#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 -1.00 0.11 0.99 4.77 -1.26 -5.00 117.00 115.62 2k5u n LEU 3 Ca 0.00 -2.00 0.00 0.00 -0.03 0.00 0.00 56.01 53.98 2k5u n LEU 3 Cb 0.00 0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 2k5u n LEU 3 CO 0.00 1.48 0.00 0.33 -1.33 0.00 0.00 177.39 177.87 2k5u n PHE 4 N -0.07 -1.66 -3.98 -1.77 7.35 -1.26 -5.07 117.46 111.00 2k5u n PHE 4 Ca -0.27 0.29 -0.30 0.00 -0.76 0.00 0.00 57.45 56.41 2k5u n PHE 4 Cb 0.70 0.41 -0.16 0.00 0.35 0.00 0.00 39.48 40.78 2k5u n PHE 4 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2k5u s ALA 5 N -2.00 2.00 0.00 3.13 0.00 -1.26 -4.79 121.76 118.84 2k5u s ALA 5 Ca 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 51.96 50.72 2k5u s ALA 5 Cb 0.00 -1.32 0.00 0.00 0.00 0.00 0.00 23.12 21.80 2k5u s ALA 5 CO 0.00 -0.91 0.00 0.43 0.00 0.00 0.00 175.76 175.28 2k5u n SER 6 N 4.68 0.00 0.03 0.00 7.64 -0.63 -4.71 113.62 120.63 2k5u n SER 6 Ca -0.14 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.66 2k5u n SER 6 Cb 0.46 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.53 2k5u n SER 6 CO 0.00 0.00 0.00 0.07 -3.01 0.00 0.00 175.04 172.10 2k5u h LYS 7 N 0.00 0.00 0.00 1.43 2.10 -2.01 -3.45 116.57 114.65 2k5u h LYS 7 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2k5u h LYS 7 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 2k5u h LYS 7 CO 0.00 0.81 0.00 -0.11 -2.00 0.00 0.00 179.45 178.15 2k5u n LEU 8 N -3.24 0.17 -4.93 7.07 -0.00 -1.26 -5.11 117.00 109.70 2k5u n LEU 8 Ca -0.06 0.07 -0.28 0.00 -0.00 0.00 0.00 56.01 55.75 2k5u n LEU 8 Cb 0.98 -0.01 0.11 0.00 -0.00 0.00 0.00 43.42 44.50 2k5u n LEU 8 CO 0.46 -0.57 0.74 -0.36 -0.00 0.00 0.00 177.39 177.66 2k5u s PHE 9 N -1.26 2.48 -0.29 1.96 0.08 -1.26 -5.11 117.98 114.58 2k5u s PHE 9 Ca 0.00 0.45 -0.20 0.00 0.12 0.00 0.00 56.93 57.30 2k5u s PHE 9 Cb 0.00 -3.52 0.17 0.00 -0.57 0.00 0.00 43.02 39.11 2k5u s PHE 9 CO 0.00 -1.87 1.21 0.45 -0.10 0.00 0.00 175.22 174.91 2k5u s SER 10 N -4.65 -0.23 -0.19 1.36 0.15 -1.26 -1.61 113.70 107.27 2k5u s SER 10 Ca 0.65 0.40 0.15 0.00 0.70 0.00 0.00 55.95 57.85 2k5u s SER 10 Cb -0.09 0.75 0.44 0.00 -1.71 0.00 0.00 66.02 65.42 2k5u s SER 10 CO 0.48 -0.07 1.19 0.59 1.20 0.00 0.00 173.24 176.63 2k5u n ASN 11 N 2.59 2.27 -1.43 5.45 3.02 -1.26 -4.74 115.26 121.16 2k5u n ASN 11 Ca -0.14 -3.16 0.00 0.00 -0.03 0.00 0.00 54.58 51.25 2k5u n ASN 11 Cb 0.57 -0.42 0.09 0.00 -0.61 0.00 0.00 39.78 39.40 2k5u n ASN 11 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 2k5u n LEU 12 N -0.57 2.23 0.00 3.41 0.00 -1.26 -4.71 117.00 116.10 2k5u n LEU 12 Ca 0.20 -3.21 0.00 0.00 0.00 0.00 0.00 56.01 53.01 2k5u n LEU 12 Cb 0.88 -0.17 0.00 0.00 0.00 0.00 0.00 43.42 44.13 2k5u n LEU 12 CO 0.08 1.12 0.21 0.33 0.00 0.00 0.00 177.39 179.13 2k5u n PHE 13 N -0.40 0.00 -2.13 1.96 -0.00 -1.26 -4.74 117.46 110.89 2k5u n PHE 13 Ca 0.16 -0.08 -0.41 0.00 -0.00 0.00 0.00 57.45 57.12 2k5u n PHE 13 Cb 0.91 -0.01 -0.00 0.00 -0.00 0.00 0.00 39.48 40.38 2k5u n PHE 13 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2k5u n GLY 14 N -0.08 5.05 3.11 7.13 0.00 -1.26 -4.66 105.19 114.47 2k5u n GLY 14 Ca 0.00 -2.08 -0.12 0.00 0.00 0.00 0.00 46.02 43.83 2k5u n GLY 14 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2k5u n ASN 15 N 2.49 -6.51 -2.67 1.61 3.02 -1.26 -4.99 115.26 106.95 2k5u n ASN 15 Ca 0.54 -0.57 -0.08 0.00 -0.03 0.00 0.00 54.58 54.43 2k5u n ASN 15 Cb 0.29 -4.92 0.04 0.00 -0.61 0.00 0.00 39.78 34.58 2k5u n ASN 15 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2k5u n LYS 16 N -2.90 1.17 -3.15 3.52 4.01 -1.26 -5.00 118.16 114.55 2k5u n LYS 16 Ca -0.06 -3.05 -0.45 0.00 -0.51 0.00 0.00 58.31 54.25 2k5u n LYS 16 Cb 0.59 -1.08 -0.00 0.00 -0.51 0.00 0.00 35.03 34.04 2k5u n LYS 16 CO 0.00 0.00 0.00 -1.83 -1.11 0.00 0.00 177.40 174.46 2k5u s GLU 17 N -2.66 4.11 0.91 1.97 -1.05 -1.26 -4.90 118.70 115.82 2k5u s GLU 17 Ca 0.26 -2.85 -0.12 0.00 -0.15 0.00 0.00 54.97 52.11 2k5u s GLU 17 Cb 0.45 -4.80 0.19 0.00 -0.44 0.00 0.00 34.13 29.54 2k5u s GLU 17 CO 0.02 -1.50 1.25 -1.64 0.95 0.00 0.00 175.26 174.34 2k5u s MET 18 N 0.22 0.78 -0.33 -4.83 -1.94 -1.26 -4.90 119.30 107.04 2k5u s MET 18 Ca 0.36 -0.67 -0.01 0.00 -1.71 0.00 0.00 55.69 53.66 2k5u s MET 18 Cb -0.07 -1.97 0.13 0.00 2.01 0.00 0.00 34.83 34.94 2k5u s MET 18 CO -0.04 -2.24 0.23 0.50 -0.01 0.00 0.00 175.02 173.45 2k5u s ARG 19 N -5.72 0.43 -0.11 2.03 3.52 -1.26 -2.85 118.95 114.99 2k5u s ARG 19 Ca 0.73 -0.86 -0.26 0.00 -0.13 0.00 0.00 55.73 55.21 2k5u s ARG 19 Cb -0.03 -1.08 -0.02 0.00 -1.56 0.00 0.00 34.95 32.26 2k5u s ARG 19 CO 0.51 -1.13 0.85 0.42 -0.81 0.00 0.00 175.30 175.14 2k5u s ILE 20 N 1.60 4.90 0.15 4.11 -1.09 -0.69 0.22 121.20 130.40 2k5u s ILE 20 Ca 0.14 1.71 0.10 0.00 -2.23 0.00 0.00 60.65 60.37 2k5u s ILE 20 Cb -0.19 -4.17 -0.04 0.00 -1.58 0.00 0.00 42.46 36.49 2k5u s ILE 20 CO -0.15 0.10 -0.18 -0.76 -1.23 0.00 0.00 174.94 172.72 2k5u s LEU 21 N 1.63 2.69 -0.35 2.97 1.43 -0.95 -2.55 118.68 123.56 2k5u s LEU 21 Ca 0.42 -0.63 -0.08 0.00 -1.03 0.00 0.00 54.13 52.81 2k5u s LEU 21 Cb -0.18 -1.48 0.04 0.00 0.03 0.00 0.00 46.19 44.60 2k5u s LEU 21 CO 0.17 0.15 0.14 -0.32 0.23 0.00 0.00 176.35 176.72 2k5u s MET 22 N -2.41 2.65 0.16 1.70 1.75 0.30 -1.33 119.30 122.13 2k5u s MET 22 Ca 0.20 -1.19 0.11 0.00 -1.25 0.00 0.00 55.69 53.56 2k5u s MET 22 Cb -0.10 -3.55 -0.04 0.00 2.84 0.00 0.00 34.83 33.98 2k5u s MET 22 CO 0.11 -0.70 -0.24 0.08 -0.65 0.00 0.00 175.02 173.61 2k5u s VAL 23 N 1.43 2.38 -5.00 10.11 1.01 -0.82 -2.01 120.40 127.50 2k5u s VAL 23 Ca -0.00 -1.89 0.00 0.00 0.00 0.00 0.00 61.98 60.09 2k5u s VAL 23 Cb -0.20 -2.11 0.00 0.00 0.00 0.00 0.00 36.38 34.08 2k5u s VAL 23 CO 0.04 -0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.72 2k5u n GLY 24 N 0.53 -0.13 3.77 4.51 0.00 -1.26 -0.12 105.19 112.49 2k5u n GLY 24 Ca -0.15 -1.51 -0.40 0.00 0.00 0.00 0.00 46.02 43.97 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 4.37 0.66 0.99 1.98 -1.17 -1.46 118.68 124.06 2k5u s LEU 25 Ca 0.00 2.50 -0.17 0.00 -2.89 0.00 0.00 54.13 53.57 2k5u s LEU 25 Cb 0.00 -3.77 -0.00 0.00 0.66 0.00 0.00 46.19 43.07 2k5u s LEU 25 CO 0.00 -0.53 1.23 -0.67 -1.89 0.00 0.00 176.35 174.50 2k5u n ASP 26 N 0.61 1.75 -0.04 3.68 -0.08 -1.26 -2.15 116.55 119.06 2k5u n ASP 26 Ca 0.01 0.79 -0.00 0.00 -1.51 0.00 0.00 54.79 54.08 2k5u n ASP 26 Cb 0.44 -1.53 -0.00 0.00 2.34 0.00 0.00 41.12 42.37 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 0.94 0.20 0.28 0.27 0.00 -1.26 -4.85 105.19 100.77 2k5u n GLY 27 Ca 0.15 -0.01 0.05 0.00 0.00 0.00 0.00 46.02 46.21 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 1.73 0.00 4.61 0.00 -1.76 -3.45 119.26 120.39 2k5u h ALA 28 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2k5u h ALA 28 Cb 0.69 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2k5u h ALA 28 CO 0.01 0.22 0.00 0.41 0.00 0.00 0.00 179.25 179.90 2k5u n GLY 29 N -1.34 0.34 0.17 0.00 0.00 -1.26 -4.72 105.19 98.37 2k5u n GLY 29 Ca 0.01 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.06 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 0.00 -0.03 1.61 1.57 -1.94 -2.37 116.57 115.42 2k5u h LYS 30 Ca 0.00 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.60 2k5u h LYS 30 Cb 0.00 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.32 2k5u h LYS 30 CO 0.00 0.47 -0.67 1.15 -0.57 0.00 0.00 179.45 179.82 2k5u h THR 31 N 0.00 1.38 -0.15 -0.16 2.02 -1.96 -1.32 112.91 112.72 2k5u h THR 31 Ca -0.00 -2.06 -0.04 0.00 0.77 0.00 0.00 66.41 65.08 2k5u h THR 31 Cb 1.06 2.46 -0.00 0.00 -1.74 0.00 0.00 68.15 69.93 2k5u h THR 31 CO 0.06 0.61 -0.06 0.74 0.37 0.00 0.00 175.52 177.24 2k5u h THR 32 N 0.06 1.31 -0.35 3.16 2.02 -1.94 -2.97 112.91 114.19 2k5u h THR 32 Ca -0.08 -1.08 -0.13 0.00 0.77 0.00 0.00 66.41 65.89 2k5u h THR 32 Cb 1.36 1.71 -0.01 0.00 -1.74 0.00 0.00 68.15 69.46 2k5u h THR 32 CO 0.13 0.32 -0.31 0.58 0.37 0.00 0.00 175.52 176.61 2k5u h VAL 33 N -0.02 1.28 -0.32 3.16 2.07 -1.53 -2.81 116.25 118.08 2k5u h VAL 33 Ca 0.03 -1.45 0.06 0.00 0.82 0.00 0.00 66.70 66.16 2k5u h VAL 33 Cb 0.52 1.34 -0.05 0.00 -1.52 0.00 0.00 31.29 31.58 2k5u h VAL 33 CO 0.02 0.48 -0.02 0.25 0.02 0.00 0.00 177.57 178.32 2k5u h LEU 34 N 0.64 -0.17 -1.09 2.57 5.85 -1.23 0.14 115.31 122.01 2k5u h LEU 34 Ca 0.07 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.84 2k5u h LEU 34 Cb 0.84 0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.98 2k5u h LEU 34 CO 0.07 -0.05 0.30 1.88 -0.34 0.00 0.00 178.44 180.31 2k5u h TYR 35 N 0.07 0.94 -0.62 1.25 0.05 -1.48 -2.56 116.97 114.62 2k5u h TYR 35 Ca 0.15 -0.04 -0.09 0.00 0.05 0.00 0.00 58.73 58.80 2k5u h TYR 35 Cb 0.22 -0.29 -0.02 0.00 1.01 0.00 0.00 36.73 37.64 2k5u h TYR 35 CO -0.25 0.70 0.02 0.87 -1.05 0.00 0.00 178.16 178.45 2k5u h LYS 36 N 0.94 1.08 -0.21 4.88 6.56 -0.97 -2.38 116.57 126.47 2k5u h LYS 36 Ca 0.23 -0.33 0.06 0.00 -1.06 0.00 0.00 60.65 59.55 2k5u h LYS 36 Cb 0.12 -0.10 -0.01 0.00 -0.57 0.00 0.00 32.23 31.67 2k5u h LYS 36 CO -0.03 1.04 0.25 -0.07 -2.06 0.00 0.00 179.45 178.58 2k5u h LEU 37 N 0.99 0.00 -2.65 2.94 4.07 -0.35 -3.47 115.31 116.84 2k5u h LEU 37 Ca 0.18 0.00 -0.10 0.00 0.08 0.00 0.00 57.88 58.04 2k5u h LEU 37 Cb 0.54 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.28 2k5u h LEU 37 CO 0.03 0.00 -0.78 0.29 -1.08 0.00 0.00 178.44 176.90 2k5u n LYS 38 N -3.72 -2.30 -0.00 1.13 4.76 -0.90 -4.97 118.16 112.17 2k5u n LYS 38 Ca 0.02 1.96 0.04 0.00 -2.87 0.00 0.00 58.31 57.46 2k5u n LYS 38 Cb 0.37 -4.45 -0.05 0.00 -1.84 0.00 0.00 35.03 29.06 2k5u n LYS 38 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2k5u n LEU 39 N -0.04 0.10 0.00 -0.35 4.77 -1.26 -5.07 117.00 115.14 2k5u n LEU 39 Ca 0.04 -0.15 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 2k5u n LEU 39 Cb 0.46 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 2k5u n LEU 39 CO 0.47 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 2k5u n GLY 40 N 1.82 2.10 3.02 -0.72 0.00 -1.26 -4.97 105.19 105.18 2k5u n GLY 40 Ca -0.01 -0.67 -0.11 0.00 0.00 0.00 0.00 46.02 45.24 2k5u n GLY 40 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2k5u s GLU 41 N 0.00 0.29 -0.04 1.61 2.12 -1.26 -5.16 118.70 116.26 2k5u s GLU 41 Ca 0.00 -0.25 0.05 0.00 0.36 0.00 0.00 54.97 55.13 2k5u s GLU 41 Cb 0.00 0.12 -0.02 0.00 0.26 0.00 0.00 34.13 34.49 2k5u s GLU 41 CO 0.00 -0.06 -0.18 0.08 -0.54 0.00 0.00 175.26 174.56 2k5u s VAL 42 N -0.85 2.74 0.05 3.70 1.01 -1.26 -4.84 120.40 120.95 2k5u s VAL 42 Ca -0.09 -0.85 -0.23 0.00 0.00 0.00 0.00 61.98 60.80 2k5u s VAL 42 Cb -0.06 -2.04 -0.06 0.00 0.00 0.00 0.00 36.38 34.23 2k5u s VAL 42 CO 0.00 0.58 0.69 -0.63 0.00 0.00 0.00 175.10 175.75 2k5u s ILE 43 N -0.70 4.75 -0.16 2.22 -1.09 -1.10 -4.93 121.20 120.19 2k5u s ILE 43 Ca 0.11 1.48 -0.04 0.00 -2.23 0.00 0.00 60.65 59.97 2k5u s ILE 43 Cb -0.10 -4.04 -0.03 0.00 -1.58 0.00 0.00 42.46 36.71 2k5u s ILE 43 CO 0.00 0.42 -0.02 -0.89 -1.23 0.00 0.00 174.94 173.21 2k5u s THR 44 N -0.32 4.00 -0.03 2.92 2.01 -1.26 -2.61 115.64 120.33 2k5u s THR 44 Ca 0.35 -0.32 -0.05 0.00 0.31 0.00 0.00 61.69 61.98 2k5u s THR 44 Cb -0.20 -2.76 0.01 0.00 0.01 0.00 0.00 72.50 69.56 2k5u s THR 44 CO 0.21 0.49 0.13 0.42 -0.69 0.00 0.00 174.62 175.18 2k5u s THR 45 N 0.39 0.03 -0.31 -0.82 -4.23 -0.93 -5.01 115.64 104.75 2k5u s THR 45 Ca -0.03 -0.24 -0.10 0.00 -1.18 0.00 0.00 61.69 60.14 2k5u s THR 45 Cb -0.14 -0.27 -0.01 0.00 1.34 0.00 0.00 72.50 73.41 2k5u s THR 45 CO 0.03 -0.13 0.17 -0.63 -0.54 0.00 0.00 174.62 173.52 2k5u s ILE 46 N -0.41 4.82 0.21 2.99 1.01 -1.26 -1.63 121.20 126.92 2k5u s ILE 46 Ca -0.05 -0.31 -0.07 0.00 0.00 0.00 0.00 60.65 60.22 2k5u s ILE 46 Cb -0.03 -3.44 0.07 0.00 0.01 0.00 0.00 42.46 39.07 2k5u s ILE 46 CO 0.01 0.07 1.67 1.55 0.00 0.00 0.00 174.94 178.24 2k5u h PRO 47 N 8.38 0.96 -1.59 2.79 0.13 -1.96 -3.48 132.00 137.24 2k5u h PRO 47 Ca -0.32 -0.31 0.24 0.00 -0.87 0.00 0.00 66.00 64.74 2k5u h PRO 47 Cb 1.15 -0.09 -0.18 0.00 0.13 0.00 0.00 31.00 32.02 2k5u h PRO 47 CO 0.61 0.97 0.77 -0.08 -0.23 0.00 0.00 178.00 180.04 2k5u s THR 48 N -4.94 0.00 0.00 1.56 -1.32 -1.26 -5.07 115.64 104.61 2k5u s THR 48 Ca -0.11 -0.03 0.00 0.00 -1.21 0.00 0.00 61.69 60.34 2k5u s THR 48 Cb 0.14 -1.12 0.00 0.00 -1.51 0.00 0.00 72.50 70.01 2k5u s THR 48 CO 0.84 0.00 0.00 -0.38 -2.21 0.00 0.00 174.62 172.87 2k5u n ILE 49 N -0.16 0.00 -3.06 5.08 2.08 -1.26 -1.90 119.36 120.14 2k5u n ILE 49 Ca -0.02 0.00 -0.26 0.00 0.56 0.00 0.00 62.75 63.04 2k5u n ILE 49 Cb 0.59 0.00 -0.05 0.00 -0.75 0.00 0.00 39.64 39.43 2k5u n ILE 49 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2k5u n GLY 50 N 0.00 5.13 3.38 7.39 0.00 -1.26 -5.06 105.19 114.77 2k5u n GLY 50 Ca 0.00 -2.60 -0.30 0.00 0.00 0.00 0.00 46.02 43.12 2k5u n GLY 50 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2k5u s PHE 51 N -3.09 2.37 -0.08 1.61 2.19 -0.80 -5.11 117.98 115.08 2k5u s PHE 51 Ca 0.46 -0.37 0.04 0.00 0.33 0.00 0.00 56.93 57.38 2k5u s PHE 51 Cb 0.26 -1.38 0.00 0.00 -1.31 0.00 0.00 43.02 40.59 2k5u s PHE 51 CO -0.11 0.19 -0.20 -0.80 1.83 0.00 0.00 175.22 176.13 2k5u s ASN 52 N -1.41 2.57 0.02 6.13 -0.87 -1.26 -3.94 114.94 116.17 2k5u s ASN 52 Ca 0.13 -0.45 0.04 0.00 -1.57 0.00 0.00 52.86 51.01 2k5u s ASN 52 Cb -0.10 -1.09 -0.02 0.00 -0.02 0.00 0.00 41.25 40.02 2k5u s ASN 52 CO 0.03 0.13 -0.12 0.54 -2.57 0.00 0.00 177.10 175.11 2k5u s VAL 53 N 0.37 0.94 0.01 1.60 0.11 -0.65 -4.70 120.40 118.08 2k5u s VAL 53 Ca -0.15 -0.76 0.08 0.00 -2.93 0.00 0.00 61.98 58.22 2k5u s VAL 53 Cb -0.16 -0.84 -0.03 0.00 -1.53 0.00 0.00 36.38 33.83 2k5u s VAL 53 CO 0.06 0.07 -0.25 -1.61 -3.33 0.00 0.00 175.10 170.05 2k5u s GLU 54 N -0.78 2.01 -0.03 1.54 0.41 -1.11 -2.19 118.70 118.54 2k5u s GLU 54 Ca 0.02 -0.99 0.00 0.00 -0.41 0.00 0.00 54.97 53.58 2k5u s GLU 54 Cb -0.06 -2.05 0.03 0.00 -1.78 0.00 0.00 34.13 30.26 2k5u s GLU 54 CO 0.00 0.54 0.01 0.99 -0.49 0.00 0.00 175.26 176.31 2k5u s THR 55 N -0.73 0.17 0.02 3.63 2.01 -1.07 -1.62 115.64 118.05 2k5u s THR 55 Ca 0.11 0.12 0.06 0.00 0.31 0.00 0.00 61.69 62.29 2k5u s THR 55 Cb -0.10 -0.28 -0.02 0.00 0.01 0.00 0.00 72.50 72.10 2k5u s THR 55 CO 0.01 0.16 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.23 2k5u s VAL 56 N 1.20 1.43 -0.21 3.82 1.01 0.99 -2.72 120.40 125.93 2k5u s VAL 56 Ca -0.07 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 60.95 2k5u s VAL 56 Cb -0.13 -1.23 0.03 0.00 0.00 0.00 0.00 36.38 35.04 2k5u s VAL 56 CO -0.02 0.25 -0.15 -1.10 0.00 0.00 0.00 175.10 174.08 2k5u s GLN 57 N -0.84 2.84 -0.36 2.72 -0.21 -1.26 0.58 119.66 123.13 2k5u s GLN 57 Ca 0.06 -0.95 -0.04 0.00 0.02 0.00 0.00 55.36 54.45 2k5u s GLN 57 Cb -0.08 -2.74 0.07 0.00 1.00 0.00 0.00 33.01 31.26 2k5u s GLN 57 CO 0.01 -0.32 0.12 -0.47 -2.12 0.00 0.00 175.29 172.51 2k5u s TYR 58 N 1.27 3.38 0.00 0.91 6.14 -0.17 -4.95 117.35 123.93 2k5u s TYR 58 Ca 0.01 -1.91 0.00 0.00 0.64 0.00 0.00 57.07 55.81 2k5u s TYR 58 Cb -0.15 -2.63 0.00 0.00 0.42 0.00 0.00 41.96 39.60 2k5u s TYR 58 CO -0.09 -0.85 0.00 1.63 0.64 0.00 0.00 175.55 176.88 2k5u n LYS 59 N 4.69 0.00 0.00 4.97 4.01 -1.26 -1.35 118.16 129.22 2k5u n LYS 59 Ca -0.09 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.71 2k5u n LYS 59 Cb 0.43 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.95 2k5u n LYS 59 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 2k5u n ASN 60 N 2.00 4.11 -4.76 4.39 2.85 -1.26 -5.04 115.26 117.55 2k5u n ASN 60 Ca 0.00 0.00 -0.40 0.00 -0.11 0.00 0.00 54.58 54.07 2k5u n ASN 60 Cb 0.00 0.18 -0.05 0.00 1.24 0.00 0.00 39.78 41.15 2k5u n ASN 60 CO 0.00 0.00 0.00 -0.51 -2.11 0.00 0.00 177.26 174.64 2k5u s ILE 61 N -1.94 3.68 0.21 -1.44 2.07 -0.46 -4.83 121.20 118.50 2k5u s ILE 61 Ca 0.00 1.68 0.06 0.00 -1.41 0.00 0.00 60.65 60.99 2k5u s ILE 61 Cb 0.00 -4.07 -0.04 0.00 0.13 0.00 0.00 42.46 38.49 2k5u s ILE 61 CO 0.00 0.39 0.15 -0.44 -1.91 0.00 0.00 174.94 173.13 2k5u s SER 62 N -1.00 5.45 0.01 4.50 0.01 -1.13 -1.00 113.70 120.55 2k5u s SER 62 Ca 0.44 -0.21 0.01 0.00 1.31 0.00 0.00 55.95 57.49 2k5u s SER 62 Cb -0.30 -1.38 -0.01 0.00 0.21 0.00 0.00 66.02 64.54 2k5u s SER 62 CO 0.38 0.02 -0.04 0.12 0.41 0.00 0.00 173.24 174.13 2k5u s PHE 63 N -1.94 0.31 -0.20 2.43 2.19 0.20 -1.71 117.98 119.26 2k5u s PHE 63 Ca 0.32 -0.27 -0.10 0.00 0.33 0.00 0.00 56.93 57.21 2k5u s PHE 63 Cb -0.09 -0.20 0.07 0.00 -1.31 0.00 0.00 43.02 41.49 2k5u s PHE 63 CO 0.24 -0.07 0.47 0.99 1.83 0.00 0.00 175.22 178.67 2k5u s THR 64 N -0.72 -0.17 0.14 0.12 2.01 -1.06 -0.00 115.64 115.96 2k5u s THR 64 Ca -0.06 0.09 0.10 0.00 0.31 0.00 0.00 61.69 62.13 2k5u s THR 64 Cb -0.05 -0.70 -0.04 0.00 0.01 0.00 0.00 72.50 71.72 2k5u s THR 64 CO -0.00 0.04 -0.21 0.68 -0.69 0.00 0.00 174.62 174.43 2k5u s VAL 65 N 1.71 2.63 -0.22 3.82 -7.23 -0.64 -0.54 120.40 119.92 2k5u s VAL 65 Ca -0.08 -1.66 -0.27 0.00 -1.81 0.00 0.00 61.98 58.15 2k5u s VAL 65 Cb -0.09 -2.21 0.12 0.00 0.56 0.00 0.00 36.38 34.76 2k5u s VAL 65 CO -0.14 0.05 0.97 -1.66 -0.31 0.00 0.00 175.10 174.01 2k5u s TRP 66 N -1.23 -0.48 0.97 2.82 -2.14 -0.85 -2.74 118.94 115.29 2k5u s TRP 66 Ca 0.18 1.04 -0.11 0.00 2.66 0.00 0.00 56.10 59.87 2k5u s TRP 66 Cb -0.10 0.39 0.18 0.00 -3.10 0.00 0.00 33.47 30.84 2k5u s TRP 66 CO 0.09 -0.31 1.11 0.16 -2.66 0.00 0.00 176.95 175.35 2k5u s ASP 67 N -0.30 2.49 0.17 -2.66 -4.77 -1.26 -4.18 116.67 106.15 2k5u s ASP 67 Ca 0.00 1.98 -0.15 0.00 -3.30 0.00 0.00 52.55 51.09 2k5u s ASP 67 Cb -0.03 -2.49 0.11 0.00 -1.09 0.00 0.00 42.92 39.42 2k5u s ASP 67 CO -0.02 -3.34 1.74 -0.37 0.70 0.00 0.00 175.17 173.88 2k5u h VAL 68 N -2.03 0.82 0.00 2.11 -1.51 -1.60 -3.45 116.25 110.60 2k5u h VAL 68 Ca -0.48 -0.09 0.00 0.00 -1.23 0.00 0.00 66.70 64.90 2k5u h VAL 68 Cb 1.28 0.54 0.00 0.00 -2.13 0.00 0.00 31.29 30.99 2k5u h VAL 68 CO 0.45 0.05 0.00 0.61 -1.23 0.00 0.00 177.57 177.44 2k5u n GLY 69 N -1.25 3.04 4.68 5.19 0.00 -1.26 -4.64 105.19 110.95 2k5u n GLY 69 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.28 0.95 0.00 -0.02 0.00 -1.26 -2.87 105.19 101.71 2k5u n GLY 70 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.11 0.00 0.00 1.61 -0.00 -1.26 -5.00 117.38 111.62 2k5u n GLN 71 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.00 2k5u n GLN 71 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 30.24 30.24 2k5u n GLN 71 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 2k5u n ASP 72 N -0.61 0.00 0.00 2.61 -0.08 -1.14 -4.73 116.55 112.60 2k5u n ASP 72 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2k5u n ASP 72 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 2k5u n ASP 72 CO 0.00 0.00 0.00 -1.14 0.12 0.00 0.00 177.20 176.18 2k5u n ARG 73 N 0.00 0.00 -4.48 -0.67 0.00 -1.26 -4.86 116.66 105.39 2k5u n ARG 73 Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 57.85 57.54 2k5u n ARG 73 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 32.46 32.35 2k5u n ARG 73 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.63 178.59 2k5u s ILE 74 N 0.00 3.38 -0.06 5.15 -0.00 -1.26 -5.13 121.20 123.28 2k5u s ILE 74 Ca 0.00 -0.95 -0.07 0.00 -0.00 0.00 0.00 60.65 59.63 2k5u s ILE 74 Cb 0.00 -2.48 0.02 0.00 -0.00 0.00 0.00 42.46 40.00 2k5u s ILE 74 CO 0.00 0.34 0.18 0.00 -0.00 0.00 0.00 174.94 175.46 2k5u s ARG 75 N -1.54 0.26 0.01 0.37 3.03 -1.26 -5.02 118.95 114.80 2k5u s ARG 75 Ca 0.17 0.16 0.00 0.00 2.03 0.00 0.00 55.73 58.10 2k5u s ARG 75 Cb -0.11 0.12 0.00 0.00 -1.03 0.00 0.00 34.95 33.93 2k5u s ARG 75 CO 0.08 -0.04 0.00 0.45 -1.13 0.00 0.00 175.30 174.66 2k5u n SER 76 N 2.75 -0.05 0.15 -2.89 2.88 -1.26 -4.96 113.62 110.25 2k5u n SER 76 Ca -0.14 0.13 -0.00 0.00 -1.33 0.00 0.00 58.87 57.53 2k5u n SER 76 Cb 0.58 0.18 0.21 0.00 -0.75 0.00 0.00 64.21 64.43 2k5u n SER 76 CO 0.00 0.00 0.00 0.17 -1.23 0.00 0.00 175.04 173.98 2k5u h LEU 77 N 0.00 0.00 -1.74 2.46 8.10 -1.99 -2.84 115.31 119.31 2k5u h LEU 77 Ca 0.00 0.00 -0.03 0.00 0.11 0.00 0.00 57.88 57.96 2k5u h LEU 77 Cb 0.00 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.22 2k5u h LEU 77 CO 0.00 0.56 -0.16 -0.50 -4.11 0.00 0.00 178.44 174.24 2k5u h TRP 78 N 0.00 0.00 0.00 0.17 6.55 -1.95 -2.65 115.95 118.07 2k5u h TRP 78 Ca -0.01 0.00 -0.03 0.00 0.95 0.00 0.00 58.89 59.80 2k5u h TRP 78 Cb 1.02 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 29.32 2k5u h TRP 78 CO 0.00 0.16 -0.25 -0.09 -1.05 0.00 0.00 178.44 177.21 2k5u h ARG 79 N 0.00 0.00 -0.93 0.49 2.43 -1.90 -2.26 114.38 112.22 2k5u h ARG 79 Ca -0.00 0.00 0.22 0.00 -0.81 0.00 0.00 59.98 59.39 2k5u h ARG 79 Cb 0.42 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 29.90 2k5u h ARG 79 CO 0.02 0.56 0.62 1.25 -1.51 0.00 0.00 179.97 180.91 2k5u h HIS 80 N -1.00 0.51 0.00 2.20 2.76 -1.51 0.92 115.15 119.04 2k5u h HIS 80 Ca -0.05 0.02 -0.25 0.00 -2.20 0.00 0.00 60.37 57.88 2k5u h HIS 80 Cb 0.66 -0.16 -0.04 0.00 1.55 0.00 0.00 27.41 29.43 2k5u h HIS 80 CO 0.10 0.12 -1.36 1.88 -1.30 0.00 0.00 177.93 177.37 2k5u h TYR 81 N 0.37 0.00 -0.20 5.26 -1.99 -1.60 -3.34 116.97 115.46 2k5u h TYR 81 Ca 0.49 0.00 0.04 0.00 2.00 0.00 0.00 58.73 61.26 2k5u h TYR 81 Cb 1.28 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 39.97 2k5u h TYR 81 CO -0.00 1.00 -0.07 -0.92 -0.00 0.00 0.00 178.16 178.17 2k5u h TYR 82 N 0.00 -0.15 -0.17 4.88 5.03 -0.18 0.88 116.97 127.25 2k5u h TYR 82 Ca -0.15 0.02 -0.00 0.00 2.58 0.00 0.00 58.73 61.18 2k5u h TYR 82 Cb 1.89 0.10 -0.01 0.00 1.55 0.00 0.00 36.73 40.27 2k5u h TYR 82 CO 0.00 -0.11 0.10 -0.09 -1.32 0.00 0.00 178.16 176.74 2k5u h ARG 83 N -0.03 0.23 -0.34 1.82 2.43 -1.68 -2.08 114.38 114.73 2k5u h ARG 83 Ca 0.10 -0.02 0.10 0.00 -0.81 0.00 0.00 59.98 59.35 2k5u h ARG 83 Cb 0.18 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 2k5u h ARG 83 CO -0.22 0.21 0.25 -0.97 -1.51 0.00 0.00 179.97 177.73 2k5u h ASN 84 N 0.18 0.00 -4.05 -3.80 -1.24 -1.57 -3.42 115.58 101.68 2k5u h ASN 84 Ca 0.06 0.00 -0.55 0.00 0.71 0.00 0.00 56.30 56.52 2k5u h ASN 84 Cb 0.05 0.00 0.14 0.00 0.73 0.00 0.00 38.32 39.23 2k5u h ASN 84 CO -0.01 0.00 0.62 -0.89 -1.29 0.00 0.00 177.43 175.86 2k5u s THR 85 N -5.03 2.04 0.00 -3.57 2.01 0.26 -4.81 115.64 106.54 2k5u s THR 85 Ca -0.05 0.03 0.00 0.00 0.31 0.00 0.00 61.69 61.98 2k5u s THR 85 Cb 0.19 -3.01 0.00 0.00 0.01 0.00 0.00 72.50 69.68 2k5u s THR 85 CO 0.71 -0.00 0.56 -0.62 -0.69 0.00 0.00 174.62 174.58 2k5u n GLU 86 N -1.00 0.40 -3.85 4.92 4.71 -0.98 -4.82 120.64 120.01 2k5u n GLU 86 Ca 0.10 -0.70 -0.12 0.00 -0.01 0.00 0.00 57.16 56.44 2k5u n GLU 86 Cb 0.45 -0.86 -0.12 0.00 -1.01 0.00 0.00 31.44 29.89 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 -0.28 -0.03 -0.19 0.62 0.00 0.60 -4.13 107.32 103.91 2k5u s GLY 87 Ca 0.00 0.14 -0.04 0.00 0.00 0.00 0.00 44.72 44.81 2k5u s GLY 87 CO 0.00 0.06 0.16 0.14 0.00 0.00 0.00 173.10 173.46 2k5u s VAL 88 N -0.48 -0.22 -0.24 1.40 1.01 -1.06 -2.24 120.40 118.57 2k5u s VAL 88 Ca -0.06 -0.16 0.01 0.00 0.00 0.00 0.00 61.98 61.78 2k5u s VAL 88 Cb -0.04 -0.64 0.04 0.00 0.00 0.00 0.00 36.38 35.74 2k5u s VAL 88 CO 0.00 -0.25 -0.11 -0.63 0.00 0.00 0.00 175.10 174.11 2k5u s ILE 89 N 2.24 2.39 -0.12 2.22 -1.09 -0.44 -2.55 121.20 123.84 2k5u s ILE 89 Ca 0.05 -1.30 -0.19 0.00 -2.23 0.00 0.00 60.65 56.98 2k5u s ILE 89 Cb -0.16 -2.26 -0.04 0.00 -1.58 0.00 0.00 42.46 38.42 2k5u s ILE 89 CO -0.12 0.15 0.51 -0.36 -1.23 0.00 0.00 174.94 173.90 2k5u s PHE 90 N 1.21 3.50 -0.16 3.97 0.08 0.39 -1.95 117.98 125.02 2k5u s PHE 90 Ca -0.03 0.92 0.00 0.00 0.12 0.00 0.00 56.93 57.94 2k5u s PHE 90 Cb -0.17 -2.60 0.03 0.00 -0.57 0.00 0.00 43.02 39.71 2k5u s PHE 90 CO -0.06 0.12 -0.09 0.08 -0.10 0.00 0.00 175.22 175.17 2k5u s VAL 91 N 0.77 1.36 0.31 -0.44 1.01 0.83 -0.04 120.40 124.21 2k5u s VAL 91 Ca 0.27 -0.67 0.09 0.00 0.00 0.00 0.00 61.98 61.67 2k5u s VAL 91 Cb -0.15 -1.41 -0.04 0.00 0.00 0.00 0.00 36.38 34.77 2k5u s VAL 91 CO 0.11 0.27 0.08 0.54 0.00 0.00 0.00 175.10 176.10 2k5u s VAL 92 N 1.55 3.15 -0.21 2.92 0.11 -1.04 -3.02 120.40 123.85 2k5u s VAL 92 Ca 0.02 -1.79 -0.24 0.00 -2.93 0.00 0.00 61.98 57.03 2k5u s VAL 92 Cb -0.14 -2.92 -0.01 0.00 -1.53 0.00 0.00 36.38 31.77 2k5u s VAL 92 CO -0.09 -0.25 0.81 -1.81 -3.33 0.00 0.00 175.10 170.43 2k5u s ASP 93 N -3.77 6.87 0.18 3.54 1.01 -1.26 -2.77 116.67 120.46 2k5u s ASP 93 Ca 0.35 1.07 0.25 0.00 0.71 0.00 0.00 52.55 54.93 2k5u s ASP 93 Cb -0.04 -2.44 0.91 0.00 1.01 0.00 0.00 42.92 42.37 2k5u s ASP 93 CO 0.21 -0.45 1.75 -0.24 0.21 0.00 0.00 175.17 176.66 2k5u n SER 94 N 5.60 0.58 -0.76 0.27 2.88 -1.08 -2.79 113.62 118.31 2k5u n SER 94 Ca 0.04 0.59 0.08 0.00 -1.33 0.00 0.00 58.87 58.25 2k5u n SER 94 Cb 0.48 -0.73 0.12 0.00 -0.75 0.00 0.00 64.21 63.33 2k5u n SER 94 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 2k5u n ASN 95 N -2.08 2.71 -3.45 -3.46 6.94 -1.26 -1.17 115.26 113.49 2k5u n ASN 95 Ca 0.05 -1.79 -0.29 0.00 -0.02 0.00 0.00 54.58 52.52 2k5u n ASN 95 Cb 0.33 -0.11 -0.06 0.00 -2.36 0.00 0.00 39.78 37.58 2k5u n ASN 95 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 2k5u n ASP 96 N 0.97 4.31 -0.23 0.53 5.75 -1.12 -4.85 116.55 121.91 2k5u n ASP 96 Ca 0.12 -3.48 -0.05 0.00 -0.01 0.00 0.00 54.79 51.37 2k5u n ASP 96 Cb 0.45 -0.75 0.10 0.00 -1.03 0.00 0.00 41.12 39.89 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 4.20 1.08 -0.07 0.11 9.65 -1.83 -0.46 114.38 127.05 2k5u h ARG 97 Ca 0.20 -0.22 0.02 0.00 -1.10 0.00 0.00 59.98 58.88 2k5u h ARG 97 Cb 0.63 -0.16 -0.00 0.00 -1.39 0.00 0.00 29.97 29.04 2k5u h ARG 97 CO 0.91 0.92 0.19 0.77 2.80 0.00 0.00 179.97 185.56 2k5u h SER 98 N 1.04 0.00 -0.02 -3.80 0.02 -1.97 -0.26 113.55 108.56 2k5u h SER 98 Ca 0.23 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 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 0.00 0.54 -1.14 0.00 0.00 176.83 176.22 2k5u n ARG 99 N -3.29 -0.11 0.04 3.45 1.74 -0.80 -4.61 116.66 113.08 2k5u n ARG 99 Ca -0.01 -0.86 0.06 0.00 -0.77 0.00 0.00 57.85 56.28 2k5u n ARG 99 Cb 0.27 -1.10 0.48 0.00 -1.02 0.00 0.00 32.46 31.10 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 1.00 1.05 -0.25 0.55 6.09 0.61 0.35 117.51 126.90 2k5u h ILE 100 Ca 0.00 -0.14 -0.14 0.00 -1.37 0.00 0.00 64.86 63.20 2k5u h ILE 100 Cb 0.24 0.59 -0.01 0.00 0.47 0.00 0.00 36.82 38.11 2k5u h ILE 100 CO 0.00 0.08 -0.44 1.23 -3.07 0.00 0.00 178.15 175.95 2k5u h GLY 101 N 0.42 0.68 1.49 8.18 0.00 -1.82 -0.99 103.07 111.03 2k5u h GLY 101 Ca 0.14 -0.71 -0.04 0.00 0.00 0.00 0.00 47.33 46.72 2k5u h GLY 101 CO -0.03 0.64 0.08 0.83 0.00 0.00 0.00 176.54 178.05 2k5u h GLU 102 N 0.50 0.64 -0.22 4.80 4.39 -1.28 -1.29 114.58 122.13 2k5u h GLU 102 Ca 0.04 -0.12 -0.20 0.00 0.34 0.00 0.00 59.36 59.41 2k5u h GLU 102 Cb 0.96 -0.10 0.01 0.00 -0.10 0.00 0.00 28.75 29.52 2k5u h GLU 102 CO 0.09 0.61 -0.65 0.00 -1.16 0.00 0.00 179.01 177.90 2k5u h ALA 103 N 1.47 0.38 -0.71 3.43 0.00 -0.92 -2.80 119.26 120.11 2k5u h ALA 103 Ca 0.14 -0.55 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 2k5u h ALA 103 Cb 0.27 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2k5u h ALA 103 CO 0.00 0.66 0.39 -0.09 0.00 0.00 0.00 179.25 180.21 2k5u h ARG 104 N 0.59 0.98 -0.49 0.00 2.43 -0.67 0.21 114.38 117.43 2k5u h ARG 104 Ca -0.02 -0.11 -0.06 0.00 -0.81 0.00 0.00 59.98 58.98 2k5u h ARG 104 Cb 1.27 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 30.60 2k5u h ARG 104 CO 0.14 0.73 0.07 1.49 -1.51 0.00 0.00 179.97 180.89 2k5u h GLU 105 N 0.97 0.82 -0.35 0.20 4.81 -1.26 0.62 114.58 120.38 2k5u h GLU 105 Ca 0.25 -0.22 -0.09 0.00 -0.13 0.00 0.00 59.36 59.17 2k5u h GLU 105 Cb 0.03 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 2k5u h GLU 105 CO -0.04 0.82 -0.14 0.28 -0.73 0.00 0.00 179.01 179.20 2k5u h VAL 106 N 0.69 1.28 -0.34 0.32 2.07 -1.24 -0.23 116.25 118.80 2k5u h VAL 106 Ca 0.15 -1.24 -0.12 0.00 0.82 0.00 0.00 66.70 66.32 2k5u h VAL 106 Cb 0.40 1.34 -0.01 0.00 -1.52 0.00 0.00 31.29 31.50 2k5u h VAL 106 CO 0.01 0.41 -0.26 -0.03 0.02 0.00 0.00 177.57 177.72 2k5u h MET 107 N 0.50 0.70 -0.41 1.57 1.85 -0.45 -2.59 114.93 116.10 2k5u h MET 107 Ca 0.08 -0.29 -0.08 0.00 -0.61 0.00 0.00 59.70 58.80 2k5u h MET 107 Cb 0.67 -0.03 -0.01 0.00 0.43 0.00 0.00 31.60 32.65 2k5u h MET 107 CO 0.05 0.88 -0.06 0.37 -0.40 0.00 0.00 176.91 177.75 2k5u h GLN 108 N 0.61 0.77 -0.78 0.39 5.75 0.40 -0.45 115.11 121.79 2k5u h GLN 108 Ca 0.08 -0.27 0.03 0.00 -0.15 0.00 0.00 58.65 58.33 2k5u h GLN 108 Cb 0.75 -0.05 -0.05 0.00 1.07 0.00 0.00 27.48 29.20 2k5u h GLN 108 CO 0.06 0.87 0.50 -0.09 -2.65 0.00 0.00 178.83 177.53 2k5u h ARG 109 N 0.59 0.96 -0.39 1.69 1.12 -0.91 -1.73 114.38 115.70 2k5u h ARG 109 Ca 0.11 -0.06 -0.12 0.00 -1.11 0.00 0.00 59.98 58.80 2k5u h ARG 109 Cb 0.57 -0.22 -0.01 0.00 -0.01 0.00 0.00 29.97 30.30 2k5u h ARG 109 CO 0.03 0.63 -0.25 0.52 -3.11 0.00 0.00 179.97 177.80 2k5u h MET 110 N 0.99 0.81 0.00 0.20 2.86 -1.29 -2.76 114.93 115.74 2k5u h MET 110 Ca 0.31 -0.35 -0.00 0.00 -2.06 0.00 0.00 59.70 57.60 2k5u h MET 110 Cb -0.02 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 31.61 2k5u h MET 110 CO -0.10 0.97 -0.01 1.25 1.06 0.00 0.00 176.91 180.09 2k5u h LEU 111 N 0.70 0.00 -1.11 1.22 5.85 -0.20 -1.26 115.31 120.51 2k5u h LEU 111 Ca 0.09 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.81 2k5u h LEU 111 Cb 0.78 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.81 2k5u h LEU 111 CO 0.06 0.01 0.00 -0.46 -0.34 0.00 0.00 178.44 177.71 2k5u n ASN 112 N -3.65 1.60 -4.60 1.25 6.94 -0.91 -4.77 115.26 111.12 2k5u n ASN 112 Ca -0.03 -2.04 -0.43 0.00 -0.02 0.00 0.00 54.58 52.07 2k5u n ASN 112 Cb 0.09 -0.23 -0.04 0.00 -2.36 0.00 0.00 39.78 37.24 2k5u n ASN 112 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 2k5u s GLU 113 N -1.64 3.79 0.48 -3.83 8.01 -0.48 -4.91 118.70 120.13 2k5u s GLU 113 Ca 0.18 0.51 0.21 0.00 0.01 0.00 0.00 54.97 55.88 2k5u s GLU 113 Cb 0.10 -3.82 1.23 0.00 -4.31 0.00 0.00 34.13 27.33 2k5u s GLU 113 CO 0.12 -0.98 1.95 0.38 0.01 0.00 0.00 175.26 176.73 2k5u h ASP 114 N 8.56 0.20 0.44 -0.19 2.03 -1.89 0.74 116.42 126.30 2k5u h ASP 114 Ca -0.23 0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.08 2k5u h ASP 114 Cb 1.08 -0.03 0.00 0.00 -0.83 0.00 0.00 39.33 39.55 2k5u h ASP 114 CO 0.98 0.10 0.00 -0.62 -1.03 0.00 0.00 179.24 178.68 2k5u n GLU 115 N -4.42 0.06 -0.02 4.15 1.02 -1.26 -2.52 120.64 117.66 2k5u n GLU 115 Ca 0.13 0.37 0.00 0.00 -0.02 0.00 0.00 57.16 57.64 2k5u n GLU 115 Cb 0.60 -1.63 0.00 0.00 -0.02 0.00 0.00 31.44 30.39 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 -1.75 0.99 0.26 -4.62 -0.00 0.17 -4.71 117.00 107.33 2k5u n LEU 116 Ca 0.02 -1.05 0.18 0.00 -0.00 0.00 0.00 56.01 55.17 2k5u n LEU 116 Cb 0.15 -0.01 0.91 0.00 -0.00 0.00 0.00 43.42 44.46 2k5u n LEU 116 CO 0.13 0.26 1.15 0.03 -0.00 0.00 0.00 177.39 178.96 2k5u h ARG 117 N 0.00 0.00 -0.32 1.47 3.08 -1.02 0.16 114.38 117.75 2k5u h ARG 117 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2k5u h ARG 117 Cb 0.78 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.83 2k5u h ARG 117 CO 0.00 0.00 0.00 0.27 -1.07 0.00 0.00 179.97 179.17 2k5u n ASN 118 N -3.49 2.94 -4.82 7.04 0.23 -1.26 -5.02 115.26 110.89 2k5u n ASN 118 Ca -0.00 -2.07 -0.33 0.00 -0.53 0.00 0.00 54.58 51.64 2k5u n ASN 118 Cb 0.28 -0.24 -0.04 0.00 -2.08 0.00 0.00 39.78 37.70 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 -1.13 2.96 -0.05 -2.53 0.00 0.04 -5.00 121.76 116.06 2k5u s ALA 119 Ca 0.23 0.42 -0.30 0.00 0.00 0.00 0.00 51.96 52.31 2k5u s ALA 119 Cb 0.13 -3.18 -0.04 0.00 0.00 0.00 0.00 23.12 20.03 2k5u s ALA 119 CO 0.14 -0.18 1.29 0.00 0.00 0.00 0.00 175.76 177.02 2k5u s ALA 120 N -2.24 3.55 -0.10 0.00 0.00 -1.26 -4.95 121.76 116.75 2k5u s ALA 120 Ca 0.63 0.70 0.01 0.00 0.00 0.00 0.00 51.96 53.31 2k5u s ALA 120 Cb -0.12 -3.56 -0.02 0.00 0.00 0.00 0.00 23.12 19.42 2k5u s ALA 120 CO 0.21 -0.87 -0.13 -1.58 0.00 0.00 0.00 175.76 173.39 2k5u s TRP 121 N 2.46 2.78 -0.04 0.00 0.51 -1.13 -2.55 118.94 120.97 2k5u s TRP 121 Ca 0.59 -0.42 0.02 0.00 -2.12 0.00 0.00 56.10 54.18 2k5u s TRP 121 Cb -0.27 -1.76 0.01 0.00 -0.81 0.00 0.00 33.47 30.64 2k5u s TRP 121 CO 0.23 -0.03 -0.09 -1.17 -0.51 0.00 0.00 176.95 175.38 2k5u s LEU 122 N -0.12 1.64 -0.43 2.99 0.20 -1.06 -2.70 118.68 119.20 2k5u s LEU 122 Ca -0.01 -0.20 -0.12 0.00 0.69 0.00 0.00 54.13 54.49 2k5u s LEU 122 Cb -0.14 -0.59 0.07 0.00 -0.43 0.00 0.00 46.19 45.10 2k5u s LEU 122 CO 0.03 0.03 0.31 -0.69 -0.29 0.00 0.00 176.35 175.74 2k5u s VAL 123 N 0.48 4.72 -0.26 1.68 1.01 0.45 -0.46 120.40 128.02 2k5u s VAL 123 Ca -0.08 -1.17 -0.13 0.00 0.00 0.00 0.00 61.98 60.61 2k5u s VAL 123 Cb -0.12 -3.81 -0.05 0.00 0.00 0.00 0.00 36.38 32.40 2k5u s VAL 123 CO 0.01 -0.49 0.26 0.12 0.00 0.00 0.00 175.10 175.00 2k5u s PHE 124 N 1.54 3.26 -0.21 5.22 5.36 0.95 -2.24 117.98 131.84 2k5u s PHE 124 Ca 0.03 0.27 -0.15 0.00 -0.96 0.00 0.00 56.93 56.12 2k5u s PHE 124 Cb -0.23 -2.43 -0.04 0.00 -0.34 0.00 0.00 43.02 39.98 2k5u s PHE 124 CO 0.05 -0.13 0.38 0.00 -1.46 0.00 0.00 175.22 174.07 2k5u s ALA 125 N 1.69 3.56 -0.26 11.12 0.00 -0.82 -2.50 121.76 134.55 2k5u s ALA 125 Ca 0.11 -0.59 0.02 0.00 0.00 0.00 0.00 51.96 51.50 2k5u s ALA 125 Cb -0.15 -2.63 0.06 0.00 0.00 0.00 0.00 23.12 20.40 2k5u s ALA 125 CO 0.09 -0.36 -0.09 -0.80 0.00 0.00 0.00 175.76 174.61 2k5u s ASN 126 N 1.14 4.30 0.00 0.00 0.01 -1.11 -1.37 114.94 117.91 2k5u s ASN 126 Ca 0.18 -1.36 0.00 0.00 -0.71 0.00 0.00 52.86 50.97 2k5u s ASN 126 Cb -0.15 -1.45 0.00 0.00 0.41 0.00 0.00 41.25 40.06 2k5u s ASN 126 CO 0.08 -0.21 0.00 0.29 -1.51 0.00 0.00 177.10 175.75 2k5u n LYS 127 N 4.49 0.00 0.09 -0.60 4.01 -1.02 -2.64 118.16 122.49 2k5u n LYS 127 Ca -0.13 0.00 0.12 0.00 -0.51 0.00 0.00 58.31 57.79 2k5u n LYS 127 Cb 0.43 0.00 0.45 0.00 -0.51 0.00 0.00 35.03 35.40 2k5u n LYS 127 CO 0.00 0.00 0.00 1.04 -1.11 0.00 0.00 177.40 177.33 2k5u n GLN 128 N 0.00 0.17 0.18 1.97 3.00 0.27 -2.60 117.38 120.37 2k5u n GLN 128 Ca 0.00 0.28 0.06 0.00 -0.01 0.00 0.00 57.00 57.33 2k5u n GLN 128 Cb 0.00 -1.76 0.27 0.00 0.00 0.00 0.00 30.24 28.75 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 -3.47 1.08 2.03 -1.93 -3.45 116.42 110.68 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 0.49 0.00 0.05 0.00 -0.83 0.00 0.00 39.33 39.04 2k5u h ASP 129 CO 0.00 0.38 0.69 -0.76 -1.03 0.00 0.00 179.24 178.52 2k5u s LEU 130 N -6.84 4.41 0.54 0.15 1.43 -1.07 -4.92 118.68 112.38 2k5u s LEU 130 Ca 0.01 2.55 0.33 0.00 -1.03 0.00 0.00 54.13 55.99 2k5u s LEU 130 Cb 0.10 -3.62 1.34 0.00 0.03 0.00 0.00 46.19 44.03 2k5u s LEU 130 CO 0.69 -0.59 1.98 1.55 0.23 0.00 0.00 176.35 180.21 2k5u h PRO 131 N 4.88 0.00 -0.25 1.29 0.13 -1.89 -2.89 132.00 133.28 2k5u h PRO 131 Ca -0.46 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.62 2k5u h PRO 131 Cb 1.22 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.32 2k5u h PRO 131 CO 0.75 0.03 -0.02 -0.85 -0.23 0.00 0.00 178.00 177.68 2k5u n GLU 132 N -3.14 2.42 -3.19 0.86 0.28 -1.26 -5.02 120.64 111.58 2k5u n GLU 132 Ca 0.00 -2.90 -0.34 0.00 -0.16 0.00 0.00 57.16 53.77 2k5u n GLU 132 Cb 0.31 -1.79 -0.06 0.00 1.43 0.00 0.00 31.44 31.33 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 -2.95 3.42 0.42 -1.84 0.00 -1.09 -4.88 121.76 114.84 2k5u s ALA 133 Ca 0.41 0.02 -0.23 0.00 0.00 0.00 0.00 51.96 52.16 2k5u s ALA 133 Cb 0.35 -2.71 -0.10 0.00 0.00 0.00 0.00 23.12 20.67 2k5u s ALA 133 CO 0.06 0.37 1.00 -1.64 0.00 0.00 0.00 175.76 175.55 2k5u s MET 134 N -2.50 4.17 0.52 0.00 -1.94 -0.32 -5.01 119.30 114.23 2k5u s MET 134 Ca 0.47 1.34 -0.16 0.00 -1.71 0.00 0.00 55.69 55.63 2k5u s MET 134 Cb -0.13 -2.38 -0.07 0.00 2.01 0.00 0.00 34.83 34.26 2k5u s MET 134 CO 0.19 -0.11 0.98 0.45 -0.01 0.00 0.00 175.02 176.52 2k5u s SER 135 N -1.84 6.57 0.47 3.03 0.15 -1.26 -4.85 113.70 115.96 2k5u s SER 135 Ca 0.60 1.53 0.15 0.00 0.70 0.00 0.00 55.95 58.93 2k5u s SER 135 Cb -0.16 -2.50 1.12 0.00 -1.71 0.00 0.00 66.02 62.77 2k5u s SER 135 CO 0.21 -0.61 2.04 0.00 1.20 0.00 0.00 173.24 176.07 2k5u h ALA 136 N 0.77 2.04 0.02 5.45 0.00 -1.96 0.39 119.26 125.97 2k5u h ALA 136 Ca -0.46 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.43 2k5u h ALA 136 Cb 1.19 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2k5u h ALA 136 CO 0.62 -0.13 -0.01 0.00 0.00 0.00 0.00 179.25 179.73 2k5u h ALA 137 N 1.78 -0.02 -0.12 0.00 0.00 -1.96 0.37 119.26 119.31 2k5u h ALA 137 Ca 0.19 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.77 2k5u h ALA 137 Cb 0.39 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2k5u h ALA 137 CO -0.04 -0.29 -0.43 1.49 0.00 0.00 0.00 179.25 179.98 2k5u h GLU 138 N -0.46 0.28 -0.12 0.00 4.81 -1.82 -2.66 114.58 114.61 2k5u h GLU 138 Ca -0.00 -0.14 -0.04 0.00 -0.13 0.00 0.00 59.36 59.05 2k5u h GLU 138 Cb 0.44 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.82 2k5u h GLU 138 CO 0.00 0.66 -0.09 0.82 -0.73 0.00 0.00 179.01 179.67 2k5u h ILE 139 N 0.23 1.34 -0.85 2.32 2.04 -0.18 -2.24 117.51 120.18 2k5u h ILE 139 Ca 0.02 -1.20 0.05 0.00 1.00 0.00 0.00 64.86 64.72 2k5u h ILE 139 Cb 0.85 1.89 -0.05 0.00 -0.74 0.00 0.00 36.82 38.77 2k5u h ILE 139 CO 0.07 0.35 0.55 0.00 0.00 0.00 0.00 178.15 179.12 2k5u h THR 140 N -0.12 1.10 0.00 -0.27 1.03 -0.17 -0.07 112.91 114.42 2k5u h THR 140 Ca 0.02 -0.34 -0.11 0.00 -0.01 0.00 0.00 66.41 65.96 2k5u h THR 140 Cb 0.59 0.01 -0.02 0.00 -1.07 0.00 0.00 68.15 67.67 2k5u h THR 140 CO 0.02 0.18 -0.54 -0.33 -0.01 0.00 0.00 175.52 174.85 2k5u h GLU 141 N 1.00 0.00 -0.32 0.00 5.08 -1.45 0.55 114.58 119.44 2k5u h GLU 141 Ca 0.35 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.56 2k5u h GLU 141 Cb 0.11 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 2k5u h GLU 141 CO -0.11 0.54 -0.40 -0.22 -1.00 0.00 0.00 179.01 177.81 2k5u h LYS 142 N 0.00 0.78 -0.08 2.33 1.63 -0.42 -2.77 116.57 118.04 2k5u h LYS 142 Ca -0.01 -0.41 0.00 0.00 -0.85 0.00 0.00 60.65 59.39 2k5u h LYS 142 Cb 0.99 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.63 2k5u h LYS 142 CO 0.07 1.04 0.00 1.28 -3.45 0.00 0.00 179.45 178.39 2k5u n LEU 143 N -4.04 0.74 -1.17 5.20 4.77 -0.52 -4.88 117.00 117.10 2k5u n LEU 143 Ca -0.02 -0.31 -0.12 0.00 -0.03 0.00 0.00 56.01 55.53 2k5u n LEU 143 Cb 0.54 -0.05 -0.02 0.00 -2.33 0.00 0.00 43.42 41.56 2k5u n LEU 143 CO 0.47 0.16 -0.14 0.61 -1.33 0.00 0.00 177.39 177.16 2k5u n GLY 144 N 0.93 0.43 0.27 -0.72 0.00 -1.05 -4.87 105.19 100.19 2k5u n GLY 144 Ca 0.14 -0.43 0.13 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.52 0.99 6.46 -1.12 -0.09 115.31 121.02 2k5u h LEU 145 Ca -0.27 0.00 -0.06 0.00 -0.12 0.00 0.00 57.88 57.43 2k5u h LEU 145 Cb 1.04 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.96 2k5u h LEU 145 CO 0.34 0.11 -0.30 -0.74 -0.62 0.00 0.00 178.44 177.22 2k5u h HIS 146 N 0.00 0.00 0.00 1.25 2.76 -1.87 -3.02 115.15 114.27 2k5u h HIS 146 Ca -0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 2k5u h HIS 146 Cb 0.29 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.25 2k5u h HIS 146 CO 0.00 0.30 0.00 0.45 -1.30 0.00 0.00 177.93 177.38 2k5u n SER 147 N -3.28 0.00 -4.87 3.26 2.88 -0.05 -4.79 113.62 106.76 2k5u n SER 147 Ca 0.01 0.10 -0.35 0.00 -1.33 0.00 0.00 58.87 57.30 2k5u n SER 147 Cb 0.56 -0.36 -0.06 0.00 -0.75 0.00 0.00 64.21 63.61 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 -2.72 5.34 0.30 2.46 2.07 -1.14 -5.04 121.20 122.47 2k5u s ILE 148 Ca 0.22 -0.05 -0.26 0.00 -1.41 0.00 0.00 60.65 59.15 2k5u s ILE 148 Cb 0.18 -3.42 -0.15 0.00 0.13 0.00 0.00 42.46 39.20 2k5u s ILE 148 CO 0.45 0.45 0.63 -2.11 -1.91 0.00 0.00 174.94 172.45 2k5u n ARG 149 N 1.41 0.53 -2.62 3.50 1.85 -1.26 -4.87 116.66 115.19 2k5u n ARG 149 Ca -0.15 0.19 -0.41 0.00 -1.00 0.00 0.00 57.85 56.48 2k5u n ARG 149 Cb 0.54 -1.37 -0.05 0.00 -1.05 0.00 0.00 32.46 30.53 2k5u n ARG 149 CO 0.00 0.00 0.00 -0.80 -0.01 0.00 0.00 177.63 176.82 2k5u s ASN 150 N -0.86 7.41 0.00 2.89 -0.87 -1.26 -3.93 114.94 118.33 2k5u s ASN 150 Ca 0.62 1.99 0.00 0.00 -1.57 0.00 0.00 52.86 53.90 2k5u s ASN 150 Cb -0.76 -2.60 0.00 0.00 -0.02 0.00 0.00 41.25 37.87 2k5u s ASN 150 CO 0.58 -0.09 0.00 -1.14 -2.57 0.00 0.00 177.10 173.88 2k5u n ARG 151 N 2.19 0.00 -0.11 -0.60 3.00 -1.26 -4.99 116.66 114.89 2k5u n ARG 151 Ca 0.01 0.00 -0.12 0.00 -0.00 0.00 0.00 57.85 57.74 2k5u n ARG 151 Cb 0.47 0.00 -0.09 0.00 0.00 0.00 0.00 32.46 32.84 2k5u n ARG 151 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.63 176.28 2k5u h PRO 152 N 0.00 -0.35 -4.96 -0.14 0.11 -1.94 -3.45 132.00 121.26 2k5u h PRO 152 Ca 0.00 0.02 -0.37 0.00 0.11 0.00 0.00 66.00 65.76 2k5u h PRO 152 Cb 0.00 0.08 -0.14 0.00 0.11 0.00 0.00 31.00 31.05 2k5u h PRO 152 CO 0.00 -0.23 -0.62 1.67 -0.21 0.00 0.00 178.00 178.61 2k5u s TRP 153 N -5.28 1.62 0.20 0.65 -2.14 -1.25 -2.84 118.94 109.89 2k5u s TRP 153 Ca -0.12 -1.12 0.07 0.00 2.66 0.00 0.00 56.10 57.59 2k5u s TRP 153 Cb 0.07 -0.97 -0.05 0.00 -3.10 0.00 0.00 33.47 29.42 2k5u s TRP 153 CO 0.53 -0.24 -0.14 -0.06 -2.66 0.00 0.00 176.95 174.38 2k5u s PHE 154 N -3.64 1.63 0.00 1.66 0.08 -1.10 -4.99 117.98 111.62 2k5u s PHE 154 Ca 0.37 -0.61 0.08 0.00 0.12 0.00 0.00 56.93 56.89 2k5u s PHE 154 Cb 0.08 -0.77 -0.02 0.00 -0.57 0.00 0.00 43.02 41.74 2k5u s PHE 154 CO 0.13 0.31 -0.25 -1.50 -0.10 0.00 0.00 175.22 173.82 2k5u s ILE 155 N -3.03 1.96 -0.15 0.64 1.10 -1.26 -0.41 121.20 120.05 2k5u s ILE 155 Ca 0.22 -1.14 -0.09 0.00 -0.51 0.00 0.00 60.65 59.13 2k5u s ILE 155 Cb -0.00 -1.65 0.05 0.00 0.15 0.00 0.00 42.46 41.01 2k5u s ILE 155 CO 0.06 0.48 0.37 -1.58 -2.11 0.00 0.00 174.94 172.16 2k5u s GLN 156 N -0.77 0.36 0.13 3.50 -0.44 -0.95 -4.99 119.66 116.49 2k5u s GLN 156 Ca 0.10 0.67 -0.22 0.00 -2.50 0.00 0.00 55.36 53.41 2k5u s GLN 156 Cb -0.10 0.00 -0.07 0.00 -1.64 0.00 0.00 33.01 31.20 2k5u s GLN 156 CO -0.00 -0.14 0.68 0.00 0.50 0.00 0.00 175.29 176.33 2k5u s ALA 157 N 1.11 3.51 0.29 1.58 0.00 -1.26 -1.95 121.76 125.04 2k5u s ALA 157 Ca -0.07 0.20 -0.08 0.00 0.00 0.00 0.00 51.96 52.00 2k5u s ALA 157 Cb -0.08 -2.80 -0.00 0.00 0.00 0.00 0.00 23.12 20.24 2k5u s ALA 157 CO -0.09 0.34 0.46 0.95 0.00 0.00 0.00 175.76 177.43 2k5u s THR 158 N -1.17 0.00 -0.21 0.00 -4.23 -0.47 -4.74 115.64 104.83 2k5u s THR 158 Ca 0.34 -1.51 -0.02 0.00 -1.18 0.00 0.00 61.69 59.31 2k5u s THR 158 Cb -0.21 -2.45 0.06 0.00 1.34 0.00 0.00 72.50 71.25 2k5u s THR 158 CO 0.23 0.00 0.02 0.00 -0.54 0.00 0.00 174.62 174.33 2k5u h ALA 160 N 8.19 1.68 0.17 0.00 0.00 -1.90 -1.60 119.26 125.79 2k5u h ALA 160 Ca -0.16 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 2k5u h ALA 160 Cb 1.11 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2k5u h ALA 160 CO 0.35 0.08 -0.08 1.79 0.00 0.00 0.00 179.25 181.40 2k5u h THR 161 N 0.00 0.79 0.00 0.00 1.35 -1.96 -3.32 112.91 109.78 2k5u h THR 161 Ca -0.00 -1.11 0.00 0.00 -0.55 0.00 0.00 66.41 64.75 2k5u h THR 161 Cb 0.14 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 67.89 2k5u h THR 161 CO 0.01 0.21 -0.13 -0.24 -0.25 0.00 0.00 175.52 175.11 2k5u n SER 162 N -4.93 0.23 0.00 5.36 2.88 -1.23 -4.90 113.62 111.03 2k5u n SER 162 Ca -0.07 0.33 0.00 0.00 -1.33 0.00 0.00 58.87 57.80 2k5u n SER 162 Cb 0.26 -0.34 0.00 0.00 -0.75 0.00 0.00 64.21 63.37 2k5u n SER 162 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2k5u n GLY 163 N 1.47 0.68 3.64 0.46 0.00 -0.61 -4.97 105.19 105.86 2k5u n GLY 163 Ca 0.06 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 -0.25 3.96 0.00 1.61 2.56 -1.19 -2.56 118.70 122.83 2k5u s GLU 164 Ca 0.00 1.47 0.00 0.00 0.00 0.00 0.00 54.97 56.44 2k5u s GLU 164 Cb 0.00 -3.90 0.00 0.00 2.00 0.00 0.00 34.13 32.23 2k5u s GLU 164 CO 0.00 -1.07 0.00 0.41 -0.56 0.00 0.00 175.26 174.04 2k5u n GLY 165 N 4.26 3.15 0.15 -1.50 0.00 -1.26 -1.32 105.19 108.67 2k5u n GLY 165 Ca 0.16 0.00 -0.13 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 0.46 -0.11 0.99 3.38 -1.78 -1.18 115.31 117.07 2k5u h LEU 166 Ca 0.00 -0.45 -0.02 0.00 0.09 0.00 0.00 57.88 57.51 2k5u h LEU 166 Cb 0.00 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 2k5u h LEU 166 CO 0.00 0.81 0.01 1.88 0.09 0.00 0.00 178.44 181.23 2k5u h TYR 167 N 0.11 0.20 0.00 1.13 -1.99 -1.91 -2.51 116.97 112.00 2k5u h TYR 167 Ca 0.04 -0.03 -0.04 0.00 2.00 0.00 0.00 58.73 60.69 2k5u h TYR 167 Cb 0.66 -0.05 -0.01 0.00 2.00 0.00 0.00 36.73 39.33 2k5u h TYR 167 CO 0.07 0.41 -0.19 1.49 -0.00 0.00 0.00 178.16 179.94 2k5u h GLU 168 N -0.06 0.00 -0.03 4.88 4.81 -1.90 -0.70 114.58 121.58 2k5u h GLU 168 Ca 0.03 0.00 -0.22 0.00 -0.13 0.00 0.00 59.36 59.04 2k5u h GLU 168 Cb 0.32 0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.72 2k5u h GLU 168 CO 0.00 0.19 -0.85 0.78 -0.73 0.00 0.00 179.01 178.41 2k5u h GLY 169 N 0.96 0.69 0.60 1.92 0.00 -1.05 -2.62 103.07 103.57 2k5u h GLY 169 Ca -0.00 -1.16 -0.10 0.00 0.00 0.00 0.00 47.33 46.06 2k5u h GLY 169 CO 0.02 1.03 -0.40 0.17 0.00 0.00 0.00 176.54 177.37 2k5u h LEU 170 N 0.25 0.36 -0.57 3.11 8.10 -1.33 -2.20 115.31 123.03 2k5u h LEU 170 Ca -0.10 -0.76 0.10 0.00 0.11 0.00 0.00 57.88 57.23 2k5u h LEU 170 Cb 1.52 -0.11 -0.08 0.00 -0.44 0.00 0.00 40.66 41.55 2k5u h LEU 170 CO 0.17 1.07 0.14 -0.33 -4.11 0.00 0.00 178.44 175.38 2k5u h GLU 171 N -0.32 0.27 -0.42 0.17 5.08 -1.24 0.40 114.58 118.52 2k5u h GLU 171 Ca -0.05 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.26 2k5u h GLU 171 Cb 1.13 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.30 2k5u h GLU 171 CO 0.08 0.18 0.12 -1.49 -1.00 0.00 0.00 179.01 176.90 2k5u h TRP 172 N 0.28 0.69 -0.66 4.33 4.06 -1.52 -2.64 115.95 120.48 2k5u h TRP 172 Ca 0.29 -0.07 -0.01 0.00 2.06 0.00 0.00 58.89 61.16 2k5u h TRP 172 Cb 0.41 -0.20 -0.03 0.00 -1.00 0.00 0.00 29.16 28.34 2k5u h TRP 172 CO -0.23 0.63 0.39 1.25 -3.56 0.00 0.00 178.44 176.93 2k5u h LEU 173 N 0.54 0.79 -0.73 -4.49 7.12 -0.56 -2.35 115.31 115.64 2k5u h LEU 173 Ca 0.14 -0.05 -0.01 0.00 0.13 0.00 0.00 57.88 58.09 2k5u h LEU 173 Cb 0.28 -0.20 -0.03 0.00 -0.53 0.00 0.00 40.66 40.17 2k5u h LEU 173 CO -0.00 0.62 0.43 0.28 -0.13 0.00 0.00 178.44 179.64 2k5u h SER 174 N 0.91 0.88 -0.53 1.25 0.02 0.09 -2.54 113.55 113.62 2k5u h SER 174 Ca 0.24 -0.07 0.01 0.00 -0.84 0.00 0.00 61.79 61.13 2k5u h SER 174 Cb -0.02 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.27 2k5u h SER 174 CO -0.04 0.69 0.34 0.78 -1.14 0.00 0.00 176.83 177.46 2k5u h ASN 175 N 0.99 0.59 -0.25 3.07 4.21 -1.14 0.66 115.58 123.72 2k5u h ASN 175 Ca 0.26 -0.01 0.01 0.00 1.21 0.00 0.00 56.30 57.77 2k5u h ASN 175 Cb -0.03 -0.14 -0.01 0.00 -1.12 0.00 0.00 38.32 37.02 2k5u h ASN 175 CO -0.05 0.43 0.17 0.28 -1.29 0.00 0.00 177.43 176.96 2k5u h SER 176 N 0.70 0.25 1.47 5.81 0.02 -1.29 0.60 113.55 121.10 2k5u h SER 176 Ca 0.20 -0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 61.04 2k5u h SER 176 Cb -0.07 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.40 2k5u h SER 176 CO -0.05 0.17 -0.54 -0.07 -1.14 0.00 0.00 176.83 175.20 2k5u h LEU 177 N 0.29 0.00 0.00 5.07 3.38 -0.90 -3.28 115.31 119.86 2k5u h LEU 177 Ca 0.10 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.89 2k5u h LEU 177 Cb 0.04 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 2k5u h LEU 177 CO -0.02 0.47 -1.31 0.11 0.09 0.00 0.00 178.44 177.78 2k5u h LYS 178 N 0.00 0.00 -1.01 1.13 1.57 0.87 -2.77 116.57 116.36 2k5u h LYS 178 Ca -0.02 0.00 -0.67 0.00 -1.87 0.00 0.00 60.65 58.09 2k5u h LYS 178 Cb 1.37 0.00 -0.29 0.00 0.08 0.00 0.00 32.23 33.39 2k5u h LYS 178 CO 0.06 0.35 0.87 -1.71 -0.57 0.00 0.00 179.45 178.45 2k5u n ASN 179 N -2.96 7.65 0.00 0.86 2.85 0.19 -4.69 115.26 119.16 2k5u n ASN 179 Ca -0.08 -3.78 0.00 0.00 -0.11 0.00 0.00 54.58 50.61 2k5u n ASN 179 Cb 0.85 -0.98 0.00 0.00 1.24 0.00 0.00 39.78 40.89 2k5u n ASN 179 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 2k5u n SER 180 N -0.90 0.00 0.00 1.20 3.41 -1.25 -4.96 113.62 111.12 2k5u n SER 180 Ca 0.62 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.23 2k5u n SER 180 Cb 0.67 0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.66 2k5u n SER 180 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29