#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k5u s LEU 3 N 0.00 4.14 -0.27 0.99 0.20 -1.26 -5.04 118.68 117.44 2k5u s LEU 3 Ca 0.00 1.07 -0.27 0.00 0.69 0.00 0.00 54.13 55.61 2k5u s LEU 3 Cb 0.00 -3.80 0.01 0.00 -0.43 0.00 0.00 46.19 41.97 2k5u s LEU 3 CO 0.00 -0.11 0.98 -0.36 -0.29 0.00 0.00 176.35 176.57 2k5u s PHE 4 N -1.85 3.25 0.28 5.38 0.08 -1.26 -4.80 117.98 119.06 2k5u s PHE 4 Ca 0.49 1.22 0.00 0.00 0.12 0.00 0.00 56.93 58.76 2k5u s PHE 4 Cb -0.11 -3.37 0.00 0.00 -0.57 0.00 0.00 43.02 38.97 2k5u s PHE 4 CO 0.20 -0.58 0.00 0.00 -0.10 0.00 0.00 175.22 174.74 2k5u n ALA 5 N 6.44 3.00 0.12 5.36 0.00 -1.26 -5.09 120.51 129.07 2k5u n ALA 5 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 2k5u n ALA 5 Cb 0.47 0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.94 2k5u n ALA 5 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2k5u n SER 6 N -3.48 -2.07 -3.56 0.00 3.41 -1.26 -5.16 113.62 101.49 2k5u n SER 6 Ca 0.00 0.49 -0.13 0.00 -0.26 0.00 0.00 58.87 58.97 2k5u n SER 6 Cb 0.00 2.14 -0.06 0.00 -0.26 0.00 0.00 64.21 66.04 2k5u n SER 6 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2k5u s LYS 7 N -2.00 0.78 -0.32 4.33 2.20 -1.26 -5.14 119.74 118.33 2k5u s LYS 7 Ca 0.00 0.27 0.00 0.00 -0.36 0.00 0.00 55.97 55.88 2k5u s LYS 7 Cb 0.00 0.37 0.07 0.00 -1.51 0.00 0.00 37.83 36.76 2k5u s LYS 7 CO 0.00 -0.23 0.02 -0.48 -0.36 0.00 0.00 175.35 174.31 2k5u s LEU 8 N -0.96 4.24 -0.00 5.43 0.05 -1.26 -4.96 118.68 121.22 2k5u s LEU 8 Ca -0.05 -1.64 -0.18 0.00 0.05 0.00 0.00 54.13 52.31 2k5u s LEU 8 Cb -0.01 -1.68 -0.34 0.00 -2.05 0.00 0.00 46.19 42.11 2k5u s LEU 8 CO 0.04 -0.32 0.95 -0.26 -0.55 0.00 0.00 176.35 176.21 2k5u h PHE 9 N 7.87 0.82 -1.29 3.48 0.04 -2.05 -3.42 116.94 122.39 2k5u h PHE 9 Ca -0.15 -0.60 -0.34 0.00 2.80 0.00 0.00 57.97 59.68 2k5u h PHE 9 Cb 1.04 -0.03 -0.00 0.00 2.20 0.00 0.00 35.95 39.16 2k5u h PHE 9 CO 0.58 1.48 1.14 -1.12 -0.60 0.00 0.00 178.31 179.78 2k5u s SER 10 N -7.36 4.43 -0.07 2.17 0.01 -1.26 -4.67 113.70 106.94 2k5u s SER 10 Ca -0.11 0.62 0.11 0.00 1.31 0.00 0.00 55.95 57.88 2k5u s SER 10 Cb 0.03 -2.52 0.17 0.00 0.21 0.00 0.00 66.02 63.91 2k5u s SER 10 CO 0.90 -3.08 1.09 0.59 0.41 0.00 0.00 173.24 173.16 2k5u n ASN 11 N 16.15 1.30 -1.83 2.44 4.13 -1.26 -5.06 115.26 131.13 2k5u n ASN 11 Ca 0.37 -2.62 -0.13 0.00 1.68 0.00 0.00 54.58 53.88 2k5u n ASN 11 Cb 0.51 -0.33 -0.08 0.00 -1.54 0.00 0.00 39.78 38.34 2k5u n ASN 11 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2k5u n LEU 12 N -0.77 -0.22 -1.51 3.41 -0.00 -1.26 -4.73 117.00 111.91 2k5u n LEU 12 Ca 0.09 -0.07 -0.11 0.00 -0.00 0.00 0.00 56.01 55.92 2k5u n LEU 12 Cb 0.68 -0.30 0.18 0.00 -0.00 0.00 0.00 43.42 43.98 2k5u n LEU 12 CO 0.00 -0.43 0.85 0.49 -0.00 0.00 0.00 177.39 178.30 2k5u n PHE 13 N 3.33 1.72 0.06 1.47 3.72 -1.26 -4.72 117.46 121.77 2k5u n PHE 13 Ca 0.27 -1.76 0.03 0.00 -0.05 0.00 0.00 57.45 55.94 2k5u n PHE 13 Cb 0.03 -0.64 0.15 0.00 -0.94 0.00 0.00 39.48 38.08 2k5u n PHE 13 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2k5u n GLY 14 N -1.11 -0.44 1.24 1.37 0.00 -1.26 -4.74 105.19 100.24 2k5u n GLY 14 Ca 0.42 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.49 2k5u n GLY 14 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2k5u n ASN 15 N -1.61 0.00 -4.57 1.61 5.15 -1.26 -4.98 115.26 109.59 2k5u n ASN 15 Ca -0.00 0.00 -0.39 0.00 -0.60 0.00 0.00 54.58 53.59 2k5u n ASN 15 Cb 0.22 0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.45 2k5u n ASN 15 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 2k5u s LYS 16 N -0.60 3.51 0.91 1.20 3.01 -1.26 -4.97 119.74 121.54 2k5u s LYS 16 Ca 0.00 -1.50 -0.15 0.00 -1.01 0.00 0.00 55.97 53.32 2k5u s LYS 16 Cb 0.00 -5.40 -0.04 0.00 -1.01 0.00 0.00 37.83 31.38 2k5u s LYS 16 CO 0.00 -2.64 0.05 -1.91 0.51 0.00 0.00 175.35 171.36 2k5u n GLU 17 N 8.54 -0.10 -4.18 1.68 2.13 -1.26 -5.01 120.64 122.44 2k5u n GLU 17 Ca 0.44 0.00 -0.20 0.00 0.66 0.00 0.00 57.16 58.05 2k5u n GLU 17 Cb 0.47 -1.57 -0.16 0.00 0.27 0.00 0.00 31.44 30.45 2k5u n GLU 17 CO 0.00 0.00 0.00 -1.64 -0.41 0.00 0.00 177.13 175.08 2k5u s MET 18 N -2.91 0.87 -0.34 5.31 -1.94 -1.26 -4.78 119.30 114.26 2k5u s MET 18 Ca 0.53 -0.12 -0.01 0.00 -1.71 0.00 0.00 55.69 54.39 2k5u s MET 18 Cb -0.24 -0.87 0.11 0.00 2.01 0.00 0.00 34.83 35.85 2k5u s MET 18 CO 0.70 -0.08 0.15 0.50 -0.01 0.00 0.00 175.02 176.29 2k5u s ARG 19 N 0.91 0.65 -0.33 2.03 3.00 -1.26 -2.84 118.95 121.10 2k5u s ARG 19 Ca -0.11 -1.15 -0.29 0.00 -1.00 0.00 0.00 55.73 53.18 2k5u s ARG 19 Cb -0.14 -1.70 0.02 0.00 0.00 0.00 0.00 34.95 33.12 2k5u s ARG 19 CO 0.00 -1.07 1.09 0.42 0.00 0.00 0.00 175.30 175.74 2k5u s ILE 20 N 1.41 4.47 -0.03 4.11 -1.09 -0.42 0.20 121.20 129.84 2k5u s ILE 20 Ca 0.13 1.68 -0.01 0.00 -2.23 0.00 0.00 60.65 60.21 2k5u s ILE 20 Cb -0.19 -4.42 -0.04 0.00 -1.58 0.00 0.00 42.46 36.23 2k5u s ILE 20 CO -0.18 -0.52 0.07 -0.22 -1.23 0.00 0.00 174.94 172.85 2k5u s LEU 21 N 3.75 3.88 -0.42 2.97 0.20 0.27 -2.58 118.68 126.74 2k5u s LEU 21 Ca 0.46 0.18 -0.15 0.00 0.69 0.00 0.00 54.13 55.31 2k5u s LEU 21 Cb -0.12 -2.15 0.03 0.00 -0.43 0.00 0.00 46.19 43.53 2k5u s LEU 21 CO 0.17 0.31 0.31 -0.04 -0.29 0.00 0.00 176.35 176.81 2k5u s MET 22 N -1.48 2.95 0.06 1.98 -1.94 0.85 -2.50 119.30 119.23 2k5u s MET 22 Ca 0.20 -1.11 0.09 0.00 -1.71 0.00 0.00 55.69 53.16 2k5u s MET 22 Cb -0.12 -3.99 -0.03 0.00 2.01 0.00 0.00 34.83 32.70 2k5u s MET 22 CO 0.10 -0.81 -0.25 0.08 -0.01 0.00 0.00 175.02 174.13 2k5u s VAL 23 N 1.66 2.24 -5.00 -6.03 1.01 -1.04 -2.06 120.40 111.17 2k5u s VAL 23 Ca 0.05 -1.41 0.00 0.00 0.00 0.00 0.00 61.98 60.61 2k5u s VAL 23 Cb -0.20 -1.90 0.00 0.00 0.00 0.00 0.00 36.38 34.28 2k5u s VAL 23 CO 0.09 0.33 0.00 0.61 0.00 0.00 0.00 175.10 176.13 2k5u n GLY 24 N 1.63 -0.67 3.76 4.51 0.00 -1.26 -1.80 105.19 111.36 2k5u n GLY 24 Ca -0.17 -1.43 -0.41 0.00 0.00 0.00 0.00 46.02 44.01 2k5u n GLY 24 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k5u s LEU 25 N 0.00 4.41 0.73 0.99 2.01 -1.25 -0.48 118.68 125.08 2k5u s LEU 25 Ca 0.00 2.70 -0.16 0.00 0.01 0.00 0.00 54.13 56.68 2k5u s LEU 25 Cb 0.00 -3.64 0.04 0.00 0.01 0.00 0.00 46.19 42.59 2k5u s LEU 25 CO 0.00 -0.61 1.25 -0.62 1.01 0.00 0.00 176.35 177.38 2k5u s ASP 26 N -0.19 4.10 0.00 2.29 2.15 -1.26 -2.22 116.67 121.54 2k5u s ASP 26 Ca 0.52 2.50 0.00 0.00 0.43 0.00 0.00 52.55 56.00 2k5u s ASP 26 Cb -0.41 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 39.61 2k5u s ASP 26 CO 0.50 -2.34 0.00 0.61 -0.17 0.00 0.00 175.17 173.78 2k5u n GLY 27 N 0.69 0.27 0.24 2.66 0.00 -1.26 -4.84 105.19 102.97 2k5u n GLY 27 Ca 0.15 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.33 2k5u n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k5u h ALA 28 N 0.00 1.00 0.00 4.61 0.00 -1.77 -3.45 119.26 119.66 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 0.41 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2k5u h ALA 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 2k5u n GLY 29 N -0.38 1.28 0.22 0.00 0.00 -1.26 -4.65 105.19 100.39 2k5u n GLY 29 Ca -0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.09 2k5u n GLY 29 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k5u h LYS 30 N 0.00 0.00 0.15 1.61 1.57 -1.93 -1.49 116.57 116.48 2k5u h LYS 30 Ca 0.00 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.50 2k5u h LYS 30 Cb 0.00 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.34 2k5u h LYS 30 CO 0.00 0.28 -1.19 1.15 -0.57 0.00 0.00 179.45 179.12 2k5u h THR 31 N 0.00 1.33 0.00 -0.16 2.02 -1.96 -2.45 112.91 111.69 2k5u h THR 31 Ca -0.00 -2.50 -0.00 0.00 0.77 0.00 0.00 66.41 64.68 2k5u h THR 31 Cb 0.64 2.85 0.00 0.00 -1.74 0.00 0.00 68.15 69.91 2k5u h THR 31 CO 0.04 0.75 -0.00 0.74 0.37 0.00 0.00 175.52 177.41 2k5u h THR 32 N 0.11 1.26 -0.55 3.16 2.02 -1.93 -2.94 112.91 114.04 2k5u h THR 32 Ca -0.19 -0.77 -0.05 0.00 0.77 0.00 0.00 66.41 66.17 2k5u h THR 32 Cb 1.89 1.79 -0.03 0.00 -1.74 0.00 0.00 68.15 70.06 2k5u h THR 32 CO 0.23 0.20 0.13 0.58 0.37 0.00 0.00 175.52 177.03 2k5u h VAL 33 N -0.33 1.23 -0.24 3.16 2.07 -1.41 -2.84 116.25 117.89 2k5u h VAL 33 Ca -0.00 -0.82 0.05 0.00 0.82 0.00 0.00 66.70 66.75 2k5u h VAL 33 Cb 0.33 0.66 -0.05 0.00 -1.52 0.00 0.00 31.29 30.71 2k5u h VAL 33 CO 0.00 0.31 -0.09 0.25 0.02 0.00 0.00 177.57 178.06 2k5u h LEU 34 N 0.82 -0.31 -1.04 2.57 6.46 -1.39 -1.21 115.31 121.21 2k5u h LEU 34 Ca 0.18 0.08 0.06 0.00 -0.12 0.00 0.00 57.88 58.08 2k5u h LEU 34 Cb 0.30 0.18 -0.06 0.00 -0.73 0.00 0.00 40.66 40.35 2k5u h LEU 34 CO -0.00 -0.12 0.64 1.88 -0.62 0.00 0.00 178.44 180.22 2k5u h TYR 35 N -0.05 1.17 -0.76 1.25 -1.99 -1.33 0.18 116.97 115.45 2k5u h TYR 35 Ca 0.12 0.03 0.12 0.00 2.00 0.00 0.00 58.73 61.01 2k5u h TYR 35 Cb 0.23 -0.39 -0.05 0.00 2.00 0.00 0.00 36.73 38.52 2k5u h TYR 35 CO -0.27 0.62 0.50 -0.22 -0.00 0.00 0.00 178.16 178.79 2k5u h LYS 36 N 1.16 0.53 0.00 4.88 3.11 -1.00 -0.71 116.57 124.53 2k5u h LYS 36 Ca 0.42 -0.03 -0.26 0.00 -2.81 0.00 0.00 60.65 57.97 2k5u h LYS 36 Cb 0.15 -0.12 -0.04 0.00 -1.00 0.00 0.00 32.23 31.22 2k5u h LYS 36 CO -0.16 0.35 -1.47 -0.07 -2.81 0.00 0.00 179.45 175.29 2k5u h LEU 37 N 0.54 0.00 0.00 5.20 4.07 -0.79 -3.48 115.31 120.86 2k5u h LEU 37 Ca 0.37 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.33 2k5u h LEU 37 Cb 0.67 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.41 2k5u h LEU 37 CO -0.13 0.98 0.00 0.29 -1.08 0.00 0.00 178.44 178.50 2k5u n LYS 38 N -3.13 0.00 0.00 1.13 5.02 0.49 -4.71 118.16 116.96 2k5u n LYS 38 Ca -0.11 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.18 2k5u n LYS 38 Cb 1.01 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 36.02 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 0.00 0.00 -0.35 4.32 -1.26 -4.36 117.00 115.35 2k5u n LEU 39 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 2k5u n LEU 39 Cb 0.00 -0.17 0.00 0.00 -1.62 0.00 0.00 43.42 41.63 2k5u n LEU 39 CO 0.00 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 176.78 2k5u n GLY 40 N -1.94 1.83 2.97 -0.72 0.00 -1.26 -4.95 105.19 101.12 2k5u n GLY 40 Ca 0.00 -0.73 -0.14 0.00 0.00 0.00 0.00 46.02 45.15 2k5u n GLY 40 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2k5u s GLU 41 N 0.00 0.13 0.20 1.61 2.56 -1.26 -5.15 118.70 116.79 2k5u s GLU 41 Ca 0.00 0.58 -0.27 0.00 0.00 0.00 0.00 54.97 55.29 2k5u s GLU 41 Cb 0.00 -0.14 -0.08 0.00 2.00 0.00 0.00 34.13 35.91 2k5u s GLU 41 CO 0.00 -0.23 0.83 0.54 -0.56 0.00 0.00 175.26 175.84 2k5u s VAL 42 N 1.85 4.27 -0.01 3.70 0.11 -1.26 -4.91 120.40 124.15 2k5u s VAL 42 Ca -0.03 1.82 -0.23 0.00 -2.93 0.00 0.00 61.98 60.61 2k5u s VAL 42 Cb -0.11 -4.19 -0.05 0.00 -1.53 0.00 0.00 36.38 30.50 2k5u s VAL 42 CO -0.08 0.50 0.70 -0.63 -3.33 0.00 0.00 175.10 172.26 2k5u s ILE 43 N -1.18 4.90 -0.55 7.04 -1.09 -0.90 -4.97 121.20 124.46 2k5u s ILE 43 Ca 0.38 1.47 -0.22 0.00 -2.23 0.00 0.00 60.65 60.04 2k5u s ILE 43 Cb -0.24 -4.04 0.05 0.00 -1.58 0.00 0.00 42.46 36.65 2k5u s ILE 43 CO 0.28 0.33 0.85 0.28 -1.23 0.00 0.00 174.94 175.45 2k5u s THR 44 N 0.26 4.53 -0.03 2.92 -1.32 -1.26 -2.83 115.64 117.91 2k5u s THR 44 Ca 0.36 -0.01 -0.01 0.00 -1.21 0.00 0.00 61.69 60.83 2k5u s THR 44 Cb -0.19 -4.48 -0.04 0.00 -1.51 0.00 0.00 72.50 66.29 2k5u s THR 44 CO 0.20 -1.05 0.03 0.42 -2.21 0.00 0.00 174.62 172.01 2k5u s THR 45 N 3.55 4.45 -0.36 5.08 -4.23 -0.86 -5.05 115.64 118.22 2k5u s THR 45 Ca 0.25 -0.39 -0.03 0.00 -1.18 0.00 0.00 61.69 60.34 2k5u s THR 45 Cb -0.15 -2.96 0.08 0.00 1.34 0.00 0.00 72.50 70.81 2k5u s THR 45 CO 0.16 0.45 0.12 -0.63 -0.54 0.00 0.00 174.62 174.18 2k5u s ILE 46 N -1.05 3.23 0.01 2.99 1.01 -1.26 -1.92 121.20 124.20 2k5u s ILE 46 Ca 0.18 -1.71 -0.25 0.00 0.00 0.00 0.00 60.65 58.87 2k5u s ILE 46 Cb -0.12 -3.04 -0.18 0.00 0.01 0.00 0.00 42.46 39.13 2k5u s ILE 46 CO 0.09 -0.42 1.35 1.55 0.00 0.00 0.00 174.94 177.51 2k5u h PRO 47 N 8.05 -0.10 -3.33 2.79 0.13 -1.92 -3.46 132.00 134.15 2k5u h PRO 47 Ca -0.17 0.01 -0.15 0.00 -0.87 0.00 0.00 66.00 64.82 2k5u h PRO 47 Cb 1.06 0.02 -0.22 0.00 0.13 0.00 0.00 31.00 31.99 2k5u h PRO 47 CO 0.63 0.25 -0.44 0.99 -0.23 0.00 0.00 178.00 179.19 2k5u s THR 48 N -4.74 0.05 0.06 1.56 2.01 -1.26 -5.01 115.64 108.31 2k5u s THR 48 Ca -0.15 -0.44 0.03 0.00 0.31 0.00 0.00 61.69 61.44 2k5u s THR 48 Cb 0.03 -0.43 0.06 0.00 0.01 0.00 0.00 72.50 72.17 2k5u s THR 48 CO 0.64 -0.24 0.25 0.00 -0.69 0.00 0.00 174.62 174.58 2k5u n ILE 49 N 1.88 -0.07 -2.00 1.82 0.13 -1.26 0.15 119.36 120.00 2k5u n ILE 49 Ca -0.19 0.33 -0.24 0.00 -1.10 0.00 0.00 62.75 61.54 2k5u n ILE 49 Cb 0.56 -0.52 0.02 0.00 -0.84 0.00 0.00 39.64 38.86 2k5u n ILE 49 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 2k5u n GLY 50 N -1.05 6.40 3.08 4.50 0.00 -1.26 -5.03 105.19 111.83 2k5u n GLY 50 Ca 0.06 -2.66 -0.10 0.00 0.00 0.00 0.00 46.02 43.32 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 -3.61 0.20 -0.03 1.61 0.40 0.38 -5.13 117.98 111.81 2k5u s PHE 51 Ca 0.51 -0.46 0.02 0.00 -0.60 0.00 0.00 56.93 56.40 2k5u s PHE 51 Cb 0.41 -0.15 0.01 0.00 0.51 0.00 0.00 43.02 43.80 2k5u s PHE 51 CO 0.04 -0.30 -0.07 -0.80 0.70 0.00 0.00 175.22 174.79 2k5u s ASN 52 N -1.83 0.99 0.01 1.36 -0.87 -1.26 -4.00 114.94 109.35 2k5u s ASN 52 Ca -0.09 -0.15 0.02 0.00 -1.57 0.00 0.00 52.86 51.06 2k5u s ASN 52 Cb -0.04 -0.31 -0.01 0.00 -0.02 0.00 0.00 41.25 40.86 2k5u s ASN 52 CO -0.02 0.03 -0.06 0.54 -2.57 0.00 0.00 177.10 175.01 2k5u s VAL 53 N 0.37 0.41 -0.07 1.60 0.11 -0.81 -4.69 120.40 117.32 2k5u s VAL 53 Ca -0.05 -0.51 0.01 0.00 -2.93 0.00 0.00 61.98 58.50 2k5u s VAL 53 Cb -0.09 -0.40 -0.03 0.00 -1.53 0.00 0.00 36.38 34.32 2k5u s VAL 53 CO 0.00 -0.08 -0.08 -1.61 -3.33 0.00 0.00 175.10 170.00 2k5u s GLU 54 N -0.64 2.76 -0.04 1.54 8.01 -1.12 -2.03 118.70 127.19 2k5u s GLU 54 Ca -0.03 -0.58 0.01 0.00 0.01 0.00 0.00 54.97 54.39 2k5u s GLU 54 Cb -0.05 -2.57 0.02 0.00 -4.31 0.00 0.00 34.13 27.23 2k5u s GLU 54 CO -0.00 0.63 -0.04 0.95 0.01 0.00 0.00 175.26 176.81 2k5u s THR 55 N -0.71 0.46 0.03 3.63 -4.23 -1.13 -2.07 115.64 111.61 2k5u s THR 55 Ca 0.11 -0.08 0.04 0.00 -1.18 0.00 0.00 61.69 60.57 2k5u s THR 55 Cb -0.11 -0.49 -0.02 0.00 1.34 0.00 0.00 72.50 73.22 2k5u s THR 55 CO 0.01 0.20 -0.11 0.68 -0.54 0.00 0.00 174.62 174.87 2k5u s VAL 56 N 0.89 0.86 -0.04 2.29 -7.23 0.93 -2.12 120.40 115.98 2k5u s VAL 56 Ca -0.11 -0.89 0.07 0.00 -1.81 0.00 0.00 61.98 59.24 2k5u s VAL 56 Cb -0.14 -0.80 -0.01 0.00 0.56 0.00 0.00 36.38 35.98 2k5u s VAL 56 CO -0.00 -0.07 -0.25 0.00 -0.31 0.00 0.00 175.10 174.47 2k5u s GLN 57 N -1.07 2.26 -0.34 4.82 -2.07 -1.26 -0.88 119.66 121.12 2k5u s GLN 57 Ca -0.01 -0.89 -0.01 0.00 -1.82 0.00 0.00 55.36 52.63 2k5u s GLN 57 Cb -0.07 -2.04 0.12 0.00 -1.09 0.00 0.00 33.01 29.92 2k5u s GLN 57 CO 0.01 0.46 0.16 -0.47 -1.32 0.00 0.00 175.29 174.12 2k5u s TYR 58 N -0.37 1.12 0.00 9.60 6.14 -0.50 -4.99 117.35 128.35 2k5u s TYR 58 Ca 0.03 -1.58 0.00 0.00 0.64 0.00 0.00 57.07 56.16 2k5u s TYR 58 Cb -0.12 -1.32 0.00 0.00 0.42 0.00 0.00 41.96 40.95 2k5u s TYR 58 CO 0.01 -0.84 0.00 1.63 0.64 0.00 0.00 175.55 177.00 2k5u n LYS 59 N 4.55 0.00 -0.00 4.97 4.76 -1.26 -1.37 118.16 129.81 2k5u n LYS 59 Ca 0.02 0.00 -0.01 0.00 -2.87 0.00 0.00 58.31 55.46 2k5u n LYS 59 Cb 0.39 0.00 -0.00 0.00 -1.84 0.00 0.00 35.03 33.58 2k5u n LYS 59 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2k5u n ASN 60 N 1.95 4.12 -4.70 4.39 4.13 -1.26 -5.01 115.26 118.88 2k5u n ASN 60 Ca 0.00 -0.00 -0.42 0.00 1.68 0.00 0.00 54.58 55.83 2k5u n ASN 60 Cb 0.00 0.10 -0.03 0.00 -1.54 0.00 0.00 39.78 38.31 2k5u n ASN 60 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2k5u s ILE 61 N -2.02 4.84 -0.04 2.41 1.09 -0.47 -4.72 121.20 122.30 2k5u s ILE 61 Ca -0.01 2.04 0.01 0.00 -1.10 0.00 0.00 60.65 61.59 2k5u s ILE 61 Cb 0.00 -4.31 -0.03 0.00 -1.06 0.00 0.00 42.46 37.06 2k5u s ILE 61 CO 0.02 0.10 -0.04 -0.44 -0.10 0.00 0.00 174.94 174.48 2k5u s SER 62 N 1.04 4.84 0.04 3.58 0.01 -1.13 -1.41 113.70 120.67 2k5u s SER 62 Ca 0.50 -0.02 0.07 0.00 1.31 0.00 0.00 55.95 57.81 2k5u s SER 62 Cb -0.20 -1.23 -0.02 0.00 0.21 0.00 0.00 66.02 64.78 2k5u s SER 62 CO 0.24 0.33 -0.20 -0.36 0.41 0.00 0.00 173.24 173.66 2k5u s PHE 63 N -0.93 1.74 -0.18 2.43 0.40 -0.05 -1.30 117.98 120.09 2k5u s PHE 63 Ca 0.15 -0.37 -0.11 0.00 -0.60 0.00 0.00 56.93 56.00 2k5u s PHE 63 Cb -0.11 -1.04 0.06 0.00 0.51 0.00 0.00 43.02 42.44 2k5u s PHE 63 CO 0.05 0.08 0.45 -0.08 0.70 0.00 0.00 175.22 176.42 2k5u s THR 64 N -0.79 -0.02 0.07 0.64 -1.32 -1.07 -0.05 115.64 113.11 2k5u s THR 64 Ca 0.07 0.06 0.03 0.00 -1.21 0.00 0.00 61.69 60.65 2k5u s THR 64 Cb -0.09 -0.65 -0.04 0.00 -1.51 0.00 0.00 72.50 70.21 2k5u s THR 64 CO 0.02 0.03 0.04 0.68 -2.21 0.00 0.00 174.62 173.17 2k5u s VAL 65 N 1.16 4.28 -0.22 5.08 -7.23 -0.88 -0.10 120.40 122.49 2k5u s VAL 65 Ca -0.07 -0.83 -0.10 0.00 -1.81 0.00 0.00 61.98 59.16 2k5u s VAL 65 Cb -0.07 -3.03 0.08 0.00 0.56 0.00 0.00 36.38 33.92 2k5u s VAL 65 CO -0.10 0.16 0.51 0.86 -0.31 0.00 0.00 175.10 176.22 2k5u s TRP 66 N -1.32 -0.86 -0.07 2.82 -0.11 -0.88 -2.80 118.94 115.73 2k5u s TRP 66 Ca 0.27 1.70 -0.29 0.00 1.22 0.00 0.00 56.10 58.99 2k5u s TRP 66 Cb -0.12 0.44 -0.06 0.00 -1.50 0.00 0.00 33.47 32.23 2k5u s TRP 66 CO 0.19 -0.47 1.85 0.16 -4.62 0.00 0.00 176.95 174.06 2k5u s ASP 67 N 1.94 6.38 -0.14 5.86 -4.77 -1.26 -4.12 116.67 120.56 2k5u s ASP 67 Ca -0.07 2.27 -0.12 0.00 -3.30 0.00 0.00 52.55 51.32 2k5u s ASP 67 Cb -0.09 -2.53 0.02 0.00 -1.09 0.00 0.00 42.92 39.23 2k5u s ASP 67 CO -0.15 -1.16 0.20 1.33 0.70 0.00 0.00 175.17 176.09 2k5u n VAL 68 N 5.95 -1.51 0.11 2.11 0.24 0.37 -4.78 118.33 120.82 2k5u n VAL 68 Ca 0.20 0.11 -0.09 0.00 -2.04 0.00 0.00 64.34 62.52 2k5u n VAL 68 Cb 0.43 -1.58 0.06 0.00 -1.47 0.00 0.00 33.84 31.27 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 0.26 2.95 0.50 7.63 0.00 -1.26 -4.46 105.19 110.81 2k5u n GLY 69 Ca -0.03 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.57 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 0.04 1.09 0.95 -0.02 0.00 -1.26 -2.69 105.19 103.29 2k5u n GLY 70 Ca 0.20 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.19 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 0.13 0.00 -1.74 1.61 1.13 -1.26 -4.94 117.38 112.30 2k5u n GLN 71 Ca 0.00 -0.95 -0.66 0.00 -1.94 0.00 0.00 57.00 53.45 2k5u n GLN 71 Cb 0.18 0.25 -0.09 0.00 0.11 0.00 0.00 30.24 30.68 2k5u n GLN 71 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 2k5u n ASP 72 N 0.08 1.43 0.00 1.08 8.00 -1.09 -4.89 116.55 121.16 2k5u n ASP 72 Ca -0.15 1.17 0.00 0.00 0.71 0.00 0.00 54.79 56.52 2k5u n ASP 72 Cb 0.73 -0.93 0.00 0.00 -0.02 0.00 0.00 41.12 40.90 2k5u n ASP 72 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 2k5u n ARG 73 N 4.24 0.00 0.00 -1.24 3.00 -1.26 -5.07 116.66 116.33 2k5u n ARG 73 Ca 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.15 2k5u n ARG 73 Cb -0.02 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.44 2k5u n ARG 73 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.63 178.07 2k5u n ILE 74 N 0.00 0.00 0.00 5.15 -0.00 -1.26 -5.11 119.36 118.14 2k5u n ILE 74 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.75 2k5u n ILE 74 Cb 0.00 -0.22 0.00 0.00 -0.00 0.00 0.00 39.64 39.42 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 -1.89 0.00 -0.03 6.28 3.00 -1.26 -4.99 116.66 117.77 2k5u n ARG 75 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2k5u n ARG 75 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.53 2k5u n ARG 75 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 2k5u n SER 76 N 0.00 0.00 -0.01 6.15 7.64 -1.26 -4.92 113.62 121.22 2k5u n SER 76 Ca 0.00 -1.04 -0.12 0.00 1.01 0.00 0.00 58.87 58.72 2k5u n SER 76 Cb 0.00 -0.01 -0.10 0.00 -1.01 0.00 0.00 64.21 63.09 2k5u n SER 76 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2k5u h LEU 77 N 0.00 -0.05 -1.02 -3.43 6.46 -1.96 -2.99 115.31 112.31 2k5u h LEU 77 Ca 0.00 -0.59 0.14 0.00 -0.12 0.00 0.00 57.88 57.30 2k5u h LEU 77 Cb 1.01 0.01 -0.09 0.00 -0.73 0.00 0.00 40.66 40.87 2k5u h LEU 77 CO 0.00 0.60 0.63 -0.25 -0.62 0.00 0.00 178.44 178.80 2k5u h TRP 78 N -0.74 1.12 0.76 1.25 7.01 -1.98 -1.94 115.95 121.43 2k5u h TRP 78 Ca -0.01 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 60.99 2k5u h TRP 78 Cb 0.64 -0.35 0.01 0.00 -2.10 0.00 0.00 29.16 27.35 2k5u h TRP 78 CO 0.14 0.40 -0.36 0.00 -2.79 0.00 0.00 178.44 175.83 2k5u h ARG 79 N 0.93 -0.98 -0.56 2.65 3.08 -1.92 0.89 114.38 118.48 2k5u h ARG 79 Ca 0.51 0.07 0.11 0.00 0.07 0.00 0.00 59.98 60.74 2k5u h ARG 79 Cb 0.59 0.22 -0.10 0.00 0.08 0.00 0.00 29.97 30.76 2k5u h ARG 79 CO -0.29 -0.65 -0.10 0.45 -1.07 0.00 0.00 179.97 178.31 2k5u h HIS 80 N -1.02 -0.22 0.00 3.04 3.86 -1.29 0.45 115.15 119.97 2k5u h HIS 80 Ca -0.10 0.05 -0.01 0.00 -1.16 0.00 0.00 60.37 59.14 2k5u h HIS 80 Cb 0.78 0.19 -0.00 0.00 1.06 0.00 0.00 27.41 29.43 2k5u h HIS 80 CO -0.02 -0.21 -0.05 1.88 0.86 0.00 0.00 177.93 180.39 2k5u h TYR 81 N 0.03 0.00 0.00 2.45 -1.99 -1.24 -3.00 116.97 113.22 2k5u h TYR 81 Ca 0.27 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.00 2k5u h TYR 81 Cb 0.43 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.16 2k5u h TYR 81 CO -0.43 0.05 0.00 0.98 -0.00 0.00 0.00 178.16 178.76 2k5u n TYR 82 N -3.14 0.00 -0.23 4.88 9.36 0.31 0.12 117.16 128.45 2k5u n TYR 82 Ca 0.01 0.00 -0.02 0.00 3.32 0.00 0.00 57.90 61.21 2k5u n TYR 82 Cb 0.40 -0.47 0.09 0.00 -0.63 0.00 0.00 39.34 38.73 2k5u n TYR 82 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2k5u h ARG 83 N 0.00 0.69 -0.52 2.98 3.08 -1.61 -2.54 114.38 116.46 2k5u h ARG 83 Ca 0.00 -0.04 0.05 0.00 0.07 0.00 0.00 59.98 60.06 2k5u h ARG 83 Cb 0.00 -0.16 -0.05 0.00 0.08 0.00 0.00 29.97 29.85 2k5u h ARG 83 CO 0.00 0.46 0.24 -0.91 -1.07 0.00 0.00 179.97 178.69 2k5u h ASN 84 N 0.71 0.33 -2.20 7.04 4.21 -1.42 -3.41 115.58 120.85 2k5u h ASN 84 Ca 0.29 0.04 -0.57 0.00 1.21 0.00 0.00 56.30 57.27 2k5u h ASN 84 Cb 0.15 -0.02 0.02 0.00 -1.12 0.00 0.00 38.32 37.35 2k5u h ASN 84 CO -0.17 0.23 1.18 0.35 -1.29 0.00 0.00 177.43 177.73 2k5u n THR 85 N -4.91 0.68 -0.09 2.81 -2.24 0.32 -4.47 114.28 106.39 2k5u n THR 85 Ca 0.05 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 2k5u n THR 85 Cb 0.16 -2.12 0.00 0.00 -2.10 0.00 0.00 70.33 66.26 2k5u n THR 85 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2k5u n GLU 86 N 7.17 0.71 -3.78 -0.78 4.71 -0.89 -4.83 120.64 122.95 2k5u n GLU 86 Ca 0.21 -0.88 -0.15 0.00 -0.01 0.00 0.00 57.16 56.33 2k5u n GLU 86 Cb 0.36 -0.96 -0.16 0.00 -1.01 0.00 0.00 31.44 29.67 2k5u n GLU 86 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 2k5u s GLY 87 N -0.41 0.11 -0.20 0.62 0.00 0.53 -4.12 107.32 103.84 2k5u s GLY 87 Ca 0.00 0.29 -0.00 0.00 0.00 0.00 0.00 44.72 45.01 2k5u s GLY 87 CO 0.00 0.68 -0.04 0.54 0.00 0.00 0.00 173.10 174.28 2k5u s VAL 88 N 1.05 1.25 -0.09 1.40 0.11 -1.15 -0.57 120.40 122.41 2k5u s VAL 88 Ca -0.09 -0.92 0.02 0.00 -2.93 0.00 0.00 61.98 58.06 2k5u s VAL 88 Cb -0.13 -1.52 0.01 0.00 -1.53 0.00 0.00 36.38 33.22 2k5u s VAL 88 CO -0.03 -0.03 -0.14 -0.63 -3.33 0.00 0.00 175.10 170.94 2k5u s ILE 89 N 1.54 1.39 -0.22 7.04 -1.09 -1.04 -2.51 121.20 126.30 2k5u s ILE 89 Ca -0.03 -0.59 -0.09 0.00 -2.23 0.00 0.00 60.65 57.71 2k5u s ILE 89 Cb -0.17 -1.27 -0.04 0.00 -1.58 0.00 0.00 42.46 39.40 2k5u s ILE 89 CO -0.07 0.42 0.11 0.12 -1.23 0.00 0.00 174.94 174.29 2k5u s PHE 90 N 0.85 3.26 -0.23 3.97 5.36 0.12 -2.50 117.98 128.82 2k5u s PHE 90 Ca -0.10 0.09 0.02 0.00 -0.96 0.00 0.00 56.93 55.98 2k5u s PHE 90 Cb -0.15 -2.20 0.04 0.00 -0.34 0.00 0.00 43.02 40.37 2k5u s PHE 90 CO 0.01 0.05 -0.15 0.08 -1.46 0.00 0.00 175.22 173.75 2k5u s VAL 91 N 0.88 2.12 0.30 3.12 1.01 -0.75 0.44 120.40 127.52 2k5u s VAL 91 Ca 0.06 -1.34 0.09 0.00 0.00 0.00 0.00 61.98 60.79 2k5u s VAL 91 Cb -0.13 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 2k5u s VAL 91 CO 0.03 0.21 0.06 0.54 0.00 0.00 0.00 175.10 175.94 2k5u s VAL 92 N 1.18 3.30 -0.23 2.92 0.11 -1.05 -3.89 120.40 122.74 2k5u s VAL 92 Ca -0.03 -1.81 -0.25 0.00 -2.93 0.00 0.00 61.98 56.96 2k5u s VAL 92 Cb -0.17 -2.92 -0.01 0.00 -1.53 0.00 0.00 36.38 31.75 2k5u s VAL 92 CO -0.08 -0.29 0.84 -0.62 -3.33 0.00 0.00 175.10 171.61 2k5u s ASP 93 N -3.75 6.87 0.49 3.54 -1.08 -1.26 -2.69 116.67 118.78 2k5u s ASP 93 Ca 0.34 1.08 0.29 0.00 -0.52 0.00 0.00 52.55 53.73 2k5u s ASP 93 Cb -0.05 -2.44 0.89 0.00 -1.46 0.00 0.00 42.92 39.86 2k5u s ASP 93 CO 0.21 -0.51 1.81 0.28 0.52 0.00 0.00 175.17 177.48 2k5u h SER 94 N 7.61 0.00 -0.48 -0.34 0.02 -1.78 -2.91 113.55 115.67 2k5u h SER 94 Ca -0.24 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 2k5u h SER 94 Cb 1.10 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.64 2k5u h SER 94 CO 0.87 0.00 0.00 -3.20 -1.14 0.00 0.00 176.83 173.36 2k5u n ASN 95 N -3.07 3.56 -3.43 3.07 5.15 -1.26 -2.39 115.26 116.89 2k5u n ASN 95 Ca 0.02 -1.98 -0.28 0.00 -0.60 0.00 0.00 54.58 51.74 2k5u n ASN 95 Cb 0.41 -0.31 -0.07 0.00 -0.53 0.00 0.00 39.78 39.27 2k5u n ASN 95 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 2k5u n ASP 96 N 1.48 3.96 -0.26 1.20 2.03 -1.10 -4.87 116.55 118.99 2k5u n ASP 96 Ca 0.20 -3.46 -0.07 0.00 0.52 0.00 0.00 54.79 51.98 2k5u n ASP 96 Cb 0.60 -0.70 0.05 0.00 -0.72 0.00 0.00 41.12 40.35 2k5u n ASP 96 CO 0.00 0.00 0.00 0.08 -1.92 0.00 0.00 177.20 175.36 2k5u h ARG 97 N 4.18 1.14 -0.10 -0.67 -0.00 -1.81 -2.00 114.38 115.12 2k5u h ARG 97 Ca 0.20 -0.25 0.03 0.00 -0.00 0.00 0.00 59.98 59.95 2k5u h ARG 97 Cb 0.65 -0.16 -0.00 0.00 -0.00 0.00 0.00 29.97 30.45 2k5u h ARG 97 CO 0.87 0.98 0.32 0.77 -0.00 0.00 0.00 179.97 182.91 2k5u h SER 98 N 1.08 0.00 -0.05 0.08 0.02 -1.96 0.21 113.55 112.93 2k5u h SER 98 Ca 0.23 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 2k5u h SER 98 Cb 0.32 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 -3.15 0.56 -0.21 3.45 1.74 -0.87 -4.61 116.66 113.56 2k5u n ARG 99 Ca 0.00 -1.11 0.02 0.00 -0.77 0.00 0.00 57.85 55.99 2k5u n ARG 99 Cb 0.41 -1.15 0.27 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 1.40 1.15 -0.38 0.55 6.09 0.12 -0.68 117.51 125.77 2k5u h ILE 100 Ca 0.00 -0.33 -0.12 0.00 -1.37 0.00 0.00 64.86 63.04 2k5u h ILE 100 Cb 0.37 0.11 -0.01 0.00 0.47 0.00 0.00 36.82 37.75 2k5u h ILE 100 CO 0.00 0.18 -0.26 1.23 -3.07 0.00 0.00 178.15 176.23 2k5u h GLY 101 N 0.96 0.84 1.55 8.18 0.00 -1.82 -0.47 103.07 112.32 2k5u h GLY 101 Ca 0.29 -0.75 -0.02 0.00 0.00 0.00 0.00 47.33 46.85 2k5u h GLY 101 CO -0.07 0.68 0.18 0.83 0.00 0.00 0.00 176.54 178.15 2k5u h GLU 102 N 0.67 0.59 -0.11 4.80 3.07 -1.47 -1.81 114.58 120.31 2k5u h GLU 102 Ca 0.09 -0.07 -0.24 0.00 -0.50 0.00 0.00 59.36 58.63 2k5u h GLU 102 Cb 0.78 -0.11 0.01 0.00 -0.84 0.00 0.00 28.75 28.59 2k5u h GLU 102 CO 0.06 0.48 -0.86 0.00 -1.40 0.00 0.00 179.01 177.29 2k5u h ALA 103 N 1.61 0.26 -0.96 3.43 0.00 -0.77 -2.82 119.26 120.02 2k5u h ALA 103 Ca 0.15 -0.63 0.05 0.00 0.00 0.00 0.00 54.91 54.48 2k5u h ALA 103 Cb 0.11 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.84 2k5u h ALA 103 CO -0.02 0.69 0.62 -0.09 0.00 0.00 0.00 179.25 180.44 2k5u h ARG 104 N 0.50 1.11 -0.32 0.00 1.12 -0.37 0.11 114.38 116.54 2k5u h ARG 104 Ca -0.08 -0.07 -0.18 0.00 -1.11 0.00 0.00 59.98 58.55 2k5u h ARG 104 Cb 1.50 -0.25 -0.00 0.00 -0.01 0.00 0.00 29.97 31.21 2k5u h ARG 104 CO 0.17 0.74 -0.51 0.93 -3.11 0.00 0.00 179.97 178.19 2k5u h GLU 105 N 1.15 0.90 -0.31 0.20 5.08 -1.38 0.38 114.58 120.60 2k5u h GLU 105 Ca 0.40 -0.55 -0.03 0.00 -1.00 0.00 0.00 59.36 58.19 2k5u h GLU 105 Cb 0.11 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 2k5u h GLU 105 CO -0.15 1.19 0.09 0.28 -1.00 0.00 0.00 179.01 179.41 2k5u h VAL 106 N 0.70 1.21 -0.26 3.13 2.07 -1.14 0.05 116.25 122.01 2k5u h VAL 106 Ca 0.03 -0.68 -0.12 0.00 0.82 0.00 0.00 66.70 66.74 2k5u h VAL 106 Cb 1.12 1.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.95 2k5u h VAL 106 CO 0.12 0.23 -0.35 0.00 0.02 0.00 0.00 177.57 177.59 2k5u h MET 107 N 0.34 0.57 -0.25 1.57 -0.00 -0.78 -2.55 114.93 113.83 2k5u h MET 107 Ca 0.10 -0.27 -0.03 0.00 -0.00 0.00 0.00 59.70 59.50 2k5u h MET 107 Cb 0.26 -0.01 -0.01 0.00 -0.00 0.00 0.00 31.60 31.84 2k5u h MET 107 CO -0.00 0.84 0.04 0.37 -0.00 0.00 0.00 176.91 178.16 2k5u h GLN 108 N 0.48 0.41 -0.89 -0.10 5.75 -0.68 0.56 115.11 120.65 2k5u h GLN 108 Ca 0.05 -0.11 0.00 0.00 -0.15 0.00 0.00 58.65 58.44 2k5u h GLN 108 Cb 0.83 -0.05 -0.04 0.00 1.07 0.00 0.00 27.48 29.29 2k5u h GLN 108 CO 0.07 0.54 0.56 0.00 -2.65 0.00 0.00 178.83 177.35 2k5u h ARG 109 N 0.21 1.19 -0.51 1.69 -0.00 -0.95 -2.18 114.38 113.84 2k5u h ARG 109 Ca 0.07 -0.09 -0.12 0.00 -0.50 0.00 0.00 59.98 59.34 2k5u h ARG 109 Cb 0.33 -0.26 -0.02 0.00 0.00 0.00 0.00 29.97 30.03 2k5u h ARG 109 CO 0.01 0.82 -0.15 1.98 0.00 0.00 0.00 179.97 182.63 2k5u h MET 110 N 1.21 1.00 0.00 0.04 4.05 -1.27 -2.65 114.93 117.30 2k5u h MET 110 Ca 0.32 -0.39 -0.00 0.00 -0.28 0.00 0.00 59.70 59.35 2k5u h MET 110 Cb -0.08 -0.05 -0.00 0.00 -0.80 0.00 0.00 31.60 30.66 2k5u h MET 110 CO -0.06 1.07 -0.00 1.25 0.23 0.00 0.00 176.91 179.39 2k5u h LEU 111 N 0.86 0.00 0.00 3.39 6.46 -0.36 -1.67 115.31 123.99 2k5u h LEU 111 Ca 0.13 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.89 2k5u h LEU 111 Cb 0.72 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.65 2k5u h LEU 111 CO 0.06 0.00 0.00 0.59 -0.62 0.00 0.00 178.44 178.47 2k5u n ASN 112 N -3.11 0.00 -4.60 1.25 3.02 -0.87 -4.77 115.26 106.19 2k5u n ASN 112 Ca -0.02 -1.56 -0.43 0.00 -0.03 0.00 0.00 54.58 52.54 2k5u n ASN 112 Cb 0.15 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.30 2k5u n ASN 112 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2k5u s GLU 113 N -2.00 3.67 0.40 3.52 8.01 -0.63 -4.89 118.70 126.78 2k5u s GLU 113 Ca 0.21 0.62 0.14 0.00 0.01 0.00 0.00 54.97 55.95 2k5u s GLU 113 Cb 0.10 -3.95 0.99 0.00 -4.31 0.00 0.00 34.13 26.96 2k5u s GLU 113 CO 0.16 -1.46 1.90 -0.44 0.01 0.00 0.00 175.26 175.43 2k5u h ASP 114 N 9.62 0.47 0.85 -0.19 3.32 -1.90 0.50 116.42 129.10 2k5u h ASP 114 Ca -0.24 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.84 2k5u h ASP 114 Cb 1.07 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.56 2k5u h ASP 114 CO 1.13 0.24 0.00 -0.62 -1.72 0.00 0.00 179.24 178.26 2k5u n GLU 115 N -4.51 0.08 -0.11 3.56 4.71 -1.26 -2.48 120.64 120.64 2k5u n GLU 115 Ca 0.16 0.21 0.06 0.00 -0.01 0.00 0.00 57.16 57.57 2k5u n GLU 115 Cb 0.53 -1.62 0.12 0.00 -1.01 0.00 0.00 31.44 29.45 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 2.58 0.24 -4.62 4.32 0.17 -4.49 117.00 113.42 2k5u n LEU 116 Ca 0.05 -1.56 0.16 0.00 -0.02 0.00 0.00 56.01 54.64 2k5u n LEU 116 Cb 0.27 -0.14 0.67 0.00 -1.62 0.00 0.00 43.42 42.61 2k5u n LEU 116 CO 0.21 0.59 0.97 0.03 -1.22 0.00 0.00 177.39 177.97 2k5u h ARG 117 N 2.31 0.00 -0.02 3.23 3.08 -0.98 -2.58 114.38 119.42 2k5u h ARG 117 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2k5u h ARG 117 Cb 0.65 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.70 2k5u h ARG 117 CO 0.00 0.00 -0.19 0.09 -1.07 0.00 0.00 179.97 178.80 2k5u n ASN 118 N -2.83 1.95 -4.84 7.04 5.03 -1.26 -4.99 115.26 115.36 2k5u n ASN 118 Ca 0.01 -1.48 -0.32 0.00 0.87 0.00 0.00 54.58 53.66 2k5u n ASN 118 Cb 0.26 0.27 -0.06 0.00 -1.02 0.00 0.00 39.78 39.23 2k5u n ASN 118 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2k5u s ALA 119 N -1.68 3.23 -0.03 5.41 0.00 -0.97 -5.03 121.76 122.69 2k5u s ALA 119 Ca 0.16 0.11 -0.30 0.00 0.00 0.00 0.00 51.96 51.93 2k5u s ALA 119 Cb 0.13 -2.89 -0.04 0.00 0.00 0.00 0.00 23.12 20.33 2k5u s ALA 119 CO 0.32 0.17 1.19 0.00 0.00 0.00 0.00 175.76 177.44 2k5u s ALA 120 N -2.16 3.46 -0.09 0.00 0.00 -1.26 -4.96 121.76 116.75 2k5u s ALA 120 Ca 0.56 0.65 -0.00 0.00 0.00 0.00 0.00 51.96 53.17 2k5u s ALA 120 Cb -0.10 -3.50 -0.03 0.00 0.00 0.00 0.00 23.12 19.50 2k5u s ALA 120 CO 0.20 -0.68 -0.07 -1.58 0.00 0.00 0.00 175.76 173.63 2k5u s TRP 121 N 1.97 2.95 -0.01 0.00 0.52 -1.12 -2.95 118.94 120.29 2k5u s TRP 121 Ca 0.56 -0.11 -0.00 0.00 0.02 0.00 0.00 56.10 56.57 2k5u s TRP 121 Cb -0.25 -1.78 0.01 0.00 -1.15 0.00 0.00 33.47 30.30 2k5u s TRP 121 CO 0.23 0.20 0.02 -1.17 0.02 0.00 0.00 176.95 176.25 2k5u s LEU 122 N -0.44 1.74 -0.37 2.99 2.96 -1.05 -2.59 118.68 121.93 2k5u s LEU 122 Ca 0.06 0.04 -0.06 0.00 -0.22 0.00 0.00 54.13 53.96 2k5u s LEU 122 Cb -0.12 0.04 0.07 0.00 0.50 0.00 0.00 46.19 46.67 2k5u s LEU 122 CO 0.02 -0.03 0.16 -0.69 -1.32 0.00 0.00 176.35 174.49 2k5u s VAL 123 N 0.24 3.69 -0.24 1.68 1.01 0.19 0.15 120.40 127.12 2k5u s VAL 123 Ca -0.02 -1.47 -0.17 0.00 0.00 0.00 0.00 61.98 60.32 2k5u s VAL 123 Cb -0.03 -3.24 -0.03 0.00 0.00 0.00 0.00 36.38 33.08 2k5u s VAL 123 CO -0.01 -0.39 0.47 0.12 0.00 0.00 0.00 175.10 175.30 2k5u s PHE 124 N 1.33 3.31 -0.20 5.22 5.36 0.17 -2.72 117.98 130.44 2k5u s PHE 124 Ca 0.01 0.63 -0.15 0.00 -0.96 0.00 0.00 56.93 56.47 2k5u s PHE 124 Cb -0.21 -2.65 -0.04 0.00 -0.34 0.00 0.00 43.02 39.78 2k5u s PHE 124 CO 0.00 -0.18 0.37 0.00 -1.46 0.00 0.00 175.22 173.95 2k5u s ALA 125 N 1.92 3.56 -0.24 11.12 0.00 -0.85 -2.52 121.76 134.74 2k5u s ALA 125 Ca 0.21 -0.55 0.01 0.00 0.00 0.00 0.00 51.96 51.63 2k5u s ALA 125 Cb -0.15 -2.58 0.06 0.00 0.00 0.00 0.00 23.12 20.44 2k5u s ALA 125 CO 0.09 -0.25 -0.07 -0.80 0.00 0.00 0.00 175.76 174.73 2k5u s ASN 126 N 0.99 4.02 0.00 0.00 0.01 -1.10 -1.90 114.94 116.96 2k5u s ASN 126 Ca 0.18 -1.24 0.00 0.00 -0.71 0.00 0.00 52.86 51.09 2k5u s ASN 126 Cb -0.14 -1.29 0.00 0.00 0.41 0.00 0.00 41.25 40.23 2k5u s ASN 126 CO 0.07 -0.22 0.00 0.29 -1.51 0.00 0.00 177.10 175.73 2k5u n LYS 127 N 4.60 0.00 0.04 -0.60 4.01 -1.12 -2.45 118.16 122.64 2k5u n LYS 127 Ca -0.13 0.00 0.12 0.00 -0.51 0.00 0.00 58.31 57.79 2k5u n LYS 127 Cb 0.43 0.00 0.48 0.00 -0.51 0.00 0.00 35.03 35.43 2k5u n LYS 127 CO 0.00 0.00 0.00 1.04 -1.11 0.00 0.00 177.40 177.33 2k5u n GLN 128 N 0.00 0.08 0.20 1.97 1.13 0.10 -2.74 117.38 118.12 2k5u n GLN 128 Ca 0.00 0.16 0.12 0.00 -1.94 0.00 0.00 57.00 55.34 2k5u n GLN 128 Cb 0.00 -1.61 0.15 0.00 0.11 0.00 0.00 30.24 28.89 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 -2.85 1.08 3.04 -1.95 -3.45 116.42 112.28 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 0.46 0.00 0.03 0.00 -1.04 0.00 0.00 39.33 38.78 2k5u h ASP 129 CO 0.00 0.02 0.86 -0.22 -2.04 0.00 0.00 179.24 177.86 2k5u s LEU 130 N -6.13 4.36 0.61 0.15 1.98 -1.11 -4.89 118.68 113.65 2k5u s LEU 130 Ca 0.06 2.43 0.34 0.00 -2.89 0.00 0.00 54.13 54.07 2k5u s LEU 130 Cb 0.06 -3.58 1.97 0.00 0.66 0.00 0.00 46.19 45.29 2k5u s LEU 130 CO 0.69 -0.78 2.27 1.55 -1.89 0.00 0.00 176.35 178.19 2k5u h PRO 131 N 7.33 0.00 -0.41 0.98 0.13 -1.90 -1.35 132.00 136.78 2k5u h PRO 131 Ca -0.42 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.59 2k5u h PRO 131 Cb 1.20 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.26 2k5u h PRO 131 CO 0.90 0.01 0.06 -0.85 -0.23 0.00 0.00 178.00 177.89 2k5u n GLU 132 N -3.60 2.72 -3.27 0.86 0.28 -1.26 -5.00 120.64 111.36 2k5u n GLU 132 Ca -0.03 -3.01 -0.33 0.00 -0.16 0.00 0.00 57.16 53.63 2k5u n GLU 132 Cb 0.09 -1.93 -0.06 0.00 1.43 0.00 0.00 31.44 30.98 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 -3.01 3.47 0.39 -1.84 0.00 -0.51 -4.85 121.76 115.41 2k5u s ALA 133 Ca 0.46 -0.08 -0.23 0.00 0.00 0.00 0.00 51.96 52.11 2k5u s ALA 133 Cb 0.39 -2.61 -0.10 0.00 0.00 0.00 0.00 23.12 20.79 2k5u s ALA 133 CO 0.07 0.42 0.97 0.00 0.00 0.00 0.00 175.76 177.21 2k5u s MET 134 N -2.57 4.33 0.48 0.00 0.23 -1.01 -5.01 119.30 115.75 2k5u s MET 134 Ca 0.47 1.26 -0.20 0.00 -1.03 0.00 0.00 55.69 56.19 2k5u s MET 134 Cb -0.12 -2.45 -0.09 0.00 -1.53 0.00 0.00 34.83 30.63 2k5u s MET 134 CO 0.19 0.05 1.00 -1.12 -2.03 0.00 0.00 175.02 173.11 2k5u s SER 135 N -1.88 6.57 0.35 -1.18 0.01 -1.26 -4.84 113.70 111.48 2k5u s SER 135 Ca 0.57 1.78 0.12 0.00 1.31 0.00 0.00 55.95 59.74 2k5u s SER 135 Cb -0.15 -2.54 0.94 0.00 0.21 0.00 0.00 66.02 64.48 2k5u s SER 135 CO 0.19 -0.62 1.77 0.00 0.41 0.00 0.00 173.24 174.99 2k5u h ALA 136 N 1.54 1.95 -0.44 1.44 0.00 -1.96 0.13 119.26 121.92 2k5u h ALA 136 Ca -0.49 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 2k5u h ALA 136 Cb 1.20 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 2k5u h ALA 136 CO 0.60 -0.36 0.20 0.00 0.00 0.00 0.00 179.25 179.70 2k5u h ALA 137 N 1.66 0.57 -0.25 0.00 0.00 -1.98 0.16 119.26 119.42 2k5u h ALA 137 Ca 0.59 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 55.26 2k5u h ALA 137 Cb 1.22 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 2k5u h ALA 137 CO -0.36 0.15 -0.33 1.49 0.00 0.00 0.00 179.25 180.20 2k5u h GLU 138 N 0.57 0.52 -0.38 0.00 4.81 -1.21 -2.61 114.58 116.28 2k5u h GLU 138 Ca 0.15 -0.23 -0.14 0.00 -0.13 0.00 0.00 59.36 59.01 2k5u h GLU 138 Cb 0.14 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 2k5u h GLU 138 CO -0.02 0.79 -0.30 0.82 -0.73 0.00 0.00 179.01 179.57 2k5u h ILE 139 N 0.45 1.28 -0.87 2.32 2.04 -0.64 -0.67 117.51 121.41 2k5u h ILE 139 Ca 0.05 -1.47 0.05 0.00 1.00 0.00 0.00 64.86 64.50 2k5u h ILE 139 Cb 0.80 1.38 -0.06 0.00 -0.74 0.00 0.00 36.82 38.19 2k5u h ILE 139 CO 0.06 0.49 0.55 0.74 0.00 0.00 0.00 178.15 179.99 2k5u h THR 140 N 0.68 1.07 -0.02 -0.27 2.02 -0.52 0.29 112.91 116.16 2k5u h THR 140 Ca 0.07 -0.35 -0.17 0.00 0.77 0.00 0.00 66.41 66.73 2k5u h THR 140 Cb 0.89 -0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 2k5u h THR 140 CO 0.08 0.18 -0.77 -0.33 0.37 0.00 0.00 175.52 175.06 2k5u h GLU 141 N 1.01 0.16 -0.34 6.66 4.39 -1.35 0.50 114.58 125.62 2k5u h GLU 141 Ca 0.37 -0.15 -0.12 0.00 0.34 0.00 0.00 59.36 59.80 2k5u h GLU 141 Cb 0.13 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.81 2k5u h GLU 141 CO -0.16 0.85 -0.26 -0.22 -1.16 0.00 0.00 179.01 178.06 2k5u h LYS 142 N 0.10 0.78 -0.06 2.33 1.63 0.15 -2.87 116.57 118.63 2k5u h LYS 142 Ca -0.03 -0.38 0.00 0.00 -0.85 0.00 0.00 60.65 59.39 2k5u h LYS 142 Cb 1.35 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.98 2k5u h LYS 142 CO 0.11 1.01 0.00 1.28 -3.45 0.00 0.00 179.45 178.40 2k5u n LEU 143 N -4.23 0.73 -1.17 5.20 4.77 0.90 -4.87 117.00 118.32 2k5u n LEU 143 Ca -0.03 -0.29 -0.12 0.00 -0.03 0.00 0.00 56.01 55.54 2k5u n LEU 143 Cb 0.46 -0.04 -0.03 0.00 -2.33 0.00 0.00 43.42 41.49 2k5u n LEU 143 CO 0.45 0.15 -0.14 0.61 -1.33 0.00 0.00 177.39 177.13 2k5u n GLY 144 N 0.96 0.52 0.29 -0.72 0.00 -1.08 -4.86 105.19 100.30 2k5u n GLY 144 Ca 0.16 -0.42 0.12 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.47 0.99 6.46 -0.25 0.33 115.31 122.37 2k5u h LEU 145 Ca -0.27 0.00 -0.07 0.00 -0.12 0.00 0.00 57.88 57.42 2k5u h LEU 145 Cb 1.02 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.94 2k5u h LEU 145 CO 0.35 0.00 -0.34 0.45 -0.62 0.00 0.00 178.44 178.28 2k5u h HIS 146 N 0.00 0.00 0.00 1.25 3.86 -1.88 -3.01 115.15 115.36 2k5u h HIS 146 Ca 0.02 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 2k5u h HIS 146 Cb 0.11 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.58 2k5u h HIS 146 CO 0.00 0.34 0.00 0.45 0.86 0.00 0.00 177.93 179.58 2k5u n SER 147 N -3.29 0.00 -4.81 2.45 2.88 0.11 -4.75 113.62 106.22 2k5u n SER 147 Ca 0.01 0.43 -0.34 0.00 -1.33 0.00 0.00 58.87 57.64 2k5u n SER 147 Cb 0.59 -0.47 -0.07 0.00 -0.75 0.00 0.00 64.21 63.50 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 -2.95 4.95 0.67 2.46 2.07 -1.14 -5.07 121.20 122.20 2k5u s ILE 148 Ca 0.11 -0.19 -0.17 0.00 -1.41 0.00 0.00 60.65 59.00 2k5u s ILE 148 Cb 0.14 -3.21 -0.10 0.00 0.13 0.00 0.00 42.46 39.42 2k5u s ILE 148 CO 0.38 0.46 0.07 -1.14 -1.91 0.00 0.00 174.94 172.80 2k5u n ARG 149 N 1.53 0.16 -2.80 3.50 3.00 -1.26 -4.88 116.66 115.91 2k5u n ARG 149 Ca -0.16 0.07 -0.41 0.00 -0.00 0.00 0.00 57.85 57.36 2k5u n ARG 149 Cb 0.53 -1.38 -0.04 0.00 0.00 0.00 0.00 32.46 31.58 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 -1.19 7.35 0.00 6.15 3.04 -1.26 -3.97 114.94 125.06 2k5u s ASN 150 Ca 0.58 1.63 0.00 0.00 0.04 0.00 0.00 52.86 55.11 2k5u s ASN 150 Cb -0.39 -2.54 0.00 0.00 -1.54 0.00 0.00 41.25 36.78 2k5u s ASN 150 CO 0.65 -0.11 0.00 -1.14 -3.04 0.00 0.00 177.10 173.45 2k5u n ARG 151 N 3.22 0.00 -0.25 0.43 0.63 -1.26 -5.00 116.66 114.43 2k5u n ARG 151 Ca 0.02 0.00 -0.09 0.00 -0.92 0.00 0.00 57.85 56.86 2k5u n ARG 151 Cb 0.50 0.00 -0.07 0.00 0.45 0.00 0.00 32.46 33.34 2k5u n ARG 151 CO 0.00 0.00 0.00 -1.35 -2.51 0.00 0.00 177.63 173.77 2k5u h PRO 152 N 0.00 -0.08 -4.85 -0.14 0.11 -1.94 -3.44 132.00 121.66 2k5u h PRO 152 Ca 0.00 0.01 -0.31 0.00 0.11 0.00 0.00 66.00 65.80 2k5u h PRO 152 Cb 0.00 0.02 -0.15 0.00 0.11 0.00 0.00 31.00 30.98 2k5u h PRO 152 CO 0.00 -0.05 -0.65 1.67 -0.21 0.00 0.00 178.00 178.76 2k5u s TRP 153 N -4.87 1.32 0.18 0.65 -2.14 -1.25 -2.79 118.94 110.05 2k5u s TRP 153 Ca -0.09 -1.05 0.11 0.00 2.66 0.00 0.00 56.10 57.73 2k5u s TRP 153 Cb 0.08 -0.76 -0.04 0.00 -3.10 0.00 0.00 33.47 29.64 2k5u s TRP 153 CO 0.45 -0.23 -0.23 0.12 -2.66 0.00 0.00 176.95 174.41 2k5u s PHE 154 N -3.66 2.21 -0.01 1.66 5.36 -1.07 -4.97 117.98 117.49 2k5u s PHE 154 Ca 0.28 -0.38 0.07 0.00 -0.96 0.00 0.00 56.93 55.94 2k5u s PHE 154 Cb 0.06 -1.11 -0.02 0.00 -0.34 0.00 0.00 43.02 41.61 2k5u s PHE 154 CO 0.07 0.44 -0.24 -1.50 -1.46 0.00 0.00 175.22 172.53 2k5u s ILE 155 N -1.63 1.88 -0.13 3.12 -1.16 -1.26 -0.64 121.20 121.39 2k5u s ILE 155 Ca 0.18 -1.04 -0.08 0.00 -0.51 0.00 0.00 60.65 59.21 2k5u s ILE 155 Cb -0.08 -1.57 0.05 0.00 0.61 0.00 0.00 42.46 41.47 2k5u s ILE 155 CO 0.09 0.52 0.31 -1.58 -2.81 0.00 0.00 174.94 171.47 2k5u s GLN 156 N -0.60 0.31 0.11 3.50 -0.44 -1.10 -5.01 119.66 116.43 2k5u s GLN 156 Ca 0.09 0.58 -0.23 0.00 -2.50 0.00 0.00 55.36 53.30 2k5u s GLN 156 Cb -0.09 -0.01 -0.07 0.00 -1.64 0.00 0.00 33.01 31.20 2k5u s GLN 156 CO -0.01 -0.13 0.68 0.00 0.50 0.00 0.00 175.29 176.34 2k5u s ALA 157 N 0.98 3.50 0.30 1.58 0.00 -1.26 -2.01 121.76 124.86 2k5u s ALA 157 Ca -0.07 0.21 -0.06 0.00 0.00 0.00 0.00 51.96 52.04 2k5u s ALA 157 Cb -0.07 -2.82 -0.00 0.00 0.00 0.00 0.00 23.12 20.23 2k5u s ALA 157 CO -0.07 0.32 0.46 0.95 0.00 0.00 0.00 175.76 177.41 2k5u s THR 158 N -1.03 0.00 -0.27 0.00 -4.23 -0.80 -4.76 115.64 104.56 2k5u s THR 158 Ca 0.33 -1.55 0.00 0.00 -1.18 0.00 0.00 61.69 59.29 2k5u s THR 158 Cb -0.21 -2.49 0.08 0.00 1.34 0.00 0.00 72.50 71.21 2k5u s THR 158 CO 0.23 0.00 0.03 0.00 -0.54 0.00 0.00 174.62 174.34 2k5u h ALA 160 N 8.00 1.60 0.08 0.00 0.00 -1.90 -0.83 119.26 126.22 2k5u h ALA 160 Ca -0.14 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 2k5u h ALA 160 Cb 1.05 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2k5u h ALA 160 CO 0.44 0.32 -0.04 0.00 0.00 0.00 0.00 179.25 179.96 2k5u h THR 161 N 0.49 1.16 -0.00 0.00 1.03 -1.95 -3.29 112.91 110.36 2k5u h THR 161 Ca 0.12 -1.32 0.00 0.00 -0.01 0.00 0.00 66.41 65.20 2k5u h THR 161 Cb 0.09 1.96 0.00 0.00 -1.07 0.00 0.00 68.15 69.13 2k5u h THR 161 CO -0.01 0.30 -0.08 -1.54 -0.01 0.00 0.00 175.52 174.18 2k5u n SER 162 N -4.85 0.14 0.00 0.00 3.41 -1.23 -4.89 113.62 106.20 2k5u n SER 162 Ca -0.08 0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.59 2k5u n SER 162 Cb 0.29 -0.28 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 2k5u n SER 162 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2k5u n GLY 163 N 1.41 0.58 3.64 5.00 0.00 -0.33 -4.96 105.19 110.52 2k5u n GLY 163 Ca 0.10 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 -0.41 3.94 0.00 1.61 2.12 -1.10 -2.52 118.70 122.34 2k5u s GLU 164 Ca 0.00 1.55 0.00 0.00 0.36 0.00 0.00 54.97 56.88 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 3.39 0.19 -1.50 0.00 -1.26 0.09 105.19 110.41 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 0.61 -0.19 0.99 3.38 -1.76 -0.96 115.31 117.38 2k5u h LEU 166 Ca 0.00 -0.39 -0.03 0.00 0.09 0.00 0.00 57.88 57.55 2k5u h LEU 166 Cb 0.00 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2k5u h LEU 166 CO 0.00 0.86 0.01 1.88 0.09 0.00 0.00 178.44 181.28 2k5u h TYR 167 N 0.36 0.35 0.00 1.13 0.05 -1.91 -2.75 116.97 114.19 2k5u h TYR 167 Ca 0.07 -0.06 -0.05 0.00 0.05 0.00 0.00 58.73 58.74 2k5u h TYR 167 Cb 0.62 -0.09 -0.01 0.00 1.01 0.00 0.00 36.73 38.26 2k5u h TYR 167 CO 0.06 0.51 -0.25 0.93 -1.05 0.00 0.00 178.16 178.36 2k5u h GLU 168 N 0.09 0.00 -0.14 4.88 4.39 -1.90 -1.35 114.58 120.54 2k5u h GLU 168 Ca 0.05 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.56 2k5u h GLU 168 Cb 0.37 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.02 2k5u h GLU 168 CO 0.01 0.25 -0.65 0.78 -1.16 0.00 0.00 179.01 178.23 2k5u h GLY 169 N 1.21 0.76 0.78 -3.84 0.00 -1.03 -2.51 103.07 98.46 2k5u h GLY 169 Ca -0.00 -1.06 -0.15 0.00 0.00 0.00 0.00 47.33 46.11 2k5u h GLY 169 CO 0.03 0.95 -0.58 0.17 0.00 0.00 0.00 176.54 177.11 2k5u h LEU 170 N 0.38 0.53 -0.56 3.11 8.10 -1.41 -2.48 115.31 122.98 2k5u h LEU 170 Ca -0.04 -0.75 0.10 0.00 0.11 0.00 0.00 57.88 57.30 2k5u h LEU 170 Cb 1.29 -0.16 -0.08 0.00 -0.44 0.00 0.00 40.66 41.27 2k5u h LEU 170 CO 0.14 1.20 0.13 -0.08 -4.11 0.00 0.00 178.44 175.72 2k5u h GLU 171 N -0.09 0.26 -0.40 0.17 4.57 -1.33 0.35 114.58 118.11 2k5u h GLU 171 Ca -0.07 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.08 2k5u h GLU 171 Cb 1.28 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.79 2k5u h GLU 171 CO 0.11 0.17 0.18 -1.49 -1.18 0.00 0.00 179.01 176.81 2k5u h TRP 172 N 0.27 0.58 -0.70 0.92 4.06 -1.49 -2.46 115.95 117.13 2k5u h TRP 172 Ca 0.29 -0.03 0.01 0.00 2.06 0.00 0.00 58.89 61.22 2k5u h TRP 172 Cb 0.41 -0.18 -0.03 0.00 -1.00 0.00 0.00 29.16 28.36 2k5u h TRP 172 CO -0.23 0.49 0.46 1.25 -3.56 0.00 0.00 178.44 176.85 2k5u h LEU 173 N 0.50 0.80 -0.75 -4.49 7.12 -0.70 -2.16 115.31 115.62 2k5u h LEU 173 Ca 0.14 -0.02 -0.02 0.00 0.13 0.00 0.00 57.88 58.11 2k5u h LEU 173 Cb 0.13 -0.20 -0.04 0.00 -0.53 0.00 0.00 40.66 40.03 2k5u h LEU 173 CO -0.02 0.58 0.40 0.77 -0.13 0.00 0.00 178.44 180.04 2k5u h SER 174 N 0.94 0.95 -0.54 1.25 4.64 0.09 -2.14 113.55 118.74 2k5u h SER 174 Ca 0.26 -0.10 0.02 0.00 -0.47 0.00 0.00 61.79 61.49 2k5u h SER 174 Cb -0.10 -0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 61.72 2k5u h SER 174 CO -0.06 0.78 0.34 -1.13 -0.87 0.00 0.00 176.83 175.89 2k5u h ASN 175 N 1.04 0.56 0.18 4.97 -0.73 -1.02 0.24 115.58 120.82 2k5u h ASN 175 Ca 0.26 -0.00 -0.05 0.00 1.87 0.00 0.00 56.30 58.38 2k5u h ASN 175 Cb 0.05 -0.12 -0.01 0.00 0.27 0.00 0.00 38.32 38.51 2k5u h ASN 175 CO -0.04 0.40 -0.22 0.28 -0.37 0.00 0.00 177.43 177.48 2k5u h SER 176 N 0.67 0.07 0.88 1.15 0.02 -1.30 0.86 113.55 115.90 2k5u h SER 176 Ca 0.21 -0.02 -0.23 0.00 -0.84 0.00 0.00 61.79 60.91 2k5u h SER 176 Cb -0.02 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 2k5u h SER 176 CO -0.08 0.30 -1.10 -0.07 -1.14 0.00 0.00 176.83 174.74 2k5u h LEU 177 N 0.07 0.10 0.00 5.07 -0.00 -0.65 -3.37 115.31 116.53 2k5u h LEU 177 Ca 0.01 -0.12 -0.15 0.00 -0.00 0.00 0.00 57.88 57.63 2k5u h LEU 177 Cb 0.43 -0.03 -0.02 0.00 -0.00 0.00 0.00 40.66 41.03 2k5u h LEU 177 CO 0.03 1.09 -0.95 0.07 -0.00 0.00 0.00 178.44 178.68 2k5u h LYS 178 N 0.02 0.00 -3.56 1.13 2.10 -0.17 -3.51 116.57 112.58 2k5u h LYS 178 Ca -0.06 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.59 2k5u h LYS 178 Cb 1.83 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.16 2k5u h LYS 178 CO 0.14 0.70 -0.79 -1.71 -2.00 0.00 0.00 179.45 175.79 2k5u n ASN 179 N -4.50 -8.05 0.01 7.07 4.05 0.29 -5.06 115.26 109.07 2k5u n ASN 179 Ca -0.23 1.13 0.00 0.00 0.45 0.00 0.00 54.58 55.93 2k5u n ASN 179 Cb 0.54 -4.17 0.00 0.00 1.23 0.00 0.00 39.78 37.37 2k5u n ASN 179 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 177.26 173.97 2k5u n SER 180 N 0.84 -0.02 -0.84 1.20 2.88 -1.26 -5.09 113.62 111.32 2k5u n SER 180 Ca 0.00 0.05 0.12 0.00 -1.33 0.00 0.00 58.87 57.71 2k5u n SER 180 Cb 0.00 0.05 0.20 0.00 -0.75 0.00 0.00 64.21 63.71 2k5u n SER 180 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88