#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k5u s LEU 3 N 0.00 2.82 0.11 0.99 1.43 -1.26 -5.01 118.68 117.76 2k5u s LEU 3 Ca 0.00 -0.01 -0.12 0.00 -1.03 0.00 0.00 54.13 52.97 2k5u s LEU 3 Cb 0.00 -2.12 -0.13 0.00 0.03 0.00 0.00 46.19 43.97 2k5u s LEU 3 CO 0.00 -2.44 1.35 0.15 0.23 0.00 0.00 176.35 175.64 2k5u h PHE 4 N -1.24 1.10 -2.77 0.29 3.04 -2.10 -3.42 116.94 111.83 2k5u h PHE 4 Ca -0.41 -0.44 -0.57 0.00 3.98 0.00 0.00 57.97 60.53 2k5u h PHE 4 Cb 1.24 -0.19 -0.03 0.00 2.56 0.00 0.00 35.95 39.54 2k5u h PHE 4 CO -0.84 1.28 1.15 0.00 -2.02 0.00 0.00 178.31 177.88 2k5u s ALA 5 N -3.92 3.18 -0.08 2.41 0.00 -1.26 -4.95 121.76 117.13 2k5u s ALA 5 Ca -0.10 0.40 -0.31 0.00 0.00 0.00 0.00 51.96 51.95 2k5u s ALA 5 Cb 0.09 -3.89 0.08 0.00 0.00 0.00 0.00 23.12 19.41 2k5u s ALA 5 CO 0.90 -2.11 0.75 -1.54 0.00 0.00 0.00 175.76 173.77 2k5u s SER 6 N 4.58 -0.60 0.01 0.00 1.04 -1.26 -5.08 113.70 112.39 2k5u s SER 6 Ca 0.73 0.67 -0.04 0.00 0.48 0.00 0.00 55.95 57.79 2k5u s SER 6 Cb -0.24 0.52 -0.01 0.00 0.10 0.00 0.00 66.02 66.39 2k5u s SER 6 CO 0.30 -0.54 -0.07 1.17 0.98 0.00 0.00 173.24 175.09 2k5u n LYS 7 N 0.93 0.10 -0.00 4.02 3.00 -1.26 -5.02 118.16 119.93 2k5u n LYS 7 Ca -0.17 0.04 -0.00 0.00 -0.00 0.00 0.00 58.31 58.18 2k5u n LYS 7 Cb 0.57 -0.55 -0.00 0.00 0.00 0.00 0.00 35.03 35.05 2k5u n LYS 7 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 2k5u n LEU 8 N -3.29 0.06 -2.31 3.14 4.32 -1.26 -5.12 117.00 112.54 2k5u n LEU 8 Ca -0.03 0.01 -0.01 0.00 -0.02 0.00 0.00 56.01 55.96 2k5u n LEU 8 Cb 0.10 -0.25 -0.01 0.00 -1.62 0.00 0.00 43.42 41.64 2k5u n LEU 8 CO 0.04 -0.50 -0.49 0.33 -1.22 0.00 0.00 177.39 175.55 2k5u n PHE 9 N -2.56 -4.53 -3.63 -1.77 7.35 -1.26 -5.01 117.46 106.05 2k5u n PHE 9 Ca -0.00 2.68 -0.04 0.00 -0.76 0.00 0.00 57.45 59.33 2k5u n PHE 9 Cb 0.01 -3.76 -0.07 0.00 0.35 0.00 0.00 39.48 36.02 2k5u n PHE 9 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 2k5u s SER 10 N -0.58 -0.76 0.12 -2.13 0.15 -1.26 -4.93 113.70 104.31 2k5u s SER 10 Ca -0.04 1.20 0.00 0.00 0.70 0.00 0.00 55.95 57.81 2k5u s SER 10 Cb 0.00 1.36 0.00 0.00 -1.71 0.00 0.00 66.02 65.68 2k5u s SER 10 CO 0.11 -0.19 0.00 -3.20 1.20 0.00 0.00 173.24 171.16 2k5u n ASN 11 N 4.13 -0.24 -4.50 5.45 4.05 -1.26 -5.11 115.26 117.78 2k5u n ASN 11 Ca -0.19 0.21 -0.39 0.00 0.45 0.00 0.00 54.58 54.66 2k5u n ASN 11 Cb 0.58 0.34 0.03 0.00 1.23 0.00 0.00 39.78 41.96 2k5u n ASN 11 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 177.26 174.10 2k5u n LEU 12 N -2.88 1.24 -1.46 1.20 0.00 -1.26 -4.91 117.00 108.93 2k5u n LEU 12 Ca 0.00 0.82 -0.00 0.00 0.00 0.00 0.00 56.01 56.83 2k5u n LEU 12 Cb 0.00 -1.21 0.00 0.00 0.00 0.00 0.00 43.42 42.21 2k5u n LEU 12 CO 0.00 -2.65 0.24 0.33 0.00 0.00 0.00 177.39 175.32 2k5u n PHE 13 N -1.36 -0.03 0.05 1.96 7.35 -1.26 -4.92 117.46 119.25 2k5u n PHE 13 Ca 0.12 -0.03 -0.03 0.00 -0.76 0.00 0.00 57.45 56.75 2k5u n PHE 13 Cb 0.45 0.55 -0.01 0.00 0.35 0.00 0.00 39.48 40.81 2k5u n PHE 13 CO 0.00 0.00 0.00 0.78 -0.76 0.00 0.00 176.76 176.78 2k5u h GLY 14 N 0.02 -0.20 -3.63 7.13 0.00 -1.95 -3.35 103.07 101.08 2k5u h GLY 14 Ca -0.01 0.07 -0.37 0.00 0.00 0.00 0.00 47.33 47.02 2k5u h GLY 14 CO -0.00 -0.07 0.47 -2.01 0.00 0.00 0.00 176.54 174.93 2k5u n ASN 15 N -3.94 3.86 -2.99 0.19 2.85 -1.26 -4.97 115.26 109.00 2k5u n ASN 15 Ca -0.02 -3.28 -0.01 0.00 -0.11 0.00 0.00 54.58 51.16 2k5u n ASN 15 Cb 0.08 -0.77 -0.01 0.00 1.24 0.00 0.00 39.78 40.32 2k5u n ASN 15 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 2k5u n LYS 16 N -0.68 -1.75 -2.40 1.20 4.81 -1.26 -4.63 118.16 113.46 2k5u n LYS 16 Ca 0.47 1.66 -0.01 0.00 -0.87 0.00 0.00 58.31 59.56 2k5u n LYS 16 Cb 1.44 -2.50 -0.01 0.00 0.02 0.00 0.00 35.03 33.98 2k5u n LYS 16 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2k5u n GLU 17 N 1.43 -4.80 -3.19 1.64 1.02 -1.26 -5.03 120.64 110.44 2k5u n GLU 17 Ca -0.05 3.50 -0.18 0.00 -0.02 0.00 0.00 57.16 60.42 2k5u n GLU 17 Cb 0.30 -4.54 0.00 0.00 -0.02 0.00 0.00 31.44 27.18 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 -0.57 2.89 -0.31 3.49 0.23 -1.26 -4.84 119.30 118.92 2k5u s MET 18 Ca -0.05 -1.20 0.04 0.00 -1.03 0.00 0.00 55.69 53.45 2k5u s MET 18 Cb 0.00 -2.75 0.17 0.00 -1.53 0.00 0.00 34.83 30.73 2k5u s MET 18 CO 0.15 -0.16 0.48 0.50 -2.03 0.00 0.00 175.02 173.95 2k5u s ARG 19 N -4.28 0.53 0.01 3.16 3.52 -1.26 -2.86 118.95 117.77 2k5u s ARG 19 Ca 0.51 0.06 -0.29 0.00 -0.13 0.00 0.00 55.73 55.89 2k5u s ARG 19 Cb -0.09 -0.17 -0.04 0.00 -1.56 0.00 0.00 34.95 33.09 2k5u s ARG 19 CO 0.32 -1.08 0.92 0.42 -0.81 0.00 0.00 175.30 175.07 2k5u s ILE 20 N 2.39 4.84 0.15 4.11 -1.09 -0.50 0.20 121.20 131.31 2k5u s ILE 20 Ca 0.11 1.94 0.11 0.00 -2.23 0.00 0.00 60.65 60.59 2k5u s ILE 20 Cb -0.11 -4.27 -0.04 0.00 -1.58 0.00 0.00 42.46 36.46 2k5u s ILE 20 CO -0.23 0.20 -0.26 -1.48 -1.23 0.00 0.00 174.94 171.94 2k5u s LEU 21 N 0.80 2.36 -0.25 2.97 0.05 -1.00 -2.62 118.68 120.98 2k5u s LEU 21 Ca 0.48 -0.79 0.02 0.00 0.05 0.00 0.00 54.13 53.90 2k5u s LEU 21 Cb -0.21 -1.19 0.05 0.00 -2.05 0.00 0.00 46.19 42.79 2k5u s LEU 21 CO 0.26 0.16 -0.11 0.00 -0.55 0.00 0.00 176.35 176.11 2k5u s MET 22 N -2.25 2.43 0.22 1.48 0.23 -0.96 0.61 119.30 121.06 2k5u s MET 22 Ca 0.16 -1.22 0.08 0.00 -1.03 0.00 0.00 55.69 53.67 2k5u s MET 22 Cb -0.09 -2.87 -0.04 0.00 -1.53 0.00 0.00 34.83 30.29 2k5u s MET 22 CO 0.07 -0.50 0.05 0.14 -2.03 0.00 0.00 175.02 172.75 2k5u s VAL 23 N 1.17 3.83 0.00 5.16 -7.23 0.77 -3.28 120.40 120.81 2k5u s VAL 23 Ca -0.06 -1.55 0.00 0.00 -1.81 0.00 0.00 61.98 58.56 2k5u s VAL 23 Cb -0.19 -3.00 0.00 0.00 0.56 0.00 0.00 36.38 33.76 2k5u s VAL 23 CO -0.06 -0.24 0.00 0.61 -0.31 0.00 0.00 175.10 175.10 2k5u n GLY 24 N -0.59 -0.19 3.74 2.32 0.00 -1.26 -0.21 105.19 109.01 2k5u n GLY 24 Ca -0.08 -1.20 -0.37 0.00 0.00 0.00 0.00 46.02 44.36 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 3.73 0.58 0.99 1.43 -1.25 -1.21 118.68 122.96 2k5u s LEU 25 Ca 0.00 2.64 -0.20 0.00 -1.03 0.00 0.00 54.13 55.54 2k5u s LEU 25 Cb 0.00 -4.45 -0.05 0.00 0.03 0.00 0.00 46.19 41.73 2k5u s LEU 25 CO 0.00 -1.71 1.13 -0.67 0.23 0.00 0.00 176.35 175.33 2k5u n ASP 26 N -1.41 1.55 -0.59 2.29 -0.08 -1.26 -1.57 116.55 115.48 2k5u n ASP 26 Ca 0.13 0.87 -0.08 0.00 -1.51 0.00 0.00 54.79 54.20 2k5u n ASP 26 Cb 0.47 -1.47 -0.03 0.00 2.34 0.00 0.00 41.12 42.43 2k5u n ASP 26 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2k5u n GLY 27 N 1.07 0.73 0.33 0.27 0.00 -1.26 -4.82 105.19 101.51 2k5u n GLY 27 Ca 0.13 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.18 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 0.01 1.61 0.00 4.61 0.00 -1.64 -3.45 119.26 120.39 2k5u h ALA 28 Ca -0.16 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2k5u h ALA 28 Cb 1.13 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2k5u h ALA 28 CO 0.23 0.36 0.00 0.41 0.00 0.00 0.00 179.25 180.25 2k5u n GLY 29 N -1.45 0.00 0.17 0.00 0.00 -1.26 -4.74 105.19 97.90 2k5u n GLY 29 Ca 0.05 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.91 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 0.00 0.53 -0.90 1.61 1.57 -1.93 -2.87 116.57 114.58 2k5u h LYS 30 Ca 0.00 -0.47 0.07 0.00 -1.87 0.00 0.00 60.65 58.39 2k5u h LYS 30 Cb 0.00 0.11 -0.07 0.00 0.08 0.00 0.00 32.23 32.35 2k5u h LYS 30 CO 0.00 1.10 0.56 1.15 -0.57 0.00 0.00 179.45 181.69 2k5u h THR 31 N 0.12 1.02 -0.06 -0.16 2.02 -1.96 0.51 112.91 114.39 2k5u h THR 31 Ca -0.05 -0.34 -0.02 0.00 0.77 0.00 0.00 66.41 66.77 2k5u h THR 31 Cb 1.24 -0.06 -0.00 0.00 -1.74 0.00 0.00 68.15 67.59 2k5u h THR 31 CO 0.12 0.18 -0.02 0.00 0.37 0.00 0.00 175.52 176.16 2k5u h THR 32 N 0.99 1.31 -0.42 3.16 1.03 -1.96 -2.87 112.91 114.16 2k5u h THR 32 Ca 0.41 -1.00 -0.06 0.00 -0.01 0.00 0.00 66.41 65.75 2k5u h THR 32 Cb 0.24 1.85 -0.02 0.00 -1.07 0.00 0.00 68.15 69.15 2k5u h THR 32 CO -0.20 0.27 -0.01 0.58 -0.01 0.00 0.00 175.52 176.16 2k5u h VAL 33 N -0.24 1.23 -0.20 0.00 2.07 -1.23 -2.87 116.25 115.01 2k5u h VAL 33 Ca 0.01 -0.94 0.04 0.00 0.82 0.00 0.00 66.70 66.64 2k5u h VAL 33 Cb 0.45 0.92 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 2k5u h VAL 33 CO 0.01 0.32 -0.07 -0.07 0.02 0.00 0.00 177.57 177.78 2k5u h LEU 34 N 0.64 -0.25 -1.20 2.57 -0.00 0.06 -1.06 115.31 116.07 2k5u h LEU 34 Ca 0.13 0.07 0.06 0.00 -0.00 0.00 0.00 57.88 58.14 2k5u h LEU 34 Cb 0.41 0.15 -0.05 0.00 -0.00 0.00 0.00 40.66 41.17 2k5u h LEU 34 CO 0.02 -0.10 0.56 0.22 -0.00 0.00 0.00 178.44 179.14 2k5u h TYR 35 N -0.04 0.99 -0.58 1.13 3.20 -1.32 -0.76 116.97 119.58 2k5u h TYR 35 Ca 0.10 0.03 0.01 0.00 3.14 0.00 0.00 58.73 62.00 2k5u h TYR 35 Cb 0.19 -0.32 -0.03 0.00 1.54 0.00 0.00 36.73 38.11 2k5u h TYR 35 CO -0.24 0.52 0.38 -0.22 -1.64 0.00 0.00 178.16 176.97 2k5u h LYS 36 N 0.98 0.76 0.00 1.82 1.63 -1.01 0.02 116.57 120.76 2k5u h LYS 36 Ca 0.37 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 60.12 2k5u h LYS 36 Cb 0.19 -0.17 0.00 0.00 -0.60 0.00 0.00 32.23 31.65 2k5u h LYS 36 CO -0.13 0.51 0.00 1.28 -3.45 0.00 0.00 179.45 177.65 2k5u n LEU 37 N -4.45 0.00 0.00 5.20 4.77 -0.30 -4.90 117.00 117.32 2k5u n LEU 37 Ca 0.06 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 2k5u n LEU 37 Cb 0.04 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 2k5u n LEU 37 CO 0.36 -0.01 0.00 0.29 -1.33 0.00 0.00 177.39 176.69 2k5u n LYS 38 N -1.08 0.00 -1.90 3.23 5.02 -0.01 -4.64 118.16 118.78 2k5u n LYS 38 Ca 0.18 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.45 2k5u n LYS 38 Cb 0.12 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.13 2k5u n LYS 38 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2k5u n LEU 39 N 0.00 -3.72 0.00 -0.35 7.94 -1.25 -4.87 117.00 114.74 2k5u n LEU 39 Ca 0.00 0.14 0.00 0.00 -1.11 0.00 0.00 56.01 55.04 2k5u n LEU 39 Cb 0.00 -1.71 0.00 0.00 0.53 0.00 0.00 43.42 42.24 2k5u n LEU 39 CO 0.00 -0.67 0.33 0.61 -1.11 0.00 0.00 177.39 176.55 2k5u n GLY 40 N -0.51 -2.64 3.98 -3.96 0.00 -1.26 -4.87 105.19 95.94 2k5u n GLY 40 Ca 0.03 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.87 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 -1.69 2.89 -0.32 1.61 8.01 -1.26 -5.08 118.70 122.85 2k5u s GLU 41 Ca 0.00 -1.20 0.03 0.00 0.01 0.00 0.00 54.97 53.81 2k5u s GLU 41 Cb 0.00 -2.73 0.09 0.00 -4.31 0.00 0.00 34.13 27.18 2k5u s GLU 41 CO 0.00 -0.13 0.02 0.08 0.01 0.00 0.00 175.26 175.23 2k5u s VAL 42 N -2.30 2.40 -0.29 2.63 1.01 -1.26 -4.75 120.40 117.83 2k5u s VAL 42 Ca 0.50 -2.06 -0.11 0.00 0.00 0.00 0.00 61.98 60.31 2k5u s VAL 42 Cb -0.09 -2.64 -0.04 0.00 0.00 0.00 0.00 36.38 33.61 2k5u s VAL 42 CO 0.32 -0.42 0.19 -0.63 0.00 0.00 0.00 175.10 174.56 2k5u s ILE 43 N 1.00 5.22 -0.27 2.22 -1.09 -0.96 -5.00 121.20 122.32 2k5u s ILE 43 Ca 0.04 0.06 0.00 0.00 -2.23 0.00 0.00 60.65 58.53 2k5u s ILE 43 Cb -0.20 -3.53 0.08 0.00 -1.58 0.00 0.00 42.46 37.24 2k5u s ILE 43 CO -0.06 0.20 0.02 -0.89 -1.23 0.00 0.00 174.94 172.98 2k5u s THR 44 N 1.74 1.36 0.13 2.92 2.01 -1.26 -2.13 115.64 120.40 2k5u s THR 44 Ca 0.07 -1.42 0.08 0.00 0.31 0.00 0.00 61.69 60.73 2k5u s THR 44 Cb -0.16 -1.84 -0.04 0.00 0.01 0.00 0.00 72.50 70.46 2k5u s THR 44 CO 0.10 -0.39 -0.15 -0.89 -0.69 0.00 0.00 174.62 172.61 2k5u s THR 45 N 1.42 3.03 -0.31 -0.82 2.01 -1.02 -5.02 115.64 114.94 2k5u s THR 45 Ca 0.03 -1.48 0.00 0.00 0.31 0.00 0.00 61.69 60.55 2k5u s THR 45 Cb -0.18 -2.42 0.07 0.00 0.01 0.00 0.00 72.50 69.98 2k5u s THR 45 CO -0.13 0.06 -0.00 -0.63 -0.69 0.00 0.00 174.62 173.24 2k5u s ILE 46 N -1.26 2.71 0.05 1.82 -1.09 -1.26 -2.49 121.20 119.67 2k5u s ILE 46 Ca 0.20 -1.65 -0.27 0.00 -2.23 0.00 0.00 60.65 56.70 2k5u s ILE 46 Cb -0.10 -2.66 -0.17 0.00 -1.58 0.00 0.00 42.46 37.95 2k5u s ILE 46 CO 0.12 -0.21 1.51 1.55 -1.23 0.00 0.00 174.94 176.67 2k5u h PRO 47 N 7.89 -0.36 -1.18 2.79 0.13 -1.97 -3.49 132.00 135.82 2k5u h PRO 47 Ca -0.17 0.02 0.35 0.00 -0.87 0.00 0.00 66.00 65.33 2k5u h PRO 47 Cb 1.05 0.08 -0.15 0.00 0.13 0.00 0.00 31.00 32.11 2k5u h PRO 47 CO 0.53 -0.13 0.93 0.95 -0.23 0.00 0.00 178.00 180.05 2k5u s THR 48 N -5.49 0.00 0.00 1.56 -4.23 -1.26 -4.93 115.64 101.29 2k5u s THR 48 Ca -0.15 -0.06 0.00 0.00 -1.18 0.00 0.00 61.69 60.30 2k5u s THR 48 Cb 0.04 -1.70 0.00 0.00 1.34 0.00 0.00 72.50 72.17 2k5u s THR 48 CO 0.61 0.00 0.00 -0.38 -0.54 0.00 0.00 174.62 174.31 2k5u n ILE 49 N -0.36 0.00 -3.01 2.99 -0.00 -1.26 -1.98 119.36 115.74 2k5u n ILE 49 Ca -0.05 0.00 -0.26 0.00 -0.00 0.00 0.00 62.75 62.44 2k5u n ILE 49 Cb 0.62 0.00 -0.04 0.00 -0.00 0.00 0.00 39.64 40.21 2k5u n ILE 49 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2k5u n GLY 50 N 0.00 5.23 3.32 7.39 0.00 -1.26 -5.05 105.19 114.82 2k5u n GLY 50 Ca 0.00 -2.61 -0.30 0.00 0.00 0.00 0.00 46.02 43.11 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 -3.23 2.27 -0.06 1.61 0.40 -0.84 -5.13 117.98 113.00 2k5u s PHE 51 Ca 0.47 -0.42 0.05 0.00 -0.60 0.00 0.00 56.93 56.43 2k5u s PHE 51 Cb 0.28 -1.41 -0.01 0.00 0.51 0.00 0.00 43.02 42.40 2k5u s PHE 51 CO -0.12 0.04 -0.22 -0.80 0.70 0.00 0.00 175.22 174.82 2k5u s ASN 52 N -0.92 2.77 0.02 1.36 0.01 -1.26 -4.15 114.94 112.77 2k5u s ASN 52 Ca 0.11 -0.47 0.04 0.00 -0.71 0.00 0.00 52.86 51.83 2k5u s ASN 52 Cb -0.10 -0.85 -0.02 0.00 0.41 0.00 0.00 41.25 40.70 2k5u s ASN 52 CO 0.01 0.20 -0.12 0.54 -1.51 0.00 0.00 177.10 176.21 2k5u s VAL 53 N -0.01 0.97 0.26 1.60 0.11 -1.04 -4.82 120.40 117.48 2k5u s VAL 53 Ca -0.06 -0.80 0.11 0.00 -2.93 0.00 0.00 61.98 58.29 2k5u s VAL 53 Cb -0.14 -0.87 -0.05 0.00 -1.53 0.00 0.00 36.38 33.79 2k5u s VAL 53 CO 0.04 0.07 -0.18 -0.70 -3.33 0.00 0.00 175.10 171.00 2k5u s GLU 54 N -0.84 1.60 -0.18 1.54 2.12 -1.12 -2.43 118.70 119.40 2k5u s GLU 54 Ca 0.02 -1.73 -0.20 0.00 0.36 0.00 0.00 54.97 53.41 2k5u s GLU 54 Cb -0.07 -1.60 0.05 0.00 0.26 0.00 0.00 34.13 32.78 2k5u s GLU 54 CO 0.01 0.28 0.56 0.99 -0.54 0.00 0.00 175.26 176.56 2k5u s THR 55 N -2.63 0.00 -0.01 -1.70 2.01 -0.90 -1.63 115.64 110.78 2k5u s THR 55 Ca 0.28 -0.04 0.04 0.00 0.31 0.00 0.00 61.69 62.29 2k5u s THR 55 Cb -0.04 -0.80 -0.01 0.00 0.01 0.00 0.00 72.50 71.67 2k5u s THR 55 CO 0.13 -0.02 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.21 2k5u s VAL 56 N 0.01 1.08 -0.24 3.82 1.01 0.11 -2.26 120.40 123.93 2k5u s VAL 56 Ca -0.02 -0.62 0.01 0.00 0.00 0.00 0.00 61.98 61.34 2k5u s VAL 56 Cb -0.04 -0.91 0.04 0.00 0.00 0.00 0.00 36.38 35.48 2k5u s VAL 56 CO 0.02 0.28 -0.11 -1.10 0.00 0.00 0.00 175.10 174.19 2k5u s GLN 57 N -0.40 2.63 -0.18 2.72 -0.21 -1.26 0.20 119.66 123.16 2k5u s GLN 57 Ca 0.05 -1.09 -0.02 0.00 0.02 0.00 0.00 55.36 54.31 2k5u s GLN 57 Cb -0.05 -2.86 -0.01 0.00 1.00 0.00 0.00 33.01 31.09 2k5u s GLN 57 CO -0.00 -0.43 -0.08 0.71 -2.12 0.00 0.00 175.29 173.37 2k5u s TYR 58 N 1.23 2.91 0.00 0.91 2.02 -0.65 -4.61 117.35 119.16 2k5u s TYR 58 Ca -0.02 -0.82 0.00 0.00 -0.37 0.00 0.00 57.07 55.86 2k5u s TYR 58 Cb -0.17 -2.00 0.00 0.00 -0.40 0.00 0.00 41.96 39.39 2k5u s TYR 58 CO -0.07 -0.40 0.00 0.36 -1.57 0.00 0.00 175.55 173.87 2k5u n LYS 59 N 4.25 0.00 -0.01 -0.62 2.85 -1.26 -0.64 118.16 122.72 2k5u n LYS 59 Ca -0.18 0.00 -0.01 0.00 -1.05 0.00 0.00 58.31 57.07 2k5u n LYS 59 Cb 0.52 0.00 -0.02 0.00 -0.65 0.00 0.00 35.03 34.88 2k5u n LYS 59 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 177.40 177.62 2k5u n ASN 60 N 2.14 4.38 -4.76 -5.58 0.23 -1.26 -5.03 115.26 105.38 2k5u n ASN 60 Ca 0.00 -0.00 -0.40 0.00 -0.53 0.00 0.00 54.58 53.65 2k5u n ASN 60 Cb 0.00 0.52 -0.05 0.00 -2.08 0.00 0.00 39.78 38.18 2k5u n ASN 60 CO 0.00 0.00 0.00 -0.51 -0.93 0.00 0.00 177.26 175.82 2k5u s ILE 61 N -2.06 3.61 0.14 1.53 2.07 0.18 -4.85 121.20 121.83 2k5u s ILE 61 Ca -0.01 1.62 0.04 0.00 -1.41 0.00 0.00 60.65 60.88 2k5u s ILE 61 Cb 0.01 -4.03 -0.04 0.00 0.13 0.00 0.00 42.46 38.53 2k5u s ILE 61 CO 0.10 0.38 0.17 -0.44 -1.91 0.00 0.00 174.94 173.24 2k5u s SER 62 N -0.95 5.81 0.01 4.50 0.01 -1.13 -1.64 113.70 120.30 2k5u s SER 62 Ca 0.44 0.00 0.00 0.00 1.31 0.00 0.00 55.95 57.71 2k5u s SER 62 Cb -0.31 -1.62 -0.01 0.00 0.21 0.00 0.00 66.02 64.30 2k5u s SER 62 CO 0.39 0.09 -0.02 -0.36 0.41 0.00 0.00 173.24 173.75 2k5u s PHE 63 N -1.67 0.16 -0.09 2.43 0.40 0.13 -1.40 117.98 117.93 2k5u s PHE 63 Ca 0.32 -0.15 -0.04 0.00 -0.60 0.00 0.00 56.93 56.46 2k5u s PHE 63 Cb -0.11 -0.10 0.04 0.00 0.51 0.00 0.00 43.02 43.36 2k5u s PHE 63 CO 0.25 -0.05 0.20 -0.08 0.70 0.00 0.00 175.22 176.24 2k5u s THR 64 N -0.39 -0.05 0.09 0.64 -1.32 -1.08 0.04 115.64 113.57 2k5u s THR 64 Ca -0.04 0.17 0.07 0.00 -1.21 0.00 0.00 61.69 60.68 2k5u s THR 64 Cb -0.03 -0.32 -0.04 0.00 -1.51 0.00 0.00 72.50 70.60 2k5u s THR 64 CO -0.00 0.07 -0.14 0.68 -2.21 0.00 0.00 174.62 173.02 2k5u s VAL 65 N 1.25 3.12 -0.28 5.08 -7.23 -0.64 -2.26 120.40 119.44 2k5u s VAL 65 Ca -0.09 -1.29 -0.26 0.00 -1.81 0.00 0.00 61.98 58.53 2k5u s VAL 65 Cb -0.11 -2.42 0.14 0.00 0.56 0.00 0.00 36.38 34.55 2k5u s VAL 65 CO -0.07 0.17 1.15 -1.66 -0.31 0.00 0.00 175.10 174.37 2k5u s TRP 66 N -1.13 -0.34 1.26 2.82 -2.14 -1.21 -2.78 118.94 115.42 2k5u s TRP 66 Ca 0.19 0.82 -0.15 0.00 2.66 0.00 0.00 56.10 59.61 2k5u s TRP 66 Cb -0.11 0.40 0.32 0.00 -3.10 0.00 0.00 33.47 30.99 2k5u s TRP 66 CO 0.11 -0.18 0.99 0.16 -2.66 0.00 0.00 176.95 175.37 2k5u s ASP 67 N 0.04 0.23 0.17 -2.66 1.47 -1.26 -4.01 116.67 110.64 2k5u s ASP 67 Ca 0.04 1.35 -0.15 0.00 1.18 0.00 0.00 52.55 54.97 2k5u s ASP 67 Cb -0.05 -2.06 0.05 0.00 -0.34 0.00 0.00 42.92 40.53 2k5u s ASP 67 CO -0.08 -4.64 1.82 -0.37 0.68 0.00 0.00 175.17 172.58 2k5u h VAL 68 N -2.92 1.10 0.00 2.11 -1.51 -1.49 -3.43 116.25 110.11 2k5u h VAL 68 Ca -0.59 -0.21 0.00 0.00 -1.23 0.00 0.00 66.70 64.67 2k5u h VAL 68 Cb 1.34 0.44 0.00 0.00 -2.13 0.00 0.00 31.29 30.94 2k5u h VAL 68 CO 0.45 0.11 0.00 0.61 -1.23 0.00 0.00 177.57 177.51 2k5u n GLY 69 N -1.23 1.74 3.54 5.19 0.00 -1.26 -4.95 105.19 108.21 2k5u n GLY 69 Ca 0.02 -0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 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 0.00 0.52 2.42 -0.02 0.00 -1.26 -1.24 105.19 105.61 2k5u n GLY 70 Ca 0.00 0.81 -0.19 0.00 0.00 0.00 0.00 46.02 46.64 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 8.67 -1.75 -1.47 1.61 6.02 -1.26 -4.61 117.38 124.60 2k5u n GLN 71 Ca 0.38 0.96 0.07 0.00 -0.01 0.00 0.00 57.00 58.40 2k5u n GLN 71 Cb 0.39 -5.58 -0.04 0.00 1.02 0.00 0.00 30.24 26.03 2k5u n GLN 71 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2k5u n ASP 72 N -1.89 -7.93 -3.64 1.08 2.03 -0.37 -5.08 116.55 100.76 2k5u n ASP 72 Ca -0.23 1.65 -0.03 0.00 0.52 0.00 0.00 54.79 56.71 2k5u n ASP 72 Cb 0.67 -4.86 -0.04 0.00 -0.72 0.00 0.00 41.12 36.17 2k5u n ASP 72 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 2k5u s ARG 73 N -4.90 0.10 -0.03 -0.67 3.52 -1.26 -5.07 118.95 110.64 2k5u s ARG 73 Ca 0.00 0.01 0.01 0.00 -0.13 0.00 0.00 55.73 55.62 2k5u s ARG 73 Cb 0.00 0.05 0.02 0.00 -1.56 0.00 0.00 34.95 33.46 2k5u s ARG 73 CO 0.00 -0.03 -0.03 0.42 -0.81 0.00 0.00 175.30 174.85 2k5u s ILE 74 N -1.19 0.35 0.25 4.11 1.09 -1.26 -5.09 121.20 119.46 2k5u s ILE 74 Ca 0.08 -0.05 0.05 0.00 -1.10 0.00 0.00 60.65 59.63 2k5u s ILE 74 Cb -0.01 -0.39 -0.02 0.00 -1.06 0.00 0.00 42.46 40.98 2k5u s ILE 74 CO -0.07 0.17 0.24 0.54 -0.10 0.00 0.00 174.94 175.72 2k5u n ARG 75 N 3.85 0.35 0.03 2.79 5.12 -1.26 -5.06 116.66 122.48 2k5u n ARG 75 Ca -0.24 -2.47 -0.10 0.00 -1.93 0.00 0.00 57.85 53.11 2k5u n ARG 75 Cb 0.52 2.07 -0.13 0.00 -1.16 0.00 0.00 32.46 33.76 2k5u n ARG 75 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 2k5u h SER 76 N 1.55 0.11 -1.01 0.55 0.87 -2.01 -3.34 113.55 110.27 2k5u h SER 76 Ca -0.18 -0.16 0.06 0.00 -1.23 0.00 0.00 61.79 60.28 2k5u h SER 76 Cb 0.91 -0.04 -0.07 0.00 -0.44 0.00 0.00 62.40 62.77 2k5u h SER 76 CO 0.26 1.13 0.65 0.25 -0.53 0.00 0.00 176.83 178.60 2k5u h LEU 77 N 0.02 1.06 -0.77 2.23 6.46 -1.97 -1.92 115.31 120.41 2k5u h LEU 77 Ca -0.18 0.01 0.02 0.00 -0.12 0.00 0.00 57.88 57.61 2k5u h LEU 77 Cb 1.93 -0.22 -0.04 0.00 -0.73 0.00 0.00 40.66 41.59 2k5u h LEU 77 CO 0.12 0.68 0.50 -0.50 -0.62 0.00 0.00 178.44 178.62 2k5u h TRP 78 N 1.20 0.93 -0.48 1.25 6.55 -2.00 -2.52 115.95 120.89 2k5u h TRP 78 Ca 0.43 0.02 0.00 0.00 0.95 0.00 0.00 58.89 60.30 2k5u h TRP 78 Cb 0.13 -0.31 -0.02 0.00 -0.86 0.00 0.00 29.16 28.10 2k5u h TRP 78 CO -0.00 0.56 0.32 -0.09 -1.05 0.00 0.00 178.44 178.17 2k5u h ARG 79 N 0.98 0.63 0.01 0.49 9.65 -1.50 1.01 114.38 125.65 2k5u h ARG 79 Ca 0.30 -0.04 0.03 0.00 -1.10 0.00 0.00 59.98 59.17 2k5u h ARG 79 Cb -0.04 -0.14 -0.05 0.00 -1.39 0.00 0.00 29.97 28.35 2k5u h ARG 79 CO -0.09 0.42 -0.28 1.25 2.80 0.00 0.00 179.97 184.07 2k5u h HIS 80 N 0.65 -0.75 0.00 2.20 2.76 -1.14 -1.53 115.15 117.34 2k5u h HIS 80 Ca 0.17 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.37 2k5u h HIS 80 Cb -0.07 0.33 0.00 0.00 1.55 0.00 0.00 27.41 29.22 2k5u h HIS 80 CO -0.04 -0.37 0.00 1.88 -1.30 0.00 0.00 177.93 178.10 2k5u h TYR 81 N -0.43 0.00 0.00 5.26 0.05 -1.33 -3.13 116.97 117.39 2k5u h TYR 81 Ca 0.06 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.84 2k5u h TYR 81 Cb 0.51 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.25 2k5u h TYR 81 CO -0.30 0.00 0.00 0.98 -1.05 0.00 0.00 178.16 177.79 2k5u n TYR 82 N -2.85 0.00 -0.23 4.88 9.36 0.35 0.11 117.16 128.78 2k5u n TYR 82 Ca 0.04 0.00 -0.04 0.00 3.32 0.00 0.00 57.90 61.21 2k5u n TYR 82 Cb 0.44 -0.44 0.06 0.00 -0.63 0.00 0.00 39.34 38.77 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 0.80 -0.74 2.98 2.47 -1.66 -2.68 114.38 115.55 2k5u h ARG 83 Ca 0.00 -0.05 0.08 0.00 -1.26 0.00 0.00 59.98 58.75 2k5u h ARG 83 Cb 0.00 -0.18 -0.06 0.00 -1.65 0.00 0.00 29.97 28.08 2k5u h ARG 83 CO 0.00 0.53 0.41 -0.91 0.56 0.00 0.00 179.97 180.55 2k5u h ASN 84 N 0.82 0.58 -2.77 7.04 2.35 -1.47 -3.41 115.58 118.71 2k5u h ASN 84 Ca 0.26 0.04 -0.52 0.00 -0.55 0.00 0.00 56.30 55.53 2k5u h ASN 84 Cb -0.01 -0.07 0.06 0.00 0.05 0.00 0.00 38.32 38.34 2k5u h ASN 84 CO -0.09 0.35 0.96 0.42 -1.65 0.00 0.00 177.43 177.42 2k5u s THR 85 N -6.06 2.21 -0.19 2.81 -4.23 0.30 -4.66 115.64 105.81 2k5u s THR 85 Ca -0.13 0.15 0.08 0.00 -1.18 0.00 0.00 61.69 60.61 2k5u s THR 85 Cb 0.18 -3.10 0.16 0.00 1.34 0.00 0.00 72.50 71.08 2k5u s THR 85 CO 0.77 0.01 1.11 1.21 -0.54 0.00 0.00 174.62 177.18 2k5u n GLU 86 N 3.82 2.56 -3.85 3.99 0.00 -0.24 -4.84 120.64 122.07 2k5u n GLU 86 Ca 0.15 -1.95 -0.11 0.00 0.00 0.00 0.00 57.16 55.24 2k5u n GLU 86 Cb 0.36 -1.23 -0.09 0.00 0.00 0.00 0.00 31.44 30.48 2k5u n GLU 86 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 2k5u s GLY 87 N -1.53 0.02 -0.13 8.31 0.00 0.52 -4.14 107.32 110.37 2k5u s GLY 87 Ca 0.15 -0.11 -0.04 0.00 0.00 0.00 0.00 44.72 44.72 2k5u s GLY 87 CO 0.04 -0.27 0.18 -1.34 0.00 0.00 0.00 173.10 171.71 2k5u s VAL 88 N -1.69 -0.27 -0.14 1.40 -7.23 -1.15 -2.38 120.40 108.94 2k5u s VAL 88 Ca -0.12 0.17 0.01 0.00 -1.81 0.00 0.00 61.98 60.23 2k5u s VAL 88 Cb -0.06 -0.44 0.02 0.00 0.56 0.00 0.00 36.38 36.46 2k5u s VAL 88 CO 0.01 0.00 -0.17 -0.63 -0.31 0.00 0.00 175.10 174.00 2k5u s ILE 89 N 2.30 1.76 -0.24 -0.62 -1.09 0.20 -2.20 121.20 121.31 2k5u s ILE 89 Ca 0.04 -0.77 -0.10 0.00 -2.23 0.00 0.00 60.65 57.59 2k5u s ILE 89 Cb -0.13 -1.60 -0.05 0.00 -1.58 0.00 0.00 42.46 39.10 2k5u s ILE 89 CO -0.08 0.49 0.14 -0.36 -1.23 0.00 0.00 174.94 173.90 2k5u s PHE 90 N 1.18 3.27 -0.21 3.97 0.08 0.15 -0.16 117.98 126.26 2k5u s PHE 90 Ca -0.00 0.12 0.01 0.00 0.12 0.00 0.00 56.93 57.18 2k5u s PHE 90 Cb -0.14 -2.25 0.05 0.00 -0.57 0.00 0.00 43.02 40.10 2k5u s PHE 90 CO -0.07 0.00 -0.09 0.08 -0.10 0.00 0.00 175.22 175.04 2k5u s VAL 91 N 1.11 1.64 0.34 -0.44 1.01 0.71 0.77 120.40 125.54 2k5u s VAL 91 Ca 0.07 -1.09 0.08 0.00 0.00 0.00 0.00 61.98 61.03 2k5u s VAL 91 Cb -0.14 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 2k5u s VAL 91 CO 0.05 0.09 0.16 0.54 0.00 0.00 0.00 175.10 175.94 2k5u s VAL 92 N 1.38 3.09 -0.21 2.92 0.11 -1.00 -3.75 120.40 122.94 2k5u s VAL 92 Ca -0.03 -1.65 -0.24 0.00 -2.93 0.00 0.00 61.98 57.13 2k5u s VAL 92 Cb -0.17 -3.01 -0.01 0.00 -1.53 0.00 0.00 36.38 31.66 2k5u s VAL 92 CO -0.07 -0.18 0.78 -1.81 -3.33 0.00 0.00 175.10 170.48 2k5u s ASP 93 N -3.87 6.82 0.47 3.54 1.01 -1.26 -2.69 116.67 120.70 2k5u s ASP 93 Ca 0.38 1.01 0.26 0.00 0.71 0.00 0.00 52.55 54.91 2k5u s ASP 93 Cb -0.03 -2.42 1.11 0.00 1.01 0.00 0.00 42.92 42.59 2k5u s ASP 93 CO 0.23 -0.43 1.91 -1.28 0.21 0.00 0.00 175.17 175.81 2k5u h SER 94 N 7.56 0.00 -0.47 0.27 0.87 -1.82 -2.70 113.55 117.26 2k5u h SER 94 Ca -0.27 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.29 2k5u h SER 94 Cb 1.12 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.08 2k5u h SER 94 CO 0.84 0.18 0.00 -3.20 -0.53 0.00 0.00 176.83 174.12 2k5u n ASN 95 N -3.44 3.39 -3.50 6.23 5.15 -1.26 -2.04 115.26 119.79 2k5u n ASN 95 Ca -0.00 -1.96 -0.33 0.00 -0.60 0.00 0.00 54.58 51.69 2k5u n ASN 95 Cb 0.37 -0.31 -0.03 0.00 -0.53 0.00 0.00 39.78 39.27 2k5u n ASN 95 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 2k5u n ASP 96 N 1.24 5.12 -0.27 1.20 9.92 -1.02 -4.83 116.55 127.91 2k5u n ASP 96 Ca 0.18 -3.53 -0.06 0.00 -0.53 0.00 0.00 54.79 50.85 2k5u n ASP 96 Cb 0.54 -0.87 0.06 0.00 -0.64 0.00 0.00 41.12 40.21 2k5u n ASP 96 CO 0.00 0.00 0.00 0.08 0.13 0.00 0.00 177.20 177.41 2k5u h ARG 97 N 4.25 1.16 -0.12 -1.24 0.11 -1.82 -0.92 114.38 115.80 2k5u h ARG 97 Ca 0.23 -0.25 0.03 0.00 0.10 0.00 0.00 59.98 60.10 2k5u h ARG 97 Cb 0.57 -0.17 -0.00 0.00 1.11 0.00 0.00 29.97 31.47 2k5u h ARG 97 CO 1.01 0.98 0.23 0.77 0.10 0.00 0.00 179.97 183.06 2k5u h SER 98 N 1.11 0.00 -0.01 0.08 0.02 -1.97 -0.26 113.55 112.53 2k5u h SER 98 Ca 0.24 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.19 2k5u h SER 98 Cb 0.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.84 2k5u h SER 98 CO -0.01 0.00 -0.02 0.54 -1.14 0.00 0.00 176.83 176.20 2k5u n ARG 99 N -3.37 0.36 -0.23 3.45 1.74 -0.86 -4.62 116.66 113.14 2k5u n ARG 99 Ca 0.00 -0.85 0.08 0.00 -0.77 0.00 0.00 57.85 56.31 2k5u n ARG 99 Cb 0.33 -1.11 0.34 0.00 -1.02 0.00 0.00 32.46 31.00 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 1.28 0.97 -0.38 0.55 6.09 0.34 0.11 117.51 126.48 2k5u h ILE 100 Ca 0.00 -0.27 -0.09 0.00 -1.37 0.00 0.00 64.86 63.13 2k5u h ILE 100 Cb 0.28 0.13 -0.02 0.00 0.47 0.00 0.00 36.82 37.68 2k5u h ILE 100 CO 0.00 0.14 -0.15 1.23 -3.07 0.00 0.00 178.15 176.30 2k5u h GLY 101 N 0.78 0.75 1.25 8.18 0.00 -1.82 -1.47 103.07 110.75 2k5u h GLY 101 Ca 0.36 -0.58 0.04 0.00 0.00 0.00 0.00 47.33 47.16 2k5u h GLY 101 CO -0.14 0.53 0.41 0.83 0.00 0.00 0.00 176.54 178.17 2k5u h GLU 102 N 0.63 0.67 -0.09 4.80 4.39 -1.09 -0.56 114.58 123.33 2k5u h GLU 102 Ca 0.10 -0.04 -0.22 0.00 0.34 0.00 0.00 59.36 59.54 2k5u h GLU 102 Cb 0.61 -0.15 0.01 0.00 -0.10 0.00 0.00 28.75 29.12 2k5u h GLU 102 CO 0.04 0.44 -0.84 0.00 -1.16 0.00 0.00 179.01 177.49 2k5u h ALA 103 N 1.65 0.34 -0.29 3.43 0.00 -0.82 -2.62 119.26 120.95 2k5u h ALA 103 Ca 0.25 -0.63 -0.00 0.00 0.00 0.00 0.00 54.91 54.53 2k5u h ALA 103 Cb 0.14 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2k5u h ALA 103 CO -0.07 0.72 0.18 -0.09 0.00 0.00 0.00 179.25 179.99 2k5u h ARG 104 N 0.42 0.39 -0.27 0.00 2.43 -0.17 0.43 114.38 117.61 2k5u h ARG 104 Ca -0.07 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 58.99 2k5u h ARG 104 Cb 1.47 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.93 2k5u h ARG 104 CO 0.16 0.29 -0.15 0.93 -1.51 0.00 0.00 179.97 179.69 2k5u h GLU 105 N 0.38 0.58 -0.33 0.20 5.08 -1.22 0.30 114.58 119.57 2k5u h GLU 105 Ca 0.10 -0.26 -0.11 0.00 -1.00 0.00 0.00 59.36 58.09 2k5u h GLU 105 Cb -0.01 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 2k5u h GLU 105 CO -0.02 0.84 -0.24 -0.24 -1.00 0.00 0.00 179.01 178.35 2k5u h VAL 106 N 0.31 1.29 -0.41 3.13 3.04 -1.40 0.17 116.25 122.39 2k5u h VAL 106 Ca 0.06 -1.39 -0.13 0.00 -1.01 0.00 0.00 66.70 64.23 2k5u h VAL 106 Cb 0.67 1.45 -0.01 0.00 -2.01 0.00 0.00 31.29 31.39 2k5u h VAL 106 CO 0.04 0.45 -0.24 0.00 -1.01 0.00 0.00 177.57 176.81 2k5u h MET 107 N 0.52 0.89 -0.44 4.17 -0.00 -0.14 -1.44 114.93 118.50 2k5u h MET 107 Ca 0.06 -0.41 -0.05 0.00 -0.00 0.00 0.00 59.70 59.30 2k5u h MET 107 Cb 0.80 -0.01 -0.02 0.00 -0.00 0.00 0.00 31.60 32.37 2k5u h MET 107 CO 0.06 1.06 0.06 0.37 -0.00 0.00 0.00 176.91 178.46 2k5u h GLN 108 N 0.70 0.73 -0.70 -0.10 5.75 -0.35 -0.00 115.11 121.14 2k5u h GLN 108 Ca 0.09 -0.20 -0.07 0.00 -0.15 0.00 0.00 58.65 58.32 2k5u h GLN 108 Cb 0.82 -0.08 -0.03 0.00 1.07 0.00 0.00 27.48 29.25 2k5u h GLN 108 CO 0.07 0.76 0.17 0.00 -2.65 0.00 0.00 178.83 177.18 2k5u h ARG 109 N 0.58 1.11 -0.50 1.69 3.08 -0.92 -2.39 114.38 117.03 2k5u h ARG 109 Ca 0.13 -0.26 -0.12 0.00 0.07 0.00 0.00 59.98 59.80 2k5u h ARG 109 Cb 0.39 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 2k5u h ARG 109 CO 0.01 0.98 -0.16 1.98 -1.07 0.00 0.00 179.97 181.70 2k5u h MET 110 N 1.05 0.99 0.00 0.04 4.05 -1.04 -2.65 114.93 117.37 2k5u h MET 110 Ca 0.22 -0.39 0.00 0.00 -0.28 0.00 0.00 59.70 59.25 2k5u h MET 110 Cb 0.36 -0.05 0.00 0.00 -0.80 0.00 0.00 31.60 31.11 2k5u h MET 110 CO 0.00 1.07 0.00 1.25 0.23 0.00 0.00 176.91 179.46 2k5u h LEU 111 N 0.86 0.00 0.00 3.39 6.46 -0.73 -2.45 115.31 122.84 2k5u h LEU 111 Ca 0.12 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.88 2k5u h LEU 111 Cb 0.73 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.66 2k5u h LEU 111 CO 0.06 0.00 0.00 -3.20 -0.62 0.00 0.00 178.44 174.68 2k5u n ASN 112 N -2.52 0.00 -4.60 1.25 5.15 -0.92 -4.73 115.26 108.88 2k5u n ASN 112 Ca 0.01 -1.36 -0.43 0.00 -0.60 0.00 0.00 54.58 52.20 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 3.65 0.40 1.20 0.41 -0.93 -4.89 118.70 116.54 2k5u s GLU 113 Ca 0.13 0.60 0.13 0.00 -0.41 0.00 0.00 54.97 55.42 2k5u s GLU 113 Cb 0.06 -3.95 0.96 0.00 -1.78 0.00 0.00 34.13 29.42 2k5u s GLU 113 CO 0.10 -1.48 1.90 -0.44 -0.49 0.00 0.00 175.26 174.85 2k5u h ASP 114 N 9.65 0.49 0.78 -0.19 3.32 -1.91 0.53 116.42 129.09 2k5u h ASP 114 Ca -0.24 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.84 2k5u h ASP 114 Cb 1.07 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.55 2k5u h ASP 114 CO 1.13 0.25 0.00 -0.62 -1.72 0.00 0.00 179.24 178.28 2k5u n GLU 115 N -4.51 0.09 -0.16 3.56 1.02 -1.26 -2.08 120.64 117.30 2k5u n GLU 115 Ca 0.16 0.25 0.09 0.00 -0.02 0.00 0.00 57.16 57.64 2k5u n GLU 115 Cb 0.52 -1.65 0.17 0.00 -0.02 0.00 0.00 31.44 30.45 2k5u n GLU 115 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2k5u n LEU 116 N -1.82 3.01 0.21 -4.62 4.32 0.18 -4.45 117.00 113.84 2k5u n LEU 116 Ca 0.04 -1.58 0.15 0.00 -0.02 0.00 0.00 56.01 54.60 2k5u n LEU 116 Cb 0.25 -0.21 0.73 0.00 -1.62 0.00 0.00 43.42 42.58 2k5u n LEU 116 CO 0.20 0.68 0.95 -0.09 -1.22 0.00 0.00 177.39 177.90 2k5u h ARG 117 N 3.23 0.00 -0.44 3.23 2.43 -0.86 -1.10 114.38 120.88 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 0.80 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.35 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 -2.58 3.36 -4.85 -3.80 0.23 -1.26 -4.98 115.26 101.38 2k5u n ASN 118 Ca -0.01 -2.13 -0.37 0.00 -0.53 0.00 0.00 54.58 51.54 2k5u n ASN 118 Cb 0.13 -0.34 -0.06 0.00 -2.08 0.00 0.00 39.78 37.43 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 -1.24 3.72 -0.25 -2.53 0.00 -0.42 -5.06 121.76 116.00 2k5u s ALA 119 Ca 0.32 -0.29 -0.26 0.00 0.00 0.00 0.00 51.96 51.73 2k5u s ALA 119 Cb 0.18 -2.32 0.00 0.00 0.00 0.00 0.00 23.12 20.98 2k5u s ALA 119 CO 0.19 0.51 0.90 0.00 0.00 0.00 0.00 175.76 177.37 2k5u s ALA 120 N -1.14 3.65 -0.04 0.00 0.00 -1.26 -4.95 121.76 118.01 2k5u s ALA 120 Ca 0.25 -0.05 -0.04 0.00 0.00 0.00 0.00 51.96 52.11 2k5u s ALA 120 Cb -0.16 -3.38 -0.04 0.00 0.00 0.00 0.00 23.12 19.54 2k5u s ALA 120 CO 0.13 -1.00 0.17 -1.58 0.00 0.00 0.00 175.76 173.49 2k5u s TRP 121 N 2.99 3.57 -0.09 0.00 0.51 -1.13 -2.92 118.94 121.86 2k5u s TRP 121 Ca 0.38 0.41 -0.03 0.00 -2.12 0.00 0.00 56.10 54.74 2k5u s TRP 121 Cb -0.15 -1.87 0.05 0.00 -0.81 0.00 0.00 33.47 30.69 2k5u s TRP 121 CO 0.07 0.68 0.14 -1.17 -0.51 0.00 0.00 176.95 176.16 2k5u s LEU 122 N -1.65 0.00 0.02 2.99 1.98 -0.93 -2.72 118.68 118.37 2k5u s LEU 122 Ca 0.23 0.14 -0.21 0.00 -2.89 0.00 0.00 54.13 51.41 2k5u s LEU 122 Cb -0.12 0.15 -0.06 0.00 0.66 0.00 0.00 46.19 46.82 2k5u s LEU 122 CO 0.14 -0.26 0.62 -0.69 -1.89 0.00 0.00 176.35 174.27 2k5u s VAL 123 N 2.26 4.85 -0.09 1.68 1.01 0.17 0.29 120.40 130.57 2k5u s VAL 123 Ca 0.04 1.31 0.01 0.00 0.00 0.00 0.00 61.98 63.34 2k5u s VAL 123 Cb -0.13 -3.96 0.02 0.00 0.00 0.00 0.00 36.38 32.31 2k5u s VAL 123 CO -0.06 0.43 -0.12 0.12 0.00 0.00 0.00 175.10 175.47 2k5u s PHE 124 N -0.32 1.62 -0.19 5.22 5.36 0.23 -2.15 117.98 127.76 2k5u s PHE 124 Ca 0.32 -0.71 -0.18 0.00 -0.96 0.00 0.00 56.93 55.40 2k5u s PHE 124 Cb -0.19 -1.22 -0.03 0.00 -0.34 0.00 0.00 43.02 41.24 2k5u s PHE 124 CO 0.18 -0.40 0.49 0.00 -1.46 0.00 0.00 175.22 174.04 2k5u s ALA 125 N 1.02 3.53 -0.26 11.12 0.00 0.75 -2.38 121.76 135.56 2k5u s ALA 125 Ca -0.07 -0.39 0.02 0.00 0.00 0.00 0.00 51.96 51.52 2k5u s ALA 125 Cb -0.15 -2.76 0.06 0.00 0.00 0.00 0.00 23.12 20.28 2k5u s ALA 125 CO -0.01 -0.35 -0.08 1.21 0.00 0.00 0.00 175.76 176.53 2k5u s ASN 126 N 1.05 4.26 0.00 0.00 3.04 -1.09 -1.00 114.94 121.20 2k5u s ASN 126 Ca 0.23 -1.37 0.00 0.00 0.04 0.00 0.00 52.86 51.77 2k5u s ASN 126 Cb -0.15 -1.42 0.00 0.00 -1.54 0.00 0.00 41.25 38.14 2k5u s ASN 126 CO 0.09 -0.22 0.00 0.29 -3.04 0.00 0.00 177.10 174.23 2k5u n LYS 127 N 4.51 0.00 0.04 0.43 5.02 -0.92 -2.69 118.16 124.56 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 0.50 0.00 -0.02 0.00 0.00 35.03 35.94 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 0.09 0.16 1.97 3.00 0.51 -2.95 117.38 120.16 2k5u n GLN 128 Ca 0.00 0.14 0.06 0.00 -0.01 0.00 0.00 57.00 57.19 2k5u n GLN 128 Cb 0.00 -1.62 0.07 0.00 0.00 0.00 0.00 30.24 28.68 2k5u n GLN 128 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.06 177.44 2k5u h ASP 129 N 0.00 0.00 -2.82 1.08 3.04 -1.93 -3.46 116.42 112.33 2k5u h ASP 129 Ca 0.00 0.00 -0.52 0.00 -3.24 0.00 0.00 57.03 53.27 2k5u h ASP 129 Cb 0.52 0.00 0.06 0.00 -1.04 0.00 0.00 39.33 38.87 2k5u h ASP 129 CO 0.00 0.34 0.98 -0.22 -2.04 0.00 0.00 179.24 178.29 2k5u s LEU 130 N -6.34 4.36 0.36 0.15 1.98 -1.15 -4.89 118.68 113.15 2k5u s LEU 130 Ca 0.05 2.87 0.05 0.00 -2.89 0.00 0.00 54.13 54.21 2k5u s LEU 130 Cb 0.07 -3.61 0.69 0.00 0.66 0.00 0.00 46.19 44.00 2k5u s LEU 130 CO 0.72 -0.95 1.96 1.55 -1.89 0.00 0.00 176.35 177.74 2k5u h PRO 131 N 6.37 0.57 -0.60 0.98 0.13 -1.91 -2.22 132.00 135.33 2k5u h PRO 131 Ca -0.44 -0.08 -0.17 0.00 -0.87 0.00 0.00 66.00 64.44 2k5u h PRO 131 Cb 1.20 -0.11 -0.10 0.00 0.13 0.00 0.00 31.00 32.13 2k5u h PRO 131 CO 0.92 0.49 0.18 -0.85 -0.23 0.00 0.00 178.00 178.50 2k5u n GLU 132 N -4.37 3.34 -3.08 0.86 0.28 -1.26 -4.99 120.64 111.42 2k5u n GLU 132 Ca 0.03 -3.06 -0.33 0.00 -0.16 0.00 0.00 57.16 53.63 2k5u n GLU 132 Cb 0.15 -2.10 -0.06 0.00 1.43 0.00 0.00 31.44 30.86 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 -3.00 3.28 0.48 -1.84 0.00 -0.84 -4.91 121.76 114.93 2k5u s ALA 133 Ca 0.51 0.12 -0.16 0.00 0.00 0.00 0.00 51.96 52.43 2k5u s ALA 133 Cb 0.42 -2.84 -0.08 0.00 0.00 0.00 0.00 23.12 20.62 2k5u s ALA 133 CO 0.11 0.30 0.94 -1.64 0.00 0.00 0.00 175.76 175.46 2k5u s MET 134 N -2.90 3.94 0.40 0.00 -1.94 -0.87 -4.99 119.30 112.95 2k5u s MET 134 Ca 0.54 0.88 -0.17 0.00 -1.71 0.00 0.00 55.69 55.23 2k5u s MET 134 Cb -0.11 -2.19 -0.09 0.00 2.01 0.00 0.00 34.83 34.45 2k5u s MET 134 CO 0.17 -0.20 0.86 -1.54 -0.01 0.00 0.00 175.02 174.30 2k5u s SER 135 N -2.99 6.78 0.47 3.03 1.04 -1.26 -4.83 113.70 115.94 2k5u s SER 135 Ca 0.58 1.46 0.20 0.00 0.48 0.00 0.00 55.95 58.67 2k5u s SER 135 Cb -0.10 -2.45 1.21 0.00 0.10 0.00 0.00 66.02 64.78 2k5u s SER 135 CO 0.29 -0.34 1.95 0.00 0.98 0.00 0.00 173.24 176.12 2k5u h ALA 136 N 1.81 2.30 0.03 5.32 0.00 -1.97 0.37 119.26 127.11 2k5u h ALA 136 Ca -0.48 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 2k5u h ALA 136 Cb 1.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2k5u h ALA 136 CO 0.63 -0.48 -0.01 0.00 0.00 0.00 0.00 179.25 179.39 2k5u h ALA 137 N 1.68 -0.03 -0.13 0.00 0.00 -1.99 0.32 119.26 119.11 2k5u h ALA 137 Ca 0.32 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 2k5u h ALA 137 Cb 0.94 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 2k5u h ALA 137 CO -0.07 -0.32 -0.40 1.49 0.00 0.00 0.00 179.25 179.95 2k5u h GLU 138 N -0.44 0.30 -0.20 0.00 4.81 -1.72 -2.60 114.58 114.73 2k5u h GLU 138 Ca -0.00 -0.14 -0.07 0.00 -0.13 0.00 0.00 59.36 59.01 2k5u h GLU 138 Cb 0.41 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.78 2k5u h GLU 138 CO 0.01 0.66 -0.15 0.82 -0.73 0.00 0.00 179.01 179.61 2k5u h ILE 139 N 0.25 1.32 -0.97 2.32 2.04 -0.25 -1.82 117.51 120.40 2k5u h ILE 139 Ca 0.02 -1.27 0.04 0.00 1.00 0.00 0.00 64.86 64.66 2k5u h ILE 139 Cb 0.82 1.70 -0.06 0.00 -0.74 0.00 0.00 36.82 38.55 2k5u h ILE 139 CO 0.07 0.39 0.63 0.71 0.00 0.00 0.00 178.15 179.94 2k5u h THR 140 N 0.15 1.14 -0.00 -0.27 1.35 -0.21 0.03 112.91 115.11 2k5u h THR 140 Ca 0.04 -0.41 -0.15 0.00 -0.55 0.00 0.00 66.41 65.34 2k5u h THR 140 Cb 0.67 -0.16 -0.02 0.00 -1.73 0.00 0.00 68.15 66.91 2k5u h THR 140 CO 0.04 0.22 -0.70 1.05 -0.25 0.00 0.00 175.52 175.87 2k5u h GLU 141 N 1.19 0.00 -0.29 4.72 4.11 -1.42 0.76 114.58 123.66 2k5u h GLU 141 Ca 0.39 -0.00 -0.16 0.00 0.07 0.00 0.00 59.36 59.67 2k5u h GLU 141 Cb 0.06 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2k5u h GLU 141 CO -0.13 0.71 -0.45 -0.22 0.07 0.00 0.00 179.01 178.99 2k5u h LYS 142 N 0.00 0.74 -0.12 1.06 3.11 -0.36 -2.87 116.57 118.13 2k5u h LYS 142 Ca -0.01 -0.41 0.00 0.00 -2.81 0.00 0.00 60.65 57.42 2k5u h LYS 142 Cb 1.24 0.02 0.00 0.00 -1.00 0.00 0.00 32.23 32.50 2k5u h LYS 142 CO 0.09 1.03 0.00 1.47 -2.81 0.00 0.00 179.45 179.24 2k5u n LEU 143 N -4.02 1.46 -0.56 5.20 -0.00 -0.11 -4.82 117.00 114.15 2k5u n LEU 143 Ca -0.03 -0.59 -0.06 0.00 -0.00 0.00 0.00 56.01 55.34 2k5u n LEU 143 Cb 0.56 -0.07 -0.02 0.00 -0.00 0.00 0.00 43.42 43.89 2k5u n LEU 143 CO 0.47 0.29 -0.07 0.61 -0.00 0.00 0.00 177.39 178.70 2k5u n GLY 144 N 1.11 0.59 0.31 1.47 0.00 -0.97 -4.70 105.19 102.99 2k5u n GLY 144 Ca 0.17 -0.72 0.13 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.49 0.99 7.12 0.28 0.34 115.31 123.55 2k5u h LEU 145 Ca -0.13 0.00 -0.08 0.00 0.13 0.00 0.00 57.88 57.79 2k5u h LEU 145 Cb 0.66 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.78 2k5u h LEU 145 CO 0.18 0.00 -0.40 1.12 -0.13 0.00 0.00 178.44 179.21 2k5u h HIS 146 N 0.00 0.00 0.00 1.25 2.07 -1.88 -2.93 115.15 113.66 2k5u h HIS 146 Ca 0.06 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.58 2k5u h HIS 146 Cb 0.28 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.26 2k5u h HIS 146 CO 0.00 0.40 0.00 0.45 -3.07 0.00 0.00 177.93 175.71 2k5u n SER 147 N -3.34 0.00 -4.76 3.10 2.88 0.12 -4.67 113.62 106.95 2k5u n SER 147 Ca 0.01 0.45 -0.37 0.00 -1.33 0.00 0.00 58.87 57.63 2k5u n SER 147 Cb 0.60 -0.48 -0.06 0.00 -0.75 0.00 0.00 64.21 63.52 2k5u n SER 147 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2k5u s ILE 148 N -2.95 5.22 1.03 2.46 1.01 -1.11 -5.06 121.20 121.79 2k5u s ILE 148 Ca 0.07 0.70 -0.20 0.00 0.00 0.00 0.00 60.65 61.22 2k5u s ILE 148 Cb 0.09 -3.68 -0.07 0.00 0.01 0.00 0.00 42.46 38.81 2k5u s ILE 148 CO 0.25 0.44 -0.64 -1.14 0.00 0.00 0.00 174.94 173.84 2k5u n ARG 149 N 3.04 -0.49 -3.09 2.79 3.00 -1.26 -4.88 116.66 115.75 2k5u n ARG 149 Ca -0.12 -0.13 -0.40 0.00 -0.00 0.00 0.00 57.85 57.20 2k5u n ARG 149 Cb 0.52 -1.33 -0.05 0.00 0.00 0.00 0.00 32.46 31.60 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 -1.40 6.79 0.00 6.15 4.22 -1.26 -4.10 114.94 125.35 2k5u s ASN 150 Ca 0.46 0.96 0.00 0.00 -2.14 0.00 0.00 52.86 52.14 2k5u s ASN 150 Cb -0.07 -2.37 0.00 0.00 1.28 0.00 0.00 41.25 40.09 2k5u s ASN 150 CO 0.70 -0.22 0.00 -1.14 -2.04 0.00 0.00 177.10 174.40 2k5u n ARG 151 N 4.61 0.00 -0.33 3.55 0.63 -1.26 -4.99 116.66 118.88 2k5u n ARG 151 Ca -0.01 0.00 -0.03 0.00 -0.92 0.00 0.00 57.85 56.89 2k5u n ARG 151 Cb 0.50 0.00 0.02 0.00 0.45 0.00 0.00 32.46 33.43 2k5u n ARG 151 CO 0.00 0.00 0.00 -1.35 -2.51 0.00 0.00 177.63 173.77 2k5u h PRO 152 N 0.00 -0.06 -4.37 -0.14 0.11 -1.94 -3.45 132.00 122.15 2k5u h PRO 152 Ca 0.00 0.00 -0.31 0.00 0.11 0.00 0.00 66.00 65.81 2k5u h PRO 152 Cb 0.00 0.01 -0.11 0.00 0.11 0.00 0.00 31.00 31.02 2k5u h PRO 152 CO 0.00 -0.04 -0.33 1.67 -0.21 0.00 0.00 178.00 179.09 2k5u s TRP 153 N -5.93 1.21 0.06 0.65 -2.14 -1.25 -2.82 118.94 108.72 2k5u s TRP 153 Ca -0.14 -1.36 0.03 0.00 2.66 0.00 0.00 56.10 57.29 2k5u s TRP 153 Cb 0.18 -0.31 -0.03 0.00 -3.10 0.00 0.00 33.47 30.22 2k5u s TRP 153 CO 0.70 -0.98 -0.10 0.12 -2.66 0.00 0.00 176.95 174.03 2k5u s PHE 154 N -3.40 0.87 0.12 1.66 5.36 -1.10 -4.98 117.98 116.50 2k5u s PHE 154 Ca 0.34 -0.53 0.10 0.00 -0.96 0.00 0.00 56.93 55.88 2k5u s PHE 154 Cb 0.01 -0.50 -0.04 0.00 -0.34 0.00 0.00 43.02 42.15 2k5u s PHE 154 CO 0.20 -0.04 -0.26 -1.50 -1.46 0.00 0.00 175.22 172.16 2k5u s ILE 155 N -1.62 2.15 -0.15 3.12 -1.16 -1.26 0.47 121.20 122.75 2k5u s ILE 155 Ca -0.05 -1.70 -0.11 0.00 -0.51 0.00 0.00 60.65 58.28 2k5u s ILE 155 Cb -0.08 -1.91 0.05 0.00 0.61 0.00 0.00 42.46 41.12 2k5u s ILE 155 CO 0.01 0.08 0.37 -1.58 -2.81 0.00 0.00 174.94 171.00 2k5u s GLN 156 N -1.99 0.39 0.05 3.50 2.00 -0.91 -4.98 119.66 117.72 2k5u s GLN 156 Ca 0.12 0.61 -0.21 0.00 -2.00 0.00 0.00 55.36 53.89 2k5u s GLN 156 Cb -0.10 0.09 -0.06 0.00 0.80 0.00 0.00 33.01 33.74 2k5u s GLN 156 CO 0.05 -0.10 0.62 0.00 -0.50 0.00 0.00 175.29 175.36 2k5u s ALA 157 N 0.75 3.51 0.31 1.58 0.00 -1.26 -0.18 121.76 126.47 2k5u s ALA 157 Ca -0.04 0.09 -0.08 0.00 0.00 0.00 0.00 51.96 51.93 2k5u s ALA 157 Cb -0.06 -2.75 0.00 0.00 0.00 0.00 0.00 23.12 20.32 2k5u s ALA 157 CO -0.05 0.26 0.50 0.95 0.00 0.00 0.00 175.76 177.42 2k5u s THR 158 N -0.64 0.00 -0.20 0.00 -4.23 -0.17 -4.78 115.64 105.62 2k5u s THR 158 Ca 0.31 -1.47 -0.02 0.00 -1.18 0.00 0.00 61.69 59.34 2k5u s THR 158 Cb -0.19 -2.49 0.06 0.00 1.34 0.00 0.00 72.50 71.21 2k5u s THR 158 CO 0.19 0.00 0.01 0.00 -0.54 0.00 0.00 174.62 174.28 2k5u h ALA 160 N 8.16 1.68 0.23 0.00 0.00 -1.90 -1.51 119.26 125.92 2k5u h ALA 160 Ca -0.17 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 2k5u h ALA 160 Cb 1.11 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2k5u h ALA 160 CO 0.36 0.22 -0.11 1.79 0.00 0.00 0.00 179.25 181.51 2k5u h THR 161 N 0.00 0.72 0.00 0.00 1.35 -1.96 -3.29 112.91 109.73 2k5u h THR 161 Ca -0.00 -0.93 0.00 0.00 -0.55 0.00 0.00 66.41 64.93 2k5u h THR 161 Cb 0.32 1.17 0.00 0.00 -1.73 0.00 0.00 68.15 67.91 2k5u h THR 161 CO 0.02 0.17 -0.11 -1.20 -0.25 0.00 0.00 175.52 174.16 2k5u n SER 162 N -5.00 0.39 0.00 5.36 7.64 -1.24 -4.90 113.62 115.87 2k5u n SER 162 Ca -0.08 0.42 0.00 0.00 1.01 0.00 0.00 58.87 60.21 2k5u n SER 162 Cb 0.26 -0.47 0.00 0.00 -1.01 0.00 0.00 64.21 62.99 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 1.42 0.57 3.64 0.23 0.00 -0.58 -4.97 105.19 105.50 2k5u n GLY 163 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.34 3.98 0.00 1.61 2.12 -1.17 -2.57 118.70 122.32 2k5u s GLU 164 Ca 0.00 1.39 0.00 0.00 0.36 0.00 0.00 54.97 56.72 2k5u s GLU 164 Cb 0.00 -3.87 0.00 0.00 0.26 0.00 0.00 34.13 30.52 2k5u s GLU 164 CO 0.00 -1.04 0.00 0.41 -0.54 0.00 0.00 175.26 174.09 2k5u n GLY 165 N 4.18 3.28 0.15 -1.50 0.00 -1.26 -1.42 105.19 108.62 2k5u n GLY 165 Ca 0.15 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.05 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 0.45 -0.10 0.99 3.38 -1.77 -1.19 115.31 117.06 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 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 2k5u h LEU 166 CO 0.00 0.72 0.01 0.10 0.09 0.00 0.00 178.44 179.36 2k5u h TYR 167 N 0.17 0.19 0.00 1.13 -0.00 -1.92 -1.38 116.97 115.16 2k5u h TYR 167 Ca 0.06 -0.03 -0.02 0.00 0.00 0.00 0.00 58.73 58.74 2k5u h TYR 167 Cb 0.53 -0.05 -0.00 0.00 0.00 0.00 0.00 36.73 37.21 2k5u h TYR 167 CO 0.05 0.40 -0.08 0.93 -0.00 0.00 0.00 178.16 179.46 2k5u h GLU 168 N -0.07 0.00 0.14 0.10 5.08 -1.90 0.22 114.58 118.15 2k5u h GLU 168 Ca 0.03 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.21 2k5u h GLU 168 Cb 0.31 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.59 2k5u h GLU 168 CO 0.00 0.08 -0.81 0.78 -1.00 0.00 0.00 179.01 178.07 2k5u h GLY 169 N 0.40 0.34 0.42 -3.84 0.00 -0.96 -2.72 103.07 96.71 2k5u h GLY 169 Ca -0.00 -0.87 -0.00 0.00 0.00 0.00 0.00 47.33 46.45 2k5u h GLY 169 CO 0.01 0.77 -0.01 0.17 0.00 0.00 0.00 176.54 177.48 2k5u h LEU 170 N -0.37 -0.03 -0.56 3.11 8.10 -1.02 -0.73 115.31 123.82 2k5u h LEU 170 Ca -0.14 -0.55 0.10 0.00 0.11 0.00 0.00 57.88 57.40 2k5u h LEU 170 Cb 1.64 0.01 -0.08 0.00 -0.44 0.00 0.00 40.66 41.78 2k5u h LEU 170 CO 0.15 0.54 0.12 -0.08 -4.11 0.00 0.00 178.44 175.07 2k5u h GLU 171 N -0.61 0.25 -0.51 0.17 4.81 -0.73 0.36 114.58 118.32 2k5u h GLU 171 Ca -0.00 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.18 2k5u h GLU 171 Cb 0.57 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.87 2k5u h GLU 171 CO 0.01 0.17 0.19 2.35 -0.73 0.00 0.00 179.01 180.99 2k5u h TRP 172 N 0.26 0.80 -0.69 0.92 2.91 -1.50 -2.51 115.95 116.14 2k5u h TRP 172 Ca 0.29 -0.07 0.00 0.00 1.13 0.00 0.00 58.89 60.24 2k5u h TRP 172 Cb 0.40 -0.24 -0.03 0.00 -0.51 0.00 0.00 29.16 28.79 2k5u h TRP 172 CO -0.24 0.67 0.43 -0.07 -1.03 0.00 0.00 178.44 178.21 2k5u h LEU 173 N 0.69 0.81 -0.71 0.65 -0.00 0.41 -2.28 115.31 114.87 2k5u h LEU 173 Ca 0.17 -0.03 -0.00 0.00 -0.00 0.00 0.00 57.88 58.02 2k5u h LEU 173 Cb 0.22 -0.20 -0.03 0.00 -0.00 0.00 0.00 40.66 40.65 2k5u h LEU 173 CO -0.01 0.60 0.44 0.77 -0.00 0.00 0.00 178.44 180.24 2k5u h SER 174 N 0.94 0.84 -0.36 -0.43 4.64 0.08 -1.42 113.55 117.84 2k5u h SER 174 Ca 0.25 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 2k5u h SER 174 Cb -0.07 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 61.79 2k5u h SER 174 CO -0.05 0.64 0.24 0.78 -0.87 0.00 0.00 176.83 177.57 2k5u h ASN 175 N 0.97 0.42 -0.54 4.97 2.35 -1.16 0.81 115.58 123.40 2k5u h ASN 175 Ca 0.26 -0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.96 2k5u h ASN 175 Cb -0.05 -0.10 -0.03 0.00 0.05 0.00 0.00 38.32 38.18 2k5u h ASN 175 CO -0.05 0.31 0.23 0.77 -1.65 0.00 0.00 177.43 177.03 2k5u h SER 176 N 0.49 0.76 1.66 5.81 4.64 -1.25 -0.76 113.55 124.90 2k5u h SER 176 Ca 0.13 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2k5u h SER 176 Cb -0.05 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 61.84 2k5u h SER 176 CO -0.03 0.69 -0.14 -0.07 -0.87 0.00 0.00 176.83 176.41 2k5u h LEU 177 N 0.82 0.00 0.00 5.97 -0.00 -0.73 -3.22 115.31 118.16 2k5u h LEU 177 Ca 0.20 -0.02 0.00 0.00 -0.00 0.00 0.00 57.88 58.06 2k5u h LEU 177 Cb 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.82 2k5u h LEU 177 CO -0.02 0.01 0.00 1.17 -0.00 0.00 0.00 178.44 179.60 2k5u n LYS 178 N -2.73 0.00 0.01 1.13 4.81 0.28 -5.02 118.16 116.64 2k5u n LYS 178 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.48 2k5u n LYS 178 Cb 0.50 -0.36 0.00 0.00 0.02 0.00 0.00 35.03 35.18 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 -0.80 0.15 -4.57 3.14 2.85 -0.41 -4.93 115.26 110.69 2k5u n ASN 179 Ca 0.00 0.02 -0.36 0.00 -0.11 0.00 0.00 54.58 54.13 2k5u n ASN 179 Cb 0.00 -0.04 -0.03 0.00 1.24 0.00 0.00 39.78 40.95 2k5u n ASN 179 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 2k5u s SER 180 N -5.09 6.05 0.00 1.20 0.01 -1.13 -4.94 113.70 109.80 2k5u s SER 180 Ca 0.00 -1.71 0.03 0.00 1.31 0.00 0.00 55.95 55.58 2k5u s SER 180 Cb 0.00 -2.58 0.18 0.00 0.21 0.00 0.00 66.02 63.83 2k5u s SER 180 CO 0.00 -1.96 0.66 0.35 0.41 0.00 0.00 173.24 172.70