#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k4p s ASP 9 N -2.29 5.04 0.41 0.00 2.15 -1.26 0.02 116.67 120.74 3k4p s ASP 9 Ca 0.18 -2.00 0.07 0.00 0.43 0.00 0.00 52.55 51.23 3k4p s ASP 9 Cb 0.17 -1.74 -0.07 0.00 -0.30 0.00 0.00 42.92 40.98 3k4p s ASP 9 CO 0.51 -0.46 0.08 0.42 -0.17 0.00 0.00 175.17 175.55 3k4p s THR 10 N 1.06 2.15 0.17 1.71 -4.23 -0.77 -4.98 115.64 110.75 3k4p s THR 10 Ca 0.08 -1.87 -0.10 0.00 -1.18 0.00 0.00 61.69 58.61 3k4p s THR 10 Cb -0.21 -2.99 0.03 0.00 1.34 0.00 0.00 72.50 70.67 3k4p s THR 10 CO -0.05 -0.01 1.59 0.58 -0.54 0.00 0.00 174.62 176.19 3k4p h VAL 11 N 1.63 1.27 0.24 2.29 2.07 -1.94 -2.57 116.25 119.24 3k4p h VAL 11 Ca -0.43 -1.27 -0.34 0.00 0.82 0.00 0.00 66.70 65.48 3k4p h VAL 11 Cb 1.25 0.99 0.03 0.00 -1.52 0.00 0.00 31.29 32.04 3k4p h VAL 11 CO 0.76 0.45 -1.52 -0.78 0.02 0.00 0.00 177.57 176.50 3k4p h ASP 12 N 0.89 0.80 0.00 0.57 1.82 -1.96 -3.37 116.42 115.16 3k4p h ASP 12 Ca 0.14 -0.89 0.00 0.00 -0.39 0.00 0.00 57.03 55.89 3k4p h ASP 12 Cb 0.68 -0.26 0.00 0.00 0.68 0.00 0.00 39.33 40.43 3k4p h ASP 12 CO 0.05 1.71 -0.84 0.00 -1.61 0.00 0.00 179.24 178.55 3k4p n GLN 13 N -3.69 1.45 0.00 0.28 1.13 -1.25 -4.76 117.38 110.55 3k4p n GLN 13 Ca -0.18 -0.01 0.00 0.00 -1.94 0.00 0.00 57.00 54.88 3k4p n GLN 13 Cb 1.10 -1.29 0.00 0.00 0.11 0.00 0.00 30.24 30.16 3k4p n GLN 13 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3k4p n GLY 14 N 1.40 0.21 3.34 1.08 0.00 -0.97 -0.83 105.19 109.43 3k4p n GLY 14 Ca 0.03 -1.25 -0.46 0.00 0.00 0.00 0.00 46.02 44.33 3k4p n GLY 14 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3k4p s TYR 15 N 0.00 3.48 -2.08 1.61 5.04 0.73 -1.84 117.35 124.28 3k4p s TYR 15 Ca 0.00 -1.64 0.22 0.00 -2.44 0.00 0.00 57.07 53.21 3k4p s TYR 15 Cb 0.00 -3.89 0.51 0.00 0.35 0.00 0.00 41.96 38.92 3k4p s TYR 15 CO 0.00 -1.09 1.44 1.04 -1.34 0.00 0.00 175.55 175.59 3k4p n GLN 16 N 4.85 2.59 -2.29 4.97 1.13 0.10 -4.70 117.38 124.03 3k4p n GLN 16 Ca 0.06 -2.42 -0.40 0.00 -1.94 0.00 0.00 57.00 52.30 3k4p n GLN 16 Cb 0.45 -1.51 -0.03 0.00 0.11 0.00 0.00 30.24 29.26 3k4p n GLN 16 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3k4p n PHE 18 N 0.97 -2.07 0.28 0.00 3.72 -1.26 -4.68 117.46 114.42 3k4p n PHE 18 Ca -0.00 0.64 0.13 0.00 -0.05 0.00 0.00 57.45 58.17 3k4p n PHE 18 Cb 0.43 -3.88 0.83 0.00 -0.94 0.00 0.00 39.48 35.92 3k4p n PHE 18 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3k4p h SER 19 N -1.54 0.00 1.04 4.37 4.64 -1.91 0.72 113.55 120.87 3k4p h SER 19 Ca -0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 3k4p h SER 19 Cb 1.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.43 3k4p h SER 19 CO 0.58 0.01 0.00 1.05 -0.87 0.00 0.00 176.83 177.60 3k4p h GLU 20 N 0.00 0.00 0.00 4.77 9.09 -1.93 -2.86 114.58 123.65 3k4p h GLU 20 Ca -0.00 0.00 -0.13 0.00 0.05 0.00 0.00 59.36 59.28 3k4p h GLU 20 Cb 0.02 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.10 3k4p h GLU 20 CO 0.00 0.00 -1.21 2.41 0.05 0.00 0.00 179.01 180.26 3k4p n THR 21 N -2.91 1.08 0.29 -1.06 -1.04 -0.41 -4.77 114.28 105.45 3k4p n THR 21 Ca 0.01 0.02 0.15 0.00 -2.04 0.00 0.00 64.05 62.19 3k4p n THR 21 Cb 0.31 -1.84 0.88 0.00 -1.82 0.00 0.00 70.33 67.86 3k4p n THR 21 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 3k4p h SER 22 N -0.53 0.00 1.09 8.00 4.64 -1.00 -1.15 113.55 124.61 3k4p h SER 22 Ca -0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 3k4p h SER 22 Cb 0.95 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 3k4p h SER 22 CO -0.12 0.03 -0.07 1.41 -0.87 0.00 0.00 176.83 177.21 3k4p n HIS 23 N -3.75 0.30 -1.23 4.77 8.25 -1.08 -3.70 115.22 118.79 3k4p n HIS 23 Ca -0.03 0.09 -0.08 0.00 -0.26 0.00 0.00 57.72 57.44 3k4p n HIS 23 Cb 0.12 -0.62 0.23 0.00 1.12 0.00 0.00 29.99 30.84 3k4p n HIS 23 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3k4p n LEU 24 N -1.76 5.29 -1.31 2.41 4.77 -0.43 -4.35 117.00 121.62 3k4p n LEU 24 Ca 0.06 -3.49 0.08 0.00 -0.03 0.00 0.00 56.01 52.64 3k4p n LEU 24 Cb 0.37 -0.71 0.29 0.00 -2.33 0.00 0.00 43.42 41.04 3k4p n LEU 24 CO 0.29 1.01 0.74 0.79 -1.33 0.00 0.00 177.39 178.88 3k4p n TRP 25 N -0.80 1.14 0.00 -1.77 8.01 -1.24 -3.18 117.44 119.60 3k4p n TRP 25 Ca 0.41 -0.47 0.00 0.00 -1.31 0.00 0.00 57.50 56.12 3k4p n TRP 25 Cb 1.28 -0.17 0.00 0.00 -2.01 0.00 0.00 31.31 30.41 3k4p n TRP 25 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3k4p n GLY 26 N 1.08 3.52 0.11 6.99 0.00 -1.26 -0.49 105.19 115.15 3k4p n GLY 26 Ca 0.21 0.12 0.15 0.00 0.00 0.00 0.00 46.02 46.50 3k4p n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k4p n GLN 27 N 14.00 1.16 -0.11 1.61 0.00 -1.26 -1.41 117.38 131.37 3k4p n GLN 27 Ca 0.00 -0.23 0.12 0.00 0.00 0.00 0.00 57.00 56.89 3k4p n GLN 27 Cb 0.00 -1.49 0.26 0.00 0.00 0.00 0.00 30.24 29.01 3k4p n GLN 27 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 3k4p n TYR 28 N -0.72 0.28 -3.02 2.61 4.01 0.36 -3.95 117.16 116.74 3k4p n TYR 28 Ca 0.23 -0.14 -0.39 0.00 -0.16 0.00 0.00 57.90 57.43 3k4p n TYR 28 Cb 0.17 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.14 3k4p n TYR 28 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3k4p s ALA 29 N -1.72 3.43 0.45 -0.72 0.00 -0.50 -4.85 121.76 117.85 3k4p s ALA 29 Ca 0.35 0.28 -0.24 0.00 0.00 0.00 0.00 51.96 52.35 3k4p s ALA 29 Cb 0.21 -2.93 -0.08 0.00 0.00 0.00 0.00 23.12 20.32 3k4p s ALA 29 CO 0.30 0.21 1.28 -1.25 0.00 0.00 0.00 175.76 176.30 3k4p s PRO 30 N -0.66 3.74 0.03 0.00 0.04 -1.26 -0.24 135.00 136.64 3k4p s PRO 30 Ca 0.36 2.08 -0.36 0.00 0.04 0.00 0.00 61.00 63.12 3k4p s PRO 30 Cb -0.21 -2.57 -0.19 0.00 0.04 0.00 0.00 34.50 31.57 3k4p s PRO 30 CO 0.24 -0.65 0.94 0.34 0.04 0.00 0.00 177.00 177.91 3k4p n PHE 31 N -0.27 0.46 -3.74 0.56 7.35 0.18 -4.70 117.46 117.31 3k4p n PHE 31 Ca 0.06 0.99 -0.17 0.00 -0.76 0.00 0.00 57.45 57.57 3k4p n PHE 31 Cb 0.45 -1.96 -0.17 0.00 0.35 0.00 0.00 39.48 38.15 3k4p n PHE 31 CO 0.00 0.00 0.00 -0.59 -0.76 0.00 0.00 176.76 175.41 3k4p s PHE 32 N -0.13 0.07 0.25 -5.13 -0.71 -1.26 -0.19 117.98 110.89 3k4p s PHE 32 Ca 0.83 0.17 -0.30 0.00 -1.04 0.00 0.00 56.93 56.58 3k4p s PHE 32 Cb -1.16 -0.35 -0.10 0.00 -1.21 0.00 0.00 43.02 40.19 3k4p s PHE 32 CO 0.54 -0.13 1.50 0.45 -1.34 0.00 0.00 175.22 176.23 3k4p s SER 33 N 1.51 6.57 -0.24 1.98 0.15 -0.01 -4.93 113.70 118.73 3k4p s SER 33 Ca -0.03 2.74 0.13 0.00 0.70 0.00 0.00 55.95 59.49 3k4p s SER 33 Cb -0.13 -2.62 0.79 0.00 -1.71 0.00 0.00 66.02 62.35 3k4p s SER 33 CO -0.03 -0.77 1.72 0.18 1.20 0.00 0.00 173.24 175.54 3k4p n LEU 34 N 2.43 5.65 -0.31 3.45 4.77 0.22 -4.61 117.00 128.61 3k4p n LEU 34 Ca 0.08 -2.88 -0.04 0.00 -0.03 0.00 0.00 56.01 53.14 3k4p n LEU 34 Cb 0.39 -0.69 0.08 0.00 -2.33 0.00 0.00 43.42 40.87 3k4p n LEU 34 CO 0.62 0.63 1.22 0.00 -1.33 0.00 0.00 177.39 178.53 3k4p h ALA 35 N 3.83 1.06 0.00 -1.18 0.00 -1.74 0.25 119.26 121.48 3k4p h ALA 35 Ca 0.03 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3k4p h ALA 35 Cb 1.98 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 19.43 3k4p h ALA 35 CO 0.51 0.48 0.00 -0.91 0.00 0.00 0.00 179.25 179.33 3k4p h ASN 36 N 1.14 0.00 0.17 0.00 2.35 -1.87 -2.21 115.58 115.15 3k4p h ASN 36 Ca 0.31 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.06 3k4p h ASN 36 Cb -0.11 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.26 3k4p h ASN 36 CO -0.06 0.00 -0.35 -0.62 -1.65 0.00 0.00 177.43 174.75 3k4p n GLU 37 N -2.96 0.90 -2.59 0.81 -0.58 0.04 -4.90 120.64 111.36 3k4p n GLU 37 Ca -0.01 -0.61 -0.43 0.00 -0.42 0.00 0.00 57.16 55.69 3k4p n GLU 37 Cb 0.17 -1.49 -0.02 0.00 -0.57 0.00 0.00 31.44 29.53 3k4p n GLU 37 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 3k4p s SER 38 N -2.52 7.05 0.18 1.62 0.15 -0.83 -4.90 113.70 114.45 3k4p s SER 38 Ca 0.22 1.47 0.02 0.00 0.70 0.00 0.00 55.95 58.37 3k4p s SER 38 Cb 0.19 -2.54 0.06 0.00 -1.71 0.00 0.00 66.02 62.02 3k4p s SER 38 CO 0.55 -0.70 1.42 0.58 1.20 0.00 0.00 173.24 176.29 3k4p h VAL 39 N 5.46 1.45 -3.15 4.45 2.07 -1.88 -3.42 116.25 121.23 3k4p h VAL 39 Ca -0.21 -2.41 -0.59 0.00 0.82 0.00 0.00 66.70 64.31 3k4p h VAL 39 Cb 1.07 2.32 -0.05 0.00 -1.52 0.00 0.00 31.29 33.11 3k4p h VAL 39 CO 0.98 0.71 -0.13 -0.63 0.02 0.00 0.00 177.57 178.51 3k4p s ILE 40 N -3.38 4.91 0.10 4.57 1.01 -1.26 -5.03 121.20 122.11 3k4p s ILE 40 Ca -0.03 0.93 -0.31 0.00 0.00 0.00 0.00 60.65 61.23 3k4p s ILE 40 Cb 0.11 -3.77 -0.07 0.00 0.01 0.00 0.00 42.46 38.73 3k4p s ILE 40 CO 0.82 0.48 1.33 -0.55 0.00 0.00 0.00 174.94 177.03 3k4p s SER 41 N -1.27 6.90 0.46 3.58 0.15 -1.26 -4.54 113.70 117.73 3k4p s SER 41 Ca 0.29 2.23 0.22 0.00 0.70 0.00 0.00 55.95 59.39 3k4p s SER 41 Cb -0.17 -2.58 1.14 0.00 -1.71 0.00 0.00 66.02 62.69 3k4p s SER 41 CO 0.17 -0.60 1.96 1.55 1.20 0.00 0.00 173.24 177.51 3k4p h PRO 42 N 6.81 0.00 -6.54 5.44 0.13 -1.91 -3.46 132.00 132.47 3k4p h PRO 42 Ca -0.42 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.12 3k4p h PRO 42 Cb 1.21 0.00 0.15 0.00 0.13 0.00 0.00 31.00 32.49 3k4p h PRO 42 CO 0.85 0.21 -0.16 0.39 -0.23 0.00 0.00 178.00 179.06 3k4p n GLU 43 N -3.73 0.83 -2.17 0.86 4.71 -1.26 -4.93 120.64 114.94 3k4p n GLU 43 Ca -0.01 0.31 -0.42 0.00 -0.01 0.00 0.00 57.16 57.02 3k4p n GLU 43 Cb 0.32 -1.81 -0.03 0.00 -1.01 0.00 0.00 31.44 28.91 3k4p n GLU 43 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 3k4p s VAL 44 N -1.48 3.51 0.76 2.62 1.01 -1.26 -4.99 120.40 120.57 3k4p s VAL 44 Ca 0.66 0.97 -0.12 0.00 0.00 0.00 0.00 61.98 63.50 3k4p s VAL 44 Cb -0.52 -3.63 0.05 0.00 0.00 0.00 0.00 36.38 32.29 3k4p s VAL 44 CO 0.55 0.02 1.11 -2.84 0.00 0.00 0.00 175.10 173.94 3k4p s PRO 45 N 2.05 2.22 0.52 2.72 0.02 -1.26 -4.94 135.00 136.32 3k4p s PRO 45 Ca 0.65 1.31 -0.22 0.00 0.02 0.00 0.00 61.00 62.76 3k4p s PRO 45 Cb -0.34 -1.88 -0.06 0.00 0.02 0.00 0.00 34.50 32.24 3k4p s PRO 45 CO 0.28 -1.69 1.27 0.00 -0.33 0.00 0.00 177.00 176.54 3k4p s ALA 46 N -2.68 2.85 0.00 -1.55 0.00 -1.26 -2.13 121.76 116.99 3k4p s ALA 46 Ca 0.64 1.16 0.00 0.00 0.00 0.00 0.00 51.96 53.76 3k4p s ALA 46 Cb -0.19 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.44 3k4p s ALA 46 CO 0.52 -1.09 0.00 0.41 0.00 0.00 0.00 175.76 175.60 3k4p n GLY 47 N 0.60 2.25 3.68 0.00 0.00 -1.26 -4.81 105.19 105.65 3k4p n GLY 47 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 3k4p n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k4p s ARG 49 N -1.33 0.24 0.02 0.00 3.52 0.17 -4.78 118.95 116.78 3k4p s ARG 49 Ca 0.17 0.07 -0.30 0.00 -0.13 0.00 0.00 55.73 55.54 3k4p s ARG 49 Cb -0.11 -0.41 -0.06 0.00 -1.56 0.00 0.00 34.95 32.81 3k4p s ARG 49 CO 0.08 -0.11 1.40 0.08 -0.81 0.00 0.00 175.30 175.94 3k4p s VAL 50 N 0.86 3.66 0.00 7.11 1.01 -1.26 0.10 120.40 131.88 3k4p s VAL 50 Ca -0.08 1.07 0.00 0.00 0.00 0.00 0.00 61.98 62.97 3k4p s VAL 50 Cb -0.12 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.57 3k4p s VAL 50 CO -0.02 0.01 0.89 0.35 0.00 0.00 0.00 175.10 176.34 3k4p n THR 51 N 4.56 0.79 -3.64 3.92 -2.24 0.59 -4.92 114.28 113.35 3k4p n THR 51 Ca 0.13 -0.89 -0.06 0.00 -2.27 0.00 0.00 64.05 60.96 3k4p n THR 51 Cb 0.43 0.61 -0.07 0.00 -2.10 0.00 0.00 70.33 69.20 3k4p n THR 51 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 3k4p s PHE 52 N -0.79 -0.78 -0.10 4.78 2.19 -1.15 -4.93 117.98 117.20 3k4p s PHE 52 Ca 0.00 1.62 -0.04 0.00 0.33 0.00 0.00 56.93 58.84 3k4p s PHE 52 Cb 0.00 0.45 0.05 0.00 -1.31 0.00 0.00 43.02 42.21 3k4p s PHE 52 CO 0.00 -0.38 0.19 0.00 1.83 0.00 0.00 175.22 176.86 3k4p s ALA 53 N 1.21 -0.27 -0.11 11.12 0.00 -0.20 -2.54 121.76 130.96 3k4p s ALA 53 Ca -0.07 0.67 -0.00 0.00 0.00 0.00 0.00 51.96 52.55 3k4p s ALA 53 Cb -0.04 -0.85 -0.02 0.00 0.00 0.00 0.00 23.12 22.20 3k4p s ALA 53 CO -0.14 -0.57 -0.10 -1.14 0.00 0.00 0.00 175.76 173.82 3k4p s GLN 54 N 2.27 3.21 -0.12 0.00 0.74 -0.65 -1.70 119.66 123.41 3k4p s GLN 54 Ca 0.02 -0.62 0.02 0.00 0.05 0.00 0.00 55.36 54.83 3k4p s GLN 54 Cb -0.12 -2.66 -0.00 0.00 1.10 0.00 0.00 33.01 31.33 3k4p s GLN 54 CO -0.06 0.37 -0.19 0.54 -0.55 0.00 0.00 175.29 175.40 3k4p s VAL 55 N -0.03 2.49 -0.21 1.34 0.11 0.32 -0.43 120.40 123.99 3k4p s VAL 55 Ca -0.01 -0.86 -0.06 0.00 -2.93 0.00 0.00 61.98 58.11 3k4p s VAL 55 Cb -0.14 -2.01 -0.03 0.00 -1.53 0.00 0.00 36.38 32.68 3k4p s VAL 55 CO 0.03 0.54 0.04 -0.22 -3.33 0.00 0.00 175.10 172.16 3k4p s LEU 56 N 0.46 3.47 0.04 2.54 2.96 0.55 -0.53 118.68 128.17 3k4p s LEU 56 Ca -0.13 -0.12 0.05 0.00 -0.22 0.00 0.00 54.13 53.71 3k4p s LEU 56 Cb -0.17 -1.89 -0.02 0.00 0.50 0.00 0.00 46.19 44.61 3k4p s LEU 56 CO 0.06 0.07 -0.15 -0.55 -1.32 0.00 0.00 176.35 174.46 3k4p s SER 57 N 0.98 1.72 0.54 3.68 0.15 0.14 0.11 113.70 121.03 3k4p s SER 57 Ca 0.03 -0.45 -0.05 0.00 0.70 0.00 0.00 55.95 56.18 3k4p s SER 57 Cb -0.14 -0.12 -0.01 0.00 -1.71 0.00 0.00 66.02 64.04 3k4p s SER 57 CO 0.02 0.05 0.85 -0.60 1.20 0.00 0.00 173.24 174.76 3k4p s ARG 58 N -1.09 3.16 1.15 5.44 3.52 -0.39 -0.84 118.95 129.89 3k4p s ARG 58 Ca 0.02 0.04 -0.14 0.00 -0.13 0.00 0.00 55.73 55.52 3k4p s ARG 58 Cb -0.08 -2.33 0.27 0.00 -1.56 0.00 0.00 34.95 31.25 3k4p s ARG 58 CO 0.01 -0.49 1.04 -3.38 -0.81 0.00 0.00 175.30 171.67 3k4p s HIS 59 N -2.87 1.35 0.86 5.12 -3.43 -1.06 -4.28 115.29 110.98 3k4p s HIS 59 Ca 0.51 0.98 -0.10 0.00 -0.80 0.00 0.00 55.06 55.65 3k4p s HIS 59 Cb -0.10 -3.16 0.17 0.00 -1.43 0.00 0.00 32.58 28.05 3k4p s HIS 59 CO 0.45 -3.70 1.19 0.20 -2.00 0.00 0.00 174.74 170.87 3k4p s GLY 60 N -3.00 1.77 0.15 -1.38 0.00 -1.26 -0.21 107.32 103.38 3k4p s GLY 60 Ca 0.68 -1.41 -0.34 0.00 0.00 0.00 0.00 44.72 43.65 3k4p s GLY 60 CO 0.61 -0.73 1.14 0.00 0.00 0.00 0.00 173.10 174.12 3k4p n ALA 61 N -3.38 -1.19 -2.44 3.20 0.00 -1.26 -4.65 120.51 110.79 3k4p n ALA 61 Ca 0.15 0.48 -0.19 0.00 0.00 0.00 0.00 53.44 53.88 3k4p n ALA 61 Cb 0.60 -1.99 -0.11 0.00 0.00 0.00 0.00 19.45 17.96 3k4p n ALA 61 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 3k4p s ARG 62 N -0.27 1.14 0.79 0.00 1.70 -1.26 -1.85 118.95 119.20 3k4p s ARG 62 Ca 0.76 -1.36 -0.14 0.00 -0.47 0.00 0.00 55.73 54.52 3k4p s ARG 62 Cb -0.91 -1.03 0.05 0.00 -0.57 0.00 0.00 34.95 32.49 3k4p s ARG 62 CO 0.52 0.19 0.99 0.66 -1.08 0.00 0.00 175.30 176.59 3k4p n TYR 63 N 0.26 0.63 -1.54 5.89 4.01 -0.26 -4.84 117.16 121.31 3k4p n TYR 63 Ca -0.13 0.38 -0.36 0.00 -0.16 0.00 0.00 57.90 57.63 3k4p n TYR 63 Cb 0.58 -2.05 0.08 0.00 -0.31 0.00 0.00 39.34 37.64 3k4p n TYR 63 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 3k4p n PRO 64 N -2.50 0.82 -0.99 -0.72 -0.02 -1.26 -3.64 135.00 126.69 3k4p n PRO 64 Ca 0.12 0.34 -0.30 0.00 -2.02 0.00 0.00 63.50 61.64 3k4p n PRO 64 Cb 0.50 -2.41 0.15 0.00 -0.02 0.00 0.00 33.50 31.72 3k4p n PRO 64 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3k4p s THR 65 N -1.60 2.56 0.12 3.45 -4.23 -1.26 -1.57 115.64 113.10 3k4p s THR 65 Ca 0.79 0.18 -0.23 0.00 -1.18 0.00 0.00 61.69 61.25 3k4p s THR 65 Cb -0.36 -2.49 -0.07 0.00 1.34 0.00 0.00 72.50 70.92 3k4p s THR 65 CO 0.45 -0.24 1.69 -0.78 -0.54 0.00 0.00 174.62 175.20 3k4p h ASP 66 N -1.70 -0.34 0.00 3.99 3.58 -1.93 -1.05 116.42 118.97 3k4p h ASP 66 Ca -0.48 0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.02 3k4p h ASP 66 Cb 1.28 0.15 0.00 0.00 1.72 0.00 0.00 39.33 42.48 3k4p h ASP 66 CO 0.50 -0.16 0.00 -0.24 -2.88 0.00 0.00 179.24 176.46 3k4p n SER 67 N -5.25 0.00 -0.27 2.28 2.88 -1.26 -1.72 113.62 110.28 3k4p n SER 67 Ca -0.05 0.82 0.01 0.00 -1.33 0.00 0.00 58.87 58.32 3k4p n SER 67 Cb 0.17 -0.39 0.22 0.00 -0.75 0.00 0.00 64.21 63.45 3k4p n SER 67 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 3k4p h LYS 68 N 0.00 1.06 -0.50 -1.46 1.79 -1.84 -2.23 116.57 113.39 3k4p h LYS 68 Ca 0.00 -0.06 -0.10 0.00 -2.18 0.00 0.00 60.65 58.31 3k4p h LYS 68 Cb 0.00 -0.24 -0.02 0.00 -1.58 0.00 0.00 32.23 30.39 3k4p h LYS 68 CO 0.00 0.70 -0.08 0.78 -1.08 0.00 0.00 179.45 179.78 3k4p h GLY 69 N 1.09 0.98 0.02 3.86 0.00 -1.01 0.13 103.07 108.13 3k4p h GLY 69 Ca 0.32 -0.74 0.01 0.00 0.00 0.00 0.00 47.33 46.93 3k4p h GLY 69 CO -0.08 0.68 -0.40 0.50 0.00 0.00 0.00 176.54 177.24 3k4p h LYS 70 N 0.82 -0.49 -0.35 4.80 1.79 -0.72 0.11 116.57 122.53 3k4p h LYS 70 Ca 0.14 0.03 0.07 0.00 -2.18 0.00 0.00 60.65 58.71 3k4p h LYS 70 Cb 0.59 0.11 -0.07 0.00 -1.58 0.00 0.00 32.23 31.29 3k4p h LYS 70 CO 0.04 -0.33 -0.09 0.87 -1.08 0.00 0.00 179.45 178.86 3k4p h LYS 71 N -0.51 -0.00 -0.08 3.15 1.57 -1.23 0.47 116.57 119.94 3k4p h LYS 71 Ca 0.01 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 58.82 3k4p h LYS 71 Cb 0.54 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.81 3k4p h LYS 71 CO -0.26 -0.00 -0.19 1.88 -0.57 0.00 0.00 179.45 180.31 3k4p h TYR 72 N -0.00 -0.49 -0.17 -1.35 0.05 -0.53 0.66 116.97 115.14 3k4p h TYR 72 Ca 0.17 0.02 0.03 0.00 0.05 0.00 0.00 58.73 59.00 3k4p h TYR 72 Cb 0.26 0.23 -0.03 0.00 1.01 0.00 0.00 36.73 38.20 3k4p h TYR 72 CO -0.32 -0.27 -0.02 1.03 -1.05 0.00 0.00 178.16 177.53 3k4p h SER 73 N -0.26 -0.10 -0.37 3.88 0.87 -0.01 -0.99 113.55 116.57 3k4p h SER 73 Ca 0.08 0.04 0.06 0.00 -1.23 0.00 0.00 61.79 60.74 3k4p h SER 73 Cb 0.38 0.08 -0.05 0.00 -0.44 0.00 0.00 62.40 62.37 3k4p h SER 73 CO -0.23 -0.03 0.07 0.00 -0.53 0.00 0.00 176.83 176.11 3k4p h ALA 74 N 1.16 0.39 -0.39 6.23 0.00 0.58 -2.10 119.26 125.13 3k4p h ALA 74 Ca 0.08 0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.09 3k4p h ALA 74 Cb 0.11 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 3k4p h ALA 74 CO -0.15 -0.33 0.22 1.25 0.00 0.00 0.00 179.25 180.23 3k4p h LEU 75 N 0.19 0.35 -1.30 0.00 5.85 0.79 -2.24 115.31 118.95 3k4p h LEU 75 Ca 0.18 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.84 3k4p h LEU 75 Cb 0.21 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 3k4p h LEU 75 CO -0.24 0.26 -0.31 0.40 -0.34 0.00 0.00 178.44 178.21 3k4p h ILE 76 N 0.45 0.93 0.12 4.05 2.04 -0.96 -0.16 117.51 123.98 3k4p h ILE 76 Ca 0.16 -1.17 -0.01 0.00 1.00 0.00 0.00 64.86 64.84 3k4p h ILE 76 Cb 0.02 1.69 0.00 0.00 -0.74 0.00 0.00 36.82 37.79 3k4p h ILE 76 CO -0.08 0.30 -0.06 -0.33 0.00 0.00 0.00 178.15 177.99 3k4p h GLU 77 N 0.00 -0.15 -0.95 2.37 5.08 -0.99 -2.01 114.58 117.94 3k4p h GLU 77 Ca -0.00 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.46 3k4p h GLU 77 Cb 0.67 0.03 -0.07 0.00 0.50 0.00 0.00 28.75 29.88 3k4p h GLU 77 CO 0.04 0.15 0.61 0.93 -1.00 0.00 0.00 179.01 179.74 3k4p h GLU 78 N -0.46 0.96 -0.83 2.33 5.08 -1.06 0.41 114.58 121.02 3k4p h GLU 78 Ca -0.02 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.25 3k4p h GLU 78 Cb 0.37 -0.22 -0.04 0.00 0.50 0.00 0.00 28.75 29.37 3k4p h GLU 78 CO 0.03 0.64 0.38 0.82 -1.00 0.00 0.00 179.01 179.87 3k4p h ILE 79 N 0.99 1.26 -0.00 3.13 2.04 -1.00 -2.45 117.51 121.48 3k4p h ILE 79 Ca 0.44 -0.76 -0.16 0.00 1.00 0.00 0.00 64.86 65.37 3k4p h ILE 79 Cb 0.36 0.21 -0.02 0.00 -0.74 0.00 0.00 36.82 36.63 3k4p h ILE 79 CO -0.20 0.32 -0.77 1.56 0.00 0.00 0.00 178.15 179.07 3k4p h GLN 80 N 1.20 0.01 -0.07 2.37 4.20 -0.10 -2.80 115.11 119.92 3k4p h GLN 80 Ca 0.28 -0.01 -0.16 0.00 0.06 0.00 0.00 58.65 58.83 3k4p h GLN 80 Cb 0.15 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 3k4p h GLN 80 CO -0.03 0.78 -0.64 1.96 -0.67 0.00 0.00 178.83 180.22 3k4p h GLN 81 N 0.01 0.27 0.00 1.46 4.20 -0.20 -3.39 115.11 117.46 3k4p h GLN 81 Ca -0.01 -0.20 -0.38 0.00 0.06 0.00 0.00 58.65 58.12 3k4p h GLN 81 Cb 1.36 0.03 -0.07 0.00 0.30 0.00 0.00 27.48 29.11 3k4p h GLN 81 CO 0.10 0.82 -2.44 0.09 -0.67 0.00 0.00 178.83 176.74 3k4p n ASN 82 N -3.85 1.58 -4.80 1.46 4.13 -0.93 -5.02 115.26 107.82 3k4p n ASN 82 Ca -0.03 -0.11 -0.34 0.00 1.68 0.00 0.00 54.58 55.79 3k4p n ASN 82 Cb 0.65 -0.09 -0.04 0.00 -1.54 0.00 0.00 39.78 38.76 3k4p n ASN 82 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3k4p s ALA 83 N -2.50 2.91 -0.14 5.41 0.00 -1.06 -4.52 121.76 121.85 3k4p s ALA 83 Ca -0.29 0.55 0.08 0.00 0.00 0.00 0.00 51.96 52.30 3k4p s ALA 83 Cb 0.08 -3.23 -0.12 0.00 0.00 0.00 0.00 23.12 19.86 3k4p s ALA 83 CO 0.64 -0.24 0.24 0.25 0.00 0.00 0.00 175.76 176.66 3k4p n THR 84 N -0.95 0.00 -3.76 0.00 -2.24 -0.48 -4.87 114.28 101.98 3k4p n THR 84 Ca 0.09 -0.23 -0.30 0.00 -2.27 0.00 0.00 64.05 61.34 3k4p n THR 84 Cb 0.53 0.54 -0.15 0.00 -2.10 0.00 0.00 70.33 69.14 3k4p n THR 84 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3k4p s THR 85 N -2.32 0.97 -0.92 4.28 -4.23 -1.26 -5.02 115.64 107.13 3k4p s THR 85 Ca -0.01 -1.39 -0.12 0.00 -1.18 0.00 0.00 61.69 58.99 3k4p s THR 85 Cb 0.06 -1.69 0.24 0.00 1.34 0.00 0.00 72.50 72.45 3k4p s THR 85 CO 0.35 -0.61 0.88 -0.36 -0.54 0.00 0.00 174.62 174.34 3k4p s PHE 86 N 1.58 3.94 0.34 3.99 0.08 -1.26 -4.57 117.98 122.08 3k4p s PHE 86 Ca 0.08 -2.25 0.06 0.00 0.12 0.00 0.00 56.93 54.94 3k4p s PHE 86 Cb -0.17 -3.81 -0.03 0.00 -0.57 0.00 0.00 43.02 38.43 3k4p s PHE 86 CO -0.22 -0.97 0.24 0.16 -0.10 0.00 0.00 175.22 174.33 3k4p s ASP 87 N 1.83 1.86 1.21 1.36 1.47 -1.26 -3.77 116.67 119.38 3k4p s ASP 87 Ca 0.22 -1.74 0.00 0.00 1.18 0.00 0.00 52.55 52.22 3k4p s ASP 87 Cb -0.10 0.55 0.00 0.00 -0.34 0.00 0.00 42.92 43.03 3k4p s ASP 87 CO -0.09 -1.03 0.00 0.61 0.68 0.00 0.00 175.17 175.34 3k4p n GLY 88 N -0.67 3.06 0.00 2.12 0.00 -1.26 -1.97 105.19 106.47 3k4p n GLY 88 Ca 0.05 -0.25 0.04 0.00 0.00 0.00 0.00 46.02 45.85 3k4p n GLY 88 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3k4p n LYS 89 N 14.00 0.14 0.04 1.61 2.85 -1.26 -2.35 118.16 133.19 3k4p n LYS 89 Ca 0.00 0.17 0.11 0.00 -1.05 0.00 0.00 58.31 57.54 3k4p n LYS 89 Cb 0.00 -1.50 0.06 0.00 -0.65 0.00 0.00 35.03 32.94 3k4p n LYS 89 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 3k4p n TYR 90 N -1.22 0.36 -0.27 5.58 4.01 -0.83 -4.55 117.16 120.24 3k4p n TYR 90 Ca 0.04 0.10 0.09 0.00 -0.16 0.00 0.00 57.90 57.97 3k4p n TYR 90 Cb 0.06 -0.51 0.23 0.00 -0.31 0.00 0.00 39.34 38.80 3k4p n TYR 90 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3k4p h ALA 91 N 2.51 1.10 -0.49 -0.72 0.00 -1.56 -1.27 119.26 118.84 3k4p h ALA 91 Ca 0.00 0.19 0.14 0.00 0.00 0.00 0.00 54.91 55.24 3k4p h ALA 91 Cb 0.75 0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 3k4p h ALA 91 CO 0.00 -0.37 0.37 0.27 0.00 0.00 0.00 179.25 179.52 3k4p h PHE 92 N 0.27 0.00 0.00 0.00 -0.00 -1.85 -0.97 116.94 114.39 3k4p h PHE 92 Ca 0.47 0.00 -0.03 0.00 -0.00 0.00 0.00 57.97 58.41 3k4p h PHE 92 Cb 0.87 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 36.81 3k4p h PHE 92 CO -0.26 0.00 -0.16 -0.07 -0.00 0.00 0.00 178.31 177.82 3k4p h LEU 93 N 0.00 0.00 -0.23 2.10 3.38 -1.56 -1.82 115.31 117.18 3k4p h LEU 93 Ca 0.23 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.25 3k4p h LEU 93 Cb 0.98 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.68 3k4p h LEU 93 CO -0.00 0.16 -0.10 0.50 0.09 0.00 0.00 178.44 179.09 3k4p h LYS 94 N 0.00 -0.07 0.00 1.13 3.64 -1.33 -3.22 116.57 116.72 3k4p h LYS 94 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3k4p h LYS 94 Cb 0.52 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.36 3k4p h LYS 94 CO 0.02 -0.05 -1.37 0.25 -2.27 0.00 0.00 179.45 176.03 3k4p n THR 95 N -5.27 0.00 -1.55 1.00 -2.24 -1.19 -4.95 114.28 100.08 3k4p n THR 95 Ca -0.01 -0.25 -0.61 0.00 -2.27 0.00 0.00 64.05 60.91 3k4p n THR 95 Cb 0.18 0.52 -0.08 0.00 -2.10 0.00 0.00 70.33 68.86 3k4p n THR 95 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k4p n TYR 96 N -1.80 0.89 -3.87 4.78 9.36 -0.69 -4.89 117.16 120.94 3k4p n TYR 96 Ca -0.00 1.07 -0.30 0.00 3.32 0.00 0.00 57.90 61.99 3k4p n TYR 96 Cb 0.39 -2.12 -0.13 0.00 -0.63 0.00 0.00 39.34 36.84 3k4p n TYR 96 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 3k4p s ASN 97 N 0.64 4.12 -0.08 2.98 2.47 -1.26 -5.03 114.94 118.78 3k4p s ASN 97 Ca 0.94 -2.97 -0.30 0.00 0.42 0.00 0.00 52.86 50.94 3k4p s ASN 97 Cb -1.31 -1.44 -0.08 0.00 -1.45 0.00 0.00 41.25 36.96 3k4p s ASN 97 CO 0.62 -0.23 2.05 0.00 -3.72 0.00 0.00 177.10 175.82 3k4p n TYR 98 N 3.14 2.28 0.00 0.43 4.19 -1.26 -4.83 117.16 121.10 3k4p n TYR 98 Ca 0.08 -0.21 0.00 0.00 3.31 0.00 0.00 57.90 61.07 3k4p n TYR 98 Cb 0.33 -2.75 0.00 0.00 0.49 0.00 0.00 39.34 37.41 3k4p n TYR 98 CO 0.00 0.00 0.00 -1.13 0.91 0.00 0.00 176.86 176.64 3k4p n SER 99 N 8.75 0.69 -3.49 2.98 3.41 -1.26 -5.10 113.62 119.58 3k4p n SER 99 Ca 0.24 -0.27 -0.35 0.00 -0.26 0.00 0.00 58.87 58.24 3k4p n SER 99 Cb 0.39 0.68 -0.00 0.00 -0.26 0.00 0.00 64.21 65.02 3k4p n SER 99 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3k4p n LEU 100 N -0.75 -2.19 0.00 1.04 4.77 -1.26 -5.01 117.00 113.60 3k4p n LEU 100 Ca 0.00 0.69 0.00 0.00 -0.03 0.00 0.00 56.01 56.67 3k4p n LEU 100 Cb 0.00 -0.72 0.00 0.00 -2.33 0.00 0.00 43.42 40.37 3k4p n LEU 100 CO 0.00 -3.30 0.00 0.61 -1.33 0.00 0.00 177.39 173.37 3k4p n GLY 101 N 1.87 -1.31 3.11 -0.72 0.00 -1.26 -5.03 105.19 101.85 3k4p n GLY 101 Ca 0.10 -1.61 -0.12 0.00 0.00 0.00 0.00 46.02 44.39 3k4p n GLY 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k4p s ALA 102 N -3.77 -0.72 0.00 4.61 0.00 -1.26 -4.14 121.76 116.48 3k4p s ALA 102 Ca 0.00 1.14 0.00 0.00 0.00 0.00 0.00 51.96 53.10 3k4p s ALA 102 Cb 0.00 -0.88 0.00 0.00 0.00 0.00 0.00 23.12 22.24 3k4p s ALA 102 CO 0.00 -0.40 0.00 -0.25 0.00 0.00 0.00 175.76 175.11 3k4p n ASP 103 N 4.70 0.00 -4.79 0.00 8.00 -0.61 -4.89 116.55 118.96 3k4p n ASP 103 Ca -0.17 0.00 -0.31 0.00 0.71 0.00 0.00 54.79 55.01 3k4p n ASP 103 Cb 0.52 0.00 0.07 0.00 -0.02 0.00 0.00 41.12 41.69 3k4p n ASP 103 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 3k4p s ASP 104 N 0.00 4.97 0.57 -2.24 1.01 -1.26 -4.57 116.67 115.15 3k4p s ASP 104 Ca 0.00 1.75 -0.20 0.00 0.71 0.00 0.00 52.55 54.81 3k4p s ASP 104 Cb 0.00 -2.51 -0.04 0.00 1.01 0.00 0.00 42.92 41.38 3k4p s ASP 104 CO 0.00 -1.72 1.28 -0.22 0.21 0.00 0.00 175.17 174.72 3k4p s LEU 105 N -5.61 3.77 0.39 1.23 2.96 -1.26 -1.11 118.68 119.05 3k4p s LEU 105 Ca 0.60 2.58 0.02 0.00 -0.22 0.00 0.00 54.13 57.11 3k4p s LEU 105 Cb -0.16 -4.42 -0.01 0.00 0.50 0.00 0.00 46.19 42.09 3k4p s LEU 105 CO 0.53 -1.58 0.58 0.42 -1.32 0.00 0.00 176.35 174.98 3k4p s THR 106 N -1.43 4.35 0.18 3.68 -4.23 -0.77 -4.73 115.64 112.69 3k4p s THR 106 Ca 0.74 -0.63 -0.16 0.00 -1.18 0.00 0.00 61.69 60.46 3k4p s THR 106 Cb -0.36 -3.58 0.14 0.00 1.34 0.00 0.00 72.50 70.05 3k4p s THR 106 CO 0.41 -0.35 1.65 -0.65 -0.54 0.00 0.00 174.62 175.14 3k4p h PRO 107 N 0.64 -0.01 -0.26 3.99 0.11 -1.91 0.12 132.00 134.69 3k4p h PRO 107 Ca -0.47 0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.70 3k4p h PRO 107 Cb 1.24 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.28 3k4p h PRO 107 CO 0.57 -0.01 -0.25 0.35 -0.21 0.00 0.00 178.00 178.45 3k4p h PHE 108 N -0.01 -0.68 -0.92 0.65 3.57 -1.93 -1.00 116.94 116.63 3k4p h PHE 108 Ca 0.23 0.04 0.20 0.00 3.53 0.00 0.00 57.97 61.97 3k4p h PHE 108 Cb 0.36 0.34 -0.07 0.00 2.79 0.00 0.00 35.95 39.37 3k4p h PHE 108 CO -0.41 -0.33 0.60 0.78 -2.23 0.00 0.00 178.31 176.72 3k4p h GLY 109 N -0.26 0.99 0.67 2.40 0.00 -1.27 -0.84 103.07 104.76 3k4p h GLY 109 Ca 0.14 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.25 3k4p h GLY 109 CO -0.40 -0.01 -0.06 0.83 0.00 0.00 0.00 176.54 176.89 3k4p h GLU 110 N 0.46 -0.17 -0.68 4.80 5.08 0.31 -3.14 114.58 121.25 3k4p h GLU 110 Ca 0.48 0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.87 3k4p h GLU 110 Cb 1.13 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 30.39 3k4p h GLU 110 CO -0.20 0.16 0.45 0.37 -1.00 0.00 0.00 179.01 178.79 3k4p h GLN 111 N -0.51 0.86 -0.92 2.33 5.75 -0.56 -1.36 115.11 120.70 3k4p h GLN 111 Ca -0.02 -0.05 0.15 0.00 -0.15 0.00 0.00 58.65 58.58 3k4p h GLN 111 Cb 0.40 -0.19 -0.10 0.00 1.07 0.00 0.00 27.48 28.67 3k4p h GLN 111 CO 0.03 0.57 0.53 0.93 -2.65 0.00 0.00 178.83 178.24 3k4p h GLU 112 N 0.88 0.72 0.00 1.69 5.08 -1.13 0.87 114.58 122.69 3k4p h GLU 112 Ca 0.26 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.50 3k4p h GLU 112 Cb -0.05 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.02 3k4p h GLU 112 CO -0.06 0.48 -0.65 -0.07 -1.00 0.00 0.00 179.01 177.70 3k4p h LEU 113 N 0.75 0.00 0.17 1.33 -0.00 -1.23 -0.56 115.31 115.76 3k4p h LEU 113 Ca 0.50 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 58.37 3k4p h LEU 113 Cb 0.68 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.34 3k4p h LEU 113 CO -0.34 0.31 -0.08 0.58 -0.00 0.00 0.00 178.44 178.90 3k4p h VAL 114 N 0.00 0.94 -0.83 1.22 2.07 -1.01 -1.79 116.25 116.85 3k4p h VAL 114 Ca -0.03 -0.53 0.05 0.00 0.82 0.00 0.00 66.70 67.01 3k4p h VAL 114 Cb 1.26 1.27 -0.06 0.00 -1.52 0.00 0.00 31.29 32.24 3k4p h VAL 114 CO 0.03 0.12 0.52 0.78 0.02 0.00 0.00 177.57 179.04 3k4p h ASN 115 N -0.48 0.82 -0.76 0.57 4.21 -0.75 -0.19 115.58 119.00 3k4p h ASN 115 Ca -0.02 0.01 0.02 0.00 1.21 0.00 0.00 56.30 57.52 3k4p h ASN 115 Cb 0.37 -0.16 -0.04 0.00 -1.12 0.00 0.00 38.32 37.37 3k4p h ASN 115 CO 0.04 0.54 0.50 -1.28 -1.29 0.00 0.00 177.43 175.94 3k4p h SER 116 N 0.96 0.83 -0.22 5.81 0.87 -1.05 -0.19 113.55 120.56 3k4p h SER 116 Ca 0.36 -0.01 -0.05 0.00 -1.23 0.00 0.00 61.79 60.85 3k4p h SER 116 Cb 0.13 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 61.88 3k4p h SER 116 CO -0.16 0.58 -0.06 1.23 -0.53 0.00 0.00 176.83 177.89 3k4p h GLY 117 N 0.97 0.47 0.88 5.77 0.00 -0.26 -0.13 103.07 110.77 3k4p h GLY 117 Ca 0.29 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 47.24 3k4p h GLY 117 CO -0.08 0.36 -0.10 -2.22 0.00 0.00 0.00 176.54 174.50 3k4p h ILE 118 N 0.16 0.78 -0.63 2.60 2.04 -0.94 -1.40 117.51 120.12 3k4p h ILE 118 Ca 0.06 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.98 3k4p h ILE 118 Cb 0.52 0.78 -0.06 0.00 -0.74 0.00 0.00 36.82 37.32 3k4p h ILE 118 CO 0.02 0.00 0.31 0.50 0.00 0.00 0.00 178.15 178.99 3k4p h LYS 119 N -0.22 0.56 -0.64 2.37 3.64 -0.92 -1.23 116.57 120.13 3k4p h LYS 119 Ca 0.00 -0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.26 3k4p h LYS 119 Cb 0.21 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 3k4p h LYS 119 CO -0.03 0.37 0.06 0.35 -2.27 0.00 0.00 179.45 177.93 3k4p h PHE 120 N 0.57 1.17 -0.26 1.91 3.57 -0.88 -1.98 116.94 121.05 3k4p h PHE 120 Ca 0.29 -0.18 0.05 0.00 3.53 0.00 0.00 57.97 61.67 3k4p h PHE 120 Cb 0.25 -0.31 -0.05 0.00 2.79 0.00 0.00 35.95 38.62 3k4p h PHE 120 CO -0.11 1.00 -0.07 -0.92 -2.23 0.00 0.00 178.31 175.99 3k4p h TYR 121 N 1.01 -0.14 -0.13 0.41 5.03 -0.10 -3.00 116.97 120.05 3k4p h TYR 121 Ca 0.19 0.02 -0.10 0.00 2.58 0.00 0.00 58.73 61.42 3k4p h TYR 121 Cb 0.49 0.10 0.00 0.00 1.55 0.00 0.00 36.73 38.87 3k4p h TYR 121 CO 0.04 -0.11 -0.33 1.96 -1.32 0.00 0.00 178.16 178.40 3k4p h GLN 122 N -0.00 0.45 -0.65 1.82 4.20 -1.18 -1.21 115.11 118.53 3k4p h GLN 122 Ca 0.12 -0.31 0.05 0.00 0.06 0.00 0.00 58.65 58.58 3k4p h GLN 122 Cb 0.19 0.05 -0.04 0.00 0.30 0.00 0.00 27.48 27.98 3k4p h GLN 122 CO -0.26 0.92 0.43 -0.09 -0.67 0.00 0.00 178.83 179.16 3k4p h ARG 123 N 0.05 0.67 -0.10 1.46 2.43 -1.37 -2.39 114.38 115.13 3k4p h ARG 123 Ca -0.00 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.08 3k4p h ARG 123 Cb 0.93 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 30.30 3k4p h ARG 123 CO 0.07 0.44 -0.29 0.66 -1.51 0.00 0.00 179.97 179.34 3k4p n TYR 124 N -4.47 0.33 -0.32 2.20 4.01 -1.13 -4.80 117.16 112.98 3k4p n TYR 124 Ca 0.09 -1.43 0.21 0.00 -0.16 0.00 0.00 57.90 56.61 3k4p n TYR 124 Cb 0.20 -0.30 0.39 0.00 -0.31 0.00 0.00 39.34 39.32 3k4p n TYR 124 CO 0.00 0.00 0.00 -1.91 -0.46 0.00 0.00 176.86 174.49 3k4p n GLU 125 N -1.14 -0.07 0.00 -0.72 0.00 -0.46 0.52 120.64 118.77 3k4p n GLU 125 Ca 0.22 1.37 0.11 0.00 0.00 0.00 0.00 57.16 58.86 3k4p n GLU 125 Cb 0.78 -2.28 0.63 0.00 0.00 0.00 0.00 31.44 30.57 3k4p n GLU 125 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 3k4p n SER 126 N -5.29 0.00 -0.01 4.31 3.41 -1.26 -1.85 113.62 112.93 3k4p n SER 126 Ca 0.28 -0.53 -0.01 0.00 -0.26 0.00 0.00 58.87 58.35 3k4p n SER 126 Cb 0.93 -0.07 -0.01 0.00 -0.26 0.00 0.00 64.21 64.80 3k4p n SER 126 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3k4p n LEU 127 N -1.07 0.29 0.07 1.04 4.77 0.18 -4.69 117.00 117.59 3k4p n LEU 127 Ca 0.15 -0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.25 3k4p n LEU 127 Cb 0.10 0.03 0.47 0.00 -2.33 0.00 0.00 43.42 41.68 3k4p n LEU 127 CO 0.13 0.08 0.87 0.35 -1.33 0.00 0.00 177.39 177.50 3k4p n THR 128 N -2.10 0.56 0.22 -5.08 -2.24 0.01 -2.19 114.28 103.46 3k4p n THR 128 Ca -0.02 -0.01 0.09 0.00 -2.27 0.00 0.00 64.05 61.84 3k4p n THR 128 Cb 0.54 -0.76 0.43 0.00 -2.10 0.00 0.00 70.33 68.44 3k4p n THR 128 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 3k4p h ARG 129 N 0.00 0.00 0.00 -0.78 0.11 -1.62 -3.37 114.38 108.72 3k4p h ARG 129 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3k4p h ARG 129 Cb 0.51 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.59 3k4p h ARG 129 CO 0.00 0.24 -0.14 0.27 0.10 0.00 0.00 179.97 180.44 3k4p n ASN 130 N -3.38 0.00 -4.10 0.08 6.94 -1.15 -1.53 115.26 112.12 3k4p n ASN 130 Ca 0.00 -1.28 -0.28 0.00 -0.02 0.00 0.00 54.58 53.00 3k4p n ASN 130 Cb 0.45 -0.06 -0.17 0.00 -2.36 0.00 0.00 39.78 37.65 3k4p n ASN 130 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3k4p s ILE 131 N 0.00 1.55 -0.29 1.53 1.01 -0.93 -5.00 121.20 119.07 3k4p s ILE 131 Ca 0.00 -0.71 -0.22 0.00 0.00 0.00 0.00 60.65 59.73 3k4p s ILE 131 Cb 0.00 -1.39 -0.01 0.00 0.01 0.00 0.00 42.46 41.07 3k4p s ILE 131 CO 0.00 0.45 0.70 -0.69 0.00 0.00 0.00 174.94 175.40 3k4p s VAL 132 N 0.68 4.88 0.45 2.92 1.01 -1.26 -4.64 120.40 124.44 3k4p s VAL 132 Ca -0.13 1.08 -0.24 0.00 0.00 0.00 0.00 61.98 62.69 3k4p s VAL 132 Cb -0.16 -4.05 -0.07 0.00 0.00 0.00 0.00 36.38 32.09 3k4p s VAL 132 CO 0.03 -0.15 1.25 -2.84 0.00 0.00 0.00 175.10 173.40 3k4p s PRO 133 N 2.74 3.76 -0.12 2.72 0.02 -1.26 -4.84 135.00 138.01 3k4p s PRO 133 Ca 0.29 2.00 -0.23 0.00 0.02 0.00 0.00 61.00 63.08 3k4p s PRO 133 Cb -0.15 -2.54 -0.03 0.00 0.02 0.00 0.00 34.50 31.81 3k4p s PRO 133 CO 0.11 -0.62 0.73 0.12 -0.33 0.00 0.00 177.00 177.01 3k4p s PHE 134 N -1.38 3.49 -0.14 6.54 5.36 -0.36 -4.77 117.98 126.72 3k4p s PHE 134 Ca 0.62 1.19 0.01 0.00 -0.96 0.00 0.00 56.93 57.79 3k4p s PHE 134 Cb -0.34 -2.87 0.02 0.00 -0.34 0.00 0.00 43.02 39.49 3k4p s PHE 134 CO 0.43 -0.06 -0.18 0.42 -1.46 0.00 0.00 175.22 174.37 3k4p s ILE 135 N 1.41 1.76 0.19 3.12 1.01 -1.26 -1.70 121.20 125.73 3k4p s ILE 135 Ca 0.36 -0.78 0.10 0.00 0.00 0.00 0.00 60.65 60.34 3k4p s ILE 135 Cb -0.17 -1.60 -0.04 0.00 0.01 0.00 0.00 42.46 40.65 3k4p s ILE 135 CO 0.15 0.49 -0.18 -0.13 0.00 0.00 0.00 174.94 175.27 3k4p s ARG 136 N 1.13 1.74 -0.11 2.79 0.52 0.42 0.10 118.95 125.54 3k4p s ARG 136 Ca -0.01 -1.43 -0.06 0.00 -0.52 0.00 0.00 55.73 53.70 3k4p s ARG 136 Cb -0.14 -1.96 0.05 0.00 0.52 0.00 0.00 34.95 33.41 3k4p s ARG 136 CO -0.06 0.41 0.26 0.45 0.02 0.00 0.00 175.30 176.38 3k4p s SER 137 N -2.76 -0.29 0.86 0.23 0.15 -0.56 -2.31 113.70 109.02 3k4p s SER 137 Ca 0.23 0.56 -0.13 0.00 0.70 0.00 0.00 55.95 57.31 3k4p s SER 137 Cb -0.08 0.46 0.06 0.00 -1.71 0.00 0.00 66.02 64.75 3k4p s SER 137 CO 0.12 -0.16 0.82 -0.24 1.20 0.00 0.00 173.24 174.98 3k4p n SER 138 N 4.09 -0.50 -4.39 5.45 2.88 -0.55 0.07 113.62 120.66 3k4p n SER 138 Ca -0.24 0.47 -0.45 0.00 -1.33 0.00 0.00 58.87 57.32 3k4p n SER 138 Cb 0.54 -1.36 -0.02 0.00 -0.75 0.00 0.00 64.21 62.62 3k4p n SER 138 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 3k4p s GLY 139 N -2.08 2.34 -0.16 0.46 0.00 0.30 -4.29 107.32 103.90 3k4p s GLY 139 Ca 0.65 -3.10 -0.10 0.00 0.00 0.00 0.00 44.72 42.17 3k4p s GLY 139 CO 0.59 1.66 0.38 -0.45 0.00 0.00 0.00 173.10 175.29 3k4p s SER 140 N 2.83 -0.46 0.25 1.64 0.15 -1.26 -4.36 113.70 112.50 3k4p s SER 140 Ca 0.27 0.82 -0.09 0.00 0.70 0.00 0.00 55.95 57.65 3k4p s SER 140 Cb -0.07 0.74 0.41 0.00 -1.71 0.00 0.00 66.02 65.38 3k4p s SER 140 CO -0.09 -0.17 1.60 0.28 1.20 0.00 0.00 173.24 176.06 3k4p h SER 141 N 6.67 -0.66 0.24 5.45 0.02 -1.98 0.30 113.55 123.60 3k4p h SER 141 Ca -0.34 0.24 -0.04 0.00 -0.84 0.00 0.00 61.79 60.81 3k4p h SER 141 Cb 1.18 0.48 -0.01 0.00 0.14 0.00 0.00 62.40 64.19 3k4p h SER 141 CO 0.30 -0.26 -0.19 0.08 -1.14 0.00 0.00 176.83 175.61 3k4p h ARG 142 N 0.02 0.00 0.03 3.45 0.11 -1.97 -0.62 114.38 115.40 3k4p h ARG 142 Ca 0.42 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.50 3k4p h ARG 142 Cb 0.69 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.77 3k4p h ARG 142 CO -0.82 0.19 -0.02 0.28 0.10 0.00 0.00 179.97 179.71 3k4p h VAL 143 N 0.00 1.25 -0.44 0.08 2.07 -0.74 -2.06 116.25 116.41 3k4p h VAL 143 Ca -0.00 -1.75 0.09 0.00 0.82 0.00 0.00 66.70 65.86 3k4p h VAL 143 Cb 0.37 2.28 -0.10 0.00 -1.52 0.00 0.00 31.29 32.32 3k4p h VAL 143 CO 0.03 0.39 -0.26 0.40 0.02 0.00 0.00 177.57 178.15 3k4p h ILE 144 N -0.92 0.31 -0.79 4.57 2.04 -1.39 0.21 117.51 121.54 3k4p h ILE 144 Ca -0.00 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.89 3k4p h ILE 144 Cb 0.68 0.31 -0.05 0.00 -0.74 0.00 0.00 36.82 37.02 3k4p h ILE 144 CO 0.01 0.00 0.50 0.00 0.00 0.00 0.00 178.15 178.66 3k4p h ALA 145 N 1.04 1.04 -0.33 1.87 0.00 -1.21 -1.68 119.26 119.98 3k4p h ALA 145 Ca 0.20 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 3k4p h ALA 145 Cb 0.49 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3k4p h ALA 145 CO -0.54 0.31 -0.02 0.77 0.00 0.00 0.00 179.25 179.77 3k4p h SER 146 N 0.98 0.60 -0.60 0.00 0.02 -0.55 0.35 113.55 114.35 3k4p h SER 146 Ca 0.32 -0.33 0.12 0.00 -0.84 0.00 0.00 61.79 61.06 3k4p h SER 146 Cb 0.01 -0.16 -0.12 0.00 0.14 0.00 0.00 62.40 62.28 3k4p h SER 146 CO -0.11 0.78 -0.23 1.23 -1.14 0.00 0.00 176.83 177.36 3k4p h GLY 147 N 0.40 0.24 1.93 -3.77 0.00 -0.49 -1.00 103.07 100.37 3k4p h GLY 147 Ca 0.09 0.29 -0.09 0.00 0.00 0.00 0.00 47.33 47.62 3k4p h GLY 147 CO 0.02 -0.23 -0.41 0.50 0.00 0.00 0.00 176.54 176.42 3k4p h LYS 148 N -0.07 0.08 0.00 4.80 1.57 -0.76 -0.43 116.57 121.76 3k4p h LYS 148 Ca 0.28 -0.04 -0.10 0.00 -1.87 0.00 0.00 60.65 58.91 3k4p h LYS 148 Cb 0.50 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 3k4p h LYS 148 CO -0.66 0.48 -0.50 0.87 -0.57 0.00 0.00 179.45 179.08 3k4p h LYS 149 N 0.07 0.00 -0.16 3.15 1.79 -0.31 -0.63 116.57 120.49 3k4p h LYS 149 Ca 0.00 0.00 -0.07 0.00 -2.18 0.00 0.00 60.65 58.41 3k4p h LYS 149 Cb 0.75 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.40 3k4p h LYS 149 CO 0.06 0.50 -0.16 0.35 -1.08 0.00 0.00 179.45 179.11 3k4p h PHE 150 N 0.00 0.47 -0.48 -1.35 3.04 -0.56 -2.55 116.94 115.52 3k4p h PHE 150 Ca -0.00 -0.14 -0.04 0.00 3.98 0.00 0.00 57.97 61.76 3k4p h PHE 150 Cb 0.97 -0.10 -0.02 0.00 2.56 0.00 0.00 35.95 39.36 3k4p h PHE 150 CO 0.00 0.78 0.11 0.82 -2.02 0.00 0.00 178.31 178.00 3k4p h ILE 151 N 0.03 1.21 0.02 1.41 2.04 -0.96 -1.20 117.51 120.06 3k4p h ILE 151 Ca 0.03 -0.74 0.03 0.00 1.00 0.00 0.00 64.86 65.17 3k4p h ILE 151 Cb 0.70 0.72 -0.04 0.00 -0.74 0.00 0.00 36.82 37.46 3k4p h ILE 151 CO 0.04 0.27 -0.23 -0.08 0.00 0.00 0.00 178.15 178.16 3k4p h GLU 152 N 0.70 -0.36 -0.38 2.37 4.81 -1.09 -0.35 114.58 120.28 3k4p h GLU 152 Ca 0.16 0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 59.30 3k4p h GLU 152 Cb 0.26 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 3k4p h GLU 152 CO -0.00 -0.24 -0.19 0.78 -0.73 0.00 0.00 179.01 178.63 3k4p h GLY 153 N -0.37 0.87 0.21 1.92 0.00 -1.10 -1.94 103.07 102.66 3k4p h GLY 153 Ca 0.06 -0.78 0.11 0.00 0.00 0.00 0.00 47.33 46.71 3k4p h GLY 153 CO -0.19 0.71 0.13 -2.75 0.00 0.00 0.00 176.54 174.44 3k4p h PHE 154 N 0.60 0.21 -0.20 5.60 3.04 -1.20 -1.88 116.94 123.10 3k4p h PHE 154 Ca 0.08 0.03 -0.12 0.00 3.98 0.00 0.00 57.97 61.95 3k4p h PHE 154 Cb 0.74 -0.00 -0.01 0.00 2.56 0.00 0.00 35.95 39.23 3k4p h PHE 154 CO 0.06 -0.02 -0.37 0.37 -2.02 0.00 0.00 178.31 176.32 3k4p h GLN 155 N 0.26 0.44 -0.19 1.11 5.75 -0.92 -1.62 115.11 119.94 3k4p h GLN 155 Ca 0.31 -0.21 -0.07 0.00 -0.15 0.00 0.00 58.65 58.53 3k4p h GLN 155 Cb 0.45 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.98 3k4p h GLN 155 CO -0.39 0.76 -0.20 0.77 -2.65 0.00 0.00 178.83 177.12 3k4p h SER 156 N 0.37 0.33 0.21 -0.69 0.02 -0.93 -2.55 113.55 110.32 3k4p h SER 156 Ca 0.04 -0.09 -0.31 0.00 -0.84 0.00 0.00 61.79 60.59 3k4p h SER 156 Cb 0.83 -0.09 0.03 0.00 0.14 0.00 0.00 62.40 63.31 3k4p h SER 156 CO 0.07 0.55 -1.31 0.74 -1.14 0.00 0.00 176.83 175.74 3k4p h THR 157 N 0.31 1.30 -0.79 -2.27 2.02 -1.13 -3.20 112.91 109.15 3k4p h THR 157 Ca 0.05 -2.57 0.04 0.00 0.77 0.00 0.00 66.41 64.70 3k4p h THR 157 Cb 0.54 2.81 -0.05 0.00 -1.74 0.00 0.00 68.15 69.70 3k4p h THR 157 CO 0.04 0.78 0.49 0.50 0.37 0.00 0.00 175.52 177.69 3k4p h LYS 158 N 0.23 0.91 0.00 6.66 3.64 -1.21 -1.31 116.57 125.48 3k4p h LYS 158 Ca -0.20 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.09 3k4p h LYS 158 Cb 1.99 -0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 33.60 3k4p h LYS 158 CO 0.25 0.60 -0.16 -0.07 -2.27 0.00 0.00 179.45 177.80 3k4p h LEU 159 N 0.94 0.00 -1.75 5.20 3.38 -1.55 -2.55 115.31 118.98 3k4p h LEU 159 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 3k4p h LEU 159 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3k4p h LEU 159 CO -0.14 0.16 0.00 0.29 0.09 0.00 0.00 178.44 178.84 3k4p n LYS 160 N -3.62 2.11 -3.66 1.13 5.02 -0.51 -4.86 118.16 113.77 3k4p n LYS 160 Ca -0.01 -1.72 -0.39 0.00 -2.02 0.00 0.00 58.31 54.17 3k4p n LYS 160 Cb 0.29 -1.39 -0.12 0.00 -0.02 0.00 0.00 35.03 33.80 3k4p n LYS 160 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3k4p s ASP 161 N -1.10 5.52 0.61 4.39 2.15 -0.96 -4.95 116.67 122.34 3k4p s ASP 161 Ca 0.33 -0.90 0.33 0.00 0.43 0.00 0.00 52.55 52.74 3k4p s ASP 161 Cb 0.17 -1.97 1.93 0.00 -0.30 0.00 0.00 42.92 42.76 3k4p s ASP 161 CO 0.23 -0.31 2.25 1.55 -0.17 0.00 0.00 175.17 178.72 3k4p h PRO 162 N 8.35 0.00 -0.11 4.34 0.13 -1.89 -1.10 132.00 141.73 3k4p h PRO 162 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 3k4p h PRO 162 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 3k4p h PRO 162 CO 0.64 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 178.95 3k4p n ARG 163 N -3.63 1.73 -2.25 0.86 1.74 -1.26 -4.94 116.66 108.90 3k4p n ARG 163 Ca -0.02 -1.08 -0.37 0.00 -0.77 0.00 0.00 57.85 55.60 3k4p n ARG 163 Cb 0.13 -1.43 -0.01 0.00 -1.02 0.00 0.00 32.46 30.13 3k4p n ARG 163 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3k4p s ALA 164 N -1.87 3.03 -0.61 7.54 0.00 -0.42 -4.88 121.76 124.54 3k4p s ALA 164 Ca 0.35 0.96 -0.24 0.00 0.00 0.00 0.00 51.96 53.02 3k4p s ALA 164 Cb 0.19 -3.39 0.05 0.00 0.00 0.00 0.00 23.12 19.97 3k4p s ALA 164 CO 0.29 -0.64 0.99 -1.14 0.00 0.00 0.00 175.76 175.27 3k4p s GLN 165 N -2.59 3.24 0.73 0.00 0.74 -0.58 -5.03 119.66 116.17 3k4p s GLN 165 Ca 0.62 -0.45 -0.10 0.00 0.05 0.00 0.00 55.36 55.48 3k4p s GLN 165 Cb -0.30 -4.13 0.05 0.00 1.10 0.00 0.00 33.01 29.74 3k4p s GLN 165 CO 0.36 -1.67 1.08 -1.25 -0.55 0.00 0.00 175.29 173.26 3k4p s PRO 166 N 4.19 2.33 -1.54 1.67 0.04 -1.26 -4.19 135.00 136.24 3k4p s PRO 166 Ca 0.28 0.06 0.00 0.00 0.04 0.00 0.00 61.00 61.38 3k4p s PRO 166 Cb -0.13 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.34 3k4p s PRO 166 CO 0.16 -1.27 0.00 0.41 0.04 0.00 0.00 177.00 176.34 3k4p n GLY 167 N -3.05 0.08 3.92 0.56 0.00 -1.26 -5.03 105.19 100.41 3k4p n GLY 167 Ca 0.07 -0.17 -0.26 0.00 0.00 0.00 0.00 46.02 45.66 3k4p n GLY 167 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3k4p s GLN 168 N -4.57 2.93 0.59 1.61 -0.21 -1.26 -5.04 119.66 113.72 3k4p s GLN 168 Ca 0.00 -0.04 -0.19 0.00 0.02 0.00 0.00 55.36 55.14 3k4p s GLN 168 Cb 0.00 -2.29 -0.03 0.00 1.00 0.00 0.00 33.01 31.68 3k4p s GLN 168 CO 0.00 -0.67 1.26 -1.54 -2.12 0.00 0.00 175.29 172.22 3k4p s SER 169 N -4.30 5.07 0.34 5.90 1.04 -1.26 -4.95 113.70 115.54 3k4p s SER 169 Ca 0.53 2.53 -0.25 0.00 0.48 0.00 0.00 55.95 59.25 3k4p s SER 169 Cb -0.10 -2.61 -0.14 0.00 0.10 0.00 0.00 66.02 63.26 3k4p s SER 169 CO 0.45 -1.69 0.59 -1.20 0.98 0.00 0.00 173.24 172.36 3k4p n SER 170 N -1.52 -0.73 -4.77 7.02 7.64 -1.26 -4.95 113.62 115.04 3k4p n SER 170 Ca 0.13 1.01 -0.38 0.00 1.01 0.00 0.00 58.87 60.64 3k4p n SER 170 Cb 0.48 -1.09 -0.03 0.00 -1.01 0.00 0.00 64.21 62.57 3k4p n SER 170 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 3k4p s PRO 171 N -1.37 4.13 0.29 1.43 0.04 -1.26 -5.04 135.00 133.21 3k4p s PRO 171 Ca 0.62 1.75 -0.06 0.00 0.04 0.00 0.00 61.00 63.35 3k4p s PRO 171 Cb -0.71 -2.68 -0.00 0.00 0.04 0.00 0.00 34.50 31.15 3k4p s PRO 171 CO 0.59 -0.23 0.44 -1.59 0.04 0.00 0.00 177.00 176.24 3k4p s LYS 172 N -2.28 1.71 -0.74 4.56 -2.85 -1.26 -5.02 119.74 113.86 3k4p s LYS 172 Ca 0.56 -1.56 -0.27 0.00 -1.00 0.00 0.00 55.97 53.70 3k4p s LYS 172 Cb -0.29 0.44 0.03 0.00 -2.06 0.00 0.00 37.83 35.95 3k4p s LYS 172 CO 0.36 -0.70 1.28 0.42 0.10 0.00 0.00 175.35 176.81 3k4p s ILE 173 N -3.51 3.73 0.18 3.79 1.01 -1.26 -4.38 121.20 120.77 3k4p s ILE 173 Ca 0.28 0.40 0.24 0.00 0.00 0.00 0.00 60.65 61.58 3k4p s ILE 173 Cb 0.00 -4.92 0.23 0.00 0.01 0.00 0.00 42.46 37.79 3k4p s ILE 173 CO 0.15 -1.85 1.85 0.44 0.00 0.00 0.00 174.94 175.53 3k4p h ASP 174 N 10.02 0.00 -2.15 3.58 3.32 -0.73 -3.41 116.42 127.06 3k4p h ASP 174 Ca -0.28 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.73 3k4p h ASP 174 Cb 1.05 0.00 -0.25 0.00 0.22 0.00 0.00 39.33 40.35 3k4p h ASP 174 CO 1.28 0.23 -0.31 -0.69 -1.72 0.00 0.00 179.24 178.03 3k4p s VAL 175 N -3.73 -0.78 -0.31 -1.35 1.01 -1.16 -5.01 120.40 109.07 3k4p s VAL 175 Ca -0.00 0.07 -0.18 0.00 0.00 0.00 0.00 61.98 61.87 3k4p s VAL 175 Cb 0.11 -0.81 -0.01 0.00 0.00 0.00 0.00 36.38 35.66 3k4p s VAL 175 CO 0.63 0.02 0.53 -0.69 0.00 0.00 0.00 175.10 175.59 3k4p s VAL 176 N 2.71 5.03 -0.17 2.92 1.01 -1.26 -1.49 120.40 129.14 3k4p s VAL 176 Ca 0.01 0.63 -0.19 0.00 0.00 0.00 0.00 61.98 62.43 3k4p s VAL 176 Cb -0.13 -3.91 -0.03 0.00 0.00 0.00 0.00 36.38 32.31 3k4p s VAL 176 CO -0.16 -0.08 0.54 -0.63 0.00 0.00 0.00 175.10 174.77 3k4p s ILE 177 N 2.39 5.11 0.39 2.22 1.01 0.11 -4.89 121.20 127.55 3k4p s ILE 177 Ca 0.21 1.02 -0.27 0.00 0.00 0.00 0.00 60.65 61.61 3k4p s ILE 177 Cb -0.15 -3.86 -0.10 0.00 0.01 0.00 0.00 42.46 38.36 3k4p s ILE 177 CO 0.12 0.20 1.39 -0.55 0.00 0.00 0.00 174.94 176.10 3k4p s SER 178 N 1.02 6.31 0.00 3.58 0.15 -1.26 0.11 113.70 123.61 3k4p s SER 178 Ca 0.26 2.85 0.23 0.00 0.70 0.00 0.00 55.95 59.99 3k4p s SER 178 Cb -0.16 -2.65 0.51 0.00 -1.71 0.00 0.00 66.02 62.01 3k4p s SER 178 CO 0.10 -0.87 1.44 -0.62 1.20 0.00 0.00 173.24 174.49 3k4p n GLU 179 N 0.29 2.20 -1.63 5.44 1.02 -1.26 -4.62 120.64 122.07 3k4p n GLU 179 Ca 0.02 -1.78 -0.38 0.00 -0.02 0.00 0.00 57.16 55.00 3k4p n GLU 179 Cb 0.41 -1.47 0.05 0.00 -0.02 0.00 0.00 31.44 30.41 3k4p n GLU 179 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3k4p n ALA 180 N 1.05 0.33 0.32 0.62 0.00 -1.26 -4.80 120.51 116.78 3k4p n ALA 180 Ca 0.17 0.04 0.20 0.00 0.00 0.00 0.00 53.44 53.85 3k4p n ALA 180 Cb 0.51 -2.14 1.06 0.00 0.00 0.00 0.00 19.45 18.89 3k4p n ALA 180 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3k4p h SER 181 N 0.67 0.00 -0.35 0.00 4.64 -1.94 0.12 113.55 116.69 3k4p h SER 181 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 3k4p h SER 181 Cb 1.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.45 3k4p h SER 181 CO 0.52 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.94 3k4p n SER 182 N -3.15 3.22 -4.67 4.97 3.41 -1.26 -4.54 113.62 111.60 3k4p n SER 182 Ca -0.02 -1.93 -0.42 0.00 -0.26 0.00 0.00 58.87 56.24 3k4p n SER 182 Cb 0.18 -0.22 -0.04 0.00 -0.26 0.00 0.00 64.21 63.87 3k4p n SER 182 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3k4p s SER 183 N -1.33 6.99 -0.44 4.04 0.15 0.40 -5.00 113.70 118.52 3k4p s SER 183 Ca 0.34 1.22 -0.27 0.00 0.70 0.00 0.00 55.95 57.93 3k4p s SER 183 Cb 0.20 -2.47 -0.03 0.00 -1.71 0.00 0.00 66.02 62.00 3k4p s SER 183 CO 0.27 -0.45 1.98 0.20 1.20 0.00 0.00 173.24 176.45 3k4p s ASN 184 N 1.17 5.35 -0.27 5.45 0.01 -1.26 -4.51 114.94 120.89 3k4p s ASN 184 Ca 0.40 1.01 0.02 0.00 -0.71 0.00 0.00 52.86 53.57 3k4p s ASN 184 Cb -0.16 -2.52 0.07 0.00 0.41 0.00 0.00 41.25 39.05 3k4p s ASN 184 CO 0.12 -2.19 -0.03 0.21 -1.51 0.00 0.00 177.10 173.70 3k4p s ASN 185 N 8.19 4.19 0.19 -1.22 3.04 -1.02 -3.92 114.94 124.40 3k4p s ASN 185 Ca 0.81 -1.46 0.26 0.00 0.04 0.00 0.00 52.86 52.51 3k4p s ASN 185 Cb -0.19 -1.33 0.86 0.00 -1.54 0.00 0.00 41.25 39.05 3k4p s ASN 185 CO 0.28 -0.27 1.79 0.35 -3.04 0.00 0.00 177.10 176.21 3k4p n THR 186 N 4.55 0.56 0.14 -5.21 -2.24 -1.24 -1.71 114.28 109.12 3k4p n THR 186 Ca -0.08 -0.22 0.02 0.00 -2.27 0.00 0.00 64.05 61.49 3k4p n THR 186 Cb 0.43 -0.62 0.08 0.00 -2.10 0.00 0.00 70.33 68.13 3k4p n THR 186 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 3k4p h LEU 187 N 0.00 0.00 -5.00 3.22 3.38 -1.94 -3.36 115.31 111.61 3k4p h LEU 187 Ca 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 3k4p h LEU 187 Cb 0.69 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.29 3k4p h LEU 187 CO 0.00 0.55 -0.19 -0.67 0.09 0.00 0.00 178.44 178.22 3k4p n ASP 188 N -3.33 -1.85 -4.76 -0.43 2.03 -1.10 -4.42 116.55 102.70 3k4p n ASP 188 Ca 0.01 -1.66 -0.38 0.00 0.52 0.00 0.00 54.79 53.28 3k4p n ASP 188 Cb 0.71 0.98 0.02 0.00 -0.72 0.00 0.00 41.12 42.12 3k4p n ASP 188 CO 0.00 0.00 0.00 -2.84 -1.92 0.00 0.00 177.20 172.44 3k4p s PRO 189 N 0.72 3.33 -0.02 -0.67 0.02 -0.70 -4.84 135.00 132.84 3k4p s PRO 189 Ca 0.26 2.08 0.03 0.00 0.02 0.00 0.00 61.00 63.39 3k4p s PRO 189 Cb 0.14 -2.29 0.05 0.00 0.02 0.00 0.00 34.50 32.41 3k4p s PRO 189 CO -0.10 -0.99 0.90 0.41 -0.33 0.00 0.00 177.00 176.88 3k4p n GLY 190 N 0.63 1.53 0.15 0.52 0.00 -1.26 -4.81 105.19 101.95 3k4p n GLY 190 Ca 0.09 -0.20 0.06 0.00 0.00 0.00 0.00 46.02 45.98 3k4p n GLY 190 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3k4p n THR 191 N -0.49 0.00 -2.66 2.61 -2.24 -1.26 -4.82 114.28 105.42 3k4p n THR 191 Ca 0.03 -0.28 -0.42 0.00 -2.27 0.00 0.00 64.05 61.10 3k4p n THR 191 Cb 0.43 1.08 -0.02 0.00 -2.10 0.00 0.00 70.33 69.72 3k4p n THR 191 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k4p h THR 193 N 5.98 0.21 -0.77 0.00 2.02 -1.88 0.25 112.91 118.73 3k4p h THR 193 Ca 0.30 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.44 3k4p h THR 193 Cb 0.94 0.21 -0.03 0.00 -1.74 0.00 0.00 68.15 67.53 3k4p h THR 193 CO 1.38 0.00 0.34 0.58 0.37 0.00 0.00 175.52 178.19 3k4p h VAL 194 N -0.00 1.25 -0.46 3.16 2.07 -1.67 -2.50 116.25 118.10 3k4p h VAL 194 Ca 0.37 -0.75 -0.10 0.00 0.82 0.00 0.00 66.70 67.05 3k4p h VAL 194 Cb 0.57 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 3k4p h VAL 194 CO -0.81 0.31 -0.10 0.15 0.02 0.00 0.00 177.57 177.15 3k4p h PHE 195 N 1.10 0.99 -0.19 1.57 3.57 -1.35 -2.44 116.94 120.19 3k4p h PHE 195 Ca 0.26 -0.21 0.05 0.00 3.53 0.00 0.00 57.97 61.61 3k4p h PHE 195 Cb 0.17 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.66 3k4p h PHE 195 CO 0.01 0.97 0.14 0.93 -2.23 0.00 0.00 178.31 178.13 3k4p h GLU 196 N 0.72 0.00 0.00 1.11 4.39 -0.68 -2.43 114.58 117.70 3k4p h GLU 196 Ca 0.12 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.73 3k4p h GLU 196 Cb 0.64 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.27 3k4p h GLU 196 CO 0.04 0.00 -0.97 -0.44 -1.16 0.00 0.00 179.01 176.48 3k4p h ASP 197 N 0.00 0.00 -1.61 1.42 5.19 -1.12 -3.48 116.42 116.82 3k4p h ASP 197 Ca 0.09 0.00 -0.64 0.00 -0.62 0.00 0.00 57.03 55.86 3k4p h ASP 197 Cb 0.36 0.00 0.13 0.00 0.18 0.00 0.00 39.33 40.00 3k4p h ASP 197 CO -0.00 0.35 -0.53 -0.24 -3.12 0.00 0.00 179.24 175.70 3k4p n SER 198 N -2.92 -1.28 -0.07 6.45 2.88 -0.92 -4.93 113.62 112.82 3k4p n SER 198 Ca -0.03 1.01 0.01 0.00 -1.33 0.00 0.00 58.87 58.54 3k4p n SER 198 Cb 0.71 -1.01 0.02 0.00 -0.75 0.00 0.00 64.21 63.18 3k4p n SER 198 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 3k4p n GLU 199 N 0.97 1.39 -0.16 -1.46 1.02 -1.26 -4.84 120.64 116.30 3k4p n GLU 199 Ca 0.14 -1.27 -0.04 0.00 -0.02 0.00 0.00 57.16 55.97 3k4p n GLU 199 Cb 0.32 -0.85 0.05 0.00 -0.02 0.00 0.00 31.44 30.95 3k4p n GLU 199 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3k4p h LEU 200 N 0.00 0.34 -0.10 -4.62 5.85 -1.92 -2.65 115.31 112.21 3k4p h LEU 200 Ca 0.00 0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.79 3k4p h LEU 200 Cb 0.85 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.80 3k4p h LEU 200 CO 0.00 0.23 -0.23 0.00 -0.34 0.00 0.00 178.44 178.10 3k4p h ALA 201 N 1.28 -0.24 -0.63 1.25 0.00 -1.89 -1.66 119.26 117.38 3k4p h ALA 201 Ca 0.22 0.03 0.13 0.00 0.00 0.00 0.00 54.91 55.29 3k4p h ALA 201 Cb 0.15 0.44 -0.11 0.00 0.00 0.00 0.00 17.79 18.27 3k4p h ALA 201 CO -0.17 -0.71 -0.05 -0.44 0.00 0.00 0.00 179.25 177.89 3k4p h ASP 202 N -0.32 -0.38 0.25 0.00 3.32 -1.90 0.14 116.42 117.53 3k4p h ASP 202 Ca 0.09 0.17 -0.00 0.00 0.02 0.00 0.00 57.03 57.31 3k4p h ASP 202 Cb 0.45 0.32 -0.01 0.00 0.22 0.00 0.00 39.33 40.30 3k4p h ASP 202 CO -0.28 -0.15 -0.22 0.74 -1.72 0.00 0.00 179.24 177.61 3k4p h THR 203 N 0.07 0.53 -0.89 0.35 2.02 -1.02 -0.19 112.91 113.79 3k4p h THR 203 Ca 0.32 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.58 3k4p h THR 203 Cb 0.53 0.53 -0.06 0.00 -1.74 0.00 0.00 68.15 67.41 3k4p h THR 203 CO -0.58 0.00 0.58 0.58 0.37 0.00 0.00 175.52 176.47 3k4p h VAL 204 N -0.49 1.04 0.09 3.16 2.07 -0.87 0.90 116.25 122.16 3k4p h VAL 204 Ca -0.01 -0.33 -0.00 0.00 0.82 0.00 0.00 66.70 67.17 3k4p h VAL 204 Cb 0.44 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 3k4p h VAL 204 CO -0.03 0.18 -0.04 -0.08 0.02 0.00 0.00 177.57 177.61 3k4p h GLU 205 N 0.98 -0.12 0.11 1.57 4.81 -0.05 -0.03 114.58 121.84 3k4p h GLU 205 Ca 0.39 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.62 3k4p h GLU 205 Cb 0.25 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.65 3k4p h GLU 205 CO -0.15 0.03 -0.05 0.00 -0.73 0.00 0.00 179.01 178.11 3k4p h ALA 206 N 0.64 -0.14 -0.46 2.92 0.00 -0.60 -0.67 119.26 120.96 3k4p h ALA 206 Ca -0.01 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 54.89 3k4p h ALA 206 Cb 0.21 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.00 3k4p h ALA 206 CO 0.02 -0.54 0.14 -0.91 0.00 0.00 0.00 179.25 177.96 3k4p h ASN 207 N -0.23 0.11 1.03 0.00 4.21 -0.75 -2.35 115.58 117.61 3k4p h ASN 207 Ca -0.01 0.06 -0.14 0.00 1.21 0.00 0.00 56.30 57.42 3k4p h ASN 207 Cb 0.19 0.06 -0.02 0.00 -1.12 0.00 0.00 38.32 37.43 3k4p h ASN 207 CO 0.02 0.09 -0.65 0.15 -1.29 0.00 0.00 177.43 175.76 3k4p h PHE 208 N 0.29 0.00 0.00 1.19 3.57 -0.94 -2.88 116.94 118.18 3k4p h PHE 208 Ca 0.22 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.70 3k4p h PHE 208 Cb 0.24 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.98 3k4p h PHE 208 CO -0.18 0.65 -0.11 1.79 -2.23 0.00 0.00 178.31 178.23 3k4p h THR 209 N 0.00 0.27 0.00 4.41 1.35 -0.85 -2.77 112.91 115.32 3k4p h THR 209 Ca -0.01 -0.79 0.00 0.00 -0.55 0.00 0.00 66.41 65.06 3k4p h THR 209 Cb 1.34 1.62 0.00 0.00 -1.73 0.00 0.00 68.15 69.38 3k4p h THR 209 CO 0.08 0.10 0.00 0.00 -0.25 0.00 0.00 175.52 175.46 3k4p h ALA 210 N 1.89 1.00 0.00 6.62 0.00 -1.19 -1.90 119.26 125.68 3k4p h ALA 210 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3k4p h ALA 210 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.41 3k4p h ALA 210 CO 0.01 0.00 -0.40 0.25 0.00 0.00 0.00 179.25 179.11 3k4p n THR 211 N -2.36 0.10 0.00 0.00 -2.24 -1.04 -4.67 114.28 104.06 3k4p n THR 211 Ca 0.04 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 3k4p n THR 211 Cb 0.35 -0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.56 3k4p n THR 211 CO 0.00 0.00 0.00 2.22 -0.57 0.00 0.00 175.07 176.72 3k4p n PHE 212 N -1.65 0.00 -0.13 4.78 -1.74 -1.17 -4.92 117.46 112.63 3k4p n PHE 212 Ca 0.05 0.00 -0.07 0.00 -0.56 0.00 0.00 57.45 56.87 3k4p n PHE 212 Cb 0.36 0.00 0.09 0.00 1.52 0.00 0.00 39.48 41.45 3k4p n PHE 212 CO 0.00 0.00 0.00 0.28 -0.56 0.00 0.00 176.76 176.48 3k4p h VAL 213 N 0.00 1.26 -0.85 1.97 2.07 -1.63 -3.34 116.25 115.73 3k4p h VAL 213 Ca 0.00 -1.20 0.14 0.00 0.82 0.00 0.00 66.70 66.46 3k4p h VAL 213 Cb 0.00 1.01 -0.09 0.00 -1.52 0.00 0.00 31.29 30.68 3k4p h VAL 213 CO 0.00 0.42 0.44 -0.65 0.02 0.00 0.00 177.57 177.80 3k4p h PRO 214 N 0.78 0.62 0.00 1.57 0.11 -1.83 -0.16 132.00 133.09 3k4p h PRO 214 Ca 0.13 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.20 3k4p h PRO 214 Cb 0.61 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.58 3k4p h PRO 214 CO 0.04 0.41 -0.01 0.77 -0.21 0.00 0.00 178.00 179.01 3k4p h SER 215 N 0.64 0.00 0.02 -2.05 0.02 -1.95 -1.13 113.55 109.10 3k4p h SER 215 Ca 0.46 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 61.27 3k4p h SER 215 Cb 0.64 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.17 3k4p h SER 215 CO -0.35 0.01 -0.74 0.40 -1.14 0.00 0.00 176.83 175.00 3k4p h ILE 216 N 0.00 1.32 -0.69 3.27 2.04 -1.26 -2.92 117.51 119.27 3k4p h ILE 216 Ca -0.00 -2.30 0.14 0.00 1.00 0.00 0.00 64.86 63.70 3k4p h ILE 216 Cb 0.01 2.82 -0.13 0.00 -0.74 0.00 0.00 36.82 38.78 3k4p h ILE 216 CO 0.00 0.51 -0.16 -0.09 0.00 0.00 0.00 178.15 178.41 3k4p h ARG 217 N -0.87 0.00 0.47 2.37 2.43 -0.99 0.25 114.38 118.04 3k4p h ARG 217 Ca -0.19 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 58.97 3k4p h ARG 217 Cb 1.26 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.79 3k4p h ARG 217 CO -0.07 0.00 -0.37 0.37 -1.51 0.00 0.00 179.97 178.39 3k4p h GLN 218 N 0.00 -0.80 -0.45 0.20 4.15 -1.29 -0.11 115.11 116.81 3k4p h GLN 218 Ca 0.33 0.05 0.08 0.00 0.77 0.00 0.00 58.65 59.89 3k4p h GLN 218 Cb 0.51 0.18 -0.07 0.00 0.21 0.00 0.00 27.48 28.31 3k4p h GLN 218 CO -0.70 -0.53 0.01 -0.09 -1.93 0.00 0.00 178.83 175.59 3k4p h ARG 219 N -0.83 0.12 -0.44 1.69 2.43 -1.24 0.17 114.38 116.29 3k4p h ARG 219 Ca -0.05 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.07 3k4p h ARG 219 Cb 0.71 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.21 3k4p h ARG 219 CO -0.00 0.08 0.07 -0.07 -1.51 0.00 0.00 179.97 178.54 3k4p h LEU 220 N 0.13 0.63 -0.60 3.80 3.38 -0.23 -0.91 115.31 121.51 3k4p h LEU 220 Ca 0.22 -0.11 -0.15 0.00 0.09 0.00 0.00 57.88 57.93 3k4p h LEU 220 Cb 0.32 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 3k4p h LEU 220 CO -0.36 0.65 -0.67 -0.33 0.09 0.00 0.00 178.44 177.82 3k4p h GLU 221 N 0.65 0.16 -0.36 1.13 5.08 0.00 -1.48 114.58 119.75 3k4p h GLU 221 Ca 0.14 -0.12 -0.03 0.00 -1.00 0.00 0.00 59.36 58.35 3k4p h GLU 221 Cb 0.30 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 3k4p h GLU 221 CO 0.00 0.77 0.10 -0.97 -1.00 0.00 0.00 179.01 177.92 3k4p h ASN 222 N 0.11 0.54 1.08 1.42 -0.73 -0.14 -3.22 115.58 114.64 3k4p h ASN 222 Ca -0.01 -0.21 -0.19 0.00 1.87 0.00 0.00 56.30 57.75 3k4p h ASN 222 Cb 1.20 -0.14 -0.03 0.00 0.27 0.00 0.00 38.32 39.62 3k4p h ASN 222 CO 0.10 0.61 -0.94 0.44 -0.37 0.00 0.00 177.43 177.27 3k4p h ASP 223 N 0.44 0.00 -3.23 1.15 3.32 -1.14 -3.37 116.42 113.58 3k4p h ASP 223 Ca 0.12 0.00 -0.70 0.00 0.02 0.00 0.00 57.03 56.47 3k4p h ASP 223 Cb 0.27 0.00 -0.36 0.00 0.22 0.00 0.00 39.33 39.46 3k4p h ASP 223 CO -0.00 0.88 -0.10 0.18 -1.72 0.00 0.00 179.24 178.47 3k4p n LEU 224 N -3.29 4.22 -4.67 1.55 4.77 -0.56 -4.77 117.00 114.23 3k4p n LEU 224 Ca -0.01 -5.16 -0.46 0.00 -0.03 0.00 0.00 56.01 50.36 3k4p n LEU 224 Cb 0.90 -1.07 -0.04 0.00 -2.33 0.00 0.00 43.42 40.88 3k4p n LEU 224 CO 0.45 1.60 1.54 -1.20 -1.33 0.00 0.00 177.39 178.45 3k4p n SER 225 N 2.17 3.74 0.00 -1.43 7.64 -1.25 -2.28 113.62 122.21 3k4p n SER 225 Ca 0.22 0.95 0.00 0.00 1.01 0.00 0.00 58.87 61.05 3k4p n SER 225 Cb 0.37 -1.44 0.00 0.00 -1.01 0.00 0.00 64.21 62.13 3k4p n SER 225 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3k4p n GLY 226 N 4.46 0.97 3.87 0.23 0.00 -1.26 -1.38 105.19 112.08 3k4p n GLY 226 Ca 0.21 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.87 3k4p n GLY 226 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k4p s VAL 227 N -2.03 5.47 -0.06 1.61 1.01 -0.97 -4.57 120.40 120.87 3k4p s VAL 227 Ca 0.00 0.19 0.03 0.00 0.00 0.00 0.00 61.98 62.20 3k4p s VAL 227 Cb 0.00 -3.38 0.01 0.00 0.00 0.00 0.00 36.38 33.01 3k4p s VAL 227 CO 0.00 0.62 -0.12 0.42 0.00 0.00 0.00 175.10 176.02 3k4p s THR 228 N -1.01 1.11 -0.01 3.92 -4.23 -1.26 -4.77 115.64 109.38 3k4p s THR 228 Ca 0.15 -0.49 0.06 0.00 -1.18 0.00 0.00 61.69 60.23 3k4p s THR 228 Cb -0.12 -1.01 -0.01 0.00 1.34 0.00 0.00 72.50 72.70 3k4p s THR 228 CO 0.04 0.35 -0.18 -0.76 -0.54 0.00 0.00 174.62 173.52 3k4p s LEU 229 N 0.52 2.03 0.33 4.79 1.43 -1.26 -5.10 118.68 121.43 3k4p s LEU 229 Ca -0.12 -0.33 -0.09 0.00 -1.03 0.00 0.00 54.13 52.57 3k4p s LEU 229 Cb -0.14 -0.94 -0.06 0.00 0.03 0.00 0.00 46.19 45.07 3k4p s LEU 229 CO 0.03 0.22 0.65 0.42 0.23 0.00 0.00 176.35 177.91 3k4p s THR 230 N -0.42 4.89 0.37 5.49 -4.23 -1.26 -4.98 115.64 115.49 3k4p s THR 230 Ca 0.07 0.41 0.17 0.00 -1.18 0.00 0.00 61.69 61.16 3k4p s THR 230 Cb -0.07 -3.71 0.37 0.00 1.34 0.00 0.00 72.50 70.43 3k4p s THR 230 CO -0.01 -0.35 1.71 0.44 -0.54 0.00 0.00 174.62 175.87 3k4p h ASP 231 N 1.68 0.50 -0.51 3.99 3.32 -1.99 0.87 116.42 124.28 3k4p h ASP 231 Ca -0.47 0.13 -0.09 0.00 0.02 0.00 0.00 57.03 56.62 3k4p h ASP 231 Cb 1.18 0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.78 3k4p h ASP 231 CO 0.66 0.00 -0.03 0.74 -1.72 0.00 0.00 179.24 178.89 3k4p h THR 232 N 0.39 1.27 -0.42 0.35 2.02 -2.00 -1.12 112.91 113.39 3k4p h THR 232 Ca 0.67 -1.14 -0.03 0.00 0.77 0.00 0.00 66.41 66.69 3k4p h THR 232 Cb 1.61 0.98 -0.02 0.00 -1.74 0.00 0.00 68.15 68.98 3k4p h THR 232 CO -0.43 0.40 0.15 -0.33 0.37 0.00 0.00 175.52 175.68 3k4p h GLU 233 N 0.78 0.60 -0.57 6.66 5.08 -1.24 -1.06 114.58 124.83 3k4p h GLU 233 Ca 0.14 -0.09 -0.06 0.00 -1.00 0.00 0.00 59.36 58.35 3k4p h GLU 233 Cb 0.56 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 3k4p h GLU 233 CO 0.03 0.51 0.11 0.28 -1.00 0.00 0.00 179.01 178.95 3k4p h VAL 234 N 0.60 1.25 -0.03 3.13 2.07 -0.51 -1.47 116.25 121.30 3k4p h VAL 234 Ca 0.14 -0.94 -0.03 0.00 0.82 0.00 0.00 66.70 66.69 3k4p h VAL 234 Cb 0.15 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 3k4p h VAL 234 CO -0.01 0.34 -0.14 0.71 0.02 0.00 0.00 177.57 178.49 3k4p h THR 235 N 0.83 1.12 -0.01 2.57 1.35 -0.46 -2.24 112.91 116.06 3k4p h THR 235 Ca 0.17 -0.55 0.00 0.00 -0.55 0.00 0.00 66.41 65.48 3k4p h THR 235 Cb 0.39 1.26 -0.00 0.00 -1.73 0.00 0.00 68.15 68.07 3k4p h THR 235 CO 0.01 0.16 0.01 1.88 -0.25 0.00 0.00 175.52 177.32 3k4p h TYR 236 N 0.04 0.01 -0.16 4.73 0.05 -0.46 0.49 116.97 121.67 3k4p h TYR 236 Ca 0.01 0.00 0.05 0.00 0.05 0.00 0.00 58.73 58.83 3k4p h TYR 236 Cb 0.28 -0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.01 3k4p h TYR 236 CO 0.00 0.01 0.12 -0.07 -1.05 0.00 0.00 178.16 177.17 3k4p h LEU 237 N 0.00 0.00 -0.09 3.88 3.38 -1.06 -0.10 115.31 121.33 3k4p h LEU 237 Ca 0.00 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 3k4p h LEU 237 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 3k4p h LEU 237 CO -0.00 0.00 -0.38 0.24 0.09 0.00 0.00 178.44 178.39 3k4p h MET 238 N 0.00 0.41 -0.82 1.13 2.86 -0.81 -3.21 114.93 114.49 3k4p h MET 238 Ca 0.08 -0.33 0.15 0.00 -2.06 0.00 0.00 59.70 57.53 3k4p h MET 238 Cb 0.32 0.07 -0.09 0.00 0.06 0.00 0.00 31.60 31.95 3k4p h MET 238 CO -0.00 0.96 0.40 -0.44 1.06 0.00 0.00 176.91 178.89 3k4p h ASP 239 N -0.04 0.45 -0.01 1.22 3.32 0.90 -1.81 116.42 120.45 3k4p h ASP 239 Ca -0.02 0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.13 3k4p h ASP 239 Cb 1.03 0.03 -0.00 0.00 0.22 0.00 0.00 39.33 40.61 3k4p h ASP 239 CO 0.08 0.18 0.01 0.24 -1.72 0.00 0.00 179.24 178.03 3k4p h MET 240 N 0.56 0.00 -0.23 3.56 2.86 -1.06 -2.14 114.93 118.49 3k4p h MET 240 Ca 0.45 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 58.02 3k4p h MET 240 Cb 0.66 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.30 3k4p h MET 240 CO -0.38 0.00 -0.17 0.00 1.06 0.00 0.00 176.91 177.42 3k4p h SER 242 N 0.36 -0.45 -0.85 0.00 0.87 -1.50 -3.13 113.55 108.85 3k4p h SER 242 Ca 0.06 -0.09 -0.03 0.00 -1.23 0.00 0.00 61.79 60.51 3k4p h SER 242 Cb 0.51 0.12 -0.04 0.00 -0.44 0.00 0.00 62.40 62.55 3k4p h SER 242 CO 0.03 -0.01 0.43 -0.26 -0.53 0.00 0.00 176.83 176.49 3k4p h PHE 243 N -1.04 1.20 0.00 2.24 0.04 -1.44 -1.58 116.94 116.35 3k4p h PHE 243 Ca -0.05 -0.05 -0.03 0.00 2.80 0.00 0.00 57.97 60.64 3k4p h PHE 243 Cb 0.51 -0.38 -0.00 0.00 2.20 0.00 0.00 35.95 38.28 3k4p h PHE 243 CO 0.02 0.86 -0.13 0.22 -0.60 0.00 0.00 178.31 178.67 3k4p h ASP 244 N 1.20 0.00 0.15 2.17 3.58 -0.84 -2.71 116.42 119.97 3k4p h ASP 244 Ca 0.29 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.74 3k4p h ASP 244 Cb 0.09 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.14 3k4p h ASP 244 CO -0.04 0.13 -0.07 0.74 -2.88 0.00 0.00 179.24 177.12 3k4p h THR 245 N 0.00 0.00 -0.42 2.25 2.02 -1.26 -3.40 112.91 112.10 3k4p h THR 245 Ca -0.00 -0.55 0.00 0.00 0.77 0.00 0.00 66.41 66.63 3k4p h THR 245 Cb 0.72 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.13 3k4p h THR 245 CO 0.02 0.00 0.00 2.30 0.37 0.00 0.00 175.52 178.21 3k4p n ILE 246 N -4.10 0.91 0.42 3.11 -5.35 -0.71 -3.40 119.36 110.24 3k4p n ILE 246 Ca -0.03 -0.67 0.10 0.00 -0.27 0.00 0.00 62.75 61.89 3k4p n ILE 246 Cb 0.08 0.10 -0.15 0.00 -1.74 0.00 0.00 39.64 37.94 3k4p n ILE 246 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 3k4p n SER 247 N 0.67 0.48 -4.49 7.28 7.64 -1.02 -4.71 113.62 119.47 3k4p n SER 247 Ca 0.15 -0.43 -0.24 0.00 1.01 0.00 0.00 58.87 59.36 3k4p n SER 247 Cb 0.51 1.56 -0.01 0.00 -1.01 0.00 0.00 64.21 65.25 3k4p n SER 247 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 3k4p n THR 248 N -1.92 0.00 -0.32 0.44 5.66 -1.22 -4.87 114.28 112.05 3k4p n THR 248 Ca -0.01 -1.98 0.14 0.00 -3.05 0.00 0.00 64.05 59.16 3k4p n THR 248 Cb 0.46 0.02 0.29 0.00 -1.55 0.00 0.00 70.33 69.55 3k4p n THR 248 CO 0.00 0.00 0.00 -1.28 -3.05 0.00 0.00 175.07 170.74 3k4p h SER 249 N 0.68 -0.32 0.00 1.09 0.87 -1.96 -2.88 113.55 111.03 3k4p h SER 249 Ca -0.32 0.25 0.00 0.00 -1.23 0.00 0.00 61.79 60.49 3k4p h SER 249 Cb 1.13 0.42 0.00 0.00 -0.44 0.00 0.00 62.40 63.51 3k4p h SER 249 CO 0.51 -0.30 0.00 0.35 -0.53 0.00 0.00 176.83 176.86 3k4p n THR 250 N -5.41 0.00 -0.32 2.23 -2.24 -1.26 -4.26 114.28 103.02 3k4p n THR 250 Ca 0.23 0.00 0.22 0.00 -2.27 0.00 0.00 64.05 62.23 3k4p n THR 250 Cb 0.74 -0.06 0.44 0.00 -2.10 0.00 0.00 70.33 69.35 3k4p n THR 250 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 3k4p h VAL 251 N 0.00 0.19 0.00 2.28 3.04 -1.61 0.16 116.25 120.31 3k4p h VAL 251 Ca 0.00 -0.06 0.00 0.00 -1.01 0.00 0.00 66.70 65.63 3k4p h VAL 251 Cb 0.04 -0.00 0.00 0.00 -2.01 0.00 0.00 31.29 29.32 3k4p h VAL 251 CO 0.00 0.03 -1.21 0.47 -1.01 0.00 0.00 177.57 175.85 3k4p n ASP 252 N -5.20 0.64 -0.11 3.17 8.00 -1.26 -4.62 116.55 117.16 3k4p n ASP 252 Ca 0.30 0.19 -0.15 0.00 0.71 0.00 0.00 54.79 55.84 3k4p n ASP 252 Cb 0.97 0.81 -0.10 0.00 -0.02 0.00 0.00 41.12 42.78 3k4p n ASP 252 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3k4p n THR 253 N -2.49 1.23 -4.66 -3.53 -2.24 0.46 -4.96 114.28 98.08 3k4p n THR 253 Ca -0.01 -0.46 -0.24 0.00 -2.27 0.00 0.00 64.05 61.07 3k4p n THR 253 Cb 0.54 -1.29 -0.16 0.00 -2.10 0.00 0.00 70.33 67.32 3k4p n THR 253 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3k4p s LYS 254 N -2.43 1.57 0.26 -0.78 1.02 -0.61 -5.13 119.74 113.64 3k4p s LYS 254 Ca -0.29 -0.48 -0.30 0.00 0.02 0.00 0.00 55.97 54.92 3k4p s LYS 254 Cb 0.08 -1.36 -0.09 0.00 -0.52 0.00 0.00 37.83 35.94 3k4p s LYS 254 CO 0.49 0.15 1.13 -1.17 -0.92 0.00 0.00 175.35 175.04 3k4p s LEU 255 N 0.24 4.52 0.48 3.17 2.96 -1.26 -4.64 118.68 124.15 3k4p s LEU 255 Ca -0.07 2.29 -0.22 0.00 -0.22 0.00 0.00 54.13 55.91 3k4p s LEU 255 Cb -0.12 -3.62 -0.09 0.00 0.50 0.00 0.00 46.19 42.86 3k4p s LEU 255 CO 0.02 -0.22 0.91 -0.24 -1.32 0.00 0.00 176.35 175.50 3k4p n SER 256 N 1.47 0.72 0.20 3.68 2.88 -1.26 -4.88 113.62 116.42 3k4p n SER 256 Ca 0.00 0.93 0.06 0.00 -1.33 0.00 0.00 58.87 58.53 3k4p n SER 256 Cb 0.45 -1.33 0.54 0.00 -0.75 0.00 0.00 64.21 63.12 3k4p n SER 256 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3k4p h PRO 257 N 1.07 0.10 -0.91 -1.46 0.11 -1.94 -2.47 132.00 126.51 3k4p h PRO 257 Ca -0.45 -0.01 0.20 0.00 0.11 0.00 0.00 66.00 65.84 3k4p h PRO 257 Cb 1.36 -0.02 -0.07 0.00 0.11 0.00 0.00 31.00 32.38 3k4p h PRO 257 CO 0.54 0.15 0.59 0.74 -0.21 0.00 0.00 178.00 179.81 3k4p h PHE 258 N 0.10 0.60 -0.06 0.65 0.04 -1.90 -2.37 116.94 114.01 3k4p h PHE 258 Ca 0.03 0.02 -0.06 0.00 2.80 0.00 0.00 57.97 60.76 3k4p h PHE 258 Cb 0.13 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 38.08 3k4p h PHE 258 CO 0.00 0.16 -0.22 0.00 -0.60 0.00 0.00 178.31 177.65 3k4p n ASP 260 N -4.24 0.63 0.00 0.00 2.03 -0.89 -2.81 116.55 111.27 3k4p n ASP 260 Ca -0.02 0.58 0.10 0.00 0.52 0.00 0.00 54.79 55.97 3k4p n ASP 260 Cb 0.30 -0.74 0.47 0.00 -0.72 0.00 0.00 41.12 40.43 3k4p n ASP 260 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 3k4p n LEU 261 N -2.11 0.00 -4.27 -2.67 4.77 -1.07 -4.74 117.00 106.90 3k4p n LEU 261 Ca 0.05 0.39 -0.20 0.00 -0.03 0.00 0.00 56.01 56.22 3k4p n LEU 261 Cb 0.36 -0.39 -0.12 0.00 -2.33 0.00 0.00 43.42 40.94 3k4p n LEU 261 CO 0.27 -0.12 -0.47 -0.36 -1.33 0.00 0.00 177.39 175.37 3k4p s PHE 262 N -2.78 1.59 0.49 -1.77 0.08 -1.12 -5.04 117.98 109.42 3k4p s PHE 262 Ca 0.15 -0.49 -0.01 0.00 0.12 0.00 0.00 56.93 56.69 3k4p s PHE 262 Cb 0.13 -0.83 0.00 0.00 -0.57 0.00 0.00 43.02 41.75 3k4p s PHE 262 CO 0.34 0.20 0.74 0.95 -0.10 0.00 0.00 175.22 177.35 3k4p s THR 263 N -1.79 3.86 0.16 0.64 -4.23 -1.26 -4.90 115.64 108.12 3k4p s THR 263 Ca 0.09 -0.36 -0.22 0.00 -1.18 0.00 0.00 61.69 60.03 3k4p s THR 263 Cb -0.07 -3.46 0.06 0.00 1.34 0.00 0.00 72.50 70.38 3k4p s THR 263 CO 0.04 -0.36 1.62 -0.74 -0.54 0.00 0.00 174.62 174.64 3k4p h HIS 264 N 0.22 -0.69 -0.89 3.99 2.76 -1.95 0.32 115.15 118.91 3k4p h HIS 264 Ca -0.46 0.05 -0.00 0.00 -2.20 0.00 0.00 60.37 57.76 3k4p h HIS 264 Cb 1.25 0.36 -0.04 0.00 1.55 0.00 0.00 27.41 30.53 3k4p h HIS 264 CO 0.46 -0.33 0.56 0.22 -1.30 0.00 0.00 177.93 177.53 3k4p h ASP 265 N -0.22 1.05 -0.86 3.26 1.82 -1.98 0.34 116.42 119.84 3k4p h ASP 265 Ca 0.17 -0.05 -0.00 0.00 -0.39 0.00 0.00 57.03 56.76 3k4p h ASP 265 Cb 0.48 -0.27 -0.04 0.00 0.68 0.00 0.00 39.33 40.19 3k4p h ASP 265 CO -0.47 0.79 0.53 -0.33 -1.61 0.00 0.00 179.24 178.15 3k4p h GLU 266 N 1.22 1.16 -0.96 0.28 5.08 -1.68 -1.74 114.58 117.94 3k4p h GLU 266 Ca 0.32 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.58 3k4p h GLU 266 Cb -0.08 -0.25 -0.05 0.00 0.50 0.00 0.00 28.75 28.87 3k4p h GLU 266 CO -0.06 0.80 0.59 -1.49 -1.00 0.00 0.00 179.01 177.84 3k4p h TRP 267 N 1.18 1.26 -0.68 4.33 4.06 0.33 -2.05 115.95 124.37 3k4p h TRP 267 Ca 0.31 0.00 0.06 0.00 2.06 0.00 0.00 58.89 61.33 3k4p h TRP 267 Cb -0.07 -0.41 -0.06 0.00 -1.00 0.00 0.00 29.16 27.62 3k4p h TRP 267 CO 0.00 0.83 0.37 0.82 -3.56 0.00 0.00 178.44 176.91 3k4p h ILE 268 N 1.32 0.95 -0.15 1.49 2.04 -0.02 0.14 117.51 123.28 3k4p h ILE 268 Ca 0.35 -0.23 -0.02 0.00 1.00 0.00 0.00 64.86 65.95 3k4p h ILE 268 Cb -0.07 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.21 3k4p h ILE 268 CO -0.07 0.12 0.02 0.78 0.00 0.00 0.00 178.15 179.01 3k4p h ASN 269 N 0.68 0.25 -0.43 1.72 2.35 -1.30 -2.11 115.58 116.75 3k4p h ASN 269 Ca 0.31 -0.27 0.09 0.00 -0.55 0.00 0.00 56.30 55.88 3k4p h ASN 269 Cb 0.22 -0.07 -0.09 0.00 0.05 0.00 0.00 38.32 38.43 3k4p h ASN 269 CO -0.20 0.46 -0.27 0.22 -1.65 0.00 0.00 177.43 175.99 3k4p h TYR 270 N 0.03 -0.72 -0.46 1.19 3.20 -0.62 0.39 116.97 119.98 3k4p h TYR 270 Ca 0.05 0.05 0.08 0.00 3.14 0.00 0.00 58.73 62.05 3k4p h TYR 270 Cb 0.32 0.38 -0.06 0.00 1.54 0.00 0.00 36.73 38.91 3k4p h TYR 270 CO 0.02 -0.34 0.08 0.22 -1.64 0.00 0.00 178.16 176.51 3k4p h ASP 271 N -0.19 -0.01 -0.60 -2.11 3.58 -0.93 -1.80 116.42 114.36 3k4p h ASP 271 Ca 0.20 0.08 -0.10 0.00 0.42 0.00 0.00 57.03 57.63 3k4p h ASP 271 Cb 0.50 0.12 -0.02 0.00 1.72 0.00 0.00 39.33 41.65 3k4p h ASP 271 CO -0.54 0.03 0.00 0.22 -2.88 0.00 0.00 179.24 176.07 3k4p h TYR 272 N 0.22 1.16 -0.67 0.28 3.20 -0.51 -0.45 116.97 120.19 3k4p h TYR 272 Ca 0.23 -0.20 0.14 0.00 3.14 0.00 0.00 58.73 62.04 3k4p h TYR 272 Cb 0.30 -0.30 -0.10 0.00 1.54 0.00 0.00 36.73 38.17 3k4p h TYR 272 CO -0.22 1.02 0.12 1.25 -1.64 0.00 0.00 178.16 178.69 3k4p h LEU 273 N 0.96 -0.06 -0.49 2.82 5.85 0.29 -0.32 115.31 124.36 3k4p h LEU 273 Ca 0.17 0.14 -0.09 0.00 0.84 0.00 0.00 57.88 58.94 3k4p h LEU 273 Cb 0.56 0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.77 3k4p h LEU 273 CO 0.03 -0.04 -0.03 1.56 -0.34 0.00 0.00 178.44 179.62 3k4p h GLN 274 N 0.23 0.88 -0.99 1.25 1.08 -0.31 -1.08 115.11 116.17 3k4p h GLN 274 Ca 0.36 -0.30 0.10 0.00 -1.45 0.00 0.00 58.65 57.36 3k4p h GLN 274 Cb 0.59 -0.07 -0.08 0.00 -0.05 0.00 0.00 27.48 27.88 3k4p h GLN 274 CO -0.48 0.94 0.64 0.77 -0.95 0.00 0.00 178.83 179.74 3k4p h SER 275 N 0.74 0.96 -0.12 1.46 0.02 -0.58 -2.25 113.55 113.78 3k4p h SER 275 Ca 0.13 0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.10 3k4p h SER 275 Cb 0.56 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 62.93 3k4p h SER 275 CO 0.03 0.56 0.02 -0.07 -1.14 0.00 0.00 176.83 176.23 3k4p h LEU 276 N 1.06 0.19 -0.55 5.07 3.38 -0.09 0.24 115.31 124.61 3k4p h LEU 276 Ca 0.47 -0.25 0.11 0.00 0.09 0.00 0.00 57.88 58.29 3k4p h LEU 276 Cb 0.36 -0.05 -0.10 0.00 0.09 0.00 0.00 40.66 40.96 3k4p h LEU 276 CO -0.22 0.39 -0.14 0.11 0.09 0.00 0.00 178.44 178.67 3k4p h LYS 277 N -0.02 0.00 -0.04 1.13 1.57 -1.07 -0.17 116.57 117.97 3k4p h LYS 277 Ca 0.04 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 3k4p h LYS 277 Cb 0.28 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.59 3k4p h LYS 277 CO 0.00 0.00 -0.02 0.87 -0.57 0.00 0.00 179.45 179.73 3k4p h LYS 278 N 0.00 0.09 -0.50 3.15 1.79 -1.29 0.67 116.57 120.48 3k4p h LYS 278 Ca 0.26 -0.04 0.04 0.00 -2.18 0.00 0.00 60.65 58.74 3k4p h LYS 278 Cb 0.40 -0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.00 3k4p h LYS 278 CO -0.56 0.48 0.26 -0.92 -1.08 0.00 0.00 179.45 177.63 3k4p h TYR 279 N -0.31 0.47 0.00 -1.35 3.20 -0.34 -0.98 116.97 117.66 3k4p h TYR 279 Ca 0.01 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.90 3k4p h TYR 279 Cb 0.46 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 38.59 3k4p h TYR 279 CO 0.07 0.23 -0.72 1.88 -1.64 0.00 0.00 178.16 177.98 3k4p h TYR 280 N 0.50 0.00 0.16 -3.82 0.05 -1.11 -2.25 116.97 110.50 3k4p h TYR 280 Ca 0.22 0.00 -0.23 0.00 0.05 0.00 0.00 58.73 58.77 3k4p h TYR 280 Cb 0.12 0.00 0.02 0.00 1.01 0.00 0.00 36.73 37.88 3k4p h TYR 280 CO -0.10 0.00 -1.05 0.78 -1.05 0.00 0.00 178.16 176.74 3k4p h GLY 281 N 4.37 0.39 0.00 3.88 0.00 -0.64 -3.35 103.07 107.71 3k4p h GLY 281 Ca 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 47.33 46.34 3k4p h GLY 281 CO 0.00 0.87 -0.04 1.42 0.00 0.00 0.00 176.54 178.79 3k4p n HIS 282 N -4.01 0.00 -0.44 5.60 8.25 -0.43 -4.79 115.22 119.41 3k4p n HIS 282 Ca -0.16 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.30 3k4p n HIS 282 Cb 0.89 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.00 3k4p n HIS 282 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3k4p n GLY 283 N 0.31 0.44 0.25 -1.41 0.00 -0.88 -3.23 105.19 100.66 3k4p n GLY 283 Ca 0.00 -1.69 0.03 0.00 0.00 0.00 0.00 46.02 44.36 3k4p n GLY 283 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k4p h ALA 284 N -1.73 1.58 0.00 4.61 0.00 -1.89 -2.44 119.26 119.39 3k4p h ALA 284 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3k4p h ALA 284 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3k4p h ALA 284 CO 0.00 0.31 0.00 0.41 0.00 0.00 0.00 179.25 179.97 3k4p n GLY 285 N -0.99 -0.85 3.50 0.00 0.00 -0.87 -4.55 105.19 101.43 3k4p n GLY 285 Ca -0.01 0.05 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 3k4p n GLY 285 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3k4p s ASN 286 N -3.45 4.95 0.58 1.61 3.84 -0.92 -4.79 114.94 116.76 3k4p s ASN 286 Ca 0.02 -0.13 0.28 0.00 0.21 0.00 0.00 52.86 53.24 3k4p s ASN 286 Cb 0.05 -1.83 1.65 0.00 -0.55 0.00 0.00 41.25 40.57 3k4p s ASN 286 CO 0.18 0.12 2.14 1.55 -2.79 0.00 0.00 177.10 178.30 3k4p h PRO 287 N 7.05 0.00 -0.08 0.43 0.13 -1.86 -0.87 132.00 136.81 3k4p h PRO 287 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 3k4p h PRO 287 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3k4p h PRO 287 CO 0.63 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.68 3k4p n LEU 288 N -3.91 2.06 0.43 1.56 4.77 -1.26 -4.77 117.00 115.88 3k4p n LEU 288 Ca 0.01 -1.21 -0.17 0.00 -0.03 0.00 0.00 56.01 54.61 3k4p n LEU 288 Cb 0.26 -0.04 -0.08 0.00 -2.33 0.00 0.00 43.42 41.23 3k4p n LEU 288 CO 0.28 0.43 0.47 1.23 -1.33 0.00 0.00 177.39 178.48 3k4p h GLY 289 N 1.96 -1.15 2.00 -0.72 0.00 -1.32 -2.61 103.07 101.24 3k4p h GLY 289 Ca 0.00 0.43 0.00 0.00 0.00 0.00 0.00 47.33 47.76 3k4p h GLY 289 CO 0.00 -0.42 0.00 -2.55 0.00 0.00 0.00 176.54 173.57 3k4p h PRO 290 N -1.20 0.00 0.00 4.80 0.11 -1.66 0.13 132.00 134.17 3k4p h PRO 290 Ca -0.11 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.96 3k4p h PRO 290 Cb 0.84 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.95 3k4p h PRO 290 CO 0.18 0.00 -0.16 1.15 -0.21 0.00 0.00 178.00 178.97 3k4p h THR 291 N 0.00 0.34 0.00 -1.15 2.02 -1.78 -0.89 112.91 111.45 3k4p h THR 291 Ca 0.00 -1.10 -0.01 0.00 0.77 0.00 0.00 66.41 66.08 3k4p h THR 291 Cb 0.03 1.84 -0.00 0.00 -1.74 0.00 0.00 68.15 68.28 3k4p h THR 291 CO 0.00 0.16 -0.04 1.56 0.37 0.00 0.00 175.52 177.57 3k4p h GLN 292 N 0.00 0.00 -0.02 6.66 1.08 -0.37 -3.06 115.11 119.40 3k4p h GLN 292 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3k4p h GLN 292 Cb 0.83 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.26 3k4p h GLN 292 CO 0.02 0.04 -0.09 0.41 -0.95 0.00 0.00 178.83 178.26 3k4p n GLY 293 N -0.48 0.13 0.14 3.46 0.00 -0.34 -4.51 105.19 103.59 3k4p n GLY 293 Ca -0.01 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.50 3k4p n GLY 293 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3k4p h VAL 294 N 2.72 1.24 -0.18 1.61 -1.51 -1.54 -2.23 116.25 116.35 3k4p h VAL 294 Ca 0.00 -2.16 0.01 0.00 -1.23 0.00 0.00 66.70 63.32 3k4p h VAL 294 Cb 0.64 2.23 -0.02 0.00 -2.13 0.00 0.00 31.29 32.01 3k4p h VAL 294 CO 0.00 0.58 0.08 1.23 -1.23 0.00 0.00 177.57 178.22 3k4p h GLY 295 N 2.31 0.23 1.16 5.19 0.00 -1.82 -0.89 103.07 109.25 3k4p h GLY 295 Ca -0.01 -0.05 -0.16 0.00 0.00 0.00 0.00 47.33 47.12 3k4p h GLY 295 CO 0.08 0.04 -0.37 -1.82 0.00 0.00 0.00 176.54 174.47 3k4p h TYR 296 N 0.17 1.10 -0.71 5.60 3.20 -1.69 -1.83 116.97 122.81 3k4p h TYR 296 Ca 0.08 -0.32 0.03 0.00 3.14 0.00 0.00 58.73 61.65 3k4p h TYR 296 Cb 0.03 -0.23 -0.04 0.00 1.54 0.00 0.00 36.73 38.03 3k4p h TYR 296 CO -0.10 1.15 0.47 0.00 -1.64 0.00 0.00 178.16 178.03 3k4p h ALA 297 N 0.81 1.57 0.01 1.82 0.00 -1.17 0.61 119.26 122.90 3k4p h ALA 297 Ca 0.07 -0.04 -0.20 0.00 0.00 0.00 0.00 54.91 54.74 3k4p h ALA 297 Cb 0.96 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3k4p h ALA 297 CO 0.09 0.37 -0.91 -0.91 0.00 0.00 0.00 179.25 177.90 3k4p h ASN 298 N 0.88 0.22 -0.28 0.00 2.35 -0.80 -2.09 115.58 115.86 3k4p h ASN 298 Ca 0.28 -0.18 -0.03 0.00 -0.55 0.00 0.00 56.30 55.82 3k4p h ASN 298 Cb 0.01 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.31 3k4p h ASN 298 CO -0.07 1.01 0.07 -0.33 -1.65 0.00 0.00 177.43 176.46 3k4p h GLU 299 N 0.08 0.44 -0.76 0.81 5.08 -0.91 -1.41 114.58 117.90 3k4p h GLU 299 Ca -0.04 -0.10 0.09 0.00 -1.00 0.00 0.00 59.36 58.30 3k4p h GLU 299 Cb 1.55 -0.06 -0.07 0.00 0.50 0.00 0.00 28.75 30.67 3k4p h GLU 299 CO 0.14 0.52 0.41 1.25 -1.00 0.00 0.00 179.01 180.33 3k4p h LEU 300 N 0.28 0.57 -0.15 1.33 5.85 -0.84 -1.57 115.31 120.78 3k4p h LEU 300 Ca 0.09 0.05 0.02 0.00 0.84 0.00 0.00 57.88 58.88 3k4p h LEU 300 Cb 0.28 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 3k4p h LEU 300 CO 0.00 0.33 0.03 0.40 -0.34 0.00 0.00 178.44 178.86 3k4p h ILE 301 N 0.70 0.94 -0.71 4.05 2.04 -1.09 0.17 117.51 123.61 3k4p h ILE 301 Ca 0.37 -0.03 0.14 0.00 1.00 0.00 0.00 64.86 66.33 3k4p h ILE 301 Cb 0.35 0.84 -0.13 0.00 -0.74 0.00 0.00 36.82 37.13 3k4p h ILE 301 CO -0.25 0.02 -0.25 0.00 0.00 0.00 0.00 178.15 177.67 3k4p h ALA 302 N 1.11 0.30 -0.58 1.87 0.00 -0.90 0.67 119.26 121.73 3k4p h ALA 302 Ca 0.07 0.25 -0.05 0.00 0.00 0.00 0.00 54.91 55.17 3k4p h ALA 302 Cb 0.06 0.66 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 3k4p h ALA 302 CO -0.09 -0.51 0.16 0.00 0.00 0.00 0.00 179.25 178.81 3k4p h ARG 303 N -0.05 0.93 -0.01 0.00 3.08 -0.47 0.89 114.38 118.75 3k4p h ARG 303 Ca 0.32 -0.21 -0.13 0.00 0.07 0.00 0.00 59.98 60.02 3k4p h ARG 303 Cb 0.55 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.46 3k4p h ARG 303 CO -0.75 0.85 -0.61 -0.07 -1.07 0.00 0.00 179.97 178.31 3k4p h LEU 304 N 0.84 0.04 -1.90 3.04 3.38 0.05 -3.14 115.31 117.63 3k4p h LEU 304 Ca 0.19 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.13 3k4p h LEU 304 Cb 0.33 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3k4p h LEU 304 CO -0.00 0.64 0.00 0.35 0.09 0.00 0.00 178.44 179.52 3k4p n THR 305 N -3.82 0.08 -4.02 0.22 -2.24 0.16 -4.99 114.28 99.66 3k4p n THR 305 Ca -0.01 -0.54 -0.31 0.00 -2.27 0.00 0.00 64.05 60.92 3k4p n THR 305 Cb 0.61 1.37 -0.00 0.00 -2.10 0.00 0.00 70.33 70.21 3k4p n THR 305 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3k4p n HIS 306 N 1.22 -1.92 -4.29 4.78 8.25 0.30 -4.95 115.22 118.61 3k4p n HIS 306 Ca 0.13 0.83 -0.16 0.00 -0.26 0.00 0.00 57.72 58.26 3k4p n HIS 306 Cb 0.54 -3.58 -0.10 0.00 1.12 0.00 0.00 29.99 27.97 3k4p n HIS 306 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 3k4p s SER 307 N -3.64 2.06 0.65 0.41 0.01 -0.80 -5.01 113.70 107.39 3k4p s SER 307 Ca 0.49 -1.05 -0.17 0.00 1.31 0.00 0.00 55.95 56.53 3k4p s SER 307 Cb -0.26 -0.05 -0.04 0.00 0.21 0.00 0.00 66.02 65.88 3k4p s SER 307 CO 0.88 -0.31 0.82 -2.65 0.41 0.00 0.00 173.24 172.39 3k4p n PRO 308 N -0.29 0.63 -2.32 12.44 -0.02 -1.26 -4.49 135.00 139.69 3k4p n PRO 308 Ca -0.09 0.26 -0.42 0.00 -2.02 0.00 0.00 63.50 61.23 3k4p n PRO 308 Cb 0.61 -2.05 -0.03 0.00 -0.02 0.00 0.00 33.50 32.01 3k4p n PRO 308 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3k4p s VAL 309 N -1.68 3.63 -0.39 -1.45 1.01 -1.26 -4.71 120.40 115.54 3k4p s VAL 309 Ca 0.73 1.24 -0.03 0.00 0.00 0.00 0.00 61.98 63.92 3k4p s VAL 309 Cb -0.39 -3.80 0.10 0.00 0.00 0.00 0.00 36.38 32.29 3k4p s VAL 309 CO 0.50 0.14 0.18 -1.00 0.00 0.00 0.00 175.10 174.92 3k4p s HIS 310 N 0.65 3.52 -0.28 5.22 3.76 -1.26 -5.06 115.29 121.84 3k4p s HIS 310 Ca 0.58 -2.25 -0.21 0.00 -0.15 0.00 0.00 55.06 53.03 3k4p s HIS 310 Cb -0.33 -3.03 0.11 0.00 1.11 0.00 0.00 32.58 30.44 3k4p s HIS 310 CO 0.33 -0.94 0.88 0.34 -0.85 0.00 0.00 174.74 174.50 3k4p s ASP 311 N 1.76 -0.63 -0.03 1.40 2.15 -1.26 -4.85 116.67 115.20 3k4p s ASP 311 Ca 0.06 1.11 0.05 0.00 0.43 0.00 0.00 52.55 54.19 3k4p s ASP 311 Cb -0.22 1.19 0.08 0.00 -0.30 0.00 0.00 42.92 43.66 3k4p s ASP 311 CO -0.03 -0.18 0.93 -0.67 -0.17 0.00 0.00 175.17 175.05 3k4p n ASP 312 N 3.14 0.91 0.00 -0.34 2.03 -1.26 -4.85 116.55 116.19 3k4p n ASP 312 Ca -0.16 -2.07 0.00 0.00 0.52 0.00 0.00 54.79 53.08 3k4p n ASP 312 Cb 0.57 -0.19 0.00 0.00 -0.72 0.00 0.00 41.12 40.78 3k4p n ASP 312 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 3k4p n THR 313 N -0.45 0.00 0.78 5.18 -2.24 -1.26 -4.94 114.28 111.34 3k4p n THR 313 Ca 0.04 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.90 3k4p n THR 313 Cb 0.57 -0.31 -0.05 0.00 -2.10 0.00 0.00 70.33 68.44 3k4p n THR 313 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3k4p n SER 314 N 0.00 1.19 -4.77 3.42 3.41 -1.26 -4.99 113.62 110.63 3k4p n SER 314 Ca 0.00 -1.10 -0.38 0.00 -0.26 0.00 0.00 58.87 57.13 3k4p n SER 314 Cb 0.00 0.77 -0.04 0.00 -0.26 0.00 0.00 64.21 64.68 3k4p n SER 314 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3k4p s SER 315 N -2.33 6.93 -0.15 4.04 1.04 -1.26 -2.42 113.70 119.54 3k4p s SER 315 Ca 0.10 2.19 -0.23 0.00 0.48 0.00 0.00 55.95 58.48 3k4p s SER 315 Cb 0.13 -2.61 -0.02 0.00 0.10 0.00 0.00 66.02 63.62 3k4p s SER 315 CO 0.58 -0.38 0.74 0.21 0.98 0.00 0.00 173.24 175.37 3k4p s ASN 316 N -1.20 6.88 0.12 7.02 3.84 -1.25 -4.89 114.94 125.46 3k4p s ASN 316 Ca 0.52 1.08 -0.02 0.00 0.21 0.00 0.00 52.86 54.65 3k4p s ASN 316 Cb -0.28 -2.41 -0.13 0.00 -0.55 0.00 0.00 41.25 37.88 3k4p s ASN 316 CO 0.35 -0.30 1.28 0.45 -2.79 0.00 0.00 177.10 176.09 3k4p h HIS 317 N 7.25 0.44 0.11 0.43 3.86 -1.95 0.08 115.15 125.36 3k4p h HIS 317 Ca -0.33 -0.27 -0.00 0.00 -1.16 0.00 0.00 60.37 58.61 3k4p h HIS 317 Cb 1.15 -0.04 -0.00 0.00 1.06 0.00 0.00 27.41 29.58 3k4p h HIS 317 CO 0.70 1.12 -0.07 1.15 0.86 0.00 0.00 177.93 181.70 3k4p h THR 318 N 0.13 0.85 -0.61 2.45 2.02 -1.98 -0.75 112.91 115.03 3k4p h THR 318 Ca -0.08 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.08 3k4p h THR 318 Cb 1.68 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 68.91 3k4p h THR 318 CO 0.16 0.00 0.32 -0.07 0.37 0.00 0.00 175.52 176.30 3k4p h LEU 319 N -0.17 0.77 0.00 2.58 4.07 -1.92 -3.29 115.31 117.34 3k4p h LEU 319 Ca -0.01 -0.11 -0.11 0.00 0.08 0.00 0.00 57.88 57.73 3k4p h LEU 319 Cb 0.15 -0.20 -0.02 0.00 1.08 0.00 0.00 40.66 41.67 3k4p h LEU 319 CO 0.01 0.66 -0.69 0.44 -1.08 0.00 0.00 178.44 177.78 3k4p h ASP 320 N 0.83 0.00 -0.33 -0.43 5.19 -0.92 -3.19 116.42 117.56 3k4p h ASP 320 Ca 0.21 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.62 3k4p h ASP 320 Cb 0.07 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.58 3k4p h ASP 320 CO -0.03 0.50 0.00 -1.54 -3.12 0.00 0.00 179.24 175.04 3k4p n SER 321 N -3.14 2.92 -3.93 6.45 3.41 -0.29 -4.67 113.62 114.37 3k4p n SER 321 Ca -0.00 -2.29 -0.27 0.00 -0.26 0.00 0.00 58.87 56.05 3k4p n SER 321 Cb 0.75 -0.46 -0.17 0.00 -0.26 0.00 0.00 64.21 64.06 3k4p n SER 321 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3k4p s SER 322 N -0.64 2.13 0.40 4.04 0.15 -1.26 -5.04 113.70 113.48 3k4p s SER 322 Ca 0.27 -0.31 0.10 0.00 0.70 0.00 0.00 55.95 56.72 3k4p s SER 322 Cb 0.18 -0.85 0.89 0.00 -1.71 0.00 0.00 66.02 64.54 3k4p s SER 322 CO 0.12 -0.09 1.96 -0.65 1.20 0.00 0.00 173.24 175.78 3k4p h PRO 323 N 7.97 0.56 -0.79 5.44 0.11 -1.87 0.20 132.00 143.62 3k4p h PRO 323 Ca -0.31 -0.03 0.12 0.00 0.11 0.00 0.00 66.00 65.89 3k4p h PRO 323 Cb 1.14 -0.13 -0.08 0.00 0.11 0.00 0.00 31.00 32.04 3k4p h PRO 323 CO 0.42 0.37 0.40 0.00 -0.21 0.00 0.00 178.00 178.99 3k4p h ALA 324 N 1.65 1.13 0.00 -0.75 0.00 -1.96 -1.64 119.26 117.69 3k4p h ALA 324 Ca 0.31 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.28 3k4p h ALA 324 Cb 0.45 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3k4p h ALA 324 CO -0.10 -0.04 -0.82 0.25 0.00 0.00 0.00 179.25 178.54 3k4p n THR 325 N -4.85 0.00 -3.14 0.00 -2.24 -0.74 -4.69 114.28 98.62 3k4p n THR 325 Ca 0.14 -0.19 -0.20 0.00 -2.27 0.00 0.00 64.05 61.53 3k4p n THR 325 Cb 0.34 0.88 -0.05 0.00 -2.10 0.00 0.00 70.33 69.40 3k4p n THR 325 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 3k4p n PHE 326 N -1.43 -1.63 -2.63 4.78 7.35 0.63 -4.79 117.46 119.74 3k4p n PHE 326 Ca 0.02 -2.82 -0.39 0.00 -0.76 0.00 0.00 57.45 53.50 3k4p n PHE 326 Cb 0.24 0.49 -0.05 0.00 0.35 0.00 0.00 39.48 40.51 3k4p n PHE 326 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 3k4p s PRO 327 N -0.04 4.60 0.00 -7.13 0.04 -0.63 -4.43 135.00 127.42 3k4p s PRO 327 Ca 0.33 1.56 0.23 0.00 0.04 0.00 0.00 61.00 63.16 3k4p s PRO 327 Cb 0.09 -3.01 0.20 0.00 0.04 0.00 0.00 34.50 31.82 3k4p s PRO 327 CO -0.15 0.24 1.20 1.28 0.04 0.00 0.00 177.00 179.61 3k4p n LEU 328 N 0.90 1.07 -0.99 -3.56 4.77 -1.26 -4.35 117.00 113.57 3k4p n LEU 328 Ca 0.00 -0.37 0.05 0.00 -0.03 0.00 0.00 56.01 55.67 3k4p n LEU 328 Cb 0.47 -0.09 0.10 0.00 -2.33 0.00 0.00 43.42 41.58 3k4p n LEU 328 CO 0.49 0.23 0.22 0.59 -1.33 0.00 0.00 177.39 177.59 3k4p n ASN 329 N -1.06 1.31 -3.86 -1.43 3.02 -1.26 -4.40 115.26 107.58 3k4p n ASN 329 Ca 0.07 -2.86 -0.30 0.00 -0.03 0.00 0.00 54.58 51.46 3k4p n ASN 329 Cb 0.36 -0.40 0.22 0.00 -0.61 0.00 0.00 39.78 39.36 3k4p n ASN 329 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3k4p s SER 330 N -2.51 1.90 0.00 6.41 0.01 -1.26 -4.98 113.70 113.27 3k4p s SER 330 Ca 0.34 0.34 0.00 0.00 1.31 0.00 0.00 55.95 57.94 3k4p s SER 330 Cb 0.35 -0.41 0.00 0.00 0.21 0.00 0.00 66.02 66.18 3k4p s SER 330 CO -0.11 -3.49 0.00 0.41 0.41 0.00 0.00 173.24 170.46 3k4p n THR 331 N -4.29 0.00 -4.38 1.44 -1.04 -1.26 -5.03 114.28 99.73 3k4p n THR 331 Ca 0.16 0.00 -0.22 0.00 -2.04 0.00 0.00 64.05 61.95 3k4p n THR 331 Cb 0.59 0.09 -0.13 0.00 -1.82 0.00 0.00 70.33 69.06 3k4p n THR 331 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3k4p s LEU 332 N -2.95 2.22 -0.15 -4.42 1.43 -1.26 -1.04 118.68 112.51 3k4p s LEU 332 Ca 0.00 -0.55 -0.16 0.00 -1.03 0.00 0.00 54.13 52.39 3k4p s LEU 332 Cb 0.00 -0.74 0.04 0.00 0.03 0.00 0.00 46.19 45.52 3k4p s LEU 332 CO 0.00 0.05 0.44 -0.31 0.23 0.00 0.00 176.35 176.76 3k4p s TYR 333 N -0.98 -0.47 -0.03 0.29 2.02 -0.69 -1.22 117.35 116.27 3k4p s TYR 333 Ca 0.03 1.12 -0.01 0.00 -0.37 0.00 0.00 57.07 57.85 3k4p s TYR 333 Cb -0.09 0.17 0.03 0.00 -0.40 0.00 0.00 41.96 41.67 3k4p s TYR 333 CO 0.02 -0.25 0.03 0.00 -1.57 0.00 0.00 175.55 173.77 3k4p s ALA 334 N 0.08 0.26 0.08 3.71 0.00 -0.69 -0.52 121.76 124.68 3k4p s ALA 334 Ca -0.01 0.19 0.09 0.00 0.00 0.00 0.00 51.96 52.22 3k4p s ALA 334 Cb -0.03 -0.42 -0.03 0.00 0.00 0.00 0.00 23.12 22.64 3k4p s ALA 334 CO 0.01 -0.23 -0.23 -0.51 0.00 0.00 0.00 175.76 174.81 3k4p s ASP 335 N 1.43 2.73 -0.05 0.00 1.01 0.31 -0.44 116.67 121.67 3k4p s ASP 335 Ca -0.04 -0.63 0.01 0.00 0.71 0.00 0.00 52.55 52.60 3k4p s ASP 335 Cb -0.13 -0.19 0.02 0.00 1.01 0.00 0.00 42.92 43.63 3k4p s ASP 335 CO -0.03 0.14 -0.05 -0.36 0.21 0.00 0.00 175.17 175.08 3k4p s PHE 336 N -0.97 0.83 0.00 4.23 0.40 -0.98 0.26 117.98 121.75 3k4p s PHE 336 Ca 0.09 -0.24 0.00 0.00 -0.60 0.00 0.00 56.93 56.17 3k4p s PHE 336 Cb -0.10 -0.71 0.00 0.00 0.51 0.00 0.00 43.02 42.73 3k4p s PHE 336 CO 0.03 -0.20 0.00 0.45 0.70 0.00 0.00 175.22 176.21 3k4p n SER 337 N 4.00 0.00 -4.95 1.36 2.88 -0.02 -1.49 113.62 115.39 3k4p n SER 337 Ca -0.25 -0.65 -0.20 0.00 -1.33 0.00 0.00 58.87 56.45 3k4p n SER 337 Cb 0.51 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.95 3k4p n SER 337 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 3k4p s HIS 338 N -5.66 3.16 0.24 0.66 3.76 -1.26 -2.56 115.29 113.63 3k4p s HIS 338 Ca 0.00 -0.18 -0.07 0.00 -0.15 0.00 0.00 55.06 54.66 3k4p s HIS 338 Cb 0.00 -1.82 0.42 0.00 1.11 0.00 0.00 32.58 32.29 3k4p s HIS 338 CO 0.00 0.17 1.66 0.38 -0.85 0.00 0.00 174.74 176.09 3k4p h ASP 339 N 1.06 -0.20 -0.21 1.40 3.04 -1.95 -2.50 116.42 117.06 3k4p h ASP 339 Ca -0.47 0.17 -0.02 0.00 -3.24 0.00 0.00 57.03 53.46 3k4p h ASP 339 Cb 1.25 0.27 -0.01 0.00 -1.04 0.00 0.00 39.33 39.80 3k4p h ASP 339 CO 0.56 -0.12 0.04 0.78 -2.04 0.00 0.00 179.24 178.47 3k4p h ASN 340 N 0.16 0.33 0.71 4.15 2.35 -1.95 -0.56 115.58 120.77 3k4p h ASN 340 Ca 0.39 -0.25 -0.02 0.00 -0.55 0.00 0.00 56.30 55.88 3k4p h ASN 340 Cb 0.68 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 38.96 3k4p h ASN 340 CO -0.58 0.49 -0.09 1.23 -1.65 0.00 0.00 177.43 176.84 3k4p h GLY 341 N 0.15 0.00 1.50 2.83 0.00 -1.74 -2.71 103.07 103.10 3k4p h GLY 341 Ca 0.07 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.10 3k4p h GLY 341 CO 0.00 0.00 -1.33 -2.22 0.00 0.00 0.00 176.54 172.99 3k4p h ILE 342 N 0.00 1.41 0.66 2.60 2.04 -0.80 -1.78 117.51 121.64 3k4p h ILE 342 Ca -0.00 -2.95 -0.03 0.00 1.00 0.00 0.00 64.86 62.88 3k4p h ILE 342 Cb 0.47 2.95 -0.00 0.00 -0.74 0.00 0.00 36.82 39.49 3k4p h ILE 342 CO 0.01 0.87 -0.39 0.40 0.00 0.00 0.00 178.15 179.04 3k4p h ILE 343 N 0.09 0.20 -0.99 -0.67 1.08 -0.97 -0.92 117.51 115.33 3k4p h ILE 343 Ca -0.18 0.00 0.18 0.00 -0.39 0.00 0.00 64.86 64.47 3k4p h ILE 343 Cb 2.03 0.20 -0.10 0.00 -3.07 0.00 0.00 36.82 35.88 3k4p h ILE 343 CO 0.22 0.00 0.62 0.28 -0.69 0.00 0.00 178.15 178.57 3k4p h SER 344 N -0.99 0.77 -0.22 1.72 0.02 -1.46 -1.91 113.55 111.48 3k4p h SER 344 Ca -0.08 0.08 -0.04 0.00 -0.84 0.00 0.00 61.79 60.91 3k4p h SER 344 Cb 0.80 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.27 3k4p h SER 344 CO 0.10 0.31 -0.02 0.40 -1.14 0.00 0.00 176.83 176.47 3k4p h ILE 345 N 0.77 1.27 -0.50 3.27 2.04 -1.02 -1.12 117.51 122.22 3k4p h ILE 345 Ca 0.55 -0.95 0.08 0.00 1.00 0.00 0.00 64.86 65.54 3k4p h ILE 345 Cb 0.85 1.46 -0.07 0.00 -0.74 0.00 0.00 36.82 38.32 3k4p h ILE 345 CO -0.33 0.29 0.12 -0.07 0.00 0.00 0.00 178.15 178.16 3k4p h LEU 346 N 0.15 0.06 -0.33 1.44 3.38 -0.40 -1.85 115.31 117.75 3k4p h LEU 346 Ca 0.06 0.08 -0.11 0.00 0.09 0.00 0.00 57.88 58.00 3k4p h LEU 346 Cb 0.44 0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 3k4p h LEU 346 CO 0.02 0.06 -0.21 -0.26 0.09 0.00 0.00 178.44 178.13 3k4p h PHE 347 N 0.27 0.85 0.00 1.13 0.04 -1.40 -2.27 116.94 115.56 3k4p h PHE 347 Ca 0.25 -0.23 0.00 0.00 2.80 0.00 0.00 57.97 60.79 3k4p h PHE 347 Cb 0.31 -0.19 0.00 0.00 2.20 0.00 0.00 35.95 38.27 3k4p h PHE 347 CO -0.21 0.96 0.00 0.00 -0.60 0.00 0.00 178.31 178.46 3k4p h ALA 348 N 0.76 1.00 -0.01 2.45 0.00 -1.04 -0.77 119.26 121.65 3k4p h ALA 348 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3k4p h ALA 348 Cb 0.76 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.55 3k4p h ALA 348 CO 0.06 0.00 -0.05 1.28 0.00 0.00 0.00 179.25 180.54 3k4p n LEU 349 N -3.07 1.13 0.00 0.00 4.77 -0.71 -4.68 117.00 114.44 3k4p n LEU 349 Ca -0.02 -0.35 0.00 0.00 -0.03 0.00 0.00 56.01 55.61 3k4p n LEU 349 Cb 0.12 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 3k4p n LEU 349 CO 0.22 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 3k4p n GLY 350 N 1.19 1.32 0.17 -0.72 0.00 -0.30 -4.80 105.19 102.05 3k4p n GLY 350 Ca 0.18 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.32 3k4p n GLY 350 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3k4p h LEU 351 N 0.00 0.00 -3.42 0.99 3.38 -1.61 -1.81 115.31 112.84 3k4p h LEU 351 Ca 0.00 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.76 3k4p h LEU 351 Cb 0.00 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 40.54 3k4p h LEU 351 CO 0.00 0.00 -0.71 -1.22 0.09 0.00 0.00 178.44 176.60 3k4p n TYR 352 N -2.30 0.96 0.70 1.13 4.01 -1.26 -4.79 117.16 115.60 3k4p n TYR 352 Ca -0.01 -1.66 0.03 0.00 -0.16 0.00 0.00 57.90 56.11 3k4p n TYR 352 Cb 0.07 -0.27 0.13 0.00 -0.31 0.00 0.00 39.34 38.97 3k4p n TYR 352 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3k4p n ASN 353 N -0.76 2.11 -0.11 7.72 4.13 -0.68 -2.25 115.26 125.42 3k4p n ASN 353 Ca 0.24 -2.18 0.01 0.00 1.68 0.00 0.00 54.58 54.33 3k4p n ASN 353 Cb 0.84 -0.40 0.02 0.00 -1.54 0.00 0.00 39.78 38.71 3k4p n ASN 353 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3k4p n GLY 354 N 0.52 0.52 3.71 7.41 0.00 -1.26 -5.02 105.19 111.07 3k4p n GLY 354 Ca 0.09 -0.07 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 3k4p n GLY 354 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k4p s THR 355 N -0.53 5.14 0.01 2.61 2.01 -0.95 -4.79 115.64 119.14 3k4p s THR 355 Ca 0.04 1.06 -0.19 0.00 0.31 0.00 0.00 61.69 62.90 3k4p s THR 355 Cb 0.02 -3.87 -0.06 0.00 0.01 0.00 0.00 72.50 68.61 3k4p s THR 355 CO 0.03 0.28 0.56 -0.54 -0.69 0.00 0.00 174.62 174.26 3k4p s LYS 356 N 0.85 4.24 0.07 4.92 1.02 -1.26 -4.99 119.74 124.59 3k4p s LYS 356 Ca 0.28 0.67 -0.36 0.00 0.02 0.00 0.00 55.97 56.58 3k4p s LYS 356 Cb -0.16 -3.30 -0.19 0.00 -0.52 0.00 0.00 37.83 33.67 3k4p s LYS 356 CO 0.12 0.48 0.97 -2.30 -0.92 0.00 0.00 175.35 173.69 3k4p n PRO 357 N 2.37 0.21 -2.44 -1.68 -0.02 -1.26 -4.78 135.00 127.40 3k4p n PRO 357 Ca -0.09 0.08 -0.40 0.00 -2.02 0.00 0.00 63.50 61.06 3k4p n PRO 357 Cb 0.51 -1.47 -0.04 0.00 -0.02 0.00 0.00 33.50 32.48 3k4p n PRO 357 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3k4p s LEU 358 N 0.82 4.54 0.20 2.45 1.43 -1.26 -4.95 118.68 121.91 3k4p s LEU 358 Ca 0.82 2.30 -0.33 0.00 -1.03 0.00 0.00 54.13 55.90 3k4p s LEU 358 Cb -1.12 -3.63 -0.14 0.00 0.03 0.00 0.00 46.19 41.34 3k4p s LEU 358 CO 0.56 -0.18 1.51 -0.24 0.23 0.00 0.00 176.35 178.22 3k4p n SER 359 N 1.20 3.00 0.00 2.29 2.88 -1.26 -4.91 113.62 116.82 3k4p n SER 359 Ca -0.01 1.11 0.14 0.00 -1.33 0.00 0.00 58.87 58.78 3k4p n SER 359 Cb 0.44 -1.44 0.73 0.00 -0.75 0.00 0.00 64.21 63.20 3k4p n SER 359 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 3k4p n THR 360 N 2.74 0.05 0.00 2.46 -2.24 -1.26 -4.39 114.28 111.64 3k4p n THR 360 Ca 0.14 0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.93 3k4p n THR 360 Cb 0.30 -0.53 0.00 0.00 -2.10 0.00 0.00 70.33 68.00 3k4p n THR 360 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3k4p n THR 361 N -1.28 0.00 -4.73 4.28 -2.24 -1.26 -4.23 114.28 104.82 3k4p n THR 361 Ca 0.14 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.63 3k4p n THR 361 Cb 0.23 -0.72 -0.14 0.00 -2.10 0.00 0.00 70.33 67.59 3k4p n THR 361 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3k4p s THR 362 N -1.83 2.02 0.19 4.28 2.01 -1.26 -5.01 115.64 116.05 3k4p s THR 362 Ca 0.00 -1.41 -0.33 0.00 0.31 0.00 0.00 61.69 60.26 3k4p s THR 362 Cb 0.00 -1.75 -0.14 0.00 0.01 0.00 0.00 72.50 70.61 3k4p s THR 362 CO 0.00 0.26 1.37 0.52 -0.69 0.00 0.00 174.62 176.08 3k4p n VAL 363 N 1.62 0.66 -4.21 3.82 0.31 -1.26 -4.61 118.33 114.67 3k4p n VAL 363 Ca -0.17 -0.17 -0.33 0.00 -0.01 0.00 0.00 64.34 63.66 3k4p n VAL 363 Cb 0.52 -1.26 -0.16 0.00 -0.91 0.00 0.00 33.84 32.03 3k4p n VAL 363 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 3k4p s GLU 364 N -0.07 3.00 1.25 5.55 2.02 -1.26 -5.07 118.70 124.12 3k4p s GLU 364 Ca 0.73 -0.83 -0.18 0.00 0.02 0.00 0.00 54.97 54.70 3k4p s GLU 364 Cb -0.74 -2.55 0.31 0.00 0.10 0.00 0.00 34.13 31.25 3k4p s GLU 364 CO 0.48 -0.18 1.03 0.54 0.02 0.00 0.00 175.26 177.15 3k4p s ASN 365 N 1.22 0.38 0.27 -0.19 2.20 -1.26 -4.71 114.94 112.86 3k4p s ASN 365 Ca 0.03 0.94 0.24 0.00 -0.94 0.00 0.00 52.86 53.13 3k4p s ASN 365 Cb -0.13 -1.38 1.01 0.00 -2.00 0.00 0.00 41.25 38.74 3k4p s ASN 365 CO -0.11 -4.49 1.73 0.00 -2.94 0.00 0.00 177.10 171.29 3k4p n ILE 366 N -5.05 0.82 -0.05 0.54 0.13 -1.26 -1.95 119.36 112.55 3k4p n ILE 366 Ca 0.10 0.23 -0.12 0.00 -1.10 0.00 0.00 62.75 61.86 3k4p n ILE 366 Cb 0.58 -1.18 -0.10 0.00 -0.84 0.00 0.00 39.64 38.10 3k4p n ILE 366 CO 0.00 0.00 0.00 0.74 2.80 0.00 0.00 176.55 180.09 3k4p h THR 367 N 0.00 1.42 -0.85 9.51 2.02 -1.96 -0.29 112.91 122.76 3k4p h THR 367 Ca 0.00 -1.90 0.12 0.00 0.77 0.00 0.00 66.41 65.40 3k4p h THR 367 Cb 0.37 2.61 -0.06 0.00 -1.74 0.00 0.00 68.15 69.33 3k4p h THR 367 CO 0.00 0.45 0.55 1.56 0.37 0.00 0.00 175.52 178.45 3k4p h GLN 368 N -0.92 0.70 -0.12 6.66 4.20 -1.79 0.11 115.11 123.94 3k4p h GLN 368 Ca -0.00 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.67 3k4p h GLN 368 Cb 0.76 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.38 3k4p h GLN 368 CO 0.00 0.46 0.00 0.25 -0.67 0.00 0.00 178.83 178.88 3k4p n THR 369 N -4.53 0.16 -3.84 -0.54 -2.24 -0.82 -4.59 114.28 97.88 3k4p n THR 369 Ca 0.15 -0.27 -0.25 0.00 -2.27 0.00 0.00 64.05 61.41 3k4p n THR 369 Cb 0.39 0.24 0.02 0.00 -2.10 0.00 0.00 70.33 68.88 3k4p n THR 369 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3k4p n ASP 370 N 0.08 -2.22 0.00 3.42 2.03 0.36 -2.50 116.55 117.72 3k4p n ASP 370 Ca 0.16 -0.85 0.00 0.00 0.52 0.00 0.00 54.79 54.62 3k4p n ASP 370 Cb 0.28 -3.76 0.00 0.00 -0.72 0.00 0.00 41.12 36.92 3k4p n ASP 370 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3k4p n GLY 371 N -1.68 0.71 3.69 0.27 0.00 -0.13 -4.82 105.19 103.23 3k4p n GLY 371 Ca -0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.49 3k4p n GLY 371 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3k4p s PHE 372 N -2.05 3.34 0.05 1.61 5.36 -1.04 -4.90 117.98 120.35 3k4p s PHE 372 Ca 0.00 0.23 -0.27 0.00 -0.96 0.00 0.00 56.93 55.93 3k4p s PHE 372 Cb 0.00 -2.15 0.09 0.00 -0.34 0.00 0.00 43.02 40.61 3k4p s PHE 372 CO 0.00 0.21 0.74 -1.54 -1.46 0.00 0.00 175.22 173.17 3k4p s SER 373 N 0.47 -0.50 0.17 6.13 1.04 -1.26 -4.82 113.70 114.93 3k4p s SER 373 Ca 0.06 0.14 -0.18 0.00 0.48 0.00 0.00 55.95 56.46 3k4p s SER 373 Cb -0.12 0.50 0.09 0.00 0.10 0.00 0.00 66.02 66.59 3k4p s SER 373 CO -0.00 -0.75 1.66 0.28 0.98 0.00 0.00 173.24 175.41 3k4p h SER 374 N 2.20 -0.43 0.27 7.02 0.02 -1.86 -1.68 113.55 119.09 3k4p h SER 374 Ca -0.28 0.13 -0.09 0.00 -0.84 0.00 0.00 61.79 60.71 3k4p h SER 374 Cb 1.25 0.27 -0.01 0.00 0.14 0.00 0.00 62.40 64.05 3k4p h SER 374 CO 0.35 -0.15 -0.36 0.00 -1.14 0.00 0.00 176.83 175.53 3k4p h ALA 375 N 1.33 1.27 -0.00 3.77 0.00 -1.89 0.35 119.26 124.10 3k4p h ALA 375 Ca 0.19 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3k4p h ALA 375 Cb 0.32 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3k4p h ALA 375 CO -0.42 0.51 -0.09 0.91 0.00 0.00 0.00 179.25 180.16 3k4p n TRP 376 N -4.08 0.00 0.04 0.00 7.02 -1.01 -4.16 117.44 115.25 3k4p n TRP 376 Ca -0.02 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.46 3k4p n TRP 376 Cb 0.42 -0.33 0.00 0.00 -2.42 0.00 0.00 31.31 28.98 3k4p n TRP 376 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 3k4p n THR 377 N -1.31 0.76 -2.77 -0.99 -2.24 -0.61 -4.68 114.28 102.44 3k4p n THR 377 Ca 0.11 0.25 -0.29 0.00 -2.27 0.00 0.00 64.05 61.85 3k4p n THR 377 Cb 0.30 -1.42 -0.02 0.00 -2.10 0.00 0.00 70.33 67.08 3k4p n THR 377 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 3k4p n VAL 378 N -3.33 3.16 -1.17 2.28 0.24 0.11 -4.66 118.33 114.96 3k4p n VAL 378 Ca 0.00 -5.41 -0.30 0.00 -2.04 0.00 0.00 64.34 56.58 3k4p n VAL 378 Cb 0.13 -1.37 0.24 0.00 -1.47 0.00 0.00 33.84 31.37 3k4p n VAL 378 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 3k4p s PRO 379 N -3.58 -1.17 0.28 7.34 0.04 -1.22 -4.47 135.00 132.22 3k4p s PRO 379 Ca 0.48 -0.16 -0.30 0.00 0.04 0.00 0.00 61.00 61.06 3k4p s PRO 379 Cb 0.31 -1.61 -0.12 0.00 0.04 0.00 0.00 34.50 33.11 3k4p s PRO 379 CO -0.16 -3.66 1.48 1.19 0.04 0.00 0.00 177.00 175.89 3k4p n PHE 380 N -4.70 2.52 -1.57 0.56 3.72 0.66 -2.29 117.46 116.36 3k4p n PHE 380 Ca 0.14 0.37 -0.17 0.00 -0.05 0.00 0.00 57.45 57.74 3k4p n PHE 380 Cb 0.60 -2.52 -0.07 0.00 -0.94 0.00 0.00 39.48 36.55 3k4p n PHE 380 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3k4p n ALA 381 N 1.71 -0.29 -1.05 4.37 0.00 0.70 -0.65 120.51 125.31 3k4p n ALA 381 Ca 0.09 0.27 -0.35 0.00 0.00 0.00 0.00 53.44 53.45 3k4p n ALA 381 Cb 0.35 -1.82 0.09 0.00 0.00 0.00 0.00 19.45 18.07 3k4p n ALA 381 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3k4p n SER 382 N -0.86 -1.77 -3.84 0.00 3.41 -0.97 -4.64 113.62 104.94 3k4p n SER 382 Ca -0.18 0.46 -0.12 0.00 -0.26 0.00 0.00 58.87 58.77 3k4p n SER 382 Cb 0.58 -1.19 -0.13 0.00 -0.26 0.00 0.00 64.21 63.21 3k4p n SER 382 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3k4p s ARG 383 N -3.11 0.14 -0.13 4.33 3.03 -1.26 -1.27 118.95 120.69 3k4p s ARG 383 Ca 0.61 0.08 -0.01 0.00 2.03 0.00 0.00 55.73 58.44 3k4p s ARG 383 Cb -0.28 0.06 -0.02 0.00 -1.03 0.00 0.00 34.95 33.68 3k4p s ARG 383 CO 0.63 -0.02 -0.08 -1.17 -1.13 0.00 0.00 175.30 173.53 3k4p s LEU 384 N -0.07 3.05 -0.20 -1.89 2.96 0.12 -1.43 118.68 121.22 3k4p s LEU 384 Ca -0.01 -0.17 -0.03 0.00 -0.22 0.00 0.00 54.13 53.70 3k4p s LEU 384 Cb -0.01 -1.70 -0.00 0.00 0.50 0.00 0.00 46.19 44.97 3k4p s LEU 384 CO 0.00 0.21 -0.08 -0.31 -1.32 0.00 0.00 176.35 174.86 3k4p s TYR 385 N 0.07 2.91 -0.21 5.38 2.02 -0.46 -0.33 117.35 126.74 3k4p s TYR 385 Ca -0.02 -1.01 -0.13 0.00 -0.37 0.00 0.00 57.07 55.55 3k4p s TYR 385 Cb -0.14 -2.04 -0.05 0.00 -0.40 0.00 0.00 41.96 39.34 3k4p s TYR 385 CO 0.03 -0.54 0.25 0.08 -1.57 0.00 0.00 175.55 173.80 3k4p s VAL 386 N 1.28 5.31 0.21 0.71 1.01 0.43 -1.03 120.40 128.33 3k4p s VAL 386 Ca 0.03 0.41 0.11 0.00 0.00 0.00 0.00 61.98 62.52 3k4p s VAL 386 Cb -0.14 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 3k4p s VAL 386 CO -0.04 0.34 -0.16 -1.83 0.00 0.00 0.00 175.10 173.41 3k4p s GLU 387 N 0.90 1.80 -0.05 2.72 -1.05 0.19 -1.63 118.70 121.58 3k4p s GLU 387 Ca 0.13 -1.48 0.03 0.00 -0.15 0.00 0.00 54.97 53.49 3k4p s GLU 387 Cb -0.13 -1.96 0.00 0.00 -0.44 0.00 0.00 34.13 31.60 3k4p s GLU 387 CO 0.04 0.39 -0.14 1.41 0.95 0.00 0.00 175.26 177.91 3k4p s MET 388 N -3.00 1.69 0.09 -4.83 1.75 -1.05 -0.64 119.30 113.31 3k4p s MET 388 Ca 0.25 -0.50 0.03 0.00 -1.25 0.00 0.00 55.69 54.22 3k4p s MET 388 Cb -0.07 -1.44 -0.04 0.00 2.84 0.00 0.00 34.83 36.12 3k4p s MET 388 CO 0.14 0.14 -0.10 0.00 -0.65 0.00 0.00 175.02 174.55 3k4p s MET 389 N 0.32 0.83 -0.13 4.11 0.23 -0.42 -0.30 119.30 123.94 3k4p s MET 389 Ca -0.09 -1.16 -0.00 0.00 -1.03 0.00 0.00 55.69 53.41 3k4p s MET 389 Cb -0.13 -0.50 -0.02 0.00 -1.53 0.00 0.00 34.83 32.66 3k4p s MET 389 CO 0.03 0.07 -0.12 -1.14 -2.03 0.00 0.00 175.02 171.83 3k4p s GLN 390 N -2.83 3.40 0.30 3.16 2.00 0.28 -1.30 119.66 124.68 3k4p s GLN 390 Ca 0.05 -0.67 0.11 0.00 -2.00 0.00 0.00 55.36 52.86 3k4p s GLN 390 Cb -0.02 -2.66 -0.06 0.00 0.80 0.00 0.00 33.01 31.07 3k4p s GLN 390 CO -0.00 0.23 -0.16 0.00 -0.50 0.00 0.00 175.29 174.86 3k4p h GLN 392 N 2.17 -0.46 0.00 0.00 7.50 -1.00 -3.22 115.11 120.10 3k4p h GLN 392 Ca -0.41 0.03 0.00 0.00 0.50 0.00 0.00 58.65 58.77 3k4p h GLN 392 Cb 1.26 0.11 0.00 0.00 0.05 0.00 0.00 27.48 28.89 3k4p h GLN 392 CO 0.64 -0.31 0.00 0.00 -1.50 0.00 0.00 178.83 177.66 3k4p n ALA 393 N -2.33 2.20 -3.09 3.87 0.00 -1.26 -4.87 120.51 115.04 3k4p n ALA 393 Ca -0.10 -0.11 -0.13 0.00 0.00 0.00 0.00 53.44 53.10 3k4p n ALA 393 Cb 0.22 -1.38 -0.14 0.00 0.00 0.00 0.00 19.45 18.15 3k4p n ALA 393 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3k4p s GLU 394 N -2.54 0.05 0.24 0.00 2.56 -1.22 -5.07 118.70 112.73 3k4p s GLU 394 Ca 0.23 0.11 0.02 0.00 0.00 0.00 0.00 54.97 55.32 3k4p s GLU 394 Cb 0.16 -0.02 0.27 0.00 2.00 0.00 0.00 34.13 36.54 3k4p s GLU 394 CO 0.35 -0.04 1.60 -0.56 -0.56 0.00 0.00 175.26 176.06 3k4p h GLN 395 N 6.31 0.42 -6.56 4.30 3.07 -1.89 -3.40 115.11 117.35 3k4p h GLN 395 Ca -0.28 -0.23 -0.52 0.00 0.09 0.00 0.00 58.65 57.71 3k4p h GLN 395 Cb 1.19 0.01 -0.02 0.00 0.08 0.00 0.00 27.48 28.75 3k4p h GLN 395 CO 0.47 0.79 -0.06 -1.21 0.09 0.00 0.00 178.83 178.92 3k4p s GLU 396 N -4.10 3.77 0.33 0.06 2.02 -1.26 -5.00 118.70 114.51 3k4p s GLU 396 Ca -0.06 0.27 -0.28 0.00 0.02 0.00 0.00 54.97 54.92 3k4p s GLU 396 Cb 0.12 -2.58 -0.10 0.00 0.10 0.00 0.00 34.13 31.68 3k4p s GLU 396 CO 0.81 0.20 1.19 -1.25 0.02 0.00 0.00 175.26 176.23 3k4p s PRO 397 N -3.25 4.40 -0.18 0.39 0.05 -1.26 -4.68 135.00 130.47 3k4p s PRO 397 Ca 0.48 1.96 -0.06 0.00 0.05 0.00 0.00 61.00 63.43 3k4p s PRO 397 Cb -0.11 -3.02 -0.03 0.00 0.05 0.00 0.00 34.50 31.39 3k4p s PRO 397 CO 0.25 -0.06 0.02 -0.51 0.05 0.00 0.00 177.00 176.75 3k4p s LEU 398 N -1.83 3.51 -0.03 -3.56 1.43 -0.42 -0.57 118.68 117.21 3k4p s LEU 398 Ca 0.49 -0.05 -0.16 0.00 -1.03 0.00 0.00 54.13 53.38 3k4p s LEU 398 Cb -0.34 -1.87 -0.05 0.00 0.03 0.00 0.00 46.19 43.95 3k4p s LEU 398 CO 0.45 0.15 0.45 -0.69 0.23 0.00 0.00 176.35 176.94 3k4p s VAL 399 N 0.48 5.04 0.05 -1.59 1.01 0.18 -1.30 120.40 124.27 3k4p s VAL 399 Ca -0.00 0.92 0.03 0.00 0.00 0.00 0.00 61.98 62.93 3k4p s VAL 399 Cb -0.13 -3.77 -0.03 0.00 0.00 0.00 0.00 36.38 32.45 3k4p s VAL 399 CO 0.02 0.49 -0.10 -0.60 0.00 0.00 0.00 175.10 174.91 3k4p s ARG 400 N -0.51 0.64 -0.08 2.72 3.52 0.18 -2.48 118.95 122.94 3k4p s ARG 400 Ca 0.25 -0.82 0.02 0.00 -0.13 0.00 0.00 55.73 55.05 3k4p s ARG 400 Cb -0.16 -0.50 0.01 0.00 -1.56 0.00 0.00 34.95 32.74 3k4p s ARG 400 CO 0.13 0.10 -0.13 0.08 -0.81 0.00 0.00 175.30 174.67 3k4p s VAL 401 N -1.32 1.23 -0.01 7.11 1.01 -1.26 0.57 120.40 127.73 3k4p s VAL 401 Ca -0.07 -0.52 0.07 0.00 0.00 0.00 0.00 61.98 61.46 3k4p s VAL 401 Cb -0.10 -1.12 -0.03 0.00 0.00 0.00 0.00 36.38 35.13 3k4p s VAL 401 CO 0.01 0.38 -0.21 -0.76 0.00 0.00 0.00 175.10 174.52 3k4p s LEU 402 N 0.77 2.37 -0.28 3.92 1.02 -0.20 -1.99 118.68 124.30 3k4p s LEU 402 Ca -0.12 -0.40 0.02 0.00 0.02 0.00 0.00 54.13 53.65 3k4p s LEU 402 Cb -0.16 -1.43 0.07 0.00 0.02 0.00 0.00 46.19 44.70 3k4p s LEU 402 CO 0.02 0.31 -0.03 -0.69 0.02 0.00 0.00 176.35 175.98 3k4p s VAL 403 N -0.74 1.86 -1.56 -1.59 1.01 0.51 -1.36 120.40 118.55 3k4p s VAL 403 Ca 0.12 -1.66 -0.10 0.00 0.00 0.00 0.00 61.98 60.34 3k4p s VAL 403 Cb -0.10 -2.17 0.08 0.00 0.00 0.00 0.00 36.38 34.19 3k4p s VAL 403 CO 0.01 -0.26 0.63 0.59 0.00 0.00 0.00 175.10 176.07 3k4p n ASN 404 N 4.50 -2.04 0.00 3.32 3.02 -0.51 -2.65 115.26 120.90 3k4p n ASN 404 Ca -0.07 -1.00 0.00 0.00 -0.03 0.00 0.00 54.58 53.48 3k4p n ASN 404 Cb 0.43 -2.96 0.00 0.00 -0.61 0.00 0.00 39.78 36.64 3k4p n ASN 404 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3k4p n ASP 405 N -2.82 -1.30 -4.61 6.41 8.00 -1.26 -0.61 116.55 120.37 3k4p n ASP 405 Ca -0.10 0.00 -0.36 0.00 0.71 0.00 0.00 54.79 55.04 3k4p n ASP 405 Cb 0.58 -0.22 -0.10 0.00 -0.02 0.00 0.00 41.12 41.36 3k4p n ASP 405 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 3k4p s ARG 406 N -0.28 3.95 0.16 -1.24 3.52 -1.08 -3.65 118.95 120.33 3k4p s ARG 406 Ca 0.00 -0.34 -0.31 0.00 -0.13 0.00 0.00 55.73 54.96 3k4p s ARG 406 Cb 0.00 -3.42 -0.08 0.00 -1.56 0.00 0.00 34.95 29.89 3k4p s ARG 406 CO 0.00 0.05 1.34 0.08 -0.81 0.00 0.00 175.30 175.96 3k4p s VAL 407 N 1.04 3.26 -0.19 7.11 1.01 -1.26 -0.36 120.40 131.01 3k4p s VAL 407 Ca 0.06 0.98 0.01 0.00 0.00 0.00 0.00 61.98 63.03 3k4p s VAL 407 Cb -0.14 -3.63 0.03 0.00 0.00 0.00 0.00 36.38 32.65 3k4p s VAL 407 CO 0.04 0.12 -0.14 -0.69 0.00 0.00 0.00 175.10 174.42 3k4p s VAL 408 N 0.53 1.85 0.08 2.92 1.01 -0.84 -4.80 120.40 121.14 3k4p s VAL 408 Ca 0.60 -1.00 -0.31 0.00 0.00 0.00 0.00 61.98 61.27 3k4p s VAL 408 Cb -0.36 -1.80 -0.08 0.00 0.00 0.00 0.00 36.38 34.13 3k4p s VAL 408 CO 0.35 0.32 1.55 -2.84 0.00 0.00 0.00 175.10 174.48 3k4p s PRO 409 N 1.33 4.24 0.67 2.72 0.02 -1.26 -4.48 135.00 138.24 3k4p s PRO 409 Ca 0.01 2.23 -0.17 0.00 0.02 0.00 0.00 61.00 63.09 3k4p s PRO 409 Cb -0.15 -3.44 -0.02 0.00 0.02 0.00 0.00 34.50 30.91 3k4p s PRO 409 CO -0.10 -0.63 0.94 1.28 -0.33 0.00 0.00 177.00 178.16 3k4p n LEU 410 N 4.94 3.47 -4.40 -5.54 4.77 -1.09 -4.95 117.00 114.19 3k4p n LEU 410 Ca 0.14 0.72 -0.23 0.00 -0.03 0.00 0.00 56.01 56.61 3k4p n LEU 410 Cb 0.41 -1.39 -0.11 0.00 -2.33 0.00 0.00 43.42 40.00 3k4p n LEU 410 CO 0.61 -2.03 -0.49 -1.00 -1.33 0.00 0.00 177.39 173.15 3k4p s HIS 411 N -1.69 2.08 0.00 -1.77 3.76 -1.26 -4.69 115.29 111.72 3k4p s HIS 411 Ca 0.74 -0.41 0.00 0.00 -0.15 0.00 0.00 55.06 55.24 3k4p s HIS 411 Cb -0.37 -0.97 0.00 0.00 1.11 0.00 0.00 32.58 32.35 3k4p s HIS 411 CO 0.49 0.51 0.00 0.41 -0.85 0.00 0.00 174.74 175.30 3k4p n GLY 412 N -0.15 0.72 3.39 -2.22 0.00 -1.26 -4.91 105.19 100.76 3k4p n GLY 412 Ca -0.09 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.83 3k4p n GLY 412 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k4p s PRO 414 N -3.85 2.49 0.48 0.00 0.02 -1.26 -4.93 135.00 127.95 3k4p s PRO 414 Ca 0.07 -0.67 -0.24 0.00 0.02 0.00 0.00 61.00 60.17 3k4p s PRO 414 Cb 0.01 -5.14 -0.07 0.00 0.02 0.00 0.00 34.50 29.32 3k4p s PRO 414 CO -0.08 -3.70 1.42 1.33 -0.33 0.00 0.00 177.00 175.65 3k4p n VAL 415 N 7.88 3.12 -2.54 3.83 0.24 -1.26 -4.72 118.33 124.88 3k4p n VAL 415 Ca 0.42 -0.50 -0.20 0.00 -2.04 0.00 0.00 64.34 62.03 3k4p n VAL 415 Cb 0.47 -1.80 0.10 0.00 -1.47 0.00 0.00 33.84 31.14 3k4p n VAL 415 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 3k4p n ASP 416 N -0.44 1.12 0.00 -1.34 5.68 -0.75 -4.94 116.55 115.88 3k4p n ASP 416 Ca 0.07 -1.95 0.11 0.00 -0.50 0.00 0.00 54.79 52.52 3k4p n ASP 416 Cb 0.42 -0.55 0.54 0.00 -1.14 0.00 0.00 41.12 40.39 3k4p n ASP 416 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3k4p n ALA 417 N -2.94 2.12 0.25 2.12 0.00 -1.26 -2.32 120.51 118.48 3k4p n ALA 417 Ca -0.14 -0.10 0.11 0.00 0.00 0.00 0.00 53.44 53.32 3k4p n ALA 417 Cb 0.50 -1.37 0.26 0.00 0.00 0.00 0.00 19.45 18.83 3k4p n ALA 417 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3k4p n LEU 418 N -1.38 3.33 0.00 0.00 4.77 -1.26 -4.94 117.00 117.52 3k4p n LEU 418 Ca 0.08 -1.52 0.00 0.00 -0.03 0.00 0.00 56.01 54.55 3k4p n LEU 418 Cb 0.22 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 3k4p n LEU 418 CO 0.19 0.76 0.00 0.61 -1.33 0.00 0.00 177.39 177.62 3k4p n GLY 419 N 1.49 0.73 3.83 -0.72 0.00 -0.98 -4.95 105.19 104.59 3k4p n GLY 419 Ca 0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.94 3k4p n GLY 419 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3k4p s ARG 420 N -0.34 3.04 0.21 1.61 0.52 -1.26 -2.69 118.95 120.05 3k4p s ARG 420 Ca 0.00 -0.70 0.10 0.00 -0.52 0.00 0.00 55.73 54.61 3k4p s ARG 420 Cb 0.00 -2.78 -0.05 0.00 0.52 0.00 0.00 34.95 32.65 3k4p s ARG 420 CO 0.00 0.54 -0.19 0.00 0.02 0.00 0.00 175.30 175.67 3k4p s THR 422 N -2.33 2.33 0.22 0.00 -4.23 -1.26 0.48 115.64 110.84 3k4p s THR 422 Ca 0.23 0.24 -0.08 0.00 -1.18 0.00 0.00 61.69 60.90 3k4p s THR 422 Cb -0.05 -3.12 0.16 0.00 1.34 0.00 0.00 72.50 70.83 3k4p s THR 422 CO 0.10 -0.01 1.78 -0.09 -0.54 0.00 0.00 174.62 175.86 3k4p h ARG 423 N 1.50 0.57 -0.59 3.99 1.12 -1.18 -0.48 114.38 119.31 3k4p h ARG 423 Ca -0.51 -0.03 -0.05 0.00 -1.11 0.00 0.00 59.98 58.28 3k4p h ARG 423 Cb 1.29 -0.13 -0.03 0.00 -0.01 0.00 0.00 29.97 31.10 3k4p h ARG 423 CO 0.57 0.38 0.17 -0.44 -3.11 0.00 0.00 179.97 177.55 3k4p h ASP 424 N 0.59 0.83 0.61 -3.80 3.32 -1.91 -0.95 116.42 115.11 3k4p h ASP 424 Ca 0.32 -0.14 -0.28 0.00 0.02 0.00 0.00 57.03 56.96 3k4p h ASP 424 Cb 0.32 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.65 3k4p h ASP 424 CO -0.25 0.79 -1.29 0.77 -1.72 0.00 0.00 179.24 177.54 3k4p h SER 425 N 0.87 0.39 -0.43 6.45 4.64 -1.84 -2.00 113.55 121.64 3k4p h SER 425 Ca 0.19 -0.44 0.05 0.00 -0.47 0.00 0.00 61.79 61.12 3k4p h SER 425 Cb 0.27 -0.13 -0.05 0.00 -0.31 0.00 0.00 62.40 62.18 3k4p h SER 425 CO -0.01 1.35 0.16 0.15 -0.87 0.00 0.00 176.83 177.62 3k4p h PHE 426 N 0.07 0.29 0.06 4.77 3.57 -0.84 -0.95 116.94 123.91 3k4p h PHE 426 Ca -0.15 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.37 3k4p h PHE 426 Cb 1.97 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 40.65 3k4p h PHE 426 CO 0.06 0.12 -0.03 0.28 -2.23 0.00 0.00 178.31 176.51 3k4p h VAL 427 N 0.34 1.08 -1.00 1.41 2.07 -1.14 -2.24 116.25 116.76 3k4p h VAL 427 Ca 0.20 -0.48 0.24 0.00 0.82 0.00 0.00 66.70 67.47 3k4p h VAL 427 Cb 0.17 1.40 -0.09 0.00 -1.52 0.00 0.00 31.29 31.25 3k4p h VAL 427 CO -0.19 0.12 0.64 -0.09 0.02 0.00 0.00 177.57 178.08 3k4p h ARG 428 N -0.30 0.44 0.00 1.57 2.43 -1.32 0.61 114.38 117.81 3k4p h ARG 428 Ca -0.01 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 3k4p h ARG 428 Cb 0.26 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 3k4p h ARG 428 CO 0.01 0.29 0.00 0.78 -1.51 0.00 0.00 179.97 179.54 3k4p h GLY 429 N 0.45 0.00 -3.77 2.80 0.00 -0.54 -3.23 103.07 98.78 3k4p h GLY 429 Ca 0.57 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 47.39 3k4p h GLY 429 CO -0.28 0.00 0.65 1.04 0.00 0.00 0.00 176.54 177.95 3k4p n LEU 430 N -2.89 7.09 0.03 3.11 4.77 0.21 -4.44 117.00 124.89 3k4p n LEU 430 Ca 0.00 -3.82 0.06 0.00 -0.03 0.00 0.00 56.01 52.23 3k4p n LEU 430 Cb 0.25 -1.02 0.48 0.00 -2.33 0.00 0.00 43.42 40.80 3k4p n LEU 430 CO 0.24 1.36 1.15 0.77 -1.33 0.00 0.00 177.39 179.59 3k4p h SER 431 N 1.78 0.36 0.50 -1.43 4.64 -1.72 0.12 113.55 117.81 3k4p h SER 431 Ca 0.45 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.75 3k4p h SER 431 Cb 0.84 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.83 3k4p h SER 431 CO 1.18 0.26 -0.48 0.15 -0.87 0.00 0.00 176.83 177.07 3k4p h PHE 432 N 0.42 -1.32 -0.26 4.77 3.57 -1.92 0.05 116.94 122.25 3k4p h PHE 432 Ca 0.15 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.62 3k4p h PHE 432 Cb 0.06 0.51 -0.01 0.00 2.79 0.00 0.00 35.95 39.30 3k4p h PHE 432 CO -0.00 -0.64 0.01 0.00 -2.23 0.00 0.00 178.31 175.44 3k4p h ALA 433 N -0.98 1.52 0.00 2.41 0.00 -1.73 -0.37 119.26 120.12 3k4p h ALA 433 Ca -0.06 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 3k4p h ALA 433 Cb 0.83 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 3k4p h ALA 433 CO -0.05 0.35 -0.40 0.00 0.00 0.00 0.00 179.25 179.15 3k4p h ARG 434 N 0.38 0.00 -0.00 0.00 3.08 -0.33 -1.76 114.38 115.75 3k4p h ARG 434 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.14 3k4p h ARG 434 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.30 3k4p h ARG 434 CO 0.01 0.40 -0.22 -1.13 -1.07 0.00 0.00 179.97 177.95 3k4p n SER 435 N -3.84 0.58 0.00 7.04 3.41 -0.03 -4.92 113.62 115.86 3k4p n SER 435 Ca -0.01 -0.48 0.00 0.00 -0.26 0.00 0.00 58.87 58.12 3k4p n SER 435 Cb 0.46 0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.42 3k4p n SER 435 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3k4p n GLY 436 N 1.37 0.89 7.00 5.00 0.00 -0.66 -4.99 105.19 113.80 3k4p n GLY 436 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 3k4p n GLY 436 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k4p n GLY 437 N -2.11 2.52 1.94 -0.02 0.00 -0.17 -1.85 105.19 105.50 3k4p n GLY 437 Ca 0.00 -0.16 -0.21 0.00 0.00 0.00 0.00 46.02 45.66 3k4p n GLY 437 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3k4p n ASP 438 N 1.10 4.25 0.12 1.61 8.00 -1.26 -4.68 116.55 125.69 3k4p n ASP 438 Ca 0.00 -3.71 0.05 0.00 0.71 0.00 0.00 54.79 51.84 3k4p n ASP 438 Cb 0.00 -0.78 0.49 0.00 -0.02 0.00 0.00 41.12 40.81 3k4p n ASP 438 CO 0.00 0.00 0.00 -0.25 -0.39 0.00 0.00 177.20 176.56 3k4p h TRP 439 N 1.28 0.27 -0.07 1.24 2.91 -1.71 -0.94 115.95 118.94 3k4p h TRP 439 Ca 0.50 -0.00 0.02 0.00 1.13 0.00 0.00 58.89 60.54 3k4p h TRP 439 Cb 2.04 -0.09 -0.00 0.00 -0.51 0.00 0.00 29.16 30.60 3k4p h TRP 439 CO 1.37 0.22 0.12 0.00 -1.03 0.00 0.00 178.44 179.12 3k4p h ALA 440 N 1.81 1.47 -0.05 2.65 0.00 -1.83 -0.96 119.26 122.35 3k4p h ALA 440 Ca 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3k4p h ALA 440 Cb 0.06 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3k4p h ALA 440 CO -0.01 -0.15 0.00 0.39 0.00 0.00 0.00 179.25 179.48 3k4p n GLU 441 N -3.51 1.25 0.11 0.00 1.02 -0.36 -3.71 120.64 115.45 3k4p n GLU 441 Ca -0.01 -0.37 0.12 0.00 -0.02 0.00 0.00 57.16 56.88 3k4p n GLU 441 Cb 0.21 -1.35 0.46 0.00 -0.02 0.00 0.00 31.44 30.74 3k4p n GLU 441 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3k4p n PHE 443 N -2.19 0.00 1.63 0.00 3.72 -1.24 -1.87 117.46 117.50 3k4p n PHE 443 Ca 0.03 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.58 3k4p n PHE 443 Cb 0.29 0.01 0.64 0.00 -0.94 0.00 0.00 39.48 39.48 3k4p n PHE 443 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71