#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jxh s TYR 59 N 0.00 3.33 0.05 6.00 5.04 -1.26 -5.04 117.35 125.47 3jxh s TYR 59 Ca 0.00 1.38 -0.04 0.00 -2.44 0.00 0.00 57.07 55.97 3jxh s TYR 59 Cb 0.00 -3.51 -0.02 0.00 0.35 0.00 0.00 41.96 38.78 3jxh s TYR 59 CO 0.00 -1.46 0.05 1.67 -1.34 0.00 0.00 175.55 174.46 3jxh s TRP 60 N -0.29 0.32 0.29 4.97 1.48 -1.26 -4.99 118.94 119.46 3jxh s TRP 60 Ca 0.53 -0.73 0.03 0.00 -1.06 0.00 0.00 56.10 54.86 3jxh s TRP 60 Cb -0.35 -0.23 -0.03 0.00 -1.16 0.00 0.00 33.47 31.70 3jxh s TRP 60 CO 0.40 -0.38 0.27 0.00 -4.06 0.00 0.00 176.95 173.18 3jxh s ALA 61 N -3.19 1.46 -2.73 2.67 0.00 -0.15 -5.01 121.76 114.81 3jxh s ALA 61 Ca 0.00 -1.86 0.25 0.00 0.00 0.00 0.00 51.96 50.35 3jxh s ALA 61 Cb 0.02 1.40 0.54 0.00 0.00 0.00 0.00 23.12 25.08 3jxh s ALA 61 CO -0.07 -0.67 1.46 0.66 0.00 0.00 0.00 175.76 177.14 3jxh n TYR 62 N -0.51 0.07 -3.85 0.00 4.01 -1.26 -3.61 117.16 112.00 3jxh n TYR 62 Ca 0.05 -0.03 -0.09 0.00 -0.16 0.00 0.00 57.90 57.67 3jxh n TYR 62 Cb 0.63 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.67 3jxh n TYR 62 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 3jxh s SER 63 N -1.91 0.01 0.00 7.72 1.04 -1.26 -4.60 113.70 114.69 3jxh s SER 63 Ca 0.33 -1.02 0.00 0.00 0.48 0.00 0.00 55.95 55.73 3jxh s SER 63 Cb 0.20 0.79 0.00 0.00 0.10 0.00 0.00 66.02 67.12 3jxh s SER 63 CO 0.31 -1.54 0.00 0.61 0.98 0.00 0.00 173.24 173.60 3jxh n GLY 64 N -0.51 -1.54 0.20 7.32 0.00 -1.26 -3.05 105.19 106.35 3jxh n GLY 64 Ca -0.06 -1.34 0.14 0.00 0.00 0.00 0.00 46.02 44.77 3jxh n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jxh h ALA 65 N 0.00 1.00 -0.27 4.61 0.00 -2.01 -2.01 119.26 120.58 3jxh h ALA 65 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3jxh h ALA 65 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3jxh h ALA 65 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.91 3jxh n TYR 66 N -2.63 0.92 -1.19 0.00 4.02 -1.26 -4.80 117.16 112.22 3jxh n TYR 66 Ca 0.01 -0.86 -0.30 0.00 -0.01 0.00 0.00 57.90 56.75 3jxh n TYR 66 Cb 0.26 -0.30 0.22 0.00 -0.02 0.00 0.00 39.34 39.50 3jxh n TYR 66 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 3jxh s GLY 67 N -1.88 1.59 0.42 2.72 0.00 -0.76 -0.98 107.32 108.43 3jxh s GLY 67 Ca 0.41 -0.81 0.14 0.00 0.00 0.00 0.00 44.72 44.46 3jxh s GLY 67 CO 0.09 -0.01 1.93 -2.55 0.00 0.00 0.00 173.10 172.56 3jxh h PRO 68 N -2.30 0.44 0.00 2.90 0.11 -1.81 0.14 132.00 131.48 3jxh h PRO 68 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3jxh h PRO 68 Cb 1.30 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3jxh h PRO 68 CO 0.42 0.29 0.00 0.39 -0.21 0.00 0.00 178.00 178.88 3jxh n GLU 69 N -4.48 0.01 0.00 1.05 1.02 -1.26 -2.45 120.64 114.53 3jxh n GLU 69 Ca 0.13 0.21 0.06 0.00 -0.02 0.00 0.00 57.16 57.55 3jxh n GLU 69 Cb 0.47 -1.52 0.01 0.00 -0.02 0.00 0.00 31.44 30.38 3jxh n GLU 69 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 3jxh n HIS 70 N -1.54 0.00 -0.32 -0.32 8.25 0.48 -4.60 115.22 117.17 3jxh n HIS 70 Ca 0.04 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.59 3jxh n HIS 70 Cb 0.20 0.00 0.29 0.00 1.12 0.00 0.00 29.99 31.60 3jxh n HIS 70 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 3jxh h TRP 71 N 1.68 1.02 -0.26 4.41 6.55 -1.26 -2.14 115.95 125.95 3jxh h TRP 71 Ca 0.00 0.03 0.07 0.00 0.95 0.00 0.00 58.89 59.94 3jxh h TRP 71 Cb 0.45 -0.32 -0.01 0.00 -0.86 0.00 0.00 29.16 28.41 3jxh h TRP 71 CO 0.00 0.40 0.19 -0.24 -1.05 0.00 0.00 178.44 177.74 3jxh h VAL 72 N 0.89 0.85 -0.71 1.49 3.04 -1.80 0.38 116.25 120.39 3jxh h VAL 72 Ca 0.47 0.00 0.09 0.00 -1.01 0.00 0.00 66.70 66.25 3jxh h VAL 72 Cb 0.55 0.87 -0.07 0.00 -2.01 0.00 0.00 31.29 30.63 3jxh h VAL 72 CO -0.23 0.00 0.37 0.74 -1.01 0.00 0.00 177.57 177.43 3jxh h THR 73 N 0.00 0.87 0.04 3.17 2.02 -1.72 -3.20 112.91 114.08 3jxh h THR 73 Ca 0.12 -0.22 -0.36 0.00 0.77 0.00 0.00 66.41 66.72 3jxh h THR 73 Cb 0.49 0.18 -0.05 0.00 -1.74 0.00 0.00 68.15 67.04 3jxh h THR 73 CO -0.00 0.12 -2.17 -1.20 0.37 0.00 0.00 175.52 172.63 3jxh n SER 74 N -4.84 1.47 -3.96 4.18 7.64 -0.44 -4.79 113.62 112.87 3jxh n SER 74 Ca 0.11 0.10 -0.31 0.00 1.01 0.00 0.00 58.87 59.78 3jxh n SER 74 Cb 0.26 -0.23 -0.15 0.00 -1.01 0.00 0.00 64.21 63.08 3jxh n SER 74 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 3jxh s SER 75 N -6.42 4.55 0.31 6.43 0.01 -0.01 -5.01 113.70 113.56 3jxh s SER 75 Ca -0.21 -1.94 0.03 0.00 1.31 0.00 0.00 55.95 55.14 3jxh s SER 75 Cb 0.07 -1.45 0.62 0.00 0.21 0.00 0.00 66.02 65.48 3jxh s SER 75 CO 0.74 -0.37 1.86 1.62 0.41 0.00 0.00 173.24 177.50 3jxh h VAL 76 N 6.60 0.92 -0.18 3.43 3.04 -1.82 -1.34 116.25 126.90 3jxh h VAL 76 Ca -0.08 -0.32 0.05 0.00 -1.01 0.00 0.00 66.70 65.35 3jxh h VAL 76 Cb 1.02 -0.08 -0.01 0.00 -2.01 0.00 0.00 31.29 30.21 3jxh h VAL 76 CO 0.50 0.17 0.22 0.28 -1.01 0.00 0.00 177.57 177.73 3jxh h SER 77 N 0.92 0.00 0.32 3.17 0.02 -1.88 -1.97 113.55 114.13 3jxh h SER 77 Ca 0.47 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.42 3jxh h SER 77 Cb 0.51 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.05 3jxh h SER 77 CO -0.23 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.46 3jxh n GLY 79 N -0.74 3.27 3.69 0.00 0.00 -0.74 -4.81 105.19 105.86 3jxh n GLY 79 Ca -0.01 -0.96 -0.29 0.00 0.00 0.00 0.00 46.02 44.76 3jxh n GLY 79 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3jxh s GLY 80 N -1.03 1.60 0.08 -0.02 0.00 -0.02 -4.99 107.32 102.94 3jxh s GLY 80 Ca 0.53 -0.75 0.23 0.00 0.00 0.00 0.00 44.72 44.73 3jxh s GLY 80 CO 0.14 -0.01 1.10 0.54 0.00 0.00 0.00 173.10 174.87 3jxh n ARG 81 N -4.31 0.33 -3.14 2.90 5.12 -1.26 -4.47 116.66 111.83 3jxh n ARG 81 Ca 0.10 0.03 -0.28 0.00 -1.93 0.00 0.00 57.85 55.77 3jxh n ARG 81 Cb 0.59 -1.64 -0.06 0.00 -1.16 0.00 0.00 32.46 30.19 3jxh n ARG 81 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 3jxh n HIS 82 N -2.08 3.84 -3.49 -1.55 8.25 -1.26 -4.66 115.22 114.27 3jxh n HIS 82 Ca 0.02 -4.02 -0.19 0.00 -0.26 0.00 0.00 57.72 53.27 3jxh n HIS 82 Cb 0.45 -0.55 -0.00 0.00 1.12 0.00 0.00 29.99 31.01 3jxh n HIS 82 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 3jxh s GLN 83 N -3.06 3.14 0.16 -0.41 -1.52 -1.26 -3.77 119.66 112.95 3jxh s GLN 83 Ca 0.45 -0.97 0.08 0.00 -1.95 0.00 0.00 55.36 52.97 3jxh s GLN 83 Cb 0.22 -2.82 -0.04 0.00 -0.22 0.00 0.00 33.01 30.15 3jxh s GLN 83 CO -0.08 0.08 -0.17 -1.12 -0.25 0.00 0.00 175.29 173.75 3jxh s SER 84 N -4.16 2.55 0.73 5.90 0.01 -1.26 -4.63 113.70 112.84 3jxh s SER 84 Ca 0.44 -0.88 -0.07 0.00 1.31 0.00 0.00 55.95 56.75 3jxh s SER 84 Cb -0.10 -0.14 0.08 0.00 0.21 0.00 0.00 66.02 66.07 3jxh s SER 84 CO 0.31 -0.08 1.04 -2.16 0.41 0.00 0.00 173.24 172.77 3jxh s PRO 85 N -2.92 2.04 0.21 12.44 0.04 -1.26 -4.54 135.00 141.00 3jxh s PRO 85 Ca 0.16 -0.31 0.04 0.00 0.04 0.00 0.00 61.00 60.93 3jxh s PRO 85 Cb -0.05 -2.15 -0.05 0.00 0.04 0.00 0.00 34.50 32.30 3jxh s PRO 85 CO 0.06 -1.36 -0.03 0.96 0.04 0.00 0.00 177.00 176.68 3jxh s ILE 86 N -3.30 1.06 -0.06 0.56 -4.36 -1.26 -0.52 121.20 113.33 3jxh s ILE 86 Ca 0.62 -2.04 -0.20 0.00 -0.26 0.00 0.00 60.65 58.77 3jxh s ILE 86 Cb -0.10 -2.22 -0.05 0.00 1.25 0.00 0.00 42.46 41.34 3jxh s ILE 86 CO 0.45 -0.43 0.56 -0.62 0.24 0.00 0.00 174.94 175.15 3jxh s ASP 87 N -3.27 6.86 -0.33 4.36 2.15 -1.26 -3.04 116.67 122.14 3jxh s ASP 87 Ca 0.26 1.03 -0.12 0.00 0.43 0.00 0.00 52.55 54.14 3jxh s ASP 87 Cb 0.05 -2.34 -0.01 0.00 -0.30 0.00 0.00 42.92 40.32 3jxh s ASP 87 CO 0.07 0.04 0.21 -0.63 -0.17 0.00 0.00 175.17 174.69 3jxh s ILE 88 N 0.22 5.08 -0.43 4.11 1.01 -0.00 -4.95 121.20 126.24 3jxh s ILE 88 Ca 0.30 -0.27 -0.22 0.00 0.00 0.00 0.00 60.65 60.46 3jxh s ILE 88 Cb -0.17 -3.60 0.02 0.00 0.01 0.00 0.00 42.46 38.72 3jxh s ILE 88 CO 0.15 0.02 0.69 -0.76 0.00 0.00 0.00 174.94 175.04 3jxh s LEU 89 N 1.69 4.36 0.33 2.97 1.43 -1.26 -0.44 118.68 127.76 3jxh s LEU 89 Ca 0.06 -0.16 0.04 0.00 -1.03 0.00 0.00 54.13 53.04 3jxh s LEU 89 Cb -0.17 -2.83 0.57 0.00 0.03 0.00 0.00 46.19 43.79 3jxh s LEU 89 CO 0.09 -0.79 1.85 -0.78 0.23 0.00 0.00 176.35 176.96 3jxh h ASP 90 N 8.83 0.50 -0.57 2.29 3.58 -1.96 -1.17 116.42 127.92 3jxh h ASP 90 Ca -0.25 -0.10 0.10 0.00 0.42 0.00 0.00 57.03 57.20 3jxh h ASP 90 Cb 1.09 -0.13 -0.03 0.00 1.72 0.00 0.00 39.33 41.98 3jxh h ASP 90 CO 0.91 0.59 0.38 1.56 -2.88 0.00 0.00 179.24 179.80 3jxh h GLN 91 N 0.50 0.32 -0.18 0.28 7.50 -2.02 -1.76 115.11 119.76 3jxh h GLN 91 Ca 0.10 -0.02 0.00 0.00 0.50 0.00 0.00 58.65 59.24 3jxh h GLN 91 Cb 0.37 -0.07 0.00 0.00 0.05 0.00 0.00 27.48 27.83 3jxh h GLN 91 CO 0.01 0.21 0.00 0.66 -1.50 0.00 0.00 178.83 178.22 3jxh n TYR 92 N -4.46 0.21 -2.67 2.96 0.53 -0.46 -4.90 117.16 108.38 3jxh n TYR 92 Ca 0.09 -0.11 -0.42 0.00 -1.02 0.00 0.00 57.90 56.45 3jxh n TYR 92 Cb 0.40 0.00 -0.03 0.00 -1.03 0.00 0.00 39.34 38.68 3jxh n TYR 92 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 3jxh s ALA 93 N -1.79 3.22 -0.15 -0.72 0.00 -0.66 -4.61 121.76 117.06 3jxh s ALA 93 Ca 0.34 0.57 -0.19 0.00 0.00 0.00 0.00 51.96 52.68 3jxh s ALA 93 Cb 0.21 -3.37 -0.04 0.00 0.00 0.00 0.00 23.12 19.92 3jxh s ALA 93 CO 0.30 -0.30 0.53 1.03 0.00 0.00 0.00 175.76 177.32 3jxh s ARG 94 N 1.13 4.29 0.58 0.00 1.81 -0.27 -4.70 118.95 121.79 3jxh s ARG 94 Ca 0.53 0.51 0.27 0.00 -1.72 0.00 0.00 55.73 55.32 3jxh s ARG 94 Cb -0.22 -3.49 1.59 0.00 -0.45 0.00 0.00 34.95 32.38 3jxh s ARG 94 CO 0.27 0.01 2.08 0.28 -0.68 0.00 0.00 175.30 177.26 3jxh h VAL 95 N 4.90 0.53 -0.81 3.52 2.07 -1.90 0.88 116.25 125.44 3jxh h VAL 95 Ca -0.38 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.14 3jxh h VAL 95 Cb 1.17 0.83 0.00 0.00 -1.52 0.00 0.00 31.29 31.77 3jxh h VAL 95 CO 0.75 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.95 3jxh n GLY 96 N -1.45 -0.04 3.30 2.17 0.00 -1.26 -4.50 105.19 103.41 3jxh n GLY 96 Ca 0.03 -0.61 -0.38 0.00 0.00 0.00 0.00 46.02 45.06 3jxh n GLY 96 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3jxh n GLU 97 N -0.64 0.15 -2.28 1.61 -0.58 -1.26 -4.86 120.64 112.79 3jxh n GLU 97 Ca 0.00 0.07 -0.43 0.00 -0.42 0.00 0.00 57.16 56.38 3jxh n GLU 97 Cb 0.00 -1.34 -0.02 0.00 -0.57 0.00 0.00 31.44 29.51 3jxh n GLU 97 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 3jxh s GLU 98 N -1.84 3.48 -0.07 3.49 2.12 -1.26 -5.01 118.70 119.61 3jxh s GLU 98 Ca 0.58 0.99 0.02 0.00 0.36 0.00 0.00 54.97 56.91 3jxh s GLU 98 Cb -0.39 -4.08 -0.03 0.00 0.26 0.00 0.00 34.13 29.89 3jxh s GLU 98 CO 0.65 -1.68 -0.10 0.71 -0.54 0.00 0.00 175.26 174.30 3jxh s TYR 99 N 5.86 2.85 0.17 5.30 4.12 -1.26 -5.05 117.35 129.33 3jxh s TYR 99 Ca 0.64 -0.11 -0.32 0.00 0.02 0.00 0.00 57.07 57.30 3jxh s TYR 99 Cb -0.15 -1.71 -0.16 0.00 -1.52 0.00 0.00 41.96 38.42 3jxh s TYR 99 CO 0.32 0.22 0.93 0.94 0.02 0.00 0.00 175.55 177.98 3jxh n GLN 100 N 2.43 0.66 -1.44 -0.62 7.27 -1.26 -4.77 117.38 119.65 3jxh n GLN 100 Ca -0.18 0.23 -0.33 0.00 0.07 0.00 0.00 57.00 56.79 3jxh n GLN 100 Cb 0.53 -1.56 0.09 0.00 2.41 0.00 0.00 30.24 31.70 3jxh n GLN 100 CO 0.00 0.00 0.00 -1.21 0.07 0.00 0.00 177.06 175.92 3jxh s GLU 101 N -0.70 2.20 0.09 3.69 0.41 -1.26 -1.02 118.70 122.12 3jxh s GLU 101 Ca 0.71 1.62 -0.34 0.00 -0.41 0.00 0.00 54.97 56.55 3jxh s GLU 101 Cb -0.92 -1.86 -0.13 0.00 -1.78 0.00 0.00 34.13 29.44 3jxh s GLU 101 CO 0.55 -1.76 1.66 1.28 -0.49 0.00 0.00 175.26 176.50 3jxh n LEU 102 N -2.82 3.18 -4.46 1.80 4.77 -1.26 -4.41 117.00 113.80 3jxh n LEU 102 Ca 0.12 1.05 -0.39 0.00 -0.03 0.00 0.00 56.01 56.77 3jxh n LEU 102 Cb 0.51 -1.41 -0.12 0.00 -2.33 0.00 0.00 43.42 40.07 3jxh n LEU 102 CO 0.48 -0.23 -0.20 -1.10 -1.33 0.00 0.00 177.39 175.01 3jxh s GLN 103 N 1.76 3.43 -0.15 3.23 -1.52 0.10 -4.98 119.66 121.53 3jxh s GLN 103 Ca 0.83 -0.66 -0.04 0.00 -1.95 0.00 0.00 55.36 53.53 3jxh s GLN 103 Cb -0.68 -3.58 -0.03 0.00 -0.22 0.00 0.00 33.01 28.49 3jxh s GLN 103 CO 0.42 -0.38 -0.00 -0.51 -0.25 0.00 0.00 175.29 174.56 3jxh s LEU 104 N 1.64 3.46 -0.12 2.90 1.43 -1.26 -1.74 118.68 124.98 3jxh s LEU 104 Ca 0.05 -0.02 0.03 0.00 -1.03 0.00 0.00 54.13 53.16 3jxh s LEU 104 Cb -0.17 -1.84 0.01 0.00 0.03 0.00 0.00 46.19 44.22 3jxh s LEU 104 CO 0.07 0.21 -0.22 -1.81 0.23 0.00 0.00 176.35 174.83 3jxh s ASP 105 N 0.13 3.00 0.00 2.29 1.01 -0.26 -4.74 116.67 118.11 3jxh s ASP 105 Ca 0.01 -0.57 0.00 0.00 0.71 0.00 0.00 52.55 52.70 3jxh s ASP 105 Cb -0.13 -1.38 0.00 0.00 1.01 0.00 0.00 42.92 42.41 3jxh s ASP 105 CO 0.02 0.10 0.00 0.61 0.21 0.00 0.00 175.17 176.11 3jxh n GLY 106 N 3.90 1.16 0.26 0.21 0.00 -1.26 -0.82 105.19 108.64 3jxh n GLY 106 Ca -0.20 0.00 0.14 0.00 0.00 0.00 0.00 46.02 45.97 3jxh n GLY 106 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3jxh h PHE 107 N 0.00 0.00 0.00 1.61 -1.00 -1.85 -2.84 116.94 112.85 3jxh h PHE 107 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 3jxh h PHE 107 Cb 0.00 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.56 3jxh h PHE 107 CO 0.00 0.08 -0.13 -0.44 -1.61 0.00 0.00 178.31 176.21 3jxh h ASP 108 N 0.00 0.00 -3.97 2.17 3.32 -1.94 -0.88 116.42 115.12 3jxh h ASP 108 Ca -0.00 -0.04 -0.49 0.00 0.02 0.00 0.00 57.03 56.53 3jxh h ASP 108 Cb 0.61 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.19 3jxh h ASP 108 CO 0.01 0.02 0.42 0.20 -1.72 0.00 0.00 179.24 178.17 3jxh s ASN 109 N -4.74 6.67 0.41 6.45 0.01 -1.08 -4.91 114.94 117.75 3jxh s ASN 109 Ca 0.09 2.08 -0.25 0.00 -0.71 0.00 0.00 52.86 54.08 3jxh s ASN 109 Cb 0.11 -2.59 -0.08 0.00 0.41 0.00 0.00 41.25 39.10 3jxh s ASN 109 CO 0.63 -0.55 1.18 -1.61 -1.51 0.00 0.00 177.10 175.24 3jxh s GLU 110 N -2.52 3.98 0.57 -0.60 2.02 -1.26 -4.35 118.70 116.55 3jxh s GLU 110 Ca 0.58 1.84 -0.18 0.00 0.02 0.00 0.00 54.97 57.24 3jxh s GLU 110 Cb -0.23 -2.62 -0.05 0.00 0.10 0.00 0.00 34.13 31.33 3jxh s GLU 110 CO 0.29 -0.38 1.09 -1.54 0.02 0.00 0.00 175.26 174.74 3jxh s SER 111 N -1.16 5.73 0.56 -0.19 1.04 -0.04 -4.93 113.70 114.71 3jxh s SER 111 Ca 0.58 2.01 -0.20 0.00 0.48 0.00 0.00 55.95 58.82 3jxh s SER 111 Cb -0.31 -2.56 -0.04 0.00 0.10 0.00 0.00 66.02 63.21 3jxh s SER 111 CO 0.38 -1.21 1.25 -0.55 0.98 0.00 0.00 173.24 174.10 3jxh s SER 112 N -2.20 5.35 0.00 7.02 0.15 -1.26 -4.59 113.70 118.17 3jxh s SER 112 Ca 0.68 2.51 0.19 0.00 0.70 0.00 0.00 55.95 60.03 3jxh s SER 112 Cb -0.20 -2.61 1.12 0.00 -1.71 0.00 0.00 66.02 62.62 3jxh s SER 112 CO 0.31 -1.49 1.56 -0.46 1.20 0.00 0.00 173.24 174.36 3jxh n ASN 113 N -1.24 0.00 0.01 5.45 2.04 -1.26 -2.28 115.26 117.98 3jxh n ASN 113 Ca 0.12 -0.48 0.13 0.00 -0.44 0.00 0.00 54.58 53.91 3jxh n ASN 113 Cb 0.48 -0.06 0.34 0.00 -2.53 0.00 0.00 39.78 38.01 3jxh n ASN 113 CO 0.00 0.00 0.00 0.29 -0.44 0.00 0.00 177.26 177.11 3jxh n LYS 114 N -1.06 0.04 -2.02 -3.83 4.76 -1.26 -4.59 118.16 110.19 3jxh n LYS 114 Ca 0.13 0.01 -0.41 0.00 -2.87 0.00 0.00 58.31 55.18 3jxh n LYS 114 Cb 0.09 -1.53 -0.02 0.00 -1.84 0.00 0.00 35.03 31.73 3jxh n LYS 114 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 3jxh s THR 115 N -3.02 2.62 0.14 -0.18 2.01 -0.96 -4.86 115.64 111.39 3jxh s THR 115 Ca 0.11 0.56 -0.02 0.00 0.31 0.00 0.00 61.69 62.66 3jxh s THR 115 Cb 0.17 -3.36 -0.04 0.00 0.01 0.00 0.00 72.50 69.29 3jxh s THR 115 CO 0.65 0.11 0.08 -1.66 -0.69 0.00 0.00 174.62 173.11 3jxh s TRP 116 N -0.44 0.83 -0.01 4.92 1.48 -1.17 -1.86 118.94 122.68 3jxh s TRP 116 Ca 0.56 -1.19 0.03 0.00 -1.06 0.00 0.00 56.10 54.44 3jxh s TRP 116 Cb -0.42 -0.44 -0.01 0.00 -1.16 0.00 0.00 33.47 31.45 3jxh s TRP 116 CO 0.48 -0.54 -0.11 1.41 -4.06 0.00 0.00 176.95 174.12 3jxh s MET 117 N -4.04 0.91 -0.01 3.25 1.75 0.22 -0.60 119.30 120.78 3jxh s MET 117 Ca 0.24 -0.40 0.02 0.00 -1.25 0.00 0.00 55.69 54.30 3jxh s MET 117 Cb 0.07 -0.88 -0.00 0.00 2.84 0.00 0.00 34.83 36.86 3jxh s MET 117 CO 0.02 0.24 -0.07 0.21 -0.65 0.00 0.00 175.02 174.77 3jxh s LYS 118 N -0.26 0.65 -0.54 4.11 2.20 -0.16 -1.25 119.74 124.48 3jxh s LYS 118 Ca 0.04 -0.26 -0.23 0.00 -0.36 0.00 0.00 55.97 55.16 3jxh s LYS 118 Cb -0.04 -0.63 0.04 0.00 -1.51 0.00 0.00 37.83 35.69 3jxh s LYS 118 CO -0.00 0.14 0.90 1.21 -0.36 0.00 0.00 175.35 177.23 3jxh s ASN 119 N -0.06 6.32 0.00 1.43 3.84 -0.61 -1.06 114.94 124.81 3jxh s ASN 119 Ca 0.01 -0.43 0.28 0.00 0.21 0.00 0.00 52.86 52.94 3jxh s ASN 119 Cb -0.04 -2.42 1.12 0.00 -0.55 0.00 0.00 41.25 39.37 3jxh s ASN 119 CO -0.00 -1.18 1.81 0.35 -2.79 0.00 0.00 177.10 175.29 3jxh n THR 120 N 6.12 0.00 0.00 -5.21 -2.24 -0.55 -0.55 114.28 111.85 3jxh n THR 120 Ca 0.01 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 3jxh n THR 120 Cb 0.47 -0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.60 3jxh n THR 120 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3jxh n GLY 121 N 1.34 2.86 0.02 3.38 0.00 -1.26 -4.73 105.19 106.80 3jxh n GLY 121 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 3jxh n GLY 121 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3jxh n LYS 122 N -2.00 1.55 -3.83 1.61 4.76 -1.26 -4.76 118.16 114.24 3jxh n LYS 122 Ca 0.00 -0.04 -0.08 0.00 -2.87 0.00 0.00 58.31 55.33 3jxh n LYS 122 Cb 0.00 -1.18 0.03 0.00 -1.84 0.00 0.00 35.03 32.04 3jxh n LYS 122 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 3jxh s THR 123 N -2.34 0.00 -0.19 -0.18 -1.32 -1.26 -4.90 115.64 105.45 3jxh s THR 123 Ca -0.03 -0.89 -0.04 0.00 -1.21 0.00 0.00 61.69 59.52 3jxh s THR 123 Cb 0.03 -2.99 -0.02 0.00 -1.51 0.00 0.00 72.50 68.02 3jxh s THR 123 CO 0.30 0.00 -0.04 -0.69 -2.21 0.00 0.00 174.62 171.98 3jxh s VAL 124 N -2.10 3.61 0.03 5.08 1.01 -1.26 -1.48 120.40 125.28 3jxh s VAL 124 Ca 0.18 -0.44 0.04 0.00 0.00 0.00 0.00 61.98 61.76 3jxh s VAL 124 Cb -0.04 -2.61 -0.04 0.00 0.00 0.00 0.00 36.38 33.69 3jxh s VAL 124 CO 0.10 0.45 -0.06 0.00 0.00 0.00 0.00 175.10 175.60 3jxh s ALA 125 N 0.96 3.07 -0.19 5.51 0.00 -0.22 -3.17 121.76 127.72 3jxh s ALA 125 Ca 0.00 -1.06 -0.02 0.00 0.00 0.00 0.00 51.96 50.88 3jxh s ALA 125 Cb -0.15 -1.13 -0.01 0.00 0.00 0.00 0.00 23.12 21.84 3jxh s ALA 125 CO 0.01 0.63 -0.09 0.42 0.00 0.00 0.00 175.76 176.73 3jxh s ILE 126 N -1.07 3.09 -0.39 0.00 1.01 0.60 -0.99 121.20 123.45 3jxh s ILE 126 Ca 0.19 -0.60 -0.18 0.00 0.00 0.00 0.00 60.65 60.06 3jxh s ILE 126 Cb -0.11 -2.37 0.01 0.00 0.01 0.00 0.00 42.46 40.00 3jxh s ILE 126 CO 0.10 0.47 0.50 -0.76 0.00 0.00 0.00 174.94 175.25 3jxh s LEU 127 N 1.13 4.55 0.16 2.97 2.01 0.23 -0.84 118.68 128.90 3jxh s LEU 127 Ca 0.01 -0.32 -0.29 0.00 0.01 0.00 0.00 54.13 53.54 3jxh s LEU 127 Cb -0.14 -2.53 -0.07 0.00 0.01 0.00 0.00 46.19 43.46 3jxh s LEU 127 CO -0.02 -0.56 0.93 -0.76 1.01 0.00 0.00 176.35 176.94 3jxh s LEU 128 N 2.36 4.56 0.00 1.79 1.43 -0.87 -3.04 118.68 124.91 3jxh s LEU 128 Ca 0.17 1.82 0.05 0.00 -1.03 0.00 0.00 54.13 55.14 3jxh s LEU 128 Cb -0.16 -3.55 0.12 0.00 0.03 0.00 0.00 46.19 42.64 3jxh s LEU 128 CO 0.14 0.05 1.04 0.29 0.23 0.00 0.00 176.35 178.10 3jxh n LYS 129 N 2.17 2.36 -4.14 1.70 4.76 -1.26 -4.93 118.16 118.81 3jxh n LYS 129 Ca -0.00 -1.59 -0.25 0.00 -2.87 0.00 0.00 58.31 53.61 3jxh n LYS 129 Cb 0.48 -1.12 -0.07 0.00 -1.84 0.00 0.00 35.03 32.48 3jxh n LYS 129 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3jxh s ASP 130 N -0.90 4.42 -0.29 4.39 1.01 -1.26 -4.90 116.67 119.14 3jxh s ASP 130 Ca 0.10 -1.05 -0.21 0.00 0.71 0.00 0.00 52.55 52.09 3jxh s ASP 130 Cb 0.05 -0.50 -0.01 0.00 1.01 0.00 0.00 42.92 43.48 3jxh s ASP 130 CO 0.07 -0.51 0.67 -1.81 0.21 0.00 0.00 175.17 173.81 3jxh s ASP 131 N -3.89 6.56 -0.06 0.27 1.01 -1.26 -4.94 116.67 114.35 3jxh s ASP 131 Ca 0.40 0.55 0.02 0.00 0.71 0.00 0.00 52.55 54.24 3jxh s ASP 131 Cb 0.03 -2.35 0.01 0.00 1.01 0.00 0.00 42.92 41.62 3jxh s ASP 131 CO 0.22 -0.49 -0.12 -0.31 0.21 0.00 0.00 175.17 174.68 3jxh s TYR 132 N 2.68 1.45 0.07 4.23 2.02 -1.26 -4.52 117.35 122.02 3jxh s TYR 132 Ca 0.27 -0.53 0.08 0.00 -0.37 0.00 0.00 57.07 56.52 3jxh s TYR 132 Cb -0.15 -1.06 -0.03 0.00 -0.40 0.00 0.00 41.96 40.32 3jxh s TYR 132 CO 0.11 -0.27 -0.21 -0.06 -1.57 0.00 0.00 175.55 173.55 3jxh s PHE 133 N 0.66 1.85 0.01 2.71 0.08 0.00 -0.86 117.98 122.43 3jxh s PHE 133 Ca -0.14 -0.39 0.03 0.00 0.12 0.00 0.00 56.93 56.54 3jxh s PHE 133 Cb -0.16 -1.07 -0.01 0.00 -0.57 0.00 0.00 43.02 41.21 3jxh s PHE 133 CO 0.04 0.14 -0.09 0.54 -0.10 0.00 0.00 175.22 175.75 3jxh s VAL 134 N -0.92 0.70 0.25 -0.44 0.11 0.00 -1.11 120.40 118.98 3jxh s VAL 134 Ca 0.08 -0.58 -0.07 0.00 -2.93 0.00 0.00 61.98 58.48 3jxh s VAL 134 Cb -0.09 -0.62 -0.02 0.00 -1.53 0.00 0.00 36.38 34.12 3jxh s VAL 134 CO 0.03 0.05 0.36 -0.94 -3.33 0.00 0.00 175.10 171.27 3jxh s SER 135 N -0.59 0.19 0.00 3.54 1.04 -0.71 -0.70 113.70 116.47 3jxh s SER 135 Ca 0.01 -1.19 0.00 0.00 0.48 0.00 0.00 55.95 55.25 3jxh s SER 135 Cb -0.05 0.53 0.00 0.00 0.10 0.00 0.00 66.02 66.60 3jxh s SER 135 CO 0.00 -1.06 0.00 0.61 0.98 0.00 0.00 173.24 173.77 3jxh n GLY 136 N -0.38 -1.88 3.16 7.32 0.00 -1.26 -0.72 105.19 111.43 3jxh n GLY 136 Ca 0.00 -1.82 -0.22 0.00 0.00 0.00 0.00 46.02 43.98 3jxh n GLY 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jxh n ALA 137 N 0.01 -1.01 -0.91 4.61 0.00 -0.19 -1.88 120.51 121.15 3jxh n ALA 137 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.60 3jxh n ALA 137 Cb 0.00 -3.05 0.00 0.00 0.00 0.00 0.00 19.45 16.40 3jxh n ALA 137 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3jxh n GLY 138 N -1.26 0.56 3.77 0.00 0.00 -1.26 -5.01 105.19 101.98 3jxh n GLY 138 Ca -0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 3jxh n GLY 138 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3jxh s LEU 139 N 0.00 4.31 -0.78 0.99 1.43 -0.79 -4.96 118.68 118.89 3jxh s LEU 139 Ca 0.00 2.39 -0.26 0.00 -1.03 0.00 0.00 54.13 55.22 3jxh s LEU 139 Cb 0.00 -3.88 0.03 0.00 0.03 0.00 0.00 46.19 42.37 3jxh s LEU 139 CO 0.00 -0.54 1.31 -2.16 0.23 0.00 0.00 176.35 175.19 3jxh s PRO 140 N -2.04 3.23 2.06 1.29 0.04 -1.26 -4.56 135.00 133.76 3jxh s PRO 140 Ca 0.53 -0.34 0.00 0.00 0.04 0.00 0.00 61.00 61.23 3jxh s PRO 140 Cb -0.32 -4.34 0.00 0.00 0.04 0.00 0.00 34.50 29.88 3jxh s PRO 140 CO 0.41 -2.17 0.00 0.41 0.04 0.00 0.00 177.00 175.70 3jxh n GLY 141 N 5.58 -1.34 3.80 0.56 0.00 -1.26 -4.92 105.19 107.62 3jxh n GLY 141 Ca 0.07 -1.31 -0.35 0.00 0.00 0.00 0.00 46.02 44.43 3jxh n GLY 141 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3jxh s ARG 142 N 0.00 3.21 0.09 1.61 3.52 -1.26 -4.53 118.95 121.60 3jxh s ARG 142 Ca 0.00 -0.31 0.09 0.00 -0.13 0.00 0.00 55.73 55.38 3jxh s ARG 142 Cb 0.00 -2.98 -0.03 0.00 -1.56 0.00 0.00 34.95 30.37 3jxh s ARG 142 CO 0.00 0.72 -0.24 -0.06 -0.81 0.00 0.00 175.30 174.91 3jxh s PHE 143 N -1.05 2.07 -0.10 5.12 0.40 0.13 -4.33 117.98 120.21 3jxh s PHE 143 Ca 0.17 -0.40 0.04 0.00 -0.60 0.00 0.00 56.93 56.15 3jxh s PHE 143 Cb -0.12 -1.16 -0.00 0.00 0.51 0.00 0.00 43.02 42.25 3jxh s PHE 143 CO 0.07 0.23 -0.23 0.21 0.70 0.00 0.00 175.22 176.20 3jxh s LYS 144 N -1.75 3.03 0.28 0.44 2.20 0.64 -0.82 119.74 123.77 3jxh s LYS 144 Ca 0.10 -0.87 -0.29 0.00 -0.36 0.00 0.00 55.97 54.55 3jxh s LYS 144 Cb -0.10 -2.32 -0.10 0.00 -1.51 0.00 0.00 37.83 33.81 3jxh s LYS 144 CO 0.04 0.20 1.22 0.00 -0.36 0.00 0.00 175.35 176.45 3jxh s ALA 145 N 0.30 3.46 -0.11 3.13 0.00 -0.04 -1.27 121.76 127.22 3jxh s ALA 145 Ca -0.17 1.07 -0.05 0.00 0.00 0.00 0.00 51.96 52.82 3jxh s ALA 145 Cb -0.17 -3.41 -0.05 0.00 0.00 0.00 0.00 23.12 19.48 3jxh s ALA 145 CO 0.08 -0.42 -0.14 -1.91 0.00 0.00 0.00 175.76 173.38 3jxh n GLU 146 N 1.34 0.24 -3.62 0.00 4.07 0.28 -4.72 120.64 118.23 3jxh n GLU 146 Ca 0.01 0.10 -0.10 0.00 -0.06 0.00 0.00 57.16 57.11 3jxh n GLU 146 Cb 0.43 -0.95 -0.02 0.00 -0.06 0.00 0.00 31.44 30.84 3jxh n GLU 146 CO 0.00 0.00 0.00 -1.59 -0.06 0.00 0.00 177.13 175.48 3jxh s LYS 147 N -2.21 1.47 -0.03 5.31 -2.85 -1.23 -2.06 119.74 118.15 3jxh s LYS 147 Ca -0.16 -0.71 0.06 0.00 -1.00 0.00 0.00 55.97 54.17 3jxh s LYS 147 Cb 0.06 0.59 -0.01 0.00 -2.06 0.00 0.00 37.83 36.40 3jxh s LYS 147 CO 0.21 -0.65 -0.20 0.08 0.10 0.00 0.00 175.35 174.88 3jxh s VAL 148 N -3.83 1.61 0.13 1.79 1.01 -0.02 -1.44 120.40 119.66 3jxh s VAL 148 Ca 0.06 -0.86 0.03 0.00 0.00 0.00 0.00 61.98 61.21 3jxh s VAL 148 Cb -0.03 -1.35 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 3jxh s VAL 148 CO -0.05 0.46 -0.08 -1.61 0.00 0.00 0.00 175.10 173.82 3jxh s GLU 149 N -0.34 0.98 0.06 2.72 2.02 -0.17 -0.29 118.70 123.66 3jxh s GLU 149 Ca 0.04 -1.41 0.05 0.00 0.02 0.00 0.00 54.97 53.68 3jxh s GLU 149 Cb -0.09 -0.45 -0.03 0.00 0.10 0.00 0.00 34.13 33.67 3jxh s GLU 149 CO 0.00 0.03 -0.15 -0.06 0.02 0.00 0.00 175.26 175.11 3jxh s PHE 150 N -3.45 1.28 -0.03 1.61 0.40 -1.19 -0.61 117.98 115.99 3jxh s PHE 150 Ca 0.15 -0.40 0.03 0.00 -0.60 0.00 0.00 56.93 56.11 3jxh s PHE 150 Cb 0.04 -0.74 0.00 0.00 0.51 0.00 0.00 43.02 42.83 3jxh s PHE 150 CO -0.01 0.06 -0.11 -1.01 0.70 0.00 0.00 175.22 174.84 3jxh s HIS 151 N -1.04 1.11 0.32 0.36 3.76 -0.06 -4.43 115.29 115.32 3jxh s HIS 151 Ca 0.01 -0.28 -0.03 0.00 -0.15 0.00 0.00 55.06 54.60 3jxh s HIS 151 Cb -0.09 -0.78 -0.01 0.00 1.11 0.00 0.00 32.58 32.82 3jxh s HIS 151 CO 0.02 -0.11 0.42 1.67 -0.85 0.00 0.00 174.74 175.90 3jxh s TRP 152 N 0.13 1.04 0.00 1.40 -2.14 -1.19 -0.80 118.94 117.38 3jxh s TRP 152 Ca -0.03 -1.26 0.00 0.00 2.66 0.00 0.00 56.10 57.47 3jxh s TRP 152 Cb -0.09 -0.15 0.00 0.00 -3.10 0.00 0.00 33.47 30.13 3jxh s TRP 152 CO 0.01 -1.04 0.00 0.41 -2.66 0.00 0.00 176.95 173.66 3jxh n GLY 153 N -0.52 1.18 0.98 3.67 0.00 -1.18 -2.02 105.19 107.30 3jxh n GLY 153 Ca 0.01 -0.88 -0.00 0.00 0.00 0.00 0.00 46.02 45.15 3jxh n GLY 153 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3jxh n HIS 154 N 0.00 0.00 -3.53 1.61 -0.00 -1.26 -1.40 115.22 110.63 3jxh n HIS 154 Ca 0.00 0.00 -0.11 0.00 0.46 0.00 0.00 57.72 58.07 3jxh n HIS 154 Cb 0.00 -0.00 -0.04 0.00 -0.12 0.00 0.00 29.99 29.83 3jxh n HIS 154 CO 0.00 0.00 0.00 -1.54 0.46 0.00 0.00 176.34 175.26 3jxh s SER 155 N -4.99 -0.42 -1.54 0.26 1.04 -1.26 -4.89 113.70 101.90 3jxh s SER 155 Ca -0.00 0.27 -0.14 0.00 0.48 0.00 0.00 55.95 56.56 3jxh s SER 155 Cb 0.00 0.39 0.10 0.00 0.10 0.00 0.00 66.02 66.61 3jxh s SER 155 CO 0.00 -0.52 0.85 -3.20 0.98 0.00 0.00 173.24 171.35 3jxh n ASN 156 N 0.32 -4.39 -0.41 7.02 4.05 -1.26 -1.02 115.26 119.57 3jxh n ASN 156 Ca -0.11 -0.75 -0.05 0.00 0.45 0.00 0.00 54.58 54.11 3jxh n ASN 156 Cb 0.60 -3.54 -0.02 0.00 1.23 0.00 0.00 39.78 38.05 3jxh n ASN 156 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 3jxh n GLY 157 N -1.54 0.75 3.74 8.20 0.00 -1.26 -5.01 105.19 110.07 3jxh n GLY 157 Ca 0.04 -0.82 -0.31 0.00 0.00 0.00 0.00 46.02 44.93 3jxh n GLY 157 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3jxh s SER 158 N -2.94 4.06 0.16 1.61 1.04 -0.19 -4.40 113.70 113.05 3jxh s SER 158 Ca 0.00 1.93 -0.34 0.00 0.48 0.00 0.00 55.95 58.03 3jxh s SER 158 Cb 0.00 -2.54 -0.14 0.00 0.10 0.00 0.00 66.02 63.45 3jxh s SER 158 CO 0.00 -2.34 1.56 0.00 0.98 0.00 0.00 173.24 173.44 3jxh n ALA 159 N -3.70 1.26 -0.26 5.32 0.00 -1.26 -4.12 120.51 117.74 3jxh n ALA 159 Ca 0.10 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.99 3jxh n ALA 159 Cb 0.53 -2.34 0.00 0.00 0.00 0.00 0.00 19.45 17.64 3jxh n ALA 159 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3jxh n GLY 160 N 3.33 0.96 3.83 0.00 0.00 0.01 -4.05 105.19 109.27 3jxh n GLY 160 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 3jxh n GLY 160 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3jxh s SER 161 N -0.04 5.90 -0.17 1.61 1.04 -0.47 -3.15 113.70 118.41 3jxh s SER 161 Ca 0.00 1.61 -0.22 0.00 0.48 0.00 0.00 55.95 57.82 3jxh s SER 161 Cb 0.00 -2.50 -0.20 0.00 0.10 0.00 0.00 66.02 63.42 3jxh s SER 161 CO 0.00 -1.09 0.39 -0.33 0.98 0.00 0.00 173.24 173.19 3jxh h GLU 162 N -0.06 0.00 -7.41 4.02 5.08 -1.91 -3.47 114.58 110.84 3jxh h GLU 162 Ca -0.45 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.42 3jxh h GLU 162 Cb 1.20 0.00 0.07 0.00 0.50 0.00 0.00 28.75 30.53 3jxh h GLU 162 CO 0.59 0.87 0.38 -1.01 -1.00 0.00 0.00 179.01 178.84 3jxh s HIS 163 N -2.25 3.34 0.13 4.33 3.76 -1.26 -4.59 115.29 118.75 3jxh s HIS 163 Ca -0.22 1.01 -0.05 0.00 -0.15 0.00 0.00 55.06 55.64 3jxh s HIS 163 Cb 0.02 -2.98 -0.02 0.00 1.11 0.00 0.00 32.58 30.71 3jxh s HIS 163 CO 0.57 -1.07 0.16 -1.54 -0.85 0.00 0.00 174.74 172.01 3jxh s SER 164 N -4.33 0.18 -0.16 1.40 1.04 -1.17 -4.70 113.70 105.96 3jxh s SER 164 Ca 0.57 -0.98 0.01 0.00 0.48 0.00 0.00 55.95 56.03 3jxh s SER 164 Cb -0.11 0.35 0.02 0.00 0.10 0.00 0.00 66.02 66.39 3jxh s SER 164 CO 0.51 -0.79 -0.15 -0.63 0.98 0.00 0.00 173.24 173.16 3jxh s ILE 165 N -3.98 1.69 -1.51 -1.02 1.01 -0.81 -0.82 121.20 115.75 3jxh s ILE 165 Ca 0.17 -0.74 -0.13 0.00 0.00 0.00 0.00 60.65 59.95 3jxh s ILE 165 Cb 0.05 -1.59 0.10 0.00 0.01 0.00 0.00 42.46 41.03 3jxh s ILE 165 CO -0.01 0.44 0.80 0.59 0.00 0.00 0.00 174.94 176.76 3jxh n ASN 166 N 4.73 -4.32 0.00 3.58 5.03 0.42 -1.01 115.26 123.69 3jxh n ASN 166 Ca -0.18 -0.70 0.00 0.00 0.87 0.00 0.00 54.58 54.57 3jxh n ASN 166 Cb 0.50 -3.49 0.00 0.00 -1.02 0.00 0.00 39.78 35.77 3jxh n ASN 166 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3jxh n GLY 167 N -1.49 2.18 3.67 7.41 0.00 -1.26 -5.01 105.19 110.69 3jxh n GLY 167 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 3jxh n GLY 167 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3jxh s ARG 168 N -0.30 4.31 0.35 1.61 3.52 -0.18 -5.01 118.95 123.26 3jxh s ARG 168 Ca 0.00 1.25 0.07 0.00 -0.13 0.00 0.00 55.73 56.92 3jxh s ARG 168 Cb 0.00 -3.60 -0.01 0.00 -1.56 0.00 0.00 34.95 29.78 3jxh s ARG 168 CO 0.00 -0.45 0.43 1.03 -0.81 0.00 0.00 175.30 175.50 3jxh s ARG 169 N 2.55 2.95 0.23 5.12 0.52 -1.26 -1.92 118.95 127.14 3jxh s ARG 169 Ca 0.43 -1.14 0.09 0.00 -0.52 0.00 0.00 55.73 54.59 3jxh s ARG 169 Cb -0.16 -2.70 -0.05 0.00 0.52 0.00 0.00 34.95 32.56 3jxh s ARG 169 CO 0.11 0.01 -0.16 -0.06 0.02 0.00 0.00 175.30 175.23 3jxh s PHE 170 N -2.25 1.88 0.13 -0.53 0.40 -1.26 -4.95 117.98 111.40 3jxh s PHE 170 Ca 0.45 -0.51 0.25 0.00 -0.60 0.00 0.00 56.93 56.53 3jxh s PHE 170 Cb -0.08 -0.85 0.98 0.00 0.51 0.00 0.00 43.02 43.58 3jxh s PHE 170 CO 0.30 0.46 1.85 -1.00 0.70 0.00 0.00 175.22 177.53 3jxh h PRO 171 N 2.47 0.00 -3.75 0.24 0.13 -1.76 0.42 132.00 129.75 3jxh h PRO 171 Ca -0.39 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.56 3jxh h PRO 171 Cb 1.23 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.12 3jxh h PRO 171 CO 0.62 0.19 -0.65 0.08 -0.23 0.00 0.00 178.00 178.01 3jxh s VAL 172 N -3.67 0.06 -0.10 1.56 1.01 -1.26 -3.10 120.40 114.90 3jxh s VAL 172 Ca 0.01 -0.47 0.02 0.00 0.00 0.00 0.00 61.98 61.53 3jxh s VAL 172 Cb 0.10 -0.20 0.02 0.00 0.00 0.00 0.00 36.38 36.29 3jxh s VAL 172 CO 0.62 -0.26 -0.14 -0.70 0.00 0.00 0.00 175.10 174.62 3jxh s GLU 173 N -0.79 2.11 -0.15 2.72 2.12 0.02 -1.51 118.70 123.21 3jxh s GLU 173 Ca -0.09 -0.52 -0.07 0.00 0.36 0.00 0.00 54.97 54.65 3jxh s GLU 173 Cb -0.05 -1.81 -0.04 0.00 0.26 0.00 0.00 34.13 32.49 3jxh s GLU 173 CO -0.00 -0.07 0.08 1.41 -0.54 0.00 0.00 175.26 176.14 3jxh s MET 174 N 1.00 3.71 -0.08 4.30 -2.45 0.17 -0.88 119.30 125.08 3jxh s MET 174 Ca -0.07 -0.29 0.04 0.00 -1.25 0.00 0.00 55.69 54.13 3jxh s MET 174 Cb -0.15 -3.17 -0.00 0.00 1.25 0.00 0.00 34.83 32.76 3jxh s MET 174 CO -0.01 0.47 -0.22 -0.65 1.05 0.00 0.00 175.02 175.66 3jxh s GLN 175 N -0.18 2.62 -0.12 4.11 -0.21 0.22 -0.40 119.66 125.70 3jxh s GLN 175 Ca 0.08 -0.79 -0.00 0.00 0.02 0.00 0.00 55.36 54.67 3jxh s GLN 175 Cb -0.12 -2.06 -0.02 0.00 1.00 0.00 0.00 33.01 31.81 3jxh s GLN 175 CO 0.01 0.21 -0.11 0.42 -2.12 0.00 0.00 175.29 173.70 3jxh s ILE 176 N 0.25 3.24 -0.08 1.08 1.01 -0.35 -1.00 121.20 125.34 3jxh s ILE 176 Ca -0.14 -0.60 -0.00 0.00 0.00 0.00 0.00 60.65 59.91 3jxh s ILE 176 Cb -0.16 -2.36 -0.03 0.00 0.01 0.00 0.00 42.46 39.92 3jxh s ILE 176 CO 0.06 0.53 -0.05 -0.36 0.00 0.00 0.00 174.94 175.12 3jxh s PHE 177 N 0.19 3.00 0.07 3.97 0.08 -0.52 -0.96 117.98 123.82 3jxh s PHE 177 Ca -0.07 0.02 0.05 0.00 0.12 0.00 0.00 56.93 57.05 3jxh s PHE 177 Cb -0.15 -1.76 -0.03 0.00 -0.57 0.00 0.00 43.02 40.51 3jxh s PHE 177 CO 0.05 0.32 -0.14 -0.06 -0.10 0.00 0.00 175.22 175.28 3jxh s PHE 178 N -0.68 1.20 0.26 0.36 0.08 0.24 -0.56 117.98 118.89 3jxh s PHE 178 Ca 0.10 -0.47 0.06 0.00 0.12 0.00 0.00 56.93 56.75 3jxh s PHE 178 Cb -0.11 -0.68 -0.06 0.00 -0.57 0.00 0.00 43.02 41.60 3jxh s PHE 178 CO 0.02 0.05 -0.05 1.52 -0.10 0.00 0.00 175.22 176.66 3jxh s TYR 179 N -1.31 1.84 -0.44 0.36 1.13 -0.40 -1.54 117.35 117.00 3jxh s TYR 179 Ca -0.02 -0.74 -0.21 0.00 -1.41 0.00 0.00 57.07 54.70 3jxh s TYR 179 Cb -0.10 -1.04 0.02 0.00 -1.10 0.00 0.00 41.96 39.75 3jxh s TYR 179 CO 0.02 0.22 0.63 1.21 -2.51 0.00 0.00 175.55 175.12 3jxh s ASN 180 N -3.40 6.32 0.45 -0.18 3.84 -1.26 -0.26 114.94 120.44 3jxh s ASN 180 Ca 0.28 -0.34 0.29 0.00 0.21 0.00 0.00 52.86 53.30 3jxh s ASN 180 Cb 0.04 -2.32 1.10 0.00 -0.55 0.00 0.00 41.25 39.52 3jxh s ASN 180 CO 0.11 -0.77 1.86 -0.65 -2.79 0.00 0.00 177.10 174.86 3jxh h PRO 181 N 8.86 0.00 0.00 0.43 0.11 -1.75 -2.44 132.00 137.21 3jxh h PRO 181 Ca -0.25 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.81 3jxh h PRO 181 Cb 1.10 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 3jxh h PRO 181 CO 0.89 0.00 -0.20 0.22 -0.21 0.00 0.00 178.00 178.70 3jxh h ASP 182 N 0.00 0.00 0.15 -2.05 3.58 -1.91 -3.18 116.42 113.01 3jxh h ASP 182 Ca 0.00 0.00 -0.35 0.00 0.42 0.00 0.00 57.03 57.10 3jxh h ASP 182 Cb 0.56 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 41.55 3jxh h ASP 182 CO 0.00 0.20 -2.18 0.47 -2.88 0.00 0.00 179.24 174.85 3jxh n ASP 183 N -3.38 0.65 -3.94 2.28 9.92 -0.95 -5.02 116.55 116.11 3jxh n ASP 183 Ca 0.00 0.12 -0.09 0.00 -0.53 0.00 0.00 54.79 54.29 3jxh n ASP 183 Cb 0.41 0.39 -0.09 0.00 -0.64 0.00 0.00 41.12 41.18 3jxh n ASP 183 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 3jxh s PHE 184 N -2.53 0.25 0.08 1.24 0.40 -1.04 -5.04 117.98 111.34 3jxh s PHE 184 Ca -0.12 -0.62 0.15 0.00 -0.60 0.00 0.00 56.93 55.74 3jxh s PHE 184 Cb 0.07 -0.17 0.34 0.00 0.51 0.00 0.00 43.02 43.77 3jxh s PHE 184 CO 0.80 -0.41 1.57 0.38 0.70 0.00 0.00 175.22 178.26 3jxh h ASP 185 N 3.37 0.00 -5.11 1.36 2.03 -1.89 -3.38 116.42 112.80 3jxh h ASP 185 Ca -0.33 0.00 -0.10 0.00 -0.73 0.00 0.00 57.03 55.87 3jxh h ASP 185 Cb 1.18 0.00 -0.16 0.00 -0.83 0.00 0.00 39.33 39.52 3jxh h ASP 185 CO 0.54 0.53 -0.37 -0.94 -1.03 0.00 0.00 179.24 177.97 3jxh s SER 186 N -6.53 0.07 0.29 4.15 1.04 -1.26 -5.04 113.70 106.41 3jxh s SER 186 Ca 0.01 -0.49 -0.03 0.00 0.48 0.00 0.00 55.95 55.92 3jxh s SER 186 Cb 0.10 0.32 0.41 0.00 0.10 0.00 0.00 66.02 66.94 3jxh s SER 186 CO 0.73 -0.64 1.93 0.15 0.98 0.00 0.00 173.24 176.39 3jxh h PHE 187 N 3.10 1.04 -0.35 5.02 3.57 -1.97 -1.75 116.94 125.60 3jxh h PHE 187 Ca -0.33 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.11 3jxh h PHE 187 Cb 1.20 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 39.58 3jxh h PHE 187 CO 0.46 0.69 -0.02 1.96 -2.23 0.00 0.00 178.31 179.17 3jxh h GLN 188 N 1.09 0.64 -0.54 1.11 1.08 -2.00 -2.09 115.11 114.40 3jxh h GLN 188 Ca 0.29 -0.22 0.09 0.00 -1.45 0.00 0.00 58.65 57.36 3jxh h GLN 188 Cb -0.05 -0.05 -0.07 0.00 -0.05 0.00 0.00 27.48 27.26 3jxh h GLN 188 CO -0.05 0.77 0.16 1.15 -0.95 0.00 0.00 178.83 179.90 3jxh h THR 189 N 0.45 0.75 -0.37 -0.54 2.02 -1.92 -2.22 112.91 111.07 3jxh h THR 189 Ca 0.10 -0.11 0.01 0.00 0.77 0.00 0.00 66.41 67.18 3jxh h THR 189 Cb 0.50 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 67.29 3jxh h THR 189 CO 0.02 0.06 0.24 0.00 0.37 0.00 0.00 175.52 176.21 3jxh h ALA 190 N 1.40 0.47 -0.37 6.16 0.00 -0.92 -2.68 119.26 123.32 3jxh h ALA 190 Ca 0.27 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.06 3jxh h ALA 190 Cb 0.35 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 3jxh h ALA 190 CO -0.31 -0.09 -0.21 0.82 0.00 0.00 0.00 179.25 179.46 3jxh h ILE 191 N 0.48 1.27 0.00 0.00 2.04 -1.29 -2.77 117.51 117.23 3jxh h ILE 191 Ca 0.14 -1.29 -0.00 0.00 1.00 0.00 0.00 64.86 64.70 3jxh h ILE 191 Cb -0.04 1.21 -0.00 0.00 -0.74 0.00 0.00 36.82 37.25 3jxh h ILE 191 CO -0.04 0.43 -0.02 0.28 0.00 0.00 0.00 178.15 178.80 3jxh h SER 192 N 0.63 0.00 -0.15 1.72 0.02 -1.08 -2.63 113.55 112.06 3jxh h SER 192 Ca 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 3jxh h SER 192 Cb 0.69 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.23 3jxh h SER 192 CO 0.05 0.02 0.00 -0.62 -1.14 0.00 0.00 176.83 175.14 3jxh n GLU 193 N -3.46 1.97 -3.92 3.45 1.02 -1.05 -4.98 120.64 113.67 3jxh n GLU 193 Ca -0.03 -1.86 -0.29 0.00 -0.02 0.00 0.00 57.16 54.96 3jxh n GLU 193 Cb 0.11 -1.40 0.02 0.00 -0.02 0.00 0.00 31.44 30.15 3jxh n GLU 193 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3jxh n ASN 194 N 1.16 -4.00 -4.98 1.62 5.03 -0.99 -4.99 115.26 108.10 3jxh n ASN 194 Ca 0.14 -0.81 -0.20 0.00 0.87 0.00 0.00 54.58 54.57 3jxh n ASN 194 Cb 0.51 -3.78 0.02 0.00 -1.02 0.00 0.00 39.78 35.51 3jxh n ASN 194 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 3jxh s ARG 195 N -6.56 2.75 0.09 3.52 1.81 -1.20 -4.97 118.95 114.38 3jxh s ARG 195 Ca 0.55 -0.91 -0.31 0.00 -1.72 0.00 0.00 55.73 53.34 3jxh s ARG 195 Cb -0.28 -2.61 -0.08 0.00 -0.45 0.00 0.00 34.95 31.52 3jxh s ARG 195 CO 0.84 -0.45 1.54 0.42 -0.68 0.00 0.00 175.30 176.98 3jxh s ILE 196 N -2.55 3.10 0.33 1.52 1.01 -1.26 -4.84 121.20 118.51 3jxh s ILE 196 Ca 0.54 0.66 0.09 0.00 0.00 0.00 0.00 60.65 61.95 3jxh s ILE 196 Cb -0.10 -3.42 -0.05 0.00 0.01 0.00 0.00 42.46 38.89 3jxh s ILE 196 CO 0.36 0.02 -0.01 0.27 0.00 0.00 0.00 174.94 175.58 3jxh s ILE 197 N 1.97 2.62 0.17 2.92 -4.36 -0.29 -4.49 121.20 119.75 3jxh s ILE 197 Ca 0.70 -2.02 0.09 0.00 -0.26 0.00 0.00 60.65 59.16 3jxh s ILE 197 Cb -0.39 -2.75 -0.04 0.00 1.25 0.00 0.00 42.46 40.53 3jxh s ILE 197 CO 0.31 -0.22 -0.14 -0.83 0.24 0.00 0.00 174.94 174.30 3jxh s GLY 198 N -3.69 1.72 -0.13 6.27 0.00 -0.59 -0.93 107.32 109.97 3jxh s GLY 198 Ca 0.34 -1.48 -0.11 0.00 0.00 0.00 0.00 44.72 43.47 3jxh s GLY 198 CO 0.19 -1.49 0.33 0.00 0.00 0.00 0.00 173.10 172.13 3jxh s ALA 199 N -1.58 -0.82 -0.07 3.20 0.00 -0.60 -0.59 121.76 121.29 3jxh s ALA 199 Ca 0.23 1.00 -0.01 0.00 0.00 0.00 0.00 51.96 53.18 3jxh s ALA 199 Cb -0.09 -0.59 -0.03 0.00 0.00 0.00 0.00 23.12 22.41 3jxh s ALA 199 CO 0.13 -0.17 -0.01 -1.64 0.00 0.00 0.00 175.76 174.07 3jxh s MET 200 N 0.39 2.92 -0.14 0.00 -1.94 -0.13 -0.62 119.30 119.77 3jxh s MET 200 Ca -0.02 -0.45 0.01 0.00 -1.71 0.00 0.00 55.69 53.52 3jxh s MET 200 Cb -0.04 -2.74 -0.00 0.00 2.01 0.00 0.00 34.83 34.06 3jxh s MET 200 CO -0.02 0.69 -0.16 0.00 -0.01 0.00 0.00 175.02 175.52 3jxh s ALA 201 N -0.89 2.46 -0.11 3.03 0.00 0.36 -1.22 121.76 125.38 3jxh s ALA 201 Ca 0.14 -1.01 0.02 0.00 0.00 0.00 0.00 51.96 51.11 3jxh s ALA 201 Cb -0.11 -1.15 0.01 0.00 0.00 0.00 0.00 23.12 21.87 3jxh s ALA 201 CO 0.03 0.07 -0.16 0.42 0.00 0.00 0.00 175.76 176.12 3jxh s ILE 202 N 0.65 1.59 0.26 0.00 1.09 0.47 -1.72 121.20 123.54 3jxh s ILE 202 Ca -0.09 -0.70 -0.13 0.00 -1.10 0.00 0.00 60.65 58.64 3jxh s ILE 202 Cb -0.16 -1.44 -0.08 0.00 -1.06 0.00 0.00 42.46 39.72 3jxh s ILE 202 CO 0.02 0.46 0.65 -0.36 -0.10 0.00 0.00 174.94 175.61 3jxh s PHE 203 N 0.96 3.43 0.01 3.97 0.08 -1.26 -0.66 117.98 124.51 3jxh s PHE 203 Ca -0.07 1.08 0.02 0.00 0.12 0.00 0.00 56.93 58.09 3jxh s PHE 203 Cb -0.15 -2.42 -0.04 0.00 -0.57 0.00 0.00 43.02 39.84 3jxh s PHE 203 CO -0.02 0.21 -0.01 -0.06 -0.10 0.00 0.00 175.22 175.24 3jxh s PHE 204 N -1.84 3.04 0.02 0.36 0.40 -0.57 -0.53 117.98 118.86 3jxh s PHE 204 Ca 0.49 0.05 0.04 0.00 -0.60 0.00 0.00 56.93 56.92 3jxh s PHE 204 Cb -0.11 -1.65 -0.02 0.00 0.51 0.00 0.00 43.02 41.75 3jxh s PHE 204 CO 0.19 0.45 -0.13 -1.14 0.70 0.00 0.00 175.22 175.29 3jxh s GLN 205 N -1.61 0.95 0.39 0.44 2.00 0.04 -3.55 119.66 118.32 3jxh s GLN 205 Ca 0.20 -0.66 -0.27 0.00 -2.00 0.00 0.00 55.36 52.62 3jxh s GLN 205 Cb -0.11 -0.94 -0.10 0.00 0.80 0.00 0.00 33.01 32.65 3jxh s GLN 205 CO 0.11 0.24 1.45 0.14 -0.50 0.00 0.00 175.29 176.73 3jxh s VAL 206 N -0.68 2.13 0.06 1.34 -7.23 -1.25 -1.14 120.40 113.64 3jxh s VAL 206 Ca 0.02 0.13 0.01 0.00 -1.81 0.00 0.00 61.98 60.34 3jxh s VAL 206 Cb -0.07 -3.08 -0.03 0.00 0.56 0.00 0.00 36.38 33.76 3jxh s VAL 206 CO 0.01 0.03 -0.06 -0.94 -0.31 0.00 0.00 175.10 173.83 3jxh s SER 207 N -0.29 0.81 0.38 4.85 1.04 0.30 -4.76 113.70 116.03 3jxh s SER 207 Ca 0.55 -0.82 0.08 0.00 0.48 0.00 0.00 55.95 56.23 3jxh s SER 207 Cb -0.45 0.10 0.76 0.00 0.10 0.00 0.00 66.02 66.53 3jxh s SER 207 CO 0.60 -0.40 1.94 -0.65 0.98 0.00 0.00 173.24 175.71 3jxh h PRO 208 N 3.63 0.38 -6.25 4.02 0.11 -1.96 -3.37 132.00 128.56 3jxh h PRO 208 Ca -0.35 -0.07 -0.61 0.00 0.11 0.00 0.00 66.00 65.08 3jxh h PRO 208 Cb 1.18 -0.06 -0.09 0.00 0.11 0.00 0.00 31.00 32.13 3jxh h PRO 208 CO 0.55 0.41 -0.61 1.03 -0.21 0.00 0.00 178.00 179.18 3jxh s ARG 209 N -4.97 2.73 0.38 1.05 1.81 -1.26 -4.90 118.95 113.79 3jxh s ARG 209 Ca -0.07 -0.87 -0.27 0.00 -1.72 0.00 0.00 55.73 52.81 3jxh s ARG 209 Cb 0.16 -2.59 -0.11 0.00 -0.45 0.00 0.00 34.95 31.96 3jxh s ARG 209 CO 0.74 0.51 1.32 -0.25 -0.68 0.00 0.00 175.30 176.94 3jxh n ASP 210 N 0.08 2.90 -4.53 0.23 10.43 -1.26 -4.05 116.55 120.34 3jxh n ASP 210 Ca -0.09 1.18 -0.43 0.00 2.57 0.00 0.00 54.79 58.01 3jxh n ASP 210 Cb 0.53 -1.52 -0.05 0.00 1.84 0.00 0.00 41.12 41.93 3jxh n ASP 210 CO 0.00 0.00 0.00 0.21 -1.07 0.00 0.00 177.20 176.34 3jxh s ASN 211 N -0.36 6.39 0.51 -2.24 3.84 -1.26 -4.93 114.94 116.90 3jxh s ASN 211 Ca 0.57 -0.20 0.24 0.00 0.21 0.00 0.00 52.86 53.68 3jxh s ASN 211 Cb -0.53 -2.41 1.37 0.00 -0.55 0.00 0.00 41.25 39.13 3jxh s ASN 211 CO 0.61 -1.05 2.08 0.28 -2.79 0.00 0.00 177.10 176.23 3jxh h SER 212 N 9.12 0.00 0.08 -4.21 0.02 -1.95 -1.78 113.55 114.83 3jxh h SER 212 Ca -0.25 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.69 3jxh h SER 212 Cb 1.08 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.62 3jxh h SER 212 CO 1.02 0.12 -0.04 0.00 -1.14 0.00 0.00 176.83 176.78 3jxh h ALA 213 N 1.88 1.64 -0.00 3.77 0.00 -1.91 -1.93 119.26 122.71 3jxh h ALA 213 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3jxh h ALA 213 Cb 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3jxh h ALA 213 CO 0.02 0.05 -0.22 1.28 0.00 0.00 0.00 179.25 180.38 3jxh n LEU 214 N -4.06 0.48 -0.22 0.00 4.77 -0.67 -4.46 117.00 112.84 3jxh n LEU 214 Ca -0.03 0.05 0.01 0.00 -0.03 0.00 0.00 56.01 56.02 3jxh n LEU 214 Cb 0.13 -0.25 0.10 0.00 -2.33 0.00 0.00 43.42 41.07 3jxh n LEU 214 CO 0.31 0.10 0.80 0.44 -1.33 0.00 0.00 177.39 177.70 3jxh h ASP 215 N 0.40 -0.40 0.01 -1.43 3.32 -1.43 0.49 116.42 117.38 3jxh h ASP 215 Ca 0.00 0.17 -0.05 0.00 0.02 0.00 0.00 57.03 57.17 3jxh h ASP 215 Cb 0.45 0.33 -0.01 0.00 0.22 0.00 0.00 39.33 40.31 3jxh h ASP 215 CO 0.00 -0.16 -0.13 -0.65 -1.72 0.00 0.00 179.24 176.58 3jxh h PRO 216 N 0.07 0.26 -0.16 3.56 0.11 -1.82 -0.70 132.00 133.31 3jxh h PRO 216 Ca 0.33 -0.06 -0.10 0.00 0.11 0.00 0.00 66.00 66.28 3jxh h PRO 216 Cb 0.54 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 31.62 3jxh h PRO 216 CO -0.60 0.40 -0.28 0.82 -0.21 0.00 0.00 178.00 178.13 3jxh h ILE 217 N 0.25 1.35 -0.71 4.15 1.08 -1.28 -1.69 117.51 120.66 3jxh h ILE 217 Ca 0.05 -1.51 -0.05 0.00 -0.39 0.00 0.00 64.86 62.95 3jxh h ILE 217 Cb 0.38 1.93 -0.03 0.00 -3.07 0.00 0.00 36.82 36.04 3jxh h ILE 217 CO 0.02 0.46 0.23 0.40 -0.69 0.00 0.00 178.15 178.57 3jxh h ILE 218 N 0.11 1.26 -0.75 -0.67 1.08 -0.87 -1.45 117.51 116.22 3jxh h ILE 218 Ca 0.01 -0.87 -0.03 0.00 -0.39 0.00 0.00 64.86 63.59 3jxh h ILE 218 Cb 0.86 0.48 -0.03 0.00 -3.07 0.00 0.00 36.82 35.06 3jxh h ILE 218 CO 0.06 0.34 0.37 -0.74 -0.69 0.00 0.00 178.15 177.49 3jxh h HIS 219 N 1.04 1.08 -0.36 1.37 2.76 -1.13 -2.61 115.15 117.29 3jxh h HIS 219 Ca 0.23 -0.05 0.03 0.00 -2.20 0.00 0.00 60.37 58.39 3jxh h HIS 219 Cb 0.29 -0.34 -0.03 0.00 1.55 0.00 0.00 27.41 28.88 3jxh h HIS 219 CO 0.02 0.79 0.15 0.78 -1.30 0.00 0.00 177.93 178.37 3jxh h GLY 220 N 1.06 0.47 0.44 5.26 0.00 -0.78 -2.45 103.07 107.07 3jxh h GLY 220 Ca 0.26 -0.10 0.13 0.00 0.00 0.00 0.00 47.33 47.62 3jxh h GLY 220 CO -0.03 0.06 0.63 1.41 0.00 0.00 0.00 176.54 178.61 3jxh h LEU 221 N 0.32 0.92 -2.13 3.11 3.38 -0.96 0.60 115.31 120.55 3jxh h LEU 221 Ca 0.16 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 3jxh h LEU 221 Cb 0.10 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 3jxh h LEU 221 CO -0.14 0.48 -0.03 0.11 0.09 0.00 0.00 178.44 178.95 3jxh h LYS 222 N 0.98 0.00 -0.01 1.13 1.57 -1.08 -2.19 116.57 116.97 3jxh h LYS 222 Ca 0.51 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.29 3jxh h LYS 222 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.83 3jxh h LYS 222 CO -0.27 0.03 -0.40 0.41 -0.57 0.00 0.00 179.45 178.65 3jxh n GLY 223 N -0.55 -0.72 1.49 3.86 0.00 0.18 -4.36 105.19 105.08 3jxh n GLY 223 Ca -0.01 -0.43 -0.09 0.00 0.00 0.00 0.00 46.02 45.49 3jxh n GLY 223 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3jxh n VAL 224 N -0.85 2.17 -0.29 1.61 0.24 -0.83 -4.73 118.33 115.66 3jxh n VAL 224 Ca 0.10 -3.56 -0.02 0.00 -2.04 0.00 0.00 64.34 58.82 3jxh n VAL 224 Cb 0.36 -0.49 0.11 0.00 -1.47 0.00 0.00 33.84 32.34 3jxh n VAL 224 CO 0.00 0.00 0.00 0.58 -2.14 0.00 0.00 176.83 175.27 3jxh h VAL 225 N 2.23 1.09 -3.43 3.34 2.07 -1.76 -3.42 116.25 116.37 3jxh h VAL 225 Ca 0.15 -0.33 -0.54 0.00 0.82 0.00 0.00 66.70 66.80 3jxh h VAL 225 Cb 1.33 0.05 -0.04 0.00 -1.52 0.00 0.00 31.29 31.11 3jxh h VAL 225 CO 0.38 0.18 0.06 -1.00 0.02 0.00 0.00 177.57 177.20 3jxh s HIS 226 N -6.10 3.75 0.05 1.57 3.76 -1.26 -0.54 115.29 116.53 3jxh s HIS 226 Ca -0.13 1.37 -0.37 0.00 -0.15 0.00 0.00 55.06 55.77 3jxh s HIS 226 Cb 0.17 -2.58 -0.17 0.00 1.11 0.00 0.00 32.58 31.10 3jxh s HIS 226 CO 0.78 0.46 1.33 1.58 -0.85 0.00 0.00 174.74 178.04 3jxh n HIS 227 N 1.22 1.43 -0.08 1.40 -0.00 -1.26 -1.62 115.22 116.31 3jxh n HIS 227 Ca -0.06 0.69 0.00 0.00 0.46 0.00 0.00 57.72 58.81 3jxh n HIS 227 Cb 0.51 -2.31 0.00 0.00 -0.12 0.00 0.00 29.99 28.07 3jxh n HIS 227 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 3jxh n GLU 228 N 2.54 0.00 -2.05 1.57 -0.58 0.29 -5.03 120.64 117.39 3jxh n GLU 228 Ca 0.19 0.00 -0.37 0.00 -0.42 0.00 0.00 57.16 56.56 3jxh n GLU 228 Cb 0.17 -1.22 0.02 0.00 -0.57 0.00 0.00 31.44 29.84 3jxh n GLU 228 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 3jxh s LYS 229 N -0.24 3.34 0.05 3.49 2.20 -0.64 -4.72 119.74 123.22 3jxh s LYS 229 Ca 0.00 1.93 0.03 0.00 -0.36 0.00 0.00 55.97 57.57 3jxh s LYS 229 Cb 0.00 -2.22 -0.02 0.00 -1.51 0.00 0.00 37.83 34.08 3jxh s LYS 229 CO 0.00 -0.93 -0.10 -1.21 -0.36 0.00 0.00 175.35 172.75 3jxh s GLU 230 N -2.95 0.63 -0.07 4.03 2.02 -1.26 -1.57 118.70 119.54 3jxh s GLU 230 Ca 0.70 -0.77 -0.18 0.00 0.02 0.00 0.00 54.97 54.75 3jxh s GLU 230 Cb -0.33 -0.50 0.04 0.00 0.10 0.00 0.00 34.13 33.44 3jxh s GLU 230 CO 0.38 0.11 0.42 -0.08 0.02 0.00 0.00 175.26 176.10 3jxh s THR 231 N -1.21 0.03 0.67 3.63 -1.32 -0.38 -4.98 115.64 112.08 3jxh s THR 231 Ca -0.06 -0.23 -0.13 0.00 -1.21 0.00 0.00 61.69 60.06 3jxh s THR 231 Cb -0.09 -0.68 -0.00 0.00 -1.51 0.00 0.00 72.50 70.22 3jxh s THR 231 CO 0.01 -0.13 1.07 -0.36 -2.21 0.00 0.00 174.62 173.00 3jxh s PHE 232 N -0.77 2.95 0.02 9.09 0.08 -1.26 -0.61 117.98 127.48 3jxh s PHE 232 Ca -0.09 1.48 0.04 0.00 0.12 0.00 0.00 56.93 58.49 3jxh s PHE 232 Cb -0.04 -2.97 -0.03 0.00 -0.57 0.00 0.00 43.02 39.41 3jxh s PHE 232 CO 0.04 -1.31 -0.08 -0.51 -0.10 0.00 0.00 175.22 173.26 3jxh s LEU 233 N -5.20 3.09 0.75 -0.37 1.43 -0.78 -4.85 118.68 112.76 3jxh s LEU 233 Ca 0.61 -0.21 -0.15 0.00 -1.03 0.00 0.00 54.13 53.35 3jxh s LEU 233 Cb -0.16 -1.80 0.02 0.00 0.03 0.00 0.00 46.19 44.29 3jxh s LEU 233 CO 0.48 0.26 0.97 0.47 0.23 0.00 0.00 176.35 178.77 3jxh n ASP 234 N 1.42 0.39 -4.75 2.29 8.00 -1.26 -4.71 116.55 117.93 3jxh n ASP 234 Ca -0.15 0.63 -0.41 0.00 0.71 0.00 0.00 54.79 55.56 3jxh n ASP 234 Cb 0.52 -1.41 -0.02 0.00 -0.02 0.00 0.00 41.12 40.19 3jxh n ASP 234 CO 0.00 0.00 0.00 -2.84 -0.39 0.00 0.00 177.20 173.97 3jxh s PRO 235 N -3.51 4.23 0.19 -0.24 0.02 -1.26 -4.86 135.00 129.56 3jxh s PRO 235 Ca 0.72 2.39 0.03 0.00 0.02 0.00 0.00 61.00 64.16 3jxh s PRO 235 Cb -0.32 -3.07 -0.05 0.00 0.02 0.00 0.00 34.50 31.08 3jxh s PRO 235 CO 0.52 -0.45 -0.02 -0.59 -0.33 0.00 0.00 177.00 176.13 3jxh s PHE 236 N -0.33 1.34 -0.28 6.54 -0.12 -1.26 -4.83 117.98 119.03 3jxh s PHE 236 Ca 0.58 -0.94 -0.07 0.00 -0.05 0.00 0.00 56.93 56.44 3jxh s PHE 236 Cb -0.43 -0.76 -0.00 0.00 -0.63 0.00 0.00 43.02 41.20 3jxh s PHE 236 CO 0.48 -0.10 0.08 0.08 -0.05 0.00 0.00 175.22 175.71 3jxh s VAL 237 N -3.52 4.07 0.29 -2.49 1.01 -1.26 -0.86 120.40 117.64 3jxh s VAL 237 Ca 0.24 -0.55 -0.02 0.00 0.00 0.00 0.00 61.98 61.65 3jxh s VAL 237 Cb 0.05 -3.05 0.21 0.00 0.00 0.00 0.00 36.38 33.60 3jxh s VAL 237 CO 0.05 0.15 1.90 0.25 0.00 0.00 0.00 175.10 177.45 3jxh h LEU 238 N 8.24 0.89 -1.52 3.92 5.85 -1.73 -0.88 115.31 130.07 3jxh h LEU 238 Ca -0.33 -0.08 0.19 0.00 0.84 0.00 0.00 57.88 58.49 3jxh h LEU 238 Cb 1.14 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 41.88 3jxh h LEU 238 CO 0.60 0.74 0.57 -0.09 -0.34 0.00 0.00 178.44 179.92 3jxh h ARG 239 N 0.99 0.40 -0.00 1.25 9.65 -1.51 -0.67 114.38 124.49 3jxh h ARG 239 Ca 0.25 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 59.10 3jxh h ARG 239 Cb 0.07 -0.09 0.00 0.00 -1.39 0.00 0.00 29.97 28.56 3jxh h ARG 239 CO -0.04 0.27 -0.01 -0.25 2.80 0.00 0.00 179.97 182.74 3jxh n ASP 240 N -4.50 0.11 -1.06 -3.80 8.00 -0.34 -1.70 116.55 113.26 3jxh n ASP 240 Ca 0.18 -0.70 0.12 0.00 0.71 0.00 0.00 54.79 55.10 3jxh n ASP 240 Cb 0.65 -0.10 0.17 0.00 -0.02 0.00 0.00 41.12 41.82 3jxh n ASP 240 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3jxh n LEU 241 N -1.04 3.23 -4.86 0.64 4.32 -0.26 -4.86 117.00 114.18 3jxh n LEU 241 Ca 0.20 -1.26 -0.21 0.00 -0.02 0.00 0.00 56.01 54.71 3jxh n LEU 241 Cb 0.18 -0.14 -0.04 0.00 -1.62 0.00 0.00 43.42 41.80 3jxh n LEU 241 CO 0.20 0.63 -0.09 -0.76 -1.22 0.00 0.00 177.39 176.15 3jxh s LEU 242 N -1.72 3.70 0.69 2.23 1.43 -0.69 -4.94 118.68 119.38 3jxh s LEU 242 Ca 0.34 -0.40 -0.17 0.00 -1.03 0.00 0.00 54.13 52.88 3jxh s LEU 242 Cb 0.22 -2.30 0.01 0.00 0.03 0.00 0.00 46.19 44.15 3jxh s LEU 242 CO 0.31 -0.27 1.27 -2.84 0.23 0.00 0.00 176.35 175.06 3jxh s PRO 243 N -3.96 2.33 0.25 1.29 0.02 -1.26 -4.90 135.00 128.76 3jxh s PRO 243 Ca 0.39 2.00 -0.05 0.00 0.02 0.00 0.00 61.00 63.36 3jxh s PRO 243 Cb -0.07 -1.83 0.47 0.00 0.02 0.00 0.00 34.50 33.10 3jxh s PRO 243 CO 0.26 -1.75 1.69 0.00 -0.33 0.00 0.00 177.00 176.87 3jxh h ALA 244 N 0.20 0.97 -3.55 -1.55 0.00 -1.91 -3.38 119.26 110.04 3jxh h ALA 244 Ca -0.50 0.17 -0.67 0.00 0.00 0.00 0.00 54.91 53.91 3jxh h ALA 244 Cb 1.33 0.22 -0.20 0.00 0.00 0.00 0.00 17.79 19.14 3jxh h ALA 244 CO 0.51 -0.33 -0.69 0.45 0.00 0.00 0.00 179.25 179.19 3jxh s SER 245 N -5.24 4.64 0.00 0.00 0.15 -1.26 -4.98 113.70 107.00 3jxh s SER 245 Ca -0.13 -0.07 0.22 0.00 0.70 0.00 0.00 55.95 56.68 3jxh s SER 245 Cb 0.21 -1.35 0.54 0.00 -1.71 0.00 0.00 66.02 63.70 3jxh s SER 245 CO 0.76 0.30 1.47 0.18 1.20 0.00 0.00 173.24 177.14 3jxh n LEU 246 N 2.64 3.50 0.19 3.45 4.77 -1.26 -4.51 117.00 125.78 3jxh n LEU 246 Ca -0.18 -1.63 0.13 0.00 -0.03 0.00 0.00 56.01 54.30 3jxh n LEU 246 Cb 0.53 -0.35 0.32 0.00 -2.33 0.00 0.00 43.42 41.59 3jxh n LEU 246 CO 0.29 0.82 0.86 1.23 -1.33 0.00 0.00 177.39 179.25 3jxh h GLY 247 N 4.54 0.00 -7.74 -0.72 0.00 -1.95 -3.43 103.07 93.77 3jxh h GLY 247 Ca 0.00 0.00 -0.68 0.00 0.00 0.00 0.00 47.33 46.65 3jxh h GLY 247 CO 0.00 0.00 -0.69 -0.45 0.00 0.00 0.00 176.54 175.40 3jxh s SER 248 N -5.60 4.91 0.18 0.19 0.15 -1.26 -4.76 113.70 107.50 3jxh s SER 248 Ca 0.07 -1.40 -0.12 0.00 0.70 0.00 0.00 55.95 55.20 3jxh s SER 248 Cb 0.08 -1.71 0.01 0.00 -1.71 0.00 0.00 66.02 62.68 3jxh s SER 248 CO 0.62 -0.29 0.38 -0.72 1.20 0.00 0.00 173.24 174.43 3jxh s TYR 249 N 1.22 0.19 0.14 3.44 -0.85 -1.26 -1.53 117.35 118.69 3jxh s TYR 249 Ca -0.03 -0.55 0.08 0.00 -0.52 0.00 0.00 57.07 56.05 3jxh s TYR 249 Cb -0.20 0.13 -0.04 0.00 0.38 0.00 0.00 41.96 42.23 3jxh s TYR 249 CO -0.02 -0.80 -0.11 0.71 -1.52 0.00 0.00 175.55 173.81 3jxh s TYR 250 N -3.93 2.66 -0.05 -3.49 2.02 0.25 -1.81 117.35 113.01 3jxh s TYR 250 Ca 0.14 -0.20 0.03 0.00 -0.37 0.00 0.00 57.07 56.67 3jxh s TYR 250 Cb 0.02 -1.36 0.00 0.00 -0.40 0.00 0.00 41.96 40.22 3jxh s TYR 250 CO -0.01 0.45 -0.14 1.03 -1.57 0.00 0.00 175.55 175.31 3jxh s ARG 251 N -2.45 1.59 0.21 -0.62 1.81 0.13 -0.73 118.95 118.89 3jxh s ARG 251 Ca 0.22 -0.49 -0.16 0.00 -1.72 0.00 0.00 55.73 53.58 3jxh s ARG 251 Cb -0.10 -1.37 0.02 0.00 -0.45 0.00 0.00 34.95 33.05 3jxh s ARG 251 CO 0.14 0.15 0.51 1.52 -0.68 0.00 0.00 175.30 176.94 3jxh s TYR 252 N 0.25 0.01 -0.21 -0.53 1.13 -1.06 -0.86 117.35 116.08 3jxh s TYR 252 Ca -0.07 -0.37 -0.11 0.00 -1.41 0.00 0.00 57.07 55.12 3jxh s TYR 252 Cb -0.12 0.35 -0.05 0.00 -1.10 0.00 0.00 41.96 41.04 3jxh s TYR 252 CO 0.02 -0.94 0.16 0.99 -2.51 0.00 0.00 175.55 173.27 3jxh s THR 253 N -3.91 5.38 0.00 -3.49 2.01 -1.26 -1.09 115.64 113.27 3jxh s THR 253 Ca 0.12 0.23 0.00 0.00 0.31 0.00 0.00 61.69 62.35 3jxh s THR 253 Cb -0.01 -3.50 0.00 0.00 0.01 0.00 0.00 72.50 69.00 3jxh s THR 253 CO 0.00 0.40 0.00 0.61 -0.69 0.00 0.00 174.62 174.94 3jxh n GLY 254 N 3.81 4.81 3.21 4.40 0.00 0.77 -4.87 105.19 117.32 3jxh n GLY 254 Ca -0.15 -0.60 -0.12 0.00 0.00 0.00 0.00 46.02 45.15 3jxh n GLY 254 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3jxh s SER 255 N 1.44 0.15 0.53 1.61 1.04 -1.25 -2.10 113.70 115.13 3jxh s SER 255 Ca 0.00 -1.35 -0.22 0.00 0.48 0.00 0.00 55.95 54.86 3jxh s SER 255 Cb 0.00 0.38 -0.05 0.00 0.10 0.00 0.00 66.02 66.45 3jxh s SER 255 CO 0.00 -0.84 1.35 -0.76 0.98 0.00 0.00 173.24 173.97 3jxh s LEU 256 N -3.14 3.88 0.00 2.42 1.43 -0.83 -4.43 118.68 118.01 3jxh s LEU 256 Ca 0.37 2.75 0.21 0.00 -1.03 0.00 0.00 54.13 56.42 3jxh s LEU 256 Cb 0.07 -4.25 0.54 0.00 0.03 0.00 0.00 46.19 42.58 3jxh s LEU 256 CO 0.11 -1.50 1.45 0.35 0.23 0.00 0.00 176.35 176.99 3jxh n THR 257 N -0.93 0.66 -4.24 5.49 -2.24 -1.26 -4.34 114.28 107.41 3jxh n THR 257 Ca 0.10 -0.75 -0.15 0.00 -2.27 0.00 0.00 64.05 60.98 3jxh n THR 257 Cb 0.45 0.59 -0.10 0.00 -2.10 0.00 0.00 70.33 69.17 3jxh n THR 257 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3jxh s THR 258 N -1.34 1.16 0.37 4.28 -4.23 -1.26 -4.69 115.64 109.93 3jxh s THR 258 Ca 0.40 -1.97 -0.26 0.00 -1.18 0.00 0.00 61.69 58.68 3jxh s THR 258 Cb 0.22 -1.75 -0.12 0.00 1.34 0.00 0.00 72.50 72.19 3jxh s THR 258 CO 0.29 -0.69 1.04 -2.65 -0.54 0.00 0.00 174.62 172.07 3jxh n PRO 259 N -0.02 1.44 -0.02 3.99 -0.02 -1.26 -0.44 135.00 138.66 3jxh n PRO 259 Ca -0.11 0.51 0.03 0.00 -2.02 0.00 0.00 63.50 61.91 3jxh n PRO 259 Cb 0.60 -2.01 0.15 0.00 -0.02 0.00 0.00 33.50 32.21 3jxh n PRO 259 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3jxh n PRO 260 N 0.37 1.11 -2.83 0.52 -0.04 -1.26 -4.99 135.00 127.88 3jxh n PRO 260 Ca 0.09 -0.16 -0.21 0.00 -0.04 0.00 0.00 63.50 63.17 3jxh n PRO 260 Cb 0.37 -1.10 0.01 0.00 -0.04 0.00 0.00 33.50 32.74 3jxh n PRO 260 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3jxh n SER 262 N -2.29 3.88 -3.81 0.00 7.64 -1.26 -4.43 113.62 113.34 3jxh n SER 262 Ca -0.14 1.12 -0.42 0.00 1.01 0.00 0.00 58.87 60.43 3jxh n SER 262 Cb 0.63 -1.58 0.00 0.00 -1.01 0.00 0.00 64.21 62.25 3jxh n SER 262 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3jxh n GLU 263 N 2.75 3.66 0.00 1.43 1.02 -1.26 -1.96 120.64 126.29 3jxh n GLU 263 Ca 0.11 -3.45 0.00 0.00 -0.02 0.00 0.00 57.16 53.80 3jxh n GLU 263 Cb 0.36 -2.92 0.00 0.00 -0.02 0.00 0.00 31.44 28.86 3jxh n GLU 263 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 3jxh n ILE 264 N 3.29 0.02 -3.71 -3.67 -5.35 -1.07 -4.92 119.36 103.96 3jxh n ILE 264 Ca 0.43 -0.02 -0.36 0.00 -0.27 0.00 0.00 62.75 62.52 3jxh n ILE 264 Cb 0.35 1.06 -0.10 0.00 -1.74 0.00 0.00 39.64 39.21 3jxh n ILE 264 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 3jxh s VAL 265 N -0.02 5.19 -0.39 7.28 1.01 -0.89 -1.13 120.40 131.44 3jxh s VAL 265 Ca 0.00 0.12 -0.22 0.00 0.00 0.00 0.00 61.98 61.88 3jxh s VAL 265 Cb 0.00 -3.41 0.01 0.00 0.00 0.00 0.00 36.38 32.98 3jxh s VAL 265 CO 0.00 0.36 0.70 -1.61 0.00 0.00 0.00 175.10 174.54 3jxh s GLU 266 N 1.05 3.55 -0.00 2.72 0.41 -0.11 -0.16 118.70 126.16 3jxh s GLU 266 Ca 0.07 -0.01 -0.14 0.00 -0.41 0.00 0.00 54.97 54.47 3jxh s GLU 266 Cb -0.14 -3.87 -0.06 0.00 -1.78 0.00 0.00 34.13 28.29 3jxh s GLU 266 CO 0.04 -0.90 0.39 -1.58 -0.49 0.00 0.00 175.26 172.72 3jxh s TRP 267 N 2.94 3.71 -0.22 1.61 0.52 -0.25 -1.55 118.94 125.70 3jxh s TRP 267 Ca 0.27 0.95 0.02 0.00 0.02 0.00 0.00 56.10 57.35 3jxh s TRP 267 Cb -0.14 -2.26 0.04 0.00 -1.15 0.00 0.00 33.47 29.97 3jxh s TRP 267 CO 0.18 0.65 -0.15 0.42 0.02 0.00 0.00 176.95 178.07 3jxh s ILE 268 N -1.09 2.20 -0.28 2.03 1.01 0.20 -2.55 121.20 122.72 3jxh s ILE 268 Ca 0.24 -1.24 -0.03 0.00 0.00 0.00 0.00 60.65 59.61 3jxh s ILE 268 Cb -0.16 -2.11 0.03 0.00 0.01 0.00 0.00 42.46 40.23 3jxh s ILE 268 CO 0.13 0.26 0.00 -0.69 0.00 0.00 0.00 174.94 174.65 3jxh s VAL 269 N 1.21 3.24 0.21 2.92 1.01 0.09 -0.49 120.40 128.59 3jxh s VAL 269 Ca -0.01 -1.07 -0.30 0.00 0.00 0.00 0.00 61.98 60.59 3jxh s VAL 269 Cb -0.16 -2.74 -0.08 0.00 0.00 0.00 0.00 36.38 33.40 3jxh s VAL 269 CO -0.09 0.04 1.07 -0.36 0.00 0.00 0.00 175.10 175.76 3jxh s PHE 270 N 1.35 3.66 0.14 5.22 0.08 -0.70 -0.58 117.98 127.15 3jxh s PHE 270 Ca -0.01 1.69 0.00 0.00 0.12 0.00 0.00 56.93 58.73 3jxh s PHE 270 Cb -0.18 -3.22 -0.07 0.00 -0.57 0.00 0.00 43.02 38.98 3jxh s PHE 270 CO -0.01 -0.37 1.33 -0.09 -0.10 0.00 0.00 175.22 175.97 3jxh h ARG 271 N 4.65 0.24 -5.60 0.44 2.43 -1.63 -3.42 114.38 111.50 3jxh h ARG 271 Ca -0.45 -0.28 -0.66 0.00 -0.81 0.00 0.00 59.98 57.78 3jxh h ARG 271 Cb 1.21 0.09 -0.08 0.00 -0.42 0.00 0.00 29.97 30.77 3jxh h ARG 271 CO 0.70 1.02 -0.48 1.03 -1.51 0.00 0.00 179.97 180.73 3jxh s ARG 272 N -3.13 3.53 0.57 0.20 1.81 -1.26 -5.03 118.95 115.65 3jxh s ARG 272 Ca -0.03 -0.14 -0.04 0.00 -1.72 0.00 0.00 55.73 53.79 3jxh s ARG 272 Cb 0.09 -3.22 0.01 0.00 -0.45 0.00 0.00 34.95 31.39 3jxh s ARG 272 CO 0.84 0.72 0.86 -1.25 -0.68 0.00 0.00 175.30 175.80 3jxh s PRO 273 N -0.86 2.84 -0.13 3.54 0.05 -1.26 -4.63 135.00 134.56 3jxh s PRO 273 Ca 0.14 -0.17 -0.08 0.00 0.05 0.00 0.00 61.00 60.94 3jxh s PRO 273 Cb -0.12 -2.33 -0.04 0.00 0.05 0.00 0.00 34.50 32.06 3jxh s PRO 273 CO 0.03 -0.68 0.16 0.08 0.05 0.00 0.00 177.00 176.64 3jxh s VAL 274 N -2.92 5.45 0.44 -0.36 1.01 0.31 -4.78 120.40 119.55 3jxh s VAL 274 Ca 0.54 0.26 -0.22 0.00 0.00 0.00 0.00 61.98 62.56 3jxh s VAL 274 Cb -0.10 -3.44 -0.09 0.00 0.00 0.00 0.00 36.38 32.75 3jxh s VAL 274 CO 0.43 0.57 1.04 -2.16 0.00 0.00 0.00 175.10 174.99 3jxh s PRO 275 N -0.70 3.98 -0.06 2.72 0.04 -1.26 -0.78 135.00 138.94 3jxh s PRO 275 Ca 0.14 1.43 -0.07 0.00 0.04 0.00 0.00 61.00 62.54 3jxh s PRO 275 Cb -0.12 -2.31 0.02 0.00 0.04 0.00 0.00 34.50 32.13 3jxh s PRO 275 CO 0.03 -0.29 0.19 -1.50 0.04 0.00 0.00 177.00 175.47 3jxh s ILE 276 N -1.83 0.02 0.54 0.56 2.07 -0.29 -4.62 121.20 117.66 3jxh s ILE 276 Ca 0.63 -0.15 -0.07 0.00 -1.41 0.00 0.00 60.65 59.65 3jxh s ILE 276 Cb -0.19 -0.32 -0.03 0.00 0.13 0.00 0.00 42.46 42.05 3jxh s ILE 276 CO 0.24 -0.08 0.87 -0.94 -1.91 0.00 0.00 174.94 173.11 3jxh s SER 277 N -0.24 6.09 0.38 4.50 1.04 -1.26 -0.54 113.70 123.67 3jxh s SER 277 Ca -0.03 0.99 0.05 0.00 0.48 0.00 0.00 55.95 57.43 3jxh s SER 277 Cb -0.03 -2.17 0.73 0.00 0.10 0.00 0.00 66.02 64.66 3jxh s SER 277 CO 0.01 -0.76 2.00 1.88 0.98 0.00 0.00 173.24 177.35 3jxh h TYR 278 N 0.01 0.60 -0.66 5.02 -1.99 -1.91 -1.64 116.97 116.40 3jxh h TYR 278 Ca -0.46 -0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.22 3jxh h TYR 278 Cb 1.21 -0.20 -0.03 0.00 2.00 0.00 0.00 36.73 39.72 3jxh h TYR 278 CO 0.57 0.43 0.24 1.25 -0.00 0.00 0.00 178.16 180.65 3jxh h HIS 279 N 0.63 1.03 -0.59 4.88 2.76 -1.93 -2.69 115.15 119.24 3jxh h HIS 279 Ca 0.16 -0.09 -0.08 0.00 -2.20 0.00 0.00 60.37 58.17 3jxh h HIS 279 Cb 0.02 -0.30 -0.02 0.00 1.55 0.00 0.00 27.41 28.66 3jxh h HIS 279 CO 0.00 0.82 0.06 1.96 -1.30 0.00 0.00 177.93 179.47 3jxh h GLN 280 N 0.94 0.97 -0.34 5.26 4.20 -1.79 -2.65 115.11 121.69 3jxh h GLN 280 Ca 0.22 -0.26 0.06 0.00 0.06 0.00 0.00 58.65 58.72 3jxh h GLN 280 Cb 0.24 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.89 3jxh h GLN 280 CO -0.01 0.92 0.24 -0.07 -0.67 0.00 0.00 178.83 179.23 3jxh h LEU 281 N 0.91 0.20 -2.05 1.46 3.38 -1.00 -1.90 115.31 116.30 3jxh h LEU 281 Ca 0.18 -0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.24 3jxh h LEU 281 Cb 0.45 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 3jxh h LEU 281 CO 0.02 0.13 0.25 -0.33 0.09 0.00 0.00 178.44 178.60 3jxh h GLU 282 N 0.22 0.00 -0.17 1.13 4.39 -1.24 -0.26 114.58 118.65 3jxh h GLU 282 Ca 0.15 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.80 3jxh h GLU 282 Cb 0.32 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.96 3jxh h GLU 282 CO -0.03 0.00 -0.14 0.00 -1.16 0.00 0.00 179.01 177.68 3jxh h ALA 283 N 1.80 1.44 -0.32 3.43 0.00 -1.48 -2.44 119.26 121.69 3jxh h ALA 283 Ca 0.15 -0.23 -0.13 0.00 0.00 0.00 0.00 54.91 54.70 3jxh h ALA 283 Cb 0.65 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 3jxh h ALA 283 CO -0.00 0.39 -0.33 0.74 0.00 0.00 0.00 179.25 180.05 3jxh h PHE 284 N 0.27 0.94 0.00 0.00 -1.00 -1.20 -3.26 116.94 112.68 3jxh h PHE 284 Ca 0.05 -0.28 0.00 0.00 2.81 0.00 0.00 57.97 60.55 3jxh h PHE 284 Cb 0.42 -0.20 0.00 0.00 3.61 0.00 0.00 35.95 39.78 3jxh h PHE 284 CO 0.01 1.06 0.00 1.88 -1.61 0.00 0.00 178.31 179.65 3jxh h TYR 285 N 0.55 0.00 -0.00 -0.55 0.05 -1.20 -2.77 116.97 113.04 3jxh h TYR 285 Ca 0.05 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.83 3jxh h TYR 285 Cb 0.91 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.65 3jxh h TYR 285 CO 0.07 0.00 -0.20 0.43 -1.05 0.00 0.00 178.16 177.41 3jxh n SER 286 N -2.70 0.67 -4.76 3.88 7.64 -0.98 -4.78 113.62 112.59 3jxh n SER 286 Ca 0.01 -0.62 -0.40 0.00 1.01 0.00 0.00 58.87 58.88 3jxh n SER 286 Cb 0.28 0.02 -0.03 0.00 -1.01 0.00 0.00 64.21 63.47 3jxh n SER 286 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3jxh s ILE 287 N -2.56 3.27 0.18 0.44 -1.09 -1.05 -4.90 121.20 115.49 3jxh s ILE 287 Ca 0.25 1.22 0.04 0.00 -2.23 0.00 0.00 60.65 59.93 3jxh s ILE 287 Cb 0.19 -3.76 -0.04 0.00 -1.58 0.00 0.00 42.46 37.28 3jxh s ILE 287 CO 0.52 0.25 0.24 -0.36 -1.23 0.00 0.00 174.94 174.36 3jxh s PHE 288 N -1.23 3.33 0.09 3.97 0.40 0.30 -0.03 117.98 124.82 3jxh s PHE 288 Ca 0.48 0.02 0.02 0.00 -0.60 0.00 0.00 56.93 56.85 3jxh s PHE 288 Cb -0.33 -1.57 -0.04 0.00 0.51 0.00 0.00 43.02 41.59 3jxh s PHE 288 CO 0.43 0.50 -0.06 -0.08 0.70 0.00 0.00 175.22 176.70 3jxh s THR 289 N -1.84 0.66 0.00 0.64 -1.32 0.46 -4.04 115.64 110.20 3jxh s THR 289 Ca 0.33 -1.88 0.05 0.00 -1.21 0.00 0.00 61.69 58.97 3jxh s THR 289 Cb -0.10 -1.62 -0.01 0.00 -1.51 0.00 0.00 72.50 69.26 3jxh s THR 289 CO 0.27 -0.85 -0.14 0.42 -2.21 0.00 0.00 174.62 172.10 3jxh s THR 290 N -3.52 1.14 -0.18 5.08 -4.23 -1.26 -1.50 115.64 111.16 3jxh s THR 290 Ca 0.10 -0.72 -0.02 0.00 -1.18 0.00 0.00 61.69 59.88 3jxh s THR 290 Cb 0.05 -0.97 0.00 0.00 1.34 0.00 0.00 72.50 72.92 3jxh s THR 290 CO -0.05 0.24 0.06 -0.62 -0.54 0.00 0.00 174.62 173.72 3jxh n GLU 291 N 2.51 -1.80 -1.64 3.99 1.02 -1.26 -5.00 120.64 118.45 3jxh n GLU 291 Ca -0.15 1.69 0.00 0.00 -0.02 0.00 0.00 57.16 58.68 3jxh n GLU 291 Cb 0.55 -3.48 0.00 0.00 -0.02 0.00 0.00 31.44 28.49 3jxh n GLU 291 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3jxh n SER 298 N 0.23 -8.62 -4.49 1.62 2.88 -1.26 -5.11 113.62 98.87 3jxh n SER 298 Ca 0.01 1.21 -0.33 0.00 -1.33 0.00 0.00 58.87 58.43 3jxh n SER 298 Cb 0.05 -4.48 -0.13 0.00 -0.75 0.00 0.00 64.21 58.90 3jxh n SER 298 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 3jxh s VAL 299 N -2.28 3.28 0.10 2.46 1.01 -1.26 -4.99 120.40 118.72 3jxh s VAL 299 Ca 0.00 -0.63 -0.01 0.00 0.00 0.00 0.00 61.98 61.34 3jxh s VAL 299 Cb 0.00 -2.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.02 3jxh s VAL 299 CO 0.00 0.58 0.02 -1.61 0.00 0.00 0.00 175.10 174.09 3jxh s GLU 300 N -0.57 0.81 0.36 2.72 0.41 -0.56 -5.01 118.70 116.86 3jxh s GLU 300 Ca 0.08 -1.36 -0.28 0.00 -0.41 0.00 0.00 54.97 53.01 3jxh s GLU 300 Cb -0.12 0.21 -0.10 0.00 -1.78 0.00 0.00 34.13 32.35 3jxh s GLU 300 CO 0.01 -0.20 1.30 0.71 -0.49 0.00 0.00 175.26 176.59 3jxh s TYR 301 N -3.99 2.97 -0.63 1.61 2.02 -1.26 -0.40 117.35 117.66 3jxh s TYR 301 Ca 0.18 1.42 -0.26 0.00 -0.37 0.00 0.00 57.07 58.04 3jxh s TYR 301 Cb 0.08 -3.66 0.04 0.00 -0.40 0.00 0.00 41.96 38.02 3jxh s TYR 301 CO -0.03 -1.91 1.11 -1.17 -1.57 0.00 0.00 175.55 171.98 3jxh s LEU 302 N -2.06 3.71 0.07 -1.29 2.96 0.96 -4.63 118.68 118.40 3jxh s LEU 302 Ca 0.52 -0.37 -0.08 0.00 -0.22 0.00 0.00 54.13 53.98 3jxh s LEU 302 Cb -0.39 -2.77 -0.00 0.00 0.50 0.00 0.00 46.19 43.53 3jxh s LEU 302 CO 0.51 -1.51 0.17 -0.13 -1.32 0.00 0.00 176.35 174.07 3jxh s ARG 303 N 4.75 0.77 -1.49 1.98 0.52 -1.26 -4.66 118.95 119.57 3jxh s ARG 303 Ca 0.34 -0.88 -0.08 0.00 -0.52 0.00 0.00 55.73 54.58 3jxh s ARG 303 Cb -0.11 0.31 0.06 0.00 0.52 0.00 0.00 34.95 35.73 3jxh s ARG 303 CO 0.18 -0.23 0.72 0.09 0.02 0.00 0.00 175.30 176.08 3jxh n ASN 304 N 0.19 -2.41 -3.57 0.23 3.02 -0.49 -4.85 115.26 107.37 3jxh n ASN 304 Ca -0.16 -0.90 -0.41 0.00 -0.03 0.00 0.00 54.58 53.08 3jxh n ASN 304 Cb 0.61 -3.44 0.00 0.00 -0.61 0.00 0.00 39.78 36.34 3jxh n ASN 304 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 3jxh n ASN 305 N -2.89 7.47 -4.18 6.41 6.94 -1.08 -4.89 115.26 123.05 3jxh n ASN 305 Ca -0.13 -3.21 -0.21 0.00 -0.02 0.00 0.00 54.58 51.02 3jxh n ASN 305 Cb 0.60 -1.35 -0.13 0.00 -2.36 0.00 0.00 39.78 36.53 3jxh n ASN 305 CO 0.00 0.00 0.00 0.72 -1.03 0.00 0.00 177.26 176.95 3jxh s PHE 306 N -1.33 1.36 0.18 -2.53 -0.12 -1.26 -4.52 117.98 109.76 3jxh s PHE 306 Ca 0.49 -0.39 -0.25 0.00 -0.05 0.00 0.00 56.93 56.73 3jxh s PHE 306 Cb 0.17 -0.79 -0.08 0.00 -0.63 0.00 0.00 43.02 41.69 3jxh s PHE 306 CO -0.08 0.07 0.78 0.50 -0.05 0.00 0.00 175.22 176.45 3jxh s ARG 307 N -1.40 4.54 0.54 1.99 3.52 -1.26 -5.03 118.95 121.85 3jxh s ARG 307 Ca 0.02 1.14 -0.21 0.00 -0.13 0.00 0.00 55.73 56.56 3jxh s ARG 307 Cb -0.09 -3.20 -0.06 0.00 -1.56 0.00 0.00 34.95 30.04 3jxh s ARG 307 CO 0.02 0.54 1.08 -2.30 -0.81 0.00 0.00 175.30 173.83 3jxh n PRO 308 N 1.45 1.24 -1.95 5.12 -0.02 -1.26 -4.73 135.00 134.84 3jxh n PRO 308 Ca -0.05 0.46 -0.34 0.00 -2.02 0.00 0.00 63.50 61.55 3jxh n PRO 308 Cb 0.49 -2.25 0.03 0.00 -0.02 0.00 0.00 33.50 31.76 3jxh n PRO 308 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3jxh s GLN 309 N -2.59 2.97 0.22 -0.52 -0.21 -1.26 -4.54 119.66 113.72 3jxh s GLN 309 Ca 0.71 1.57 0.09 0.00 0.02 0.00 0.00 55.36 57.76 3jxh s GLN 309 Cb -0.45 -1.96 -0.04 0.00 1.00 0.00 0.00 33.01 31.56 3jxh s GLN 309 CO 0.50 -1.15 -0.06 -0.65 -2.12 0.00 0.00 175.29 171.81 3jxh s GLN 310 N -3.66 2.15 0.30 2.91 -1.52 0.33 -4.99 119.66 115.18 3jxh s GLN 310 Ca 0.71 -1.34 -0.29 0.00 -1.95 0.00 0.00 55.36 52.50 3jxh s GLN 310 Cb -0.24 -2.15 -0.09 0.00 -0.22 0.00 0.00 33.01 30.30 3jxh s GLN 310 CO 0.35 0.41 1.10 1.03 -0.25 0.00 0.00 175.29 177.93 3jxh s ARG 311 N -3.17 4.56 0.17 2.91 3.00 -1.26 -4.60 118.95 120.55 3jxh s ARG 311 Ca 0.28 1.78 -0.12 0.00 0.00 0.00 0.00 55.73 57.66 3jxh s ARG 311 Cb -0.08 -3.09 0.06 0.00 0.00 0.00 0.00 34.95 31.84 3jxh s ARG 311 CO 0.17 0.14 1.71 1.25 0.00 0.00 0.00 175.30 178.57 3jxh h LEU 312 N 3.60 0.80 0.00 2.53 5.85 -1.92 -3.42 115.31 122.75 3jxh h LEU 312 Ca -0.47 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.06 3jxh h LEU 312 Cb 1.21 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.03 3jxh h LEU 312 CO 0.66 0.78 0.00 1.41 -0.34 0.00 0.00 178.44 180.95 3jxh n HIS 313 N -4.46 0.00 0.91 1.25 8.25 -1.26 -2.78 115.22 117.13 3jxh n HIS 313 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 3jxh n HIS 313 Cb 0.18 0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.33 3jxh n HIS 313 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 3jxh n ASP 314 N 0.98 1.74 -4.90 0.41 2.03 -1.26 -4.85 116.55 110.70 3jxh n ASP 314 Ca 0.00 -1.83 -0.29 0.00 0.52 0.00 0.00 54.79 53.19 3jxh n ASP 314 Cb 0.00 -0.46 -0.04 0.00 -0.72 0.00 0.00 41.12 39.90 3jxh n ASP 314 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 3jxh s ARG 315 N -0.51 3.32 -0.10 -0.67 0.52 -1.12 -5.10 118.95 115.29 3jxh s ARG 315 Ca 0.00 -0.57 0.02 0.00 -0.52 0.00 0.00 55.73 54.66 3jxh s ARG 315 Cb 0.00 -2.94 -0.02 0.00 0.52 0.00 0.00 34.95 32.52 3jxh s ARG 315 CO 0.00 0.56 -0.15 0.08 0.02 0.00 0.00 175.30 175.82 3jxh s VAL 316 N -1.60 2.96 -0.11 3.52 1.01 -1.26 -5.02 120.40 119.91 3jxh s VAL 316 Ca 0.34 -0.72 -0.16 0.00 0.00 0.00 0.00 61.98 61.44 3jxh s VAL 316 Cb -0.12 -2.20 -0.05 0.00 0.00 0.00 0.00 36.38 34.01 3jxh s VAL 316 CO 0.27 0.55 0.39 -0.69 0.00 0.00 0.00 175.10 175.62 3jxh s VAL 317 N -0.06 5.21 0.15 2.92 1.01 -1.26 -4.75 120.40 123.63 3jxh s VAL 317 Ca -0.03 0.77 0.03 0.00 0.00 0.00 0.00 61.98 62.75 3jxh s VAL 317 Cb -0.14 -3.72 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 3jxh s VAL 317 CO 0.04 0.40 0.27 -0.44 0.00 0.00 0.00 175.10 175.37 3jxh s SER 318 N 0.25 6.26 0.03 3.32 0.01 -0.04 -1.12 113.70 122.41 3jxh s SER 318 Ca 0.22 0.14 0.04 0.00 1.31 0.00 0.00 55.95 57.66 3jxh s SER 318 Cb -0.14 -1.86 -0.02 0.00 0.21 0.00 0.00 66.02 64.21 3jxh s SER 318 CO 0.08 0.05 -0.13 -1.59 0.41 0.00 0.00 173.24 172.06 3jxh s LYS 319 N -3.26 0.85 0.00 12.44 -2.85 0.30 -0.70 119.74 126.53 3jxh s LYS 319 Ca 0.34 -0.69 0.06 0.00 -1.00 0.00 0.00 55.97 54.68 3jxh s LYS 319 Cb -0.11 -0.83 0.33 0.00 -2.06 0.00 0.00 37.83 35.16 3jxh s LYS 319 CO 0.28 0.20 0.80 -1.13 0.10 0.00 0.00 175.35 175.60