 0.00 0.00 23.12 20.74 2k5u s ALA 133 CO 0.03 0.40 1.11 -1.64 0.00 0.00 0.00 175.76 175.66 2k5u s MET 134 N -2.19 4.34 0.59 0.00 -1.94 -0.85 -5.00 119.30 114.24 2k5u s MET 134 Ca 0.43 1.75 -0.13 0.00 -1.71 0.00 0.00 55.69 56.03 2k5u s MET 134 Cb -0.14 -2.87 -0.05 0.00 2.01 0.00 0.00 34.83 33.78 2k5u s MET 134 CO 0.20 -0.04 1.02 -1.54 -0.01 0.00 0.00 175.02 174.64 2k5u s SER 135 N -1.12 6.25 0.34 3.03 1.04 -1.26 -4.84 113.70 117.14 2k5u s SER 135 Ca 0.52 1.51 0.04 0.00 0.48 0.00 0.00 55.95 58.50 2k5u s SER 135 Cb -0.29 -2.49 0.67 0.00 0.10 0.00 0.00 66.02 64.01 2k5u s SER 135 CO 0.37 -0.85 1.93 0.00 0.98 0.00 0.00 173.24 175.67 2k5u h ALA 136 N 0.09 1.65 0.03 5.32 0.00 -1.95 0.25 119.26 124.65 2k5u h ALA 136 Ca -0.45 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 2k5u h ALA 136 Cb 1.19 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2k5u h ALA 136 CO 0.61 0.21 -0.02 0.00 0.00 0.00 0.00 179.25 180.06 2k5u h ALA 137 N 1.57 -0.04 -0.09 0.00 0.00 -1.96 0.34 119.26 119.08 2k5u h ALA 137 Ca 0.36 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.98 2k5u h ALA 137 Cb 0.29 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2k5u h ALA 137 CO -0.13 -0.34 -0.40 1.05 0.00 0.00 0.00 179.25 179.44 2k5u h GLU 138 N -0.42 0.19 -0.26 0.00 4.11 -1.87 -2.55 114.58 113.79 2k5u h GLU 138 Ca -0.00 -0.08 -0.06 0.00 0.07 0.00 0.00 59.36 59.28 2k5u h GLU 138 Cb 0.39 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 2k5u h GLU 138 CO 0.01 0.56 -0.06 0.82 0.07 0.00 0.00 179.01 180.41 2k5u h ILE 139 N 0.16 1.28 -0.99 -1.06 2.04 -0.45 0.00 117.51 118.50 2k5u h ILE 139 Ca 0.02 -1.06 0.04 0.00 1.00 0.00 0.00 64.86 64.86 2k5u h ILE 139 Cb 0.77 1.46 -0.06 0.00 -0.74 0.00 0.00 36.82 38.25 2k5u h ILE 139 CO 0.06 0.33 0.64 0.74 0.00 0.00 0.00 178.15 179.93 2k5u h THR 140 N 0.24 1.15 -0.03 -0.27 2.02 -0.72 0.62 112.91 115.92 2k5u h THR 140 Ca 0.07 -0.42 -0.19 0.00 0.77 0.00 0.00 66.41 66.63 2k5u h THR 140 Cb 0.52 -0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 66.74 2k5u h THR 140 CO 0.02 0.22 -0.82 -0.33 0.37 0.00 0.00 175.52 174.99 2k5u h GLU 141 N 1.23 0.29 -0.42 6.66 3.07 -1.34 0.21 114.58 124.28 2k5u h GLU 141 Ca 0.40 -0.28 -0.13 0.00 -0.50 0.00 0.00 59.36 58.85 2k5u h GLU 141 Cb 0.04 0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.01 2k5u h GLU 141 CO -0.14 0.96 -0.27 -0.22 -1.40 0.00 0.00 179.01 177.95 2k5u h LYS 142 N 0.18 0.92 -0.13 2.33 1.63 -0.23 -2.83 116.57 118.44 2k5u h LYS 142 Ca -0.04 -0.43 0.00 0.00 -0.85 0.00 0.00 60.65 59.33 2k5u h LYS 142 Cb 1.42 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 33.04 2k5u h LYS 142 CO 0.13 1.08 0.00 1.47 -3.45 0.00 0.00 179.45 178.69 2k5u n LEU 143 N -4.14 0.86 -1.47 5.20 -0.00 0.14 -4.82 117.00 112.76 2k5u n LEU 143 Ca -0.01 -0.40 -0.16 0.00 -0.00 0.00 0.00 56.01 55.43 2k5u n LEU 143 Cb 0.48 -0.09 -0.04 0.00 -0.00 0.00 0.00 43.42 43.77 2k5u n LEU 143 CO 0.47 0.20 -0.17 0.61 -0.00 0.00 0.00 177.39 178.50 2k5u n GLY 144 N 0.85 0.75 0.26 1.47 0.00 -1.07 -4.66 105.19 102.79 2k5u n GLY 144 Ca 0.10 -0.25 0.17 0.00 0.00 0.00 0.00 46.02 46.03 2k5u n GLY 144 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2k5u h LEU 145 N 0.00 0.00 -0.24 0.99 5.85 -0.83 -1.89 115.31 119.20 2k5u h LEU 145 Ca -0.35 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.31 2k5u h LEU 145 Cb 1.14 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.16 2k5u h LEU 145 CO 0.46 0.00 -0.32 -0.74 -0.34 0.00 0.00 178.44 177.50 2k5u h HIS 146 N 0.00 0.00 -0.03 1.25 2.76 -1.86 -2.97 115.15 114.29 2k5u h HIS 146 Ca 0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 2k5u h HIS 146 Cb 0.44 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.40 2k5u h HIS 146 CO 0.00 0.32 0.00 0.45 -1.30 0.00 0.00 177.93 177.40 2k5u n SER 147 N -3.22 0.81 -4.78 3.26 2.88 -0.71 -4.83 113.62 107.02 2k5u n SER 147 Ca 0.02 -1.36 -0.34 0.00 -1.33 0.00 0.00 58.87 55.86 2k5u n SER 147 Cb 0.62 -0.02 -0.07 0.00 -0.75 0.00 0.00 64.21 63.99 2k5u n SER 147 CO 0.00 0.00 0.00 -0.51 -1.23 0.00 0.00 175.04 173.30 2k5u s ILE 148 N -1.96 4.83 -0.48 2.46 2.07 -1.12 -5.00 121.20 122.00 2k5u s ILE 148 Ca 0.39 -0.20 -0.40 0.00 -1.41 0.00 0.00 60.65 59.03 2k5u s ILE 148 Cb 0.19 -3.14 -0.16 0.00 0.13 0.00 0.00 42.46 39.49 2k5u s ILE 148 CO 0.32 0.49 2.20 -1.14 -1.91 0.00 0.00 174.94 174.89 2k5u n ARG 149 N 1.63 0.41 -2.15 3.50 3.00 -1.26 -4.85 116.66 116.94 2k5u n ARG 149 Ca -0.16 0.11 -0.39 0.00 -0.00 0.00 0.00 57.85 57.40 2k5u n ARG 149 Cb 0.53 -1.89 -0.01 0.00 0.00 0.00 0.00 32.46 31.10 2k5u n ARG 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2k5u s ASN 150 N 6.80 6.42 0.00 6.15 4.22 -1.26 -4.14 114.94 133.13 2k5u s ASN 150 Ca 1.17 2.54 0.00 0.00 -2.14 0.00 0.00 52.86 54.43 2k5u s ASN 150 Cb -1.22 -2.63 0.00 0.00 1.28 0.00 0.00 41.25 38.68 2k5u s ASN 150 CO 0.58 -0.76 0.00 -1.14 -2.04 0.00 0.00 177.10 173.74 2k5u n ARG 151 N 0.16 0.00 0.09 3.55 0.63 -1.26 -4.94 116.66 114.89 2k5u n ARG 151 Ca 0.04 0.00 -0.16 0.00 -0.92 0.00 0.00 57.85 56.81 2k5u n ARG 151 Cb 0.44 0.00 -0.14 0.00 0.45 0.00 0.00 32.46 33.21 2k5u n ARG 151 CO 0.00 0.00 0.00 -1.00 -2.51 0.00 0.00 177.63 174.12 2k5u h PRO 152 N 0.00 0.26 -5.52 -0.14 0.14 -1.93 -3.46 132.00 121.35 2k5u h PRO 152 Ca 0.00 -0.44 -0.64 0.00 0.14 0.00 0.00 66.00 65.06 2k5u h PRO 152 Cb 0.00 0.16 -0.15 0.00 0.14 0.00 0.00 31.00 31.16 2k5u h PRO 152 CO 0.00 1.16 -0.57 1.67 0.14 0.00 0.00 178.00 180.40 2k5u s TRP 153 N -2.64 3.27 0.11 1.56 -2.14 -1.25 -2.37 118.94 115.47 2k5u s TRP 153 Ca -0.06 0.16 0.09 0.00 2.66 0.00 0.00 56.10 58.95 2k5u s TRP 153 Cb 0.07 -1.97 -0.04 0.00 -3.10 0.00 0.00 33.47 28.43 2k5u s TRP 153 CO 0.87 0.32 -0.23 0.12 -2.66 0.00 0.00 176.95 175.38 2k5u s PHE 154 N -0.18 1.93 -0.04 1.66 2.19 -1.06 -4.99 117.98 117.49 2k5u s PHE 154 Ca 0.07 -0.41 0.06 0.00 0.33 0.00 0.00 56.93 56.99 2k5u s PHE 154 Cb -0.12 -1.06 -0.02 0.00 -1.31 0.00 0.00 43.02 40.51 2k5u s PHE 154 CO 0.01 0.23 -0.22 -1.50 1.83 0.00 0.00 175.22 175.58 2k5u s ILE 155 N -1.12 2.37 -0.12 3.12 -1.16 -1.26 -0.03 121.20 123.01 2k5u s ILE 155 Ca 0.08 -0.98 -0.06 0.00 -0.51 0.00 0.00 60.65 59.19 2k5u s ILE 155 Cb -0.10 -1.87 0.05 0.00 0.61 0.00 0.00 42.46 41.15 2k5u s ILE 155 CO 0.05 0.58 0.28 -1.58 -2.81 0.00 0.00 174.94 171.45 2k5u s GLN 156 N -0.54 0.24 0.14 3.50 2.00 -0.76 -4.99 119.66 119.25 2k5u s GLN 156 Ca 0.08 0.59 -0.21 0.00 -2.00 0.00 0.00 55.36 53.81 2k5u s GLN 156 Cb -0.11 -0.10 -0.08 0.00 0.80 0.00 0.00 33.01 33.53 2k5u s GLN 156 CO 0.00 -0.17 0.68 0.00 -0.50 0.00 0.00 175.29 175.31 2k5u s ALA 157 N 1.33 3.50 0.30 1.58 0.00 -1.26 -1.18 121.76 126.03 2k5u s ALA 157 Ca -0.09 0.18 -0.07 0.00 0.00 0.00 0.00 51.96 51.98 2k5u s ALA 157 Cb -0.10 -2.79 -0.00 0.00 0.00 0.00 0.00 23.12 20.23 2k5u s ALA 157 CO -0.09 0.35 0.46 0.95 0.00 0.00 0.00 175.76 177.42 2k5u s THR 158 N -1.23 0.00 -0.27 0.00 -4.23 -0.80 -4.76 115.64 104.36 2k5u s THR 158 Ca 0.35 -1.54 -0.00 0.00 -1.18 0.00 0.00 61.69 59.32 2k5u s THR 158 Cb -0.20 -2.48 0.08 0.00 1.34 0.00 0.00 72.50 71.24 2k5u s THR 158 CO 0.22 0.00 0.03 0.00 -0.54 0.00 0.00 174.62 174.34 2k5u h ALA 160 N 8.01 1.61 0.17 0.00 0.00 -1.90 -0.81 119.26 126.33 2k5u h ALA 160 Ca -0.14 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 2k5u h ALA 160 Cb 1.05 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2k5u h ALA 160 CO 0.44 0.32 -0.08 1.79 0.00 0.00 0.00 179.25 181.71 2k5u h THR 161 N 0.51 0.87 -0.00 0.00 1.35 -1.95 -3.28 112.91 110.41 2k5u h THR 161 Ca 0.13 -1.08 0.00 0.00 -0.55 0.00 0.00 66.41 64.91 2k5u h THR 161 Cb 0.07 1.44 0.00 0.00 -1.73 0.00 0.00 68.15 67.93 2k5u h THR 161 CO -0.02 0.22 -0.03 -1.20 -0.25 0.00 0.00 175.52 174.24 2k5u n SER 162 N -4.94 0.06 0.00 5.36 7.64 -1.23 -4.89 113.62 115.63 2k5u n SER 162 Ca -0.08 0.09 0.00 0.00 1.01 0.00 0.00 58.87 59.89 2k5u n SER 162 Cb 0.27 -0.33 0.00 0.00 -1.01 0.00 0.00 64.21 63.13 2k5u n SER 162 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2k5u n GLY 163 N 1.39 0.53 3.64 0.23 0.00 -0.33 -4.95 105.19 105.70 2k5u n GLY 163 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 2k5u n GLY 163 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k5u s GLU 164 N -0.47 3.95 0.00 1.61 0.41 -1.10 -2.52 118.70 120.57 2k5u s GLU 164 Ca 0.00 1.50 0.00 0.00 -0.41 0.00 0.00 54.97 56.06 2k5u s GLU 164 Cb 0.00 -3.91 0.00 0.00 -1.78 0.00 0.00 34.13 28.44 2k5u s GLU 164 CO 0.00 -1.09 0.00 0.41 -0.49 0.00 0.00 175.26 174.09 2k5u n GLY 165 N 4.29 3.40 0.17 -1.39 0.00 -1.26 0.07 105.19 110.46 2k5u n GLY 165 Ca 0.16 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.04 2k5u n GLY 165 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2k5u h LEU 166 N 0.00 0.55 0.02 0.99 3.38 -1.76 -1.27 115.31 117.22 2k5u h LEU 166 Ca 0.00 -0.51 -0.00 0.00 0.09 0.00 0.00 57.88 57.46 2k5u h LEU 166 Cb 0.00 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.59 2k5u h LEU 166 CO 0.00 0.95 -0.01 1.88 0.09 0.00 0.00 178.44 181.35 2k5u h TYR 167 N 0.16 -0.03 0.00 1.13 -1.99 -1.92 -2.19 116.97 112.14 2k5u h TYR 167 Ca 0.02 -0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.71 2k5u h TYR 167 Cb 0.83 0.01 -0.01 0.00 2.00 0.00 0.00 36.73 39.56 2k5u h TYR 167 CO 0.09 0.25 -0.18 1.05 -0.00 0.00 0.00 178.16 179.37 2k5u h GLU 168 N -0.31 0.00 -0.06 4.88 4.11 -1.91 -0.86 114.58 120.44 2k5u h GLU 168 Ca -0.00 0.00 -0.24 0.00 0.07 0.00 0.00 59.36 59.19 2k5u h GLU 168 Cb 0.29 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.56 2k5u h GLU 168 CO 0.01 0.18 -0.90 0.78 0.07 0.00 0.00 179.01 179.14 2k5u h GLY 169 N 0.91 0.79 0.73 1.06 0.00 -1.06 -2.62 103.07 102.89 2k5u h GLY 169 Ca -0.00 -1.27 -0.14 0.00 0.00 0.00 0.00 47.33 45.92 2k5u h GLY 169 CO 0.02 1.13 -0.53 0.17 0.00 0.00 0.00 176.54 177.34 2k5u h LEU 170 N 0.40 0.48 -0.57 3.11 8.10 -1.21 -2.62 115.31 123.00 2k5u h LEU 170 Ca -0.10 -0.75 0.10 0.00 0.11 0.00 0.00 57.88 57.24 2k5u h LEU 170 Cb 1.55 -0.15 -0.08 0.00 -0.44 0.00 0.00 40.66 41.55 2k5u h LEU 170 CO 0.18 1.17 0.14 -0.08 -4.11 0.00 0.00 178.44 175.74 2k5u h GLU 171 N -0.16 0.28 -0.63 0.17 4.81 -1.26 0.40 114.58 118.19 2k5u h GLU 171 Ca -0.06 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 2k5u h GLU 171 Cb 1.24 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.53 2k5u h GLU 171 CO 0.10 0.19 0.36 -1.49 -0.73 0.00 0.00 179.01 177.44 2k5u h TRP 172 N 0.29 0.85 -0.73 0.92 6.55 -1.51 -2.25 115.95 120.07 2k5u h TRP 172 Ca 0.29 -0.01 0.02 0.00 0.95 0.00 0.00 58.89 60.14 2k5u h TRP 172 Cb 0.40 -0.28 -0.04 0.00 -0.86 0.00 0.00 29.16 28.39 2k5u h TRP 172 CO -0.22 0.60 0.48 -0.07 -1.05 0.00 0.00 178.44 178.18 2k5u h LEU 173 N 0.86 0.81 -0.68 -4.49 -0.00 -0.72 -2.10 115.31 108.99 2k5u h LEU 173 Ca 0.22 -0.02 0.00 0.00 -0.00 0.00 0.00 57.88 58.09 2k5u h LEU 173 Cb 0.01 -0.20 -0.03 0.00 -0.00 0.00 0.00 40.66 40.44 2k5u h LEU 173 CO -0.04 0.58 0.43 0.28 -0.00 0.00 0.00 178.44 179.69 2k5u h SER 174 N 0.95 0.80 -0.27 -0.43 0.02 -0.39 -1.73 113.55 112.50 2k5u h SER 174 Ca 0.28 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.19 2k5u h SER 174 Cb -0.05 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.27 2k5u h SER 174 CO -0.07 0.61 0.18 0.78 -1.14 0.00 0.00 176.83 177.19 2k5u h ASN 175 N 0.92 0.30 -0.32 3.07 2.35 -1.15 0.39 115.58 121.15 2k5u h ASN 175 Ca 0.25 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.98 2k5u h ASN 175 Cb -0.06 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.22 2k5u h ASN 175 CO -0.05 0.22 0.17 0.28 -1.65 0.00 0.00 177.43 176.41 2k5u h SER 176 N 0.36 0.43 1.50 5.81 0.02 -1.22 0.59 113.55 121.03 2k5u h SER 176 Ca 0.10 -0.03 -0.10 0.00 -0.84 0.00 0.00 61.79 60.92 2k5u h SER 176 Cb -0.04 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.38 2k5u h SER 176 CO -0.03 0.36 -0.51 -0.07 -1.14 0.00 0.00 176.83 175.45 2k5u h LEU 177 N 0.49 0.00 0.00 5.07 -0.00 -0.64 -3.39 115.31 116.84 2k5u h LEU 177 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.01 2k5u h LEU 177 Cb 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.70 2k5u h LEU 177 CO -0.02 0.47 0.00 1.17 -0.00 0.00 0.00 178.44 180.07 2k5u n LYS 178 N -3.20 0.00 0.00 1.13 4.81 0.13 -4.91 118.16 116.12 2k5u n LYS 178 Ca 0.02 0.28 0.00 0.00 -0.87 0.00 0.00 58.31 57.74 2k5u n LYS 178 Cb 0.73 -0.77 0.00 0.00 0.02 0.00 0.00 35.03 35.00 2k5u n LYS 178 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 2k5u n ASN 179 N -2.16 0.00 0.00 3.14 5.15 0.19 -4.82 115.26 116.76 2k5u n ASN 179 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 2k5u n ASN 179 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 2k5u n ASN 179 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2k5u n SER 180 N 1.53 0.00 0.00 1.20 7.64 -1.26 -5.09 113.62 117.64 2k5u n SER 180 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2k5u n SER 180 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2k5u n SER 180 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10