#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k4n s ASN 2 N 0.00 0.89 0.33 3.17 -0.87 -1.26 -4.49 114.94 112.70 2k4n s ASN 2 Ca 0.00 -1.43 0.02 0.00 -1.57 0.00 0.00 52.86 49.88 2k4n s ASN 2 Cb 0.00 0.29 0.57 0.00 -0.02 0.00 0.00 41.25 42.09 2k4n s ASN 2 CO 0.00 -0.81 1.93 0.28 -2.57 0.00 0.00 177.10 175.93 2k4n h SER 3 N 2.43 0.68 -0.64 -1.22 0.02 -1.97 -0.96 113.55 111.90 2k4n h SER 3 Ca -0.36 -0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 60.49 2k4n h SER 3 Cb 1.25 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 63.58 2k4n h SER 3 CO 0.56 0.60 0.31 -0.08 -1.14 0.00 0.00 176.83 177.07 2k4n h GLU 4 N 0.75 0.93 -0.78 3.45 4.81 -1.99 -1.67 114.58 120.08 2k4n h GLU 4 Ca 0.19 -0.14 0.01 0.00 -0.13 0.00 0.00 59.36 59.28 2k4n h GLU 4 Cb 0.11 -0.17 -0.04 0.00 0.63 0.00 0.00 28.75 29.29 2k4n h GLU 4 CO -0.02 0.74 0.52 0.28 -0.73 0.00 0.00 179.01 179.80 2k4n h VAL 5 N 0.89 1.20 -0.69 0.32 2.07 -1.64 -1.66 116.25 116.75 2k4n h VAL 5 Ca 0.22 -0.37 -0.02 0.00 0.82 0.00 0.00 66.70 67.35 2k4n h VAL 5 Cb 0.12 0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 29.91 2k4n h VAL 5 CO -0.03 0.20 0.34 0.40 0.02 0.00 0.00 177.57 178.50 2k4n h ILE 6 N 1.06 1.22 -0.02 4.57 2.04 -0.90 0.27 117.51 125.76 2k4n h ILE 6 Ca 0.29 -0.62 0.02 0.00 1.00 0.00 0.00 64.86 65.55 2k4n h ILE 6 Cb -0.12 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.31 2k4n h ILE 6 CO -0.06 0.26 -0.09 0.11 0.00 0.00 0.00 178.15 178.37 2k4n h LYS 7 N 0.95 -0.14 -0.18 2.37 1.57 -0.65 0.19 116.57 120.67 2k4n h LYS 7 Ca 0.24 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 2k4n h LYS 7 Cb 0.10 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 2k4n h LYS 7 CO -0.03 -0.09 0.12 0.93 -0.57 0.00 0.00 179.45 179.80 2k4n h GLU 8 N -0.15 0.24 -0.87 3.15 5.08 -1.11 -2.24 114.58 118.67 2k4n h GLU 8 Ca 0.04 -0.02 0.09 0.00 -1.00 0.00 0.00 59.36 58.48 2k4n h GLU 8 Cb 0.20 -0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.32 2k4n h GLU 8 CO -0.11 0.17 0.52 0.35 -1.00 0.00 0.00 179.01 178.95 2k4n h PHE 9 N 0.24 0.95 -0.52 4.33 3.57 -0.61 0.41 116.94 125.29 2k4n h PHE 9 Ca 0.07 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.54 2k4n h PHE 9 Cb -0.01 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 38.41 2k4n h PHE 9 CO -0.06 0.40 0.12 -0.07 -2.23 0.00 0.00 178.31 176.47 2k4n h LEU 10 N 0.87 0.80 -0.65 0.59 3.38 -0.66 -0.79 115.31 118.85 2k4n h LEU 10 Ca 0.42 -0.24 -0.14 0.00 0.09 0.00 0.00 57.88 58.01 2k4n h LEU 10 Cb 0.35 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2k4n h LEU 10 CO -0.24 0.83 -0.52 -0.33 0.09 0.00 0.00 178.44 178.27 2k4n h GLU 11 N 0.73 0.40 -0.73 1.13 5.08 -0.70 0.34 114.58 120.83 2k4n h GLU 11 Ca 0.16 -0.24 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2k4n h GLU 11 Cb 0.34 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.58 2k4n h GLU 11 CO 0.00 0.83 0.45 -0.44 -1.00 0.00 0.00 179.01 178.86 2k4n h ASP 12 N 0.32 0.86 -0.09 1.42 3.32 0.11 -2.18 116.42 120.18 2k4n h ASP 12 Ca 0.01 -0.04 -0.19 0.00 0.02 0.00 0.00 57.03 56.83 2k4n h ASP 12 Cb 1.02 -0.22 0.01 0.00 0.22 0.00 0.00 39.33 40.37 2k4n h ASP 12 CO 0.09 0.65 -0.70 0.40 -1.72 0.00 0.00 179.24 177.96 2k4n h ILE 13 N 1.00 1.33 0.00 0.35 2.04 -0.84 -3.48 117.51 117.91 2k4n h ILE 13 Ca 0.26 -1.98 0.00 0.00 1.00 0.00 0.00 64.86 64.14 2k4n h ILE 13 Cb -0.07 2.21 0.00 0.00 -0.74 0.00 0.00 36.82 38.22 2k4n h ILE 13 CO -0.05 0.61 0.00 0.61 0.00 0.00 0.00 178.15 179.31 2k4n n GLY 14 N 0.82 1.70 3.90 5.37 0.00 0.58 -5.10 105.19 112.46 2k4n n GLY 14 Ca -0.09 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.72 2k4n n GLY 14 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2k4n n GLU 15 N -0.84 0.62 -4.49 1.61 -0.58 0.87 -4.98 120.64 112.84 2k4n n GLU 15 Ca 0.00 -3.21 -0.24 0.00 -0.42 0.00 0.00 57.16 53.29 2k4n n GLU 15 Cb 0.00 -0.10 -0.10 0.00 -0.57 0.00 0.00 31.44 30.67 2k4n n GLU 15 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2k4n s ASP 16 N -4.53 2.64 -0.22 1.62 -1.08 -1.26 -4.30 116.67 109.54 2k4n s ASP 16 Ca 0.54 -1.50 -0.24 0.00 -0.52 0.00 0.00 52.55 50.84 2k4n s ASP 16 Cb -0.04 0.16 0.06 0.00 -1.46 0.00 0.00 42.92 41.64 2k4n s ASP 16 CO 0.34 -0.73 0.66 -0.72 0.52 0.00 0.00 175.17 175.24 2k4n s TYR 17 N -3.24 -0.71 -0.52 -5.34 1.13 -1.26 -4.55 117.35 102.86 2k4n s TYR 17 Ca 0.30 1.68 -0.17 0.00 -1.41 0.00 0.00 57.07 57.47 2k4n s TYR 17 Cb 0.06 0.27 0.09 0.00 -1.10 0.00 0.00 41.96 41.27 2k4n s TYR 17 CO 0.14 -0.38 0.52 0.42 -2.51 0.00 0.00 175.55 173.75 2k4n s ILE 18 N 0.15 5.08 -0.29 -3.49 1.01 -0.37 -4.94 121.20 118.33 2k4n s ILE 18 Ca -0.01 -1.02 -0.21 0.00 0.00 0.00 0.00 60.65 59.41 2k4n s ILE 18 Cb -0.04 -4.28 -0.01 0.00 0.01 0.00 0.00 42.46 38.14 2k4n s ILE 18 CO 0.02 -0.79 0.66 -0.70 0.00 0.00 0.00 174.94 174.13 2k4n s GLU 19 N 2.04 3.98 0.00 2.79 2.12 -1.26 0.03 118.70 128.39 2k4n s GLU 19 Ca 0.08 0.43 0.00 0.00 0.36 0.00 0.00 54.97 55.83 2k4n s GLU 19 Cb -0.24 -3.70 0.00 0.00 0.26 0.00 0.00 34.13 30.44 2k4n s GLU 19 CO 0.07 -0.54 0.00 1.28 -0.54 0.00 0.00 175.26 175.53 2k4n n LEU 20 N 5.88 0.00 -4.56 2.70 4.77 0.19 -5.01 117.00 120.97 2k4n n LEU 20 Ca -0.00 0.00 -0.39 0.00 -0.03 0.00 0.00 56.01 55.59 2k4n n LEU 20 Cb 0.49 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.55 2k4n n LEU 20 CO 0.46 -0.06 1.69 -1.61 -1.33 0.00 0.00 177.39 176.54 2k4n s GLU 21 N -0.78 2.63 -1.01 3.23 0.41 -1.26 -2.75 118.70 119.17 2k4n s GLU 21 Ca 0.00 0.95 0.00 0.00 -0.41 0.00 0.00 54.97 55.51 2k4n s GLU 21 Cb 0.00 -4.40 0.00 0.00 -1.78 0.00 0.00 34.13 27.95 2k4n s GLU 21 CO 0.00 -2.71 0.00 0.09 -0.49 0.00 0.00 175.26 172.15 2k4n n ASN 22 N 13.06 -5.06 -3.92 -0.19 3.02 -1.26 -4.96 115.26 115.95 2k4n n ASN 22 Ca 0.25 0.24 -0.22 0.00 -0.03 0.00 0.00 54.58 54.81 2k4n n ASN 22 Cb 0.52 -3.39 -0.17 0.00 -0.61 0.00 0.00 39.78 36.13 2k4n n ASN 22 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2k4n s GLU 23 N -2.61 1.12 -0.37 3.52 2.02 -1.11 -0.70 118.70 120.57 2k4n s GLU 23 Ca 0.00 -0.19 -0.06 0.00 0.02 0.00 0.00 54.97 54.74 2k4n s GLU 23 Cb 0.00 -1.07 0.06 0.00 0.10 0.00 0.00 34.13 33.22 2k4n s GLU 23 CO 0.00 -0.08 0.16 0.42 0.02 0.00 0.00 175.26 175.78 2k4n s ILE 24 N 0.98 3.79 -0.34 -1.63 1.01 0.10 0.55 121.20 125.67 2k4n s ILE 24 Ca -0.10 -1.39 -0.23 0.00 0.00 0.00 0.00 60.65 58.93 2k4n s ILE 24 Cb -0.14 -3.28 0.01 0.00 0.01 0.00 0.00 42.46 39.05 2k4n s ILE 24 CO 0.00 -0.37 0.77 -1.00 0.00 0.00 0.00 174.94 174.35 2k4n s HIS 25 N 1.36 3.15 0.29 3.97 3.76 0.10 -1.11 115.29 126.81 2k4n s HIS 25 Ca 0.01 0.64 0.04 0.00 -0.15 0.00 0.00 55.06 55.60 2k4n s HIS 25 Cb -0.21 -3.31 -0.03 0.00 1.11 0.00 0.00 32.58 30.14 2k4n s HIS 25 CO 0.01 -0.66 0.44 -0.51 -0.85 0.00 0.00 174.74 173.17 2k4n s LEU 26 N 3.01 4.15 0.08 0.89 2.01 -0.91 -1.24 118.68 126.68 2k4n s LEU 26 Ca 0.31 0.14 -0.30 0.00 0.01 0.00 0.00 54.13 54.29 2k4n s LEU 26 Cb -0.14 -2.98 -0.06 0.00 0.01 0.00 0.00 46.19 43.03 2k4n s LEU 26 CO 0.15 -0.22 1.17 -0.54 1.01 0.00 0.00 176.35 177.92 2k4n s LYS 27 N -4.13 4.47 0.25 1.70 1.02 -1.26 -4.76 119.74 117.03 2k4n s LYS 27 Ca 0.38 1.75 -0.11 0.00 0.02 0.00 0.00 55.97 58.01 2k4n s LYS 27 Cb -0.09 -3.34 0.36 0.00 -0.52 0.00 0.00 37.83 34.24 2k4n s LYS 27 CO 0.32 -0.18 1.59 -1.35 -0.92 0.00 0.00 175.35 174.80 2k4n h PRO 28 N 6.43 -0.00 -0.01 -1.68 0.11 -1.96 0.14 132.00 135.02 2k4n h PRO 28 Ca -0.42 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 65.50 2k4n h PRO 28 Cb 1.21 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 2k4n h PRO 28 CO 0.79 -0.00 -0.82 0.93 -0.21 0.00 0.00 178.00 178.69 2k4n h GLU 29 N -0.00 0.22 -0.06 1.05 5.08 -1.92 -3.19 114.58 115.76 2k4n h GLU 29 Ca 0.40 -0.22 -0.20 0.00 -1.00 0.00 0.00 59.36 58.34 2k4n h GLU 29 Cb 0.62 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.92 2k4n h GLU 29 CO -0.87 0.92 -0.79 0.28 -1.00 0.00 0.00 179.01 177.55 2k4n h VAL 30 N 0.13 1.38 -0.93 3.13 2.07 -1.51 -3.11 116.25 117.41 2k4n h VAL 30 Ca -0.04 -2.21 0.12 0.00 0.82 0.00 0.00 66.70 65.39 2k4n h VAL 30 Cb 1.42 2.18 -0.07 0.00 -1.52 0.00 0.00 31.29 33.30 2k4n h VAL 30 CO 0.13 0.67 0.60 0.15 0.02 0.00 0.00 177.57 179.13 2k4n h PHE 31 N 0.28 0.98 -0.80 1.57 3.57 -0.78 -0.28 116.94 121.48 2k4n h PHE 31 Ca -0.04 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.51 2k4n h PHE 31 Cb 1.38 -0.31 -0.05 0.00 2.79 0.00 0.00 35.95 39.76 2k4n h PHE 31 CO 0.05 0.40 0.51 -0.92 -2.23 0.00 0.00 178.31 176.13 2k4n h TYR 32 N 0.87 0.97 0.02 0.41 3.20 -1.58 0.99 116.97 121.84 2k4n h TYR 32 Ca 0.45 0.02 -0.20 0.00 3.14 0.00 0.00 58.73 62.15 2k4n h TYR 32 Cb 0.53 -0.32 -0.02 0.00 1.54 0.00 0.00 36.73 38.46 2k4n h TYR 32 CO -0.00 0.58 -0.95 0.93 -1.64 0.00 0.00 178.16 177.08 2k4n h GLU 33 N 1.02 0.07 -0.58 1.82 5.08 -1.31 -2.92 114.58 117.76 2k4n h GLU 33 Ca 0.31 -0.10 -0.08 0.00 -1.00 0.00 0.00 59.36 58.49 2k4n h GLU 33 Cb -0.04 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 2k4n h GLU 33 CO -0.10 0.96 0.04 0.28 -1.00 0.00 0.00 179.01 179.19 2k4n h VAL 34 N 0.03 1.26 -0.58 3.13 2.07 -0.66 -2.11 116.25 119.38 2k4n h VAL 34 Ca -0.03 -1.05 0.05 0.00 0.82 0.00 0.00 66.70 66.48 2k4n h VAL 34 Cb 1.64 0.77 -0.05 0.00 -1.52 0.00 0.00 31.29 32.13 2k4n h VAL 34 CO 0.13 0.38 0.32 -0.25 0.02 0.00 0.00 177.57 178.17 2k4n h TRP 35 N 0.90 0.59 -0.00 1.57 7.01 -0.72 0.12 115.95 125.42 2k4n h TRP 35 Ca 0.17 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.20 2k4n h TRP 35 Cb 0.47 -0.18 0.00 0.00 -2.10 0.00 0.00 29.16 27.35 2k4n h TRP 35 CO 0.03 0.30 -0.00 1.63 -2.79 0.00 0.00 178.44 177.61 2k4n n LYS 36 N -4.82 0.99 -0.08 2.65 5.02 -1.06 -1.45 118.16 119.41 2k4n n LYS 36 Ca 0.06 -0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 56.16 2k4n n LYS 36 Cb 0.14 -1.50 -0.13 0.00 -0.02 0.00 0.00 35.03 33.52 2k4n n LYS 36 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 2k4n n TYR 37 N -1.00 0.49 0.83 2.13 9.36 -0.26 -4.45 117.16 124.27 2k4n n TYR 37 Ca 0.24 0.11 0.01 0.00 3.32 0.00 0.00 57.90 61.57 2k4n n TYR 37 Cb 0.11 -1.07 0.04 0.00 -0.63 0.00 0.00 39.34 37.80 2k4n n TYR 37 CO 0.00 0.00 0.00 1.33 0.22 0.00 0.00 176.86 178.41 2k4n n VAL 38 N -3.33 0.29 -0.45 2.97 0.24 -0.13 -4.74 118.33 113.18 2k4n n VAL 38 Ca -0.40 -0.15 0.00 0.00 -2.04 0.00 0.00 64.34 61.75 2k4n n VAL 38 Cb 1.02 -0.46 0.00 0.00 -1.47 0.00 0.00 33.84 32.93 2k4n n VAL 38 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2k4n n GLY 39 N 0.09 0.72 3.80 7.63 0.00 -1.25 -4.52 105.19 111.67 2k4n n GLY 39 Ca 0.03 -0.47 -0.30 0.00 0.00 0.00 0.00 46.02 45.28 2k4n n GLY 39 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2k4n n GLU 40 N -2.45 -0.90 -2.09 1.61 0.28 -0.53 -4.95 120.64 111.61 2k4n n GLU 40 Ca 0.00 0.36 -0.28 0.00 -0.16 0.00 0.00 57.16 57.08 2k4n n GLU 40 Cb 0.00 -1.92 0.14 0.00 1.43 0.00 0.00 31.44 31.09 2k4n n GLU 40 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 2k4n s PRO 41 N -5.66 1.27 -0.36 3.44 0.04 -1.26 -4.98 135.00 127.49 2k4n s PRO 41 Ca 0.18 -0.44 -0.29 0.00 0.04 0.00 0.00 61.00 60.49 2k4n s PRO 41 Cb -0.10 -2.00 -0.00 0.00 0.04 0.00 0.00 34.50 32.43 2k4n s PRO 41 CO 0.80 -1.93 1.59 -1.21 0.04 0.00 0.00 177.00 176.30 2k4n s GLU 42 N -5.60 3.49 0.05 4.56 2.02 -1.26 -4.96 118.70 117.00 2k4n s GLU 42 Ca 0.69 1.21 -0.31 0.00 0.02 0.00 0.00 54.97 56.58 2k4n s GLU 42 Cb -0.06 -4.10 -0.06 0.00 0.10 0.00 0.00 34.13 30.01 2k4n s GLU 42 CO 0.49 -1.66 1.23 -0.51 0.02 0.00 0.00 175.26 174.83 2k4n s LEU 43 N 6.03 4.36 -0.23 1.80 1.43 -1.26 -5.00 118.68 125.80 2k4n s LEU 43 Ca 0.70 2.02 -0.18 0.00 -1.03 0.00 0.00 54.13 55.65 2k4n s LEU 43 Cb -0.18 -3.58 -0.03 0.00 0.03 0.00 0.00 46.19 42.43 2k4n s LEU 43 CO 0.33 -0.51 0.50 -0.75 0.23 0.00 0.00 176.35 176.14 2k4n s LYS 44 N 1.28 4.12 0.18 1.70 2.47 -0.58 -4.91 119.74 124.00 2k4n s LYS 44 Ca 0.59 0.32 0.04 0.00 -1.56 0.00 0.00 55.97 55.37 2k4n s LYS 44 Cb -0.30 -3.61 -0.04 0.00 -1.46 0.00 0.00 37.83 32.43 2k4n s LYS 44 CO 0.28 -0.25 0.22 0.95 0.16 0.00 0.00 175.35 176.71 2k4n s THR 45 N 1.96 4.84 0.04 3.43 -4.23 -1.26 -0.57 115.64 119.84 2k4n s THR 45 Ca 0.22 -0.99 0.04 0.00 -1.18 0.00 0.00 61.69 59.77 2k4n s THR 45 Cb -0.15 -3.52 -0.02 0.00 1.34 0.00 0.00 72.50 70.15 2k4n s THR 45 CO 0.09 -0.16 -0.11 -0.72 -0.54 0.00 0.00 174.62 173.18 2k4n s TYR 46 N -1.83 0.94 -0.32 3.99 1.13 0.48 -4.97 117.35 116.78 2k4n s TYR 46 Ca 0.33 -0.36 -0.13 0.00 -1.41 0.00 0.00 57.07 55.49 2k4n s TYR 46 Cb -0.10 -0.56 -0.02 0.00 -1.10 0.00 0.00 41.96 40.18 2k4n s TYR 46 CO 0.26 -0.01 0.26 0.08 -2.51 0.00 0.00 175.55 173.63 2k4n s VAL 47 N -0.93 5.26 -0.49 -3.49 1.01 -1.26 -1.44 120.40 119.06 2k4n s VAL 47 Ca -0.02 -0.05 -0.13 0.00 0.00 0.00 0.00 61.98 61.78 2k4n s VAL 47 Cb -0.08 -3.70 0.11 0.00 0.00 0.00 0.00 36.38 32.72 2k4n s VAL 47 CO 0.01 0.04 0.41 -0.51 0.00 0.00 0.00 175.10 175.04 2k4n s ILE 48 N 1.80 4.78 -0.57 2.22 2.07 0.13 -4.96 121.20 126.67 2k4n s ILE 48 Ca 0.08 -1.52 -0.25 0.00 -1.41 0.00 0.00 60.65 57.55 2k4n s ILE 48 Cb -0.17 -4.04 0.04 0.00 0.13 0.00 0.00 42.46 38.42 2k4n s ILE 48 CO 0.11 -0.76 0.99 -0.70 -1.91 0.00 0.00 174.94 172.67 2k4n s GLU 49 N 1.51 3.34 0.24 3.50 2.12 -1.26 -2.03 118.70 126.12 2k4n s GLU 49 Ca 0.04 -0.22 -0.03 0.00 0.36 0.00 0.00 54.97 55.12 2k4n s GLU 49 Cb -0.27 -4.06 -0.05 0.00 0.26 0.00 0.00 34.13 30.01 2k4n s GLU 49 CO 0.02 -1.56 0.46 0.34 -0.54 0.00 0.00 175.26 173.99 2k4n s ASP 50 N 2.94 6.42 1.62 -1.70 2.15 -1.21 -4.94 116.67 121.95 2k4n s ASP 50 Ca 0.32 0.55 0.00 0.00 0.43 0.00 0.00 52.55 53.85 2k4n s ASP 50 Cb -0.12 -2.07 0.00 0.00 -0.30 0.00 0.00 42.92 40.43 2k4n s ASP 50 CO 0.19 -0.11 0.00 -0.62 -0.17 0.00 0.00 175.17 174.47 2k4n n GLU 51 N -0.74 0.00 0.00 4.34 1.02 -1.26 -4.15 120.64 119.85 2k4n n GLU 51 Ca -0.03 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.11 2k4n n GLU 51 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.96 2k4n n GLU 51 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 2k4n n ILE 52 N 0.00 0.00 -4.02 -3.67 5.41 0.13 -4.75 119.36 112.45 2k4n n ILE 52 Ca 0.00 0.00 -0.08 0.00 1.00 0.00 0.00 62.75 63.67 2k4n n ILE 52 Cb 0.00 0.00 -0.10 0.00 -0.71 0.00 0.00 39.64 38.83 2k4n n ILE 52 CO 0.00 0.00 0.00 0.68 0.00 0.00 0.00 176.55 177.23 2k4n s VAL 53 N 0.00 0.19 -0.23 1.39 -7.23 -1.26 -4.80 120.40 108.45 2k4n s VAL 53 Ca 0.00 -1.54 -0.22 0.00 -1.81 0.00 0.00 61.98 58.41 2k4n s VAL 53 Cb 0.00 -1.29 -0.01 0.00 0.56 0.00 0.00 36.38 35.64 2k4n s VAL 53 CO 0.00 -0.85 0.72 -1.61 -0.31 0.00 0.00 175.10 173.05 2k4n s GLU 54 N -3.50 4.17 0.25 4.82 0.41 -1.26 -4.96 118.70 118.62 2k4n s GLU 54 Ca 0.03 0.74 -0.06 0.00 -0.41 0.00 0.00 54.97 55.27 2k4n s GLU 54 Cb 0.05 -3.63 0.26 0.00 -1.78 0.00 0.00 34.13 29.03 2k4n s GLU 54 CO -0.09 -0.41 1.93 -1.35 -0.49 0.00 0.00 175.26 174.85 2k4n h PRO 55 N 7.70 1.33 0.00 0.39 0.11 -1.95 -3.46 132.00 136.12 2k4n h PRO 55 Ca -0.26 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2k4n h PRO 55 Cb 1.12 -0.30 0.00 0.00 0.11 0.00 0.00 31.00 31.93 2k4n h PRO 55 CO 0.81 0.88 0.00 0.41 -0.21 0.00 0.00 178.00 179.89 2k4n n GLY 56 N -1.38 0.82 0.39 -0.55 0.00 -1.26 -4.98 105.19 98.24 2k4n n GLY 56 Ca 0.12 -0.05 0.18 0.00 0.00 0.00 0.00 46.02 46.27 2k4n n GLY 56 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2k4n h GLU 57 N 0.00 0.44 -3.95 1.61 5.08 -2.02 -3.02 114.58 112.72 2k4n h GLU 57 Ca 0.00 -0.03 -0.69 0.00 -1.00 0.00 0.00 59.36 57.64 2k4n h GLU 57 Cb 0.00 -0.10 -0.35 0.00 0.50 0.00 0.00 28.75 28.80 2k4n h GLU 57 CO 0.00 0.29 -0.46 -0.47 -1.00 0.00 0.00 179.01 177.37 2k4n s TYR 58 N -5.47 3.47 -0.35 4.33 5.04 -1.26 -5.05 117.35 118.07 2k4n s TYR 58 Ca -0.08 -2.63 -0.08 0.00 -2.44 0.00 0.00 57.07 51.83 2k4n s TYR 58 Cb 0.22 -3.18 0.04 0.00 0.35 0.00 0.00 41.96 39.39 2k4n s TYR 58 CO 0.78 -0.89 0.14 0.34 -1.34 0.00 0.00 175.55 174.58 2k4n s ASP 59 N 1.07 5.45 -0.34 4.32 2.15 -1.14 -4.76 116.67 123.43 2k4n s ASP 59 Ca 0.13 -1.09 -0.28 0.00 0.43 0.00 0.00 52.55 51.74 2k4n s ASP 59 Cb -0.22 -1.92 -0.04 0.00 -0.30 0.00 0.00 42.92 40.45 2k4n s ASP 59 CO -0.04 -0.35 2.05 -2.16 -0.17 0.00 0.00 175.17 174.51 2k4n s PRO 60 N 1.45 3.01 0.00 4.34 0.04 -1.26 -4.82 135.00 137.76 2k4n s PRO 60 Ca -0.00 1.58 0.30 0.00 0.04 0.00 0.00 61.00 62.91 2k4n s PRO 60 Cb -0.19 -4.34 1.48 0.00 0.04 0.00 0.00 34.50 31.49 2k4n s PRO 60 CO 0.04 -2.24 2.03 -2.30 0.04 0.00 0.00 177.00 174.57 2k4n n PRO 61 N 8.71 0.44 0.00 0.56 -0.02 -1.26 -2.41 135.00 141.02 2k4n n PRO 61 Ca 0.27 -0.02 0.12 0.00 -2.02 0.00 0.00 63.50 61.85 2k4n n PRO 61 Cb 0.48 -1.50 0.23 0.00 -0.02 0.00 0.00 33.50 32.69 2k4n n PRO 61 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2k4n n GLU 62 N -1.26 1.60 -2.54 -0.52 2.13 -1.26 -4.93 120.64 113.85 2k4n n GLU 62 Ca 0.14 -1.19 -0.19 0.00 0.66 0.00 0.00 57.16 56.58 2k4n n GLU 62 Cb 0.25 -1.48 -0.00 0.00 0.27 0.00 0.00 31.44 30.48 2k4n n GLU 62 CO 0.00 0.00 0.00 -1.33 -0.41 0.00 0.00 177.13 175.39 2k4n n MET 63 N 0.34 -2.37 -3.52 5.31 2.81 -1.01 -4.95 117.12 113.72 2k4n n MET 63 Ca 0.14 0.89 -0.40 0.00 -1.81 0.00 0.00 57.70 56.51 2k4n n MET 63 Cb 0.46 -5.58 -0.10 0.00 -0.71 0.00 0.00 33.22 27.29 2k4n n MET 63 CO 0.00 0.00 0.00 0.21 1.51 0.00 0.00 175.97 177.69 2k4n s LYS 64 N -5.18 3.48 -0.19 0.03 2.20 -1.26 -5.06 119.74 113.75 2k4n s LYS 64 Ca 0.06 -0.65 -0.13 0.00 -0.36 0.00 0.00 55.97 54.90 2k4n s LYS 64 Cb -0.03 -3.82 -0.05 0.00 -1.51 0.00 0.00 37.83 32.43 2k4n s LYS 64 CO 0.08 -0.46 0.24 0.71 -0.36 0.00 0.00 175.35 175.56 2k4n s TYR 65 N 1.73 3.40 0.54 4.03 1.51 -1.26 -4.83 117.35 122.47 2k4n s TYR 65 Ca 0.06 0.45 0.08 0.00 -1.01 0.00 0.00 57.07 56.66 2k4n s TYR 65 Cb -0.17 -2.31 0.06 0.00 -0.11 0.00 0.00 41.96 39.43 2k4n s TYR 65 CO 0.11 0.17 0.74 0.95 -1.11 0.00 0.00 175.55 176.41 2k4n s THR 66 N 0.71 2.43 -0.78 -0.71 -4.23 -1.26 -5.03 115.64 106.77 2k4n s THR 66 Ca 0.13 -0.96 -0.24 0.00 -1.18 0.00 0.00 61.69 59.44 2k4n s THR 66 Cb -0.13 -2.47 0.06 0.00 1.34 0.00 0.00 72.50 71.30 2k4n s THR 66 CO 0.03 0.00 1.18 0.21 -0.54 0.00 0.00 174.62 175.50 2k4n s ASN 67 N -4.57 6.27 -0.09 3.99 2.47 -1.26 -5.00 114.94 116.75 2k4n s ASN 67 Ca 0.60 -0.98 -0.10 0.00 0.42 0.00 0.00 52.86 52.80 2k4n s ASN 67 Cb -0.07 -2.49 -0.05 0.00 -1.45 0.00 0.00 41.25 37.19 2k4n s ASN 67 CO 0.38 -1.56 0.23 -0.69 -3.72 0.00 0.00 177.10 171.73 2k4n s VAL 68 N 4.68 5.35 0.44 -5.21 1.01 -1.26 -5.09 120.40 120.32 2k4n s VAL 68 Ca 0.32 0.41 -0.01 0.00 0.00 0.00 0.00 61.98 62.70 2k4n s VAL 68 Cb -0.10 -3.51 -0.02 0.00 0.00 0.00 0.00 36.38 32.76 2k4n s VAL 68 CO 0.07 0.58 0.68 -0.54 0.00 0.00 0.00 175.10 175.89 2k4n s LYS 69 N -0.87 3.28 -0.37 2.72 1.02 -1.26 -4.76 119.74 119.49 2k4n s LYS 69 Ca 0.17 -0.25 0.01 0.00 0.02 0.00 0.00 55.97 55.92 2k4n s LYS 69 Cb -0.13 -2.52 0.11 0.00 -0.52 0.00 0.00 37.83 34.77 2k4n s LYS 69 CO 0.06 -0.17 0.15 0.21 -0.92 0.00 0.00 175.35 174.68 2k4n s LYS 70 N -4.56 1.06 0.02 1.68 2.20 -1.26 0.17 119.74 119.04 2k4n s LYS 70 Ca 0.46 -1.58 0.00 0.00 -0.36 0.00 0.00 55.97 54.50 2k4n s LYS 70 Cb -0.10 -2.31 -0.01 0.00 -1.51 0.00 0.00 37.83 33.90 2k4n s LYS 70 CO 0.39 -1.05 -0.03 0.14 -0.36 0.00 0.00 175.35 174.44 2k4n s VAL 71 N 0.99 0.15 -0.38 4.02 -7.23 -1.26 -5.03 120.40 111.66 2k4n s VAL 71 Ca 0.13 -0.61 -0.13 0.00 -1.81 0.00 0.00 61.98 59.56 2k4n s VAL 71 Cb -0.21 -0.23 0.01 0.00 0.56 0.00 0.00 36.38 36.51 2k4n s VAL 71 CO -0.12 -0.30 0.25 -0.54 -0.31 0.00 0.00 175.10 174.08 2k4n s LYS 72 N -0.95 3.09 -0.07 4.82 1.02 -1.26 -3.33 119.74 123.06 2k4n s LYS 72 Ca -0.09 -0.92 -0.18 0.00 0.02 0.00 0.00 55.97 54.79 2k4n s LYS 72 Cb -0.06 -3.85 -0.05 0.00 -0.52 0.00 0.00 37.83 33.35 2k4n s LYS 72 CO -0.00 -0.64 0.50 0.42 -0.92 0.00 0.00 175.35 174.71 2k4n s ILE 73 N 1.65 5.08 -0.14 2.17 1.01 -0.86 -4.95 121.20 125.16 2k4n s ILE 73 Ca 0.05 1.03 0.01 0.00 0.00 0.00 0.00 60.65 61.74 2k4n s ILE 73 Cb -0.18 -3.84 -0.00 0.00 0.01 0.00 0.00 42.46 38.45 2k4n s ILE 73 CO 0.09 0.39 -0.18 -0.75 0.00 0.00 0.00 174.94 174.49 2k4n s LYS 74 N 0.13 3.15 0.23 2.79 2.20 -1.26 0.17 119.74 127.16 2k4n s LYS 74 Ca 0.27 -0.79 0.10 0.00 -0.36 0.00 0.00 55.97 55.19 2k4n s LYS 74 Cb -0.16 -2.52 -0.05 0.00 -1.51 0.00 0.00 37.83 33.59 2k4n s LYS 74 CO 0.13 0.06 -0.18 0.15 -0.36 0.00 0.00 175.35 175.15 2k4n s LYS 75 N 0.67 1.49 0.05 4.03 1.02 -0.52 -2.45 119.74 124.03 2k4n s LYS 75 Ca -0.09 -1.64 0.08 0.00 0.02 0.00 0.00 55.97 54.34 2k4n s LYS 75 Cb -0.16 -1.48 -0.03 0.00 -0.52 0.00 0.00 37.83 35.64 2k4n s LYS 75 CO 0.02 0.27 -0.23 0.54 -0.92 0.00 0.00 175.35 175.03 2k4n s VAL 76 N -2.57 1.88 0.19 3.17 0.11 0.28 -0.38 120.40 123.07 2k4n s VAL 76 Ca 0.25 -1.33 -0.14 0.00 -2.93 0.00 0.00 61.98 57.83 2k4n s VAL 76 Cb -0.04 -1.63 0.01 0.00 -1.53 0.00 0.00 36.38 33.20 2k4n s VAL 76 CO 0.11 0.24 0.44 -0.72 -3.33 0.00 0.00 175.10 171.83 2k4n s TYR 77 N -0.84 0.10 0.02 1.54 1.13 0.26 -0.24 117.35 119.32 2k4n s TYR 77 Ca 0.09 -0.45 0.01 0.00 -1.41 0.00 0.00 57.07 55.31 2k4n s TYR 77 Cb -0.09 0.22 -0.01 0.00 -1.10 0.00 0.00 41.96 40.97 2k4n s TYR 77 CO 0.02 -0.85 -0.04 -0.59 -2.51 0.00 0.00 175.55 171.57 2k4n s PHE 78 N -3.92 0.38 -0.25 -3.49 -0.71 -0.93 -1.53 117.98 107.54 2k4n s PHE 78 Ca 0.13 -0.28 -0.10 0.00 -1.04 0.00 0.00 56.93 55.64 2k4n s PHE 78 Cb 0.01 -0.24 -0.04 0.00 -1.21 0.00 0.00 43.02 41.53 2k4n s PHE 78 CO -0.01 -0.07 0.14 -1.21 -1.34 0.00 0.00 175.22 172.73 2k4n s GLU 79 N -0.80 3.91 1.13 1.99 2.02 -1.26 -1.39 118.70 124.31 2k4n s GLU 79 Ca -0.06 -0.35 -0.18 0.00 0.02 0.00 0.00 54.97 54.40 2k4n s GLU 79 Cb -0.06 -3.49 0.26 0.00 0.10 0.00 0.00 34.13 30.94 2k4n s GLU 79 CO -0.00 -0.06 1.18 0.95 0.02 0.00 0.00 175.26 177.35 2k4n s THR 80 N 1.37 1.72 0.44 3.63 -4.23 -0.67 -4.82 115.64 113.09 2k4n s THR 80 Ca 0.06 0.00 0.29 0.00 -1.18 0.00 0.00 61.69 60.87 2k4n s THR 80 Cb -0.15 -2.66 0.32 0.00 1.34 0.00 0.00 72.50 71.35 2k4n s THR 80 CO 0.06 0.00 2.12 -0.07 -0.54 0.00 0.00 174.62 176.19 2k4n h LEU 81 N -2.30 0.00 -0.25 4.79 4.07 -1.92 0.64 115.31 120.35 2k4n h LEU 81 Ca -0.44 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.52 2k4n h LEU 81 Cb 1.27 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.01 2k4n h LEU 81 CO 0.34 0.09 -0.04 0.47 -1.08 0.00 0.00 178.44 178.22 2k4n n ASP 82 N -3.61 0.42 -0.88 -0.43 8.00 -1.26 -4.89 116.55 113.89 2k4n n ASP 82 Ca -0.02 -0.85 -0.09 0.00 0.71 0.00 0.00 54.79 54.53 2k4n n ASP 82 Cb 0.21 -0.06 -0.02 0.00 -0.02 0.00 0.00 41.12 41.23 2k4n n ASP 82 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2k4n n ASN 83 N -0.81 -3.72 -4.77 -2.24 5.03 0.22 -5.01 115.26 103.96 2k4n n ASN 83 Ca 0.19 0.12 -0.38 0.00 0.87 0.00 0.00 54.58 55.38 2k4n n ASN 83 Cb 0.22 -2.48 -0.06 0.00 -1.02 0.00 0.00 39.78 36.44 2k4n n ASN 83 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2k4n s VAL 84 N -2.41 4.99 -0.43 2.41 1.01 -1.26 -4.78 120.40 119.94 2k4n s VAL 84 Ca 0.00 1.11 -0.20 0.00 0.00 0.00 0.00 61.98 62.88 2k4n s VAL 84 Cb 0.00 -3.87 0.02 0.00 0.00 0.00 0.00 36.38 32.54 2k4n s VAL 84 CO 0.00 0.43 0.62 -0.13 0.00 0.00 0.00 175.10 176.02 2k4n s ARG 85 N -0.16 3.28 -0.58 2.72 3.00 0.12 -1.66 118.95 125.67 2k4n s ARG 85 Ca 0.28 -0.39 -0.22 0.00 0.00 0.00 0.00 55.73 55.40 2k4n s ARG 85 Cb -0.17 -3.94 0.06 0.00 0.00 0.00 0.00 34.95 30.89 2k4n s ARG 85 CO 0.15 -0.98 0.86 0.08 0.00 0.00 0.00 175.30 175.42 2k4n s VAL 86 N 2.74 4.50 -0.06 3.52 1.01 -0.49 0.01 120.40 131.63 2k4n s VAL 86 Ca 0.22 -0.19 -0.01 0.00 0.00 0.00 0.00 61.98 61.99 2k4n s VAL 86 Cb -0.14 -4.53 -0.03 0.00 0.00 0.00 0.00 36.38 31.67 2k4n s VAL 86 CO 0.18 -1.16 0.00 -0.69 0.00 0.00 0.00 175.10 173.43 2k4n s VAL 87 N 3.61 4.28 0.03 2.92 1.01 -0.27 -2.18 120.40 129.81 2k4n s VAL 87 Ca 0.23 -0.35 -0.14 0.00 0.00 0.00 0.00 61.98 61.73 2k4n s VAL 87 Cb -0.16 -2.83 0.02 0.00 0.00 0.00 0.00 36.38 33.40 2k4n s VAL 87 CO 0.14 0.54 0.30 -0.89 0.00 0.00 0.00 175.10 175.18 2k4n s THR 88 N -0.95 0.08 0.13 3.92 2.01 0.66 -2.14 115.64 119.36 2k4n s THR 88 Ca 0.15 -0.65 -0.31 0.00 0.31 0.00 0.00 61.69 61.19 2k4n s THR 88 Cb -0.11 -0.86 -0.09 0.00 0.01 0.00 0.00 72.50 71.44 2k4n s THR 88 CO 0.05 -0.36 1.61 -0.62 -0.69 0.00 0.00 174.62 174.61 2k4n s ASP 89 N -1.89 6.59 0.21 3.53 2.15 -1.26 -0.56 116.67 125.44 2k4n s ASP 89 Ca -0.07 2.57 0.13 0.00 0.43 0.00 0.00 52.55 55.60 2k4n s ASP 89 Cb -0.02 -2.58 -0.04 0.00 -0.30 0.00 0.00 42.92 39.98 2k4n s ASP 89 CO -0.02 -0.85 1.35 0.22 -0.17 0.00 0.00 175.17 175.70 2k4n h TYR 90 N 7.44 0.00 -0.48 -5.34 3.20 -1.77 -2.07 116.97 117.95 2k4n h TYR 90 Ca -0.43 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.42 2k4n h TYR 90 Cb 1.20 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.45 2k4n h TYR 90 CO 0.70 0.67 0.21 1.03 -1.64 0.00 0.00 178.16 179.13 2k4n h SER 91 N 0.00 0.65 1.97 -2.11 0.87 -1.91 0.35 113.55 113.38 2k4n h SER 91 Ca -0.02 -0.15 -0.00 0.00 -1.23 0.00 0.00 61.79 60.38 2k4n h SER 91 Cb 1.53 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 63.32 2k4n h SER 91 CO 0.08 0.63 -0.03 -0.33 -0.53 0.00 0.00 176.83 176.66 2k4n h GLU 92 N 0.64 0.00 -0.02 2.24 5.08 -1.92 -1.89 114.58 118.70 2k4n h GLU 92 Ca 0.16 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.51 2k4n h GLU 92 Cb 0.17 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 2k4n h GLU 92 CO -0.02 0.02 -0.02 0.35 -1.00 0.00 0.00 179.01 178.34 2k4n h PHE 93 N 0.00 0.05 0.00 4.33 3.57 -0.68 -2.49 116.94 121.73 2k4n h PHE 93 Ca -0.00 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.46 2k4n h PHE 93 Cb 1.02 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.74 2k4n h PHE 93 CO 0.00 0.55 -0.10 -0.56 -2.23 0.00 0.00 178.31 175.97 2k4n h GLN 94 N -0.46 0.00 -0.45 1.11 3.07 -0.36 -0.83 115.11 117.18 2k4n h GLN 94 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.73 2k4n h GLN 94 Cb 0.54 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.08 2k4n h GLN 94 CO 0.00 0.10 0.25 -0.22 0.09 0.00 0.00 178.83 179.06 2k4n h LYS 95 N 0.00 0.63 -0.23 0.06 3.64 -1.25 0.14 116.57 119.56 2k4n h LYS 95 Ca -0.00 -0.07 -0.11 0.00 -1.27 0.00 0.00 60.65 59.20 2k4n h LYS 95 Cb 0.48 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 2k4n h LYS 95 CO 0.01 0.49 -0.34 0.82 -2.27 0.00 0.00 179.45 178.17 2k4n h ILE 96 N 0.60 1.29 -0.80 2.00 2.04 -0.84 -0.97 117.51 120.83 2k4n h ILE 96 Ca 0.16 -1.44 -0.00 0.00 1.00 0.00 0.00 64.86 64.58 2k4n h ILE 96 Cb 0.04 1.48 -0.04 0.00 -0.74 0.00 0.00 36.82 37.56 2k4n h ILE 96 CO -0.03 0.45 0.48 -0.07 0.00 0.00 0.00 178.15 178.99 2k4n h LEU 97 N 0.42 0.96 -0.64 1.44 3.38 -0.68 0.86 115.31 121.04 2k4n h LEU 97 Ca 0.05 -0.06 -0.11 0.00 0.09 0.00 0.00 57.88 57.84 2k4n h LEU 97 Cb 0.79 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 2k4n h LEU 97 CO 0.06 0.74 -0.14 0.11 0.09 0.00 0.00 178.44 179.30 2k4n h LYS 98 N 1.09 0.92 0.02 1.13 1.79 -0.45 0.19 116.57 121.26 2k4n h LYS 98 Ca 0.29 -0.34 -0.00 0.00 -2.18 0.00 0.00 60.65 58.41 2k4n h LYS 98 Cb -0.05 -0.06 0.00 0.00 -1.58 0.00 0.00 32.23 30.55 2k4n h LYS 98 CO -0.05 1.00 -0.01 -0.22 -1.08 0.00 0.00 179.45 179.08 2k4n h LYS 99 N 0.81 -0.03 -0.09 3.15 3.64 -0.50 -3.08 116.57 120.48 2k4n h LYS 99 Ca 0.12 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 2k4n h LYS 99 Cb 0.68 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 2k4n h LYS 99 CO 0.05 0.03 0.00 0.54 -2.27 0.00 0.00 179.45 177.80 2k4n n ARG 100 N -5.08 2.06 -2.19 1.90 1.74 0.23 -4.94 116.66 110.38 2k4n n ARG 100 Ca -0.07 -1.56 -0.11 0.00 -0.77 0.00 0.00 57.85 55.34 2k4n n ARG 100 Cb 0.06 -1.47 -0.01 0.00 -1.02 0.00 0.00 32.46 30.03 2k4n n ARG 100 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2k4n n GLY 101 N 1.29 -0.05 3.64 -0.13 0.00 0.32 -5.02 105.19 105.24 2k4n n GLY 101 Ca 0.17 -0.44 -0.26 0.00 0.00 0.00 0.00 46.02 45.49 2k4n n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k4n s THR 102 N -2.53 3.57 0.15 2.61 2.01 0.39 -5.00 115.64 116.83 2k4n s THR 102 Ca 0.00 -1.57 0.06 0.00 0.31 0.00 0.00 61.69 60.49 2k4n s THR 102 Cb 0.00 -2.81 -0.04 0.00 0.01 0.00 0.00 72.50 69.66 2k4n s THR 102 CO 0.00 -0.17 -0.14 -0.54 -0.69 0.00 0.00 174.62 173.08 2k4n s LYS 103 N -3.08 1.13 0.15 4.92 1.02 -1.23 -4.38 119.74 118.28 2k4n s LYS 103 Ca 0.28 -1.38 0.01 0.00 0.02 0.00 0.00 55.97 54.90 2k4n s LYS 103 Cb -0.09 -0.96 -0.04 0.00 -0.52 0.00 0.00 37.83 36.22 2k4n s LYS 103 CO 0.18 0.17 1.35 1.25 -0.92 0.00 0.00 175.35 177.38 2k4n h LEU 104 N 3.14 0.29 -0.04 3.17 5.85 -2.00 -3.30 115.31 122.41 2k4n h LEU 104 Ca -0.39 -0.24 -0.08 0.00 0.84 0.00 0.00 57.88 58.00 2k4n h LEU 104 Cb 1.20 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.15 2k4n h LEU 104 CO 0.55 1.06 -0.29 -0.33 -0.34 0.00 0.00 178.44 179.09 2k4n h GLU 105 N 0.12 0.27 -4.67 1.25 5.08 -2.02 -3.43 114.58 111.17 2k4n h GLU 105 Ca -0.05 -0.24 -0.69 0.00 -1.00 0.00 0.00 59.36 57.38 2k4n h GLU 105 Cb 1.55 0.05 -0.32 0.00 0.50 0.00 0.00 28.75 30.54 2k4n h GLU 105 CO 0.14 0.90 -0.63 -1.01 -1.00 0.00 0.00 179.01 177.41 2k4n s HIS 106 N -3.49 3.33 0.17 4.33 3.76 -1.24 -5.08 115.29 117.07 2k4n s HIS 106 Ca -0.15 -1.85 -0.16 0.00 -0.15 0.00 0.00 55.06 52.75 2k4n s HIS 106 Cb 0.03 -2.42 -0.07 0.00 1.11 0.00 0.00 32.58 31.22 2k4n s HIS 106 CO 0.76 -0.82 0.61 -1.01 -0.85 0.00 0.00 174.74 173.43 2k4n s HIS 107 N 1.28 3.62 0.24 1.40 3.76 -1.26 -3.54 115.29 120.80 2k4n s HIS 107 Ca -0.01 1.17 0.05 0.00 -0.15 0.00 0.00 55.06 56.13 2k4n s HIS 107 Cb -0.20 -2.46 -0.03 0.00 1.11 0.00 0.00 32.58 31.00 2k4n s HIS 107 CO -0.01 0.40 0.33 -1.01 -0.85 0.00 0.00 174.74 173.60 2k4n s HIS 108 N -1.48 3.37 0.00 1.40 3.76 -1.25 -4.97 115.29 116.12 2k4n s HIS 108 Ca 0.39 -0.04 -0.01 0.00 -0.15 0.00 0.00 55.06 55.25 2k4n s HIS 108 Cb -0.16 -1.55 -0.04 0.00 1.11 0.00 0.00 32.58 31.95 2k4n s HIS 108 CO 0.20 0.45 2.13 0.72 -0.85 0.00 0.00 174.74 177.38 2k4n n HIS 109 N -1.37 0.00 0.00 1.40 8.25 -1.26 -3.18 115.22 119.06 2k4n n HIS 109 Ca -0.09 -1.02 0.00 0.00 -0.26 0.00 0.00 57.72 56.36 2k4n n HIS 109 Cb 0.57 -0.64 0.00 0.00 1.12 0.00 0.00 29.99 31.04 2k4n n HIS 109 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2k4n n HIS 110 N 1.68 0.00 -1.41 4.41 -0.00 -1.26 -5.38 115.22 113.25 2k4n n HIS 110 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.78 2k4n n HIS 110 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.52 2k4n n HIS 110 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95