#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 0.07 0.00 0.99 7.94 -1.26 -4.89 117.00 119.84 2k5u n LEU 3 Ca 0.00 0.04 0.00 0.00 -1.11 0.00 0.00 56.01 54.94 2k5u n LEU 3 Cb 0.00 -0.40 0.00 0.00 0.53 0.00 0.00 43.42 43.55 2k5u n LEU 3 CO 0.00 -0.40 0.00 0.33 -1.11 0.00 0.00 177.39 176.21 2k5u n PHE 4 N -2.23 0.00 -2.88 1.96 7.35 -1.26 -4.69 117.46 115.72 2k5u n PHE 4 Ca 0.00 0.00 -0.10 0.00 -0.76 0.00 0.00 57.45 56.59 2k5u n PHE 4 Cb 0.00 0.00 0.04 0.00 0.35 0.00 0.00 39.48 39.87 2k5u n PHE 4 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2k5u n ALA 5 N 0.00 0.50 -1.23 3.13 0.00 -1.26 -5.01 120.51 116.64 2k5u n ALA 5 Ca 0.00 -1.05 -0.21 0.00 0.00 0.00 0.00 53.44 52.18 2k5u n ALA 5 Cb 0.00 0.26 0.20 0.00 0.00 0.00 0.00 19.45 19.90 2k5u n ALA 5 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2k5u n SER 6 N -2.73 3.79 -0.13 0.00 2.88 -1.26 -4.42 113.62 111.74 2k5u n SER 6 Ca 0.08 -3.58 -0.27 0.00 -1.33 0.00 0.00 58.87 53.77 2k5u n SER 6 Cb 0.30 -0.82 -0.09 0.00 -0.75 0.00 0.00 64.21 62.85 2k5u n SER 6 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2k5u n LYS 7 N -1.04 0.58 -3.64 -1.46 4.81 -1.26 -4.92 118.16 111.23 2k5u n LYS 7 Ca 0.56 0.27 -0.37 0.00 -0.87 0.00 0.00 58.31 57.90 2k5u n LYS 7 Cb 1.61 -1.50 -0.10 0.00 0.02 0.00 0.00 35.03 35.06 2k5u n LYS 7 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2k5u s LEU 8 N -7.57 4.09 -0.23 3.14 1.43 -1.26 -4.98 118.68 113.30 2k5u s LEU 8 Ca -0.37 0.09 -0.17 0.00 -1.03 0.00 0.00 54.13 52.64 2k5u s LEU 8 Cb 0.13 -2.12 -0.14 0.00 0.03 0.00 0.00 46.19 44.10 2k5u s LEU 8 CO 0.49 0.03 -0.10 0.49 0.23 0.00 0.00 176.35 177.49 2k5u n PHE 9 N 4.48 0.51 -3.58 0.29 3.01 -1.26 -4.63 117.46 116.28 2k5u n PHE 9 Ca -0.15 0.22 -0.11 0.00 1.01 0.00 0.00 57.45 58.43 2k5u n PHE 9 Cb 0.52 -0.99 -0.03 0.00 -0.01 0.00 0.00 39.48 38.97 2k5u n PHE 9 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 2k5u s SER 10 N -6.99 -0.39 -0.27 4.37 0.01 -1.26 -4.91 113.70 104.26 2k5u s SER 10 Ca -0.32 -0.24 -0.01 0.00 1.31 0.00 0.00 55.95 56.69 2k5u s SER 10 Cb 0.09 0.58 0.13 0.00 0.21 0.00 0.00 66.02 67.03 2k5u s SER 10 CO 0.51 -1.00 0.30 0.20 0.41 0.00 0.00 173.24 173.66 2k5u s ASN 11 N -2.81 1.42 0.00 2.44 0.01 -1.26 -5.13 114.94 109.61 2k5u s ASN 11 Ca 0.04 -0.56 0.00 0.00 -0.71 0.00 0.00 52.86 51.64 2k5u s ASN 11 Cb -0.01 0.58 0.00 0.00 0.41 0.00 0.00 41.25 42.24 2k5u s ASN 11 CO -0.09 -0.37 0.00 0.18 -1.51 0.00 0.00 177.10 175.32 2k5u n LEU 12 N 5.32 0.00 -1.78 0.60 4.77 -1.26 -5.02 117.00 119.63 2k5u n LEU 12 Ca -0.03 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 55.95 2k5u n LEU 12 Cb 0.47 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.58 2k5u n LEU 12 CO 0.02 0.00 0.21 0.33 -1.33 0.00 0.00 177.39 176.62 2k5u n PHE 13 N 4.41 -0.05 0.00 -1.77 7.35 -1.26 -4.95 117.46 121.19 2k5u n PHE 13 Ca 0.00 -0.98 0.00 0.00 -0.76 0.00 0.00 57.45 55.71 2k5u n PHE 13 Cb 0.00 0.25 0.00 0.00 0.35 0.00 0.00 39.48 40.08 2k5u n PHE 13 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2k5u n GLY 14 N -0.14 1.51 2.25 7.13 0.00 -1.26 -4.91 105.19 109.78 2k5u n GLY 14 Ca -0.07 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.93 2k5u n GLY 14 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2k5u n ASN 15 N 0.00 -2.42 -3.33 1.61 2.85 -1.26 -4.78 115.26 107.92 2k5u n ASN 15 Ca 0.00 0.91 -0.34 0.00 -0.11 0.00 0.00 54.58 55.04 2k5u n ASN 15 Cb 0.00 -3.86 -0.02 0.00 1.24 0.00 0.00 39.78 37.14 2k5u n ASN 15 CO 0.00 0.00 0.00 2.29 -2.11 0.00 0.00 177.26 177.44 2k5u n LYS 16 N 0.93 2.97 -2.60 1.20 2.85 -1.26 -4.69 118.16 117.56 2k5u n LYS 16 Ca -0.20 -1.98 -0.04 0.00 -1.05 0.00 0.00 58.31 55.04 2k5u n LYS 16 Cb 0.31 -2.75 -0.03 0.00 -0.65 0.00 0.00 35.03 31.91 2k5u n LYS 16 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2k5u n GLU 17 N 4.25 -4.12 -3.69 -1.58 1.02 -1.26 -5.04 120.64 110.21 2k5u n GLU 17 Ca 0.63 3.11 -0.19 0.00 -0.02 0.00 0.00 57.16 60.69 2k5u n GLU 17 Cb 0.23 -4.26 -0.17 0.00 -0.02 0.00 0.00 31.44 27.21 2k5u n GLU 17 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 2k5u s MET 18 N -0.54 -0.06 -0.31 3.49 -1.94 -1.26 -4.78 119.30 113.91 2k5u s MET 18 Ca -0.19 0.36 -0.03 0.00 -1.71 0.00 0.00 55.69 54.12 2k5u s MET 18 Cb 0.01 -0.43 0.11 0.00 2.01 0.00 0.00 34.83 36.53 2k5u s MET 18 CO 0.51 -0.29 0.15 1.03 -0.01 0.00 0.00 175.02 176.40 2k5u s ARG 19 N 1.95 0.31 0.31 2.03 0.52 -1.26 -2.61 118.95 120.21 2k5u s ARG 19 Ca 0.02 -0.75 -0.25 0.00 -0.52 0.00 0.00 55.73 54.23 2k5u s ARG 19 Cb -0.12 -1.26 -0.10 0.00 0.52 0.00 0.00 34.95 33.99 2k5u s ARG 19 CO -0.03 -1.06 0.91 0.42 0.02 0.00 0.00 175.30 175.56 2k5u s ILE 20 N 1.83 4.28 0.04 1.52 1.09 -0.33 0.18 121.20 129.81 2k5u s ILE 20 Ca 0.11 1.72 0.06 0.00 -1.10 0.00 0.00 60.65 61.43 2k5u s ILE 20 Cb -0.18 -3.96 -0.02 0.00 -1.06 0.00 0.00 42.46 37.24 2k5u s ILE 20 CO -0.28 0.13 -0.16 -0.22 -0.10 0.00 0.00 174.94 174.31 2k5u s LEU 21 N -2.10 2.16 -0.38 2.97 0.20 -0.80 -2.41 118.68 118.32 2k5u s LEU 21 Ca 0.50 -0.47 -0.18 0.00 0.69 0.00 0.00 54.13 54.67 2k5u s LEU 21 Cb -0.18 -0.72 0.00 0.00 -0.43 0.00 0.00 46.19 44.86 2k5u s LEU 21 CO 0.23 0.08 0.48 -0.32 -0.29 0.00 0.00 176.35 176.52 2k5u s MET 22 N -1.12 3.43 0.02 1.98 1.75 0.49 -2.25 119.30 123.59 2k5u s MET 22 Ca 0.04 -0.40 0.05 0.00 -1.25 0.00 0.00 55.69 54.12 2k5u s MET 22 Cb -0.08 -3.87 -0.02 0.00 2.84 0.00 0.00 34.83 33.70 2k5u s MET 22 CO 0.01 -0.72 -0.14 0.08 -0.65 0.00 0.00 175.02 173.60 2k5u s VAL 23 N 2.30 1.14 -5.00 10.11 1.01 -1.07 -3.69 120.40 125.20 2k5u s VAL 23 Ca 0.16 -0.85 0.00 0.00 0.00 0.00 0.00 61.98 61.29 2k5u s VAL 23 Cb -0.16 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.22 2k5u s VAL 23 CO 0.14 0.14 0.00 0.61 0.00 0.00 0.00 175.10 175.99 2k5u n GLY 24 N 2.23 0.01 3.75 4.51 0.00 -1.26 -2.55 105.19 111.89 2k5u n GLY 24 Ca -0.16 -1.55 -0.41 0.00 0.00 0.00 0.00 46.02 43.90 2k5u n GLY 24 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2k5u s LEU 25 N 0.00 4.50 0.64 0.99 2.96 -1.25 -1.89 118.68 124.62 2k5u s LEU 25 Ca 0.00 2.33 -0.18 0.00 -0.22 0.00 0.00 54.13 56.06 2k5u s LEU 25 Cb 0.00 -3.62 -0.02 0.00 0.50 0.00 0.00 46.19 43.05 2k5u s LEU 25 CO 0.00 -0.28 1.25 -0.90 -1.32 0.00 0.00 176.35 175.10 2k5u n ASP 26 N 1.50 1.91 0.00 3.68 5.75 -1.26 -2.32 116.55 125.81 2k5u n ASP 26 Ca 0.01 0.83 0.00 0.00 -0.01 0.00 0.00 54.79 55.62 2k5u n ASP 26 Cb 0.44 -1.53 0.00 0.00 -1.03 0.00 0.00 41.12 39.00 2k5u n ASP 26 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2k5u n GLY 27 N 0.97 0.62 0.27 6.12 0.00 -1.26 -4.87 105.19 107.05 2k5u n GLY 27 Ca 0.15 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.35 2k5u n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k5u h ALA 28 N 0.00 1.00 0.00 4.61 0.00 -1.73 -3.45 119.26 119.69 2k5u h ALA 28 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2k5u h ALA 28 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2k5u h ALA 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 2k5u n GLY 29 N -0.68 1.84 0.17 0.00 0.00 -1.26 -4.50 105.19 100.76 2k5u n GLY 29 Ca -0.01 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.05 2k5u n GLY 29 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2k5u h LYS 30 N 0.00 0.00 0.05 1.61 2.10 -1.94 -2.22 116.57 116.17 2k5u h LYS 30 Ca 0.00 0.00 -0.22 0.00 -2.00 0.00 0.00 60.65 58.43 2k5u h LYS 30 Cb 0.00 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 31.35 2k5u h LYS 30 CO 0.00 0.43 -0.87 1.15 -2.00 0.00 0.00 179.45 178.16 2k5u h THR 31 N 0.00 1.38 -0.27 0.07 2.02 -1.97 -1.80 112.91 112.34 2k5u h THR 31 Ca -0.00 -2.26 -0.09 0.00 0.77 0.00 0.00 66.41 64.82 2k5u h THR 31 Cb 1.03 2.66 -0.01 0.00 -1.74 0.00 0.00 68.15 70.09 2k5u h THR 31 CO 0.06 0.67 -0.18 0.74 0.37 0.00 0.00 175.52 177.18 2k5u h THR 32 N 0.05 1.30 -0.32 3.16 2.02 -1.97 -2.97 112.91 114.18 2k5u h THR 32 Ca -0.12 -1.30 -0.16 0.00 0.77 0.00 0.00 66.41 65.60 2k5u h THR 32 Cb 1.58 1.56 -0.01 0.00 -1.74 0.00 0.00 68.15 69.54 2k5u h THR 32 CO 0.17 0.41 -0.43 1.62 0.37 0.00 0.00 175.52 177.66 2k5u h VAL 33 N 0.33 1.28 -0.19 3.16 3.04 -1.51 -2.81 116.25 119.55 2k5u h VAL 33 Ca 0.05 -1.61 0.04 0.00 -1.01 0.00 0.00 66.70 64.18 2k5u h VAL 33 Cb 0.71 1.49 -0.04 0.00 -2.01 0.00 0.00 31.29 31.44 2k5u h VAL 33 CO 0.05 0.53 -0.08 0.25 -1.01 0.00 0.00 177.57 177.31 2k5u h LEU 34 N 0.65 -0.27 -1.19 3.16 6.46 -1.32 0.29 115.31 123.08 2k5u h LEU 34 Ca 0.05 0.07 -0.01 0.00 -0.12 0.00 0.00 57.88 57.87 2k5u h LEU 34 Cb 1.00 0.16 -0.03 0.00 -0.73 0.00 0.00 40.66 41.05 2k5u h LEU 34 CO 0.10 -0.10 0.39 0.22 -0.62 0.00 0.00 178.44 178.42 2k5u h TYR 35 N -0.05 0.92 -0.32 1.25 5.03 -1.53 -1.61 116.97 120.67 2k5u h TYR 35 Ca 0.10 -0.01 -0.15 0.00 2.58 0.00 0.00 58.73 61.26 2k5u h TYR 35 Cb 0.20 -0.30 -0.01 0.00 1.55 0.00 0.00 36.73 38.17 2k5u h TYR 35 CO -0.24 0.63 -0.39 0.87 -1.32 0.00 0.00 178.16 177.72 2k5u h LYS 36 N 0.95 0.76 0.00 1.82 6.56 -1.03 -2.73 116.57 122.90 2k5u h LYS 36 Ca 0.24 -0.39 0.00 0.00 -1.06 0.00 0.00 60.65 59.45 2k5u h LYS 36 Cb 0.01 0.01 0.00 0.00 -0.57 0.00 0.00 32.23 31.68 2k5u h LYS 36 CO -0.04 1.01 0.00 1.28 -2.06 0.00 0.00 179.45 179.64 2k5u n LEU 37 N -4.05 0.00 0.00 2.94 4.77 0.92 -4.92 117.00 116.66 2k5u n LEU 37 Ca -0.02 0.28 0.00 0.00 -0.03 0.00 0.00 56.01 56.24 2k5u n LEU 37 Cb 0.53 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 2k5u n LEU 37 CO 0.47 -0.02 0.00 0.29 -1.33 0.00 0.00 177.39 176.80 2k5u n LYS 38 N -1.28 0.00 -2.46 3.23 5.02 -0.65 -4.74 118.16 117.28 2k5u n LYS 38 Ca 0.13 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.40 2k5u n LYS 38 Cb 0.22 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.23 2k5u n LYS 38 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2k5u n LEU 39 N 0.00 -5.46 0.00 -0.35 4.77 -1.26 -4.66 117.00 110.03 2k5u n LEU 39 Ca 0.00 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 2k5u n LEU 39 Cb 0.00 -2.54 0.00 0.00 -2.33 0.00 0.00 43.42 38.55 2k5u n LEU 39 CO 0.00 -1.09 0.00 0.61 -1.33 0.00 0.00 177.39 175.58 2k5u n GLY 40 N -1.01 1.01 3.18 -0.72 0.00 -1.26 -3.56 105.19 102.83 2k5u n GLY 40 Ca 0.03 0.31 -0.35 0.00 0.00 0.00 0.00 46.02 46.01 2k5u n GLY 40 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k5u s GLU 41 N 0.00 2.49 -0.50 1.61 2.02 -1.26 -5.06 118.70 118.00 2k5u s GLU 41 Ca 0.00 -1.23 -0.27 0.00 0.02 0.00 0.00 54.97 53.49 2k5u s GLU 41 Cb 0.00 -3.17 -0.03 0.00 0.10 0.00 0.00 34.13 31.03 2k5u s GLU 41 CO 0.00 -0.60 1.92 0.54 0.02 0.00 0.00 175.26 177.14 2k5u s VAL 42 N 1.27 3.34 -0.02 2.63 0.11 -1.23 -4.59 120.40 121.90 2k5u s VAL 42 Ca -0.05 0.26 -0.18 0.00 -2.93 0.00 0.00 61.98 59.09 2k5u s VAL 42 Cb -0.19 -3.71 -0.05 0.00 -1.53 0.00 0.00 36.38 30.89 2k5u s VAL 42 CO -0.01 -0.62 0.49 -0.51 -3.33 0.00 0.00 175.10 171.12 2k5u s ILE 43 N 8.80 5.00 -0.32 7.04 1.10 -1.09 -4.97 121.20 136.76 2k5u s ILE 43 Ca 0.76 1.02 -0.15 0.00 -0.51 0.00 0.00 60.65 61.77 2k5u s ILE 43 Cb -0.16 -3.82 -0.02 0.00 0.15 0.00 0.00 42.46 38.61 2k5u s ILE 43 CO 0.26 0.47 0.36 0.42 -2.11 0.00 0.00 174.94 174.33 2k5u s THR 44 N -0.38 5.17 0.13 4.00 -4.23 -1.26 -2.66 115.64 116.40 2k5u s THR 44 Ca 0.27 0.17 0.05 0.00 -1.18 0.00 0.00 61.69 61.00 2k5u s THR 44 Cb -0.17 -3.78 -0.04 0.00 1.34 0.00 0.00 72.50 69.85 2k5u s THR 44 CO 0.14 -0.02 -0.13 -0.89 -0.54 0.00 0.00 174.62 173.18 2k5u s THR 45 N 2.02 1.27 -0.24 3.99 2.01 -1.06 -5.04 115.64 118.60 2k5u s THR 45 Ca 0.12 -1.80 0.02 0.00 0.31 0.00 0.00 61.69 60.34 2k5u s THR 45 Cb -0.16 -1.60 0.06 0.00 0.01 0.00 0.00 72.50 70.81 2k5u s THR 45 CO 0.11 -0.51 -0.09 -0.63 -0.69 0.00 0.00 174.62 172.81 2k5u s ILE 46 N -2.46 1.89 0.17 1.82 -1.09 -1.26 -2.29 121.20 117.98 2k5u s ILE 46 Ca 0.11 -1.39 -0.12 0.00 -2.23 0.00 0.00 60.65 57.02 2k5u s ILE 46 Cb -0.03 -2.03 0.07 0.00 -1.58 0.00 0.00 42.46 38.89 2k5u s ILE 46 CO 0.02 -0.00 1.70 1.55 -1.23 0.00 0.00 174.94 176.99 2k5u h PRO 47 N 7.86 0.90 -2.23 2.79 0.13 -1.97 -3.47 132.00 136.02 2k5u h PRO 47 Ca -0.21 -0.19 0.07 0.00 -0.87 0.00 0.00 66.00 64.80 2k5u h PRO 47 Cb 1.06 -0.13 -0.16 0.00 0.13 0.00 0.00 31.00 31.89 2k5u h PRO 47 CO 0.45 0.80 0.44 0.99 -0.23 0.00 0.00 178.00 180.45 2k5u s THR 48 N -5.43 0.00 0.00 1.56 2.01 -1.26 -5.05 115.64 107.46 2k5u s THR 48 Ca -0.13 0.00 0.00 0.00 0.31 0.00 0.00 61.69 61.87 2k5u s THR 48 Cb 0.13 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.64 2k5u s THR 48 CO 0.80 0.00 0.00 -0.38 -0.69 0.00 0.00 174.62 174.35 2k5u n ILE 49 N 0.01 0.00 -3.17 1.82 2.08 -1.26 -1.80 119.36 117.04 2k5u n ILE 49 Ca -0.11 0.00 -0.22 0.00 0.56 0.00 0.00 62.75 62.98 2k5u n ILE 49 Cb 0.61 0.00 -0.05 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 3.97 3.48 7.39 0.00 -1.26 -5.09 105.19 113.69 2k5u n GLY 50 Ca 0.00 -2.01 -0.33 0.00 0.00 0.00 0.00 46.02 43.68 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 -2.34 2.71 -0.20 1.61 0.40 -0.75 -5.10 117.98 114.32 2k5u s PHE 51 Ca 0.41 -0.15 -0.05 0.00 -0.60 0.00 0.00 56.93 56.53 2k5u s PHE 51 Cb 0.27 -1.64 -0.02 0.00 0.51 0.00 0.00 43.02 42.14 2k5u s PHE 51 CO -0.09 0.19 -0.00 1.21 0.70 0.00 0.00 175.22 177.22 2k5u s ASN 52 N -0.72 4.82 0.01 1.36 2.47 -1.26 -4.01 114.94 117.61 2k5u s ASN 52 Ca 0.11 -0.20 0.02 0.00 0.42 0.00 0.00 52.86 53.21 2k5u s ASN 52 Cb -0.11 -1.82 -0.01 0.00 -1.45 0.00 0.00 41.25 37.86 2k5u s ASN 52 CO 0.01 0.07 -0.06 0.54 -3.72 0.00 0.00 177.10 173.94 2k5u s VAL 53 N 0.95 0.41 -0.22 -5.21 0.11 -0.97 -4.60 120.40 110.87 2k5u s VAL 53 Ca 0.01 -0.47 -0.06 0.00 -2.93 0.00 0.00 61.98 58.53 2k5u s VAL 53 Cb -0.14 -0.40 -0.03 0.00 -1.53 0.00 0.00 36.38 34.28 2k5u s VAL 53 CO 0.02 -0.05 0.04 -1.61 -3.33 0.00 0.00 175.10 170.17 2k5u s GLU 54 N -0.56 3.68 -0.13 1.54 8.01 -0.98 -2.55 118.70 127.70 2k5u s GLU 54 Ca -0.02 -0.48 0.02 0.00 0.01 0.00 0.00 54.97 54.50 2k5u s GLU 54 Cb -0.04 -3.21 0.01 0.00 -4.31 0.00 0.00 34.13 26.58 2k5u s GLU 54 CO -0.00 -0.05 -0.20 0.99 0.01 0.00 0.00 175.26 176.01 2k5u s THR 55 N 1.22 1.91 -0.00 3.63 2.01 -1.09 -1.17 115.64 122.14 2k5u s THR 55 Ca 0.04 -0.89 0.03 0.00 0.31 0.00 0.00 61.69 61.19 2k5u s THR 55 Cb -0.14 -1.70 -0.01 0.00 0.01 0.00 0.00 72.50 70.66 2k5u s THR 55 CO 0.02 0.52 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.68 2k5u s VAL 56 N 0.88 0.85 -0.18 3.82 1.01 -0.58 -2.68 120.40 123.52 2k5u s VAL 56 Ca -0.06 -0.52 0.01 0.00 0.00 0.00 0.00 61.98 61.41 2k5u s VAL 56 Cb -0.15 -0.72 0.02 0.00 0.00 0.00 0.00 36.38 35.52 2k5u s VAL 56 CO -0.02 0.20 -0.19 0.00 0.00 0.00 0.00 175.10 175.09 2k5u s GLN 57 N -0.36 3.02 -0.27 2.72 0.00 -1.26 -1.97 119.66 121.54 2k5u s GLN 57 Ca 0.03 -0.82 -0.02 0.00 -0.00 0.00 0.00 55.36 54.56 2k5u s GLN 57 Cb -0.05 -2.60 0.08 0.00 0.00 0.00 0.00 33.01 30.45 2k5u s GLN 57 CO -0.00 -0.20 0.07 -0.47 0.00 0.00 0.00 175.29 174.69 2k5u s TYR 58 N 1.28 1.39 -0.29 9.60 5.04 -0.54 -4.78 117.35 129.05 2k5u s TYR 58 Ca 0.05 -1.36 -0.23 0.00 -2.44 0.00 0.00 57.07 53.08 2k5u s TYR 58 Cb -0.13 -1.40 0.03 0.00 0.35 0.00 0.00 41.96 40.81 2k5u s TYR 58 CO -0.12 -0.78 0.41 0.36 -1.34 0.00 0.00 175.55 174.08 2k5u n LYS 59 N 4.94 -1.17 0.00 4.97 0.00 -1.26 -0.78 118.16 124.86 2k5u n LYS 59 Ca -0.05 0.85 0.00 0.00 -0.00 0.00 0.00 58.31 59.11 2k5u n LYS 59 Cb 0.44 -1.23 0.00 0.00 -0.00 0.00 0.00 35.03 34.24 2k5u n LYS 59 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 2k5u n ASN 60 N 0.19 0.00 -4.58 -5.58 2.85 -1.26 -4.93 115.26 101.95 2k5u n ASN 60 Ca -0.06 0.00 -0.41 0.00 -0.11 0.00 0.00 54.58 54.00 2k5u n ASN 60 Cb 0.42 0.00 0.02 0.00 1.24 0.00 0.00 39.78 41.46 2k5u n ASN 60 CO 0.00 0.00 0.00 -0.38 -2.11 0.00 0.00 177.26 174.77 2k5u n ILE 61 N 0.00 2.53 -4.17 -1.44 5.41 0.04 -4.84 119.36 116.88 2k5u n ILE 61 Ca 0.00 -0.50 -0.14 0.00 1.00 0.00 0.00 62.75 63.11 2k5u n ILE 61 Cb 0.00 -1.02 -0.11 0.00 -0.71 0.00 0.00 39.64 37.80 2k5u n ILE 61 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 176.55 176.11 2k5u s SER 62 N -0.89 1.45 -0.08 4.38 0.01 -1.07 -1.47 113.70 116.02 2k5u s SER 62 Ca 0.66 -0.81 -0.04 0.00 1.31 0.00 0.00 55.95 57.08 2k5u s SER 62 Cb -0.53 0.01 0.04 0.00 0.21 0.00 0.00 66.02 65.75 2k5u s SER 62 CO 0.55 -0.26 0.18 0.12 0.41 0.00 0.00 173.24 174.24 2k5u s PHE 63 N -2.40 -0.22 -0.02 2.43 2.19 -0.83 -1.19 117.98 117.94 2k5u s PHE 63 Ca 0.05 0.61 0.05 0.00 0.33 0.00 0.00 56.93 57.97 2k5u s PHE 63 Cb -0.03 -0.10 -0.01 0.00 -1.31 0.00 0.00 43.02 41.57 2k5u s PHE 63 CO 0.00 -0.22 -0.17 0.99 1.83 0.00 0.00 175.22 177.66 2k5u s THR 64 N 1.56 1.33 0.07 0.12 2.01 -1.01 -1.52 115.64 118.20 2k5u s THR 64 Ca -0.05 -0.70 0.05 0.00 0.31 0.00 0.00 61.69 61.30 2k5u s THR 64 Cb -0.12 -1.12 -0.03 0.00 0.01 0.00 0.00 72.50 71.25 2k5u s THR 64 CO -0.07 0.38 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.40 2k5u s VAL 65 N -0.26 1.18 -0.28 3.82 1.01 -0.32 -0.38 120.40 125.18 2k5u s VAL 65 Ca 0.03 -1.32 -0.29 0.00 0.00 0.00 0.00 61.98 60.41 2k5u s VAL 65 Cb -0.08 -1.12 0.19 0.00 0.00 0.00 0.00 36.38 35.37 2k5u s VAL 65 CO 0.00 -0.20 1.34 -1.66 0.00 0.00 0.00 175.10 174.58 2k5u s TRP 66 N -1.24 -0.06 -0.23 5.22 -2.14 -1.24 -2.33 118.94 116.92 2k5u s TRP 66 Ca -0.01 0.11 -0.29 0.00 2.66 0.00 0.00 56.10 58.58 2k5u s TRP 66 Cb -0.10 0.49 0.01 0.00 -3.10 0.00 0.00 33.47 30.77 2k5u s TRP 66 CO 0.02 -0.06 1.06 -0.51 -2.66 0.00 0.00 176.95 174.80 2k5u s ASP 67 N -0.96 7.08 -0.52 -2.66 1.11 -1.26 -4.30 116.67 115.17 2k5u s ASP 67 Ca 0.08 1.39 -0.03 0.00 0.18 0.00 0.00 52.55 54.17 2k5u s ASP 67 Cb -0.01 -2.54 0.00 0.00 1.07 0.00 0.00 42.92 41.44 2k5u s ASP 67 CO -0.08 -0.68 0.36 0.52 1.18 0.00 0.00 175.17 176.47 2k5u n VAL 68 N 5.34 -1.84 -0.57 -1.27 0.31 -0.79 -4.83 118.33 114.68 2k5u n VAL 68 Ca 0.12 -0.05 0.09 0.00 -0.01 0.00 0.00 64.34 64.50 2k5u n VAL 68 Cb 0.46 -1.63 0.36 0.00 -0.91 0.00 0.00 33.84 32.12 2k5u n VAL 68 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2k5u n GLY 69 N -1.23 2.67 2.45 2.92 0.00 -1.26 -4.73 105.19 106.00 2k5u n GLY 69 Ca -0.18 -0.84 -0.15 0.00 0.00 0.00 0.00 46.02 44.85 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 1.17 2.65 0.00 -0.02 0.00 -1.26 -2.31 105.19 105.43 2k5u n GLY 70 Ca 0.26 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.52 2k5u n GLY 70 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k5u n GLN 71 N 3.56 0.00 -1.64 1.61 10.64 -1.26 -4.90 117.38 125.39 2k5u n GLN 71 Ca 0.35 0.00 -0.36 0.00 -1.83 0.00 0.00 57.00 55.15 2k5u n GLN 71 Cb 0.29 0.00 -0.03 0.00 -0.86 0.00 0.00 30.24 29.64 2k5u n GLN 71 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 2k5u s ASP 72 N 0.00 4.56 -0.46 2.61 2.15 -0.98 -4.91 116.67 119.65 2k5u s ASP 72 Ca 0.00 0.95 -0.05 0.00 0.43 0.00 0.00 52.55 53.88 2k5u s ASP 72 Cb 0.00 -2.51 0.12 0.00 -0.30 0.00 0.00 42.92 40.24 2k5u s ASP 72 CO 0.00 -2.81 0.29 -0.60 -0.17 0.00 0.00 175.17 171.88 2k5u s ARG 73 N 8.08 2.24 0.00 4.34 3.52 -1.26 -4.75 118.95 131.12 2k5u s ARG 73 Ca 0.92 -1.90 0.00 0.00 -0.13 0.00 0.00 55.73 54.62 2k5u s ARG 73 Cb -0.16 -3.72 0.00 0.00 -1.56 0.00 0.00 34.95 29.50 2k5u s ARG 73 CO 0.25 -1.13 0.00 0.44 -0.81 0.00 0.00 175.30 174.05 2k5u n ILE 74 N 4.55 0.00 -2.53 4.11 -0.00 -1.26 -5.17 119.36 119.06 2k5u n ILE 74 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.73 2k5u n ILE 74 Cb 0.41 -0.02 0.00 0.00 -0.00 0.00 0.00 39.64 40.03 2k5u n ILE 74 CO 0.00 0.00 0.00 -2.11 -0.00 0.00 0.00 176.55 174.44 2k5u n ARG 75 N -1.56 0.00 -0.58 6.28 1.85 -1.26 -5.01 116.66 116.38 2k5u n ARG 75 Ca 0.00 0.00 0.02 0.00 -1.00 0.00 0.00 57.85 56.87 2k5u n ARG 75 Cb 0.00 0.00 0.24 0.00 -1.05 0.00 0.00 32.46 31.65 2k5u n ARG 75 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 2k5u n SER 76 N -0.04 3.91 0.04 2.89 7.64 -1.26 -4.33 113.62 122.47 2k5u n SER 76 Ca 0.00 -2.62 -0.11 0.00 1.01 0.00 0.00 58.87 57.14 2k5u n SER 76 Cb 0.00 -0.63 -0.08 0.00 -1.01 0.00 0.00 64.21 62.49 2k5u n SER 76 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2k5u h LEU 77 N 2.35 -0.14 -1.21 -3.43 6.46 -1.97 -2.92 115.31 114.45 2k5u h LEU 77 Ca 0.04 -0.42 -0.06 0.00 -0.12 0.00 0.00 57.88 57.32 2k5u h LEU 77 Cb 1.50 0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 41.45 2k5u h LEU 77 CO 0.35 0.42 -0.12 4.11 -0.62 0.00 0.00 178.44 182.58 2k5u h TRP 78 N -0.80 0.43 -0.11 1.25 5.08 -1.90 -2.93 115.95 116.97 2k5u h TRP 78 Ca -0.02 -0.06 0.02 0.00 1.08 0.00 0.00 58.89 59.91 2k5u h TRP 78 Cb 0.55 -0.12 -0.02 0.00 -3.00 0.00 0.00 29.16 26.57 2k5u h TRP 78 CO 0.10 0.52 -0.00 0.00 -1.28 0.00 0.00 178.44 177.77 2k5u h ARG 79 N 0.38 0.03 0.41 0.12 3.08 -1.80 0.40 114.38 117.00 2k5u h ARG 79 Ca 0.07 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 2k5u h ARG 79 Cb 0.44 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 2k5u h ARG 79 CO 0.03 0.02 -0.33 0.45 -1.07 0.00 0.00 179.97 179.07 2k5u h HIS 80 N 0.03 -0.89 0.00 3.04 3.86 -1.34 -2.09 115.15 117.76 2k5u h HIS 80 Ca 0.05 -0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.24 2k5u h HIS 80 Cb 0.06 0.33 -0.00 0.00 1.06 0.00 0.00 27.41 28.86 2k5u h HIS 80 CO -0.13 -0.48 -0.08 1.88 0.86 0.00 0.00 177.93 179.97 2k5u h TYR 81 N -0.75 0.00 0.33 2.45 0.05 -1.41 -2.45 116.97 115.19 2k5u h TYR 81 Ca -0.04 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.73 2k5u h TYR 81 Cb 0.65 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.38 2k5u h TYR 81 CO -0.16 0.08 -0.28 1.88 -1.05 0.00 0.00 178.16 178.63 2k5u h TYR 82 N 0.00 -0.77 -0.53 4.88 -1.99 0.51 0.20 116.97 119.27 2k5u h TYR 82 Ca -0.00 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.73 2k5u h TYR 82 Cb 0.14 0.29 -0.03 0.00 2.00 0.00 0.00 36.73 39.14 2k5u h TYR 82 CO 0.00 -0.39 0.33 -0.09 -0.00 0.00 0.00 178.16 178.01 2k5u h ARG 83 N -0.60 0.71 -0.75 4.88 2.43 -1.48 -2.68 114.38 116.89 2k5u h ARG 83 Ca -0.04 -0.06 0.11 0.00 -0.81 0.00 0.00 59.98 59.18 2k5u h ARG 83 Cb 0.50 -0.15 -0.05 0.00 -0.42 0.00 0.00 29.97 29.85 2k5u h ARG 83 CO -0.01 0.50 0.50 -0.91 -1.51 0.00 0.00 179.97 178.54 2k5u h ASN 84 N 0.71 0.55 -3.80 -3.80 4.21 -1.29 -3.43 115.58 108.74 2k5u h ASN 84 Ca 0.19 0.02 -0.54 0.00 1.21 0.00 0.00 56.30 57.18 2k5u h ASN 84 Cb -0.03 -0.10 0.11 0.00 -1.12 0.00 0.00 38.32 37.17 2k5u h ASN 84 CO -0.04 0.32 0.80 0.35 -1.29 0.00 0.00 177.43 177.58 2k5u n THR 85 N -4.50 1.80 0.00 2.81 -2.24 0.69 -4.79 114.28 108.05 2k5u n THR 85 Ca 0.13 -0.45 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 2k5u n THR 85 Cb 0.38 -1.98 0.01 0.00 -2.10 0.00 0.00 70.33 66.63 2k5u n THR 85 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2k5u n GLU 86 N 0.78 1.55 -3.94 -0.78 4.71 -0.53 -4.83 120.64 117.61 2k5u n GLU 86 Ca 0.03 -1.16 -0.12 0.00 -0.01 0.00 0.00 57.16 55.90 2k5u n GLU 86 Cb 0.38 -1.01 -0.13 0.00 -1.01 0.00 0.00 31.44 29.67 2k5u n GLU 86 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 2k5u s GLY 87 N -0.65 0.10 -0.22 0.62 0.00 0.47 -4.10 107.32 103.54 2k5u s GLY 87 Ca 0.01 -0.18 -0.03 0.00 0.00 0.00 0.00 44.72 44.52 2k5u s GLY 87 CO 0.01 -0.19 0.08 0.54 0.00 0.00 0.00 173.10 173.54 2k5u s VAL 88 N -0.36 0.26 -0.15 1.40 0.11 -1.14 -1.91 120.40 118.61 2k5u s VAL 88 Ca -0.03 -0.59 0.02 0.00 -2.93 0.00 0.00 61.98 58.45 2k5u s VAL 88 Cb -0.03 -0.96 0.01 0.00 -1.53 0.00 0.00 36.38 33.87 2k5u s VAL 88 CO -0.00 -0.40 -0.21 -0.63 -3.33 0.00 0.00 175.10 170.53 2k5u s ILE 89 N 1.96 2.15 -0.17 7.04 -1.09 -0.95 -2.58 121.20 127.56 2k5u s ILE 89 Ca 0.03 -0.94 -0.06 0.00 -2.23 0.00 0.00 60.65 57.45 2k5u s ILE 89 Cb -0.17 -1.87 -0.04 0.00 -1.58 0.00 0.00 42.46 38.80 2k5u s ILE 89 CO -0.16 0.54 0.04 -0.36 -1.23 0.00 0.00 174.94 173.77 2k5u s PHE 90 N 0.89 3.21 -0.14 3.97 0.08 -0.92 -2.59 117.98 122.47 2k5u s PHE 90 Ca -0.05 0.01 0.01 0.00 0.12 0.00 0.00 56.93 57.02 2k5u s PHE 90 Cb -0.15 -2.04 0.02 0.00 -0.57 0.00 0.00 43.02 40.28 2k5u s PHE 90 CO -0.03 0.14 -0.16 0.08 -0.10 0.00 0.00 175.22 175.14 2k5u s VAL 91 N 0.30 1.69 0.32 -0.44 1.01 -1.06 -0.61 120.40 121.60 2k5u s VAL 91 Ca 0.02 -0.72 0.10 0.00 0.00 0.00 0.00 61.98 61.38 2k5u s VAL 91 Cb -0.13 -1.55 -0.06 0.00 0.00 0.00 0.00 36.38 34.65 2k5u s VAL 91 CO 0.01 0.48 -0.10 0.54 0.00 0.00 0.00 175.10 176.02 2k5u s VAL 92 N 1.28 2.49 -0.15 2.92 0.11 -1.10 -3.87 120.40 122.08 2k5u s VAL 92 Ca 0.01 -2.20 -0.21 0.00 -2.93 0.00 0.00 61.98 56.65 2k5u s VAL 92 Cb -0.14 -2.58 -0.03 0.00 -1.53 0.00 0.00 36.38 32.10 2k5u s VAL 92 CO -0.08 -0.28 0.60 -1.81 -3.33 0.00 0.00 175.10 170.20 2k5u s ASP 93 N -3.60 6.75 0.07 3.54 1.11 -1.26 -2.51 116.67 120.76 2k5u s ASP 93 Ca 0.32 0.90 0.25 0.00 0.18 0.00 0.00 52.55 54.20 2k5u s ASP 93 Cb -0.01 -2.34 1.00 0.00 1.07 0.00 0.00 42.92 42.63 2k5u s ASP 93 CO 0.17 -0.16 1.79 -1.20 1.18 0.00 0.00 175.17 176.95 2k5u n SER 94 N 4.37 0.26 -0.77 0.27 7.64 -1.09 -2.81 113.62 121.48 2k5u n SER 94 Ca -0.03 0.53 0.08 0.00 1.01 0.00 0.00 58.87 60.47 2k5u n SER 94 Cb 0.51 -0.60 0.13 0.00 -1.01 0.00 0.00 64.21 63.23 2k5u n SER 94 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2k5u n ASN 95 N -1.75 2.75 -3.43 6.43 4.05 -1.26 -1.48 115.26 120.56 2k5u n ASN 95 Ca 0.06 -1.80 -0.30 0.00 0.45 0.00 0.00 54.58 52.98 2k5u n ASN 95 Cb 0.32 -0.12 -0.06 0.00 1.23 0.00 0.00 39.78 41.15 2k5u n ASN 95 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 177.26 173.31 2k5u n ASP 96 N 0.98 4.40 -0.27 1.20 5.75 -1.12 -4.85 116.55 122.63 2k5u n ASP 96 Ca 0.12 -3.49 -0.06 0.00 -0.01 0.00 0.00 54.79 51.35 2k5u n ASP 96 Cb 0.45 -0.75 0.06 0.00 -1.03 0.00 0.00 41.12 39.85 2k5u n ASP 96 CO 0.00 0.00 0.00 -0.09 -0.11 0.00 0.00 177.20 177.00 2k5u h ARG 97 N 4.15 1.15 -0.02 0.11 2.43 -1.83 -2.11 114.38 118.26 2k5u h ARG 97 Ca 0.20 -0.23 0.01 0.00 -0.81 0.00 0.00 59.98 59.14 2k5u h ARG 97 Cb 0.61 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 29.99 2k5u h ARG 97 CO 0.92 0.96 0.25 0.77 -1.51 0.00 0.00 179.97 181.37 2k5u h SER 98 N 1.11 0.00 -0.08 -3.80 0.02 -1.97 0.21 113.55 109.03 2k5u h SER 98 Ca 0.25 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.20 2k5u h SER 98 Cb 0.27 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.81 2k5u h SER 98 CO -0.01 0.00 0.00 0.54 -1.14 0.00 0.00 176.83 176.22 2k5u n ARG 99 N -3.00 0.95 -0.18 3.45 1.74 -0.84 -4.60 116.66 114.17 2k5u n ARG 99 Ca -0.02 -1.26 0.13 0.00 -0.77 0.00 0.00 57.85 55.93 2k5u n ARG 99 Cb 0.31 -1.17 0.46 0.00 -1.02 0.00 0.00 32.46 31.04 2k5u n ARG 99 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 2k5u h ILE 100 N 1.63 0.84 -0.20 0.55 6.09 -0.07 0.44 117.51 126.80 2k5u h ILE 100 Ca 0.00 -0.18 -0.13 0.00 -1.37 0.00 0.00 64.86 63.18 2k5u h ILE 100 Cb 0.44 0.27 -0.01 0.00 0.47 0.00 0.00 36.82 38.00 2k5u h ILE 100 CO 0.00 0.10 -0.43 1.23 -3.07 0.00 0.00 178.15 175.98 2k5u h GLY 101 N 0.52 0.52 1.51 8.18 0.00 -1.81 -0.74 103.07 111.25 2k5u h GLY 101 Ca 0.37 -0.53 -0.14 0.00 0.00 0.00 0.00 47.33 47.04 2k5u h GLY 101 CO -0.13 0.48 -0.45 0.83 0.00 0.00 0.00 176.54 177.26 2k5u h GLU 102 N 0.39 0.53 -0.25 4.80 5.08 -0.63 -1.89 114.58 122.62 2k5u h GLU 102 Ca 0.03 -0.29 -0.09 0.00 -1.00 0.00 0.00 59.36 58.02 2k5u h GLU 102 Cb 0.91 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.17 2k5u h GLU 102 CO 0.08 0.88 -0.18 0.00 -1.00 0.00 0.00 179.01 178.78 2k5u h ALA 103 N 1.08 0.35 -0.26 3.43 0.00 -0.14 -2.69 119.26 121.03 2k5u h ALA 103 Ca 0.03 -0.34 -0.07 0.00 0.00 0.00 0.00 54.91 54.52 2k5u h ALA 103 Cb 0.96 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 2k5u h ALA 103 CO 0.09 0.27 -0.16 0.07 0.00 0.00 0.00 179.25 179.52 2k5u h ARG 104 N 0.27 0.45 -0.35 0.00 -0.00 -1.07 -1.90 114.38 111.78 2k5u h ARG 104 Ca 0.05 -0.13 -0.05 0.00 -0.00 0.00 0.00 59.98 59.84 2k5u h ARG 104 Cb 0.72 -0.04 -0.01 0.00 -0.00 0.00 0.00 29.97 30.63 2k5u h ARG 104 CO 0.05 0.60 0.01 1.49 -0.00 0.00 0.00 179.97 182.12 2k5u h GLU 105 N 0.41 0.60 -0.59 0.08 4.22 -1.27 0.41 114.58 118.44 2k5u h GLU 105 Ca 0.07 -0.18 -0.10 0.00 0.08 0.00 0.00 59.36 59.23 2k5u h GLU 105 Cb 0.52 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 2k5u h GLU 105 CO 0.03 0.71 -0.03 -0.24 -2.18 0.00 0.00 179.01 177.30 2k5u h VAL 106 N 0.42 1.27 -0.39 0.32 3.04 -1.35 0.46 116.25 120.01 2k5u h VAL 106 Ca 0.10 -1.19 -0.11 0.00 -1.01 0.00 0.00 66.70 64.49 2k5u h VAL 106 Cb 0.43 0.84 -0.01 0.00 -2.01 0.00 0.00 31.29 30.54 2k5u h VAL 106 CO 0.01 0.43 -0.17 -0.03 -1.01 0.00 0.00 177.57 176.81 2k5u h MET 107 N 0.96 0.81 -0.39 4.17 1.85 -1.21 -1.47 114.93 119.64 2k5u h MET 107 Ca 0.16 -0.34 -0.05 0.00 -0.61 0.00 0.00 59.70 58.86 2k5u h MET 107 Cb 0.60 -0.03 -0.01 0.00 0.43 0.00 0.00 31.60 32.58 2k5u h MET 107 CO 0.04 0.97 0.04 1.96 -0.40 0.00 0.00 176.91 179.52 2k5u h GLN 108 N 0.61 0.67 -0.59 0.39 1.08 -0.00 -0.61 115.11 116.67 2k5u h GLN 108 Ca 0.09 -0.19 -0.08 0.00 -1.45 0.00 0.00 58.65 57.01 2k5u h GLN 108 Cb 0.72 -0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 28.05 2k5u h GLN 108 CO 0.05 0.74 0.04 -0.09 -0.95 0.00 0.00 178.83 178.61 2k5u h ARG 109 N 0.51 0.99 -0.32 1.46 1.12 -0.88 -2.62 114.38 114.65 2k5u h ARG 109 Ca 0.12 -0.28 -0.11 0.00 -1.11 0.00 0.00 59.98 58.59 2k5u h ARG 109 Cb 0.41 -0.11 -0.01 0.00 -0.01 0.00 0.00 29.97 30.25 2k5u h ARG 109 CO 0.01 0.96 -0.26 1.98 -3.11 0.00 0.00 179.97 179.55 2k5u h MET 110 N 0.92 0.63 0.00 0.20 4.05 -1.10 -2.59 114.93 117.04 2k5u h MET 110 Ca 0.17 -0.25 0.00 0.00 -0.28 0.00 0.00 59.70 59.34 2k5u h MET 110 Cb 0.49 -0.03 0.00 0.00 -0.80 0.00 0.00 31.60 31.26 2k5u h MET 110 CO 0.02 0.82 0.00 -0.11 0.23 0.00 0.00 176.91 177.88 2k5u n LEU 111 N -4.11 0.71 -0.12 3.39 0.00 -0.25 -2.40 117.00 114.22 2k5u n LEU 111 Ca -0.00 0.66 0.10 0.00 0.00 0.00 0.00 56.01 56.77 2k5u n LEU 111 Cb 0.43 -0.54 0.55 0.00 0.00 0.00 0.00 43.42 43.86 2k5u n LEU 111 CO 0.44 -0.51 0.86 -3.20 0.00 0.00 0.00 177.39 174.98 2k5u n ASN 112 N -2.26 0.37 -4.64 1.96 5.15 -0.98 -4.71 115.26 110.15 2k5u n ASN 112 Ca 0.03 -1.44 -0.43 0.00 -0.60 0.00 0.00 54.58 52.14 2k5u n ASN 112 Cb 0.26 -0.02 -0.03 0.00 -0.53 0.00 0.00 39.78 39.46 2k5u n ASN 112 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 2k5u s GLU 113 N -1.96 4.11 0.36 1.20 2.56 -1.01 -4.93 118.70 119.04 2k5u s GLU 113 Ca 0.31 1.05 0.04 0.00 0.00 0.00 0.00 54.97 56.37 2k5u s GLU 113 Cb 0.15 -3.70 0.69 0.00 2.00 0.00 0.00 34.13 33.27 2k5u s GLU 113 CO 0.24 -0.75 1.99 0.22 -0.56 0.00 0.00 175.26 176.41 2k5u h ASP 114 N 7.87 0.61 0.28 -1.70 1.82 -1.91 0.12 116.42 123.51 2k5u h ASP 114 Ca -0.21 -0.04 0.00 0.00 -0.39 0.00 0.00 57.03 56.39 2k5u h ASP 114 Cb 1.07 -0.15 0.00 0.00 0.68 0.00 0.00 39.33 40.93 2k5u h ASP 114 CO 0.98 0.49 0.00 -0.62 -1.61 0.00 0.00 179.24 178.47 2k5u n GLU 115 N -4.41 0.06 -0.30 0.28 1.02 -1.26 -2.43 120.64 113.59 2k5u n GLU 115 Ca 0.04 0.43 0.00 0.00 -0.02 0.00 0.00 57.16 57.62 2k5u n GLU 115 Cb 0.09 -1.64 0.00 0.00 -0.02 0.00 0.00 31.44 29.87 2k5u n GLU 115 CO 0.00 0.00 0.00 1.47 1.18 0.00 0.00 177.13 179.78 2k5u n LEU 116 N -1.76 0.10 0.33 -4.62 -0.00 -0.76 -4.72 117.00 105.57 2k5u n LEU 116 Ca 0.01 -0.72 0.19 0.00 -0.00 0.00 0.00 56.01 55.49 2k5u n LEU 116 Cb 0.10 -0.01 1.02 0.00 -0.00 0.00 0.00 43.42 44.52 2k5u n LEU 116 CO 0.09 0.18 1.15 -0.09 -0.00 0.00 0.00 177.39 178.72 2k5u h ARG 117 N 0.00 0.00 -0.32 1.47 2.43 -0.44 0.22 114.38 117.73 2k5u h ARG 117 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2k5u h ARG 117 Cb 1.23 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 2k5u h ARG 117 CO 0.00 0.00 0.00 0.27 -1.51 0.00 0.00 179.97 178.73 2k5u n ASN 118 N -2.95 3.39 -4.79 -3.80 0.23 -1.26 -5.02 115.26 101.06 2k5u n ASN 118 Ca -0.02 -2.43 -0.36 0.00 -0.53 0.00 0.00 54.58 51.24 2k5u n ASN 118 Cb 0.21 -0.37 -0.04 0.00 -2.08 0.00 0.00 39.78 37.50 2k5u n ASN 118 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2k5u s ALA 119 N -1.78 3.01 -0.49 -2.53 0.00 0.77 -4.94 121.76 115.79 2k5u s ALA 119 Ca 0.32 0.69 -0.27 0.00 0.00 0.00 0.00 51.96 52.70 2k5u s ALA 119 Cb 0.22 -3.28 -0.02 0.00 0.00 0.00 0.00 23.12 20.04 2k5u s ALA 119 CO 0.13 -0.28 1.87 0.00 0.00 0.00 0.00 175.76 177.47 2k5u s ALA 120 N -1.75 2.41 -0.16 0.00 0.00 -1.26 -4.84 121.76 116.15 2k5u s ALA 120 Ca 0.61 -0.25 -0.19 0.00 0.00 0.00 0.00 51.96 52.13 2k5u s ALA 120 Cb -0.21 -4.19 -0.03 0.00 0.00 0.00 0.00 23.12 18.69 2k5u s ALA 120 CO 0.26 -3.43 0.54 -1.58 0.00 0.00 0.00 175.76 171.55 2k5u s TRP 121 N 8.40 3.43 -0.16 0.00 0.52 -0.73 -2.88 118.94 127.53 2k5u s TRP 121 Ca 0.74 0.88 -0.04 0.00 0.02 0.00 0.00 56.10 57.70 2k5u s TRP 121 Cb -0.17 -2.67 0.07 0.00 -1.15 0.00 0.00 33.47 29.56 2k5u s TRP 121 CO 0.26 -0.02 0.17 -1.17 0.02 0.00 0.00 176.95 176.22 2k5u s LEU 122 N 1.31 0.01 0.14 2.99 0.20 -1.06 -1.93 118.68 120.33 2k5u s LEU 122 Ca 0.27 -0.13 -0.19 0.00 0.69 0.00 0.00 54.13 54.77 2k5u s LEU 122 Cb -0.16 0.20 -0.07 0.00 -0.43 0.00 0.00 46.19 45.74 2k5u s LEU 122 CO 0.11 -0.31 0.62 -0.69 -0.29 0.00 0.00 176.35 175.79 2k5u s VAL 123 N 2.27 4.69 -0.08 1.68 1.01 0.32 -2.16 120.40 128.13 2k5u s VAL 123 Ca 0.05 1.17 0.03 0.00 0.00 0.00 0.00 61.98 63.22 2k5u s VAL 123 Cb -0.15 -3.86 0.01 0.00 0.00 0.00 0.00 36.38 32.38 2k5u s VAL 123 CO -0.09 0.37 -0.15 -0.36 0.00 0.00 0.00 175.10 174.87 2k5u s PHE 124 N -1.32 1.76 -0.27 5.22 0.08 0.22 -2.30 117.98 121.36 2k5u s PHE 124 Ca 0.36 -0.69 -0.19 0.00 0.12 0.00 0.00 56.93 56.53 2k5u s PHE 124 Cb -0.18 -1.25 -0.02 0.00 -0.57 0.00 0.00 43.02 41.00 2k5u s PHE 124 CO 0.20 -0.32 0.58 0.00 -0.10 0.00 0.00 175.22 175.58 2k5u s ALA 125 N 0.61 3.58 -0.30 5.36 0.00 0.73 -2.69 121.76 129.04 2k5u s ALA 125 Ca -0.15 -0.57 -0.01 0.00 0.00 0.00 0.00 51.96 51.23 2k5u s ALA 125 Cb -0.16 -2.99 0.06 0.00 0.00 0.00 0.00 23.12 20.02 2k5u s ALA 125 CO 0.05 -0.86 -0.01 1.21 0.00 0.00 0.00 175.76 176.15 2k5u s ASN 126 N 1.55 4.81 0.00 0.00 2.47 -1.05 -0.49 114.94 122.24 2k5u s ASN 126 Ca 0.24 -1.38 0.00 0.00 0.42 0.00 0.00 52.86 52.14 2k5u s ASN 126 Cb -0.15 -1.68 0.00 0.00 -1.45 0.00 0.00 41.25 37.97 2k5u s ASN 126 CO 0.10 -0.27 0.00 0.29 -3.72 0.00 0.00 177.10 173.50 2k5u n LYS 127 N 4.56 0.00 0.18 0.43 4.01 -0.95 -2.69 118.16 123.70 2k5u n LYS 127 Ca -0.12 0.00 0.14 0.00 -0.51 0.00 0.00 58.31 57.82 2k5u n LYS 127 Cb 0.43 0.00 0.48 0.00 -0.51 0.00 0.00 35.03 35.43 2k5u n LYS 127 CO 0.00 0.00 0.00 1.96 -1.11 0.00 0.00 177.40 178.25 2k5u h GLN 128 N 0.00 0.00 0.00 1.97 7.50 -1.16 -2.77 115.11 120.66 2k5u h GLN 128 Ca 0.00 0.00 -0.05 0.00 0.50 0.00 0.00 58.65 59.10 2k5u h GLN 128 Cb 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.52 2k5u h GLN 128 CO 0.00 0.00 -0.22 0.38 -1.50 0.00 0.00 178.83 177.49 2k5u h ASP 129 N 0.00 0.00 -3.49 1.46 2.03 -1.93 -3.44 116.42 111.06 2k5u h ASP 129 Ca 0.00 0.00 -0.52 0.00 -0.73 0.00 0.00 57.03 55.78 2k5u h ASP 129 Cb 0.59 0.00 0.04 0.00 -0.83 0.00 0.00 39.33 39.13 2k5u h ASP 129 CO 0.00 0.22 0.66 -0.76 -1.03 0.00 0.00 179.24 178.33 2k5u s LEU 130 N -6.98 4.42 0.45 0.15 1.43 -1.04 -4.92 118.68 112.17 2k5u s LEU 130 Ca -0.01 2.50 0.22 0.00 -1.03 0.00 0.00 54.13 55.82 2k5u s LEU 130 Cb 0.11 -3.62 1.04 0.00 0.03 0.00 0.00 46.19 43.75 2k5u s LEU 130 CO 0.63 -0.55 1.90 1.55 0.23 0.00 0.00 176.35 180.11 2k5u h PRO 131 N 4.89 0.00 -0.51 1.29 0.13 -1.89 -2.82 132.00 133.09 2k5u h PRO 131 Ca -0.46 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.49 2k5u h PRO 131 Cb 1.22 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.24 2k5u h PRO 131 CO 0.75 0.24 0.13 -0.85 -0.23 0.00 0.00 178.00 178.04 2k5u n GLU 132 N -3.64 2.66 -3.15 0.86 0.28 -1.26 -5.00 120.64 111.39 2k5u n GLU 132 Ca -0.01 -3.05 -0.35 0.00 -0.16 0.00 0.00 57.16 53.59 2k5u n GLU 132 Cb 0.37 -1.97 -0.06 0.00 1.43 0.00 0.00 31.44 31.20 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 -3.08 3.42 0.44 -1.84 0.00 -1.07 -4.84 121.76 114.78 2k5u s ALA 133 Ca 0.48 0.08 -0.22 0.00 0.00 0.00 0.00 51.96 52.31 2k5u s ALA 133 Cb 0.41 -2.75 -0.10 0.00 0.00 0.00 0.00 23.12 20.68 2k5u s ALA 133 CO 0.07 0.35 1.00 -1.64 0.00 0.00 0.00 175.76 175.54 2k5u s MET 134 N -2.27 4.08 0.41 0.00 -1.94 -0.55 -5.02 119.30 114.02 2k5u s MET 134 Ca 0.45 1.30 -0.13 0.00 -1.71 0.00 0.00 55.69 55.60 2k5u s MET 134 Cb -0.15 -2.26 -0.07 0.00 2.01 0.00 0.00 34.83 34.36 2k5u s MET 134 CO 0.20 -0.18 0.82 0.45 -0.01 0.00 0.00 175.02 176.29 2k5u s SER 135 N -1.95 6.62 0.47 3.03 0.15 -1.26 -4.87 113.70 115.89 2k5u s SER 135 Ca 0.62 1.28 0.20 0.00 0.70 0.00 0.00 55.95 58.76 2k5u s SER 135 Cb -0.15 -2.38 1.20 0.00 -1.71 0.00 0.00 66.02 62.98 2k5u s SER 135 CO 0.19 -0.40 1.93 0.00 1.20 0.00 0.00 173.24 176.17 2k5u h ALA 136 N 1.43 2.31 0.02 5.45 0.00 -1.96 0.37 119.26 126.88 2k5u h ALA 136 Ca -0.47 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.43 2k5u h ALA 136 Cb 1.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2k5u h ALA 136 CO 0.63 -0.51 -0.01 0.00 0.00 0.00 0.00 179.25 179.36 2k5u h ALA 137 N 1.66 -0.03 -0.16 0.00 0.00 -1.96 0.20 119.26 118.97 2k5u h ALA 137 Ca 0.35 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 2k5u h ALA 137 Cb 1.01 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 2k5u h ALA 137 CO -0.08 -0.31 -0.39 0.93 0.00 0.00 0.00 179.25 179.40 2k5u h GLU 138 N -0.43 0.34 -0.31 0.00 5.08 -1.71 -2.59 114.58 114.97 2k5u h GLU 138 Ca -0.00 -0.16 -0.08 0.00 -1.00 0.00 0.00 59.36 58.12 2k5u h GLU 138 Cb 0.41 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 2k5u h GLU 138 CO 0.00 0.69 -0.11 0.82 -1.00 0.00 0.00 179.01 179.41 2k5u h ILE 139 N 0.29 1.29 -1.00 3.13 2.04 -0.25 0.03 117.51 123.03 2k5u h ILE 139 Ca 0.03 -1.18 0.05 0.00 1.00 0.00 0.00 64.86 64.76 2k5u h ILE 139 Cb 0.82 1.42 -0.06 0.00 -0.74 0.00 0.00 36.82 38.25 2k5u h ILE 139 CO 0.07 0.38 0.65 0.74 0.00 0.00 0.00 178.15 179.98 2k5u h THR 140 N 0.38 1.14 -0.02 -0.27 2.02 -0.43 0.79 112.91 116.51 2k5u h THR 140 Ca 0.07 -0.42 -0.20 0.00 0.77 0.00 0.00 66.41 66.63 2k5u h THR 140 Cb 0.62 -0.20 -0.00 0.00 -1.74 0.00 0.00 68.15 66.83 2k5u h THR 140 CO 0.04 0.22 -0.84 -0.33 0.37 0.00 0.00 175.52 174.98 2k5u h GLU 141 N 1.22 0.33 -0.36 6.66 5.08 -1.33 0.88 114.58 127.07 2k5u h GLU 141 Ca 0.41 -0.32 -0.10 0.00 -1.00 0.00 0.00 59.36 58.35 2k5u h GLU 141 Cb 0.07 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 2k5u h GLU 141 CO -0.15 1.00 -0.17 0.87 -1.00 0.00 0.00 179.01 179.56 2k5u h LYS 142 N 0.20 0.75 -0.20 2.33 6.56 -0.17 -2.86 116.57 123.19 2k5u h LYS 142 Ca -0.05 -0.33 0.00 0.00 -1.06 0.00 0.00 60.65 59.21 2k5u h LYS 142 Cb 1.45 -0.02 0.00 0.00 -0.57 0.00 0.00 32.23 33.09 2k5u h LYS 142 CO 0.14 0.94 0.00 1.47 -2.06 0.00 0.00 179.45 179.94 2k5u n LEU 143 N -4.30 1.19 -1.06 2.94 -0.00 0.19 -4.86 117.00 111.10 2k5u n LEU 143 Ca -0.02 -0.57 -0.11 0.00 -0.00 0.00 0.00 56.01 55.31 2k5u n LEU 143 Cb 0.40 -0.13 -0.03 0.00 -0.00 0.00 0.00 43.42 43.66 2k5u n LEU 143 CO 0.44 0.28 -0.12 0.61 -0.00 0.00 0.00 177.39 178.59 2k5u n GLY 144 N 0.91 0.70 0.28 1.47 0.00 -1.08 -4.80 105.19 102.66 2k5u n GLY 144 Ca 0.10 -0.46 0.18 0.00 0.00 0.00 0.00 46.02 45.84 2k5u n GLY 144 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2k5u h LEU 145 N 0.00 0.00 -0.48 0.99 3.38 0.54 -1.83 115.31 117.91 2k5u h LEU 145 Ca -0.25 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.65 2k5u h LEU 145 Cb 0.94 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.68 2k5u h LEU 145 CO 0.33 0.00 -0.33 1.12 0.09 0.00 0.00 178.44 179.66 2k5u h HIS 146 N 0.00 0.00 -0.06 1.13 2.07 -1.84 -3.01 115.15 113.43 2k5u h HIS 146 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2k5u h HIS 146 Cb 0.37 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.35 2k5u h HIS 146 CO 0.00 0.33 0.00 0.45 -3.07 0.00 0.00 177.93 175.64 2k5u n SER 147 N -3.29 1.29 -4.84 3.10 2.88 -0.69 -4.87 113.62 107.21 2k5u n SER 147 Ca 0.01 -1.51 -0.36 0.00 -1.33 0.00 0.00 58.87 55.68 2k5u n SER 147 Cb 0.58 -0.04 -0.07 0.00 -0.75 0.00 0.00 64.21 63.94 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 -1.93 5.26 -0.39 2.46 2.07 -1.14 -5.01 121.20 122.52 2k5u s ILE 148 Ca 0.36 0.08 -0.43 0.00 -1.41 0.00 0.00 60.65 59.26 2k5u s ILE 148 Cb 0.19 -3.29 -0.17 0.00 0.13 0.00 0.00 42.46 39.31 2k5u s ILE 148 CO 0.31 0.59 1.74 -1.14 -1.91 0.00 0.00 174.94 174.53 2k5u n ARG 149 N 1.92 0.59 -2.33 3.50 0.63 -1.26 -4.85 116.66 114.85 2k5u n ARG 149 Ca -0.19 0.21 -0.40 0.00 -0.92 0.00 0.00 57.85 56.55 2k5u n ARG 149 Cb 0.55 -1.83 -0.03 0.00 0.45 0.00 0.00 32.46 31.59 2k5u n ARG 149 CO 0.00 0.00 0.00 -0.80 -2.51 0.00 0.00 177.63 174.32 2k5u s ASN 150 N 3.74 7.06 0.00 6.15 -0.87 -1.26 -3.97 114.94 125.79 2k5u s ASN 150 Ca 1.03 2.43 0.00 0.00 -1.57 0.00 0.00 52.86 54.76 2k5u s ASN 150 Cb -1.27 -2.64 0.00 0.00 -0.02 0.00 0.00 41.25 37.33 2k5u s ASN 150 CO 0.72 -0.30 0.00 0.54 -2.57 0.00 0.00 177.10 175.48 2k5u n ARG 151 N 1.01 0.00 0.02 -0.60 1.74 -1.26 -4.91 116.66 112.67 2k5u n ARG 151 Ca -0.01 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.94 2k5u n ARG 151 Cb 0.44 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.86 2k5u n ARG 151 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 2k5u h PRO 152 N 0.00 0.57 -5.81 5.56 0.11 -1.90 -3.45 132.00 127.08 2k5u h PRO 152 Ca 0.00 -0.47 -0.66 0.00 0.11 0.00 0.00 66.00 64.98 2k5u h PRO 152 Cb 0.00 0.10 -0.09 0.00 0.11 0.00 0.00 31.00 31.12 2k5u h PRO 152 CO 0.00 1.09 -0.53 1.67 -0.21 0.00 0.00 178.00 180.02 2k5u s TRP 153 N -3.67 3.45 -0.02 0.65 1.48 -1.24 -1.78 118.94 117.82 2k5u s TRP 153 Ca -0.08 0.37 0.02 0.00 -1.06 0.00 0.00 56.10 55.36 2k5u s TRP 153 Cb 0.10 -1.85 0.00 0.00 -1.16 0.00 0.00 33.47 30.56 2k5u s TRP 153 CO 0.87 0.64 -0.07 -0.06 -4.06 0.00 0.00 176.95 174.27 2k5u s PHE 154 N -1.10 0.72 -0.08 1.66 0.08 -0.81 -4.97 117.98 113.48 2k5u s PHE 154 Ca 0.19 -0.16 0.02 0.00 0.12 0.00 0.00 56.93 57.10 2k5u s PHE 154 Cb -0.12 -0.52 -0.02 0.00 -0.57 0.00 0.00 43.02 41.79 2k5u s PHE 154 CO 0.09 -0.07 -0.14 -1.50 -0.10 0.00 0.00 175.22 173.50 2k5u s ILE 155 N 0.15 3.06 -0.07 0.64 1.10 -1.26 0.12 121.20 124.94 2k5u s ILE 155 Ca -0.02 -0.70 -0.03 0.00 -0.51 0.00 0.00 60.65 59.39 2k5u s ILE 155 Cb -0.07 -2.23 0.04 0.00 0.15 0.00 0.00 42.46 40.35 2k5u s ILE 155 CO -0.00 0.56 0.15 -1.58 -2.11 0.00 0.00 174.94 171.97 2k5u s GLN 156 N -0.29 0.09 0.02 3.50 2.00 -0.97 -5.00 119.66 119.01 2k5u s GLN 156 Ca 0.02 0.41 -0.22 0.00 -2.00 0.00 0.00 55.36 53.58 2k5u s GLN 156 Cb -0.13 -0.19 -0.06 0.00 0.80 0.00 0.00 33.01 33.43 2k5u s GLN 156 CO 0.03 -0.19 0.65 0.00 -0.50 0.00 0.00 175.29 175.28 2k5u s ALA 157 N 1.38 3.45 0.31 1.58 0.00 -1.26 -0.19 121.76 127.02 2k5u s ALA 157 Ca -0.07 0.12 -0.08 0.00 0.00 0.00 0.00 51.96 51.93 2k5u s ALA 157 Cb -0.12 -2.82 0.00 0.00 0.00 0.00 0.00 23.12 20.19 2k5u s ALA 157 CO -0.06 0.15 0.49 -0.08 0.00 0.00 0.00 175.76 176.26 2k5u s THR 158 N -0.21 0.00 -0.21 0.00 -1.32 0.36 -4.73 115.64 109.53 2k5u s THR 158 Ca 0.33 -1.48 -0.01 0.00 -1.21 0.00 0.00 61.69 59.32 2k5u s THR 158 Cb -0.19 -2.50 0.06 0.00 -1.51 0.00 0.00 72.50 68.36 2k5u s THR 158 CO 0.19 0.00 0.00 0.00 -2.21 0.00 0.00 174.62 172.60 2k5u h ALA 160 N 8.14 1.79 0.19 0.00 0.00 -1.90 -1.36 119.26 126.11 2k5u h ALA 160 Ca -0.17 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 2k5u h ALA 160 Cb 1.10 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2k5u h ALA 160 CO 0.37 0.16 -0.09 1.79 0.00 0.00 0.00 179.25 181.47 2k5u h THR 161 N 0.06 0.83 0.00 0.00 1.35 -1.95 -3.28 112.91 109.92 2k5u h THR 161 Ca 0.01 -0.98 0.00 0.00 -0.55 0.00 0.00 66.41 64.90 2k5u h THR 161 Cb 0.18 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 67.94 2k5u h THR 161 CO 0.01 0.19 -0.10 -1.20 -0.25 0.00 0.00 175.52 174.18 2k5u n SER 162 N -4.98 0.11 0.00 5.36 7.64 -1.23 -4.90 113.62 115.62 2k5u n SER 162 Ca -0.08 0.36 0.00 0.00 1.01 0.00 0.00 58.87 60.16 2k5u n SER 162 Cb 0.26 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 63.10 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 1.50 0.75 3.64 0.23 0.00 -0.53 -4.97 105.19 105.81 2k5u n GLY 163 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 2k5u n GLY 163 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2k5u s GLU 164 N -0.22 3.95 0.00 1.61 2.12 -1.15 -2.55 118.70 122.47 2k5u s GLU 164 Ca 0.00 1.47 0.00 0.00 0.36 0.00 0.00 54.97 56.80 2k5u s GLU 164 Cb 0.00 -3.90 0.00 0.00 0.26 0.00 0.00 34.13 30.49 2k5u s GLU 164 CO 0.00 -1.08 0.00 0.41 -0.54 0.00 0.00 175.26 174.05 2k5u n GLY 165 N 4.27 3.11 0.14 -1.50 0.00 -1.26 -0.68 105.19 109.27 2k5u n GLY 165 Ca 0.16 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.06 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 0.38 -0.08 0.99 3.38 -1.77 -1.06 115.31 117.15 2k5u h LEU 166 Ca 0.00 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.58 2k5u h LEU 166 Cb 0.00 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 2k5u h LEU 166 CO 0.00 0.67 0.00 1.88 0.09 0.00 0.00 178.44 181.09 2k5u h TYR 167 N 0.08 0.15 0.00 1.13 0.05 -1.92 -2.37 116.97 114.09 2k5u h TYR 167 Ca 0.05 -0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.78 2k5u h TYR 167 Cb 0.51 -0.04 -0.00 0.00 1.01 0.00 0.00 36.73 38.21 2k5u h TYR 167 CO 0.06 0.39 -0.11 1.49 -1.05 0.00 0.00 178.16 178.94 2k5u h GLU 168 N -0.13 0.00 0.01 4.88 4.81 -1.90 0.70 114.58 122.96 2k5u h GLU 168 Ca 0.02 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 59.02 2k5u h GLU 168 Cb 0.32 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.71 2k5u h GLU 168 CO 0.00 0.11 -0.97 0.78 -0.73 0.00 0.00 179.01 178.19 2k5u h GLY 169 N 0.50 0.50 0.42 1.92 0.00 -1.00 -2.45 103.07 102.97 2k5u h GLY 169 Ca -0.00 -0.90 -0.05 0.00 0.00 0.00 0.00 47.33 46.38 2k5u h GLY 169 CO 0.01 0.79 -0.21 -2.00 0.00 0.00 0.00 176.54 175.14 2k5u h LEU 170 N 0.25 0.19 -0.50 3.11 6.46 -0.90 -2.13 115.31 121.79 2k5u h LEU 170 Ca -0.09 -0.77 0.08 0.00 -0.12 0.00 0.00 57.88 56.98 2k5u h LEU 170 Cb 1.62 -0.06 -0.07 0.00 -0.73 0.00 0.00 40.66 41.42 2k5u h LEU 170 CO 0.17 0.93 0.12 -0.08 -0.62 0.00 0.00 178.44 178.97 2k5u h GLU 171 N -0.54 0.26 -0.31 1.25 4.57 -0.97 0.40 114.58 119.24 2k5u h GLU 171 Ca -0.02 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.12 2k5u h GLU 171 Cb 0.96 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.48 2k5u h GLU 171 CO 0.04 0.17 0.12 -1.49 -1.18 0.00 0.00 179.01 176.68 2k5u h TRP 172 N 0.27 0.48 -0.67 0.92 4.06 -1.51 -2.51 115.95 117.00 2k5u h TRP 172 Ca 0.25 -0.04 -0.01 0.00 2.06 0.00 0.00 58.89 61.15 2k5u h TRP 172 Cb 0.31 -0.14 -0.03 0.00 -1.00 0.00 0.00 29.16 28.30 2k5u h TRP 172 CO -0.21 0.46 0.38 1.25 -3.56 0.00 0.00 178.44 176.76 2k5u h LEU 173 N 0.36 0.81 -0.63 -4.49 5.85 -0.63 -2.46 115.31 114.11 2k5u h LEU 173 Ca 0.10 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 2k5u h LEU 173 Cb 0.19 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.98 2k5u h LEU 173 CO -0.01 0.64 0.35 -1.28 -0.34 0.00 0.00 178.44 177.81 2k5u h SER 174 N 0.92 0.78 -0.24 1.25 0.87 0.11 -2.03 113.55 115.21 2k5u h SER 174 Ca 0.24 -0.09 0.01 0.00 -1.23 0.00 0.00 61.79 60.72 2k5u h SER 174 Cb -0.00 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 61.75 2k5u h SER 174 CO -0.04 0.64 0.15 0.78 -0.53 0.00 0.00 176.83 177.83 2k5u h ASN 175 N 0.86 0.25 -0.29 6.23 4.21 -1.03 0.51 115.58 126.33 2k5u h ASN 175 Ca 0.22 -0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.73 2k5u h ASN 175 Cb 0.03 -0.06 -0.01 0.00 -1.12 0.00 0.00 38.32 37.16 2k5u h ASN 175 CO -0.04 0.18 0.19 0.77 -1.29 0.00 0.00 177.43 177.24 2k5u h SER 176 N 0.31 0.34 1.40 5.81 4.64 -1.31 0.57 113.55 125.31 2k5u h SER 176 Ca 0.09 -0.01 -0.11 0.00 -0.47 0.00 0.00 61.79 61.29 2k5u h SER 176 Cb -0.02 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 61.97 2k5u h SER 176 CO -0.04 0.25 -0.61 -0.07 -0.87 0.00 0.00 176.83 175.50 2k5u h LEU 177 N 0.40 0.00 0.00 5.97 3.38 -0.60 -3.40 115.31 121.06 2k5u h LEU 177 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2k5u h LEU 177 Cb -0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.72 2k5u h LEU 177 CO -0.02 0.52 0.00 1.17 0.09 0.00 0.00 178.44 180.20 2k5u n LYS 178 N -3.20 0.00 -3.65 1.13 0.00 0.17 -4.95 118.16 107.67 2k5u n LYS 178 Ca 0.01 0.21 -0.03 0.00 0.00 0.00 0.00 58.31 58.50 2k5u n LYS 178 Cb 0.75 -0.66 -0.07 0.00 0.00 0.00 0.00 35.03 35.06 2k5u n LYS 178 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2k5u s ASN 179 N -2.77 -0.12 0.66 3.14 4.22 0.18 -5.00 114.94 115.24 2k5u s ASN 179 Ca 0.00 0.23 0.00 0.00 -2.14 0.00 0.00 52.86 50.95 2k5u s ASN 179 Cb 0.00 0.36 0.00 0.00 1.28 0.00 0.00 41.25 42.89 2k5u s ASN 179 CO 0.00 -0.04 0.00 -1.20 -2.04 0.00 0.00 177.10 173.82 2k5u n SER 180 N 1.93 -6.77 0.00 3.54 7.64 -1.26 -4.70 113.62 114.01 2k5u n SER 180 Ca -0.12 0.66 0.00 0.00 1.01 0.00 0.00 58.87 60.43 2k5u n SER 180 Cb 0.57 -1.86 0.00 0.00 -1.01 0.00 0.00 64.21 61.90 2k5u n SER 180 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10