#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 0.00 0.99 2.34 -1.26 -4.68 118.68 120.21 2k5u s LEU 3 Ca 0.00 0.01 0.00 0.00 0.06 0.00 0.00 54.13 54.20 2k5u s LEU 3 Cb 0.00 -2.25 0.00 0.00 -0.56 0.00 0.00 46.19 43.38 2k5u s LEU 3 CO 0.00 -0.16 0.00 0.49 -1.06 0.00 0.00 176.35 175.62 2k5u n PHE 4 N 5.20 -0.25 0.18 3.48 3.72 -1.26 -5.00 117.46 123.54 2k5u n PHE 4 Ca -0.11 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.19 2k5u n PHE 4 Cb 0.51 0.05 -0.05 0.00 -0.94 0.00 0.00 39.48 39.05 2k5u n PHE 4 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2k5u h ALA 5 N 0.00 -0.54 -2.95 4.37 0.00 -2.06 -3.48 119.26 114.61 2k5u h ALA 5 Ca 0.00 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.78 2k5u h ALA 5 Cb 0.00 0.21 -0.07 0.00 0.00 0.00 0.00 17.79 17.92 2k5u h ALA 5 CO 0.00 -0.52 0.13 -1.54 0.00 0.00 0.00 179.25 177.32 2k5u s SER 6 N -4.96 -0.27 -0.11 0.00 1.04 -1.26 -5.16 113.70 102.98 2k5u s SER 6 Ca -0.10 -0.57 -0.03 0.00 0.48 0.00 0.00 55.95 55.74 2k5u s SER 6 Cb 0.01 0.66 0.04 0.00 0.10 0.00 0.00 66.02 66.83 2k5u s SER 6 CO 0.31 -1.21 0.04 -1.59 0.98 0.00 0.00 173.24 171.76 2k5u s LYS 7 N -3.91 0.39 0.07 4.02 -2.85 -1.26 -4.93 119.74 111.27 2k5u s LYS 7 Ca 0.11 -0.01 0.00 0.00 -1.00 0.00 0.00 55.97 55.08 2k5u s LYS 7 Cb -0.04 -1.33 0.00 0.00 -2.06 0.00 0.00 37.83 34.40 2k5u s LYS 7 CO 0.03 -0.46 0.00 1.28 0.10 0.00 0.00 175.35 176.30 2k5u n LEU 8 N 5.18 0.29 0.00 2.77 7.99 -1.26 -5.04 117.00 126.92 2k5u n LEU 8 Ca -0.07 0.12 0.00 0.00 -0.01 0.00 0.00 56.01 56.05 2k5u n LEU 8 Cb 0.49 -0.03 0.00 0.00 -0.11 0.00 0.00 43.42 43.77 2k5u n LEU 8 CO 0.10 -0.62 -0.22 2.22 -1.51 0.00 0.00 177.39 177.36 2k5u n PHE 9 N -2.93 0.00 -1.68 -1.77 -1.74 -1.26 -5.03 117.46 103.04 2k5u n PHE 9 Ca 0.00 0.00 -0.43 0.00 -0.56 0.00 0.00 57.45 56.46 2k5u n PHE 9 Cb 0.00 0.25 -0.03 0.00 1.52 0.00 0.00 39.48 41.22 2k5u n PHE 9 CO 0.00 0.00 0.00 -1.54 -0.56 0.00 0.00 176.76 174.66 2k5u s SER 10 N -4.85 5.82 0.00 5.98 1.04 -1.26 -4.19 113.70 116.24 2k5u s SER 10 Ca 0.00 2.06 0.00 0.00 0.48 0.00 0.00 55.95 58.49 2k5u s SER 10 Cb 0.00 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.60 2k5u s SER 10 CO 0.00 -1.65 0.00 -3.20 0.98 0.00 0.00 173.24 169.37 2k5u n ASN 11 N 10.24 0.00 -0.97 7.02 2.85 -1.26 -4.96 115.26 128.18 2k5u n ASN 11 Ca 0.26 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.73 2k5u n ASN 11 Cb 0.44 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.46 2k5u n ASN 11 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 2k5u n LEU 12 N -0.60 -1.29 0.30 1.20 7.94 -1.26 -4.93 117.00 118.36 2k5u n LEU 12 Ca 0.00 0.00 0.17 0.00 -1.11 0.00 0.00 56.01 55.07 2k5u n LEU 12 Cb 0.00 -0.65 0.97 0.00 0.53 0.00 0.00 43.42 44.28 2k5u n LEU 12 CO 0.00 0.00 1.12 0.15 -1.11 0.00 0.00 177.39 177.55 2k5u h PHE 13 N 0.00 0.00 -4.33 1.96 3.04 -1.95 -3.43 116.94 112.23 2k5u h PHE 13 Ca 0.00 0.00 -0.51 0.00 3.98 0.00 0.00 57.97 61.44 2k5u h PHE 13 Cb 0.00 0.00 0.11 0.00 2.56 0.00 0.00 35.95 38.62 2k5u h PHE 13 CO 0.00 0.02 0.35 0.20 -2.02 0.00 0.00 178.31 176.86 2k5u s GLY 14 N -4.14 1.68 -0.16 2.40 0.00 -1.26 -4.98 107.32 100.85 2k5u s GLY 14 Ca -0.04 0.15 0.02 0.00 0.00 0.00 0.00 44.72 44.85 2k5u s GLY 14 CO 0.51 0.48 0.82 -2.01 0.00 0.00 0.00 173.10 172.90 2k5u n ASN 15 N -3.26 -0.60 -2.81 1.64 5.15 -1.26 -5.03 115.26 109.09 2k5u n ASN 15 Ca 0.08 -1.38 -0.29 0.00 -0.60 0.00 0.00 54.58 52.40 2k5u n ASN 15 Cb 0.53 0.48 -0.08 0.00 -0.53 0.00 0.00 39.78 40.18 2k5u n ASN 15 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 2k5u n LYS 16 N -0.35 3.09 -2.18 1.20 5.02 -1.26 -4.78 118.16 118.90 2k5u n LYS 16 Ca -0.13 -1.87 0.00 0.00 -2.02 0.00 0.00 58.31 54.29 2k5u n LYS 16 Cb 0.59 -2.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.14 2k5u n LYS 16 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2k5u n GLU 17 N 2.91 -4.66 -3.64 1.97 1.02 -1.26 -5.05 120.64 111.93 2k5u n GLU 17 Ca 0.63 3.43 -0.17 0.00 -0.02 0.00 0.00 57.16 61.03 2k5u n GLU 17 Cb 0.50 -4.23 -0.15 0.00 -0.02 0.00 0.00 31.44 27.54 2k5u n GLU 17 CO 0.00 0.00 0.00 1.41 1.18 0.00 0.00 177.13 179.72 2k5u s MET 18 N -0.79 0.06 -0.32 3.49 1.75 -1.26 -4.75 119.30 117.49 2k5u s MET 18 Ca 0.00 0.51 -0.02 0.00 -1.25 0.00 0.00 55.69 54.93 2k5u s MET 18 Cb 0.00 -0.44 0.11 0.00 2.84 0.00 0.00 34.83 37.34 2k5u s MET 18 CO 0.00 -0.37 0.14 1.03 -0.65 0.00 0.00 175.02 175.18 2k5u s ARG 19 N 2.30 0.47 -0.12 4.11 1.81 -1.26 -2.58 118.95 123.68 2k5u s ARG 19 Ca 0.03 -0.92 -0.29 0.00 -1.72 0.00 0.00 55.73 52.82 2k5u s ARG 19 Cb -0.13 -1.50 -0.01 0.00 -0.45 0.00 0.00 34.95 32.87 2k5u s ARG 19 CO -0.07 -1.05 1.02 0.42 -0.68 0.00 0.00 175.30 174.93 2k5u s ILE 20 N 1.66 4.76 0.06 1.52 -1.09 -0.32 0.21 121.20 128.00 2k5u s ILE 20 Ca 0.11 2.03 0.07 0.00 -2.23 0.00 0.00 60.65 60.64 2k5u s ILE 20 Cb -0.18 -4.31 -0.04 0.00 -1.58 0.00 0.00 42.46 36.35 2k5u s ILE 20 CO -0.24 -0.02 -0.16 -1.48 -1.23 0.00 0.00 174.94 171.80 2k5u s LEU 21 N 2.19 2.74 -0.41 2.97 0.05 -0.49 -2.52 118.68 123.21 2k5u s LEU 21 Ca 0.48 -0.43 -0.13 0.00 0.05 0.00 0.00 54.13 54.10 2k5u s LEU 21 Cb -0.18 -1.59 0.04 0.00 -2.05 0.00 0.00 46.19 42.40 2k5u s LEU 21 CO 0.16 0.23 0.28 -0.32 -0.55 0.00 0.00 176.35 176.15 2k5u s MET 22 N -1.70 2.89 0.14 1.48 1.75 -0.19 -1.23 119.30 122.43 2k5u s MET 22 Ca 0.16 -1.13 0.10 0.00 -1.25 0.00 0.00 55.69 53.58 2k5u s MET 22 Cb -0.11 -3.90 -0.04 0.00 2.84 0.00 0.00 34.83 33.63 2k5u s MET 22 CO 0.08 -0.79 -0.24 0.54 -0.65 0.00 0.00 175.02 173.96 2k5u s VAL 23 N 1.61 2.08 -5.00 10.11 0.11 -1.06 -1.66 120.40 126.59 2k5u s VAL 23 Ca 0.04 -1.76 0.00 0.00 -2.93 0.00 0.00 61.98 57.32 2k5u s VAL 23 Cb -0.20 -1.88 0.00 0.00 -1.53 0.00 0.00 36.38 32.76 2k5u s VAL 23 CO 0.08 -0.03 0.00 0.61 -3.33 0.00 0.00 175.10 172.43 2k5u n GLY 24 N 0.78 -0.90 3.79 6.54 0.00 -1.26 -2.72 105.19 111.42 2k5u n GLY 24 Ca -0.17 -1.40 -0.33 0.00 0.00 0.00 0.00 46.02 44.12 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 3.52 0.44 0.99 1.98 -1.26 -0.20 118.68 124.14 2k5u s LEU 25 Ca 0.00 1.94 -0.24 0.00 -2.89 0.00 0.00 54.13 52.94 2k5u s LEU 25 Cb 0.00 -4.55 -0.08 0.00 0.66 0.00 0.00 46.19 42.22 2k5u s LEU 25 CO 0.00 -1.31 1.24 -0.62 -1.89 0.00 0.00 176.35 173.77 2k5u s ASP 26 N -2.51 6.17 0.00 3.68 2.15 -1.26 -2.60 116.67 122.29 2k5u s ASP 26 Ca 0.66 2.50 0.00 0.00 0.43 0.00 0.00 52.55 56.14 2k5u s ASP 26 Cb -0.19 -2.62 0.00 0.00 -0.30 0.00 0.00 42.92 39.81 2k5u s ASP 26 CO 0.36 -0.93 0.00 0.61 -0.17 0.00 0.00 175.17 175.04 2k5u n GLY 27 N 0.60 1.00 0.31 2.66 0.00 -1.26 -4.86 105.19 103.64 2k5u n GLY 27 Ca 0.06 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.28 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 -1.79 -3.45 119.26 119.63 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 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 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 -0.51 1.29 0.21 0.00 0.00 -1.26 -4.14 105.19 100.78 2k5u n GLY 29 Ca -0.01 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.08 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 0.07 1.61 1.57 -1.90 -1.01 116.57 116.91 2k5u h LYS 30 Ca 0.00 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.64 2k5u h LYS 30 Cb 0.00 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.32 2k5u h LYS 30 CO 0.00 0.28 -0.58 1.15 -0.57 0.00 0.00 179.45 179.73 2k5u h THR 31 N 0.00 1.53 -0.18 -0.16 2.02 -1.96 -2.35 112.91 111.81 2k5u h THR 31 Ca -0.00 -2.32 -0.03 0.00 0.77 0.00 0.00 66.41 64.83 2k5u h THR 31 Cb 0.64 3.02 -0.01 0.00 -1.74 0.00 0.00 68.15 70.07 2k5u h THR 31 CO 0.04 0.65 0.01 0.74 0.37 0.00 0.00 175.52 177.33 2k5u h THR 32 N -0.40 1.24 -0.49 3.16 2.02 -1.95 -2.95 112.91 113.54 2k5u h THR 32 Ca -0.09 -0.81 -0.06 0.00 0.77 0.00 0.00 66.41 66.22 2k5u h THR 32 Cb 1.39 1.42 -0.02 0.00 -1.74 0.00 0.00 68.15 69.21 2k5u h THR 32 CO 0.11 0.25 0.07 0.58 0.37 0.00 0.00 175.52 176.90 2k5u h VAL 33 N 0.08 1.23 -0.21 3.16 2.07 -1.32 -2.83 116.25 118.44 2k5u h VAL 33 Ca 0.05 -0.87 0.05 0.00 0.82 0.00 0.00 66.70 66.76 2k5u h VAL 33 Cb 0.36 0.77 -0.05 0.00 -1.52 0.00 0.00 31.29 30.86 2k5u h VAL 33 CO 0.01 0.31 -0.10 -0.07 0.02 0.00 0.00 177.57 177.74 2k5u h LEU 34 N 0.74 -0.32 -1.21 2.57 3.38 -1.29 -0.54 115.31 118.64 2k5u h LEU 34 Ca 0.16 0.08 0.04 0.00 0.09 0.00 0.00 57.88 58.25 2k5u h LEU 34 Cb 0.35 0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.23 2k5u h LEU 34 CO 0.01 -0.13 0.55 0.22 0.09 0.00 0.00 178.44 179.18 2k5u h TYR 35 N -0.07 0.99 -0.36 1.13 3.20 -1.35 -1.85 116.97 118.67 2k5u h TYR 35 Ca 0.11 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.99 2k5u h TYR 35 Cb 0.24 -0.33 -0.02 0.00 1.54 0.00 0.00 36.73 38.16 2k5u h TYR 35 CO -0.26 0.57 0.16 0.87 -1.64 0.00 0.00 178.16 177.86 2k5u h LYS 36 N 1.02 0.52 0.00 1.82 6.56 -0.99 -1.94 116.57 123.56 2k5u h LYS 36 Ca 0.34 -0.08 0.00 0.00 -1.06 0.00 0.00 60.65 59.84 2k5u h LYS 36 Cb 0.06 -0.09 0.00 0.00 -0.57 0.00 0.00 32.23 31.63 2k5u h LYS 36 CO -0.10 0.49 0.00 1.28 -2.06 0.00 0.00 179.45 179.05 2k5u n LEU 37 N -4.71 0.11 0.00 2.94 7.99 -0.33 -4.90 117.00 118.09 2k5u n LEU 37 Ca -0.01 0.53 0.00 0.00 -0.01 0.00 0.00 56.01 56.52 2k5u n LEU 37 Cb 0.12 -0.51 0.00 0.00 -0.11 0.00 0.00 43.42 42.92 2k5u n LEU 37 CO 0.36 -0.28 0.00 0.29 -1.51 0.00 0.00 177.39 176.25 2k5u n LYS 38 N -1.62 0.00 -3.37 3.23 4.76 -0.73 -4.77 118.16 115.66 2k5u n LYS 38 Ca 0.04 0.00 -0.19 0.00 -2.87 0.00 0.00 58.31 55.28 2k5u n LYS 38 Cb 0.19 0.00 0.06 0.00 -1.84 0.00 0.00 35.03 33.44 2k5u n LYS 38 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2k5u n LEU 39 N 0.00 -4.86 0.00 -0.35 4.77 -1.26 -4.78 117.00 110.52 2k5u n LEU 39 Ca 0.00 -0.78 0.00 0.00 -0.03 0.00 0.00 56.01 55.20 2k5u n LEU 39 Cb 0.00 -2.97 0.00 0.00 -2.33 0.00 0.00 43.42 38.12 2k5u n LEU 39 CO 0.00 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 176.84 2k5u n GLY 40 N -1.38 0.00 2.88 -0.72 0.00 -1.26 -3.44 105.19 101.26 2k5u n GLY 40 Ca -0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.65 2k5u n GLY 40 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k5u s GLU 41 N 0.00 1.34 0.07 1.61 8.01 -1.26 -5.12 118.70 123.35 2k5u s GLU 41 Ca 0.00 -0.75 -0.18 0.00 0.01 0.00 0.00 54.97 54.05 2k5u s GLU 41 Cb 0.00 -2.36 -0.07 0.00 -4.31 0.00 0.00 34.13 27.40 2k5u s GLU 41 CO 0.00 -0.58 0.54 0.54 0.01 0.00 0.00 175.26 175.77 2k5u s VAL 42 N 1.56 4.80 0.05 2.63 0.11 -1.22 -4.90 120.40 123.43 2k5u s VAL 42 Ca -0.03 1.10 -0.23 0.00 -2.93 0.00 0.00 61.98 59.88 2k5u s VAL 42 Cb -0.18 -3.84 -0.06 0.00 -1.53 0.00 0.00 36.38 30.77 2k5u s VAL 42 CO -0.07 0.51 0.71 -0.63 -3.33 0.00 0.00 175.10 172.29 2k5u s ILE 43 N -1.16 4.72 -0.18 7.04 -1.09 -1.09 -4.95 121.20 124.50 2k5u s ILE 43 Ca 0.29 1.51 -0.10 0.00 -2.23 0.00 0.00 60.65 60.12 2k5u s ILE 43 Cb -0.18 -4.05 -0.05 0.00 -1.58 0.00 0.00 42.46 36.59 2k5u s ILE 43 CO 0.18 0.42 0.16 0.42 -1.23 0.00 0.00 174.94 174.89 2k5u s THR 44 N -0.34 5.40 -0.05 2.92 -4.23 -1.26 -2.80 115.64 115.28 2k5u s THR 44 Ca 0.35 0.27 -0.01 0.00 -1.18 0.00 0.00 61.69 61.12 2k5u s THR 44 Cb -0.20 -3.49 0.03 0.00 1.34 0.00 0.00 72.50 70.17 2k5u s THR 44 CO 0.22 0.46 0.01 0.28 -0.54 0.00 0.00 174.62 175.05 2k5u s THR 45 N 0.13 0.23 -0.67 3.99 -1.32 -1.01 -5.06 115.64 111.93 2k5u s THR 45 Ca 0.11 0.16 0.06 0.00 -1.21 0.00 0.00 61.69 60.81 2k5u s THR 45 Cb -0.12 -0.39 0.22 0.00 -1.51 0.00 0.00 72.50 70.70 2k5u s THR 45 CO 0.00 0.21 0.66 -0.38 -2.21 0.00 0.00 174.62 172.90 2k5u n ILE 46 N 4.86 2.11 0.06 5.08 2.08 -1.26 -2.65 119.36 129.64 2k5u n ILE 46 Ca -0.12 -5.10 -0.18 0.00 0.56 0.00 0.00 62.75 57.91 2k5u n ILE 46 Cb 0.50 -2.13 -0.14 0.00 -0.75 0.00 0.00 39.64 37.11 2k5u n ILE 46 CO 0.00 0.00 0.00 1.55 0.56 0.00 0.00 176.55 178.66 2k5u h PRO 47 N 4.63 0.26 -4.99 0.38 0.13 -1.95 -3.42 132.00 127.05 2k5u h PRO 47 Ca 0.18 -0.45 -0.69 0.00 -0.87 0.00 0.00 66.00 64.17 2k5u h PRO 47 Cb 0.69 0.17 -0.18 0.00 0.13 0.00 0.00 31.00 31.81 2k5u h PRO 47 CO 0.79 1.12 0.79 0.95 -0.23 0.00 0.00 178.00 181.43 2k5u s THR 48 N -2.61 4.75 -0.45 1.56 -4.23 -1.26 -4.98 115.64 108.43 2k5u s THR 48 Ca -0.11 -1.58 -0.44 0.00 -1.18 0.00 0.00 61.69 58.38 2k5u s THR 48 Cb 0.07 -4.76 -0.18 0.00 1.34 0.00 0.00 72.50 68.96 2k5u s THR 48 CO 0.85 -1.48 1.83 -0.38 -0.54 0.00 0.00 174.62 174.89 2k5u n ILE 49 N 5.45 0.07 0.00 2.99 2.08 -1.26 -0.37 119.36 128.32 2k5u n ILE 49 Ca 0.23 -0.03 0.00 0.00 0.56 0.00 0.00 62.75 63.51 2k5u n ILE 49 Cb 0.49 -0.73 0.00 0.00 -0.75 0.00 0.00 39.64 38.65 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 5.23 0.68 3.22 7.39 0.00 -1.26 -5.09 105.19 115.37 2k5u n GLY 50 Ca 0.38 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.29 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 -2.00 0.89 -0.03 1.61 0.40 0.50 -5.17 117.98 114.18 2k5u s PHE 51 Ca 0.00 -1.20 0.02 0.00 -0.60 0.00 0.00 56.93 55.15 2k5u s PHE 51 Cb 0.00 -0.42 0.01 0.00 0.51 0.00 0.00 43.02 43.12 2k5u s PHE 51 CO 0.00 -0.62 -0.07 -0.80 0.70 0.00 0.00 175.22 174.43 2k5u s ASN 52 N -3.08 1.01 -0.06 1.36 -0.87 -1.26 -4.65 114.94 107.38 2k5u s ASN 52 Ca 0.29 -0.15 0.01 0.00 -1.57 0.00 0.00 52.86 51.44 2k5u s ASN 52 Cb 0.06 -0.35 0.02 0.00 -0.02 0.00 0.00 41.25 40.97 2k5u s ASN 52 CO 0.06 0.02 -0.07 -0.69 -2.57 0.00 0.00 177.10 173.85 2k5u s VAL 53 N 0.45 0.76 0.15 1.60 1.01 -1.08 -4.29 120.40 119.00 2k5u s VAL 53 Ca -0.06 -0.22 0.08 0.00 0.00 0.00 0.00 61.98 61.77 2k5u s VAL 53 Cb -0.10 -0.77 -0.04 0.00 0.00 0.00 0.00 36.38 35.47 2k5u s VAL 53 CO 0.00 0.29 -0.07 -1.61 0.00 0.00 0.00 175.10 173.71 2k5u s GLU 54 N 1.08 2.20 -0.02 2.72 2.02 -0.98 -2.42 118.70 123.30 2k5u s GLU 54 Ca -0.08 -1.12 -0.01 0.00 0.02 0.00 0.00 54.97 53.79 2k5u s GLU 54 Cb -0.14 -2.28 0.02 0.00 0.10 0.00 0.00 34.13 31.83 2k5u s GLU 54 CO -0.01 0.47 0.04 -0.08 0.02 0.00 0.00 175.26 175.70 2k5u s THR 55 N -1.52 -0.04 0.05 3.63 -1.32 -1.12 -2.28 115.64 113.04 2k5u s THR 55 Ca 0.24 0.15 0.06 0.00 -1.21 0.00 0.00 61.69 60.93 2k5u s THR 55 Cb -0.10 -0.09 -0.02 0.00 -1.51 0.00 0.00 72.50 70.78 2k5u s THR 55 CO 0.16 0.06 -0.16 -0.69 -2.21 0.00 0.00 174.62 171.78 2k5u s VAL 56 N 0.79 1.26 -0.18 5.08 1.01 0.21 -2.68 120.40 125.88 2k5u s VAL 56 Ca -0.06 -1.12 0.01 0.00 0.00 0.00 0.00 61.98 60.80 2k5u s VAL 56 Cb -0.09 -1.14 0.02 0.00 0.00 0.00 0.00 36.38 35.16 2k5u s VAL 56 CO -0.02 0.00 -0.19 0.00 0.00 0.00 0.00 175.10 174.88 2k5u s GLN 57 N -1.30 3.01 0.17 2.72 -2.07 -1.26 -1.42 119.66 119.51 2k5u s GLN 57 Ca 0.02 -0.82 0.04 0.00 -1.82 0.00 0.00 55.36 52.78 2k5u s GLN 57 Cb -0.08 -2.59 -0.03 0.00 -1.09 0.00 0.00 33.01 29.21 2k5u s GLN 57 CO 0.02 -0.20 0.26 0.71 -1.32 0.00 0.00 175.29 174.76 2k5u s TYR 58 N 1.27 3.38 0.00 9.60 1.51 0.29 -4.96 117.35 128.45 2k5u s TYR 58 Ca 0.04 0.05 0.00 0.00 -1.01 0.00 0.00 57.07 56.16 2k5u s TYR 58 Cb -0.13 -1.60 0.00 0.00 -0.11 0.00 0.00 41.96 40.12 2k5u s TYR 58 CO -0.12 0.51 0.99 1.63 -1.11 0.00 0.00 175.55 177.44 2k5u n LYS 59 N -0.68 0.00 -0.49 -0.62 4.76 -1.26 -2.53 118.16 117.35 2k5u n LYS 59 Ca -0.08 0.96 0.08 0.00 -2.87 0.00 0.00 58.31 56.41 2k5u n LYS 59 Cb 0.55 -1.49 0.29 0.00 -1.84 0.00 0.00 35.03 32.54 2k5u n LYS 59 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 2k5u n ASN 60 N -2.90 4.17 -2.53 4.39 6.94 -1.26 -5.00 115.26 119.07 2k5u n ASN 60 Ca 0.00 -2.52 -0.08 0.00 -0.02 0.00 0.00 54.58 51.95 2k5u n ASN 60 Cb 0.00 -0.50 0.02 0.00 -2.36 0.00 0.00 39.78 36.94 2k5u n ASN 60 CO 0.00 0.00 0.00 2.30 -1.03 0.00 0.00 177.26 178.53 2k5u n ILE 61 N 0.53 0.00 -3.89 1.53 -5.35 -1.05 -4.60 119.36 106.53 2k5u n ILE 61 Ca 0.21 -0.94 -0.09 0.00 -0.27 0.00 0.00 62.75 61.66 2k5u n ILE 61 Cb 0.80 0.85 -0.08 0.00 -1.74 0.00 0.00 39.64 39.47 2k5u n ILE 61 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 2k5u s SER 62 N -2.76 0.13 -0.04 7.28 0.15 -1.07 0.11 113.70 117.51 2k5u s SER 62 Ca 0.15 -0.55 -0.00 0.00 0.70 0.00 0.00 55.95 56.25 2k5u s SER 62 Cb -0.04 0.28 0.03 0.00 -1.71 0.00 0.00 66.02 64.58 2k5u s SER 62 CO 0.11 -0.60 0.00 -0.36 1.20 0.00 0.00 173.24 173.59 2k5u s PHE 63 N -3.09 0.36 -0.07 3.44 0.40 -0.51 -1.17 117.98 117.34 2k5u s PHE 63 Ca -0.01 -0.01 -0.01 0.00 -0.60 0.00 0.00 56.93 56.31 2k5u s PHE 63 Cb 0.02 -0.48 0.03 0.00 0.51 0.00 0.00 43.02 43.09 2k5u s PHE 63 CO -0.07 -0.17 -0.01 0.99 0.70 0.00 0.00 175.22 176.66 2k5u s THR 64 N 1.26 0.44 0.11 0.64 2.01 -1.05 0.65 115.64 119.72 2k5u s THR 64 Ca -0.06 0.04 0.06 0.00 0.31 0.00 0.00 61.69 62.04 2k5u s THR 64 Cb -0.13 -0.56 -0.04 0.00 0.01 0.00 0.00 72.50 71.78 2k5u s THR 64 CO -0.02 0.25 -0.05 0.68 -0.69 0.00 0.00 174.62 174.80 2k5u s VAL 65 N 1.69 3.66 -0.27 3.82 -7.23 -0.97 -1.03 120.40 120.08 2k5u s VAL 65 Ca 0.01 -1.21 -0.27 0.00 -1.81 0.00 0.00 61.98 58.69 2k5u s VAL 65 Cb -0.13 -2.75 0.17 0.00 0.56 0.00 0.00 36.38 34.23 2k5u s VAL 65 CO -0.04 0.06 1.27 -1.66 -0.31 0.00 0.00 175.10 174.43 2k5u s TRP 66 N -1.36 -0.17 1.20 2.82 -2.14 -0.66 -2.32 118.94 116.30 2k5u s TRP 66 Ca 0.24 0.36 -0.20 0.00 2.66 0.00 0.00 56.10 59.17 2k5u s TRP 66 Cb -0.11 0.46 0.31 0.00 -3.10 0.00 0.00 33.47 31.03 2k5u s TRP 66 CO 0.16 -0.12 0.70 -3.47 -2.66 0.00 0.00 176.95 171.56 2k5u n ASP 67 N 1.19 -3.78 -4.51 -2.66 2.03 -1.26 -4.03 116.55 103.53 2k5u n ASP 67 Ca -0.07 -0.71 -0.21 0.00 0.52 0.00 0.00 54.79 54.32 2k5u n ASP 67 Cb 0.58 -0.81 -0.19 0.00 -0.72 0.00 0.00 41.12 39.98 2k5u n ASP 67 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 2k5u n VAL 68 N -5.29 -0.00 0.00 5.18 0.24 0.71 -4.52 118.33 114.65 2k5u n VAL 68 Ca 0.11 -0.48 0.00 0.00 -2.04 0.00 0.00 64.34 61.93 2k5u n VAL 68 Cb 0.48 -0.51 0.00 0.00 -1.47 0.00 0.00 33.84 32.34 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 5.85 -3.21 0.00 7.63 0.00 -1.26 -3.52 105.19 110.68 2k5u n GLY 69 Ca 0.63 0.38 0.00 0.00 0.00 0.00 0.00 46.02 47.03 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 -0.82 0.00 2.31 -0.02 0.00 -1.26 0.12 105.19 105.52 2k5u n GLY 70 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.95 1.49 -0.39 1.61 6.02 -1.23 -4.80 117.38 119.12 2k5u n GLN 71 Ca 0.00 -0.86 0.00 0.00 -0.01 0.00 0.00 57.00 56.13 2k5u n GLN 71 Cb 0.00 -1.99 0.00 0.00 1.02 0.00 0.00 30.24 29.27 2k5u n GLN 71 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2k5u n ASP 72 N 3.10 0.00 0.00 1.08 -0.08 0.32 -5.03 116.55 115.95 2k5u n ASP 72 Ca 0.32 -0.39 0.00 0.00 -1.51 0.00 0.00 54.79 53.20 2k5u n ASP 72 Cb 0.44 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.90 2k5u n ASP 72 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2k5u n ARG 73 N -0.39 0.00 -1.09 -0.67 1.74 -1.26 -5.09 116.66 109.89 2k5u n ARG 73 Ca 0.00 0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 56.74 2k5u n ARG 73 Cb 0.00 0.00 0.12 0.00 -1.02 0.00 0.00 32.46 31.56 2k5u n ARG 73 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2k5u n ILE 74 N -1.84 1.86 -3.47 0.55 2.08 -1.26 -5.03 119.36 112.26 2k5u n ILE 74 Ca 0.00 -0.22 -0.22 0.00 0.56 0.00 0.00 62.75 62.87 2k5u n ILE 74 Cb 0.00 -1.12 -0.12 0.00 -0.75 0.00 0.00 39.64 37.65 2k5u n ILE 74 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2k5u s ARG 75 N -3.96 0.25 0.00 0.38 1.70 -1.26 -4.94 118.95 111.11 2k5u s ARG 75 Ca 0.72 -0.22 0.00 0.00 -0.47 0.00 0.00 55.73 55.75 2k5u s ARG 75 Cb -0.29 -0.95 0.00 0.00 -0.57 0.00 0.00 34.95 33.14 2k5u s ARG 75 CO 0.53 -0.96 0.00 -1.13 -1.08 0.00 0.00 175.30 172.66 2k5u n SER 76 N 5.29 0.00 -0.21 -2.89 3.41 -1.26 -4.96 113.62 113.00 2k5u n SER 76 Ca -0.04 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.65 2k5u n SER 76 Cb 0.45 0.05 0.35 0.00 -0.26 0.00 0.00 64.21 64.81 2k5u n SER 76 CO 0.00 0.00 0.00 0.17 -0.16 0.00 0.00 175.04 175.05 2k5u h LEU 77 N 0.00 0.68 -0.74 1.04 8.10 -2.01 -1.46 115.31 120.92 2k5u h LEU 77 Ca 0.00 0.01 0.00 0.00 0.11 0.00 0.00 57.88 58.01 2k5u h LEU 77 Cb 0.00 -0.13 -0.04 0.00 -0.44 0.00 0.00 40.66 40.05 2k5u h LEU 77 CO 0.00 0.41 0.47 -0.25 -4.11 0.00 0.00 178.44 174.97 2k5u h TRP 78 N 0.76 0.95 0.07 0.17 7.01 -1.92 -2.64 115.95 120.35 2k5u h TRP 78 Ca 0.35 0.01 0.01 0.00 2.11 0.00 0.00 58.89 61.38 2k5u h TRP 78 Cb 0.38 -0.32 -0.02 0.00 -2.10 0.00 0.00 29.16 27.10 2k5u h TRP 78 CO -0.00 0.62 -0.14 -0.09 -2.79 0.00 0.00 178.44 176.04 2k5u h ARG 79 N 1.01 -0.26 -0.07 2.65 2.43 -1.65 0.84 114.38 119.33 2k5u h ARG 79 Ca 0.27 0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.49 2k5u h ARG 79 Cb -0.08 0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 29.47 2k5u h ARG 79 CO -0.05 -0.17 -0.38 1.25 -1.51 0.00 0.00 179.97 179.10 2k5u h HIS 80 N -0.27 -1.08 0.00 2.20 2.76 -1.33 -0.18 115.15 117.26 2k5u h HIS 80 Ca 0.03 0.04 -0.01 0.00 -2.20 0.00 0.00 60.37 58.22 2k5u h HIS 80 Cb 0.29 0.48 -0.00 0.00 1.55 0.00 0.00 27.41 29.73 2k5u h HIS 80 CO -0.16 -0.46 -0.05 1.88 -1.30 0.00 0.00 177.93 177.84 2k5u h TYR 81 N -0.49 0.00 0.06 5.26 0.05 -1.33 -2.96 116.97 117.55 2k5u h TYR 81 Ca 0.07 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.85 2k5u h TYR 81 Cb 0.61 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.35 2k5u h TYR 81 CO -0.43 0.05 -0.05 -0.92 -1.05 0.00 0.00 178.16 175.76 2k5u h TYR 82 N 0.00 -0.14 -0.63 4.88 3.20 0.26 0.59 116.97 125.13 2k5u h TYR 82 Ca -0.00 0.00 0.01 0.00 3.14 0.00 0.00 58.73 61.88 2k5u h TYR 82 Cb 0.56 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.85 2k5u h TYR 82 CO 0.00 -0.07 0.42 0.00 -1.64 0.00 0.00 178.16 176.87 2k5u h ARG 83 N -0.11 0.83 -0.89 1.82 3.08 -1.60 -2.76 114.38 114.76 2k5u h ARG 83 Ca -0.01 -0.05 0.09 0.00 0.07 0.00 0.00 59.98 60.08 2k5u h ARG 83 Cb 0.09 -0.19 -0.07 0.00 0.08 0.00 0.00 29.97 29.88 2k5u h ARG 83 CO -0.00 0.55 0.54 -0.97 -1.07 0.00 0.00 179.97 179.02 2k5u h ASN 84 N 0.86 0.82 -3.78 7.04 -0.73 -1.41 -3.42 115.58 114.95 2k5u h ASN 84 Ca 0.23 0.04 -0.54 0.00 1.87 0.00 0.00 56.30 57.89 2k5u h ASN 84 Cb -0.10 -0.13 0.11 0.00 0.27 0.00 0.00 38.32 38.47 2k5u h ASN 84 CO -0.05 0.48 0.77 0.35 -0.37 0.00 0.00 177.43 178.61 2k5u n THR 85 N -4.66 1.87 -0.27 -3.57 -2.24 0.21 -4.72 114.28 100.89 2k5u n THR 85 Ca 0.15 -0.47 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 2k5u n THR 85 Cb 0.26 -1.94 0.00 0.00 -2.10 0.00 0.00 70.33 66.54 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 0.67 1.37 -3.87 -0.78 -0.58 -0.92 -4.80 120.64 111.73 2k5u n GLU 86 Ca 0.02 -0.99 -0.12 0.00 -0.42 0.00 0.00 57.16 55.66 2k5u n GLU 86 Cb 0.38 -0.86 -0.14 0.00 -0.57 0.00 0.00 31.44 30.25 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 -0.53 0.01 -0.22 0.62 0.00 0.55 -4.10 107.32 103.65 2k5u s GLY 87 Ca 0.00 -0.00 -0.03 0.00 0.00 0.00 0.00 44.72 44.69 2k5u s GLY 87 CO 0.00 -0.01 0.07 0.14 0.00 0.00 0.00 173.10 173.30 2k5u s VAL 88 N -0.09 0.32 -0.23 1.40 1.01 -1.15 -1.39 120.40 120.26 2k5u s VAL 88 Ca -0.01 -0.61 -0.02 0.00 0.00 0.00 0.00 61.98 61.34 2k5u s VAL 88 Cb -0.01 -0.99 0.02 0.00 0.00 0.00 0.00 36.38 35.39 2k5u s VAL 88 CO -0.00 -0.38 -0.08 -0.63 0.00 0.00 0.00 175.10 174.01 2k5u s ILE 89 N 1.94 2.89 -0.19 2.22 1.09 -0.36 -2.43 121.20 126.36 2k5u s ILE 89 Ca 0.03 -0.86 -0.12 0.00 -1.10 0.00 0.00 60.65 58.60 2k5u s ILE 89 Cb -0.17 -2.39 -0.05 0.00 -1.06 0.00 0.00 42.46 38.80 2k5u s ILE 89 CO -0.15 0.31 0.22 0.12 -0.10 0.00 0.00 174.94 175.34 2k5u s PHE 90 N 1.36 3.42 -0.19 3.97 2.19 -0.47 -2.57 117.98 125.69 2k5u s PHE 90 Ca 0.03 0.45 0.00 0.00 0.33 0.00 0.00 56.93 57.74 2k5u s PHE 90 Cb -0.15 -2.27 0.04 0.00 -1.31 0.00 0.00 43.02 39.33 2k5u s PHE 90 CO -0.05 0.23 -0.08 0.08 1.83 0.00 0.00 175.22 177.23 2k5u s VAL 91 N 0.51 1.41 0.32 3.12 1.01 -1.10 0.51 120.40 126.18 2k5u s VAL 91 Ca 0.12 -0.85 0.08 0.00 0.00 0.00 0.00 61.98 61.33 2k5u s VAL 91 Cb -0.12 -1.54 -0.04 0.00 0.00 0.00 0.00 36.38 34.68 2k5u s VAL 91 CO 0.01 0.14 0.13 0.54 0.00 0.00 0.00 175.10 175.93 2k5u s VAL 92 N 1.50 3.25 -0.29 2.92 0.11 -1.03 -4.45 120.40 122.42 2k5u s VAL 92 Ca -0.01 -1.69 -0.24 0.00 -2.93 0.00 0.00 61.98 57.12 2k5u s VAL 92 Cb -0.16 -3.00 -0.00 0.00 -1.53 0.00 0.00 36.38 31.69 2k5u s VAL 92 CO -0.08 -0.23 0.80 -0.62 -3.33 0.00 0.00 175.10 171.64 2k5u s ASP 93 N -3.82 6.71 0.46 3.54 2.15 -1.26 -2.65 116.67 121.80 2k5u s ASP 93 Ca 0.36 0.78 0.25 0.00 0.43 0.00 0.00 52.55 54.37 2k5u s ASP 93 Cb -0.04 -2.41 1.05 0.00 -0.30 0.00 0.00 42.92 41.22 2k5u s ASP 93 CO 0.23 -0.58 1.89 -1.28 -0.17 0.00 0.00 175.17 175.25 2k5u h SER 94 N 7.98 0.00 -0.52 -0.34 0.87 -1.85 -2.36 113.55 117.34 2k5u h SER 94 Ca -0.24 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.32 2k5u h SER 94 Cb 1.10 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.06 2k5u h SER 94 CO 0.88 0.21 0.00 -3.20 -0.53 0.00 0.00 176.83 174.18 2k5u n ASN 95 N -3.46 3.03 -3.25 6.23 5.15 -1.26 -1.70 115.26 120.00 2k5u n ASN 95 Ca -0.00 -1.97 -0.27 0.00 -0.60 0.00 0.00 54.58 51.73 2k5u n ASN 95 Cb 0.38 -0.35 -0.07 0.00 -0.53 0.00 0.00 39.78 39.22 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 1.16 3.80 -0.02 1.20 -0.08 -0.89 -4.86 116.55 116.87 2k5u n ASP 96 Ca 0.19 -3.49 -0.00 0.00 -1.51 0.00 0.00 54.79 49.98 2k5u n ASP 96 Cb 0.49 -0.63 0.29 0.00 2.34 0.00 0.00 41.12 43.61 2k5u n ASP 96 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 2k5u h ARG 97 N 3.74 0.57 0.00 -0.67 -0.00 -1.78 -1.75 114.38 114.49 2k5u h ARG 97 Ca 0.17 -0.11 0.00 0.00 -0.50 0.00 0.00 59.98 59.54 2k5u h ARG 97 Cb 0.62 -0.09 0.00 0.00 0.00 0.00 0.00 29.97 30.51 2k5u h ARG 97 CO 0.81 0.56 0.12 0.77 0.00 0.00 0.00 179.97 182.23 2k5u h SER 98 N 0.55 0.00 -0.01 7.04 0.02 -1.95 0.81 113.55 120.00 2k5u h SER 98 Ca 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 2k5u h SER 98 Cb 0.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.84 2k5u h SER 98 CO 0.01 0.00 -0.01 0.54 -1.14 0.00 0.00 176.83 176.22 2k5u n ARG 99 N -2.90 0.57 -0.28 3.45 1.74 -0.68 -4.58 116.66 113.97 2k5u n ARG 99 Ca -0.02 -1.09 0.06 0.00 -0.77 0.00 0.00 57.85 56.02 2k5u n ARG 99 Cb 0.17 -1.19 0.28 0.00 -1.02 0.00 0.00 32.46 30.70 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 2.01 1.00 -0.37 0.55 6.09 -0.53 0.37 117.51 126.63 2k5u h ILE 100 Ca 0.00 -0.31 -0.10 0.00 -1.37 0.00 0.00 64.86 63.08 2k5u h ILE 100 Cb 0.43 0.00 -0.02 0.00 0.47 0.00 0.00 36.82 37.71 2k5u h ILE 100 CO 0.00 0.17 -0.17 1.23 -3.07 0.00 0.00 178.15 176.30 2k5u h GLY 101 N 0.92 0.74 1.27 8.18 0.00 -1.81 -0.98 103.07 111.39 2k5u h GLY 101 Ca 0.40 -0.59 -0.15 0.00 0.00 0.00 0.00 47.33 46.99 2k5u h GLY 101 CO -0.16 0.54 -0.42 -2.09 0.00 0.00 0.00 176.54 174.41 2k5u h GLU 102 N 0.61 0.80 -0.44 4.80 4.81 -1.18 -2.41 114.58 121.57 2k5u h GLU 102 Ca 0.10 -0.43 -0.05 0.00 -0.13 0.00 0.00 59.36 58.85 2k5u h GLU 102 Cb 0.64 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.02 2k5u h GLU 102 CO 0.04 1.06 0.06 0.00 -0.73 0.00 0.00 179.01 179.45 2k5u h ALA 103 N 0.88 0.58 -0.40 2.92 0.00 -0.11 -2.78 119.26 120.35 2k5u h ALA 103 Ca 0.05 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 2k5u h ALA 103 Cb 0.98 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 2k5u h ALA 103 CO 0.09 0.31 0.06 0.07 0.00 0.00 0.00 179.25 179.78 2k5u h ARG 104 N 0.58 0.61 -0.34 0.00 0.11 -1.11 -2.26 114.38 111.98 2k5u h ARG 104 Ca 0.13 -0.12 -0.03 0.00 0.10 0.00 0.00 59.98 60.07 2k5u h ARG 104 Cb 0.39 -0.09 -0.01 0.00 1.11 0.00 0.00 29.97 31.36 2k5u h ARG 104 CO 0.01 0.59 0.11 0.93 0.10 0.00 0.00 179.97 181.71 2k5u h GLU 105 N 0.59 0.53 -0.50 0.08 5.08 -1.21 0.27 114.58 119.42 2k5u h GLU 105 Ca 0.13 -0.11 -0.08 0.00 -1.00 0.00 0.00 59.36 58.30 2k5u h GLU 105 Cb 0.29 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 2k5u h GLU 105 CO 0.00 0.55 -0.00 -0.24 -1.00 0.00 0.00 179.01 178.32 2k5u h VAL 106 N 0.40 1.25 -0.19 3.13 3.04 -1.33 -1.83 116.25 120.72 2k5u h VAL 106 Ca 0.11 -1.04 -0.06 0.00 -1.01 0.00 0.00 66.70 64.70 2k5u h VAL 106 Cb 0.24 0.87 -0.00 0.00 -2.01 0.00 0.00 31.29 30.38 2k5u h VAL 106 CO -0.00 0.37 -0.11 -0.03 -1.01 0.00 0.00 177.57 176.78 2k5u h MET 107 N 0.78 0.42 -0.59 4.17 4.05 -1.16 -0.79 114.93 121.81 2k5u h MET 107 Ca 0.15 -0.19 0.03 0.00 -0.28 0.00 0.00 59.70 59.41 2k5u h MET 107 Cb 0.47 -0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 31.23 2k5u h MET 107 CO 0.02 0.73 0.36 1.96 0.23 0.00 0.00 176.91 180.20 2k5u h GLN 108 N 0.10 0.68 -0.02 0.39 1.08 -0.29 0.12 115.11 117.18 2k5u h GLN 108 Ca 0.04 -0.04 -0.18 0.00 -1.45 0.00 0.00 58.65 57.02 2k5u h GLN 108 Cb 0.61 -0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 27.88 2k5u h GLN 108 CO 0.03 0.45 -0.79 0.07 -0.95 0.00 0.00 178.83 177.64 2k5u h ARG 109 N 0.70 0.19 -0.38 1.46 0.11 -1.35 -3.05 114.38 112.05 2k5u h ARG 109 Ca 0.24 -0.18 -0.09 0.00 0.10 0.00 0.00 59.98 60.05 2k5u h ARG 109 Cb 0.03 0.05 -0.01 0.00 1.11 0.00 0.00 29.97 31.14 2k5u h ARG 109 CO -0.10 0.88 -0.11 0.52 0.10 0.00 0.00 179.97 181.25 2k5u h MET 110 N 0.11 0.74 0.00 0.08 2.86 -0.64 -2.65 114.93 115.44 2k5u h MET 110 Ca -0.03 -0.30 0.00 0.00 -2.06 0.00 0.00 59.70 57.31 2k5u h MET 110 Cb 1.38 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 33.00 2k5u h MET 110 CO 0.12 0.90 0.00 1.47 1.06 0.00 0.00 176.91 180.46 2k5u n LEU 111 N -4.34 0.00 -0.12 1.22 -0.00 0.39 -2.56 117.00 111.59 2k5u n LEU 111 Ca -0.02 0.44 0.08 0.00 -0.00 0.00 0.00 56.01 56.52 2k5u n LEU 111 Cb 0.37 -0.44 0.45 0.00 -0.00 0.00 0.00 43.42 43.80 2k5u n LEU 111 CO 0.43 -0.17 0.80 0.59 -0.00 0.00 0.00 177.39 179.03 2k5u n ASN 112 N -1.44 0.35 -4.62 1.45 3.02 -1.00 -4.71 115.26 108.32 2k5u n ASN 112 Ca 0.05 -1.55 -0.43 0.00 -0.03 0.00 0.00 54.58 52.63 2k5u n ASN 112 Cb 0.19 -0.03 -0.02 0.00 -0.61 0.00 0.00 39.78 39.31 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 -1.95 3.82 0.38 3.52 0.41 -1.06 -4.90 118.70 118.92 2k5u s GLU 113 Ca 0.26 0.90 0.11 0.00 -0.41 0.00 0.00 54.97 55.83 2k5u s GLU 113 Cb 0.12 -3.88 0.88 0.00 -1.78 0.00 0.00 34.13 29.47 2k5u s GLU 113 CO 0.20 -1.25 1.88 -0.44 -0.49 0.00 0.00 175.26 175.16 2k5u h ASP 114 N 9.26 0.58 0.86 -0.19 5.19 -1.92 0.39 116.42 130.59 2k5u h ASP 114 Ca -0.24 0.04 0.00 0.00 -0.62 0.00 0.00 57.03 56.21 2k5u h ASP 114 Cb 1.08 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 40.51 2k5u h ASP 114 CO 1.08 0.29 0.00 -0.62 -3.12 0.00 0.00 179.24 176.87 2k5u n GLU 115 N -4.54 0.10 -0.05 3.56 1.02 -1.26 -2.67 120.64 116.81 2k5u n GLU 115 Ca 0.17 0.23 0.03 0.00 -0.02 0.00 0.00 57.16 57.57 2k5u n GLU 115 Cb 0.49 -1.66 0.06 0.00 -0.02 0.00 0.00 31.44 30.31 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 -1.84 2.04 0.32 -4.62 4.32 0.12 -4.62 117.00 112.72 2k5u n LEU 116 Ca 0.04 -1.53 0.20 0.00 -0.02 0.00 0.00 56.01 54.70 2k5u n LEU 116 Cb 0.27 -0.07 1.07 0.00 -1.62 0.00 0.00 43.42 43.07 2k5u n LEU 116 CO 0.21 0.48 1.17 -0.09 -1.22 0.00 0.00 177.39 177.94 2k5u h ARG 117 N 1.15 0.00 -0.38 3.23 2.43 -0.75 0.91 114.38 120.97 2k5u h ARG 117 Ca 0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2k5u h ARG 117 Cb 0.45 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.00 2k5u h ARG 117 CO 0.00 0.00 0.00 0.09 -1.51 0.00 0.00 179.97 178.55 2k5u n ASN 118 N -3.18 4.53 -4.84 -3.80 5.03 -1.26 -4.99 115.26 106.74 2k5u n ASN 118 Ca -0.02 -3.01 -0.37 0.00 0.87 0.00 0.00 54.58 52.05 2k5u n ASN 118 Cb 0.17 -0.60 -0.06 0.00 -1.02 0.00 0.00 39.78 38.27 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 -2.83 3.70 -0.21 5.41 0.00 0.31 -5.05 121.76 123.08 2k5u s ALA 119 Ca 0.47 -0.25 -0.28 0.00 0.00 0.00 0.00 51.96 51.90 2k5u s ALA 119 Cb 0.37 -2.37 0.00 0.00 0.00 0.00 0.00 23.12 21.13 2k5u s ALA 119 CO 0.11 0.50 0.98 0.00 0.00 0.00 0.00 175.76 177.35 2k5u s ALA 120 N -1.19 3.64 -0.07 0.00 0.00 -1.26 -4.96 121.76 117.92 2k5u s ALA 120 Ca 0.27 0.12 -0.03 0.00 0.00 0.00 0.00 51.96 52.33 2k5u s ALA 120 Cb -0.16 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.47 2k5u s ALA 120 CO 0.15 -0.95 0.05 -1.58 0.00 0.00 0.00 175.76 173.43 2k5u s TRP 121 N 2.92 3.28 -0.16 0.00 0.52 -0.90 -2.93 118.94 121.67 2k5u s TRP 121 Ca 0.42 0.27 -0.04 0.00 0.02 0.00 0.00 56.10 56.77 2k5u s TRP 121 Cb -0.16 -1.81 0.08 0.00 -1.15 0.00 0.00 33.47 30.43 2k5u s TRP 121 CO 0.08 0.55 0.21 -1.17 0.02 0.00 0.00 176.95 176.64 2k5u s LEU 122 N -1.12 -0.11 0.11 2.99 0.20 -1.02 -2.46 118.68 117.28 2k5u s LEU 122 Ca 0.16 0.02 -0.21 0.00 0.69 0.00 0.00 54.13 54.79 2k5u s LEU 122 Cb -0.12 0.39 -0.07 0.00 -0.43 0.00 0.00 46.19 45.96 2k5u s LEU 122 CO 0.05 -0.29 0.64 -0.69 -0.29 0.00 0.00 176.35 175.77 2k5u s VAL 123 N 2.33 4.63 -0.11 1.68 1.01 0.17 -1.37 120.40 128.73 2k5u s VAL 123 Ca 0.05 1.34 0.02 0.00 0.00 0.00 0.00 61.98 63.39 2k5u s VAL 123 Cb -0.14 -3.96 0.01 0.00 0.00 0.00 0.00 36.38 32.29 2k5u s VAL 123 CO -0.10 0.51 -0.16 0.12 0.00 0.00 0.00 175.10 175.47 2k5u s PHE 124 N -1.16 2.06 -0.16 5.22 5.36 0.18 -2.34 117.98 127.14 2k5u s PHE 124 Ca 0.32 -0.97 -0.21 0.00 -0.96 0.00 0.00 56.93 55.11 2k5u s PHE 124 Cb -0.20 -1.47 -0.03 0.00 -0.34 0.00 0.00 43.02 40.98 2k5u s PHE 124 CO 0.21 -0.48 0.63 0.00 -1.46 0.00 0.00 175.22 174.12 2k5u s ALA 125 N 0.92 3.49 -0.26 11.12 0.00 0.66 -2.45 121.76 135.24 2k5u s ALA 125 Ca -0.08 -0.17 0.02 0.00 0.00 0.00 0.00 51.96 51.74 2k5u s ALA 125 Cb -0.15 -2.93 0.06 0.00 0.00 0.00 0.00 23.12 20.10 2k5u s ALA 125 CO -0.01 -0.39 -0.08 1.21 0.00 0.00 0.00 175.76 176.50 2k5u s ASN 126 N 1.03 4.31 0.00 0.00 2.47 -1.08 -0.80 114.94 120.87 2k5u s ASN 126 Ca 0.30 -1.42 0.00 0.00 0.42 0.00 0.00 52.86 52.17 2k5u s ASN 126 Cb -0.16 -1.44 0.00 0.00 -1.45 0.00 0.00 41.25 38.19 2k5u s ASN 126 CO 0.12 -0.22 0.00 0.29 -3.72 0.00 0.00 177.10 173.56 2k5u n LYS 127 N 4.49 0.00 0.19 0.43 4.01 -1.07 -2.76 118.16 123.45 2k5u n LYS 127 Ca -0.12 0.00 0.14 0.00 -0.51 0.00 0.00 58.31 57.82 2k5u n LYS 127 Cb 0.43 0.00 0.49 0.00 -0.51 0.00 0.00 35.03 35.44 2k5u n LYS 127 CO 0.00 0.00 0.00 1.96 -1.11 0.00 0.00 177.40 178.25 2k5u h GLN 128 N 0.00 0.00 0.00 1.97 7.50 -1.14 -2.77 115.11 120.67 2k5u h GLN 128 Ca 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.14 2k5u h GLN 128 Cb 0.00 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 27.53 2k5u h GLN 128 CO 0.00 0.00 -0.07 0.38 -1.50 0.00 0.00 178.83 177.64 2k5u h ASP 129 N 0.00 0.00 -3.60 1.46 3.04 -1.94 -3.43 116.42 111.95 2k5u h ASP 129 Ca 0.00 0.00 -0.51 0.00 -3.24 0.00 0.00 57.03 53.28 2k5u h ASP 129 Cb 0.57 0.00 -0.02 0.00 -1.04 0.00 0.00 39.33 38.84 2k5u h ASP 129 CO 0.00 0.07 0.36 -0.22 -2.04 0.00 0.00 179.24 177.40 2k5u s LEU 130 N -6.53 4.53 0.00 0.15 2.96 -1.04 -4.94 118.68 113.81 2k5u s LEU 130 Ca -0.01 1.82 0.19 0.00 -0.22 0.00 0.00 54.13 55.91 2k5u s LEU 130 Cb 0.11 -3.59 1.06 0.00 0.50 0.00 0.00 46.19 44.27 2k5u s LEU 130 CO 0.55 -0.02 1.55 -0.81 -1.32 0.00 0.00 176.35 176.30 2k5u n PRO 131 N 2.55 0.46 -0.16 0.98 -0.04 -1.26 -2.64 135.00 134.89 2k5u n PRO 131 Ca 0.01 0.05 0.09 0.00 -0.04 0.00 0.00 63.50 63.61 2k5u n PRO 131 Cb 0.49 -1.50 0.14 0.00 -0.04 0.00 0.00 33.50 32.59 2k5u n PRO 131 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2k5u n GLU 132 N -1.12 1.27 -3.22 0.54 0.00 -1.26 -5.04 120.64 111.80 2k5u n GLU 132 Ca 0.12 -2.61 -0.35 0.00 0.00 0.00 0.00 57.16 54.31 2k5u n GLU 132 Cb 0.10 -1.47 -0.06 0.00 0.00 0.00 0.00 31.44 30.01 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 -2.81 3.48 0.38 -1.84 0.00 -1.08 -4.78 121.76 115.11 2k5u s ALA 133 Ca 0.32 0.02 -0.26 0.00 0.00 0.00 0.00 51.96 52.04 2k5u s ALA 133 Cb 0.28 -2.68 -0.09 0.00 0.00 0.00 0.00 23.12 20.63 2k5u s ALA 133 CO 0.02 0.39 1.17 -1.64 0.00 0.00 0.00 175.76 175.69 2k5u s MET 134 N -2.06 4.15 0.56 0.00 -1.94 -0.69 -4.99 119.30 114.34 2k5u s MET 134 Ca 0.42 1.86 -0.15 0.00 -1.71 0.00 0.00 55.69 56.11 2k5u s MET 134 Cb -0.15 -2.77 -0.06 0.00 2.01 0.00 0.00 34.83 33.86 2k5u s MET 134 CO 0.20 -0.24 1.01 -1.54 -0.01 0.00 0.00 175.02 174.44 2k5u s SER 135 N -1.06 6.34 0.28 3.03 1.04 -1.26 -4.84 113.70 117.23 2k5u s SER 135 Ca 0.55 1.58 0.00 0.00 0.48 0.00 0.00 55.95 58.56 2k5u s SER 135 Cb -0.31 -2.50 0.52 0.00 0.10 0.00 0.00 66.02 63.82 2k5u s SER 135 CO 0.40 -0.79 1.86 0.00 0.98 0.00 0.00 173.24 175.70 2k5u h ALA 136 N 0.49 1.50 0.04 5.32 0.00 -1.95 0.31 119.26 124.96 2k5u h ALA 136 Ca -0.46 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.45 2k5u h ALA 136 Cb 1.19 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2k5u h ALA 136 CO 0.61 0.30 -0.02 0.00 0.00 0.00 0.00 179.25 180.14 2k5u h ALA 137 N 1.51 -0.06 -0.09 0.00 0.00 -1.94 0.92 119.26 119.60 2k5u h ALA 137 Ca 0.46 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 55.17 2k5u h ALA 137 Cb 0.35 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2k5u h ALA 137 CO -0.21 -0.42 -0.33 0.93 0.00 0.00 0.00 179.25 179.22 2k5u h GLU 138 N -0.28 0.16 -0.30 0.00 3.07 -1.84 -2.81 114.58 112.59 2k5u h GLU 138 Ca -0.01 -0.06 -0.10 0.00 -0.50 0.00 0.00 59.36 58.69 2k5u h GLU 138 Cb 0.26 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.15 2k5u h GLU 138 CO 0.01 0.48 -0.20 0.82 -1.40 0.00 0.00 179.01 178.72 2k5u h ILE 139 N 0.15 1.30 -1.00 3.13 2.04 -0.23 -0.91 117.51 121.99 2k5u h ILE 139 Ca 0.02 -1.33 0.06 0.00 1.00 0.00 0.00 64.86 64.60 2k5u h ILE 139 Cb 0.66 1.51 -0.06 0.00 -0.74 0.00 0.00 36.82 38.19 2k5u h ILE 139 CO 0.05 0.43 0.65 0.71 0.00 0.00 0.00 178.15 179.98 2k5u h THR 140 N 0.41 1.12 -0.03 -0.27 1.35 -0.58 -1.18 112.91 113.72 2k5u h THR 140 Ca 0.06 -0.41 -0.20 0.00 -0.55 0.00 0.00 66.41 65.30 2k5u h THR 140 Cb 0.74 -0.19 -0.00 0.00 -1.73 0.00 0.00 68.15 66.97 2k5u h THR 140 CO 0.05 0.22 -0.84 -0.33 -0.25 0.00 0.00 175.52 174.37 2k5u h GLU 141 N 1.20 0.36 -0.41 4.72 4.39 -1.41 0.77 114.58 124.21 2k5u h GLU 141 Ca 0.42 -0.35 -0.05 0.00 0.34 0.00 0.00 59.36 59.72 2k5u h GLU 141 Cb 0.11 0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.83 2k5u h GLU 141 CO -0.15 1.02 0.07 -0.22 -1.16 0.00 0.00 179.01 178.56 2k5u h LYS 142 N 0.22 0.68 -0.30 2.33 3.64 -0.34 -2.83 116.57 119.97 2k5u h LYS 142 Ca -0.05 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.15 2k5u h LYS 142 Cb 1.45 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.19 2k5u h LYS 142 CO 0.14 0.72 0.00 1.47 -2.27 0.00 0.00 179.45 179.51 2k5u n LEU 143 N -4.51 1.94 -0.73 5.20 -0.00 -0.53 -4.82 117.00 113.55 2k5u n LEU 143 Ca -0.00 -0.91 -0.07 0.00 -0.00 0.00 0.00 56.01 55.03 2k5u n LEU 143 Cb 0.24 -0.20 -0.01 0.00 -0.00 0.00 0.00 43.42 43.45 2k5u n LEU 143 CO 0.39 0.46 -0.08 0.61 -0.00 0.00 0.00 177.39 178.76 2k5u n GLY 144 N 1.13 0.22 0.24 1.47 0.00 -1.07 -4.72 105.19 102.46 2k5u n GLY 144 Ca 0.14 -0.63 0.10 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.29 0.99 5.85 0.32 -1.45 115.31 120.73 2k5u h LEU 145 Ca -0.16 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.49 2k5u h LEU 145 Cb 1.01 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.03 2k5u h LEU 145 CO 0.19 0.18 -0.36 -0.74 -0.34 0.00 0.00 178.44 177.38 2k5u h HIS 146 N 0.00 0.00 -0.00 1.25 2.76 -1.86 -2.97 115.15 114.32 2k5u h HIS 146 Ca -0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 2k5u h HIS 146 Cb 0.47 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.43 2k5u h HIS 146 CO 0.00 0.36 -0.04 0.45 -1.30 0.00 0.00 177.93 177.39 2k5u n SER 147 N -3.25 0.52 -4.75 3.26 2.88 -0.56 -4.82 113.62 106.90 2k5u n SER 147 Ca 0.02 -0.90 -0.35 0.00 -1.33 0.00 0.00 58.87 56.31 2k5u n SER 147 Cb 0.63 -0.04 -0.08 0.00 -0.75 0.00 0.00 64.21 63.96 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 -2.22 4.67 -0.47 2.46 2.07 -1.13 -5.00 121.20 121.58 2k5u s ILE 148 Ca 0.37 -0.21 -0.40 0.00 -1.41 0.00 0.00 60.65 59.01 2k5u s ILE 148 Cb 0.21 -3.03 -0.16 0.00 0.13 0.00 0.00 42.46 39.61 2k5u s ILE 148 CO 0.41 0.53 2.20 -1.14 -1.91 0.00 0.00 174.94 175.03 2k5u n ARG 149 N 1.83 0.41 -2.08 3.50 0.63 -1.26 -4.84 116.66 114.85 2k5u n ARG 149 Ca -0.17 0.11 -0.41 0.00 -0.92 0.00 0.00 57.85 56.46 2k5u n ARG 149 Cb 0.54 -1.89 -0.02 0.00 0.45 0.00 0.00 32.46 31.54 2k5u n ARG 149 CO 0.00 0.00 0.00 -0.80 -2.51 0.00 0.00 177.63 174.32 2k5u s ASN 150 N 6.77 6.73 0.00 6.15 0.01 -1.26 -4.26 114.94 129.07 2k5u s ASN 150 Ca 1.17 2.70 0.00 0.00 -0.71 0.00 0.00 52.86 56.02 2k5u s ASN 150 Cb -1.23 -2.65 0.00 0.00 0.41 0.00 0.00 41.25 37.79 2k5u s ASN 150 CO 0.58 -0.58 0.00 0.54 -1.51 0.00 0.00 177.10 176.13 2k5u n ARG 151 N 1.05 0.00 0.04 -0.60 1.74 -1.26 -4.96 116.66 112.66 2k5u n ARG 151 Ca 0.01 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.00 2k5u n ARG 151 Cb 0.41 0.00 -0.13 0.00 -1.02 0.00 0.00 32.46 31.72 2k5u n ARG 151 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 2k5u h PRO 152 N 0.00 0.04 -5.47 5.56 0.11 -1.91 -3.46 132.00 126.87 2k5u h PRO 152 Ca 0.00 -0.07 -0.63 0.00 0.11 0.00 0.00 66.00 65.41 2k5u h PRO 152 Cb 0.00 0.03 -0.12 0.00 0.11 0.00 0.00 31.00 31.01 2k5u h PRO 152 CO 0.00 0.86 -0.52 1.67 -0.21 0.00 0.00 178.00 179.79 2k5u s TRP 153 N -2.66 3.39 0.09 0.65 -2.14 -1.24 -2.12 118.94 114.91 2k5u s TRP 153 Ca -0.02 0.29 0.07 0.00 2.66 0.00 0.00 56.10 59.11 2k5u s TRP 153 Cb 0.09 -2.03 -0.03 0.00 -3.10 0.00 0.00 33.47 28.40 2k5u s TRP 153 CO 0.83 0.40 -0.19 -0.06 -2.66 0.00 0.00 176.95 175.27 2k5u s PHE 154 N -0.20 1.66 -0.02 1.66 0.08 -1.03 -4.98 117.98 115.16 2k5u s PHE 154 Ca 0.09 -0.42 0.08 0.00 0.12 0.00 0.00 56.93 56.80 2k5u s PHE 154 Cb -0.12 -0.93 -0.02 0.00 -0.57 0.00 0.00 43.02 41.38 2k5u s PHE 154 CO 0.01 0.16 -0.25 -1.50 -0.10 0.00 0.00 175.22 173.53 2k5u s ILE 155 N -1.12 1.99 -0.11 0.64 -1.16 -1.26 0.41 121.20 120.59 2k5u s ILE 155 Ca 0.05 -1.08 -0.06 0.00 -0.51 0.00 0.00 60.65 59.05 2k5u s ILE 155 Cb -0.10 -1.65 0.04 0.00 0.61 0.00 0.00 42.46 41.36 2k5u s ILE 155 CO 0.03 0.56 0.26 -1.58 -2.81 0.00 0.00 174.94 171.41 2k5u s GLN 156 N -0.57 0.24 0.13 3.50 2.00 -0.99 -4.99 119.66 118.98 2k5u s GLN 156 Ca 0.09 0.53 -0.21 0.00 -2.00 0.00 0.00 55.36 53.77 2k5u s GLN 156 Cb -0.10 -0.07 -0.07 0.00 0.80 0.00 0.00 33.01 33.57 2k5u s GLN 156 CO -0.01 -0.14 0.66 0.00 -0.50 0.00 0.00 175.29 175.30 2k5u s ALA 157 N 1.09 3.52 0.30 1.58 0.00 -1.26 -0.24 121.76 126.75 2k5u s ALA 157 Ca -0.08 0.15 -0.07 0.00 0.00 0.00 0.00 51.96 51.97 2k5u s ALA 157 Cb -0.09 -2.76 -0.00 0.00 0.00 0.00 0.00 23.12 20.27 2k5u s ALA 157 CO -0.08 0.36 0.47 0.95 0.00 0.00 0.00 175.76 177.46 2k5u s THR 158 N -1.20 0.00 -0.27 0.00 -4.23 0.02 -4.74 115.64 105.22 2k5u s THR 158 Ca 0.34 -1.53 0.00 0.00 -1.18 0.00 0.00 61.69 59.32 2k5u s THR 158 Cb -0.20 -2.49 0.08 0.00 1.34 0.00 0.00 72.50 71.23 2k5u s THR 158 CO 0.22 0.00 0.03 0.00 -0.54 0.00 0.00 174.62 174.32 2k5u h ALA 160 N 7.99 1.60 0.11 0.00 0.00 -1.90 -0.97 119.26 126.09 2k5u h ALA 160 Ca -0.14 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 2k5u h ALA 160 Cb 1.05 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.68 2k5u h ALA 160 CO 0.44 0.33 -0.05 0.00 0.00 0.00 0.00 179.25 179.96 2k5u h THR 161 N 0.54 1.07 -0.00 0.00 1.03 -1.95 -3.27 112.91 110.33 2k5u h THR 161 Ca 0.14 -1.18 0.00 0.00 -0.01 0.00 0.00 66.41 65.35 2k5u h THR 161 Cb 0.06 1.77 0.00 0.00 -1.07 0.00 0.00 68.15 68.91 2k5u h THR 161 CO -0.02 0.26 -0.05 -1.54 -0.01 0.00 0.00 175.52 174.16 2k5u n SER 162 N -4.90 0.08 0.00 0.00 3.41 -1.23 -4.89 113.62 106.09 2k5u n SER 162 Ca -0.08 0.21 0.00 0.00 -0.26 0.00 0.00 58.87 58.74 2k5u n SER 162 Cb 0.28 -0.35 0.00 0.00 -0.26 0.00 0.00 64.21 63.87 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 1.44 0.60 3.64 5.00 0.00 -0.39 -4.96 105.19 110.52 2k5u n GLY 163 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 2k5u n GLY 163 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k5u s GLU 164 N -0.38 3.94 0.00 1.61 0.41 -1.10 -2.55 118.70 120.64 2k5u s GLU 164 Ca 0.00 1.52 0.00 0.00 -0.41 0.00 0.00 54.97 56.08 2k5u s GLU 164 Cb 0.00 -3.92 0.00 0.00 -1.78 0.00 0.00 34.13 28.43 2k5u s GLU 164 CO 0.00 -1.10 0.00 0.41 -0.49 0.00 0.00 175.26 174.08 2k5u n GLY 165 N 4.31 3.35 0.14 -1.39 0.00 -1.26 0.05 105.19 110.39 2k5u n GLY 165 Ca 0.16 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.05 2k5u n GLY 165 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2k5u h LEU 166 N 0.00 0.42 -0.01 0.99 3.38 -1.77 -1.01 115.31 117.32 2k5u h LEU 166 Ca 0.00 -0.49 -0.00 0.00 0.09 0.00 0.00 57.88 57.48 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 0.00 1.88 0.09 0.00 0.00 178.44 181.24 2k5u h TYR 167 N 0.03 0.01 0.00 1.13 -1.99 -1.92 -2.18 116.97 112.05 2k5u h TYR 167 Ca 0.02 -0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.71 2k5u h TYR 167 Cb 0.71 -0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.43 2k5u h TYR 167 CO 0.09 0.29 -0.21 1.05 -0.00 0.00 0.00 178.16 179.38 2k5u h GLU 168 N -0.27 0.00 -0.03 4.88 -0.00 -1.90 -0.01 114.58 117.25 2k5u h GLU 168 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 59.36 59.17 2k5u h GLU 168 Cb 0.28 0.00 0.01 0.00 -0.00 0.00 0.00 28.75 29.05 2k5u h GLU 168 CO 0.00 0.21 -0.73 0.78 -0.00 0.00 0.00 179.01 179.27 2k5u h GLY 169 N 1.04 0.60 0.55 1.06 0.00 -1.04 -2.63 103.07 102.64 2k5u h GLY 169 Ca -0.00 -1.00 -0.09 0.00 0.00 0.00 0.00 47.33 46.24 2k5u h GLY 169 CO 0.03 0.89 -0.34 0.17 0.00 0.00 0.00 176.54 177.28 2k5u h LEU 170 N 0.12 0.31 -0.58 3.11 8.10 -1.27 -2.68 115.31 122.42 2k5u h LEU 170 Ca -0.08 -0.76 0.10 0.00 0.11 0.00 0.00 57.88 57.25 2k5u h LEU 170 Cb 1.40 -0.09 -0.08 0.00 -0.44 0.00 0.00 40.66 41.45 2k5u h LEU 170 CO 0.14 1.03 0.14 -0.08 -4.11 0.00 0.00 178.44 175.56 2k5u h GLU 171 N -0.38 0.27 -0.83 0.17 4.81 -1.12 0.26 114.58 117.76 2k5u h GLU 171 Ca -0.04 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2k5u h GLU 171 Cb 1.08 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 30.36 2k5u h GLU 171 CO 0.07 0.18 0.51 -1.49 -0.73 0.00 0.00 179.01 177.55 2k5u h TRP 172 N 0.28 1.08 -0.54 0.92 4.06 -1.53 -1.92 115.95 118.31 2k5u h TRP 172 Ca 0.30 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 61.22 2k5u h TRP 172 Cb 0.43 -0.36 -0.03 0.00 -1.00 0.00 0.00 29.16 28.21 2k5u h TRP 172 CO -0.23 0.72 0.18 1.25 -3.56 0.00 0.00 178.44 176.80 2k5u h LEU 173 N 1.14 0.73 -0.65 -4.49 7.12 -0.56 -2.67 115.31 115.93 2k5u h LEU 173 Ca 0.30 -0.10 -0.01 0.00 0.13 0.00 0.00 57.88 58.20 2k5u h LEU 173 Cb -0.06 -0.19 -0.03 0.00 -0.53 0.00 0.00 40.66 39.85 2k5u h LEU 173 CO -0.06 0.68 0.37 0.77 -0.13 0.00 0.00 178.44 180.07 2k5u h SER 174 N 0.78 0.80 -0.17 1.25 4.64 0.19 -2.24 113.55 118.80 2k5u h SER 174 Ca 0.18 -0.08 0.01 0.00 -0.47 0.00 0.00 61.79 61.43 2k5u h SER 174 Cb 0.20 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 2k5u h SER 174 CO -0.01 0.65 0.10 0.78 -0.87 0.00 0.00 176.83 177.47 2k5u h ASN 175 N 0.88 0.15 -0.27 4.97 2.35 -1.15 0.17 115.58 122.69 2k5u h ASN 175 Ca 0.23 0.00 0.05 0.00 -0.55 0.00 0.00 56.30 56.03 2k5u h ASN 175 Cb 0.02 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 2k5u h ASN 175 CO -0.04 0.11 0.19 -1.28 -1.65 0.00 0.00 177.43 174.76 2k5u h SER 176 N 0.20 0.14 1.64 5.81 0.87 -1.34 0.37 113.55 121.24 2k5u h SER 176 Ca 0.07 -0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.56 2k5u h SER 176 Cb 0.00 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 61.92 2k5u h SER 176 CO -0.04 0.10 -0.36 -0.07 -0.53 0.00 0.00 176.83 175.93 2k5u h LEU 177 N 0.17 0.00 0.00 2.23 -0.00 -0.69 -3.27 115.31 113.75 2k5u h LEU 177 Ca 0.12 0.00 -0.17 0.00 -0.00 0.00 0.00 57.88 57.82 2k5u h LEU 177 Cb 0.26 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 40.90 2k5u h LEU 177 CO -0.02 0.30 -1.29 0.50 -0.00 0.00 0.00 178.44 177.93 2k5u h LYS 178 N 0.00 0.00 -3.74 1.13 3.64 0.20 -3.42 116.57 114.38 2k5u h LYS 178 Ca -0.01 0.00 -0.74 0.00 -1.27 0.00 0.00 60.65 58.63 2k5u h LYS 178 Cb 1.23 0.00 -0.31 0.00 -0.41 0.00 0.00 32.23 32.75 2k5u h LYS 178 CO 0.04 0.38 -0.15 -0.80 -2.27 0.00 0.00 179.45 176.64 2k5u s ASN 179 N -5.96 5.97 -0.45 4.20 0.01 0.10 -4.87 114.94 113.93 2k5u s ASN 179 Ca -0.02 -2.72 0.06 0.00 -0.71 0.00 0.00 52.86 49.47 2k5u s ASN 179 Cb 0.08 -2.03 0.19 0.00 0.41 0.00 0.00 41.25 39.91 2k5u s ASN 179 CO 0.80 -0.48 0.56 -1.54 -1.51 0.00 0.00 177.10 174.93 2k5u n SER 180 N 3.80 -1.71 -0.36 -1.22 3.41 -1.26 -4.82 113.62 111.45 2k5u n SER 180 Ca 0.09 -2.70 0.05 0.00 -0.26 0.00 0.00 58.87 56.05 2k5u n SER 180 Cb 0.42 0.50 0.04 0.00 -0.26 0.00 0.00 64.21 64.91 2k5u n SER 180 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95