#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k5u n LEU 3 N 0.00 0.00 -2.70 0.99 7.99 -1.26 -4.26 117.00 117.75 2k5u n LEU 3 Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 56.01 55.98 2k5u n LEU 3 Cb 0.00 -0.16 -0.01 0.00 -0.11 0.00 0.00 43.42 43.13 2k5u n LEU 3 CO 0.00 -0.19 -0.55 0.33 -1.51 0.00 0.00 177.39 175.47 2k5u n PHE 4 N -1.84 -4.04 -2.77 -1.77 7.35 -1.26 -3.98 117.46 109.16 2k5u n PHE 4 Ca 0.00 1.98 -0.22 0.00 -0.76 0.00 0.00 57.45 58.46 2k5u n PHE 4 Cb 0.00 -3.90 0.02 0.00 0.35 0.00 0.00 39.48 35.95 2k5u n PHE 4 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2k5u n ALA 5 N 1.05 -0.83 -0.89 3.13 0.00 -1.26 -4.22 120.51 117.49 2k5u n ALA 5 Ca -0.13 0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.54 2k5u n ALA 5 Cb 0.22 -3.12 0.00 0.00 0.00 0.00 0.00 19.45 16.54 2k5u n ALA 5 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2k5u n SER 6 N -2.30 0.00 0.00 0.00 7.64 -1.26 -4.82 113.62 112.89 2k5u n SER 6 Ca -0.17 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.71 2k5u n SER 6 Cb 0.65 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.85 2k5u n SER 6 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2k5u n LYS 7 N 0.00 0.00 -3.75 1.43 5.02 -1.26 -4.45 118.16 115.15 2k5u n LYS 7 Ca 0.00 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.17 2k5u n LYS 7 Cb 0.00 0.00 -0.12 0.00 -0.02 0.00 0.00 35.03 34.89 2k5u n LYS 7 CO 0.00 0.00 0.00 -0.48 -0.52 0.00 0.00 177.40 176.40 2k5u s LEU 8 N 0.00 0.59 -0.08 -0.35 2.34 -1.26 -5.11 118.68 114.81 2k5u s LEU 8 Ca 0.00 0.63 -0.29 0.00 0.06 0.00 0.00 54.13 54.52 2k5u s LEU 8 Cb 0.00 1.00 -0.07 0.00 -0.56 0.00 0.00 46.19 46.55 2k5u s LEU 8 CO 0.00 -0.13 2.08 2.22 -1.06 0.00 0.00 176.35 179.46 2k5u n PHE 9 N 3.47 2.27 -2.26 3.48 -1.74 -1.26 -4.86 117.46 116.57 2k5u n PHE 9 Ca -0.18 -0.26 -0.25 0.00 -0.56 0.00 0.00 57.45 56.20 2k5u n PHE 9 Cb 0.56 -2.77 0.07 0.00 1.52 0.00 0.00 39.48 38.87 2k5u n PHE 9 CO 0.00 0.00 0.00 -1.12 -0.56 0.00 0.00 176.76 175.08 2k5u s SER 10 N 6.10 4.75 0.00 5.98 0.01 -1.26 -5.03 113.70 124.25 2k5u s SER 10 Ca 0.94 0.35 0.00 0.00 1.31 0.00 0.00 55.95 58.55 2k5u s SER 10 Cb -0.40 -0.98 0.00 0.00 0.21 0.00 0.00 66.02 64.85 2k5u s SER 10 CO 0.40 -1.62 0.30 0.59 0.41 0.00 0.00 173.24 173.32 2k5u n ASN 11 N -2.89 0.57 -4.62 2.44 4.13 -1.26 -5.04 115.26 108.58 2k5u n ASN 11 Ca 0.09 -1.04 -0.43 0.00 1.68 0.00 0.00 54.58 54.88 2k5u n ASN 11 Cb 0.60 0.00 -0.03 0.00 -1.54 0.00 0.00 39.78 38.81 2k5u n ASN 11 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2k5u s LEU 12 N -0.04 3.83 0.00 3.41 1.02 -1.26 -4.79 118.68 120.85 2k5u s LEU 12 Ca 0.00 1.98 0.00 0.00 0.02 0.00 0.00 54.13 56.13 2k5u s LEU 12 Cb 0.00 -3.52 0.00 0.00 0.02 0.00 0.00 46.19 42.69 2k5u s LEU 12 CO 0.00 -1.52 0.20 0.49 0.02 0.00 0.00 176.35 175.54 2k5u n PHE 13 N 9.64 0.00 -1.95 0.29 3.72 -1.26 -5.04 117.46 122.86 2k5u n PHE 13 Ca 0.24 0.00 -0.35 0.00 -0.05 0.00 0.00 57.45 57.28 2k5u n PHE 13 Cb 0.44 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 39.02 2k5u n PHE 13 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2k5u s GLY 14 N -0.47 2.62 -0.07 1.37 0.00 -1.26 -4.94 107.32 104.56 2k5u s GLY 14 Ca 0.00 0.92 0.03 0.00 0.00 0.00 0.00 44.72 45.67 2k5u s GLY 14 CO 0.00 1.30 0.76 -2.01 0.00 0.00 0.00 173.10 173.15 2k5u n ASN 15 N -1.77 -0.66 -2.70 1.64 2.85 -1.26 -5.02 115.26 108.33 2k5u n ASN 15 Ca 0.13 -1.34 -0.26 0.00 -0.11 0.00 0.00 54.58 53.00 2k5u n ASN 15 Cb 0.50 0.25 -0.09 0.00 1.24 0.00 0.00 39.78 41.68 2k5u n ASN 15 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 2k5u n LYS 16 N -0.33 2.92 -2.16 1.20 4.81 -1.26 -4.79 118.16 118.56 2k5u n LYS 16 Ca -0.14 -1.65 0.00 0.00 -0.87 0.00 0.00 58.31 55.65 2k5u n LYS 16 Cb 0.58 -2.43 0.00 0.00 0.02 0.00 0.00 35.03 33.21 2k5u n LYS 16 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2k5u n GLU 17 N 3.06 -4.66 -3.74 1.64 -0.58 -1.26 -5.06 120.64 110.03 2k5u n GLU 17 Ca 0.62 3.43 -0.14 0.00 -0.42 0.00 0.00 57.16 60.65 2k5u n GLU 17 Cb 0.55 -4.19 -0.14 0.00 -0.57 0.00 0.00 31.44 27.09 2k5u n GLU 17 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2k5u s MET 18 N -0.80 0.10 -0.32 3.49 0.23 -1.26 -4.83 119.30 115.90 2k5u s MET 18 Ca 0.00 0.41 -0.01 0.00 -1.03 0.00 0.00 55.69 55.06 2k5u s MET 18 Cb 0.00 -0.18 0.13 0.00 -1.53 0.00 0.00 34.83 33.25 2k5u s MET 18 CO 0.00 -0.18 0.25 0.50 -2.03 0.00 0.00 175.02 173.56 2k5u s ARG 19 N 1.29 0.40 -0.12 3.16 3.52 -1.26 -2.51 118.95 123.43 2k5u s ARG 19 Ca -0.08 -0.65 -0.29 0.00 -0.13 0.00 0.00 55.73 54.58 2k5u s ARG 19 Cb -0.12 -0.94 -0.01 0.00 -1.56 0.00 0.00 34.95 32.32 2k5u s ARG 19 CO -0.06 -1.10 1.01 0.42 -0.81 0.00 0.00 175.30 174.75 2k5u s ILE 20 N 1.83 4.78 0.15 4.11 -1.09 -0.39 0.20 121.20 130.77 2k5u s ILE 20 Ca 0.13 2.03 0.10 0.00 -2.23 0.00 0.00 60.65 60.67 2k5u s ILE 20 Cb -0.17 -4.31 -0.04 0.00 -1.58 0.00 0.00 42.46 36.36 2k5u s ILE 20 CO -0.21 -0.01 -0.22 -1.48 -1.23 0.00 0.00 174.94 171.79 2k5u s LEU 21 N 2.14 2.37 -0.41 2.97 2.34 0.88 -2.55 118.68 126.42 2k5u s LEU 21 Ca 0.48 -0.79 -0.17 0.00 0.06 0.00 0.00 54.13 53.70 2k5u s LEU 21 Cb -0.18 -0.99 0.02 0.00 -0.56 0.00 0.00 46.19 44.48 2k5u s LEU 21 CO 0.16 0.07 0.45 -0.04 -1.06 0.00 0.00 176.35 175.93 2k5u s MET 22 N -2.37 3.16 0.03 1.48 -1.94 -0.03 -2.65 119.30 116.98 2k5u s MET 22 Ca 0.14 -0.69 0.08 0.00 -1.71 0.00 0.00 55.69 53.51 2k5u s MET 22 Cb -0.08 -3.95 -0.03 0.00 2.01 0.00 0.00 34.83 32.78 2k5u s MET 22 CO 0.07 -0.83 -0.25 0.14 -0.01 0.00 0.00 175.02 174.14 2k5u s VAL 23 N 2.17 2.00 -5.00 -6.03 -7.23 -1.02 -2.97 120.40 102.32 2k5u s VAL 23 Ca 0.13 -1.25 0.00 0.00 -1.81 0.00 0.00 61.98 59.05 2k5u s VAL 23 Cb -0.17 -1.69 0.00 0.00 0.56 0.00 0.00 36.38 35.08 2k5u s VAL 23 CO 0.14 0.40 0.00 0.61 -0.31 0.00 0.00 175.10 175.93 2k5u n GLY 24 N 2.01 -0.28 3.80 2.32 0.00 -1.26 -2.63 105.19 109.15 2k5u n GLY 24 Ca -0.17 -1.48 -0.33 0.00 0.00 0.00 0.00 46.02 44.04 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 3.71 0.52 0.99 2.96 -1.26 -2.09 118.68 123.51 2k5u s LEU 25 Ca 0.00 1.86 -0.22 0.00 -0.22 0.00 0.00 54.13 55.56 2k5u s LEU 25 Cb 0.00 -4.55 -0.06 0.00 0.50 0.00 0.00 46.19 42.09 2k5u s LEU 25 CO 0.00 -0.90 1.24 -0.62 -1.32 0.00 0.00 176.35 174.75 2k5u s ASP 26 N -2.33 5.66 0.00 3.68 -1.08 -1.26 -2.57 116.67 118.77 2k5u s ASP 26 Ca 0.65 2.47 0.00 0.00 -0.52 0.00 0.00 52.55 55.15 2k5u s ASP 26 Cb -0.16 -2.61 0.00 0.00 -1.46 0.00 0.00 42.92 38.69 2k5u s ASP 26 CO 0.26 -1.28 0.00 0.61 0.52 0.00 0.00 175.17 175.29 2k5u n GLY 27 N 0.54 0.83 0.27 2.66 0.00 -1.26 -4.87 105.19 103.36 2k5u n GLY 27 Ca 0.10 0.00 0.09 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 1.93 0.00 4.61 0.00 -1.78 -3.45 119.26 120.57 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 0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2k5u h ALA 28 CO 0.00 -0.01 0.00 0.41 0.00 0.00 0.00 179.25 179.65 2k5u n GLY 29 N -1.51 0.91 0.14 0.00 0.00 -1.26 -4.13 105.19 99.34 2k5u n GLY 29 Ca -0.03 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.93 2k5u n GLY 29 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2k5u h LYS 30 N 0.00 0.19 -0.09 1.61 2.10 -1.92 -2.51 116.57 115.95 2k5u h LYS 30 Ca 0.00 -0.17 -0.00 0.00 -2.00 0.00 0.00 60.65 58.47 2k5u h LYS 30 Cb 0.00 0.04 -0.00 0.00 -0.90 0.00 0.00 32.23 31.37 2k5u h LYS 30 CO 0.00 0.86 0.04 1.15 -2.00 0.00 0.00 179.45 179.50 2k5u h THR 31 N 0.12 1.12 -0.31 0.07 2.02 -1.96 0.48 112.91 114.45 2k5u h THR 31 Ca -0.03 -0.35 -0.06 0.00 0.77 0.00 0.00 66.41 66.74 2k5u h THR 31 Cb 1.33 1.20 -0.01 0.00 -1.74 0.00 0.00 68.15 68.93 2k5u h THR 31 CO 0.11 0.10 -0.05 0.00 0.37 0.00 0.00 175.52 176.06 2k5u h THR 32 N 0.01 1.27 -0.47 3.16 1.03 -1.97 -2.94 112.91 113.00 2k5u h THR 32 Ca 0.03 -1.05 -0.09 0.00 -0.01 0.00 0.00 66.41 65.29 2k5u h THR 32 Cb 0.13 1.33 -0.02 0.00 -1.07 0.00 0.00 68.15 68.53 2k5u h THR 32 CO -0.00 0.34 -0.07 0.58 -0.01 0.00 0.00 175.52 176.36 2k5u h VAL 33 N 0.36 1.26 -0.19 0.00 2.07 -1.38 -2.80 116.25 115.56 2k5u h VAL 33 Ca 0.08 -1.13 0.05 0.00 0.82 0.00 0.00 66.70 66.52 2k5u h VAL 33 Cb 0.52 0.97 -0.05 0.00 -1.52 0.00 0.00 31.29 31.21 2k5u h VAL 33 CO 0.02 0.39 -0.10 0.25 0.02 0.00 0.00 177.57 178.15 2k5u h LEU 34 N 0.75 -0.35 -1.38 2.57 5.85 0.07 -0.97 115.31 121.86 2k5u h LEU 34 Ca 0.13 0.08 0.02 0.00 0.84 0.00 0.00 57.88 58.96 2k5u h LEU 34 Cb 0.56 0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.74 2k5u h LEU 34 CO 0.03 -0.14 0.44 1.88 -0.34 0.00 0.00 178.44 180.31 2k5u h TYR 35 N -0.09 0.79 -0.91 1.25 0.05 -1.41 -1.91 116.97 114.73 2k5u h TYR 35 Ca 0.11 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.90 2k5u h TYR 35 Cb 0.25 -0.26 -0.04 0.00 1.01 0.00 0.00 36.73 37.68 2k5u h TYR 35 CO -0.26 0.47 0.52 0.87 -1.05 0.00 0.00 178.16 178.71 2k5u h LYS 36 N 0.83 1.26 0.00 4.88 1.79 -0.94 -1.14 116.57 123.24 2k5u h LYS 36 Ca 0.26 -0.13 0.00 0.00 -2.18 0.00 0.00 60.65 58.59 2k5u h LYS 36 Cb 0.01 -0.25 0.00 0.00 -1.58 0.00 0.00 32.23 30.41 2k5u h LYS 36 CO -0.07 0.90 0.00 -0.11 -1.08 0.00 0.00 179.45 179.10 2k5u n LEU 37 N -4.35 0.41 0.00 2.94 7.94 -0.70 -4.87 117.00 118.37 2k5u n LEU 37 Ca 0.10 0.61 0.00 0.00 -1.11 0.00 0.00 56.01 55.61 2k5u n LEU 37 Cb 0.08 -0.56 0.00 0.00 0.53 0.00 0.00 43.42 43.47 2k5u n LEU 37 CO 0.38 -0.48 0.00 1.17 -1.11 0.00 0.00 177.39 177.36 2k5u n LYS 38 N -1.96 0.00 -1.55 1.96 0.00 -0.43 -4.51 118.16 111.67 2k5u n LYS 38 Ca 0.02 0.00 -0.00 0.00 0.00 0.00 0.00 58.31 58.33 2k5u n LYS 38 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.22 2k5u n LYS 38 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 2k5u n LEU 39 N 0.00 -2.22 0.00 3.14 0.00 -1.26 -4.95 117.00 111.71 2k5u n LEU 39 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 56.01 56.03 2k5u n LEU 39 Cb 0.00 -1.09 0.00 0.00 0.00 0.00 0.00 43.42 42.33 2k5u n LEU 39 CO 0.00 -0.09 0.00 0.61 0.00 0.00 0.00 177.39 177.91 2k5u n GLY 40 N -0.41 -0.41 3.48 -3.96 0.00 -1.26 -4.33 105.19 98.30 2k5u n GLY 40 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 3.09 -0.53 1.61 2.12 -1.21 -4.85 118.70 118.94 2k5u s GLU 41 Ca 0.00 -0.77 -0.27 0.00 0.36 0.00 0.00 54.97 54.29 2k5u s GLU 41 Cb 0.00 -3.98 -0.03 0.00 0.26 0.00 0.00 34.13 30.39 2k5u s GLU 41 CO 0.00 -0.87 1.92 0.08 -0.54 0.00 0.00 175.26 175.85 2k5u s VAL 42 N 2.15 3.34 -0.05 3.70 1.01 -1.26 -3.60 120.40 125.68 2k5u s VAL 42 Ca 0.12 0.24 0.06 0.00 0.00 0.00 0.00 61.98 62.40 2k5u s VAL 42 Cb -0.17 -3.75 -0.01 0.00 0.00 0.00 0.00 36.38 32.45 2k5u s VAL 42 CO 0.13 -0.68 -0.22 -0.63 0.00 0.00 0.00 175.10 173.71 2k5u s ILE 43 N 8.98 1.81 -0.18 2.22 -1.09 -0.84 -5.03 121.20 127.07 2k5u s ILE 43 Ca 0.74 -0.94 0.00 0.00 -2.23 0.00 0.00 60.65 58.23 2k5u s ILE 43 Cb -0.15 -1.53 0.04 0.00 -1.58 0.00 0.00 42.46 39.23 2k5u s ILE 43 CO 0.24 0.51 -0.09 -0.89 -1.23 0.00 0.00 174.94 173.49 2k5u s THR 44 N -0.14 1.41 0.22 2.92 2.01 -1.26 -2.51 115.64 118.29 2k5u s THR 44 Ca -0.02 -0.81 0.02 0.00 0.31 0.00 0.00 61.69 61.19 2k5u s THR 44 Cb -0.12 -1.51 -0.05 0.00 0.01 0.00 0.00 72.50 70.83 2k5u s THR 44 CO 0.03 0.18 0.05 0.28 -0.69 0.00 0.00 174.62 174.47 2k5u s THR 45 N 1.51 0.61 -0.10 -0.82 -1.32 -1.13 -5.06 115.64 109.32 2k5u s THR 45 Ca 0.00 -1.99 -0.01 0.00 -1.21 0.00 0.00 61.69 58.48 2k5u s THR 45 Cb -0.15 -2.41 0.03 0.00 -1.51 0.00 0.00 72.50 68.46 2k5u s THR 45 CO -0.08 -0.21 -0.02 -0.63 -2.21 0.00 0.00 174.62 171.47 2k5u s ILE 46 N -3.71 0.59 0.15 5.08 -1.09 -1.26 -2.74 121.20 118.22 2k5u s ILE 46 Ca 0.32 -0.10 -0.11 0.00 -2.23 0.00 0.00 60.65 58.53 2k5u s ILE 46 Cb 0.07 -0.75 0.02 0.00 -1.58 0.00 0.00 42.46 40.22 2k5u s ILE 46 CO 0.09 0.22 1.59 1.55 -1.23 0.00 0.00 174.94 177.17 2k5u h PRO 47 N 8.27 0.92 -1.68 2.79 0.13 -1.98 -3.48 132.00 136.98 2k5u h PRO 47 Ca -0.22 -0.32 0.23 0.00 -0.87 0.00 0.00 66.00 64.82 2k5u h PRO 47 Cb 1.12 -0.07 -0.17 0.00 0.13 0.00 0.00 31.00 32.01 2k5u h PRO 47 CO 0.31 0.97 0.73 -0.08 -0.23 0.00 0.00 178.00 179.70 2k5u s THR 48 N -4.94 0.00 0.00 1.56 -1.32 -1.26 -4.92 115.64 104.76 2k5u s THR 48 Ca -0.12 -0.06 0.00 0.00 -1.21 0.00 0.00 61.69 60.30 2k5u s THR 48 Cb 0.12 -1.16 0.00 0.00 -1.51 0.00 0.00 72.50 69.95 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 -0.19 0.00 -3.04 5.08 2.08 -1.26 -1.98 119.36 120.05 2k5u n ILE 49 Ca -0.03 0.00 -0.25 0.00 0.56 0.00 0.00 62.75 63.03 2k5u n ILE 49 Cb 0.60 0.00 -0.04 0.00 -0.75 0.00 0.00 39.64 39.44 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 4.99 3.36 7.39 0.00 -1.26 -5.05 105.19 114.62 2k5u n GLY 50 Ca 0.00 -2.48 -0.34 0.00 0.00 0.00 0.00 46.02 43.20 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 2.91 -0.27 1.61 2.19 -0.84 -5.09 117.98 115.40 2k5u s PHE 51 Ca 0.46 -0.75 -0.09 0.00 0.33 0.00 0.00 56.93 56.88 2k5u s PHE 51 Cb 0.29 -1.98 -0.03 0.00 -1.31 0.00 0.00 43.02 39.98 2k5u s PHE 51 CO -0.12 -0.35 0.12 1.21 1.83 0.00 0.00 175.22 177.91 2k5u s ASN 52 N 0.89 5.48 0.02 6.13 2.47 -1.26 -4.03 114.94 124.65 2k5u s ASN 52 Ca -0.02 -0.18 0.05 0.00 0.42 0.00 0.00 52.86 53.13 2k5u s ASN 52 Cb -0.15 -2.00 -0.02 0.00 -1.45 0.00 0.00 41.25 37.63 2k5u s ASN 52 CO 0.01 -0.06 -0.15 0.54 -3.72 0.00 0.00 177.10 173.72 2k5u s VAL 53 N 1.66 1.17 0.01 -5.21 0.11 -1.11 -4.82 120.40 112.21 2k5u s VAL 53 Ca 0.06 -0.89 0.05 0.00 -2.93 0.00 0.00 61.98 58.28 2k5u s VAL 53 Cb -0.16 -1.02 -0.03 0.00 -1.53 0.00 0.00 36.38 33.64 2k5u s VAL 53 CO 0.06 0.13 -0.15 -0.70 -3.33 0.00 0.00 175.10 171.11 2k5u s GLU 54 N -0.87 2.28 -0.01 1.54 2.12 -1.12 -2.85 118.70 119.78 2k5u s GLU 54 Ca 0.03 -0.86 0.01 0.00 0.36 0.00 0.00 54.97 54.52 2k5u s GLU 54 Cb -0.07 -2.29 0.00 0.00 0.26 0.00 0.00 34.13 32.03 2k5u s GLU 54 CO 0.01 0.57 -0.02 0.99 -0.54 0.00 0.00 175.26 176.27 2k5u s THR 55 N -0.88 0.23 -0.00 -1.70 2.01 -1.04 -2.49 115.64 111.76 2k5u s THR 55 Ca 0.14 -0.09 -0.03 0.00 0.31 0.00 0.00 61.69 62.02 2k5u s THR 55 Cb -0.11 -0.22 -0.00 0.00 0.01 0.00 0.00 72.50 72.18 2k5u s THR 55 CO 0.04 0.08 0.07 0.68 -0.69 0.00 0.00 174.62 174.80 2k5u s VAL 56 N 0.16 0.06 -0.04 3.82 -7.23 -0.11 -1.99 120.40 115.08 2k5u s VAL 56 Ca -0.01 -0.53 0.07 0.00 -1.81 0.00 0.00 61.98 59.70 2k5u s VAL 56 Cb -0.04 -0.27 -0.02 0.00 0.56 0.00 0.00 36.38 36.61 2k5u s VAL 56 CO -0.00 -0.29 -0.25 -1.58 -0.31 0.00 0.00 175.10 172.66 2k5u s GLN 57 N -0.93 2.26 -0.36 4.82 0.74 -1.26 -1.17 119.66 123.76 2k5u s GLN 57 Ca -0.10 -0.90 0.00 0.00 0.05 0.00 0.00 55.36 54.41 2k5u s GLN 57 Cb -0.06 -2.06 0.12 0.00 1.10 0.00 0.00 33.01 32.11 2k5u s GLN 57 CO 0.00 0.47 0.15 0.71 -0.55 0.00 0.00 175.29 176.08 2k5u s TYR 58 N -0.41 1.75 0.00 1.67 2.02 -0.62 -3.29 117.35 118.47 2k5u s TYR 58 Ca 0.04 -1.98 0.00 0.00 -0.37 0.00 0.00 57.07 54.76 2k5u s TYR 58 Cb -0.11 -1.73 0.00 0.00 -0.40 0.00 0.00 41.96 39.71 2k5u s TYR 58 CO 0.01 -0.84 0.00 1.63 -1.57 0.00 0.00 175.55 174.78 2k5u n LYS 59 N 4.33 0.00 0.00 -0.62 5.02 -1.26 -1.33 118.16 124.29 2k5u n LYS 59 Ca 0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 2k5u n LYS 59 Cb 0.39 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.40 2k5u n LYS 59 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2k5u n ASN 60 N 1.70 3.89 -4.69 4.39 3.02 -1.26 -5.02 115.26 117.30 2k5u n ASN 60 Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.13 2k5u n ASN 60 Cb 0.00 0.10 -0.03 0.00 -0.61 0.00 0.00 39.78 39.24 2k5u n ASN 60 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 2k5u s ILE 61 N -1.92 4.67 0.22 2.41 -1.16 -0.44 -4.78 121.20 120.19 2k5u s ILE 61 Ca 0.00 1.95 0.03 0.00 -0.51 0.00 0.00 60.65 62.11 2k5u s ILE 61 Cb 0.00 -4.25 -0.03 0.00 0.61 0.00 0.00 42.46 38.79 2k5u s ILE 61 CO 0.00 -0.00 0.36 -0.44 -2.81 0.00 0.00 174.94 172.05 2k5u s SER 62 N 1.18 6.33 -0.04 4.50 0.01 -1.04 -1.59 113.70 123.05 2k5u s SER 62 Ca 0.50 0.20 -0.03 0.00 1.31 0.00 0.00 55.95 57.92 2k5u s SER 62 Cb -0.20 -1.92 0.01 0.00 0.21 0.00 0.00 66.02 64.13 2k5u s SER 62 CO 0.18 -0.05 0.10 0.12 0.41 0.00 0.00 173.24 174.00 2k5u s PHE 63 N -1.93 -0.11 -0.08 2.43 2.19 -0.32 -1.27 117.98 118.89 2k5u s PHE 63 Ca 0.36 0.29 -0.05 0.00 0.33 0.00 0.00 56.93 57.86 2k5u s PHE 63 Cb -0.10 0.03 0.03 0.00 -1.31 0.00 0.00 43.02 41.67 2k5u s PHE 63 CO 0.30 -0.06 0.19 0.95 1.83 0.00 0.00 175.22 178.42 2k5u s THR 64 N 0.14 -0.03 -0.01 0.12 -4.23 -1.06 -0.93 115.64 109.65 2k5u s THR 64 Ca -0.01 0.12 0.05 0.00 -1.18 0.00 0.00 61.69 60.67 2k5u s THR 64 Cb -0.02 -0.29 -0.03 0.00 1.34 0.00 0.00 72.50 73.50 2k5u s THR 64 CO -0.00 0.05 -0.15 0.54 -0.54 0.00 0.00 174.62 174.51 2k5u s VAL 65 N 0.88 2.99 -0.27 2.29 0.11 -1.04 -0.85 120.40 124.51 2k5u s VAL 65 Ca -0.07 -0.93 -0.27 0.00 -2.93 0.00 0.00 61.98 57.79 2k5u s VAL 65 Cb -0.08 -2.22 0.16 0.00 -1.53 0.00 0.00 36.38 32.72 2k5u s VAL 65 CO -0.05 0.47 1.25 -1.66 -3.33 0.00 0.00 175.10 171.78 2k5u s TRP 66 N -0.84 -0.21 0.68 1.54 -2.14 -1.16 -2.79 118.94 114.03 2k5u s TRP 66 Ca 0.13 0.47 -0.09 0.00 2.66 0.00 0.00 56.10 59.28 2k5u s TRP 66 Cb -0.11 0.45 0.03 0.00 -3.10 0.00 0.00 33.47 30.74 2k5u s TRP 66 CO 0.03 -0.13 1.03 0.16 -2.66 0.00 0.00 176.95 175.38 2k5u s ASP 67 N -0.28 5.25 0.01 -2.66 1.47 -1.26 -4.43 116.67 114.77 2k5u s ASP 67 Ca 0.05 0.81 -0.19 0.00 1.18 0.00 0.00 52.55 54.41 2k5u s ASP 67 Cb -0.04 -1.61 0.04 0.00 -0.34 0.00 0.00 42.92 40.97 2k5u s ASP 67 CO -0.09 -1.37 0.42 -0.69 0.68 0.00 0.00 175.17 174.12 2k5u s VAL 68 N -3.24 0.05 0.00 2.11 1.01 -0.89 -4.92 120.40 114.52 2k5u s VAL 68 Ca 0.58 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 62.17 2k5u s VAL 68 Cb -0.11 -0.85 0.00 0.00 0.00 0.00 0.00 36.38 35.43 2k5u s VAL 68 CO 0.48 -0.21 0.00 0.61 0.00 0.00 0.00 175.10 175.97 2k5u n GLY 69 N 0.83 0.13 0.15 4.51 0.00 -1.26 -4.26 105.19 105.28 2k5u n GLY 69 Ca -0.20 -0.89 -0.14 0.00 0.00 0.00 0.00 46.02 44.80 2k5u n GLY 69 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2k5u h GLY 70 N 0.00 -0.29 1.83 -0.02 0.00 -2.00 -2.47 103.07 100.11 2k5u h GLY 70 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.44 2k5u h GLY 70 CO 0.00 -0.11 0.08 0.06 0.00 0.00 0.00 176.54 176.58 2k5u h GLN 71 N -0.48 0.00 -6.90 4.80 3.07 -2.03 -3.42 115.11 110.15 2k5u h GLN 71 Ca -0.03 0.00 -0.47 0.00 0.09 0.00 0.00 58.65 58.24 2k5u h GLN 71 Cb 0.36 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.91 2k5u h GLN 71 CO 0.05 0.00 0.36 -0.51 0.09 0.00 0.00 178.83 178.82 2k5u s ASP 72 N -4.90 7.24 0.61 0.06 1.01 -0.93 -5.07 116.67 114.69 2k5u s ASP 72 Ca -0.04 1.88 0.01 0.00 0.71 0.00 0.00 52.55 55.10 2k5u s ASP 72 Cb 0.11 -2.58 0.10 0.00 1.01 0.00 0.00 42.92 41.56 2k5u s ASP 72 CO 0.36 -0.14 0.68 -2.11 0.21 0.00 0.00 175.17 174.17 2k5u n ARG 73 N 0.45 0.17 -4.24 8.23 1.85 -1.26 -4.79 116.66 117.08 2k5u n ARG 73 Ca 0.02 -1.92 -0.16 0.00 -1.00 0.00 0.00 57.85 54.79 2k5u n ARG 73 Cb 0.50 -0.43 -0.09 0.00 -1.05 0.00 0.00 32.46 31.39 2k5u n ARG 73 CO 0.00 0.00 0.00 0.96 -0.01 0.00 0.00 177.63 178.58 2k5u s ILE 74 N -2.02 0.00 0.00 8.89 -0.00 -1.26 -5.00 121.20 121.81 2k5u s ILE 74 Ca 0.46 -1.99 0.00 0.00 -0.00 0.00 0.00 60.65 59.12 2k5u s ILE 74 Cb -0.03 -2.50 0.00 0.00 -0.00 0.00 0.00 42.46 39.93 2k5u s ILE 74 CO 0.30 0.00 0.00 -1.14 -0.00 0.00 0.00 174.94 174.10 2k5u n ARG 75 N -0.46 0.00 0.00 0.37 3.00 -1.26 -5.05 116.66 113.26 2k5u n ARG 75 Ca 0.05 0.00 0.06 0.00 -0.00 0.00 0.00 57.85 57.96 2k5u n ARG 75 Cb 0.64 0.00 -0.05 0.00 0.00 0.00 0.00 32.46 33.05 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 0.00 0.95 0.05 6.15 2.88 -1.26 -4.48 113.62 117.91 2k5u n SER 76 Ca 0.00 -0.97 -0.21 0.00 -1.33 0.00 0.00 58.87 56.36 2k5u n SER 76 Cb 0.00 0.80 -0.11 0.00 -0.75 0.00 0.00 64.21 64.15 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 0.59 0.91 -1.02 2.46 5.85 -1.97 -2.93 115.31 119.20 2k5u h LEU 77 Ca 0.00 -0.76 -0.08 0.00 0.84 0.00 0.00 57.88 57.88 2k5u h LEU 77 Cb 0.37 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 2k5u h LEU 77 CO 0.00 1.56 -0.19 4.11 -0.34 0.00 0.00 178.44 183.58 2k5u h TRP 78 N 0.37 0.53 -0.03 1.25 5.08 -2.00 -2.97 115.95 118.18 2k5u h TRP 78 Ca -0.15 -0.10 -0.01 0.00 1.08 0.00 0.00 58.89 59.72 2k5u h TRP 78 Cb 1.75 -0.14 -0.00 0.00 -3.00 0.00 0.00 29.16 27.78 2k5u h TRP 78 CO 0.11 0.65 -0.01 -0.09 -1.28 0.00 0.00 178.44 177.82 2k5u h ARG 79 N 0.44 0.05 -0.19 0.12 9.65 -1.78 -0.18 114.38 122.50 2k5u h ARG 79 Ca 0.07 -0.02 0.05 0.00 -1.10 0.00 0.00 59.98 58.98 2k5u h ARG 79 Cb 0.58 -0.00 -0.07 0.00 -1.39 0.00 0.00 29.97 29.09 2k5u h ARG 79 CO 0.04 0.39 -0.39 0.45 2.80 0.00 0.00 179.97 183.27 2k5u h HIS 80 N -0.29 -1.10 0.00 2.20 3.86 -1.44 0.79 115.15 119.17 2k5u h HIS 80 Ca 0.01 0.05 -0.02 0.00 -1.16 0.00 0.00 60.37 59.24 2k5u h HIS 80 Cb 0.37 0.51 -0.00 0.00 1.06 0.00 0.00 27.41 29.35 2k5u h HIS 80 CO 0.05 -0.44 -0.10 1.88 0.86 0.00 0.00 177.93 180.17 2k5u h TYR 81 N -0.43 0.00 0.54 2.45 0.05 -1.57 -3.17 116.97 114.85 2k5u h TYR 81 Ca 0.10 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.86 2k5u h TYR 81 Cb 0.59 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.32 2k5u h TYR 81 CO -0.49 0.10 -0.46 -0.92 -1.05 0.00 0.00 178.16 175.35 2k5u h TYR 82 N 0.00 -1.26 -0.22 4.88 3.20 0.11 0.27 116.97 123.95 2k5u h TYR 82 Ca -0.00 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 2k5u h TYR 82 Cb 0.52 0.48 -0.01 0.00 1.54 0.00 0.00 36.73 39.26 2k5u h TYR 82 CO 0.00 -0.63 0.12 -0.09 -1.64 0.00 0.00 178.16 175.92 2k5u h ARG 83 N -0.98 0.31 -0.30 1.82 2.43 -1.56 -2.28 114.38 113.83 2k5u h ARG 83 Ca -0.07 -0.04 0.09 0.00 -0.81 0.00 0.00 59.98 59.15 2k5u h ARG 83 Cb 0.82 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.30 2k5u h ARG 83 CO -0.01 0.29 0.27 -0.91 -1.51 0.00 0.00 179.97 178.10 2k5u h ASN 84 N 0.25 0.00 -3.96 -3.80 4.21 -1.50 -3.42 115.58 107.37 2k5u h ASN 84 Ca 0.08 0.00 -0.53 0.00 1.21 0.00 0.00 56.30 57.06 2k5u h ASN 84 Cb 0.07 0.00 0.09 0.00 -1.12 0.00 0.00 38.32 37.36 2k5u h ASN 84 CO -0.01 0.00 0.61 -0.89 -1.29 0.00 0.00 177.43 175.85 2k5u s THR 85 N -4.80 2.58 0.00 2.81 2.01 0.94 -4.79 115.64 114.39 2k5u s THR 85 Ca -0.05 0.51 0.00 0.00 0.31 0.00 0.00 61.69 62.46 2k5u s THR 85 Cb 0.17 -3.30 0.00 0.00 0.01 0.00 0.00 72.50 69.38 2k5u s THR 85 CO 0.62 0.07 0.47 -0.62 -0.69 0.00 0.00 174.62 174.47 2k5u n GLU 86 N 0.04 0.23 -3.68 4.92 -0.58 -0.89 -4.84 120.64 115.84 2k5u n GLU 86 Ca 0.04 -0.58 -0.26 0.00 -0.42 0.00 0.00 57.16 55.94 2k5u n GLU 86 Cb 0.44 -0.80 -0.17 0.00 -0.57 0.00 0.00 31.44 30.34 2k5u n GLU 86 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 2k5u s GLY 87 N -0.21 0.53 -0.34 0.62 0.00 0.52 -4.11 107.32 104.33 2k5u s GLY 87 Ca 0.00 -0.47 -0.08 0.00 0.00 0.00 0.00 44.72 44.17 2k5u s GLY 87 CO 0.00 1.54 0.14 0.14 0.00 0.00 0.00 173.10 174.92 2k5u s VAL 88 N 1.99 4.16 -0.22 1.40 1.01 -0.94 -0.09 120.40 127.72 2k5u s VAL 88 Ca 0.01 -0.90 0.02 0.00 0.00 0.00 0.00 61.98 61.10 2k5u s VAL 88 Cb -0.16 -3.28 0.05 0.00 0.00 0.00 0.00 36.38 32.98 2k5u s VAL 88 CO -0.08 -0.13 -0.11 -0.63 0.00 0.00 0.00 175.10 174.15 2k5u s ILE 89 N 1.49 1.84 -0.16 2.22 -1.09 -1.08 -1.98 121.20 122.45 2k5u s ILE 89 Ca 0.01 -1.24 -0.17 0.00 -2.23 0.00 0.00 60.65 57.02 2k5u s ILE 89 Cb -0.19 -1.93 -0.04 0.00 -1.58 0.00 0.00 42.46 38.72 2k5u s ILE 89 CO 0.04 0.11 0.43 0.12 -1.23 0.00 0.00 174.94 174.40 2k5u s PHE 90 N 1.29 3.45 -0.12 3.97 2.19 0.21 -2.43 117.98 126.53 2k5u s PHE 90 Ca -0.04 0.75 0.01 0.00 0.33 0.00 0.00 56.93 57.98 2k5u s PHE 90 Cb -0.17 -2.52 0.02 0.00 -1.31 0.00 0.00 43.02 39.04 2k5u s PHE 90 CO -0.07 0.11 -0.12 0.08 1.83 0.00 0.00 175.22 177.04 2k5u s VAL 91 N 0.88 1.35 0.35 3.12 1.01 -1.08 -0.93 120.40 125.11 2k5u s VAL 91 Ca 0.22 -0.52 0.09 0.00 0.00 0.00 0.00 61.98 61.78 2k5u s VAL 91 Cb -0.15 -1.29 -0.06 0.00 0.00 0.00 0.00 36.38 34.89 2k5u s VAL 91 CO 0.08 0.42 -0.02 0.54 0.00 0.00 0.00 175.10 176.12 2k5u s VAL 92 N 1.40 2.42 -0.15 2.92 0.11 -1.08 -4.27 120.40 121.74 2k5u s VAL 92 Ca 0.01 -2.05 -0.21 0.00 -2.93 0.00 0.00 61.98 56.80 2k5u s VAL 92 Cb -0.13 -2.77 -0.03 0.00 -1.53 0.00 0.00 36.38 31.92 2k5u s VAL 92 CO -0.07 -0.18 0.64 -1.81 -3.33 0.00 0.00 175.10 170.35 2k5u s ASP 93 N -3.68 6.78 0.39 3.54 1.11 -1.26 -2.74 116.67 120.82 2k5u s ASP 93 Ca 0.34 0.95 0.27 0.00 0.18 0.00 0.00 52.55 54.29 2k5u s ASP 93 Cb 0.02 -2.36 0.93 0.00 1.07 0.00 0.00 42.92 42.58 2k5u s ASP 93 CO 0.18 -0.20 1.79 -1.28 1.18 0.00 0.00 175.17 176.85 2k5u h SER 94 N 7.16 0.00 -0.28 0.27 0.87 -1.84 -2.93 113.55 116.80 2k5u h SER 94 Ca -0.35 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.21 2k5u h SER 94 Cb 1.16 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.12 2k5u h SER 94 CO 0.77 0.00 0.00 -3.20 -0.53 0.00 0.00 176.83 173.87 2k5u n ASN 95 N -2.74 3.12 -3.39 6.23 4.05 -1.26 -1.07 115.26 120.20 2k5u n ASN 95 Ca 0.03 -1.91 -0.31 0.00 0.45 0.00 0.00 54.58 52.83 2k5u n ASN 95 Cb 0.36 -0.18 -0.04 0.00 1.23 0.00 0.00 39.78 41.15 2k5u n ASN 95 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 177.26 173.31 2k5u n ASP 96 N 1.24 4.87 -0.28 1.20 5.75 -1.10 -4.83 116.55 123.38 2k5u n ASP 96 Ca 0.16 -3.55 -0.06 0.00 -0.01 0.00 0.00 54.79 51.33 2k5u n ASP 96 Cb 0.54 -0.79 0.06 0.00 -1.03 0.00 0.00 41.12 39.90 2k5u n ASP 96 CO 0.00 0.00 0.00 0.08 -0.11 0.00 0.00 177.20 177.17 2k5u h ARG 97 N 4.01 1.18 -0.00 0.11 0.11 -1.81 -1.35 114.38 116.63 2k5u h ARG 97 Ca 0.22 -0.24 0.00 0.00 0.10 0.00 0.00 59.98 60.07 2k5u h ARG 97 Cb 0.56 -0.18 -0.00 0.00 1.11 0.00 0.00 29.97 31.46 2k5u h ARG 97 CO 0.96 0.98 0.16 0.77 0.10 0.00 0.00 179.97 182.94 2k5u h SER 98 N 1.14 0.00 -0.03 0.08 0.02 -1.97 0.12 113.55 112.91 2k5u h SER 98 Ca 0.25 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.20 2k5u h SER 98 Cb 0.27 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.81 2k5u h SER 98 CO -0.01 0.00 0.00 0.54 -1.14 0.00 0.00 176.83 176.22 2k5u n ARG 99 N -3.01 0.25 -0.09 3.45 1.74 -0.78 -4.62 116.66 113.60 2k5u n ARG 99 Ca -0.02 -0.98 0.07 0.00 -0.77 0.00 0.00 57.85 56.15 2k5u n ARG 99 Cb 0.22 -1.11 0.42 0.00 -1.02 0.00 0.00 32.46 30.97 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 1.08 1.01 -0.28 0.55 6.09 0.13 0.87 117.51 126.95 2k5u h ILE 100 Ca 0.00 -0.20 -0.11 0.00 -1.37 0.00 0.00 64.86 63.18 2k5u h ILE 100 Cb 0.29 0.38 -0.01 0.00 0.47 0.00 0.00 36.82 37.95 2k5u h ILE 100 CO 0.00 0.11 -0.29 1.23 -3.07 0.00 0.00 178.15 176.13 2k5u h GLY 101 N 0.58 0.61 1.23 8.18 0.00 -1.82 -1.59 103.07 110.26 2k5u h GLY 101 Ca 0.25 -0.54 -0.03 0.00 0.00 0.00 0.00 47.33 47.02 2k5u h GLY 101 CO -0.07 0.49 0.33 0.83 0.00 0.00 0.00 176.54 178.11 2k5u h GLU 102 N 0.49 1.00 -0.36 4.80 4.39 -1.16 -1.10 114.58 122.64 2k5u h GLU 102 Ca 0.06 -0.14 -0.10 0.00 0.34 0.00 0.00 59.36 59.52 2k5u h GLU 102 Cb 0.75 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 29.20 2k5u h GLU 102 CO 0.06 0.77 -0.18 0.00 -1.16 0.00 0.00 179.01 178.50 2k5u h ALA 103 N 1.37 0.51 -0.46 3.43 0.00 -0.93 -2.44 119.26 120.74 2k5u h ALA 103 Ca 0.24 -0.36 0.02 0.00 0.00 0.00 0.00 54.91 54.82 2k5u h ALA 103 Cb 0.11 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2k5u h ALA 103 CO -0.03 0.45 0.26 -0.09 0.00 0.00 0.00 179.25 179.84 2k5u h ARG 104 N 0.55 0.51 -0.42 0.00 2.43 -0.71 0.05 114.38 116.80 2k5u h ARG 104 Ca 0.08 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.20 2k5u h ARG 104 Cb 0.73 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.14 2k5u h ARG 104 CO 0.05 0.34 0.19 0.93 -1.51 0.00 0.00 179.97 179.98 2k5u h GLU 105 N 0.53 0.62 -0.82 0.20 5.08 -1.17 0.38 114.58 119.39 2k5u h GLU 105 Ca 0.19 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 2k5u h GLU 105 Cb 0.03 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.13 2k5u h GLU 105 CO -0.09 0.54 0.47 0.28 -1.00 0.00 0.00 179.01 179.21 2k5u h VAL 106 N 0.54 1.24 -0.38 3.13 2.07 -1.14 -1.30 116.25 120.40 2k5u h VAL 106 Ca 0.14 -0.56 -0.13 0.00 0.82 0.00 0.00 66.70 66.97 2k5u h VAL 106 Cb 0.14 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.02 2k5u h VAL 106 CO -0.02 0.26 -0.28 -0.03 0.02 0.00 0.00 177.57 177.53 2k5u h MET 107 N 1.14 0.80 -0.33 1.57 1.85 -0.61 -1.51 114.93 117.84 2k5u h MET 107 Ca 0.29 -0.36 0.00 0.00 -0.61 0.00 0.00 59.70 59.03 2k5u h MET 107 Cb 0.00 -0.02 -0.02 0.00 0.43 0.00 0.00 31.60 31.99 2k5u h MET 107 CO -0.05 0.98 0.21 1.96 -0.40 0.00 0.00 176.91 179.62 2k5u h GLN 108 N 0.69 0.44 -0.28 0.39 1.08 0.42 0.26 115.11 118.12 2k5u h GLN 108 Ca 0.08 -0.03 -0.16 0.00 -1.45 0.00 0.00 58.65 57.09 2k5u h GLN 108 Cb 0.81 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 28.14 2k5u h GLN 108 CO 0.07 0.31 -0.46 -0.09 -0.95 0.00 0.00 178.83 177.71 2k5u h ARG 109 N 0.44 0.72 -0.33 1.46 1.12 -1.22 -2.81 114.38 113.77 2k5u h ARG 109 Ca 0.12 -0.41 -0.06 0.00 -1.11 0.00 0.00 59.98 58.52 2k5u h ARG 109 Cb -0.03 0.03 -0.01 0.00 -0.01 0.00 0.00 29.97 29.95 2k5u h ARG 109 CO -0.02 1.03 -0.02 0.52 -3.11 0.00 0.00 179.97 178.37 2k5u h MET 110 N 0.58 0.59 0.00 0.20 2.86 -0.97 -2.66 114.93 115.52 2k5u h MET 110 Ca 0.03 -0.20 0.00 0.00 -2.06 0.00 0.00 59.70 57.48 2k5u h MET 110 Cb 1.02 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.63 2k5u h MET 110 CO 0.10 0.73 0.00 -0.11 1.06 0.00 0.00 176.91 178.69 2k5u n LEU 111 N -4.51 0.61 -0.01 1.22 0.00 0.90 -2.19 117.00 113.02 2k5u n LEU 111 Ca -0.02 0.67 0.10 0.00 0.00 0.00 0.00 56.01 56.76 2k5u n LEU 111 Cb 0.28 -0.62 0.61 0.00 0.00 0.00 0.00 43.42 43.69 2k5u n LEU 111 CO 0.40 -0.61 0.89 -0.46 0.00 0.00 0.00 177.39 177.60 2k5u n ASN 112 N -2.20 0.02 -4.60 1.96 0.23 -1.00 -4.77 115.26 104.90 2k5u n ASN 112 Ca 0.02 -1.36 -0.43 0.00 -0.53 0.00 0.00 54.58 52.27 2k5u n ASN 112 Cb 0.19 -0.00 -0.02 0.00 -2.08 0.00 0.00 39.78 37.87 2k5u n ASN 112 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 2k5u s GLU 113 N -2.00 3.74 0.47 -3.83 0.41 -0.93 -4.89 118.70 111.67 2k5u s GLU 113 Ca 0.31 0.68 0.20 0.00 -0.41 0.00 0.00 54.97 55.75 2k5u s GLU 113 Cb 0.14 -3.91 1.19 0.00 -1.78 0.00 0.00 34.13 29.77 2k5u s GLU 113 CO 0.24 -1.36 1.93 0.22 -0.49 0.00 0.00 175.26 175.80 2k5u h ASP 114 N 9.35 0.24 0.84 -0.19 3.58 -1.91 0.43 116.42 128.76 2k5u h ASP 114 Ca -0.24 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.23 2k5u h ASP 114 Cb 1.07 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 42.09 2k5u h ASP 114 CO 1.11 0.12 0.00 -0.62 -2.88 0.00 0.00 179.24 176.97 2k5u n GLU 115 N -4.43 0.10 -0.08 0.28 1.02 -1.26 -2.54 120.64 113.72 2k5u n GLU 115 Ca 0.14 0.24 0.04 0.00 -0.02 0.00 0.00 57.16 57.57 2k5u n GLU 115 Cb 0.61 -1.66 0.09 0.00 -0.02 0.00 0.00 31.44 30.45 2k5u n GLU 115 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2k5u n LEU 116 N -1.85 2.31 0.30 -4.62 7.99 0.14 -4.58 117.00 116.70 2k5u n LEU 116 Ca 0.04 -1.56 0.17 0.00 -0.01 0.00 0.00 56.01 54.65 2k5u n LEU 116 Cb 0.27 -0.11 0.92 0.00 -0.11 0.00 0.00 43.42 44.40 2k5u n LEU 116 CO 0.21 0.54 1.08 -0.09 -1.51 0.00 0.00 177.39 177.61 2k5u h ARG 117 N 1.69 0.00 -0.48 3.23 2.43 -1.08 -1.64 114.38 118.54 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 0.55 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 2k5u h ARG 117 CO 0.00 0.04 0.00 0.27 -1.51 0.00 0.00 179.97 178.77 2k5u n ASN 118 N -3.39 3.33 -4.84 -3.80 0.23 -1.26 -4.98 115.26 100.55 2k5u n ASN 118 Ca -0.02 -1.96 -0.35 0.00 -0.53 0.00 0.00 54.58 51.72 2k5u n ASN 118 Cb 0.17 -0.32 -0.06 0.00 -2.08 0.00 0.00 39.78 37.49 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 -1.07 3.50 -0.06 -2.53 0.00 -0.62 -5.04 121.76 115.95 2k5u s ALA 119 Ca 0.35 -0.03 -0.30 0.00 0.00 0.00 0.00 51.96 51.98 2k5u s ALA 119 Cb 0.19 -2.64 -0.03 0.00 0.00 0.00 0.00 23.12 20.63 2k5u s ALA 119 CO 0.25 0.41 1.25 0.00 0.00 0.00 0.00 175.76 177.66 2k5u s ALA 120 N -1.56 3.53 -0.10 0.00 0.00 -1.26 -4.92 121.76 117.45 2k5u s ALA 120 Ca 0.42 0.65 -0.00 0.00 0.00 0.00 0.00 51.96 53.02 2k5u s ALA 120 Cb -0.15 -3.54 -0.02 0.00 0.00 0.00 0.00 23.12 19.40 2k5u s ALA 120 CO 0.20 -0.85 -0.09 -0.46 0.00 0.00 0.00 175.76 174.57 2k5u s TRP 121 N 2.42 2.90 -0.00 0.00 -0.11 -1.11 -2.21 118.94 120.83 2k5u s TRP 121 Ca 0.57 -0.24 0.01 0.00 1.22 0.00 0.00 56.10 57.66 2k5u s TRP 121 Cb -0.25 -1.80 -0.00 0.00 -1.50 0.00 0.00 33.47 29.92 2k5u s TRP 121 CO 0.22 0.09 -0.03 -1.17 -4.62 0.00 0.00 176.95 171.43 2k5u s LEU 122 N -0.22 2.01 -0.11 5.86 1.98 -0.83 -2.68 118.68 124.68 2k5u s LEU 122 Ca 0.02 -0.06 -0.01 0.00 -2.89 0.00 0.00 54.13 51.20 2k5u s LEU 122 Cb -0.13 -0.16 -0.03 0.00 0.66 0.00 0.00 46.19 46.53 2k5u s LEU 122 CO 0.03 0.04 -0.07 -0.69 -1.89 0.00 0.00 176.35 173.77 2k5u s VAL 123 N -0.08 3.69 -0.06 1.68 1.01 0.12 0.63 120.40 127.39 2k5u s VAL 123 Ca 0.01 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.55 2k5u s VAL 123 Cb -0.01 -2.55 0.01 0.00 0.00 0.00 0.00 36.38 33.83 2k5u s VAL 123 CO -0.00 0.55 -0.12 -0.36 0.00 0.00 0.00 175.10 175.17 2k5u s PHE 124 N -0.27 1.47 -0.24 5.22 0.08 -0.10 -2.31 117.98 121.83 2k5u s PHE 124 Ca 0.04 -0.54 -0.17 0.00 0.12 0.00 0.00 56.93 56.38 2k5u s PHE 124 Cb -0.13 -1.07 -0.03 0.00 -0.57 0.00 0.00 43.02 41.22 2k5u s PHE 124 CO 0.02 -0.27 0.46 0.00 -0.10 0.00 0.00 175.22 175.33 2k5u s ALA 125 N 0.64 3.57 -0.29 5.36 0.00 0.36 -2.65 121.76 128.74 2k5u s ALA 125 Ca -0.14 -0.61 -0.00 0.00 0.00 0.00 0.00 51.96 51.21 2k5u s ALA 125 Cb -0.16 -2.78 0.06 0.00 0.00 0.00 0.00 23.12 20.24 2k5u s ALA 125 CO 0.04 -0.58 -0.03 -0.80 0.00 0.00 0.00 175.76 174.39 2k5u s ASN 126 N 1.40 4.76 0.00 0.00 0.01 -1.11 0.29 114.94 120.29 2k5u s ASN 126 Ca 0.20 -1.35 0.00 0.00 -0.71 0.00 0.00 52.86 51.00 2k5u s ASN 126 Cb -0.15 -1.66 0.00 0.00 0.41 0.00 0.00 41.25 39.84 2k5u s ASN 126 CO 0.09 -0.25 0.00 0.29 -1.51 0.00 0.00 177.10 175.72 2k5u n LYS 127 N 4.55 0.00 0.08 -0.60 5.02 -0.74 -2.82 118.16 123.66 2k5u n LYS 127 Ca -0.13 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.28 2k5u n LYS 127 Cb 0.43 0.00 0.45 0.00 -0.02 0.00 0.00 35.03 35.89 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 0.15 0.18 1.97 3.00 0.68 -2.48 117.38 120.89 2k5u n GLN 128 Ca 0.00 0.29 0.06 0.00 -0.01 0.00 0.00 57.00 57.34 2k5u n GLN 128 Cb 0.00 -1.74 0.24 0.00 0.00 0.00 0.00 30.24 28.73 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 -3.58 1.08 3.04 -1.93 -3.45 116.42 111.58 2k5u h ASP 129 Ca 0.00 0.00 -0.52 0.00 -3.24 0.00 0.00 57.03 53.27 2k5u h ASP 129 Cb 0.46 0.00 0.06 0.00 -1.04 0.00 0.00 39.33 38.81 2k5u h ASP 129 CO 0.00 0.34 0.70 -0.76 -2.04 0.00 0.00 179.24 177.48 2k5u s LEU 130 N -6.63 4.40 0.48 0.15 1.43 -1.03 -4.92 118.68 112.56 2k5u s LEU 130 Ca 0.02 2.65 0.26 0.00 -1.03 0.00 0.00 54.13 56.03 2k5u s LEU 130 Cb 0.09 -3.63 1.14 0.00 0.03 0.00 0.00 46.19 43.82 2k5u s LEU 130 CO 0.69 -0.62 1.92 1.55 0.23 0.00 0.00 176.35 180.12 2k5u h PRO 131 N 4.41 0.00 -0.36 1.29 0.13 -1.89 -2.86 132.00 132.72 2k5u h PRO 131 Ca -0.47 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.57 2k5u h PRO 131 Cb 1.22 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.30 2k5u h PRO 131 CO 0.73 0.17 0.03 -0.85 -0.23 0.00 0.00 178.00 177.84 2k5u n GLU 132 N -3.41 2.72 -3.18 0.86 0.00 -1.26 -5.01 120.64 111.36 2k5u n GLU 132 Ca -0.00 -2.97 -0.34 0.00 0.00 0.00 0.00 57.16 53.84 2k5u n GLU 132 Cb 0.36 -1.89 -0.06 0.00 0.00 0.00 0.00 31.44 29.84 2k5u n GLU 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2k5u s ALA 133 N -2.98 3.42 0.44 -1.84 0.00 -1.08 -4.83 121.76 114.88 2k5u s ALA 133 Ca 0.45 0.04 -0.22 0.00 0.00 0.00 0.00 51.96 52.22 2k5u s ALA 133 Cb 0.38 -2.72 -0.09 0.00 0.00 0.00 0.00 23.12 20.68 2k5u s ALA 133 CO 0.07 0.36 1.04 -1.64 0.00 0.00 0.00 175.76 175.60 2k5u s MET 134 N -2.43 3.99 0.49 0.00 -1.94 -0.23 -4.99 119.30 114.19 2k5u s MET 134 Ca 0.47 1.43 -0.08 0.00 -1.71 0.00 0.00 55.69 55.80 2k5u s MET 134 Cb -0.13 -2.32 -0.05 0.00 2.01 0.00 0.00 34.83 34.34 2k5u s MET 134 CO 0.19 -0.28 0.84 -1.12 -0.01 0.00 0.00 175.02 174.65 2k5u s SER 135 N -1.77 6.34 0.39 3.03 0.01 -1.26 -4.85 113.70 115.59 2k5u s SER 135 Ca 0.62 1.11 0.11 0.00 1.31 0.00 0.00 55.95 59.11 2k5u s SER 135 Cb -0.19 -2.33 0.91 0.00 0.21 0.00 0.00 66.02 64.62 2k5u s SER 135 CO 0.24 -0.59 1.93 0.00 0.41 0.00 0.00 173.24 175.22 2k5u h ALA 136 N 0.41 1.92 0.04 1.44 0.00 -1.96 0.37 119.26 121.48 2k5u h ALA 136 Ca -0.46 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 2k5u h ALA 136 Cb 1.20 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2k5u h ALA 136 CO 0.62 -0.09 -0.02 0.00 0.00 0.00 0.00 179.25 179.76 2k5u h ALA 137 N 1.63 -0.05 -0.20 0.00 0.00 -1.98 0.51 119.26 119.17 2k5u h ALA 137 Ca 0.36 -0.16 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 2k5u h ALA 137 Cb 0.60 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2k5u h ALA 137 CO -0.13 -0.37 -0.37 1.49 0.00 0.00 0.00 179.25 179.88 2k5u h GLU 138 N -0.37 0.44 -0.34 0.00 4.57 -1.80 -2.16 114.58 114.93 2k5u h GLU 138 Ca -0.01 -0.21 -0.13 0.00 -1.18 0.00 0.00 59.36 57.84 2k5u h GLU 138 Cb 0.34 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.92 2k5u h GLU 138 CO 0.01 0.75 -0.29 0.82 -1.18 0.00 0.00 179.01 179.12 2k5u h ILE 139 N 0.38 1.29 -0.44 2.32 2.04 -0.21 0.24 117.51 123.12 2k5u h ILE 139 Ca 0.04 -1.45 0.03 0.00 1.00 0.00 0.00 64.86 64.47 2k5u h ILE 139 Cb 0.82 1.46 -0.03 0.00 -0.74 0.00 0.00 36.82 38.33 2k5u h ILE 139 CO 0.07 0.48 0.25 0.74 0.00 0.00 0.00 178.15 179.68 2k5u h THR 140 N 0.57 1.02 -0.01 -0.27 2.02 0.23 0.76 112.91 117.23 2k5u h THR 140 Ca 0.06 -0.17 -0.20 0.00 0.77 0.00 0.00 66.41 66.87 2k5u h THR 140 Cb 0.86 0.48 -0.01 0.00 -1.74 0.00 0.00 68.15 67.75 2k5u h THR 140 CO 0.07 0.09 -0.86 1.05 0.37 0.00 0.00 175.52 176.24 2k5u h GLU 141 N 0.49 0.30 -0.40 6.66 4.11 -1.33 0.56 114.58 124.97 2k5u h GLU 141 Ca 0.18 -0.31 -0.10 0.00 0.07 0.00 0.00 59.36 59.21 2k5u h GLU 141 Cb 0.05 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 2k5u h GLU 141 CO -0.10 1.00 -0.13 0.87 0.07 0.00 0.00 179.01 180.72 2k5u h LYS 142 N 0.18 0.80 -0.20 1.06 1.79 -0.11 -2.87 116.57 117.23 2k5u h LYS 142 Ca -0.05 -0.32 0.00 0.00 -2.18 0.00 0.00 60.65 58.10 2k5u h LYS 142 Cb 1.48 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 32.09 2k5u h LYS 142 CO 0.14 0.94 0.00 1.47 -1.08 0.00 0.00 179.45 180.92 2k5u n LEU 143 N -4.30 1.09 -0.85 2.94 -0.00 0.23 -4.87 117.00 111.24 2k5u n LEU 143 Ca -0.01 -0.54 -0.10 0.00 -0.00 0.00 0.00 56.01 55.36 2k5u n LEU 143 Cb 0.38 -0.13 -0.03 0.00 -0.00 0.00 0.00 43.42 43.64 2k5u n LEU 143 CO 0.43 0.27 -0.10 0.61 -0.00 0.00 0.00 177.39 178.60 2k5u n GLY 144 N 0.84 0.86 0.33 1.47 0.00 -1.08 -4.79 105.19 102.82 2k5u n GLY 144 Ca 0.08 -0.55 0.16 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.56 0.99 6.46 -0.11 0.68 115.31 122.77 2k5u h LEU 145 Ca -0.21 0.00 -0.06 0.00 -0.12 0.00 0.00 57.88 57.49 2k5u h LEU 145 Cb 0.77 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.70 2k5u h LEU 145 CO 0.29 0.00 -0.27 -0.74 -0.62 0.00 0.00 178.44 177.10 2k5u h HIS 146 N 0.00 0.00 0.00 1.25 2.76 -1.86 -3.01 115.15 114.30 2k5u h HIS 146 Ca 0.11 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.28 2k5u h HIS 146 Cb 0.54 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.50 2k5u h HIS 146 CO 0.00 0.27 0.00 0.45 -1.30 0.00 0.00 177.93 177.35 2k5u n SER 147 N -3.27 0.56 -4.85 3.26 2.88 0.23 -4.74 113.62 107.69 2k5u n SER 147 Ca 0.01 0.60 -0.37 0.00 -1.33 0.00 0.00 58.87 57.78 2k5u n SER 147 Cb 0.55 -0.73 -0.06 0.00 -0.75 0.00 0.00 64.21 63.22 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 -3.17 5.42 0.73 2.46 2.07 -1.14 -5.05 121.20 122.52 2k5u s ILE 148 Ca 0.08 0.32 -0.17 0.00 -1.41 0.00 0.00 60.65 59.47 2k5u s ILE 148 Cb 0.11 -3.46 -0.10 0.00 0.13 0.00 0.00 42.46 39.13 2k5u s ILE 148 CO 0.46 0.58 -0.05 -1.14 -1.91 0.00 0.00 174.94 172.88 2k5u n ARG 149 N 2.19 0.10 -2.90 3.50 3.00 -1.26 -4.88 116.66 116.40 2k5u n ARG 149 Ca -0.18 0.05 -0.41 0.00 -0.00 0.00 0.00 57.85 57.31 2k5u n ARG 149 Cb 0.54 -1.32 -0.04 0.00 0.00 0.00 0.00 32.46 31.64 2k5u n ARG 149 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.63 178.84 2k5u s ASN 150 N -1.20 7.08 0.00 6.15 3.84 -1.26 -3.99 114.94 125.56 2k5u s ASN 150 Ca 0.55 1.31 0.00 0.00 0.21 0.00 0.00 52.86 54.93 2k5u s ASN 150 Cb -0.35 -2.47 0.00 0.00 -0.55 0.00 0.00 41.25 37.88 2k5u s ASN 150 CO 0.68 -0.25 0.00 0.54 -2.79 0.00 0.00 177.10 175.28 2k5u n ARG 151 N 4.31 0.00 -0.20 0.43 3.00 -1.26 -5.00 116.66 117.93 2k5u n ARG 151 Ca 0.03 0.00 -0.06 0.00 -0.01 0.00 0.00 57.85 57.81 2k5u n ARG 151 Cb 0.50 0.00 -0.05 0.00 0.00 0.00 0.00 32.46 32.91 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 -0.02 -4.91 5.56 0.11 -1.93 -3.44 132.00 127.37 2k5u h PRO 152 Ca 0.00 0.00 -0.30 0.00 0.11 0.00 0.00 66.00 65.81 2k5u h PRO 152 Cb 0.00 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 30.97 2k5u h PRO 152 CO 0.00 -0.01 -0.69 1.67 -0.21 0.00 0.00 178.00 178.76 2k5u s TRP 153 N -4.31 1.22 0.21 0.65 1.48 -1.24 -2.75 118.94 114.20 2k5u s TRP 153 Ca -0.06 -0.89 0.10 0.00 -1.06 0.00 0.00 56.10 54.18 2k5u s TRP 153 Cb 0.06 -0.67 -0.04 0.00 -1.16 0.00 0.00 33.47 31.65 2k5u s TRP 153 CO 0.32 -0.07 -0.10 -0.06 -4.06 0.00 0.00 176.95 172.99 2k5u s PHE 154 N -3.49 2.59 -0.01 1.66 0.08 -1.09 -4.95 117.98 112.76 2k5u s PHE 154 Ca 0.20 -0.24 0.07 0.00 0.12 0.00 0.00 56.93 57.07 2k5u s PHE 154 Cb 0.05 -1.23 -0.02 0.00 -0.57 0.00 0.00 43.02 41.25 2k5u s PHE 154 CO 0.02 0.55 -0.23 -1.50 -0.10 0.00 0.00 175.22 173.96 2k5u s ILE 155 N -1.91 1.78 -0.15 0.64 -1.16 -1.26 0.14 121.20 119.29 2k5u s ILE 155 Ca 0.26 -0.98 -0.10 0.00 -0.51 0.00 0.00 60.65 59.33 2k5u s ILE 155 Cb -0.08 -1.48 0.05 0.00 0.61 0.00 0.00 42.46 41.56 2k5u s ILE 155 CO 0.16 0.49 0.37 -1.58 -2.81 0.00 0.00 174.94 171.56 2k5u s GLN 156 N -0.56 0.38 0.11 3.50 -0.44 -0.98 -5.00 119.66 116.67 2k5u s GLN 156 Ca 0.09 0.63 -0.22 0.00 -2.50 0.00 0.00 55.36 53.36 2k5u s GLN 156 Cb -0.09 0.06 -0.07 0.00 -1.64 0.00 0.00 33.01 31.27 2k5u s GLN 156 CO -0.01 -0.11 0.68 0.00 0.50 0.00 0.00 175.29 176.34 2k5u s ALA 157 N 0.88 3.51 0.30 1.58 0.00 -1.26 -0.49 121.76 126.28 2k5u s ALA 157 Ca -0.06 0.20 -0.08 0.00 0.00 0.00 0.00 51.96 52.03 2k5u s ALA 157 Cb -0.06 -2.81 0.00 0.00 0.00 0.00 0.00 23.12 20.25 2k5u s ALA 157 CO -0.07 0.33 0.48 0.95 0.00 0.00 0.00 175.76 177.45 2k5u s THR 158 N -1.04 0.00 -0.20 0.00 -4.23 0.15 -4.75 115.64 105.56 2k5u s THR 158 Ca 0.33 -1.50 -0.02 0.00 -1.18 0.00 0.00 61.69 59.32 2k5u s THR 158 Cb -0.21 -2.48 0.06 0.00 1.34 0.00 0.00 72.50 71.21 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 1.72 0.15 0.00 0.00 -1.89 -1.55 119.26 125.89 2k5u h ALA 160 Ca -0.16 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 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 0.11 -0.07 1.79 0.00 0.00 0.00 179.25 181.43 2k5u h THR 161 N 0.00 0.89 0.00 0.00 1.35 -1.96 -3.31 112.91 109.88 2k5u h THR 161 Ca -0.00 -1.15 0.00 0.00 -0.55 0.00 0.00 66.41 64.70 2k5u h THR 161 Cb 0.17 1.49 0.00 0.00 -1.73 0.00 0.00 68.15 68.08 2k5u h THR 161 CO 0.01 0.23 -0.12 -0.24 -0.25 0.00 0.00 175.52 175.15 2k5u n SER 162 N -4.91 0.29 0.00 5.36 2.88 -1.23 -4.90 113.62 111.11 2k5u n SER 162 Ca -0.08 0.37 0.00 0.00 -1.33 0.00 0.00 58.87 57.84 2k5u n SER 162 Cb 0.27 -0.40 0.00 0.00 -0.75 0.00 0.00 64.21 63.33 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 1.45 0.64 3.64 0.46 0.00 -0.59 -4.97 105.19 105.83 2k5u n GLY 163 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 2k5u n GLY 163 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2k5u s GLU 164 N -0.29 3.97 0.00 1.61 2.56 -1.19 -2.56 118.70 122.80 2k5u s GLU 164 Ca 0.00 1.45 0.00 0.00 0.00 0.00 0.00 54.97 56.42 2k5u s GLU 164 Cb 0.00 -3.89 0.00 0.00 2.00 0.00 0.00 34.13 32.24 2k5u s GLU 164 CO 0.00 -1.06 0.00 0.41 -0.56 0.00 0.00 175.26 174.05 2k5u n GLY 165 N 4.22 3.16 0.14 -1.50 0.00 -1.26 -1.37 105.19 108.59 2k5u n GLY 165 Ca 0.15 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.04 2k5u n GLY 165 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2k5u h LEU 166 N 0.00 0.43 -0.07 0.99 3.38 -1.78 -1.37 115.31 116.88 2k5u h LEU 166 Ca 0.00 -0.49 -0.01 0.00 0.09 0.00 0.00 57.88 57.47 2k5u h LEU 166 Cb 0.00 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 2k5u h LEU 166 CO 0.00 0.83 0.01 1.88 0.09 0.00 0.00 178.44 181.25 2k5u h TYR 167 N 0.03 0.13 0.00 1.13 0.05 -1.92 -2.55 116.97 113.85 2k5u h TYR 167 Ca 0.02 -0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.75 2k5u h TYR 167 Cb 0.72 -0.04 -0.00 0.00 1.01 0.00 0.00 36.73 38.42 2k5u h TYR 167 CO 0.09 0.36 -0.13 1.49 -1.05 0.00 0.00 178.16 178.92 2k5u h GLU 168 N -0.13 0.00 -0.13 4.88 4.81 -1.90 -0.86 114.58 121.25 2k5u h GLU 168 Ca 0.02 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 59.07 2k5u h GLU 168 Cb 0.31 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.69 2k5u h GLU 168 CO 0.00 0.13 -0.65 0.78 -0.73 0.00 0.00 179.01 178.55 2k5u h GLY 169 N 0.69 0.73 0.70 1.92 0.00 -1.03 -2.37 103.07 103.71 2k5u h GLY 169 Ca -0.00 -1.04 -0.12 0.00 0.00 0.00 0.00 47.33 46.17 2k5u h GLY 169 CO 0.02 0.92 -0.45 0.17 0.00 0.00 0.00 176.54 177.20 2k5u h LEU 170 N 0.33 0.44 -0.55 3.11 8.10 -1.22 -1.99 115.31 123.53 2k5u h LEU 170 Ca -0.04 -0.73 0.10 0.00 0.11 0.00 0.00 57.88 57.31 2k5u h LEU 170 Cb 1.29 -0.13 -0.08 0.00 -0.44 0.00 0.00 40.66 41.30 2k5u h LEU 170 CO 0.13 1.11 0.12 -0.08 -4.11 0.00 0.00 178.44 175.61 2k5u h GLU 171 N -0.18 0.25 -0.29 0.17 4.57 -1.25 0.46 114.58 118.30 2k5u h GLU 171 Ca -0.05 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.10 2k5u h GLU 171 Cb 1.15 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.68 2k5u h GLU 171 CO 0.09 0.16 0.11 2.35 -1.18 0.00 0.00 179.01 180.54 2k5u h TRP 172 N 0.26 0.44 -0.68 0.92 -0.00 -1.46 -2.64 115.95 112.78 2k5u h TRP 172 Ca 0.28 -0.04 0.01 0.00 -0.00 0.00 0.00 58.89 59.15 2k5u h TRP 172 Cb 0.39 -0.13 -0.04 0.00 -0.00 0.00 0.00 29.16 29.38 2k5u h TRP 172 CO -0.23 0.45 0.45 -0.07 -0.00 0.00 0.00 178.44 179.04 2k5u h LEU 173 N 0.31 0.76 -0.75 0.65 -0.00 -0.47 -2.14 115.31 113.67 2k5u h LEU 173 Ca 0.09 -0.02 0.00 0.00 -0.00 0.00 0.00 57.88 57.96 2k5u h LEU 173 Cb 0.20 -0.19 -0.04 0.00 -0.00 0.00 0.00 40.66 40.64 2k5u h LEU 173 CO -0.01 0.54 0.47 0.28 -0.00 0.00 0.00 178.44 179.73 2k5u h SER 174 N 0.90 0.88 -0.40 -0.43 0.02 0.21 -1.93 113.55 112.80 2k5u h SER 174 Ca 0.26 -0.05 0.01 0.00 -0.84 0.00 0.00 61.79 61.17 2k5u h SER 174 Cb -0.05 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.24 2k5u h SER 174 CO -0.06 0.66 0.26 -1.13 -1.14 0.00 0.00 176.83 175.42 2k5u h ASN 175 N 1.02 0.44 -0.24 3.07 -0.73 -1.13 0.31 115.58 118.31 2k5u h ASN 175 Ca 0.27 -0.01 -0.02 0.00 1.87 0.00 0.00 56.30 58.42 2k5u h ASN 175 Cb -0.07 -0.10 -0.02 0.00 0.27 0.00 0.00 38.32 38.40 2k5u h ASN 175 CO -0.05 0.32 0.11 0.77 -0.37 0.00 0.00 177.43 178.20 2k5u h SER 176 N 0.52 0.36 1.68 1.15 4.64 -1.29 -0.92 113.55 119.69 2k5u h SER 176 Ca 0.15 -0.03 -0.06 0.00 -0.47 0.00 0.00 61.79 61.38 2k5u h SER 176 Cb -0.05 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 61.94 2k5u h SER 176 CO -0.04 0.34 -0.33 -0.07 -0.87 0.00 0.00 176.83 175.86 2k5u h LEU 177 N 0.41 0.00 -0.21 5.97 4.07 -0.56 -3.28 115.31 121.72 2k5u h LEU 177 Ca 0.10 0.00 -0.22 0.00 0.08 0.00 0.00 57.88 57.84 2k5u h LEU 177 Cb 0.09 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.83 2k5u h LEU 177 CO -0.01 0.26 -0.90 0.50 -1.08 0.00 0.00 178.44 177.21 2k5u h LYS 178 N 0.00 0.43 -4.27 1.13 3.64 0.92 -3.41 116.57 115.01 2k5u h LYS 178 Ca -0.01 -0.44 -0.74 0.00 -1.27 0.00 0.00 60.65 58.20 2k5u h LYS 178 Cb 1.21 0.12 -0.25 0.00 -0.41 0.00 0.00 32.23 32.90 2k5u h LYS 178 CO 0.03 1.09 -0.33 1.21 -2.27 0.00 0.00 179.45 179.19 2k5u s ASN 179 N -7.07 6.01 -0.07 4.20 2.47 -0.73 -4.62 114.94 115.13 2k5u s ASN 179 Ca -0.06 -1.58 -0.13 0.00 0.42 0.00 0.00 52.86 51.51 2k5u s ASN 179 Cb 0.09 -2.13 -0.05 0.00 -1.45 0.00 0.00 41.25 37.71 2k5u s ASN 179 CO 0.86 -0.70 0.33 -0.44 -3.72 0.00 0.00 177.10 173.44 2k5u s SER 180 N 2.82 6.64 0.00 -4.21 0.01 -1.26 -4.87 113.70 112.82 2k5u s SER 180 Ca 0.04 0.76 0.18 0.00 1.31 0.00 0.00 55.95 58.23 2k5u s SER 180 Cb -0.26 -2.20 1.05 0.00 0.21 0.00 0.00 66.02 64.82 2k5u s SER 180 CO 0.04 0.28 1.45 0.35 0.41 0.00 0.00 173.24 175.76