#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 -6.05 -4.72 0.99 4.77 -1.26 -4.88 117.00 105.85 2k5u n LEU 3 Ca 0.00 2.99 -0.42 0.00 -0.03 0.00 0.00 56.01 58.55 2k5u n LEU 3 Cb 0.00 -3.08 -0.03 0.00 -2.33 0.00 0.00 43.42 37.98 2k5u n LEU 3 CO 0.00 -2.02 0.89 -0.36 -1.33 0.00 0.00 177.39 174.57 2k5u s PHE 4 N -0.51 3.44 0.35 -1.77 0.40 -1.26 -4.83 117.98 113.79 2k5u s PHE 4 Ca 0.00 1.33 0.00 0.00 -0.60 0.00 0.00 56.93 57.66 2k5u s PHE 4 Cb 0.00 -3.43 0.00 0.00 0.51 0.00 0.00 43.02 40.10 2k5u s PHE 4 CO 0.00 -1.28 0.00 0.00 0.70 0.00 0.00 175.22 174.64 2k5u n ALA 5 N 3.52 -3.78 0.06 5.36 0.00 -1.26 -4.64 120.51 119.77 2k5u n ALA 5 Ca 0.08 0.47 -0.03 0.00 0.00 0.00 0.00 53.44 53.96 2k5u n ALA 5 Cb 0.46 -1.31 -0.02 0.00 0.00 0.00 0.00 19.45 18.58 2k5u n ALA 5 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2k5u h SER 6 N -1.35 -0.18 -4.96 0.00 4.64 -1.88 -3.47 113.55 106.34 2k5u h SER 6 Ca 0.02 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2k5u h SER 6 Cb 1.34 0.05 -0.05 0.00 -0.31 0.00 0.00 62.40 63.43 2k5u h SER 6 CO 0.01 0.16 -1.15 0.29 -0.87 0.00 0.00 176.83 175.27 2k5u n LYS 7 N -4.24 -3.71 -3.24 4.77 5.02 -1.26 -3.93 118.16 111.57 2k5u n LYS 7 Ca -0.03 2.91 -0.23 0.00 -2.02 0.00 0.00 58.31 58.95 2k5u n LYS 7 Cb 0.09 -5.06 0.05 0.00 -0.02 0.00 0.00 35.03 30.09 2k5u n LYS 7 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2k5u n LEU 8 N 1.01 -2.97 -1.81 -0.35 4.32 -1.26 -4.50 117.00 111.43 2k5u n LEU 8 Ca -0.15 -0.38 0.00 0.00 -0.02 0.00 0.00 56.01 55.46 2k5u n LEU 8 Cb 0.23 -2.99 0.00 0.00 -1.62 0.00 0.00 43.42 39.04 2k5u n LEU 8 CO 0.41 0.40 -0.44 0.49 -1.22 0.00 0.00 177.39 177.03 2k5u n PHE 9 N -4.71 -4.51 -3.09 -1.77 3.01 -1.26 -5.06 117.46 100.08 2k5u n PHE 9 Ca -0.07 2.50 0.02 0.00 1.01 0.00 0.00 57.45 60.92 2k5u n PHE 9 Cb 0.60 -3.54 -0.00 0.00 -0.01 0.00 0.00 39.48 36.52 2k5u n PHE 9 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 2k5u s SER 10 N -1.32 -1.16 -0.32 4.37 0.01 -1.25 -5.02 113.70 109.00 2k5u s SER 10 Ca 0.00 -0.36 0.15 0.00 1.31 0.00 0.00 55.95 57.05 2k5u s SER 10 Cb 0.00 1.55 0.42 0.00 0.21 0.00 0.00 66.02 68.21 2k5u s SER 10 CO 0.00 -0.15 1.48 -0.46 0.41 0.00 0.00 173.24 174.51 2k5u n ASN 11 N 4.52 -0.98 -2.98 2.44 0.23 -1.26 -4.83 115.26 112.40 2k5u n ASN 11 Ca 0.08 -2.19 -0.01 0.00 -0.53 0.00 0.00 54.58 51.94 2k5u n ASN 11 Cb 0.58 0.50 -0.01 0.00 -2.08 0.00 0.00 39.78 38.77 2k5u n ASN 11 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 2k5u n LEU 12 N -1.39 -5.19 0.05 -4.53 4.32 -1.26 -4.91 117.00 104.08 2k5u n LEU 12 Ca -0.14 1.02 -0.21 0.00 -0.02 0.00 0.00 56.01 56.67 2k5u n LEU 12 Cb 0.87 -2.20 -0.12 0.00 -1.62 0.00 0.00 43.42 40.35 2k5u n LEU 12 CO -0.12 -2.51 0.05 2.19 -1.22 0.00 0.00 177.39 175.78 2k5u h PHE 13 N 3.88 0.97 -3.18 -1.77 -5.15 -2.00 -3.41 116.94 106.28 2k5u h PHE 13 Ca -0.08 -0.56 -0.75 0.00 -0.20 0.00 0.00 57.97 56.39 2k5u h PHE 13 Cb 0.58 -0.10 -0.23 0.00 0.22 0.00 0.00 35.95 36.42 2k5u h PHE 13 CO 0.00 1.40 -0.26 0.20 -2.00 0.00 0.00 178.31 177.65 2k5u s GLY 14 N -4.32 2.06 -0.84 6.09 0.00 -1.26 -4.98 107.32 104.08 2k5u s GLY 14 Ca -0.10 -2.35 0.01 0.00 0.00 0.00 0.00 44.72 42.28 2k5u s GLY 14 CO 0.91 1.15 1.00 0.70 0.00 0.00 0.00 173.10 176.86 2k5u n ASN 15 N 5.26 4.75 -2.69 1.64 3.02 -1.26 -4.93 115.26 121.04 2k5u n ASN 15 Ca -0.13 -3.38 -0.26 0.00 -0.03 0.00 0.00 54.58 50.77 2k5u n ASN 15 Cb 0.42 -0.94 -0.09 0.00 -0.61 0.00 0.00 39.78 38.55 2k5u n ASN 15 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 2k5u n LYS 16 N 1.27 2.92 -2.24 3.52 3.00 -1.26 -4.79 118.16 120.58 2k5u n LYS 16 Ca 0.27 -1.70 0.00 0.00 -0.00 0.00 0.00 58.31 56.88 2k5u n LYS 16 Cb 0.37 -2.41 0.00 0.00 0.00 0.00 0.00 35.03 33.00 2k5u n LYS 16 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2k5u n GLU 17 N 2.93 -4.84 -3.67 1.64 4.71 -1.26 -5.05 120.64 115.11 2k5u n GLU 17 Ca 0.61 3.54 -0.20 0.00 -0.01 0.00 0.00 57.16 61.10 2k5u n GLU 17 Cb 0.56 -4.41 -0.18 0.00 -1.01 0.00 0.00 31.44 26.40 2k5u n GLU 17 CO 0.00 0.00 0.00 -1.64 0.09 0.00 0.00 177.13 175.58 2k5u s MET 18 N -0.73 -0.07 -0.33 3.49 -1.94 -1.26 -4.85 119.30 113.61 2k5u s MET 18 Ca 0.00 0.35 0.00 0.00 -1.71 0.00 0.00 55.69 54.33 2k5u s MET 18 Cb 0.00 -0.59 0.14 0.00 2.01 0.00 0.00 34.83 36.38 2k5u s MET 18 CO 0.00 -0.35 0.27 1.03 -0.01 0.00 0.00 175.02 175.96 2k5u s ARG 19 N 2.17 0.44 0.38 2.03 3.00 -1.26 -2.81 118.95 122.91 2k5u s ARG 19 Ca 0.05 -0.67 -0.23 0.00 0.00 0.00 0.00 55.73 54.88 2k5u s ARG 19 Cb -0.12 -0.89 -0.10 0.00 0.00 0.00 0.00 34.95 33.83 2k5u s ARG 19 CO -0.03 -1.12 0.95 0.42 0.00 0.00 0.00 175.30 175.52 2k5u s ILE 20 N 1.77 4.26 0.02 1.52 1.09 -0.47 0.19 121.20 129.58 2k5u s ILE 20 Ca 0.13 1.62 0.05 0.00 -1.10 0.00 0.00 60.65 61.35 2k5u s ILE 20 Cb -0.17 -3.78 -0.02 0.00 -1.06 0.00 0.00 42.46 37.44 2k5u s ILE 20 CO -0.18 -0.10 -0.15 -0.22 -0.10 0.00 0.00 174.94 174.19 2k5u s LEU 21 N -2.68 2.11 -0.41 2.97 2.96 -0.73 -2.67 118.68 120.24 2k5u s LEU 21 Ca 0.57 -0.38 -0.14 0.00 -0.22 0.00 0.00 54.13 53.96 2k5u s LEU 21 Cb -0.14 -0.69 0.03 0.00 0.50 0.00 0.00 46.19 45.89 2k5u s LEU 21 CO 0.18 0.10 0.29 -0.32 -1.32 0.00 0.00 176.35 175.29 2k5u s MET 22 N -0.81 2.90 0.13 1.98 1.75 0.88 -2.07 119.30 124.07 2k5u s MET 22 Ca 0.04 -1.12 0.08 0.00 -1.25 0.00 0.00 55.69 53.43 2k5u s MET 22 Cb -0.07 -3.92 -0.04 0.00 2.84 0.00 0.00 34.83 33.64 2k5u s MET 22 CO 0.01 -0.80 -0.18 0.08 -0.65 0.00 0.00 175.02 173.47 2k5u s VAL 23 N 1.62 1.69 -5.00 10.11 1.01 -1.12 -1.43 120.40 127.28 2k5u s VAL 23 Ca 0.04 -1.74 0.00 0.00 0.00 0.00 0.00 61.98 60.28 2k5u s VAL 23 Cb -0.20 -1.67 0.00 0.00 0.00 0.00 0.00 36.38 34.51 2k5u s VAL 23 CO 0.08 -0.24 0.00 0.61 0.00 0.00 0.00 175.10 175.55 2k5u n GLY 24 N 0.64 0.21 3.77 4.51 0.00 -1.26 -2.71 105.19 110.35 2k5u n GLY 24 Ca -0.16 -1.57 -0.41 0.00 0.00 0.00 0.00 46.02 43.89 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 4.43 0.66 0.99 2.96 -1.25 0.49 118.68 126.96 2k5u s LEU 25 Ca 0.00 2.69 -0.17 0.00 -0.22 0.00 0.00 54.13 56.43 2k5u s LEU 25 Cb 0.00 -3.65 0.00 0.00 0.50 0.00 0.00 46.19 43.04 2k5u s LEU 25 CO 0.00 -0.54 1.21 1.51 -1.32 0.00 0.00 176.35 177.21 2k5u s ASP 26 N -0.48 4.72 0.00 3.68 -4.77 -1.26 -2.41 116.67 116.15 2k5u s ASP 26 Ca 0.49 2.36 0.00 0.00 -3.30 0.00 0.00 52.55 52.10 2k5u s ASP 26 Cb -0.40 -2.59 0.00 0.00 -1.09 0.00 0.00 42.92 38.84 2k5u s ASP 26 CO 0.53 -1.91 0.00 0.61 0.70 0.00 0.00 175.17 175.10 2k5u n GLY 27 N 0.39 0.00 0.27 2.12 0.00 -1.26 -4.79 105.19 101.92 2k5u n GLY 27 Ca 0.13 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.25 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 2.03 0.00 4.61 0.00 -1.82 -3.44 119.26 120.64 2k5u h ALA 28 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2k5u h ALA 28 Cb 0.75 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2k5u h ALA 28 CO 0.00 -0.06 0.00 0.41 0.00 0.00 0.00 179.25 179.60 2k5u n GLY 29 N -1.54 0.08 0.11 0.00 0.00 -1.26 -4.44 105.19 98.14 2k5u n GLY 29 Ca -0.02 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.85 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 0.25 -0.88 1.61 6.56 -1.92 -2.72 116.57 119.48 2k5u h LYS 30 Ca 0.00 -0.22 0.07 0.00 -1.06 0.00 0.00 60.65 59.44 2k5u h LYS 30 Cb 0.00 0.05 -0.07 0.00 -0.57 0.00 0.00 32.23 31.65 2k5u h LYS 30 CO 0.00 0.90 0.54 1.15 -2.06 0.00 0.00 179.45 179.98 2k5u h THR 31 N -0.31 1.02 0.05 -0.16 2.02 -1.97 0.47 112.91 114.02 2k5u h THR 31 Ca -0.02 -0.33 -0.00 0.00 0.77 0.00 0.00 66.41 66.82 2k5u h THR 31 Cb 0.97 -0.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.34 2k5u h THR 31 CO 0.06 0.18 -0.02 0.74 0.37 0.00 0.00 175.52 176.84 2k5u h THR 32 N 0.97 1.16 -0.37 3.16 2.02 -1.99 -2.84 112.91 115.02 2k5u h THR 32 Ca 0.39 -0.68 -0.07 0.00 0.77 0.00 0.00 66.41 66.82 2k5u h THR 32 Cb 0.22 1.61 -0.02 0.00 -1.74 0.00 0.00 68.15 68.22 2k5u h THR 32 CO -0.19 0.17 -0.07 1.62 0.37 0.00 0.00 175.52 177.42 2k5u h VAL 33 N -0.36 1.23 -0.24 3.16 3.04 -1.16 -2.90 116.25 119.01 2k5u h VAL 33 Ca -0.01 -1.01 0.05 0.00 -1.01 0.00 0.00 66.70 64.72 2k5u h VAL 33 Cb 0.33 1.03 -0.05 0.00 -2.01 0.00 0.00 31.29 30.59 2k5u h VAL 33 CO 0.01 0.34 -0.08 0.25 -1.01 0.00 0.00 177.57 177.08 2k5u h LEU 34 N 0.58 -0.29 -0.97 3.16 6.46 0.00 -1.47 115.31 122.79 2k5u h LEU 34 Ca 0.11 0.08 0.02 0.00 -0.12 0.00 0.00 57.88 57.97 2k5u h LEU 34 Cb 0.48 0.18 -0.05 0.00 -0.73 0.00 0.00 40.66 40.53 2k5u h LEU 34 CO 0.03 -0.11 0.64 1.88 -0.62 0.00 0.00 178.44 180.26 2k5u h TYR 35 N -0.03 1.21 -0.46 1.25 0.05 -1.35 0.14 116.97 117.77 2k5u h TYR 35 Ca 0.12 0.03 0.12 0.00 0.05 0.00 0.00 58.73 59.05 2k5u h TYR 35 Cb 0.22 -0.41 -0.02 0.00 1.01 0.00 0.00 36.73 37.53 2k5u h TYR 35 CO -0.27 0.73 0.32 -0.22 -1.05 0.00 0.00 178.16 177.68 2k5u h LYS 36 N 1.28 0.05 0.06 4.88 1.63 -1.09 -0.35 116.57 123.04 2k5u h LYS 36 Ca 0.37 -0.00 -0.30 0.00 -0.85 0.00 0.00 60.65 59.87 2k5u h LYS 36 Cb -0.09 -0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 31.50 2k5u h LYS 36 CO -0.10 0.03 -1.60 -0.07 -3.45 0.00 0.00 179.45 174.26 2k5u h LEU 37 N 0.05 0.20 0.00 5.20 3.38 -0.70 -3.47 115.31 119.97 2k5u h LEU 37 Ca 0.22 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2k5u h LEU 37 Cb 0.79 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.48 2k5u h LEU 37 CO -0.01 1.29 0.00 0.29 0.09 0.00 0.00 178.44 180.10 2k5u n LYS 38 N -3.29 0.00 -0.68 1.13 5.02 -0.09 -4.69 118.16 115.56 2k5u n LYS 38 Ca -0.17 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.12 2k5u n LYS 38 Cb 1.03 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 36.04 2k5u n LYS 38 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2k5u n LEU 39 N 0.00 0.57 0.00 -0.35 4.77 -1.26 -4.29 117.00 116.43 2k5u n LEU 39 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2k5u n LEU 39 Cb 0.00 -0.86 0.00 0.00 -2.33 0.00 0.00 43.42 40.23 2k5u n LEU 39 CO 0.00 -0.28 0.00 0.61 -1.33 0.00 0.00 177.39 176.39 2k5u n GLY 40 N -2.00 1.29 3.00 -0.72 0.00 -1.26 -4.94 105.19 100.56 2k5u n GLY 40 Ca 0.00 -0.75 -0.13 0.00 0.00 0.00 0.00 46.02 45.14 2k5u n GLY 40 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2k5u s GLU 41 N 0.00 0.16 -0.11 1.61 -1.05 -1.26 -5.15 118.70 112.89 2k5u s GLU 41 Ca 0.00 0.46 -0.07 0.00 -0.15 0.00 0.00 54.97 55.21 2k5u s GLU 41 Cb 0.00 -0.14 -0.04 0.00 -0.44 0.00 0.00 34.13 33.51 2k5u s GLU 41 CO 0.00 -0.16 0.15 0.08 0.95 0.00 0.00 175.26 176.28 2k5u s VAL 42 N 1.19 5.49 -0.01 1.83 1.01 -1.26 -4.89 120.40 123.76 2k5u s VAL 42 Ca -0.09 0.22 -0.19 0.00 0.00 0.00 0.00 61.98 61.92 2k5u s VAL 42 Cb -0.11 -3.41 -0.05 0.00 0.00 0.00 0.00 36.38 32.81 2k5u s VAL 42 CO -0.07 0.61 0.53 -0.63 0.00 0.00 0.00 175.10 175.54 2k5u s ILE 43 N -1.04 4.96 -0.13 2.22 -1.09 -1.12 -4.92 121.20 120.08 2k5u s ILE 43 Ca 0.16 1.10 -0.05 0.00 -2.23 0.00 0.00 60.65 59.62 2k5u s ILE 43 Cb -0.12 -3.86 -0.04 0.00 -1.58 0.00 0.00 42.46 36.86 2k5u s ILE 43 CO 0.05 0.46 0.07 -0.89 -1.23 0.00 0.00 174.94 173.39 2k5u s THR 44 N -0.36 4.87 -0.07 2.92 2.01 -1.26 -2.45 115.64 121.30 2k5u s THR 44 Ca 0.28 -0.02 -0.09 0.00 0.31 0.00 0.00 61.69 62.17 2k5u s THR 44 Cb -0.17 -3.13 0.02 0.00 0.01 0.00 0.00 72.50 69.23 2k5u s THR 44 CO 0.15 0.56 0.24 0.42 -0.69 0.00 0.00 174.62 175.30 2k5u s THR 45 N -0.50 0.02 -0.31 -0.82 -4.23 -0.11 -4.97 115.64 104.72 2k5u s THR 45 Ca 0.10 -0.16 -0.15 0.00 -1.18 0.00 0.00 61.69 60.30 2k5u s THR 45 Cb -0.12 -0.40 -0.02 0.00 1.34 0.00 0.00 72.50 73.30 2k5u s THR 45 CO 0.02 -0.09 0.39 -0.63 -0.54 0.00 0.00 174.62 173.77 2k5u s ILE 46 N -0.27 5.15 0.14 2.99 1.09 -1.26 -0.07 121.20 128.96 2k5u s ILE 46 Ca -0.04 0.34 -0.09 0.00 -1.10 0.00 0.00 60.65 59.76 2k5u s ILE 46 Cb -0.03 -3.78 -0.10 0.00 -1.06 0.00 0.00 42.46 37.49 2k5u s ILE 46 CO 0.01 0.01 1.41 1.55 -0.10 0.00 0.00 174.94 177.82 2k5u h PRO 47 N 8.32 0.76 -1.86 2.79 0.13 -1.94 -3.48 132.00 136.73 2k5u h PRO 47 Ca -0.30 -0.52 0.08 0.00 -0.87 0.00 0.00 66.00 64.39 2k5u h PRO 47 Cb 1.15 0.08 -0.20 0.00 0.13 0.00 0.00 31.00 32.16 2k5u h PRO 47 CO 0.68 1.14 0.50 -0.08 -0.23 0.00 0.00 178.00 180.02 2k5u s THR 48 N -3.97 0.00 0.00 1.56 -1.32 -1.26 -5.05 115.64 105.59 2k5u s THR 48 Ca -0.09 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.39 2k5u s THR 48 Cb 0.10 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.09 2k5u s THR 48 CO 0.88 0.00 0.00 -0.38 -2.21 0.00 0.00 174.62 172.91 2k5u n ILE 49 N 0.37 0.00 -3.08 5.08 5.41 -1.26 -1.55 119.36 124.33 2k5u n ILE 49 Ca -0.10 0.00 -0.27 0.00 1.00 0.00 0.00 62.75 63.38 2k5u n ILE 49 Cb 0.59 0.00 -0.05 0.00 -0.71 0.00 0.00 39.64 39.47 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 5.31 3.42 7.39 0.00 -1.26 -5.05 105.19 115.00 2k5u n GLY 50 Ca 0.00 -2.73 -0.28 0.00 0.00 0.00 0.00 46.02 43.01 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 -3.16 2.35 -0.10 1.61 0.40 -0.60 -5.09 117.98 113.39 2k5u s PHE 51 Ca 0.46 -0.35 0.02 0.00 -0.60 0.00 0.00 56.93 56.46 2k5u s PHE 51 Cb 0.25 -1.22 0.01 0.00 0.51 0.00 0.00 43.02 42.57 2k5u s PHE 51 CO -0.10 0.41 -0.16 -0.80 0.70 0.00 0.00 175.22 175.27 2k5u s ASN 52 N -2.34 2.37 -0.03 1.36 -0.87 -1.26 -3.90 114.94 110.27 2k5u s ASN 52 Ca 0.18 -0.42 0.05 0.00 -1.57 0.00 0.00 52.86 51.10 2k5u s ASN 52 Cb -0.09 -1.07 -0.01 0.00 -0.02 0.00 0.00 41.25 40.06 2k5u s ASN 52 CO 0.08 0.04 -0.17 -0.69 -2.57 0.00 0.00 177.10 173.80 2k5u s VAL 53 N 0.81 1.37 0.06 1.60 1.01 0.89 -4.70 120.40 121.45 2k5u s VAL 53 Ca -0.10 -0.71 0.06 0.00 0.00 0.00 0.00 61.98 61.23 2k5u s VAL 53 Cb -0.16 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 2k5u s VAL 53 CO 0.01 0.39 -0.12 -1.61 0.00 0.00 0.00 175.10 173.78 2k5u s GLU 54 N -0.16 2.20 -0.10 2.72 0.41 -1.13 -0.94 118.70 121.71 2k5u s GLU 54 Ca 0.01 -0.95 -0.05 0.00 -0.41 0.00 0.00 54.97 53.58 2k5u s GLU 54 Cb -0.09 -2.31 0.05 0.00 -1.78 0.00 0.00 34.13 29.99 2k5u s GLU 54 CO 0.01 0.54 0.22 -0.08 -0.49 0.00 0.00 175.26 175.45 2k5u s THR 55 N -1.08 -0.06 0.00 3.63 -1.32 -1.03 -2.32 115.64 113.47 2k5u s THR 55 Ca 0.18 0.17 0.05 0.00 -1.21 0.00 0.00 61.69 60.88 2k5u s THR 55 Cb -0.11 -0.34 -0.02 0.00 -1.51 0.00 0.00 72.50 70.52 2k5u s THR 55 CO 0.10 0.07 -0.16 -0.69 -2.21 0.00 0.00 174.62 171.72 2k5u s VAL 56 N 1.30 1.28 -0.24 5.08 1.01 0.57 -2.79 120.40 126.61 2k5u s VAL 56 Ca -0.09 -0.80 0.00 0.00 0.00 0.00 0.00 61.98 61.10 2k5u s VAL 56 Cb -0.11 -1.08 0.04 0.00 0.00 0.00 0.00 36.38 35.23 2k5u s VAL 56 CO -0.08 0.27 -0.10 -1.10 0.00 0.00 0.00 175.10 174.09 2k5u s GLN 57 N -0.61 2.64 -0.09 2.72 -0.21 -1.26 -2.03 119.66 120.82 2k5u s GLN 57 Ca 0.05 -1.09 -0.02 0.00 0.02 0.00 0.00 55.36 54.32 2k5u s GLN 57 Cb -0.07 -2.89 0.03 0.00 1.00 0.00 0.00 33.01 31.09 2k5u s GLN 57 CO 0.00 -0.44 0.01 -0.47 -2.12 0.00 0.00 175.29 172.28 2k5u s TYR 58 N 1.24 0.65 -1.50 0.91 5.04 -0.84 -4.86 117.35 117.98 2k5u s TYR 58 Ca -0.02 -0.24 -0.04 0.00 -2.44 0.00 0.00 57.07 54.33 2k5u s TYR 58 Cb -0.17 -0.80 0.04 0.00 0.35 0.00 0.00 41.96 41.37 2k5u s TYR 58 CO -0.06 -0.36 0.43 1.17 -1.34 0.00 0.00 175.55 175.38 2k5u n LYS 59 N 5.15 -2.81 0.00 4.97 4.81 -1.26 -0.98 118.16 128.04 2k5u n LYS 59 Ca -0.07 0.34 0.00 0.00 -0.87 0.00 0.00 58.31 57.71 2k5u n LYS 59 Cb 0.50 -4.49 0.00 0.00 0.02 0.00 0.00 35.03 31.06 2k5u n LYS 59 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2k5u n ASN 60 N -2.89 0.00 -4.66 3.14 4.13 -1.26 -4.96 115.26 108.76 2k5u n ASN 60 Ca -0.22 0.00 -0.46 0.00 1.68 0.00 0.00 54.58 55.58 2k5u n ASN 60 Cb 0.64 0.00 -0.03 0.00 -1.54 0.00 0.00 39.78 38.85 2k5u n ASN 60 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 2k5u n ILE 61 N 0.00 0.83 -4.10 2.41 5.41 -0.15 -4.95 119.36 118.81 2k5u n ILE 61 Ca 0.00 -0.21 -0.32 0.00 1.00 0.00 0.00 62.75 63.22 2k5u n ILE 61 Cb 0.00 -1.38 -0.07 0.00 -0.71 0.00 0.00 39.64 37.48 2k5u n ILE 61 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 2k5u s SER 62 N 0.31 5.63 -0.13 4.38 0.15 -1.12 -1.99 113.70 120.93 2k5u s SER 62 Ca 0.70 0.11 -0.04 0.00 0.70 0.00 0.00 55.95 57.42 2k5u s SER 62 Cb -0.69 -1.59 0.06 0.00 -1.71 0.00 0.00 66.02 62.09 2k5u s SER 62 CO 0.49 0.25 0.19 0.12 1.20 0.00 0.00 173.24 175.49 2k5u s PHE 63 N -1.23 -0.23 -0.02 3.44 2.19 -0.86 -1.37 117.98 119.89 2k5u s PHE 63 Ca 0.24 0.52 0.03 0.00 0.33 0.00 0.00 56.93 58.05 2k5u s PHE 63 Cb -0.12 -0.27 0.00 0.00 -1.31 0.00 0.00 43.02 41.32 2k5u s PHE 63 CO 0.16 -0.39 -0.10 0.99 1.83 0.00 0.00 175.22 177.71 2k5u s THR 64 N 2.32 0.83 0.02 0.12 2.01 -1.09 -0.31 115.64 119.54 2k5u s THR 64 Ca 0.04 -0.40 0.05 0.00 0.31 0.00 0.00 61.69 61.68 2k5u s THR 64 Cb -0.13 -0.73 -0.03 0.00 0.01 0.00 0.00 72.50 71.61 2k5u s THR 64 CO -0.08 0.25 -0.09 0.54 -0.69 0.00 0.00 174.62 174.55 2k5u s VAL 65 N 0.10 3.44 -0.26 3.82 0.11 -0.98 -0.08 120.40 126.55 2k5u s VAL 65 Ca -0.02 -0.92 -0.20 0.00 -2.93 0.00 0.00 61.98 57.91 2k5u s VAL 65 Cb -0.08 -2.50 0.07 0.00 -1.53 0.00 0.00 36.38 32.34 2k5u s VAL 65 CO 0.00 0.35 0.66 0.86 -3.33 0.00 0.00 175.10 173.64 2k5u s TRP 66 N -1.01 -0.83 0.09 1.54 -0.00 -0.51 -2.82 118.94 115.39 2k5u s TRP 66 Ca 0.17 1.87 -0.30 0.00 -0.00 0.00 0.00 56.10 57.84 2k5u s TRP 66 Cb -0.11 0.37 -0.06 0.00 -0.00 0.00 0.00 33.47 33.67 2k5u s TRP 66 CO 0.08 -0.41 1.13 -0.51 -0.00 0.00 0.00 176.95 177.24 2k5u s ASP 67 N 0.80 7.19 -0.01 5.86 1.01 -1.26 -4.21 116.67 126.05 2k5u s ASP 67 Ca -0.04 1.98 -0.00 0.00 0.71 0.00 0.00 52.55 55.21 2k5u s ASP 67 Cb -0.05 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.29 2k5u s ASP 67 CO -0.06 -0.35 0.01 1.33 0.21 0.00 0.00 175.17 176.31 2k5u n VAL 68 N 3.37 -0.05 0.16 -1.27 0.24 0.18 -4.77 118.33 116.19 2k5u n VAL 68 Ca 0.06 0.00 0.03 0.00 -2.04 0.00 0.00 64.34 62.40 2k5u n VAL 68 Cb 0.47 -0.05 0.19 0.00 -1.47 0.00 0.00 33.84 32.98 2k5u n VAL 68 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2k5u n GLY 69 N -0.31 2.09 1.22 7.63 0.00 -1.26 -4.47 105.19 110.09 2k5u n GLY 69 Ca -0.00 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.59 2k5u n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k5u n GLY 70 N 0.34 1.80 0.65 -0.02 0.00 -1.26 -2.65 105.19 104.05 2k5u n GLY 70 Ca 0.13 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.12 2k5u n GLY 70 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2k5u n GLN 71 N 0.97 0.00 0.26 1.61 6.02 -1.26 -4.88 117.38 120.10 2k5u n GLN 71 Ca 0.00 -0.39 0.12 0.00 -0.01 0.00 0.00 57.00 56.73 2k5u n GLN 71 Cb 0.40 0.23 0.69 0.00 1.02 0.00 0.00 30.24 32.58 2k5u n GLN 71 CO 0.00 0.00 0.00 0.38 -1.01 0.00 0.00 177.06 176.43 2k5u h ASP 72 N 0.00 0.00 -3.99 1.08 3.04 -1.85 -3.48 116.42 111.23 2k5u h ASP 72 Ca -0.22 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.57 2k5u h ASP 72 Cb 1.03 0.00 -0.06 0.00 -1.04 0.00 0.00 39.33 39.26 2k5u h ASP 72 CO -0.11 0.13 -0.77 0.54 -2.04 0.00 0.00 179.24 176.99 2k5u n ARG 73 N -3.63 -2.23 -1.68 4.15 1.74 -1.26 -4.84 116.66 108.90 2k5u n ARG 73 Ca -0.02 1.94 -0.53 0.00 -0.77 0.00 0.00 57.85 58.48 2k5u n ARG 73 Cb 0.26 -3.04 -0.06 0.00 -1.02 0.00 0.00 32.46 28.60 2k5u n ARG 73 CO 0.00 0.00 0.00 1.51 -1.52 0.00 0.00 177.63 177.62 2k5u n ILE 74 N 0.79 0.33 0.00 0.55 0.00 -1.26 -4.70 119.36 115.07 2k5u n ILE 74 Ca -0.19 -0.06 0.00 0.00 0.00 0.00 0.00 62.75 62.50 2k5u n ILE 74 Cb 0.30 -1.41 0.00 0.00 0.00 0.00 0.00 39.64 38.53 2k5u n ILE 74 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.55 175.41 2k5u n ARG 75 N 5.27 0.00 0.02 9.51 0.00 -1.26 -5.03 116.66 125.17 2k5u n ARG 75 Ca 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.08 2k5u n ARG 75 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.66 2k5u n ARG 75 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2k5u n SER 76 N -2.15 0.09 0.22 6.15 2.88 -1.26 -4.75 113.62 114.80 2k5u n SER 76 Ca 0.00 0.06 -0.17 0.00 -1.33 0.00 0.00 58.87 57.43 2k5u n SER 76 Cb 0.00 0.01 -0.09 0.00 -0.75 0.00 0.00 64.21 63.38 2k5u n SER 76 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 2k5u h LEU 77 N 0.00 -1.37 -1.63 2.46 5.85 -1.98 -1.44 115.31 117.19 2k5u h LEU 77 Ca 0.00 0.13 0.31 0.00 0.84 0.00 0.00 57.88 59.16 2k5u h LEU 77 Cb 0.00 0.48 -0.08 0.00 0.37 0.00 0.00 40.66 41.43 2k5u h LEU 77 CO 0.00 -0.60 0.75 -0.25 -0.34 0.00 0.00 178.44 178.01 2k5u h TRP 78 N -0.87 0.38 0.21 1.25 -0.00 -1.91 -1.09 115.95 113.91 2k5u h TRP 78 Ca -0.03 0.01 -0.01 0.00 -0.00 0.00 0.00 58.89 58.86 2k5u h TRP 78 Cb 0.80 -0.11 0.00 0.00 -0.00 0.00 0.00 29.16 29.85 2k5u h TRP 78 CO -0.32 0.02 -0.10 0.00 -0.00 0.00 0.00 178.44 178.04 2k5u h ARG 79 N 0.21 -0.27 -0.35 2.65 2.47 -1.59 -0.88 114.38 116.63 2k5u h ARG 79 Ca 0.59 0.02 0.05 0.00 -1.26 0.00 0.00 59.98 59.38 2k5u h ARG 79 Cb 1.88 0.06 -0.08 0.00 -1.65 0.00 0.00 29.97 30.18 2k5u h ARG 79 CO -0.18 0.11 -0.53 1.25 0.56 0.00 0.00 179.97 181.18 2k5u h HIS 80 N -0.74 -1.59 0.00 3.04 2.76 -0.34 0.35 115.15 118.64 2k5u h HIS 80 Ca -0.03 0.08 0.00 0.00 -2.20 0.00 0.00 60.37 58.22 2k5u h HIS 80 Cb 0.50 0.74 0.00 0.00 1.55 0.00 0.00 27.41 30.20 2k5u h HIS 80 CO 0.05 -0.49 0.00 -0.92 -1.30 0.00 0.00 177.93 175.27 2k5u h TYR 81 N -0.42 0.00 0.00 5.26 3.20 -1.58 -2.94 116.97 120.49 2k5u h TYR 81 Ca 0.08 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.95 2k5u h TYR 81 Cb 0.61 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.88 2k5u h TYR 81 CO -0.67 0.00 0.00 0.98 -1.64 0.00 0.00 178.16 176.83 2k5u n TYR 82 N -2.92 0.00 -0.24 -3.82 9.36 0.12 0.11 117.16 119.77 2k5u n TYR 82 Ca 0.00 0.00 -0.03 0.00 3.32 0.00 0.00 57.90 61.19 2k5u n TYR 82 Cb 0.24 -0.40 0.08 0.00 -0.63 0.00 0.00 39.34 38.64 2k5u n TYR 82 CO 0.00 0.00 0.00 0.07 0.22 0.00 0.00 176.86 177.15 2k5u h ARG 83 N 0.00 0.78 -0.97 2.98 0.11 -1.57 -2.40 114.38 113.30 2k5u h ARG 83 Ca 0.00 -0.05 0.07 0.00 0.10 0.00 0.00 59.98 60.10 2k5u h ARG 83 Cb 0.00 -0.18 -0.07 0.00 1.11 0.00 0.00 29.97 30.84 2k5u h ARG 83 CO 0.00 0.52 0.63 -0.97 0.10 0.00 0.00 179.97 180.25 2k5u h ASN 84 N 0.81 0.99 -2.87 0.08 -0.73 -1.43 -3.41 115.58 109.01 2k5u h ASN 84 Ca 0.28 0.01 -0.54 0.00 1.87 0.00 0.00 56.30 57.92 2k5u h ASN 84 Cb 0.06 -0.20 0.01 0.00 0.27 0.00 0.00 38.32 38.46 2k5u h ASN 84 CO -0.13 0.62 0.86 0.28 -0.37 0.00 0.00 177.43 178.69 2k5u s THR 85 N -5.98 3.53 0.00 -3.57 -1.32 0.31 -4.54 115.64 104.06 2k5u s THR 85 Ca -0.12 0.95 0.00 0.00 -1.21 0.00 0.00 61.69 61.31 2k5u s THR 85 Cb 0.20 -3.61 0.00 0.00 -1.51 0.00 0.00 72.50 67.58 2k5u s THR 85 CO 0.81 0.01 0.79 -0.62 -2.21 0.00 0.00 174.62 173.39 2k5u n GLU 86 N 5.26 1.64 -3.89 7.08 4.71 0.11 -4.84 120.64 130.70 2k5u n GLU 86 Ca 0.13 -1.10 -0.11 0.00 -0.01 0.00 0.00 57.16 56.08 2k5u n GLU 86 Cb 0.43 -0.92 -0.12 0.00 -1.01 0.00 0.00 31.44 29.82 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 -0.62 0.06 -0.18 0.62 0.00 0.51 -4.11 107.32 103.60 2k5u s GLY 87 Ca 0.00 -0.12 -0.04 0.00 0.00 0.00 0.00 44.72 44.57 2k5u s GLY 87 CO 0.00 -0.19 0.06 0.14 0.00 0.00 0.00 173.10 173.11 2k5u s VAL 88 N -0.82 0.22 -0.18 1.40 1.01 -1.14 -1.77 120.40 119.13 2k5u s VAL 88 Ca -0.09 -0.34 0.01 0.00 0.00 0.00 0.00 61.98 61.56 2k5u s VAL 88 Cb -0.05 -0.79 0.02 0.00 0.00 0.00 0.00 36.38 35.56 2k5u s VAL 88 CO 0.00 -0.23 -0.19 -0.63 0.00 0.00 0.00 175.10 174.05 2k5u s ILE 89 N 2.00 1.99 -0.19 2.22 -1.09 -0.88 -2.35 121.20 122.90 2k5u s ILE 89 Ca 0.01 -0.90 -0.09 0.00 -2.23 0.00 0.00 60.65 57.44 2k5u s ILE 89 Cb -0.16 -1.81 -0.05 0.00 -1.58 0.00 0.00 42.46 38.86 2k5u s ILE 89 CO -0.08 0.52 0.10 0.12 -1.23 0.00 0.00 174.94 174.37 2k5u s PHE 90 N 1.32 3.33 -0.11 3.97 5.36 0.23 -2.81 117.98 129.27 2k5u s PHE 90 Ca 0.05 0.20 0.02 0.00 -0.96 0.00 0.00 56.93 56.24 2k5u s PHE 90 Cb -0.13 -2.13 0.01 0.00 -0.34 0.00 0.00 43.02 40.43 2k5u s PHE 90 CO -0.13 0.21 -0.17 0.08 -1.46 0.00 0.00 175.22 173.75 2k5u s VAL 91 N 0.41 1.64 0.28 3.12 1.01 -1.10 -0.26 120.40 125.50 2k5u s VAL 91 Ca 0.06 -0.73 0.10 0.00 0.00 0.00 0.00 61.98 61.41 2k5u s VAL 91 Cb -0.12 -1.48 -0.05 0.00 0.00 0.00 0.00 36.38 34.73 2k5u s VAL 91 CO -0.01 0.47 -0.16 0.54 0.00 0.00 0.00 175.10 175.94 2k5u s VAL 92 N 0.87 2.26 -0.21 2.92 0.11 -0.88 -3.84 120.40 121.63 2k5u s VAL 92 Ca -0.08 -2.32 -0.25 0.00 -2.93 0.00 0.00 61.98 56.40 2k5u s VAL 92 Cb -0.15 -2.35 -0.01 0.00 -1.53 0.00 0.00 36.38 32.34 2k5u s VAL 92 CO -0.00 -0.38 0.85 -0.62 -3.33 0.00 0.00 175.10 171.62 2k5u s ASP 93 N -3.50 6.91 0.26 3.54 2.15 -1.26 -2.80 116.67 121.96 2k5u s ASP 93 Ca 0.29 1.12 0.25 0.00 0.43 0.00 0.00 52.55 54.65 2k5u s ASP 93 Cb -0.02 -2.45 0.87 0.00 -0.30 0.00 0.00 42.92 41.02 2k5u s ASP 93 CO 0.14 -0.49 1.75 -1.28 -0.17 0.00 0.00 175.17 175.13 2k5u h SER 94 N 7.52 0.00 -0.38 -0.34 0.87 -1.84 -2.89 113.55 116.49 2k5u h SER 94 Ca -0.25 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.31 2k5u h SER 94 Cb 1.10 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.06 2k5u h SER 94 CO 0.87 0.00 0.00 -3.20 -0.53 0.00 0.00 176.83 173.97 2k5u n ASN 95 N -2.34 3.15 -3.28 6.23 4.05 -1.26 -2.18 115.26 119.63 2k5u n ASN 95 Ca 0.04 -1.91 -0.27 0.00 0.45 0.00 0.00 54.58 52.89 2k5u n ASN 95 Cb 0.36 -0.25 -0.07 0.00 1.23 0.00 0.00 39.78 41.05 2k5u n ASN 95 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 177.26 173.54 2k5u n ASP 96 N 1.08 3.65 -0.20 1.20 -0.08 -1.09 -4.87 116.55 116.23 2k5u n ASP 96 Ca 0.16 -3.45 -0.05 0.00 -1.51 0.00 0.00 54.79 49.94 2k5u n ASP 96 Cb 0.50 -0.64 0.12 0.00 2.34 0.00 0.00 41.12 43.44 2k5u n ASP 96 CO 0.00 0.00 0.00 0.08 0.12 0.00 0.00 177.20 177.40 2k5u h ARG 97 N 3.83 1.00 -0.04 -0.67 0.11 -1.82 -1.84 114.38 114.95 2k5u h ARG 97 Ca 0.17 -0.22 0.01 0.00 0.10 0.00 0.00 59.98 60.04 2k5u h ARG 97 Cb 0.64 -0.14 -0.00 0.00 1.11 0.00 0.00 29.97 31.58 2k5u h ARG 97 CO 0.80 0.88 0.24 0.77 0.10 0.00 0.00 179.97 182.76 2k5u h SER 98 N 0.95 0.00 -0.04 0.08 0.02 -1.96 0.70 113.55 113.31 2k5u h SER 98 Ca 0.21 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 2k5u h SER 98 Cb 0.32 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.86 2k5u h SER 98 CO -0.00 0.00 0.00 0.54 -1.14 0.00 0.00 176.83 176.23 2k5u n ARG 99 N -3.07 0.51 -0.03 3.45 1.74 -0.84 -4.63 116.66 113.81 2k5u n ARG 99 Ca -0.01 -1.02 0.04 0.00 -0.77 0.00 0.00 57.85 56.08 2k5u n ARG 99 Cb 0.30 -1.09 0.41 0.00 -1.02 0.00 0.00 32.46 31.06 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 0.85 1.11 -0.32 0.55 6.09 -0.05 -0.07 117.51 125.66 2k5u h ILE 100 Ca 0.00 -0.21 -0.09 0.00 -1.37 0.00 0.00 64.86 63.20 2k5u h ILE 100 Cb 0.29 0.45 -0.02 0.00 0.47 0.00 0.00 36.82 38.02 2k5u h ILE 100 CO 0.00 0.11 -0.16 1.23 -3.07 0.00 0.00 178.15 176.26 2k5u h GLY 101 N 0.60 0.63 1.57 8.18 0.00 -1.82 -1.01 103.07 111.22 2k5u h GLY 101 Ca 0.17 -0.47 -0.05 0.00 0.00 0.00 0.00 47.33 46.98 2k5u h GLY 101 CO -0.04 0.43 0.02 0.83 0.00 0.00 0.00 176.54 177.79 2k5u h GLU 102 N 0.53 0.54 -0.20 4.80 4.39 -1.34 -1.57 114.58 121.73 2k5u h GLU 102 Ca 0.09 -0.11 -0.17 0.00 0.34 0.00 0.00 59.36 59.51 2k5u h GLU 102 Cb 0.58 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.16 2k5u h GLU 102 CO 0.04 0.55 -0.53 0.00 -1.16 0.00 0.00 179.01 177.91 2k5u h ALA 103 N 1.50 0.33 -0.67 3.43 0.00 -0.79 -2.54 119.26 120.53 2k5u h ALA 103 Ca 0.11 -0.51 0.03 0.00 0.00 0.00 0.00 54.91 54.55 2k5u h ALA 103 Cb 0.31 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 2k5u h ALA 103 CO 0.01 0.53 0.42 -0.09 0.00 0.00 0.00 179.25 180.12 2k5u h ARG 104 N 0.42 0.80 -0.42 0.00 1.12 -0.70 0.67 114.38 116.26 2k5u h ARG 104 Ca -0.01 -0.05 -0.10 0.00 -1.11 0.00 0.00 59.98 58.71 2k5u h ARG 104 Cb 1.15 -0.18 -0.01 0.00 -0.01 0.00 0.00 29.97 30.91 2k5u h ARG 104 CO 0.11 0.53 -0.14 1.05 -3.11 0.00 0.00 179.97 178.41 2k5u h GLU 105 N 0.82 0.84 -0.54 0.20 4.11 -1.31 0.23 114.58 118.92 2k5u h GLU 105 Ca 0.27 -0.34 -0.03 0.00 0.07 0.00 0.00 59.36 59.33 2k5u h GLU 105 Cb 0.02 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 2k5u h GLU 105 CO -0.11 0.97 0.22 0.28 0.07 0.00 0.00 179.01 180.45 2k5u h VAL 106 N 0.66 1.22 -0.36 -1.06 2.07 -1.10 0.87 116.25 118.55 2k5u h VAL 106 Ca 0.10 -0.67 -0.13 0.00 0.82 0.00 0.00 66.70 66.83 2k5u h VAL 106 Cb 0.69 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 2k5u h VAL 106 CO 0.05 0.26 -0.29 -0.03 0.02 0.00 0.00 177.57 177.57 2k5u h MET 107 N 0.74 0.76 -0.22 1.57 1.85 -0.75 -1.83 114.93 117.04 2k5u h MET 107 Ca 0.18 -0.34 -0.03 0.00 -0.61 0.00 0.00 59.70 58.90 2k5u h MET 107 Cb 0.19 -0.02 -0.01 0.00 0.43 0.00 0.00 31.60 32.19 2k5u h MET 107 CO -0.02 0.96 0.02 0.37 -0.40 0.00 0.00 176.91 177.84 2k5u h GLN 108 N 0.65 0.37 -0.59 0.39 5.75 -0.15 0.08 115.11 121.62 2k5u h GLN 108 Ca 0.08 -0.11 -0.09 0.00 -0.15 0.00 0.00 58.65 58.38 2k5u h GLN 108 Cb 0.82 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 29.31 2k5u h GLN 108 CO 0.07 0.55 0.02 -0.09 -2.65 0.00 0.00 178.83 176.72 2k5u h ARG 109 N 0.15 1.02 -0.49 1.69 2.43 -0.82 -2.40 114.38 115.96 2k5u h ARG 109 Ca 0.06 -0.30 -0.12 0.00 -0.81 0.00 0.00 59.98 58.81 2k5u h ARG 109 Cb 0.37 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.80 2k5u h ARG 109 CO 0.01 0.98 -0.17 1.98 -1.51 0.00 0.00 179.97 181.27 2k5u h MET 110 N 0.94 0.96 0.00 0.20 4.05 -1.23 -2.66 114.93 117.18 2k5u h MET 110 Ca 0.17 -0.38 0.00 0.00 -0.28 0.00 0.00 59.70 59.22 2k5u h MET 110 Cb 0.52 -0.05 0.00 0.00 -0.80 0.00 0.00 31.60 31.27 2k5u h MET 110 CO 0.03 1.04 0.00 -0.11 0.23 0.00 0.00 176.91 178.10 2k5u n LEU 111 N -4.13 0.72 0.00 3.39 0.00 0.01 -2.55 117.00 114.44 2k5u n LEU 111 Ca 0.01 0.66 0.09 0.00 0.00 0.00 0.00 56.01 56.77 2k5u n LEU 111 Cb 0.43 -0.54 0.53 0.00 0.00 0.00 0.00 43.42 43.83 2k5u n LEU 111 CO 0.46 -0.52 0.78 -3.20 0.00 0.00 0.00 177.39 174.91 2k5u n ASN 112 N -2.28 0.00 -4.61 1.96 5.15 -0.92 -4.65 115.26 109.92 2k5u n ASN 112 Ca 0.02 -1.11 -0.43 0.00 -0.60 0.00 0.00 54.58 52.47 2k5u n ASN 112 Cb 0.26 0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.49 2k5u n ASN 112 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2k5u s GLU 113 N -2.00 3.77 0.45 1.20 8.01 -1.06 -4.89 118.70 124.18 2k5u s GLU 113 Ca 0.27 0.72 0.18 0.00 0.01 0.00 0.00 54.97 56.15 2k5u s GLU 113 Cb 0.12 -3.90 1.13 0.00 -4.31 0.00 0.00 34.13 27.18 2k5u s GLU 113 CO 0.21 -1.32 1.93 0.38 0.01 0.00 0.00 175.26 176.46 2k5u h ASP 114 N 9.24 0.31 0.65 -0.19 2.03 -1.92 0.44 116.42 126.98 2k5u h ASP 114 Ca -0.23 0.02 0.00 0.00 -0.73 0.00 0.00 57.03 56.09 2k5u h ASP 114 Cb 1.07 -0.04 0.00 0.00 -0.83 0.00 0.00 39.33 39.53 2k5u h ASP 114 CO 1.10 0.16 0.00 -0.62 -1.03 0.00 0.00 179.24 178.85 2k5u n GLU 115 N -4.45 0.07 0.00 4.15 4.71 -1.26 -2.56 120.64 121.30 2k5u n GLU 115 Ca 0.14 0.29 0.00 0.00 -0.01 0.00 0.00 57.16 57.58 2k5u n GLU 115 Cb 0.57 -1.63 0.00 0.00 -1.01 0.00 0.00 31.44 29.37 2k5u n GLU 115 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 2k5u n LEU 116 N -1.77 1.52 0.33 -4.62 4.77 0.14 -4.74 117.00 112.63 2k5u n LEU 116 Ca 0.03 -1.52 0.19 0.00 -0.03 0.00 0.00 56.01 54.68 2k5u n LEU 116 Cb 0.21 0.00 1.03 0.00 -2.33 0.00 0.00 43.42 42.33 2k5u n LEU 116 CO 0.17 0.38 1.16 -0.09 -1.33 0.00 0.00 177.39 177.68 2k5u h ARG 117 N 0.00 0.00 -0.29 3.23 2.43 -0.73 0.13 114.38 119.15 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 0.54 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 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 -3.03 3.78 -4.83 -3.80 0.23 -1.26 -5.01 115.26 101.33 2k5u n ASN 118 Ca -0.02 -2.80 -0.34 0.00 -0.53 0.00 0.00 54.58 50.88 2k5u n ASN 118 Cb 0.22 -0.49 -0.06 0.00 -2.08 0.00 0.00 39.78 37.37 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 -2.45 3.31 -0.20 -2.53 0.00 0.46 -5.03 121.76 115.31 2k5u s ALA 119 Ca 0.39 0.15 -0.27 0.00 0.00 0.00 0.00 51.96 52.23 2k5u s ALA 119 Cb 0.30 -2.85 -0.00 0.00 0.00 0.00 0.00 23.12 20.56 2k5u s ALA 119 CO 0.11 0.30 0.91 0.00 0.00 0.00 0.00 175.76 177.08 2k5u s ALA 120 N -1.85 3.60 -0.16 0.00 0.00 -1.26 -4.91 121.76 117.18 2k5u s ALA 120 Ca 0.51 0.06 -0.06 0.00 0.00 0.00 0.00 51.96 52.48 2k5u s ALA 120 Cb -0.12 -3.37 -0.04 0.00 0.00 0.00 0.00 23.12 19.59 2k5u s ALA 120 CO 0.18 -0.85 0.04 -1.58 0.00 0.00 0.00 175.76 173.55 2k5u s TRP 121 N 2.67 3.21 -0.12 0.00 0.51 -0.98 -2.89 118.94 121.35 2k5u s TRP 121 Ca 0.40 0.05 0.03 0.00 -2.12 0.00 0.00 56.10 54.46 2k5u s TRP 121 Cb -0.16 -2.00 0.01 0.00 -0.81 0.00 0.00 33.47 30.51 2k5u s TRP 121 CO 0.09 0.21 -0.21 -1.17 -0.51 0.00 0.00 176.95 175.36 2k5u s LEU 122 N 0.07 2.00 -0.45 2.99 1.98 -0.99 -2.53 118.68 121.74 2k5u s LEU 122 Ca 0.04 -0.54 -0.14 0.00 -2.89 0.00 0.00 54.13 50.60 2k5u s LEU 122 Cb -0.12 -1.33 0.07 0.00 0.66 0.00 0.00 46.19 45.47 2k5u s LEU 122 CO 0.01 0.09 0.36 -0.69 -1.89 0.00 0.00 176.35 174.23 2k5u s VAL 123 N 0.70 5.07 -0.28 1.68 1.01 0.10 0.77 120.40 129.46 2k5u s VAL 123 Ca -0.11 -1.06 -0.11 0.00 0.00 0.00 0.00 61.98 60.70 2k5u s VAL 123 Cb -0.16 -4.01 -0.05 0.00 0.00 0.00 0.00 36.38 32.16 2k5u s VAL 123 CO 0.02 -0.53 0.20 0.12 0.00 0.00 0.00 175.10 174.91 2k5u s PHE 124 N 1.61 3.23 -0.25 5.22 5.36 0.64 -1.60 117.98 132.19 2k5u s PHE 124 Ca 0.04 0.15 -0.15 0.00 -0.96 0.00 0.00 56.93 56.01 2k5u s PHE 124 Cb -0.23 -2.39 -0.04 0.00 -0.34 0.00 0.00 43.02 40.02 2k5u s PHE 124 CO 0.06 -0.15 0.36 0.00 -1.46 0.00 0.00 175.22 174.03 2k5u s ALA 125 N 1.73 3.57 -0.27 11.12 0.00 -0.63 -2.07 121.76 135.20 2k5u s ALA 125 Ca 0.08 -0.74 0.01 0.00 0.00 0.00 0.00 51.96 51.31 2k5u s ALA 125 Cb -0.16 -2.65 0.06 0.00 0.00 0.00 0.00 23.12 20.37 2k5u s ALA 125 CO 0.10 -0.50 -0.07 0.54 0.00 0.00 0.00 175.76 175.83 2k5u s ASN 126 N 1.41 4.58 0.00 0.00 2.20 -1.12 -1.67 114.94 120.33 2k5u s ASN 126 Ca 0.15 -1.33 0.00 0.00 -0.94 0.00 0.00 52.86 50.74 2k5u s ASN 126 Cb -0.15 -1.61 0.00 0.00 -2.00 0.00 0.00 41.25 37.49 2k5u s ASN 126 CO 0.09 -0.21 0.00 0.29 -2.94 0.00 0.00 177.10 174.33 2k5u n LYS 127 N 4.50 0.00 0.00 3.55 5.02 -1.12 -2.82 118.16 127.29 2k5u n LYS 127 Ca -0.14 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.26 2k5u n LYS 127 Cb 0.43 0.00 0.49 0.00 -0.02 0.00 0.00 35.03 35.93 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 0.02 0.18 1.97 1.13 0.26 -2.63 117.38 118.30 2k5u n GLN 128 Ca 0.00 0.11 0.07 0.00 -1.94 0.00 0.00 57.00 55.23 2k5u n GLN 128 Cb 0.00 -1.50 0.14 0.00 0.11 0.00 0.00 30.24 28.99 2k5u n GLN 128 CO 0.00 0.00 0.00 0.38 -1.44 0.00 0.00 177.06 176.00 2k5u h ASP 129 N 0.00 0.00 -3.14 1.08 3.04 -1.95 -3.45 116.42 112.00 2k5u h ASP 129 Ca 0.00 0.00 -0.53 0.00 -3.24 0.00 0.00 57.03 53.26 2k5u h ASP 129 Cb 0.38 0.00 0.04 0.00 -1.04 0.00 0.00 39.33 38.71 2k5u h ASP 129 CO 0.00 0.31 0.77 -0.76 -2.04 0.00 0.00 179.24 177.52 2k5u s LEU 130 N -6.43 4.38 0.43 0.15 1.43 -1.08 -4.89 118.68 112.67 2k5u s LEU 130 Ca 0.04 2.54 0.30 0.00 -1.03 0.00 0.00 54.13 55.98 2k5u s LEU 130 Cb 0.07 -3.61 1.44 0.00 0.03 0.00 0.00 46.19 44.13 2k5u s LEU 130 CO 0.70 -0.70 1.91 1.55 0.23 0.00 0.00 176.35 180.04 2k5u h PRO 131 N 5.95 0.00 -0.23 1.29 0.13 -1.90 -2.24 132.00 135.00 2k5u h PRO 131 Ca -0.44 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.63 2k5u h PRO 131 Cb 1.21 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.30 2k5u h PRO 131 CO 0.83 0.00 -0.05 -0.85 -0.23 0.00 0.00 178.00 177.70 2k5u n GLU 132 N -2.62 2.19 -3.27 0.86 0.28 -1.26 -5.02 120.64 111.80 2k5u n GLU 132 Ca -0.00 -2.94 -0.35 0.00 -0.16 0.00 0.00 57.16 53.71 2k5u n GLU 132 Cb 0.16 -1.77 -0.06 0.00 1.43 0.00 0.00 31.44 31.21 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 3.49 0.43 -1.84 0.00 -0.85 -4.87 121.76 115.12 2k5u s ALA 133 Ca 0.41 -0.05 -0.21 0.00 0.00 0.00 0.00 51.96 52.11 2k5u s ALA 133 Cb 0.35 -2.62 -0.11 0.00 0.00 0.00 0.00 23.12 20.75 2k5u s ALA 133 CO 0.04 0.41 0.96 0.00 0.00 0.00 0.00 175.76 177.17 2k5u s MET 134 N -2.25 4.21 0.48 0.00 0.23 -0.93 -5.02 119.30 116.02 2k5u s MET 134 Ca 0.43 1.18 -0.20 0.00 -1.03 0.00 0.00 55.69 56.07 2k5u s MET 134 Cb -0.14 -2.24 -0.09 0.00 -1.53 0.00 0.00 34.83 30.84 2k5u s MET 134 CO 0.20 -0.05 1.04 -1.12 -2.03 0.00 0.00 175.02 173.05 2k5u s SER 135 N -2.09 6.36 0.28 -1.18 0.01 -1.26 -4.84 113.70 110.98 2k5u s SER 135 Ca 0.61 1.93 0.03 0.00 1.31 0.00 0.00 55.95 59.83 2k5u s SER 135 Cb -0.11 -2.56 0.66 0.00 0.21 0.00 0.00 66.02 64.21 2k5u s SER 135 CO 0.15 -0.77 1.75 0.00 0.41 0.00 0.00 173.24 174.78 2k5u h ALA 136 N 1.59 1.45 -0.51 1.44 0.00 -1.96 0.15 119.26 121.43 2k5u h ALA 136 Ca -0.49 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.47 2k5u h ALA 136 Cb 1.22 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 2k5u h ALA 136 CO 0.59 -0.15 0.13 0.00 0.00 0.00 0.00 179.25 179.82 2k5u h ALA 137 N 1.63 1.28 -0.11 0.00 0.00 -1.94 0.90 119.26 121.02 2k5u h ALA 137 Ca 0.53 -0.19 -0.18 0.00 0.00 0.00 0.00 54.91 55.07 2k5u h ALA 137 Cb 0.85 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 2k5u h ALA 137 CO -0.41 0.51 -0.68 0.93 0.00 0.00 0.00 179.25 179.59 2k5u h GLU 138 N 0.74 0.47 -0.12 0.00 5.08 -1.17 -2.67 114.58 116.90 2k5u h GLU 138 Ca 0.17 -0.36 -0.05 0.00 -1.00 0.00 0.00 59.36 58.12 2k5u h GLU 138 Cb 0.26 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 2k5u h GLU 138 CO -0.00 0.98 -0.11 0.82 -1.00 0.00 0.00 179.01 179.70 2k5u h ILE 139 N 0.33 1.35 -0.99 3.13 2.04 -0.51 0.30 117.51 123.15 2k5u h ILE 139 Ca -0.02 -1.24 0.04 0.00 1.00 0.00 0.00 64.86 64.63 2k5u h ILE 139 Cb 1.25 1.89 -0.06 0.00 -0.74 0.00 0.00 36.82 39.17 2k5u h ILE 139 CO 0.12 0.36 0.65 0.00 0.00 0.00 0.00 178.15 179.28 2k5u h THR 140 N -0.09 1.17 -0.01 -0.27 1.03 -0.86 0.11 112.91 113.98 2k5u h THR 140 Ca 0.02 -0.43 -0.18 0.00 -0.01 0.00 0.00 66.41 65.82 2k5u h THR 140 Cb 0.62 -0.19 -0.01 0.00 -1.07 0.00 0.00 68.15 67.50 2k5u h THR 140 CO 0.03 0.23 -0.79 -0.08 -0.01 0.00 0.00 175.52 174.89 2k5u h GLU 141 N 1.25 0.14 -0.39 0.00 4.81 -1.46 0.53 114.58 119.47 2k5u h GLU 141 Ca 0.39 -0.14 -0.11 0.00 -0.13 0.00 0.00 59.36 59.37 2k5u h GLU 141 Cb 0.01 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 2k5u h GLU 141 CO -0.13 0.86 -0.20 -0.22 -0.73 0.00 0.00 179.01 178.60 2k5u h LYS 142 N 0.09 0.82 -0.17 1.92 3.64 0.10 -2.81 116.57 120.15 2k5u h LYS 142 Ca -0.03 -0.36 0.00 0.00 -1.27 0.00 0.00 60.65 58.99 2k5u h LYS 142 Cb 1.39 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.19 2k5u h LYS 142 CO 0.12 0.99 0.00 1.47 -2.27 0.00 0.00 179.45 179.76 2k5u n LEU 143 N -4.25 0.74 -1.29 5.20 -0.00 0.28 -4.86 117.00 112.83 2k5u n LEU 143 Ca -0.02 -0.37 -0.13 0.00 -0.00 0.00 0.00 56.01 55.49 2k5u n LEU 143 Cb 0.43 -0.11 -0.03 0.00 -0.00 0.00 0.00 43.42 43.71 2k5u n LEU 143 CO 0.45 0.18 -0.15 0.61 -0.00 0.00 0.00 177.39 178.47 2k5u n GLY 144 N 0.67 0.50 0.23 1.47 0.00 -1.06 -4.79 105.19 102.20 2k5u n GLY 144 Ca 0.04 -0.37 0.10 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.20 0.99 7.12 -0.15 -2.14 115.31 120.93 2k5u h LEU 145 Ca -0.29 0.00 -0.08 0.00 0.13 0.00 0.00 57.88 57.64 2k5u h LEU 145 Cb 1.07 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 41.19 2k5u h LEU 145 CO 0.38 0.22 -0.38 -0.74 -0.13 0.00 0.00 178.44 177.79 2k5u h HIS 146 N 0.00 0.00 -0.01 1.25 2.76 -1.84 -3.01 115.15 114.30 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 0.59 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.55 2k5u h HIS 146 CO 0.00 0.38 0.00 0.45 -1.30 0.00 0.00 177.93 177.46 2k5u n SER 147 N -3.24 0.53 -4.77 3.26 2.88 -0.81 -4.82 113.62 106.64 2k5u n SER 147 Ca 0.02 -1.19 -0.34 0.00 -1.33 0.00 0.00 58.87 56.03 2k5u n SER 147 Cb 0.65 -0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 64.03 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 -2.00 4.77 -0.46 2.46 2.07 -1.14 -5.00 121.20 121.90 2k5u s ILE 148 Ca 0.44 -0.24 -0.40 0.00 -1.41 0.00 0.00 60.65 59.04 2k5u s ILE 148 Cb 0.21 -3.11 -0.16 0.00 0.13 0.00 0.00 42.46 39.53 2k5u s ILE 148 CO 0.35 0.47 2.19 0.54 -1.91 0.00 0.00 174.94 176.58 2k5u n ARG 149 N 1.61 0.42 -2.09 3.50 3.00 -1.26 -4.84 116.66 116.99 2k5u n ARG 149 Ca -0.16 0.11 -0.41 0.00 -0.01 0.00 0.00 57.85 57.38 2k5u n ARG 149 Cb 0.53 -1.89 -0.02 0.00 0.00 0.00 0.00 32.46 31.09 2k5u n ARG 149 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.63 176.83 2k5u s ASN 150 N 6.71 6.74 0.00 0.55 0.01 -1.26 -4.30 114.94 123.39 2k5u s ASN 150 Ca 1.16 2.72 0.00 0.00 -0.71 0.00 0.00 52.86 56.03 2k5u s ASN 150 Cb -1.23 -2.65 0.00 0.00 0.41 0.00 0.00 41.25 37.78 2k5u s ASN 150 CO 0.58 -0.57 0.00 0.54 -1.51 0.00 0.00 177.10 176.15 2k5u n ARG 151 N 0.82 0.00 0.06 -0.60 5.12 -1.26 -4.96 116.66 115.83 2k5u n ARG 151 Ca 0.00 0.00 -0.14 0.00 -1.93 0.00 0.00 57.85 55.78 2k5u n ARG 151 Cb 0.42 0.00 -0.14 0.00 -1.16 0.00 0.00 32.46 31.58 2k5u n ARG 151 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 2k5u h PRO 152 N 0.00 0.18 -5.65 5.56 0.11 -1.93 -3.46 132.00 126.81 2k5u h PRO 152 Ca 0.00 -0.31 -0.66 0.00 0.11 0.00 0.00 66.00 65.14 2k5u h PRO 152 Cb 0.00 0.11 -0.10 0.00 0.11 0.00 0.00 31.00 31.12 2k5u h PRO 152 CO 0.00 1.05 -0.52 1.67 -0.21 0.00 0.00 178.00 179.98 2k5u s TRP 153 N -2.64 3.44 0.07 0.65 -2.14 -1.25 -2.32 118.94 114.76 2k5u s TRP 153 Ca -0.06 0.39 0.03 0.00 2.66 0.00 0.00 56.10 59.12 2k5u s TRP 153 Cb 0.08 -1.94 -0.03 0.00 -3.10 0.00 0.00 33.47 28.48 2k5u s TRP 153 CO 0.85 0.58 -0.10 0.12 -2.66 0.00 0.00 176.95 175.74 2k5u s PHE 154 N -0.73 0.92 -0.04 1.66 5.36 -1.05 -4.99 117.98 119.11 2k5u s PHE 154 Ca 0.13 -0.58 0.06 0.00 -0.96 0.00 0.00 56.93 55.57 2k5u s PHE 154 Cb -0.12 -0.52 -0.02 0.00 -0.34 0.00 0.00 43.02 42.02 2k5u s PHE 154 CO 0.03 -0.04 -0.21 -1.50 -1.46 0.00 0.00 175.22 172.03 2k5u s ILE 155 N -1.92 2.43 -0.06 3.12 1.10 -1.26 0.03 121.20 124.65 2k5u s ILE 155 Ca -0.02 -0.95 -0.02 0.00 -0.51 0.00 0.00 60.65 59.15 2k5u s ILE 155 Cb -0.06 -1.90 0.04 0.00 0.15 0.00 0.00 42.46 40.69 2k5u s ILE 155 CO 0.00 0.58 0.13 -1.58 -2.11 0.00 0.00 174.94 171.96 2k5u s GLN 156 N -0.55 0.07 0.09 3.50 -0.44 -0.63 -4.98 119.66 116.72 2k5u s GLN 156 Ca 0.08 0.35 -0.23 0.00 -2.50 0.00 0.00 55.36 53.06 2k5u s GLN 156 Cb -0.11 -0.20 -0.07 0.00 -1.64 0.00 0.00 33.01 30.99 2k5u s GLN 156 CO 0.00 -0.18 0.71 0.00 0.50 0.00 0.00 175.29 176.33 2k5u s ALA 157 N 1.23 3.46 0.29 1.58 0.00 -1.26 -1.61 121.76 125.45 2k5u s ALA 157 Ca -0.08 0.23 -0.07 0.00 0.00 0.00 0.00 51.96 52.04 2k5u s ALA 157 Cb -0.12 -2.87 -0.00 0.00 0.00 0.00 0.00 23.12 20.13 2k5u s ALA 157 CO -0.05 0.24 0.45 0.95 0.00 0.00 0.00 175.76 177.34 2k5u s THR 158 N -0.71 0.00 -0.27 0.00 -4.23 -0.67 -4.76 115.64 105.00 2k5u s THR 158 Ca 0.34 -1.55 -0.00 0.00 -1.18 0.00 0.00 61.69 59.30 2k5u s THR 158 Cb -0.21 -2.48 0.08 0.00 1.34 0.00 0.00 72.50 71.23 2k5u s THR 158 CO 0.23 0.00 0.04 0.00 -0.54 0.00 0.00 174.62 174.34 2k5u h ALA 160 N 8.04 1.61 0.09 0.00 0.00 -1.90 -0.91 119.26 126.20 2k5u h ALA 160 Ca -0.14 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 2k5u h ALA 160 Cb 1.05 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2k5u h ALA 160 CO 0.43 0.31 -0.04 0.00 0.00 0.00 0.00 179.25 179.94 2k5u h THR 161 N 0.45 1.14 -0.00 0.00 1.03 -1.95 -3.29 112.91 110.28 2k5u h THR 161 Ca 0.11 -1.29 0.00 0.00 -0.01 0.00 0.00 66.41 65.22 2k5u h THR 161 Cb 0.11 1.91 0.00 0.00 -1.07 0.00 0.00 68.15 69.10 2k5u h THR 161 CO -0.01 0.29 -0.10 -1.20 -0.01 0.00 0.00 175.52 174.50 2k5u n SER 162 N -4.86 0.15 0.00 0.00 7.64 -1.23 -4.90 113.62 110.43 2k5u n SER 162 Ca -0.08 0.08 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2k5u n SER 162 Cb 0.29 -0.27 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 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 0.62 3.64 0.23 0.00 -0.36 -4.96 105.19 105.78 2k5u n GLY 163 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.35 3.94 0.00 1.61 2.12 -1.10 -2.51 118.70 122.42 2k5u s GLU 164 Ca 0.00 1.57 0.00 0.00 0.36 0.00 0.00 54.97 56.90 2k5u s GLU 164 Cb 0.00 -3.93 0.00 0.00 0.26 0.00 0.00 34.13 30.46 2k5u s GLU 164 CO 0.00 -1.10 0.00 0.41 -0.54 0.00 0.00 175.26 174.03 2k5u n GLY 165 N 4.32 3.42 0.11 -1.50 0.00 -1.26 0.10 105.19 110.38 2k5u n GLY 165 Ca 0.16 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.06 2k5u n GLY 165 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2k5u h LEU 166 N 0.00 0.24 -0.18 0.99 3.38 -1.76 -0.66 115.31 117.32 2k5u h LEU 166 Ca 0.00 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.60 2k5u h LEU 166 Cb 0.00 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2k5u h LEU 166 CO 0.00 0.52 0.01 0.10 0.09 0.00 0.00 178.44 179.16 2k5u h TYR 167 N -0.06 0.33 0.00 1.13 -0.00 -1.92 -2.65 116.97 113.80 2k5u h TYR 167 Ca 0.03 -0.05 -0.03 0.00 0.00 0.00 0.00 58.73 58.68 2k5u h TYR 167 Cb 0.41 -0.09 -0.00 0.00 0.00 0.00 0.00 36.73 37.05 2k5u h TYR 167 CO 0.04 0.49 -0.16 0.93 -0.00 0.00 0.00 178.16 179.46 2k5u h GLU 168 N 0.07 0.00 -0.07 0.10 5.08 -1.90 -0.91 114.58 116.96 2k5u h GLU 168 Ca 0.05 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.21 2k5u h GLU 168 Cb 0.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 2k5u h GLU 168 CO 0.01 0.16 -0.80 0.78 -1.00 0.00 0.00 179.01 178.16 2k5u h GLY 169 N 0.81 0.55 0.64 -3.84 0.00 -0.93 -2.26 103.07 98.04 2k5u h GLY 169 Ca -0.00 -0.82 -0.11 0.00 0.00 0.00 0.00 47.33 46.39 2k5u h GLY 169 CO 0.02 0.73 -0.44 -2.00 0.00 0.00 0.00 176.54 174.85 2k5u h LEU 170 N 0.32 0.40 -0.45 3.11 6.46 -1.12 -1.93 115.31 122.10 2k5u h LEU 170 Ca -0.05 -0.76 0.06 0.00 -0.12 0.00 0.00 57.88 57.01 2k5u h LEU 170 Cb 1.41 -0.12 -0.05 0.00 -0.73 0.00 0.00 40.66 41.16 2k5u h LEU 170 CO 0.14 1.11 0.15 -0.08 -0.62 0.00 0.00 178.44 179.14 2k5u h GLU 171 N -0.27 0.31 -0.04 1.25 4.81 -1.24 0.47 114.58 119.87 2k5u h GLU 171 Ca -0.05 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.15 2k5u h GLU 171 Cb 1.17 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.48 2k5u h GLU 171 CO 0.09 0.20 0.01 2.35 -0.73 0.00 0.00 179.01 180.93 2k5u h TRP 172 N 0.32 0.07 -0.74 0.92 7.01 -1.47 -2.62 115.95 119.43 2k5u h TRP 172 Ca 0.21 -0.01 0.04 0.00 2.11 0.00 0.00 58.89 61.24 2k5u h TRP 172 Cb 0.22 -0.02 -0.04 0.00 -2.10 0.00 0.00 29.16 27.22 2k5u h TRP 172 CO -0.16 0.27 0.49 1.25 -2.79 0.00 0.00 178.44 177.50 2k5u h LEU 173 N -0.15 0.77 -0.82 0.65 5.85 -0.91 -1.91 115.31 118.79 2k5u h LEU 173 Ca 0.01 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 2k5u h LEU 173 Cb 0.23 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.05 2k5u h LEU 173 CO 0.00 0.53 0.51 -1.28 -0.34 0.00 0.00 178.44 177.86 2k5u h SER 174 N 0.90 0.96 -0.58 1.25 0.87 0.15 -1.67 113.55 115.43 2k5u h SER 174 Ca 0.30 -0.05 0.01 0.00 -1.23 0.00 0.00 61.79 60.81 2k5u h SER 174 Cb 0.07 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 61.76 2k5u h SER 174 CO -0.09 0.73 0.38 0.78 -0.53 0.00 0.00 176.83 178.11 2k5u h ASN 175 N 1.11 0.66 -0.26 6.23 4.21 -0.98 0.95 115.58 127.51 2k5u h ASN 175 Ca 0.29 -0.02 -0.06 0.00 1.21 0.00 0.00 56.30 57.73 2k5u h ASN 175 Cb -0.07 -0.16 -0.02 0.00 -1.12 0.00 0.00 38.32 36.94 2k5u h ASN 175 CO -0.06 0.48 -0.03 0.28 -1.29 0.00 0.00 177.43 176.81 2k5u h SER 176 N 0.78 0.57 1.49 5.81 0.02 -1.28 0.43 113.55 121.38 2k5u h SER 176 Ca 0.22 -0.13 -0.09 0.00 -0.84 0.00 0.00 61.79 60.95 2k5u h SER 176 Cb -0.08 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.29 2k5u h SER 176 CO -0.05 0.66 -0.52 -0.07 -1.14 0.00 0.00 176.83 175.72 2k5u h LEU 177 N 0.56 0.00 0.00 5.07 3.38 -0.61 -2.96 115.31 120.75 2k5u h LEU 177 Ca 0.11 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.91 2k5u h LEU 177 Cb 0.41 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 2k5u h LEU 177 CO 0.02 0.41 -1.30 0.50 0.09 0.00 0.00 178.44 178.15 2k5u h LYS 178 N 0.00 0.00 0.00 1.13 3.11 0.15 -3.44 116.57 117.52 2k5u h LYS 178 Ca -0.02 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.82 2k5u h LYS 178 Cb 1.32 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.55 2k5u h LYS 178 CO 0.05 0.37 0.00 -1.71 -2.81 0.00 0.00 179.45 175.35 2k5u n ASN 179 N -2.97 0.00 0.00 4.20 5.15 0.15 -5.03 115.26 116.76 2k5u n ASN 179 Ca -0.08 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.90 2k5u n ASN 179 Cb 0.85 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 40.10 2k5u n ASN 179 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2k5u n SER 180 N -0.73 0.00 0.00 1.20 7.64 -1.12 -5.06 113.62 115.55 2k5u n SER 180 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2k5u n SER 180 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2k5u n SER 180 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38