#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k4u s ARG 2 N 0.00 1.03 0.00 1.47 1.81 -1.26 -4.93 118.95 117.08 3k4u s ARG 2 Ca 0.00 -0.23 0.00 0.00 -1.72 0.00 0.00 55.73 53.78 3k4u s ARG 2 Cb 0.00 -0.95 0.00 0.00 -0.45 0.00 0.00 34.95 33.55 3k4u s ARG 2 CO 0.00 0.01 0.00 0.41 -0.68 0.00 0.00 175.30 175.04 3k4u n GLY 3 N 3.72 1.20 2.97 -3.53 0.00 -1.26 -4.79 105.19 103.50 3k4u n GLY 3 Ca -0.22 -0.02 -0.13 0.00 0.00 0.00 0.00 46.02 45.65 3k4u n GLY 3 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3k4u s GLU 4 N 0.00 0.12 -0.20 1.61 -1.05 -1.26 -2.58 118.70 115.34 3k4u s GLU 4 Ca 0.00 0.26 -0.24 0.00 -0.15 0.00 0.00 54.97 54.85 3k4u s GLU 4 Cb 0.00 -0.04 -0.02 0.00 -0.44 0.00 0.00 34.13 33.64 3k4u s GLU 4 CO 0.00 -0.08 0.77 -1.17 0.95 0.00 0.00 175.26 175.73 3k4u s LEU 5 N 0.56 4.14 -0.32 1.83 2.96 -0.97 -4.94 118.68 121.94 3k4u s LEU 5 Ca -0.04 1.03 -0.11 0.00 -0.22 0.00 0.00 54.13 54.79 3k4u s LEU 5 Cb -0.06 -3.12 -0.01 0.00 0.50 0.00 0.00 46.19 43.51 3k4u s LEU 5 CO -0.03 -0.39 0.19 -0.13 -1.32 0.00 0.00 176.35 174.67 3k4u s ARG 6 N 2.27 3.41 -0.06 1.98 0.52 -1.26 -1.90 118.95 123.92 3k4u s ARG 6 Ca 0.34 -0.68 -0.13 0.00 -0.52 0.00 0.00 55.73 54.74 3k4u s ARG 6 Cb -0.16 -3.66 -0.05 0.00 0.52 0.00 0.00 34.95 31.60 3k4u s ARG 6 CO 0.10 -0.42 0.33 0.08 0.02 0.00 0.00 175.30 175.41 3k4u s VAL 7 N 1.66 5.20 -0.24 3.52 1.01 -0.26 -0.49 120.40 130.79 3k4u s VAL 7 Ca 0.05 0.65 -0.05 0.00 0.00 0.00 0.00 61.98 62.63 3k4u s VAL 7 Cb -0.17 -3.63 -0.01 0.00 0.00 0.00 0.00 36.38 32.57 3k4u s VAL 7 CO 0.08 0.55 -0.00 -0.83 0.00 0.00 0.00 175.10 174.89 3k4u s GLY 8 N -0.74 1.67 0.17 4.51 0.00 -0.24 -0.39 107.32 112.29 3k4u s GLY 8 Ca 0.21 -1.23 -0.05 0.00 0.00 0.00 0.00 44.72 43.64 3k4u s GLY 8 CO 0.09 0.49 0.20 0.48 0.00 0.00 0.00 173.10 174.37 3k4u s LEU 9 N 1.49 1.19 -0.16 0.66 0.05 -1.17 -3.16 118.68 117.58 3k4u s LEU 9 Ca 0.05 -1.08 0.00 0.00 0.05 0.00 0.00 54.13 53.15 3k4u s LEU 9 Cb -0.15 0.82 0.03 0.00 -2.05 0.00 0.00 46.19 44.84 3k4u s LEU 9 CO -0.01 -0.86 -0.10 -0.70 -0.55 0.00 0.00 176.35 174.13 3k4u s GLU 10 N -4.03 1.91 0.35 1.48 2.12 -1.23 -0.31 118.70 118.98 3k4u s GLU 10 Ca 0.24 -0.60 -0.29 0.00 0.36 0.00 0.00 54.97 54.68 3k4u s GLU 10 Cb 0.05 -2.11 -0.11 0.00 0.26 0.00 0.00 34.13 32.22 3k4u s GLU 10 CO 0.04 -0.35 1.39 -2.14 -0.54 0.00 0.00 175.26 173.66 3k4u s PRO 11 N 1.52 4.25 0.00 4.30 0.02 -1.26 -4.35 135.00 139.48 3k4u s PRO 11 Ca 0.02 2.37 0.00 0.00 0.02 0.00 0.00 61.00 63.41 3k4u s PRO 11 Cb -0.14 -3.03 0.00 0.00 0.02 0.00 0.00 34.50 31.35 3k4u s PRO 11 CO -0.09 -0.34 0.00 0.41 -0.33 0.00 0.00 177.00 176.65 3k4u n GLY 12 N 0.75 0.18 3.71 0.52 0.00 0.26 -4.88 105.19 105.72 3k4u n GLY 12 Ca 0.01 0.17 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 3k4u n GLY 12 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3k4u n TYR 13 N 0.00 2.65 -4.96 1.61 -0.00 -1.18 -4.85 117.16 110.43 3k4u n TYR 13 Ca 0.00 0.06 -0.32 0.00 -0.00 0.00 0.00 57.90 57.63 3k4u n TYR 13 Cb 0.00 -2.66 -0.15 0.00 -0.00 0.00 0.00 39.34 36.54 3k4u n TYR 13 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 3k4u s LEU 14 N 1.33 2.52 -0.44 2.98 1.02 -1.26 -0.99 118.68 123.84 3k4u s LEU 14 Ca 0.77 -0.35 0.04 0.00 0.02 0.00 0.00 54.13 54.61 3k4u s LEU 14 Cb -0.54 -1.52 0.59 0.00 0.02 0.00 0.00 46.19 44.73 3k4u s LEU 14 CO 0.34 0.23 1.79 -0.81 0.02 0.00 0.00 176.35 177.92 3k4u n PRO 15 N 3.06 2.26 -0.06 1.29 -0.04 -1.26 -3.24 135.00 137.01 3k4u n PRO 15 Ca -0.18 -3.15 -0.05 0.00 -0.04 0.00 0.00 63.50 60.08 3k4u n PRO 15 Cb 0.52 -2.10 -0.04 0.00 -0.04 0.00 0.00 33.50 31.84 3k4u n PRO 15 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 3k4u h PHE 16 N 1.20 0.00 -3.84 0.54 0.04 -1.74 -2.56 116.94 110.58 3k4u h PHE 16 Ca 0.51 0.00 -0.13 0.00 2.80 0.00 0.00 57.97 61.16 3k4u h PHE 16 Cb 2.19 0.00 -0.17 0.00 2.20 0.00 0.00 35.95 40.17 3k4u h PHE 16 CO 1.40 0.33 -0.53 -1.21 -0.60 0.00 0.00 178.31 177.70 3k4u s GLU 17 N -1.84 0.59 -0.05 1.51 8.01 -0.16 -1.77 118.70 124.99 3k4u s GLU 17 Ca -0.08 -0.79 0.00 0.00 0.01 0.00 0.00 54.97 54.11 3k4u s GLU 17 Cb -0.00 0.23 0.02 0.00 -4.31 0.00 0.00 34.13 30.07 3k4u s GLU 17 CO 0.23 -0.15 -0.02 0.21 0.01 0.00 0.00 175.26 175.54 3k4u s LYS 19 N -2.73 0.66 -0.02 1.61 2.20 -1.26 0.89 119.74 121.09 3k4u s LYS 19 Ca -0.04 0.01 -0.27 0.00 -0.36 0.00 0.00 55.97 55.31 3k4u s LYS 19 Cb -0.00 -0.83 0.06 0.00 -1.51 0.00 0.00 37.83 35.54 3k4u s LYS 19 CO -0.05 -0.18 0.60 0.34 -0.36 0.00 0.00 175.35 175.70 3k4u s ASP 20 N 1.34 -0.56 0.00 1.43 3.68 -0.28 -4.91 116.67 117.37 3k4u s ASP 20 Ca -0.05 0.51 0.00 0.00 2.13 0.00 0.00 52.55 55.14 3k4u s ASP 20 Cb -0.13 0.51 0.00 0.00 -1.45 0.00 0.00 42.92 41.84 3k4u s ASP 20 CO -0.02 -0.63 0.00 0.29 0.13 0.00 0.00 175.17 174.94 3k4u n LYS 21 N 0.81 0.00 0.00 4.34 5.02 -1.26 -2.92 118.16 124.14 3k4u n LYS 21 Ca -0.19 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.23 3k4u n LYS 21 Cb 0.58 0.00 0.47 0.00 -0.02 0.00 0.00 35.03 36.06 3k4u n LYS 21 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3k4u n LYS 22 N 0.00 0.98 -0.98 1.97 5.02 -1.26 -4.87 118.16 119.02 3k4u n LYS 22 Ca 0.00 -0.53 0.00 0.00 -2.02 0.00 0.00 58.31 55.76 3k4u n LYS 22 Cb 0.00 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.52 3k4u n LYS 22 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3k4u n GLY 23 N 1.29 0.49 3.84 0.72 0.00 -1.15 -5.03 105.19 105.35 3k4u n GLY 23 Ca 0.14 -0.14 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 3k4u n GLY 23 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3k4u s ASN 24 N -2.12 6.69 -0.07 1.61 0.01 -1.25 -4.74 114.94 115.06 3k4u s ASN 24 Ca 0.00 1.58 -0.04 0.00 -0.71 0.00 0.00 52.86 53.69 3k4u s ASN 24 Cb 0.00 -2.51 -0.04 0.00 0.41 0.00 0.00 41.25 39.11 3k4u s ASN 24 CO 0.00 -0.53 0.11 0.54 -1.51 0.00 0.00 177.10 175.71 3k4u s VAL 25 N -2.52 5.12 0.22 1.60 0.11 -1.26 -1.13 120.40 122.54 3k4u s VAL 25 Ca 0.59 -0.06 -0.17 0.00 -2.93 0.00 0.00 61.98 59.41 3k4u s VAL 25 Cb -0.10 -3.27 0.02 0.00 -1.53 0.00 0.00 36.38 31.51 3k4u s VAL 25 CO 0.27 0.52 0.55 0.27 -3.33 0.00 0.00 175.10 173.37 3k4u s ILE 26 N -1.08 0.02 -4.11 7.04 -4.36 -1.26 -4.98 121.20 112.46 3k4u s ILE 26 Ca 0.18 -0.90 0.00 0.00 -0.26 0.00 0.00 60.65 59.67 3k4u s ILE 26 Cb -0.12 -1.74 0.00 0.00 1.25 0.00 0.00 42.46 41.85 3k4u s ILE 26 CO 0.08 -0.08 0.00 0.61 0.24 0.00 0.00 174.94 175.79 3k4u n GLY 27 N -0.37 0.94 0.15 6.27 0.00 -1.26 -4.12 105.19 106.82 3k4u n GLY 27 Ca -0.08 -2.00 -0.14 0.00 0.00 0.00 0.00 46.02 43.80 3k4u n GLY 27 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3k4u h PHE 28 N 0.00 -0.28 -0.28 1.61 3.57 -0.90 -0.72 116.94 119.93 3k4u h PHE 28 Ca 0.00 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.53 3k4u h PHE 28 Cb 0.00 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.82 3k4u h PHE 28 CO 0.00 -0.17 0.19 -0.44 -2.23 0.00 0.00 178.31 175.65 3k4u h ASP 29 N -0.30 0.18 0.00 0.41 3.45 -1.63 0.52 116.42 119.06 3k4u h ASP 29 Ca -0.03 -0.00 -0.04 0.00 0.43 0.00 0.00 57.03 57.39 3k4u h ASP 29 Cb 0.23 -0.04 0.00 0.00 -0.56 0.00 0.00 39.33 38.96 3k4u h ASP 29 CO 0.04 0.12 -0.16 0.58 -1.57 0.00 0.00 179.24 178.26 3k4u h VAL 30 N 0.21 1.59 -0.98 -1.35 2.07 -1.52 -1.16 116.25 115.12 3k4u h VAL 30 Ca 0.12 -1.96 0.13 0.00 0.82 0.00 0.00 66.70 65.81 3k4u h VAL 30 Cb 0.21 2.87 -0.08 0.00 -1.52 0.00 0.00 31.29 32.77 3k4u h VAL 30 CO -0.02 0.53 0.62 0.44 0.02 0.00 0.00 177.57 179.16 3k4u h ASP 31 N -0.64 0.87 0.66 0.57 5.19 -1.03 0.27 116.42 122.32 3k4u h ASP 31 Ca -0.02 0.05 -0.03 0.00 -0.62 0.00 0.00 57.03 56.41 3k4u h ASP 31 Cb 0.95 -0.12 -0.00 0.00 0.18 0.00 0.00 39.33 40.33 3k4u h ASP 31 CO 0.03 0.45 -0.40 -0.07 -3.12 0.00 0.00 179.24 176.13 3k4u h LEU 32 N 0.93 -1.00 -2.01 1.55 4.07 -0.84 -2.31 115.31 115.70 3k4u h LEU 32 Ca 0.49 0.06 0.02 0.00 0.08 0.00 0.00 57.88 58.53 3k4u h LEU 32 Cb 0.55 0.29 -0.00 0.00 1.08 0.00 0.00 40.66 42.58 3k4u h LEU 32 CO -0.26 -0.63 0.06 0.00 -1.08 0.00 0.00 178.44 176.54 3k4u h ALA 33 N -0.74 2.07 -0.32 1.53 0.00 -0.61 -1.32 119.26 119.87 3k4u h ALA 33 Ca -0.08 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 3k4u h ALA 33 Cb 0.80 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 3k4u h ALA 33 CO 0.09 -0.11 0.10 0.00 0.00 0.00 0.00 179.25 179.33 3k4u h ARG 34 N 0.00 0.50 -1.83 0.00 3.08 -0.31 -1.88 114.38 113.94 3k4u h ARG 34 Ca 0.04 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.98 3k4u h ARG 34 Cb 0.16 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.14 3k4u h ARG 34 CO -0.00 0.54 0.00 0.39 -1.07 0.00 0.00 179.97 179.83 3k4u n GLU 35 N -4.67 0.45 0.00 0.04 -0.58 -0.50 -2.69 120.64 112.69 3k4u n GLU 35 Ca -0.02 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.72 3k4u n GLU 35 Cb 0.17 -1.27 0.00 0.00 -0.57 0.00 0.00 31.44 29.77 3k4u n GLU 35 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3k4u n ALA 37 N 1.40 0.00 -0.06 0.62 0.00 -0.71 -1.92 120.51 119.84 3k4u n ALA 37 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 3k4u n ALA 37 Cb 0.23 0.00 0.25 0.00 0.00 0.00 0.00 19.45 19.92 3k4u n ALA 37 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3k4u h LYS 38 N 0.00 0.67 -0.84 0.00 6.56 -1.71 -0.40 116.57 120.86 3k4u h LYS 38 Ca 0.00 -0.14 0.00 0.00 -1.06 0.00 0.00 60.65 59.45 3k4u h LYS 38 Cb 0.00 -0.10 0.00 0.00 -0.57 0.00 0.00 32.23 31.56 3k4u h LYS 38 CO 0.00 0.64 0.00 0.00 -2.06 0.00 0.00 179.45 178.03 3k4u n ALA 39 N -2.47 1.64 -1.85 3.86 0.00 -0.81 -4.69 120.51 116.19 3k4u n ALA 39 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 3k4u n ALA 39 Cb 0.23 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.68 3k4u n ALA 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k4u n GLY 41 N 0.52 0.89 4.02 0.00 0.00 -0.28 -5.24 105.19 105.10 3k4u n GLY 41 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 3k4u n GLY 41 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k4u s VAL 42 N 0.00 2.27 -0.02 1.61 1.01 -0.47 -4.98 120.40 119.81 3k4u s VAL 42 Ca 0.00 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.07 3k4u s VAL 42 Cb 0.00 -2.34 -0.03 0.00 0.00 0.00 0.00 36.38 34.01 3k4u s VAL 42 CO 0.00 0.00 -0.06 -0.54 0.00 0.00 0.00 175.10 174.50 3k4u s LYS 43 N -4.70 2.66 0.22 2.72 3.01 -1.07 -4.39 119.74 118.19 3k4u s LYS 43 Ca 0.62 -0.64 -0.29 0.00 -1.01 0.00 0.00 55.97 54.64 3k4u s LYS 43 Cb -0.06 -2.56 -0.09 0.00 -1.01 0.00 0.00 37.83 34.11 3k4u s LYS 43 CO 0.39 0.63 0.91 -1.17 0.51 0.00 0.00 175.35 176.62 3k4u s LEU 44 N -1.23 4.63 -0.08 3.17 2.96 -1.26 -2.29 118.68 124.57 3k4u s LEU 44 Ca 0.16 1.88 -0.01 0.00 -0.22 0.00 0.00 54.13 55.94 3k4u s LEU 44 Cb -0.11 -3.55 0.03 0.00 0.50 0.00 0.00 46.19 43.05 3k4u s LEU 44 CO 0.06 0.15 -0.03 -0.75 -1.32 0.00 0.00 176.35 174.46 3k4u s LYS 45 N -1.07 0.91 -0.09 1.98 2.47 -0.80 -4.95 119.74 118.19 3k4u s LYS 45 Ca 0.41 -0.02 -0.15 0.00 -1.56 0.00 0.00 55.97 54.64 3k4u s LYS 45 Cb -0.25 -1.15 -0.05 0.00 -1.46 0.00 0.00 37.83 34.92 3k4u s LYS 45 CO 0.31 -0.27 0.38 -0.51 0.16 0.00 0.00 175.35 175.42 3k4u s LEU 46 N 1.80 4.34 -0.56 5.43 1.43 -1.26 -1.10 118.68 128.76 3k4u s LEU 46 Ca 0.04 0.75 0.04 0.00 -1.03 0.00 0.00 54.13 53.93 3k4u s LEU 46 Cb -0.13 -2.53 0.15 0.00 0.03 0.00 0.00 46.19 43.72 3k4u s LEU 46 CO -0.06 0.16 0.36 -0.69 0.23 0.00 0.00 176.35 176.35 3k4u s VAL 47 N -0.06 2.12 0.24 -1.59 1.01 0.47 -4.93 120.40 117.66 3k4u s VAL 47 Ca 0.22 -3.42 -0.30 0.00 0.00 0.00 0.00 61.98 58.48 3k4u s VAL 47 Cb -0.15 -2.43 -0.09 0.00 0.00 0.00 0.00 36.38 33.71 3k4u s VAL 47 CO 0.09 -0.96 1.29 -2.84 0.00 0.00 0.00 175.10 172.68 3k4u s PRO 48 N -0.55 4.40 -0.25 2.72 0.02 -1.26 -3.03 135.00 137.06 3k4u s PRO 48 Ca 0.22 2.07 -0.25 0.00 0.02 0.00 0.00 61.00 63.07 3k4u s PRO 48 Cb -0.13 -3.16 0.07 0.00 0.02 0.00 0.00 34.50 31.29 3k4u s PRO 48 CO -0.09 -0.19 0.70 0.99 -0.33 0.00 0.00 177.00 178.07 3k4u s THR 49 N -0.31 0.00 0.49 0.99 2.01 0.58 -4.94 115.64 114.47 3k4u s THR 49 Ca 0.54 -0.00 -0.21 0.00 0.31 0.00 0.00 61.69 62.32 3k4u s THR 49 Cb -0.37 -0.97 -0.07 0.00 0.01 0.00 0.00 72.50 71.10 3k4u s THR 49 CO 0.42 -0.00 1.13 -0.94 -0.69 0.00 0.00 174.62 174.54 3k4u s SER 50 N 0.27 6.05 0.21 3.53 1.04 -1.26 -3.54 113.70 119.99 3k4u s SER 50 Ca -0.01 2.19 -0.18 0.00 0.48 0.00 0.00 55.95 58.43 3k4u s SER 50 Cb -0.05 -2.59 0.18 0.00 0.10 0.00 0.00 66.02 63.67 3k4u s SER 50 CO 0.02 -0.99 1.45 1.87 0.98 0.00 0.00 173.24 176.56 3k4u n TRP 51 N -0.84 -0.03 1.18 5.02 -0.00 -1.26 -0.07 117.44 121.42 3k4u n TRP 51 Ca 0.09 1.15 0.04 0.00 -0.00 0.00 0.00 57.50 58.78 3k4u n TRP 51 Cb 0.50 -0.81 0.22 0.00 -0.00 0.00 0.00 31.31 31.22 3k4u n TRP 51 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 177.69 177.29 3k4u n ASP 52 N -5.34 0.00 -0.15 5.87 3.85 -1.26 -2.33 116.55 117.19 3k4u n ASP 52 Ca 0.08 -0.95 0.08 0.00 -0.71 0.00 0.00 54.79 53.30 3k4u n ASP 52 Cb 0.36 0.00 0.12 0.00 -1.35 0.00 0.00 41.12 40.24 3k4u n ASP 52 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3k4u n GLY 53 N 0.12 4.17 0.06 6.12 0.00 0.89 -4.67 105.19 111.89 3k4u n GLY 53 Ca 0.06 -0.95 -0.05 0.00 0.00 0.00 0.00 46.02 45.08 3k4u n GLY 53 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3k4u h LEU 54 N 0.01 0.00 -0.27 0.99 3.38 -1.53 -1.87 115.31 116.02 3k4u h LEU 54 Ca -0.00 -0.10 0.05 0.00 0.09 0.00 0.00 57.88 57.92 3k4u h LEU 54 Cb 1.07 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.77 3k4u h LEU 54 CO 0.00 0.72 -0.03 0.40 0.09 0.00 0.00 178.44 179.61 3k4u h ILE 55 N -1.00 0.77 -0.29 1.22 2.04 -1.87 0.50 117.51 118.88 3k4u h ILE 55 Ca -0.03 -0.01 -0.02 0.00 1.00 0.00 0.00 64.86 65.80 3k4u h ILE 55 Cb 0.39 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 37.17 3k4u h ILE 55 CO -0.02 0.01 0.07 -0.65 0.00 0.00 0.00 178.15 177.56 3k4u h PRO 56 N 0.04 0.41 0.00 2.37 0.11 -1.83 -0.45 132.00 132.65 3k4u h PRO 56 Ca 0.13 -0.06 -0.07 0.00 0.11 0.00 0.00 66.00 66.12 3k4u h PRO 56 Cb 0.18 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.21 3k4u h PRO 56 CO -0.25 0.38 -0.31 0.78 -0.21 0.00 0.00 178.00 178.39 3k4u h GLY 57 N 0.63 0.00 0.39 -0.55 0.00 -0.59 -2.54 103.07 100.40 3k4u h GLY 57 Ca 0.10 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.33 3k4u h GLY 57 CO -0.00 0.00 -0.42 -2.00 0.00 0.00 0.00 176.54 174.12 3k4u h LEU 58 N 0.00 0.25 -2.07 3.11 5.85 -0.18 0.14 115.31 122.41 3k4u h LEU 58 Ca -0.00 -0.95 -0.00 0.00 0.84 0.00 0.00 57.88 57.76 3k4u h LEU 58 Cb 0.56 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.51 3k4u h LEU 58 CO 0.04 1.18 -0.01 0.58 -0.34 0.00 0.00 178.44 179.89 3k4u h VAL 59 N -0.63 0.04 -0.17 1.05 2.07 -1.01 -2.11 116.25 115.49 3k4u h VAL 59 Ca -0.07 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.12 3k4u h VAL 59 Cb 1.31 1.31 0.00 0.00 -1.52 0.00 0.00 31.29 32.39 3k4u h VAL 59 CO 0.08 0.01 0.00 0.41 0.02 0.00 0.00 177.57 178.09 3k4u n THR 60 N -3.13 0.32 -2.22 2.57 -1.04 -0.97 -4.97 114.28 104.85 3k4u n THR 60 Ca -0.01 -0.66 -0.15 0.00 -2.04 0.00 0.00 64.05 61.19 3k4u n THR 60 Cb 0.21 1.06 -0.01 0.00 -1.82 0.00 0.00 70.33 69.77 3k4u n THR 60 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3k4u n GLU 61 N 0.89 -1.21 -0.33 -2.82 1.02 -0.79 -4.86 120.64 112.54 3k4u n GLU 61 Ca 0.11 0.77 -0.04 0.00 -0.02 0.00 0.00 57.16 57.98 3k4u n GLU 61 Cb 0.42 -5.11 0.09 0.00 -0.02 0.00 0.00 31.44 26.82 3k4u n GLU 61 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 3k4u h LYS 62 N 0.00 1.24 -3.75 3.49 6.56 -0.98 -3.47 116.57 119.66 3k4u h LYS 62 Ca -0.36 -0.14 -0.08 0.00 -1.06 0.00 0.00 60.65 59.01 3k4u h LYS 62 Cb 1.25 -0.25 -0.11 0.00 -0.57 0.00 0.00 32.23 32.56 3k4u h LYS 62 CO 0.43 0.89 -0.20 -0.59 -2.06 0.00 0.00 179.45 177.93 3k4u s PHE 63 N -5.87 0.38 -0.13 -1.35 -0.12 -1.17 -4.99 117.98 104.73 3k4u s PHE 63 Ca -0.13 -0.73 0.18 0.00 -0.05 0.00 0.00 56.93 56.21 3k4u s PHE 63 Cb 0.17 0.09 -0.19 0.00 -0.63 0.00 0.00 43.02 42.46 3k4u s PHE 63 CO 0.82 -0.88 0.63 -0.25 -0.05 0.00 0.00 175.22 175.49 3k4u n ASP 64 N -0.32 0.53 -3.75 1.98 8.00 0.35 -4.56 116.55 118.78 3k4u n ASP 64 Ca -0.04 0.23 -0.13 0.00 0.71 0.00 0.00 54.79 55.56 3k4u n ASP 64 Cb 0.63 0.68 -0.09 0.00 -0.02 0.00 0.00 41.12 42.32 3k4u n ASP 64 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3k4u s ILE 65 N -2.98 0.05 -0.35 0.53 2.07 -1.14 -4.64 121.20 114.73 3k4u s ILE 65 Ca -0.05 -0.37 -0.10 0.00 -1.41 0.00 0.00 60.65 58.71 3k4u s ILE 65 Cb 0.09 -0.60 0.02 0.00 0.13 0.00 0.00 42.46 42.10 3k4u s ILE 65 CO 0.83 -0.20 0.18 -0.63 -1.91 0.00 0.00 174.94 173.21 3k4u s ILE 66 N -1.04 4.52 -0.66 2.00 1.01 -0.16 -1.07 121.20 125.80 3k4u s ILE 66 Ca -0.11 -0.75 0.05 0.00 0.00 0.00 0.00 60.65 59.84 3k4u s ILE 66 Cb -0.05 -3.46 0.18 0.00 0.01 0.00 0.00 42.46 39.15 3k4u s ILE 66 CO 0.04 -0.14 0.51 -0.38 0.00 0.00 0.00 174.94 174.97 3k4u n ILE 67 N 4.98 1.37 -3.19 2.92 5.41 -1.19 -2.38 119.36 127.28 3k4u n ILE 67 Ca -0.12 -4.74 -0.22 0.00 1.00 0.00 0.00 62.75 58.66 3k4u n ILE 67 Cb 0.47 -2.11 -0.06 0.00 -0.71 0.00 0.00 39.64 37.23 3k4u n ILE 67 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 3k4u n SER 68 N 1.89 0.70 -2.09 4.38 3.41 -1.26 -4.73 113.62 115.93 3k4u n SER 68 Ca 0.23 -2.86 0.00 0.00 -0.26 0.00 0.00 58.87 55.97 3k4u n SER 68 Cb 0.38 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 63.69 3k4u n SER 68 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3k4u n GLY 69 N 0.97 -4.01 3.27 5.00 0.00 -1.26 -4.85 105.19 104.30 3k4u n GLY 69 Ca 0.23 -0.05 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 3k4u n GLY 69 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k4u s THR 71 N -0.40 1.85 -0.90 2.61 2.01 -1.26 -4.96 115.64 114.58 3k4u s THR 71 Ca 0.00 -1.04 -0.20 0.00 0.31 0.00 0.00 61.69 60.76 3k4u s THR 71 Cb 0.00 -1.54 0.10 0.00 0.01 0.00 0.00 72.50 71.07 3k4u s THR 71 CO 0.00 0.49 1.17 -0.63 -0.69 0.00 0.00 174.62 174.96 3k4u s ILE 72 N -0.58 4.48 0.19 1.82 1.01 0.05 -4.80 121.20 123.36 3k4u s ILE 72 Ca 0.09 -1.18 0.05 0.00 0.00 0.00 0.00 60.65 59.61 3k4u s ILE 72 Cb -0.09 -4.82 -0.04 0.00 0.01 0.00 0.00 42.46 37.52 3k4u s ILE 72 CO -0.01 -1.59 0.23 -0.94 0.00 0.00 0.00 174.94 172.63 3k4u s SER 73 N 3.92 5.89 0.53 3.58 1.04 -1.26 -4.74 113.70 122.66 3k4u s SER 73 Ca 0.34 -0.03 0.27 0.00 0.48 0.00 0.00 55.95 57.00 3k4u s SER 73 Cb -0.06 -1.64 1.49 0.00 0.10 0.00 0.00 66.02 65.91 3k4u s SER 73 CO -0.06 0.02 2.11 1.56 0.98 0.00 0.00 173.24 177.85 3k4u h GLN 74 N 1.98 0.00 -0.09 4.02 7.50 -1.96 0.99 115.11 127.55 3k4u h GLN 74 Ca -0.49 0.00 -0.24 0.00 0.50 0.00 0.00 58.65 58.42 3k4u h GLN 74 Cb 1.21 0.00 0.01 0.00 0.05 0.00 0.00 27.48 28.75 3k4u h GLN 74 CO 0.64 0.10 -0.89 1.49 -1.50 0.00 0.00 178.83 178.67 3k4u h GLU 75 N 0.00 0.74 0.00 1.46 4.81 -1.99 -3.04 114.58 116.55 3k4u h GLU 75 Ca -0.00 -0.68 -0.17 0.00 -0.13 0.00 0.00 59.36 58.38 3k4u h GLU 75 Cb 0.26 0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 3k4u h GLU 75 CO 0.01 1.27 -0.80 0.00 -0.73 0.00 0.00 179.01 178.76 3k4u h ARG 76 N 0.47 0.00 0.00 1.92 3.08 -1.83 -3.07 114.38 114.94 3k4u h ARG 76 Ca -0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.97 3k4u h ARG 76 Cb 1.52 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.57 3k4u h ARG 76 CO 0.18 0.80 0.00 -0.97 -1.07 0.00 0.00 179.97 178.91 3k4u h ASN 77 N 0.00 0.00 1.54 7.04 -0.00 -0.78 -1.00 115.58 122.39 3k4u h ASN 77 Ca -0.01 0.00 -0.01 0.00 -0.00 0.00 0.00 56.30 56.28 3k4u h ASN 77 Cb 1.62 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 39.94 3k4u h ASN 77 CO 0.10 0.00 -0.04 -0.07 -0.00 0.00 0.00 177.43 177.42 3k4u h LEU 78 N 0.00 0.00 0.00 0.34 3.38 -1.43 -3.33 115.31 114.27 3k4u h LEU 78 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3k4u h LEU 78 Cb 0.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.21 3k4u h LEU 78 CO 0.00 0.04 -1.41 0.54 0.09 0.00 0.00 178.44 177.71 3k4u n ARG 79 N -3.12 0.77 -3.87 1.13 1.74 -0.42 -5.03 116.66 107.84 3k4u n ARG 79 Ca 0.02 -0.09 -0.09 0.00 -0.77 0.00 0.00 57.85 56.92 3k4u n ARG 79 Cb 0.45 -1.25 -0.05 0.00 -1.02 0.00 0.00 32.46 30.60 3k4u n ARG 79 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 3k4u s VAL 80 N -2.73 0.02 -0.04 1.55 -7.23 -0.95 -4.69 120.40 106.33 3k4u s VAL 80 Ca -0.03 -1.11 -0.04 0.00 -1.81 0.00 0.00 61.98 58.99 3k4u s VAL 80 Cb 0.08 -1.87 -0.04 0.00 0.56 0.00 0.00 36.38 35.11 3k4u s VAL 80 CO 0.50 -0.10 0.16 0.20 -0.31 0.00 0.00 175.10 175.55 3k4u s ASN 81 N -2.94 6.29 -0.15 4.85 0.01 0.76 -4.36 114.94 119.39 3k4u s ASN 81 Ca 0.15 0.36 -0.06 0.00 -0.71 0.00 0.00 52.86 52.60 3k4u s ASN 81 Cb -0.01 -1.97 -0.04 0.00 0.41 0.00 0.00 41.25 39.64 3k4u s ASN 81 CO 0.02 0.30 0.05 -0.36 -1.51 0.00 0.00 177.10 175.60 3k4u s PHE 82 N -1.23 3.24 1.09 2.20 0.08 -1.26 -0.49 117.98 121.61 3k4u s PHE 82 Ca 0.23 0.10 -0.15 0.00 0.12 0.00 0.00 56.93 57.24 3k4u s PHE 82 Cb -0.12 -1.99 0.16 0.00 -0.57 0.00 0.00 43.02 40.50 3k4u s PHE 82 CO 0.14 0.26 0.56 0.28 -0.10 0.00 0.00 175.22 176.36 3k4u n VAL 83 N 3.08 0.00 -2.16 -0.44 0.31 -0.07 -4.95 118.33 114.09 3k4u n VAL 83 Ca -0.17 -0.30 -0.35 0.00 -0.01 0.00 0.00 64.34 63.51 3k4u n VAL 83 Cb 0.53 -0.79 0.01 0.00 -0.91 0.00 0.00 33.84 32.68 3k4u n VAL 83 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 3k4u s GLU 84 N -3.95 3.23 0.24 5.55 0.41 -1.26 -4.50 118.70 118.42 3k4u s GLU 84 Ca 0.62 1.62 -0.31 0.00 -0.41 0.00 0.00 54.97 56.48 3k4u s GLU 84 Cb -0.19 -1.99 -0.13 0.00 -1.78 0.00 0.00 34.13 30.04 3k4u s GLU 84 CO 0.65 -0.95 1.45 -0.35 -0.49 0.00 0.00 175.26 175.57 3k4u n PRO 85 N -1.48 2.15 0.00 0.39 -0.04 -1.26 -4.69 135.00 130.08 3k4u n PRO 85 Ca 0.12 0.77 0.13 0.00 -0.04 0.00 0.00 63.50 64.47 3k4u n PRO 85 Cb 0.51 -2.45 0.32 0.00 -0.04 0.00 0.00 33.50 31.83 3k4u n PRO 85 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 3k4u n TYR 86 N 2.07 0.00 -3.58 0.54 0.18 0.74 -4.93 117.16 112.18 3k4u n TYR 86 Ca 0.12 0.00 -0.13 0.00 1.88 0.00 0.00 57.90 59.77 3k4u n TYR 86 Cb 0.32 -0.14 -0.06 0.00 -0.38 0.00 0.00 39.34 39.08 3k4u n TYR 86 CO 0.00 0.00 0.00 -1.50 -2.08 0.00 0.00 176.86 173.28 3k4u s ILE 87 N -2.62 0.00 -0.14 -3.48 2.07 -1.22 -5.02 121.20 110.78 3k4u s ILE 87 Ca 0.21 0.00 -0.01 0.00 -1.41 0.00 0.00 60.65 59.44 3k4u s ILE 87 Cb 0.19 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 41.76 3k4u s ILE 87 CO 0.57 0.00 -0.12 -0.69 -1.91 0.00 0.00 174.94 172.79 3k4u s VAL 88 N -0.69 3.13 0.00 4.00 1.01 -1.26 -1.69 120.40 124.90 3k4u s VAL 88 Ca -0.03 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.32 3k4u s VAL 88 Cb -0.02 -2.33 0.00 0.00 0.00 0.00 0.00 36.38 34.03 3k4u s VAL 88 CO 0.02 0.51 0.00 0.52 0.00 0.00 0.00 175.10 176.16 3k4u n VAL 89 N 3.67 0.00 0.00 2.92 0.31 -0.51 -4.97 118.33 119.75 3k4u n VAL 89 Ca -0.18 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.15 3k4u n VAL 89 Cb 0.52 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.45 3k4u n VAL 89 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3k4u n GLY 90 N 3.46 1.37 3.72 2.92 0.00 -1.26 -2.13 105.19 113.27 3k4u n GLY 90 Ca 0.00 -0.42 -0.42 0.00 0.00 0.00 0.00 46.02 45.18 3k4u n GLY 90 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3k4u s GLN 91 N -2.00 4.17 0.40 1.61 1.11 -1.26 -0.30 119.66 123.38 3k4u s GLN 91 Ca 0.00 2.49 0.03 0.00 0.01 0.00 0.00 55.36 57.89 3k4u s GLN 91 Cb 0.00 -3.15 -0.04 0.00 -1.01 0.00 0.00 33.01 28.81 3k4u s GLN 91 CO 0.00 -0.69 0.08 -1.54 0.01 0.00 0.00 175.29 173.15 3k4u s SER 92 N 1.27 2.92 -0.07 5.90 1.04 -0.84 0.09 113.70 124.01 3k4u s SER 92 Ca 0.73 -1.56 0.03 0.00 0.48 0.00 0.00 55.95 55.63 3k4u s SER 92 Cb -0.46 0.28 0.01 0.00 0.10 0.00 0.00 66.02 65.94 3k4u s SER 92 CO 0.32 -0.79 -0.16 -0.76 0.98 0.00 0.00 173.24 172.82 3k4u s LEU 93 N -3.62 1.82 0.02 2.42 1.43 -1.24 -2.47 118.68 117.03 3k4u s LEU 93 Ca 0.25 -0.38 -0.23 0.00 -1.03 0.00 0.00 54.13 52.74 3k4u s LEU 93 Cb 0.05 -1.01 -0.05 0.00 0.03 0.00 0.00 46.19 45.21 3k4u s LEU 93 CO 0.13 0.09 0.70 -0.76 0.23 0.00 0.00 176.35 176.74 3k4u s LEU 94 N 0.44 4.43 0.14 1.79 1.43 -0.56 -1.57 118.68 124.78 3k4u s LEU 94 Ca -0.13 1.33 0.03 0.00 -1.03 0.00 0.00 54.13 54.32 3k4u s LEU 94 Cb -0.15 -3.11 -0.04 0.00 0.03 0.00 0.00 46.19 42.91 3k4u s LEU 94 CO 0.05 0.03 -0.07 0.68 0.23 0.00 0.00 176.35 177.27 3k4u s VAL 95 N -0.02 0.95 0.60 -1.59 -7.23 -0.09 0.11 120.40 113.12 3k4u s VAL 95 Ca 0.36 -2.01 -0.18 0.00 -1.81 0.00 0.00 61.98 58.34 3k4u s VAL 95 Cb -0.19 -1.85 -0.03 0.00 0.56 0.00 0.00 36.38 34.87 3k4u s VAL 95 CO 0.21 -0.74 1.20 -0.75 -0.31 0.00 0.00 175.10 174.70 3k4u s LYS 96 N -3.80 2.96 0.33 4.82 2.36 -1.23 0.12 119.74 125.29 3k4u s LYS 96 Ca 0.16 1.79 -0.29 0.00 -2.55 0.00 0.00 55.97 55.09 3k4u s LYS 96 Cb 0.04 -1.93 -0.11 0.00 -1.05 0.00 0.00 37.83 34.78 3k4u s LYS 96 CO -0.00 -1.21 1.50 0.21 1.55 0.00 0.00 175.35 177.40 3k4u s LYS 97 N -3.38 4.15 0.00 4.03 2.20 -1.26 -1.86 119.74 123.62 3k4u s LYS 97 Ca 0.77 2.52 0.00 0.00 -0.36 0.00 0.00 55.97 58.89 3k4u s LYS 97 Cb -0.29 -3.01 0.00 0.00 -1.51 0.00 0.00 37.83 33.02 3k4u s LYS 97 CO 0.33 -0.53 0.00 0.41 -0.36 0.00 0.00 175.35 175.21 3k4u n GLY 98 N 1.24 3.11 0.22 5.54 0.00 -1.26 -4.90 105.19 109.13 3k4u n GLY 98 Ca 0.04 -0.90 0.04 0.00 0.00 0.00 0.00 46.02 45.20 3k4u n GLY 98 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3k4u h LEU 99 N 0.00 0.02 -0.33 0.99 3.38 -1.74 -3.07 115.31 114.55 3k4u h LEU 99 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3k4u h LEU 99 Cb 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3k4u h LEU 99 CO 0.00 0.24 0.00 -1.84 0.09 0.00 0.00 178.44 176.93 3k4u n GLU 100 N -4.27 0.07 -2.70 1.13 0.00 -1.26 -4.73 120.64 108.88 3k4u n GLU 100 Ca -0.02 0.38 -0.43 0.00 0.00 0.00 0.00 57.16 57.09 3k4u n GLU 100 Cb 0.28 -1.65 -0.02 0.00 0.00 0.00 0.00 31.44 30.05 3k4u n GLU 100 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 3k4u s LYS 101 N -3.14 4.29 0.00 3.44 1.02 -1.16 -3.39 119.74 120.79 3k4u s LYS 101 Ca 0.04 1.32 0.00 0.00 0.02 0.00 0.00 55.97 57.34 3k4u s LYS 101 Cb 0.07 -3.61 0.00 0.00 -0.52 0.00 0.00 37.83 33.77 3k4u s LYS 101 CO 0.24 -0.53 0.00 0.41 -0.92 0.00 0.00 175.35 174.55 3k4u n GLY 102 N 3.31 0.56 3.68 -3.33 0.00 -1.26 -4.95 105.19 103.19 3k4u n GLY 102 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 3k4u n GLY 102 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3k4u s VAL 103 N -2.43 3.41 -0.16 1.61 -7.23 -1.22 -4.92 120.40 109.46 3k4u s VAL 103 Ca 0.00 0.69 0.17 0.00 -1.81 0.00 0.00 61.98 61.03 3k4u s VAL 103 Cb 0.00 -3.44 0.34 0.00 0.56 0.00 0.00 36.38 33.84 3k4u s VAL 103 CO 0.00 -0.03 1.20 0.29 -0.31 0.00 0.00 175.10 176.25 3k4u n LYS 104 N 6.29 1.48 0.00 4.82 5.02 -1.26 -5.00 118.16 129.51 3k4u n LYS 104 Ca 0.16 -2.78 0.00 0.00 -2.02 0.00 0.00 58.31 53.67 3k4u n LYS 104 Cb 0.42 -1.56 0.00 0.00 -0.02 0.00 0.00 35.03 33.87 3k4u n LYS 104 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3k4u n SER 105 N -1.29 0.00 -0.10 4.39 2.88 -1.26 -4.96 113.62 113.27 3k4u n SER 105 Ca 0.18 0.00 0.27 0.00 -1.33 0.00 0.00 58.87 57.98 3k4u n SER 105 Cb 0.68 0.00 0.69 0.00 -0.75 0.00 0.00 64.21 64.83 3k4u n SER 105 CO 0.00 0.00 0.00 0.10 -1.23 0.00 0.00 175.04 173.91 3k4u h TYR 106 N 0.00 0.00 -0.45 0.66 -0.00 -2.00 -2.65 116.97 112.53 3k4u h TYR 106 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 58.73 58.59 3k4u h TYR 106 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 36.72 3k4u h TYR 106 CO 0.00 0.00 -0.26 -0.22 -0.00 0.00 0.00 178.16 177.68 3k4u h LYS 107 N 0.00 0.97 -0.82 0.10 3.64 -1.97 -0.63 116.57 117.85 3k4u h LYS 107 Ca 0.37 -0.44 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3k4u h LYS 107 Cb 1.80 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.59 3k4u h LYS 107 CO -0.00 1.10 0.00 -0.40 -2.27 0.00 0.00 179.45 177.88 3k4u n ASP 108 N -4.10 0.99 -0.24 4.20 5.68 -1.00 -2.41 116.55 119.67 3k4u n ASP 108 Ca -0.00 -1.42 0.06 0.00 -0.50 0.00 0.00 54.79 52.93 3k4u n ASP 108 Cb 0.48 -0.35 0.08 0.00 -1.14 0.00 0.00 41.12 40.19 3k4u n ASP 108 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3k4u n LEU 109 N 0.24 1.40 -4.32 -2.12 4.32 -0.24 -4.95 117.00 111.33 3k4u n LEU 109 Ca 0.00 -2.24 -0.45 0.00 -0.02 0.00 0.00 56.01 53.30 3k4u n LEU 109 Cb 0.21 -0.26 -0.01 0.00 -1.62 0.00 0.00 43.42 41.74 3k4u n LEU 109 CO 0.00 0.52 0.59 -0.62 -1.22 0.00 0.00 177.39 176.66 3k4u s ASP 110 N -2.12 6.97 -0.01 -1.43 2.15 -1.01 -4.89 116.67 116.33 3k4u s ASP 110 Ca 0.19 -3.20 0.01 0.00 0.43 0.00 0.00 52.55 49.98 3k4u s ASP 110 Cb 0.17 -2.19 -0.00 0.00 -0.30 0.00 0.00 42.92 40.60 3k4u s ASP 110 CO 0.02 -0.40 -0.04 -0.54 -0.17 0.00 0.00 175.17 174.03 3k4u s LYS 111 N -0.63 0.37 0.00 4.34 -0.14 -1.26 -4.60 119.74 117.82 3k4u s LYS 111 Ca 0.25 -0.15 0.05 0.00 -1.36 0.00 0.00 55.97 54.76 3k4u s LYS 111 Cb -0.10 -0.37 0.24 0.00 -1.68 0.00 0.00 37.83 35.92 3k4u s LYS 111 CO -0.08 0.08 1.05 -2.30 -0.76 0.00 0.00 175.35 173.34 3k4u n PRO 112 N 3.06 0.05 -0.09 -1.68 -0.02 -1.24 -2.15 135.00 132.92 3k4u n PRO 112 Ca -0.14 0.30 -0.22 0.00 -2.02 0.00 0.00 63.50 61.42 3k4u n PRO 112 Cb 0.58 -1.50 -0.12 0.00 -0.02 0.00 0.00 33.50 32.44 3k4u n PRO 112 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3k4u h GLU 113 N 0.00 0.03 -7.03 -0.52 3.07 -1.97 -3.40 114.58 104.76 3k4u h GLU 113 Ca 0.00 -0.05 -0.54 0.00 -0.50 0.00 0.00 59.36 58.28 3k4u h GLU 113 Cb 0.06 0.02 0.11 0.00 -0.84 0.00 0.00 28.75 28.10 3k4u h GLU 113 CO 0.00 1.02 0.57 -0.51 -1.40 0.00 0.00 179.01 178.69 3k4u s LEU 114 N -7.79 3.91 -0.19 1.33 1.43 -0.91 -4.78 118.68 111.68 3k4u s LEU 114 Ca -0.28 2.62 0.01 0.00 -1.03 0.00 0.00 54.13 55.45 3k4u s LEU 114 Cb 0.06 -4.25 0.03 0.00 0.03 0.00 0.00 46.19 42.07 3k4u s LEU 114 CO 0.61 -1.34 -0.14 -0.89 0.23 0.00 0.00 176.35 174.82 3k4u s THR 115 N -1.38 1.85 0.03 5.49 2.01 -1.24 -2.01 115.64 120.39 3k4u s THR 115 Ca 0.68 -1.03 -0.14 0.00 0.31 0.00 0.00 61.69 61.52 3k4u s THR 115 Cb -0.37 -1.81 -0.06 0.00 0.01 0.00 0.00 72.50 70.27 3k4u s THR 115 CO 0.44 0.31 0.43 -0.22 -0.69 0.00 0.00 174.62 174.89 3k4u s LEU 116 N 1.33 4.45 0.07 4.42 2.96 0.08 -4.13 118.68 127.86 3k4u s LEU 116 Ca 0.01 0.97 0.04 0.00 -0.22 0.00 0.00 54.13 54.93 3k4u s LEU 116 Cb -0.15 -2.73 -0.03 0.00 0.50 0.00 0.00 46.19 43.77 3k4u s LEU 116 CO -0.10 0.28 -0.12 0.68 -1.32 0.00 0.00 176.35 175.77 3k4u s VAL 117 N -1.17 0.99 0.32 1.68 -7.23 -1.26 -1.78 120.40 111.95 3k4u s VAL 117 Ca 0.27 -1.35 -0.12 0.00 -1.81 0.00 0.00 61.98 58.98 3k4u s VAL 117 Cb -0.16 -1.06 0.02 0.00 0.56 0.00 0.00 36.38 35.73 3k4u s VAL 117 CO 0.15 -0.32 0.59 0.28 -0.31 0.00 0.00 175.10 175.49 3k4u s THR 118 N -1.54 0.00 0.29 5.32 -1.32 -0.92 -2.29 115.64 115.18 3k4u s THR 118 Ca -0.02 -1.30 -0.28 0.00 -1.21 0.00 0.00 61.69 58.88 3k4u s THR 118 Cb -0.08 -2.49 -0.09 0.00 -1.51 0.00 0.00 72.50 68.33 3k4u s THR 118 CO 0.02 0.00 0.99 -0.75 -2.21 0.00 0.00 174.62 172.66 3k4u s LYS 119 N -3.27 4.65 0.24 7.08 2.20 -1.26 -0.56 119.74 128.82 3k4u s LYS 119 Ca 0.21 1.51 -0.30 0.00 -0.36 0.00 0.00 55.97 57.04 3k4u s LYS 119 Cb -0.02 -3.03 -0.09 0.00 -1.51 0.00 0.00 37.83 33.18 3k4u s LYS 119 CO 0.13 0.31 1.05 0.12 -0.36 0.00 0.00 175.35 176.60 3k4u s PHE 120 N -1.37 3.70 -0.32 4.03 5.36 0.12 -4.21 117.98 125.29 3k4u s PHE 120 Ca 0.46 1.74 -0.01 0.00 -0.96 0.00 0.00 56.93 58.16 3k4u s PHE 120 Cb -0.24 -3.20 0.00 0.00 -0.34 0.00 0.00 43.02 39.24 3k4u s PHE 120 CO 0.31 -0.27 0.15 0.41 -1.46 0.00 0.00 175.22 174.35 3k4u n GLY 121 N 1.48 0.46 3.30 13.12 0.00 -1.26 -4.96 105.19 117.33 3k4u n GLY 121 Ca -0.00 -0.57 -0.16 0.00 0.00 0.00 0.00 46.02 45.29 3k4u n GLY 121 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k4u s VAL 122 N -2.73 0.90 0.34 1.61 1.01 -1.26 -4.94 120.40 115.33 3k4u s VAL 122 Ca 0.07 -2.02 0.06 0.00 0.00 0.00 0.00 61.98 60.10 3k4u s VAL 122 Cb -0.03 -2.28 0.31 0.00 0.00 0.00 0.00 36.38 34.37 3k4u s VAL 122 CO 0.09 -0.36 1.88 0.77 0.00 0.00 0.00 175.10 177.48 3k4u h SER 123 N 2.54 0.73 -0.89 3.32 4.64 -1.96 -0.80 113.55 121.13 3k4u h SER 123 Ca -0.38 0.03 0.13 0.00 -0.47 0.00 0.00 61.79 61.11 3k4u h SER 123 Cb 1.22 -0.11 -0.09 0.00 -0.31 0.00 0.00 62.40 63.11 3k4u h SER 123 CO 0.64 0.40 0.51 0.00 -0.87 0.00 0.00 176.83 177.50 3k4u h ALA 124 N 1.58 1.34 -0.47 5.18 0.00 -1.90 -1.36 119.26 123.62 3k4u h ALA 124 Ca 0.44 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.37 3k4u h ALA 124 Cb 0.57 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3k4u h ALA 124 CO -0.20 0.03 0.14 1.49 0.00 0.00 0.00 179.25 180.72 3k4u h GLU 125 N 0.76 0.69 0.04 0.00 4.81 -1.35 -1.60 114.58 117.93 3k4u h GLU 125 Ca 0.46 -0.12 -0.22 0.00 -0.13 0.00 0.00 59.36 59.36 3k4u h GLU 125 Cb 0.56 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 3k4u h GLU 125 CO -0.31 0.61 -1.01 1.88 -0.73 0.00 0.00 179.01 179.45 3k4u h TYR 126 N 0.68 0.28 -0.34 0.92 0.05 -1.22 -2.80 116.97 114.53 3k4u h TYR 126 Ca 0.16 -0.18 -0.17 0.00 0.05 0.00 0.00 58.73 58.59 3k4u h TYR 126 Cb 0.21 -0.02 -0.00 0.00 1.01 0.00 0.00 36.73 37.93 3k4u h TYR 126 CO 0.01 1.07 -0.45 0.00 -1.05 0.00 0.00 178.16 177.74 3k4u h ALA 127 N 0.87 0.55 -0.52 3.88 0.00 -1.40 -2.44 119.26 120.20 3k4u h ALA 127 Ca -0.06 -0.48 0.10 0.00 0.00 0.00 0.00 54.91 54.47 3k4u h ALA 127 Cb 1.70 -0.10 -0.11 0.00 0.00 0.00 0.00 17.79 19.28 3k4u h ALA 127 CO 0.15 0.68 -0.26 0.00 0.00 0.00 0.00 179.25 179.82 3k4u h ALA 128 N 0.76 0.08 -0.09 0.00 0.00 -1.16 -0.58 119.26 118.26 3k4u h ALA 128 Ca 0.04 0.17 -0.10 0.00 0.00 0.00 0.00 54.91 55.02 3k4u h ALA 128 Cb 1.04 0.62 -0.01 0.00 0.00 0.00 0.00 17.79 19.45 3k4u h ALA 128 CO 0.10 -0.60 -0.40 0.87 0.00 0.00 0.00 179.25 179.23 3k4u h LYS 129 N -0.14 0.20 -0.10 0.00 1.57 -1.46 -1.92 116.57 114.72 3k4u h LYS 129 Ca 0.23 -0.09 -0.18 0.00 -1.87 0.00 0.00 60.65 58.74 3k4u h LYS 129 Cb 0.51 -0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.82 3k4u h LYS 129 CO -0.60 0.57 -0.63 -0.09 -0.57 0.00 0.00 179.45 178.13 3k4u h ARG 130 N 0.17 0.61 0.00 3.15 2.43 -0.90 -3.39 114.38 116.45 3k4u h ARG 130 Ca 0.02 -0.52 -0.20 0.00 -0.81 0.00 0.00 59.98 58.47 3k4u h ARG 130 Cb 0.79 0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 30.42 3k4u h ARG 130 CO 0.06 1.14 -1.07 -0.07 -1.51 0.00 0.00 179.97 178.52 3k4u h LEU 131 N 0.25 0.00 -8.65 3.80 4.07 -1.19 -3.46 115.31 110.13 3k4u h LEU 131 Ca -0.05 -0.57 -0.65 0.00 0.08 0.00 0.00 57.88 56.68 3k4u h LEU 131 Cb 1.28 0.00 -0.15 0.00 1.08 0.00 0.00 40.66 42.87 3k4u h LEU 131 CO 0.13 1.41 0.05 -0.36 -1.08 0.00 0.00 178.44 178.59 3k4u s PHE 132 N -2.34 3.12 -0.15 1.13 0.40 -0.72 -4.94 117.98 114.47 3k4u s PHE 132 Ca -0.27 0.03 -0.21 0.00 -0.60 0.00 0.00 56.93 55.88 3k4u s PHE 132 Cb 0.05 -3.17 -0.24 0.00 0.51 0.00 0.00 43.02 40.17 3k4u s PHE 132 CO 0.60 -0.74 0.46 0.87 0.70 0.00 0.00 175.22 177.11 3k4u h LYS 133 N 8.70 0.10 0.00 0.44 1.79 -1.84 -3.42 116.57 122.33 3k4u h LYS 133 Ca -0.26 -0.17 -0.25 0.00 -2.18 0.00 0.00 60.65 57.79 3k4u h LYS 133 Cb 1.11 0.06 -0.05 0.00 -1.58 0.00 0.00 32.23 31.77 3k4u h LYS 133 CO 0.85 1.08 -1.93 0.09 -1.08 0.00 0.00 179.45 178.46 3k4u n ASN 134 N -4.25 0.43 -4.70 0.86 3.02 -1.26 -4.91 115.26 104.45 3k4u n ASN 134 Ca -0.25 0.20 -0.42 0.00 -0.03 0.00 0.00 54.58 54.07 3k4u n ASN 134 Cb 0.73 0.66 -0.03 0.00 -0.61 0.00 0.00 39.78 40.53 3k4u n ASN 134 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3k4u s ALA 135 N -2.76 3.60 0.19 5.41 0.00 -1.25 -3.69 121.76 123.26 3k4u s ALA 135 Ca -0.07 1.01 -0.32 0.00 0.00 0.00 0.00 51.96 52.58 3k4u s ALA 135 Cb 0.08 -3.59 -0.15 0.00 0.00 0.00 0.00 23.12 19.46 3k4u s ALA 135 CO 0.83 -0.84 1.30 1.63 0.00 0.00 0.00 175.76 178.68 3k4u n LYS 136 N 4.92 1.57 -4.90 0.00 5.02 -0.85 -4.81 118.16 119.11 3k4u n LYS 136 Ca 0.13 0.56 -0.27 0.00 -2.02 0.00 0.00 58.31 56.71 3k4u n LYS 136 Cb 0.43 -2.15 -0.16 0.00 -0.02 0.00 0.00 35.03 33.13 3k4u n LYS 136 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 3k4u s LEU 137 N 0.43 1.93 0.10 -0.35 2.96 -1.26 -0.75 118.68 121.74 3k4u s LEU 137 Ca 0.72 -0.39 0.07 0.00 -0.22 0.00 0.00 54.13 54.31 3k4u s LEU 137 Cb -0.76 -1.05 -0.03 0.00 0.50 0.00 0.00 46.19 44.84 3k4u s LEU 137 CO 0.50 0.16 -0.18 -0.54 -1.32 0.00 0.00 176.35 174.96 3k4u s LYS 138 N 0.09 1.03 0.03 1.98 1.02 -0.73 -4.99 119.74 118.17 3k4u s LYS 138 Ca -0.06 -1.12 0.06 0.00 0.02 0.00 0.00 55.97 54.87 3k4u s LYS 138 Cb -0.13 -1.18 -0.02 0.00 -0.52 0.00 0.00 37.83 35.98 3k4u s LYS 138 CO 0.03 0.27 -0.18 0.95 -0.92 0.00 0.00 175.35 175.49 3k4u s THR 139 N -1.32 1.46 0.26 2.17 -4.23 -1.26 -2.17 115.64 110.55 3k4u s THR 139 Ca 0.05 -1.07 0.05 0.00 -1.18 0.00 0.00 61.69 59.53 3k4u s THR 139 Cb -0.09 -1.28 -0.06 0.00 1.34 0.00 0.00 72.50 72.41 3k4u s THR 139 CO 0.04 0.18 -0.01 -0.31 -0.54 0.00 0.00 174.62 173.97 3k4u s TYR 140 N -0.75 1.76 0.32 3.99 2.02 0.27 -4.78 117.35 120.18 3k4u s TYR 140 Ca 0.06 -0.85 0.05 0.00 -0.37 0.00 0.00 57.07 55.96 3k4u s TYR 140 Cb -0.08 -1.04 0.54 0.00 -0.40 0.00 0.00 41.96 40.98 3k4u s TYR 140 CO 0.01 0.08 1.79 -0.44 -1.57 0.00 0.00 175.55 175.42 3k4u h ASP 141 N 2.35 0.38 -2.62 2.29 3.32 -1.93 0.35 116.42 120.56 3k4u h ASP 141 Ca -0.39 -0.11 -0.54 0.00 0.02 0.00 0.00 57.03 56.01 3k4u h ASP 141 Cb 1.23 -0.10 -0.13 0.00 0.22 0.00 0.00 39.33 40.54 3k4u h ASP 141 CO 0.66 0.60 -0.58 0.42 -1.72 0.00 0.00 179.24 178.62 3k4u s THR 142 N -4.57 1.26 0.12 0.35 -4.23 -1.26 -4.69 115.64 102.63 3k4u s THR 142 Ca -0.06 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 58.33 3k4u s THR 142 Cb 0.14 -2.71 -0.11 0.00 1.34 0.00 0.00 72.50 71.17 3k4u s THR 142 CO 0.77 0.00 1.38 -0.33 -0.54 0.00 0.00 174.62 175.90 3k4u h GLU 143 N 1.92 0.87 0.18 3.99 3.07 -1.93 -3.13 114.58 119.55 3k4u h GLU 143 Ca -0.41 -0.59 -0.01 0.00 -0.50 0.00 0.00 59.36 57.86 3k4u h GLU 143 Cb 1.25 0.08 0.00 0.00 -0.84 0.00 0.00 28.75 29.25 3k4u h GLU 143 CO 0.70 1.21 -0.09 0.00 -1.40 0.00 0.00 179.01 179.44 3k4u h ALA 144 N 0.65 -0.25 -1.05 3.43 0.00 -1.95 -2.12 119.26 117.97 3k4u h ALA 144 Ca -0.00 -0.14 0.28 0.00 0.00 0.00 0.00 54.91 55.05 3k4u h ALA 144 Cb 1.22 0.10 -0.11 0.00 0.00 0.00 0.00 17.79 18.99 3k4u h ALA 144 CO 0.13 -0.53 0.66 0.93 0.00 0.00 0.00 179.25 180.44 3k4u h GLU 145 N -0.46 0.40 0.05 0.00 5.08 -1.97 -0.14 114.58 117.53 3k4u h GLU 145 Ca -0.03 -0.02 -0.15 0.00 -1.00 0.00 0.00 59.36 58.16 3k4u h GLU 145 Cb 0.35 -0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.53 3k4u h GLU 145 CO 0.04 0.26 -0.63 0.00 -1.00 0.00 0.00 179.01 177.69 3k4u h ALA 146 N 1.66 0.01 0.00 3.43 0.00 -1.45 -3.18 119.26 119.74 3k4u h ALA 146 Ca 0.63 -0.60 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 3k4u h ALA 146 Cb 1.54 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.38 3k4u h ALA 146 CO -0.37 0.32 -0.35 -0.39 0.00 0.00 0.00 179.25 178.46 3k4u h VAL 147 N -0.26 0.99 -0.14 0.00 -1.51 -1.00 -3.14 116.25 111.18 3k4u h VAL 147 Ca -0.09 -1.35 0.04 0.00 -1.23 0.00 0.00 66.70 64.07 3k4u h VAL 147 Cb 1.39 1.79 -0.04 0.00 -2.13 0.00 0.00 31.29 32.30 3k4u h VAL 147 CO 0.12 0.35 -0.11 -0.61 -1.23 0.00 0.00 177.57 176.09 3k4u h GLN 148 N 0.00 -0.11 -0.82 5.19 -0.00 -1.01 0.16 115.11 118.52 3k4u h GLN 148 Ca -0.00 0.01 0.03 0.00 -0.00 0.00 0.00 58.65 58.68 3k4u h GLN 148 Cb 0.76 0.03 -0.05 0.00 0.00 0.00 0.00 27.48 28.22 3k4u h GLN 148 CO 0.05 -0.08 0.52 0.93 0.00 0.00 0.00 178.83 180.25 3k4u h GLU 149 N -0.12 0.99 -0.60 1.69 3.07 -1.53 0.31 114.58 118.39 3k4u h GLU 149 Ca 0.09 -0.06 -0.05 0.00 -0.50 0.00 0.00 59.36 58.84 3k4u h GLU 149 Cb 0.25 -0.22 -0.03 0.00 -0.84 0.00 0.00 28.75 27.91 3k4u h GLU 149 CO -0.21 0.66 0.18 -0.24 -1.40 0.00 0.00 179.01 177.99 3k4u h VAL 150 N 1.02 1.25 -0.48 3.13 3.04 -1.35 -2.62 116.25 120.24 3k4u h VAL 150 Ca 0.32 -0.85 -0.04 0.00 -1.01 0.00 0.00 66.70 65.12 3k4u h VAL 150 Cb -0.00 0.66 -0.02 0.00 -2.01 0.00 0.00 31.29 29.92 3k4u h VAL 150 CO -0.11 0.32 0.14 -0.07 -1.01 0.00 0.00 177.57 176.84 3k4u h LEU 151 N 0.86 0.71-10.52 3.16 3.38 0.16 -3.40 115.31 109.66 3k4u h LEU 151 Ca 0.19 -0.21 -0.45 0.00 0.09 0.00 0.00 57.88 57.50 3k4u h LEU 151 Cb 0.31 -0.19 0.15 0.00 0.09 0.00 0.00 40.66 41.02 3k4u h LEU 151 CO -0.00 0.74 0.29 0.54 0.09 0.00 0.00 178.44 180.09 3k4u s ASN 152 N -6.07 2.97 0.00 -0.43 4.22 0.84 -4.97 114.94 111.49 3k4u s ASN 152 Ca -0.13 0.80 0.27 0.00 -2.14 0.00 0.00 52.86 51.66 3k4u s ASN 152 Cb 0.11 -1.24 0.75 0.00 1.28 0.00 0.00 41.25 42.15 3k4u s ASN 152 CO 0.78 -2.87 1.57 0.61 -2.04 0.00 0.00 177.10 175.15 3k4u n GLY 153 N -2.20 0.15 0.28 0.45 0.00 -1.24 -4.65 105.19 97.99 3k4u n GLY 153 Ca 0.09 -0.51 -0.06 0.00 0.00 0.00 0.00 46.02 45.54 3k4u n GLY 153 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3k4u h LYS 154 N 2.76 0.96 0.00 1.61 1.57 -1.78 -3.39 116.57 118.30 3k4u h LYS 154 Ca 0.00 -0.12 -0.42 0.00 -1.87 0.00 0.00 60.65 58.24 3k4u h LYS 154 Cb 0.63 -0.18 -0.06 0.00 0.08 0.00 0.00 32.23 32.70 3k4u h LYS 154 CO 0.00 0.74 -2.39 0.00 -0.57 0.00 0.00 179.45 177.22 3k4u n ALA 155 N -2.35 1.39 -0.37 3.86 0.00 -1.11 -5.00 120.51 116.93 3k4u n ALA 155 Ca 0.05 -0.99 0.00 0.00 0.00 0.00 0.00 53.44 52.50 3k4u n ALA 155 Cb 0.11 0.18 0.00 0.00 0.00 0.00 0.00 19.45 19.73 3k4u n ALA 155 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3k4u n ASP 156 N -4.11 -0.25 -3.64 0.00 5.68 -1.26 -3.70 116.55 109.27 3k4u n ASP 156 Ca -0.49 0.00 -0.10 0.00 -0.50 0.00 0.00 54.79 53.70 3k4u n ASP 156 Cb 0.85 -0.10 -0.07 0.00 -1.14 0.00 0.00 41.12 40.66 3k4u n ASP 156 CO 0.00 0.00 0.00 0.12 -1.33 0.00 0.00 177.20 175.99 3k4u s PHE 158 N -2.00 -0.93 -0.10 2.11 5.36 0.30 -3.57 117.98 119.15 3k4u s PHE 158 Ca 0.00 2.00 0.04 0.00 -0.96 0.00 0.00 56.93 58.01 3k4u s PHE 158 Cb 0.00 0.48 0.00 0.00 -0.34 0.00 0.00 43.02 43.16 3k4u s PHE 158 CO 0.00 -0.46 -0.24 -1.50 -1.46 0.00 0.00 175.22 171.57 3k4u s ILE 159 N 1.11 2.03 0.12 3.12 2.07 -0.97 -1.49 121.20 127.19 3k4u s ILE 159 Ca -0.06 -1.00 -0.26 0.00 -1.41 0.00 0.00 60.65 57.92 3k4u s ILE 159 Cb -0.05 -1.76 0.07 0.00 0.13 0.00 0.00 42.46 40.86 3k4u s ILE 159 CO -0.11 0.55 1.01 0.12 -1.91 0.00 0.00 174.94 174.60 3k4u s PHE 160 N 0.35 -0.12 0.38 3.50 5.36 -1.03 -4.72 117.98 121.70 3k4u s PHE 160 Ca -0.19 -0.14 -0.26 0.00 -0.96 0.00 0.00 56.93 55.38 3k4u s PHE 160 Cb -0.18 0.62 -0.11 0.00 -0.34 0.00 0.00 43.02 43.01 3k4u s PHE 160 CO 0.09 -0.73 1.19 -0.25 -1.46 0.00 0.00 175.22 174.06 3k4u n ASP 161 N -0.46 2.21 -0.26 6.13 10.43 -1.26 -1.99 116.55 131.34 3k4u n ASP 161 Ca -0.06 1.13 -0.00 0.00 2.57 0.00 0.00 54.79 58.42 3k4u n ASP 161 Cb 0.61 -1.44 0.12 0.00 1.84 0.00 0.00 41.12 42.25 3k4u n ASP 161 CO 0.00 0.00 0.00 0.25 -1.07 0.00 0.00 177.20 176.38 3k4u h LEU 162 N 2.10 0.64 -2.06 0.64 6.46 -0.98 -2.29 115.31 119.83 3k4u h LEU 162 Ca -0.46 0.03 0.09 0.00 -0.12 0.00 0.00 57.88 57.42 3k4u h LEU 162 Cb 1.31 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 41.12 3k4u h LEU 162 CO 0.60 0.41 0.24 -0.65 -0.62 0.00 0.00 178.44 178.42 3k4u h PRO 163 N 0.78 0.00 -0.08 5.25 0.11 -1.88 0.17 132.00 136.34 3k4u h PRO 163 Ca 0.34 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.37 3k4u h PRO 163 Cb 0.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.33 3k4u h PRO 163 CO -0.19 0.00 -0.25 0.35 -0.21 0.00 0.00 178.00 177.70 3k4u h PHE 164 N 0.00 0.41 -0.24 0.65 3.57 -1.38 -2.16 116.94 117.78 3k4u h PHE 164 Ca 0.14 -0.17 -0.06 0.00 3.53 0.00 0.00 57.97 61.42 3k4u h PHE 164 Cb 0.62 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.28 3k4u h PHE 164 CO 0.00 0.87 -0.10 -0.91 -2.23 0.00 0.00 178.31 175.94 3k4u h ASN 165 N -0.17 0.37 0.20 0.41 -0.26 -0.66 0.45 115.58 115.91 3k4u h ASN 165 Ca -0.01 -0.08 -0.21 0.00 -0.56 0.00 0.00 56.30 55.44 3k4u h ASN 165 Cb 0.88 -0.10 0.00 0.00 -1.06 0.00 0.00 38.32 38.04 3k4u h ASN 165 CO 0.05 0.51 -0.82 -0.37 -1.06 0.00 0.00 177.43 175.75 3k4u h VAL 166 N 0.37 1.36 -0.15 2.81 -1.51 -1.30 -3.33 116.25 114.49 3k4u h VAL 166 Ca 0.07 -2.21 -0.05 0.00 -1.23 0.00 0.00 66.70 63.29 3k4u h VAL 166 Cb 0.40 2.19 -0.00 0.00 -2.13 0.00 0.00 31.29 31.75 3k4u h VAL 166 CO 0.02 0.67 -0.09 0.00 -1.23 0.00 0.00 177.57 176.94 3k4u h ALA 167 N 0.78 0.22 0.00 5.19 0.00 -0.44 -0.95 119.26 124.06 3k4u h ALA 167 Ca -0.05 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3k4u h ALA 167 Cb 1.42 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.16 3k4u h ALA 167 CO 0.15 0.04 0.00 0.34 0.00 0.00 0.00 179.25 179.78 3k4u n PHE 168 N -4.61 0.00 0.00 0.00 7.35 0.14 -2.13 117.46 118.21 3k4u n PHE 168 Ca -0.06 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.63 3k4u n PHE 168 Cb 0.32 -0.05 0.00 0.00 0.35 0.00 0.00 39.48 40.09 3k4u n PHE 168 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3k4u n ALA 170 N 0.74 0.00 -0.03 3.13 0.00 -0.36 -0.58 120.51 123.41 3k4u n ALA 170 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 3k4u n ALA 170 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 3k4u n ALA 170 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 3k4u h GLN 171 N 0.00 0.00 0.00 0.00 3.07 -1.70 -3.46 115.11 113.01 3k4u h GLN 171 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3k4u h GLN 171 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.56 3k4u h GLN 171 CO 0.00 0.00 -0.98 1.63 0.09 0.00 0.00 178.83 179.57 3k4u n LYS 172 N -3.44 1.81 0.00 0.06 5.02 0.26 -4.77 118.16 117.09 3k4u n LYS 172 Ca -0.03 -0.04 0.13 0.00 -2.02 0.00 0.00 58.31 56.34 3k4u n LYS 172 Cb 0.11 -1.06 0.37 0.00 -0.02 0.00 0.00 35.03 34.43 3k4u n LYS 172 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3k4u n GLY 173 N 1.74 -0.46 0.24 0.72 0.00 -0.87 -4.70 105.19 101.87 3k4u n GLY 173 Ca -0.00 -0.43 -0.07 0.00 0.00 0.00 0.00 46.02 45.51 3k4u n GLY 173 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3k4u h GLN 174 N 1.50 0.79 -0.04 1.61 7.50 -1.86 -2.46 115.11 122.15 3k4u h GLN 174 Ca 0.00 -0.11 -0.03 0.00 0.50 0.00 0.00 58.65 59.01 3k4u h GLN 174 Cb 0.53 -0.14 0.00 0.00 0.05 0.00 0.00 27.48 27.92 3k4u h GLN 174 CO 0.00 0.64 -0.09 0.78 -1.50 0.00 0.00 178.83 178.66 3k4u h GLY 175 N 0.74 0.15 1.29 3.46 0.00 -1.98 -3.41 103.07 103.31 3k4u h GLY 175 Ca 0.19 -0.17 -0.04 0.00 0.00 0.00 0.00 47.33 47.30 3k4u h GLY 175 CO -0.03 0.16 0.21 -0.97 0.00 0.00 0.00 176.54 175.91 3k4u h TYR 176 N -0.39 0.92 -3.02 5.60 0.05 -1.79 -3.48 116.97 114.87 3k4u h TYR 176 Ca 0.00 -0.07 -0.43 0.00 0.05 0.00 0.00 58.73 58.28 3k4u h TYR 176 Cb 0.67 -0.28 -0.14 0.00 1.01 0.00 0.00 36.73 37.99 3k4u h TYR 176 CO 0.12 0.73 -0.65 -0.51 -1.05 0.00 0.00 178.16 176.81 3k4u s LEU 177 N -9.47 2.24 -0.07 3.88 1.02 -0.95 -4.16 118.68 111.18 3k4u s LEU 177 Ca -0.10 -1.26 0.04 0.00 0.02 0.00 0.00 54.13 52.82 3k4u s LEU 177 Cb 0.16 -0.39 -0.02 0.00 0.02 0.00 0.00 46.19 45.97 3k4u s LEU 177 CO 0.80 -0.51 -0.19 -0.69 0.02 0.00 0.00 176.35 175.78 3k4u s VAL 178 N -3.29 2.55 -0.37 -1.59 1.01 0.32 -4.81 120.40 114.22 3k4u s VAL 178 Ca 0.31 -0.88 -0.10 0.00 0.00 0.00 0.00 61.98 61.31 3k4u s VAL 178 Cb 0.06 -1.99 0.03 0.00 0.00 0.00 0.00 36.38 34.48 3k4u s VAL 178 CO 0.12 0.56 0.19 -2.28 0.00 0.00 0.00 175.10 173.69 3k4u s HIS 179 N -0.16 3.24 -0.79 5.22 2.46 -1.26 -0.92 115.29 123.08 3k4u s HIS 179 Ca -0.02 -0.98 -0.24 0.00 0.47 0.00 0.00 55.06 54.28 3k4u s HIS 179 Cb -0.14 -2.42 0.05 0.00 -0.13 0.00 0.00 32.58 29.95 3k4u s HIS 179 CO 0.04 -0.64 1.21 -0.51 -2.47 0.00 0.00 174.74 172.36 3k4u s LEU 180 N 1.54 3.75 0.47 8.88 1.43 -0.61 -4.87 118.68 129.27 3k4u s LEU 180 Ca 0.02 -0.95 0.13 0.00 -1.03 0.00 0.00 54.13 52.30 3k4u s LEU 180 Cb -0.19 -2.51 1.07 0.00 0.03 0.00 0.00 46.19 44.60 3k4u s LEU 180 CO 0.06 -1.59 2.08 -2.24 0.23 0.00 0.00 176.35 174.90 3k4u h ASP 181 N 9.74 0.16 -1.63 2.29 2.03 -1.95 -3.30 116.42 123.77 3k4u h ASP 181 Ca -0.15 -0.01 -0.64 0.00 -0.73 0.00 0.00 57.03 55.50 3k4u h ASP 181 Cb 1.05 -0.04 0.12 0.00 -0.83 0.00 0.00 39.33 39.62 3k4u h ASP 181 CO 1.27 0.16 -0.34 0.41 -1.03 0.00 0.00 179.24 179.71 3k4u n THR 182 N -4.47 1.90 -3.15 1.15 -1.04 -1.26 -4.84 114.28 102.56 3k4u n THR 182 Ca -0.01 -0.50 -0.41 0.00 -2.04 0.00 0.00 64.05 61.09 3k4u n THR 182 Cb 0.11 -0.37 -0.07 0.00 -1.82 0.00 0.00 70.33 68.19 3k4u n THR 182 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 3k4u s SER 183 N -0.86 6.47 0.17 8.00 0.15 -1.26 -4.43 113.70 121.94 3k4u s SER 183 Ca 0.62 0.43 0.23 0.00 0.70 0.00 0.00 55.95 57.93 3k4u s SER 183 Cb -0.81 -2.31 0.05 0.00 -1.71 0.00 0.00 66.02 61.24 3k4u s SER 183 CO 0.58 -0.43 1.07 0.18 1.20 0.00 0.00 173.24 175.84 3k4u n LEU 184 N 5.78 0.78 0.00 3.45 4.77 0.11 -4.93 117.00 126.96 3k4u n LEU 184 Ca -0.02 0.27 -0.17 0.00 -0.03 0.00 0.00 56.01 56.06 3k4u n LEU 184 Cb 0.49 -0.08 -0.06 0.00 -2.33 0.00 0.00 43.42 41.44 3k4u n LEU 184 CO 0.44 -0.14 -0.03 0.35 -1.33 0.00 0.00 177.39 176.68 3k4u n THR 185 N -2.51 0.00 -3.93 -5.08 -2.24 -1.26 -4.89 114.28 94.36 3k4u n THR 185 Ca 0.01 -2.12 -0.35 0.00 -2.27 0.00 0.00 64.05 59.32 3k4u n THR 185 Cb 0.52 1.10 -0.14 0.00 -2.10 0.00 0.00 70.33 69.71 3k4u n THR 185 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3k4u s TYR 186 N -3.20 3.08 -0.38 4.78 5.04 -1.26 -4.50 117.35 120.90 3k4u s TYR 186 Ca 0.35 -1.48 0.01 0.00 -2.44 0.00 0.00 57.07 53.50 3k4u s TYR 186 Cb 0.01 -2.08 0.12 0.00 0.35 0.00 0.00 41.96 40.36 3k4u s TYR 186 CO 0.25 -0.71 0.18 -1.21 -1.34 0.00 0.00 175.55 172.72 3k4u s GLU 187 N 1.35 0.99 0.23 4.97 2.02 -0.91 -5.00 118.70 122.35 3k4u s GLU 187 Ca 0.00 -1.58 -0.30 0.00 0.02 0.00 0.00 54.97 53.11 3k4u s GLU 187 Cb -0.17 -2.09 -0.09 0.00 0.10 0.00 0.00 34.13 31.88 3k4u s GLU 187 CO -0.04 -1.10 0.96 -1.25 0.02 0.00 0.00 175.26 173.85 3k4u s PRO 188 N 0.90 4.81 -0.15 0.39 0.04 -1.26 -1.42 135.00 138.32 3k4u s PRO 188 Ca 0.15 1.52 -0.02 0.00 0.04 0.00 0.00 61.00 62.69 3k4u s PRO 188 Cb -0.22 -3.28 -0.02 0.00 0.04 0.00 0.00 34.50 31.02 3k4u s PRO 188 CO -0.09 0.45 -0.09 -0.51 0.04 0.00 0.00 177.00 176.80 3k4u s LEU 189 N -1.06 2.93 0.18 -3.56 1.02 -0.68 -0.77 118.68 116.75 3k4u s LEU 189 Ca 0.42 -0.26 0.02 0.00 0.02 0.00 0.00 54.13 54.33 3k4u s LEU 189 Cb -0.26 -1.69 -0.05 0.00 0.02 0.00 0.00 46.19 44.21 3k4u s LEU 189 CO 0.33 0.15 0.02 -0.83 0.02 0.00 0.00 176.35 176.04 3k4u s GLY 190 N 0.46 1.28 0.26 -3.19 0.00 -1.26 -0.19 107.32 104.69 3k4u s GLY 190 Ca -0.07 -1.62 -0.24 0.00 0.00 0.00 0.00 44.72 42.79 3k4u s GLY 190 CO 0.04 -1.53 0.84 -0.98 0.00 0.00 0.00 173.10 171.47 3k4u s TRP 191 N -3.70 3.71 -0.07 1.90 0.51 -1.26 -4.81 118.94 115.22 3k4u s TRP 191 Ca 0.26 1.62 0.04 0.00 -2.12 0.00 0.00 56.10 55.90 3k4u s TRP 191 Cb 0.06 -2.79 -0.01 0.00 -0.81 0.00 0.00 33.47 29.92 3k4u s TRP 191 CO 0.05 0.30 -0.20 0.00 -0.51 0.00 0.00 176.95 176.59 3k4u s ALA 192 N -1.51 2.36 0.13 0.98 0.00 -1.00 -0.89 121.76 121.82 3k4u s ALA 192 Ca 0.45 -1.00 0.05 0.00 0.00 0.00 0.00 51.96 51.47 3k4u s ALA 192 Cb -0.19 -0.86 -0.04 0.00 0.00 0.00 0.00 23.12 22.04 3k4u s ALA 192 CO 0.23 0.40 -0.11 0.96 0.00 0.00 0.00 175.76 177.24 3k4u s ILE 193 N -0.13 1.18 0.78 0.00 -4.36 0.36 -0.98 121.20 118.04 3k4u s ILE 193 Ca -0.03 -1.87 -0.11 0.00 -0.26 0.00 0.00 60.65 58.38 3k4u s ILE 193 Cb -0.14 -1.64 0.06 0.00 1.25 0.00 0.00 42.46 41.99 3k4u s ILE 193 CO 0.04 -0.61 1.11 -1.59 0.24 0.00 0.00 174.94 174.13 3k4u s LYS 194 N -3.21 2.12 0.97 0.37 -2.85 -1.26 -0.17 119.74 115.71 3k4u s LYS 194 Ca 0.12 1.27 -0.12 0.00 -1.00 0.00 0.00 55.97 56.24 3k4u s LYS 194 Cb -0.01 -1.87 0.17 0.00 -2.06 0.00 0.00 37.83 34.06 3k4u s LYS 194 CO 0.01 -1.76 1.09 0.15 0.10 0.00 0.00 175.35 174.94 3k4u s LYS 195 N -4.75 0.68 0.00 1.78 1.02 -1.26 -3.99 119.74 113.22 3k4u s LYS 195 Ca 0.63 0.69 0.00 0.00 0.02 0.00 0.00 55.97 57.31 3k4u s LYS 195 Cb -0.19 -1.75 0.00 0.00 -0.52 0.00 0.00 37.83 35.37 3k4u s LYS 195 CO 0.54 -2.61 0.00 0.41 -0.92 0.00 0.00 175.35 172.78 3k4u n GLY 196 N -0.93 0.84 2.99 -3.33 0.00 -1.26 -4.97 105.19 98.53 3k4u n GLY 196 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 3k4u n GLY 196 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3k4u s ASP 197 N -2.71 4.70 0.22 1.61 3.68 -1.26 -4.92 116.67 117.99 3k4u s ASP 197 Ca 0.00 -3.11 0.25 0.00 2.13 0.00 0.00 52.55 51.82 3k4u s ASP 197 Cb 0.00 -1.71 0.87 0.00 -1.45 0.00 0.00 42.92 40.63 3k4u s ASP 197 CO 0.00 -0.25 1.76 -0.81 0.13 0.00 0.00 175.17 176.01 3k4u n PRO 198 N 3.03 0.24 -0.03 4.34 -0.04 -1.26 -3.36 135.00 137.92 3k4u n PRO 198 Ca 0.08 0.26 -0.16 0.00 -0.04 0.00 0.00 63.50 63.65 3k4u n PRO 198 Cb 0.34 -1.81 -0.12 0.00 -0.04 0.00 0.00 33.50 31.86 3k4u n PRO 198 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3k4u h ASP 199 N 0.00 0.19 -0.75 3.54 3.32 -2.00 -2.11 116.42 118.62 3k4u h ASP 199 Ca 0.00 -0.87 0.04 0.00 0.02 0.00 0.00 57.03 56.22 3k4u h ASP 199 Cb 0.63 -0.06 -0.04 0.00 0.22 0.00 0.00 39.33 40.08 3k4u h ASP 199 CO 0.00 1.04 0.49 0.15 -1.72 0.00 0.00 179.24 179.21 3k4u h PHE 200 N -0.63 0.87 0.53 4.55 3.57 -1.99 -0.92 116.94 122.92 3k4u h PHE 200 Ca -0.04 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 3k4u h PHE 200 Cb 1.10 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 39.54 3k4u h PHE 200 CO 0.21 0.50 -0.45 -0.07 -2.23 0.00 0.00 178.31 176.27 3k4u h LEU 201 N 0.89 -1.19 -0.62 0.59 3.38 -1.59 0.12 115.31 116.89 3k4u h LEU 201 Ca 0.30 0.09 0.12 0.00 0.09 0.00 0.00 57.88 58.49 3k4u h LEU 201 Cb 0.09 0.38 -0.12 0.00 0.09 0.00 0.00 40.66 41.10 3k4u h LEU 201 CO -0.09 -0.63 -0.20 -1.13 0.09 0.00 0.00 178.44 176.48 3k4u h ASN 202 N -0.96 -0.71 -0.22 -0.43 -0.73 -0.69 0.61 115.58 112.45 3k4u h ASN 202 Ca -0.06 0.20 0.03 0.00 1.87 0.00 0.00 56.30 58.34 3k4u h ASN 202 Cb 0.82 0.43 -0.03 0.00 0.27 0.00 0.00 38.32 39.82 3k4u h ASN 202 CO -0.02 -0.23 0.04 -0.25 -0.37 0.00 0.00 177.43 176.60 3k4u h TRP 203 N -0.04 0.06 -0.32 0.67 7.01 -1.09 -2.34 115.95 119.90 3k4u h TRP 203 Ca 0.29 0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.29 3k4u h TRP 203 Cb 0.49 0.01 -0.01 0.00 -2.10 0.00 0.00 29.16 27.54 3k4u h TRP 203 CO -0.54 0.01 0.15 -0.07 -2.79 0.00 0.00 178.44 175.20 3k4u h LEU 204 N 0.12 0.43 -1.26 0.65 4.07 0.23 -1.02 115.31 118.53 3k4u h LEU 204 Ca 0.10 -0.14 0.05 0.00 0.08 0.00 0.00 57.88 57.97 3k4u h LEU 204 Cb 0.10 -0.11 -0.05 0.00 1.08 0.00 0.00 40.66 41.68 3k4u h LEU 204 CO -0.14 0.45 0.53 0.78 -1.08 0.00 0.00 178.44 178.98 3k4u h ASN 205 N 0.38 0.81 0.27 -0.43 2.35 0.04 -1.31 115.58 117.69 3k4u h ASN 205 Ca 0.11 -0.00 -0.23 0.00 -0.55 0.00 0.00 56.30 55.63 3k4u h ASN 205 Cb 0.14 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.34 3k4u h ASN 205 CO -0.01 0.53 -0.94 0.45 -1.65 0.00 0.00 177.43 175.81 3k4u h HIS 206 N 0.93 0.68 -0.41 1.19 3.86 -0.85 -2.87 115.15 117.69 3k4u h HIS 206 Ca 0.34 -0.36 0.04 0.00 -1.16 0.00 0.00 60.37 59.22 3k4u h HIS 206 Cb 0.15 -0.08 -0.04 0.00 1.06 0.00 0.00 27.41 28.50 3k4u h HIS 206 CO -0.00 1.18 0.17 0.35 0.86 0.00 0.00 177.93 180.49 3k4u h PHE 207 N 0.27 0.31 -0.53 2.45 3.57 -1.06 -1.35 116.94 120.60 3k4u h PHE 207 Ca -0.08 0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.51 3k4u h PHE 207 Cb 1.57 -0.08 -0.06 0.00 2.79 0.00 0.00 35.95 40.17 3k4u h PHE 207 CO 0.07 0.14 0.20 1.25 -2.23 0.00 0.00 178.31 177.74 3k4u h LEU 208 N 0.36 0.22 -0.58 0.59 5.85 -1.17 -2.35 115.31 118.23 3k4u h LEU 208 Ca 0.18 0.06 -0.09 0.00 0.84 0.00 0.00 57.88 58.87 3k4u h LEU 208 Cb 0.13 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 3k4u h LEU 208 CO -0.16 0.15 -0.43 0.00 -0.34 0.00 0.00 178.44 177.66 3k4u h ALA 209 N 1.35 0.86 0.65 1.25 0.00 -1.31 -2.49 119.26 119.56 3k4u h ALA 209 Ca 0.26 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 3k4u h ALA 209 Cb 0.27 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.00 3k4u h ALA 209 CO -0.25 0.53 -0.31 0.37 0.00 0.00 0.00 179.25 179.59 3k4u h GLN 210 N 0.00 -0.85 0.00 0.00 -0.00 -0.77 -2.59 115.11 110.90 3k4u h GLN 210 Ca -0.00 0.06 -0.01 0.00 -0.00 0.00 0.00 58.65 58.69 3k4u h GLN 210 Cb 1.09 0.19 -0.00 0.00 0.00 0.00 0.00 27.48 28.76 3k4u h GLN 210 CO 0.06 -0.53 -0.07 -0.84 0.00 0.00 0.00 178.83 177.44 3k4u h ILE 211 N -1.00 0.49 0.00 2.39 3.07 -1.40 0.16 117.51 121.23 3k4u h ILE 211 Ca -0.09 -0.33 0.00 0.00 1.55 0.00 0.00 64.86 65.99 3k4u h ILE 211 Cb 0.71 1.22 0.00 0.00 -0.27 0.00 0.00 36.82 38.47 3k4u h ILE 211 CO 0.15 0.07 0.00 0.11 -1.05 0.00 0.00 178.15 177.43 3k4u h LYS 212 N 0.00 0.00 0.00 0.16 1.79 -1.23 -1.33 116.57 115.96 3k4u h LYS 212 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3k4u h LYS 212 Cb 0.21 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.86 3k4u h LYS 212 CO 0.01 0.00 0.00 0.72 -1.08 0.00 0.00 179.45 179.10 3k4u n HIS 213 N -2.87 0.00 0.12 -1.35 8.25 -0.19 -4.60 115.22 114.57 3k4u n HIS 213 Ca 0.02 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.57 3k4u n HIS 213 Cb 0.34 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.47 3k4u n HIS 213 CO 0.00 0.00 0.00 0.22 0.64 0.00 0.00 176.34 177.20 3k4u h ASP 214 N 0.00 0.00 0.00 0.41 3.58 -0.68 -3.47 116.42 116.26 3k4u h ASP 214 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 3k4u h ASP 214 Cb 0.01 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.06 3k4u h ASP 214 CO 0.00 0.11 0.00 0.61 -2.88 0.00 0.00 179.24 177.08 3k4u n GLY 215 N 1.20 3.03 0.04 -0.78 0.00 -1.24 -4.93 105.19 102.51 3k4u n GLY 215 Ca -0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 3k4u n GLY 215 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3k4u h SER 216 N 0.00 -0.00 -0.18 1.61 0.02 -1.88 -1.37 113.55 111.74 3k4u h SER 216 Ca 0.00 -0.05 0.04 0.00 -0.84 0.00 0.00 61.79 60.94 3k4u h SER 216 Cb 0.00 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 62.47 3k4u h SER 216 CO 0.00 0.05 -0.48 0.22 -1.14 0.00 0.00 176.83 175.48 3k4u h TYR 217 N -0.06 -1.42 -0.69 3.45 3.20 -1.60 -2.42 116.97 117.44 3k4u h TYR 217 Ca -0.00 0.06 0.14 0.00 3.14 0.00 0.00 58.73 62.06 3k4u h TYR 217 Cb 0.06 0.64 -0.13 0.00 1.54 0.00 0.00 36.73 38.84 3k4u h TYR 217 CO -0.06 -0.51 -0.20 -0.44 -1.64 0.00 0.00 178.16 175.31 3k4u h ASP 218 N -0.51 -0.73 0.27 -2.11 3.45 -1.73 0.16 116.42 115.22 3k4u h ASP 218 Ca 0.07 0.21 0.01 0.00 0.43 0.00 0.00 57.03 57.75 3k4u h ASP 218 Cb 0.65 0.46 -0.03 0.00 -0.56 0.00 0.00 39.33 39.85 3k4u h ASP 218 CO -0.45 -0.24 -0.33 -0.33 -1.57 0.00 0.00 179.24 176.31 3k4u h GLU 219 N -0.02 -0.63 -0.86 3.56 5.08 -0.94 -1.08 114.58 119.68 3k4u h GLU 219 Ca 0.32 0.04 0.15 0.00 -1.00 0.00 0.00 59.36 58.87 3k4u h GLU 219 Cb 0.52 0.14 -0.07 0.00 0.50 0.00 0.00 28.75 29.85 3k4u h GLU 219 CO -0.72 -0.42 0.56 -0.07 -1.00 0.00 0.00 179.01 177.36 3k4u h LEU 220 N -0.65 0.59 -0.11 1.33 3.38 -0.90 -0.81 115.31 118.13 3k4u h LEU 220 Ca -0.00 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 3k4u h LEU 220 Cb 0.62 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 3k4u h LEU 220 CO -0.10 0.30 -0.00 0.22 0.09 0.00 0.00 178.44 178.94 3k4u h TYR 221 N 0.62 0.22 -0.01 1.13 3.20 0.08 -2.37 116.97 119.85 3k4u h TYR 221 Ca 0.43 -0.04 -0.00 0.00 3.14 0.00 0.00 58.73 62.26 3k4u h TYR 221 Cb 0.76 -0.06 -0.00 0.00 1.54 0.00 0.00 36.73 38.97 3k4u h TYR 221 CO -0.00 0.45 0.00 0.93 -1.64 0.00 0.00 178.16 177.91 3k4u h GLU 222 N -0.07 0.01 -0.51 1.82 4.39 -0.75 0.17 114.58 119.64 3k4u h GLU 222 Ca 0.03 -0.00 0.15 0.00 0.34 0.00 0.00 59.36 59.88 3k4u h GLU 222 Cb 0.37 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.00 3k4u h GLU 222 CO 0.01 0.14 0.57 -0.09 -1.16 0.00 0.00 179.01 178.47 3k4u h ARG 223 N -0.12 0.00 0.00 2.33 2.43 -1.10 0.57 114.38 118.49 3k4u h ARG 223 Ca 0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.17 3k4u h ARG 223 Cb 0.13 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.68 3k4u h ARG 223 CO -0.00 0.00 -1.07 0.91 -1.51 0.00 0.00 179.97 178.30 3k4u n TRP 224 N -3.62 0.00 0.22 2.20 7.02 -0.90 -4.51 117.44 117.85 3k4u n TRP 224 Ca 0.10 0.00 0.03 0.00 -1.02 0.00 0.00 57.50 56.61 3k4u n TRP 224 Cb 0.76 -0.04 -0.04 0.00 -2.42 0.00 0.00 31.31 29.57 3k4u n TRP 224 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 3k4u n PHE 225 N -1.71 0.00 0.07 -5.99 3.72 0.55 -4.82 117.46 109.28 3k4u n PHE 225 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 3k4u n PHE 225 Cb 0.20 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 38.70 3k4u n PHE 225 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 3k4u n VAL 226 N -1.28 0.46 -0.97 -4.37 0.31 -0.75 -5.02 118.33 106.71 3k4u n VAL 226 Ca 0.01 0.15 -0.36 0.00 -0.01 0.00 0.00 64.34 64.12 3k4u n VAL 226 Cb 0.11 -1.07 -0.04 0.00 -0.91 0.00 0.00 33.84 31.92 3k4u n VAL 226 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 3k4u n ASP 227 N -3.27 -0.32 -0.61 4.52 4.64 0.19 -4.86 116.55 116.85 3k4u n ASP 227 Ca 0.00 0.76 0.05 0.00 -1.38 0.00 0.00 54.79 54.23 3k4u n ASP 227 Cb 0.08 -0.62 0.14 0.00 -1.04 0.00 0.00 41.12 39.69 3k4u n ASP 227 CO 0.00 0.00 0.00 0.35 -0.82 0.00 0.00 177.20 176.73 3k4u n THR 228 N 0.62 0.99 0.21 5.18 -2.24 -1.26 -4.63 114.28 113.16 3k4u n THR 228 Ca 0.13 -1.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.01 3k4u n THR 228 Cb 0.10 0.51 0.34 0.00 -2.10 0.00 0.00 70.33 69.17 3k4u n THR 228 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 3k4u h LYS 229 N 1.93 0.00 -0.07 -0.78 3.64 -1.89 -3.32 116.57 116.07 3k4u h LYS 229 Ca 0.00 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.20 3k4u h LYS 229 Cb 0.72 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.53 3k4u h LYS 229 CO 0.00 0.22 -0.72 0.11 -2.27 0.00 0.00 179.45 176.79 3k4u h TRP 230 N 0.00 0.52 0.00 1.91 5.08 -1.84 -3.27 115.95 118.34 3k4u h TRP 230 Ca -0.00 -0.23 0.00 0.00 1.08 0.00 0.00 58.89 59.74 3k4u h TRP 230 Cb 0.91 -0.08 0.00 0.00 -3.00 0.00 0.00 29.16 26.99 3k4u h TRP 230 CO 0.00 0.98 0.11 1.28 -1.28 0.00 0.00 178.44 179.53 3k4u n LEU 231 N -3.83 0.00 -0.56 0.11 4.32 -1.25 0.12 117.00 115.92 3k4u n LEU 231 Ca -0.04 0.39 0.00 0.00 -0.02 0.00 0.00 56.01 56.34 3k4u n LEU 231 Cb 0.70 -0.39 0.00 0.00 -1.62 0.00 0.00 43.42 42.11 3k4u n LEU 231 CO 0.48 -0.39 0.24 -0.62 -1.22 0.00 0.00 177.39 175.87 3k4u n GLU 232 N -1.39 0.86 0.00 3.23 1.02 -1.24 -5.10 120.64 118.02 3k4u n GLU 232 Ca -0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 3k4u n GLU 232 Cb 0.11 -1.39 0.00 0.00 -0.02 0.00 0.00 31.44 30.14 3k4u n GLU 232 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94