#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x33 s ILE 74 N 0.00 4.63 -0.11 -0.61 1.01 -1.26 -4.65 121.20 120.21 1x33 s ILE 74 Ca 0.00 -0.62 -0.02 0.00 0.00 0.00 0.00 60.65 60.00 1x33 s ILE 74 Cb 0.00 -3.68 0.04 0.00 0.01 0.00 0.00 42.46 38.83 1x33 s ILE 74 CO 0.00 -0.40 0.04 -0.89 0.00 0.00 0.00 174.94 173.69 1x33 s THR 75 N -2.33 0.20 -0.07 2.92 2.01 -1.04 -5.00 115.64 112.34 1x33 s THR 75 Ca 0.42 0.01 0.02 0.00 0.31 0.00 0.00 61.69 62.45 1x33 s THR 75 Cb -0.10 -0.55 -0.03 0.00 0.01 0.00 0.00 72.50 71.84 1x33 s THR 75 CO 0.35 0.05 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.53 1x33 s VAL 76 N 2.03 3.39 0.02 3.82 1.01 -1.26 -1.66 120.40 127.75 1x33 s VAL 76 Ca 0.03 -0.59 -0.04 0.00 0.00 0.00 0.00 61.98 61.39 1x33 s VAL 76 Cb -0.14 -2.37 -0.01 0.00 0.00 0.00 0.00 36.38 33.85 1x33 s VAL 76 CO -0.06 0.58 0.05 -1.48 0.00 0.00 0.00 175.10 174.20 1x33 s LEU 77 N -0.61 1.95 -0.05 3.92 2.34 -1.04 -5.01 118.68 120.18 1x33 s LEU 77 Ca 0.09 -0.48 0.03 0.00 0.06 0.00 0.00 54.13 53.83 1x33 s LEU 77 Cb -0.11 0.42 0.00 0.00 -0.56 0.00 0.00 46.19 45.93 1x33 s LEU 77 CO 0.01 -0.41 -0.15 -0.89 -1.06 0.00 0.00 176.35 173.86 1x33 s THR 78 N -2.03 1.27 0.15 5.48 2.01 -1.26 -1.68 115.64 119.57 1x33 s THR 78 Ca -0.10 -0.61 -0.25 0.00 0.31 0.00 0.00 61.69 61.05 1x33 s THR 78 Cb -0.05 -1.11 0.06 0.00 0.01 0.00 0.00 72.50 71.41 1x33 s THR 78 CO -0.02 0.38 0.81 -2.28 -0.69 0.00 0.00 174.62 172.82 1x33 s HIS 79 N 0.25 -0.28 -0.01 4.92 5.04 0.05 -4.99 115.29 120.26 1x33 s HIS 79 Ca -0.07 -0.01 0.03 0.00 -1.54 0.00 0.00 55.06 53.47 1x33 s HIS 79 Cb -0.12 0.62 -0.00 0.00 0.04 0.00 0.00 32.58 33.11 1x33 s HIS 79 CO 0.03 -0.87 -0.09 -1.12 -2.34 0.00 0.00 174.74 170.35 1x33 s SER 80 N -2.79 1.12 0.25 9.88 0.01 -1.26 -0.21 113.70 120.70 1x33 s SER 80 Ca 0.08 -0.17 -0.11 0.00 1.31 0.00 0.00 55.95 57.06 1x33 s SER 80 Cb -0.02 -0.19 -0.01 0.00 0.21 0.00 0.00 66.02 66.01 1x33 s SER 80 CO -0.02 0.09 0.45 -1.83 0.41 0.00 0.00 173.24 172.34 1x33 s GLU 81 N -0.06 1.56 0.05 12.44 -1.05 -0.77 -4.98 118.70 125.89 1x33 s GLU 81 Ca 0.01 -1.34 -0.31 0.00 -0.15 0.00 0.00 54.97 53.18 1x33 s GLU 81 Cb -0.05 0.45 -0.06 0.00 -0.44 0.00 0.00 34.13 34.03 1x33 s GLU 81 CO -0.00 -0.64 1.25 -1.17 0.95 0.00 0.00 175.26 175.65 1x33 s LEU 82 N -3.06 4.35 -0.24 1.83 2.96 -1.26 -1.18 118.68 122.09 1x33 s LEU 82 Ca 0.25 2.06 0.03 0.00 -0.22 0.00 0.00 54.13 56.24 1x33 s LEU 82 Cb 0.00 -3.58 -0.16 0.00 0.50 0.00 0.00 46.19 42.95 1x33 s LEU 82 CO 0.10 -0.54 -0.19 -0.24 -1.32 0.00 0.00 176.35 174.16 1x33 n SER 83 N 4.21 1.99 -3.61 3.68 2.88 0.04 -4.58 113.62 118.22 1x33 n SER 83 Ca 0.10 -0.12 -0.09 0.00 -1.33 0.00 0.00 58.87 57.43 1x33 n SER 83 Cb 0.45 -0.28 -0.06 0.00 -0.75 0.00 0.00 64.21 63.57 1x33 n SER 83 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1x33 s ALA 84 N -2.48 -1.99 -0.07 -1.46 0.00 -0.73 -4.85 121.76 110.17 1x33 s ALA 84 Ca -0.31 1.73 -0.16 0.00 0.00 0.00 0.00 51.96 53.22 1x33 s ALA 84 Cb 0.08 -1.16 -0.05 0.00 0.00 0.00 0.00 23.12 21.99 1x33 s ALA 84 CO 0.57 -0.25 0.42 -1.21 0.00 0.00 0.00 175.76 175.29 1x33 s GLU 85 N -0.45 4.16 -0.04 0.00 2.02 -1.26 -0.62 118.70 122.50 1x33 s GLU 85 Ca 0.02 0.38 -0.01 0.00 0.02 0.00 0.00 54.97 55.38 1x33 s GLU 85 Cb -0.03 -3.34 -0.04 0.00 0.10 0.00 0.00 34.13 30.82 1x33 s GLU 85 CO -0.04 0.39 0.03 0.42 0.02 0.00 0.00 175.26 176.08 1x33 s ILE 86 N -0.11 4.45 -0.00 -1.63 -1.09 -0.15 -4.98 121.20 117.68 1x33 s ILE 86 Ca 0.24 -0.37 0.00 0.00 -2.23 0.00 0.00 60.65 58.29 1x33 s ILE 86 Cb -0.15 -2.95 0.00 0.00 -1.58 0.00 0.00 42.46 37.78 1x33 s ILE 86 CO 0.11 0.47 0.00 -0.83 -1.23 0.00 0.00 174.94 173.46 1x33 s GLY 87 N -1.31 0.02 0.03 6.18 0.00 -1.26 -2.05 107.32 108.92 1x33 s GLY 87 Ca 0.18 0.03 0.03 0.00 0.00 0.00 0.00 44.72 44.95 1x33 s GLY 87 CO 0.08 0.07 -0.01 0.54 0.00 0.00 0.00 173.10 173.78 1x33 s VAL 88 N 0.11 4.05 0.00 1.40 0.11 -0.82 -4.78 120.40 120.47 1x33 s VAL 88 Ca -0.01 -0.76 0.00 0.00 -2.93 0.00 0.00 61.98 58.28 1x33 s VAL 88 Cb -0.01 -2.84 0.00 0.00 -1.53 0.00 0.00 36.38 31.99 1x33 s VAL 88 CO -0.00 0.29 0.00 0.35 -3.33 0.00 0.00 175.10 172.40 1x33 n THR 89 N 1.12 0.00 0.33 5.04 -2.24 -1.26 -2.62 114.28 114.65 1x33 n THR 89 Ca -0.13 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.77 1x33 n THR 89 Cb 0.52 0.00 0.12 0.00 -2.10 0.00 0.00 70.33 68.88 1x33 n THR 89 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 1x33 h ASP 90 N 0.00 0.00 -4.10 3.42 2.03 -1.03 0.27 116.42 117.00 1x33 h ASP 90 Ca 0.00 -0.08 -0.64 0.00 -0.73 0.00 0.00 57.03 55.58 1x33 h ASP 90 Cb 0.00 0.00 -0.23 0.00 -0.83 0.00 0.00 39.33 38.27 1x33 h ASP 90 CO 0.00 0.04 -0.86 -0.44 -1.03 0.00 0.00 179.24 176.95 1x33 s SER 91 N -5.04 2.96 0.32 4.15 0.01 -1.26 -4.53 113.70 110.32 1x33 s SER 91 Ca 0.04 -0.68 -0.28 0.00 1.31 0.00 0.00 55.95 56.34 1x33 s SER 91 Cb 0.10 -0.21 -0.13 0.00 0.21 0.00 0.00 66.02 66.00 1x33 s SER 91 CO 0.73 0.15 1.23 -0.38 0.41 0.00 0.00 173.24 175.39 1x33 n ILE 92 N 1.22 1.94 -3.62 1.44 5.41 -1.26 -4.61 119.36 119.88 1x33 n ILE 92 Ca -0.18 -0.49 -0.27 0.00 1.00 0.00 0.00 62.75 62.81 1x33 n ILE 92 Cb 0.53 -1.44 -0.16 0.00 -0.71 0.00 0.00 39.64 37.86 1x33 n ILE 92 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1x33 s VAL 93 N -1.03 0.08 -0.17 1.39 1.01 -1.12 -4.97 120.40 115.60 1x33 s VAL 93 Ca 0.57 -0.47 -0.13 0.00 0.00 0.00 0.00 61.98 61.96 1x33 s VAL 93 Cb -0.60 -0.83 -0.05 0.00 0.00 0.00 0.00 36.38 34.90 1x33 s VAL 93 CO 0.61 -0.41 0.24 -0.69 0.00 0.00 0.00 175.10 174.86 1x33 s VAL 94 N 2.05 5.34 0.28 2.92 1.01 -1.26 -2.52 120.40 128.21 1x33 s VAL 94 Ca 0.04 0.44 0.02 0.00 0.00 0.00 0.00 61.98 62.48 1x33 s VAL 94 Cb -0.16 -3.58 -0.06 0.00 0.00 0.00 0.00 36.38 32.58 1x33 s VAL 94 CO -0.17 0.40 0.07 -0.94 0.00 0.00 0.00 175.10 174.46 1x33 s SER 95 N 0.47 1.70 -0.06 3.32 1.04 0.60 -4.99 113.70 115.78 1x33 s SER 95 Ca 0.14 -1.36 -0.20 0.00 0.48 0.00 0.00 55.95 55.01 1x33 s SER 95 Cb -0.12 0.05 0.04 0.00 0.10 0.00 0.00 66.02 66.09 1x33 s SER 95 CO 0.02 -0.66 0.45 -0.94 0.98 0.00 0.00 173.24 173.09 1x33 s SER 96 N -3.37 -0.38 -0.02 7.02 1.04 -1.26 -0.46 113.70 116.25 1x33 s SER 96 Ca 0.36 0.44 0.06 0.00 0.48 0.00 0.00 55.95 57.29 1x33 s SER 96 Cb 0.08 0.51 -0.01 0.00 0.10 0.00 0.00 66.02 66.70 1x33 s SER 96 CO 0.14 -0.43 -0.20 -1.61 0.98 0.00 0.00 173.24 172.11 1x33 s GLU 97 N -0.96 1.77 0.44 4.02 0.41 -0.24 -4.98 118.70 119.16 1x33 s GLU 97 Ca -0.10 -0.72 -0.22 0.00 -0.41 0.00 0.00 54.97 53.52 1x33 s GLU 97 Cb -0.03 -1.65 -0.09 0.00 -1.78 0.00 0.00 34.13 30.58 1x33 s GLU 97 CO 0.05 0.40 1.02 -0.51 -0.49 0.00 0.00 175.26 175.72 1x33 s LEU 98 N -0.35 3.97 -0.98 1.80 1.43 -1.26 -0.20 118.68 123.08 1x33 s LEU 98 Ca 0.05 1.90 -0.01 0.00 -1.03 0.00 0.00 54.13 55.03 1x33 s LEU 98 Cb -0.09 -4.43 0.33 0.00 0.03 0.00 0.00 46.19 42.03 1x33 s LEU 98 CO 0.00 -0.57 1.88 0.52 0.23 0.00 0.00 176.35 178.41 1x33 n VAL 99 N -0.58 5.48 -4.33 -1.59 0.31 0.15 -4.46 118.33 113.32 1x33 n VAL 99 Ca 0.07 -5.56 -0.25 0.00 -0.01 0.00 0.00 64.34 58.59 1x33 n VAL 99 Cb 0.52 -1.47 -0.12 0.00 -0.91 0.00 0.00 33.84 31.85 1x33 n VAL 99 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1x33 s MET 100 N -4.27 1.25 0.31 5.55 0.23 -1.26 -4.60 119.30 116.50 1x33 s MET 100 Ca 0.42 -1.27 0.06 0.00 -1.03 0.00 0.00 55.69 53.88 1x33 s MET 100 Cb 0.25 -1.57 0.84 0.00 -1.53 0.00 0.00 34.83 32.83 1x33 s MET 100 CO -0.20 0.36 1.64 -1.35 -2.03 0.00 0.00 175.02 173.43 1x33 h PRO 101 N 3.89 0.19 -0.81 3.16 0.11 -1.92 -1.62 132.00 134.99 1x33 h PRO 101 Ca -0.47 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 1x33 h PRO 101 Cb 1.18 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 32.21 1x33 h PRO 101 CO 0.41 0.12 0.45 -0.92 -0.21 0.00 0.00 178.00 177.85 1x33 h TYR 102 N 0.19 1.10 -0.00 0.65 5.03 -1.88 -3.17 116.97 118.89 1x33 h TYR 102 Ca 0.62 -0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.91 1x33 h TYR 102 Cb 1.33 -0.35 0.00 0.00 1.55 0.00 0.00 36.73 39.26 1x33 h TYR 102 CO -0.22 0.76 -0.75 0.25 -1.32 0.00 0.00 178.16 176.88 1x33 n THR 103 N -4.35 0.00 0.02 1.81 -2.24 -0.66 -4.37 114.28 104.49 1x33 n THR 103 Ca 0.08 -0.04 -0.12 0.00 -2.27 0.00 0.00 64.05 61.70 1x33 n THR 103 Cb 0.09 0.80 -0.08 0.00 -2.10 0.00 0.00 70.33 69.04 1x33 n THR 103 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1x33 h VAL 104 N 0.41 1.11 -2.03 2.28 2.07 -1.38 -3.47 116.25 115.25 1x33 h VAL 104 Ca 0.00 -0.34 0.23 0.00 0.82 0.00 0.00 66.70 67.41 1x33 h VAL 104 Cb 0.54 1.33 -0.10 0.00 -1.52 0.00 0.00 31.29 31.54 1x33 h VAL 104 CO 0.00 0.09 0.60 -0.83 0.02 0.00 0.00 177.57 177.45 1x33 s GLY 105 N -2.48 -0.30 0.08 2.17 0.00 -1.26 -4.33 107.32 101.20 1x33 s GLY 105 Ca -0.14 0.34 -0.33 0.00 0.00 0.00 0.00 44.72 44.59 1x33 s GLY 105 CO 0.67 0.05 1.61 -0.84 0.00 0.00 0.00 173.10 174.59 1x33 h THR 106 N 2.00 0.25 0.02 0.90 2.02 -1.88 -1.76 112.91 114.46 1x33 h THR 106 Ca -0.26 0.00 0.01 0.00 0.77 0.00 0.00 66.41 66.93 1x33 h THR 106 Cb 1.22 0.25 -0.02 0.00 -1.74 0.00 0.00 68.15 67.85 1x33 h THR 106 CO 0.26 0.00 -0.24 -0.25 0.37 0.00 0.00 175.52 175.67 1x33 h TRP 107 N -0.93 -0.70 -0.96 3.16 7.01 -1.97 -2.16 115.95 119.41 1x33 h TRP 107 Ca -0.08 0.02 0.11 0.00 2.11 0.00 0.00 58.89 61.05 1x33 h TRP 107 Cb 0.75 0.30 -0.08 0.00 -2.10 0.00 0.00 29.16 28.04 1x33 h TRP 107 CO -0.09 -0.26 0.61 1.25 -2.79 0.00 0.00 178.44 177.16 1x33 h LEU 108 N -0.31 0.88 -0.85 0.65 5.85 -1.88 -0.84 115.31 118.81 1x33 h LEU 108 Ca 0.00 0.03 0.12 0.00 0.84 0.00 0.00 57.88 58.87 1x33 h LEU 108 Cb 0.33 -0.14 -0.08 0.00 0.37 0.00 0.00 40.66 41.13 1x33 h LEU 108 CO -0.15 0.49 0.47 -0.09 -0.34 0.00 0.00 178.44 178.82 1x33 h ARG 109 N 0.96 0.72 -0.01 1.25 2.43 -0.96 0.76 114.38 119.52 1x33 h ARG 109 Ca 0.46 -0.04 -0.18 0.00 -0.81 0.00 0.00 59.98 59.40 1x33 h ARG 109 Cb 0.45 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 1x33 h ARG 109 CO -0.22 0.48 -0.81 0.78 -1.51 0.00 0.00 179.97 178.68 1x33 h GLY 110 N 0.74 0.20 0.17 2.80 0.00 -0.52 -3.25 103.07 103.21 1x33 h GLY 110 Ca 0.43 -0.33 -0.11 0.00 0.00 0.00 0.00 47.33 47.32 1x33 h GLY 110 CO -0.29 0.29 -0.55 -0.24 0.00 0.00 0.00 176.54 175.75 1x33 h VAL 111 N 0.11 1.49 -0.06 4.60 3.04 -1.01 -3.33 116.25 121.08 1x33 h VAL 111 Ca -0.03 -2.35 0.02 0.00 -1.01 0.00 0.00 66.70 63.32 1x33 h VAL 111 Cb 1.42 3.05 -0.00 0.00 -2.01 0.00 0.00 31.29 33.74 1x33 h VAL 111 CO 0.12 0.58 0.23 0.00 -1.01 0.00 0.00 177.57 177.49 1x33 h ALA 112 N -0.09 1.37 0.00 3.17 0.00 -1.00 -1.63 119.26 121.08 1x33 h ALA 112 Ca -0.13 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1x33 h ALA 112 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1x33 h ALA 112 CO -0.01 -0.26 0.00 0.00 0.00 0.00 0.00 179.25 178.98 1x33 h ALA 113 N 1.59 1.00 -0.00 0.00 0.00 -1.67 -2.96 119.26 117.22 1x33 h ALA 113 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1x33 h ALA 113 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1x33 h ALA 113 CO -0.00 0.00 -0.01 0.09 0.00 0.00 0.00 179.25 179.33 1x33 n ASN 114 N -2.42 0.30 -4.28 0.00 3.02 -0.61 -4.23 115.26 107.04 1x33 n ASN 114 Ca 0.02 -0.94 -0.24 0.00 -0.03 0.00 0.00 54.58 53.39 1x33 n ASN 114 Cb 0.26 -0.04 -0.13 0.00 -0.61 0.00 0.00 39.78 39.26 1x33 n ASN 114 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 1x33 s TRP 115 N -2.12 1.77 -0.06 3.10 0.51 -1.12 -1.12 118.94 119.92 1x33 s TRP 115 Ca 0.42 -0.41 -0.27 0.00 -2.12 0.00 0.00 56.10 53.72 1x33 s TRP 115 Cb 0.21 -0.99 -0.22 0.00 -0.81 0.00 0.00 33.47 31.67 1x33 s TRP 115 CO 0.39 0.18 1.11 0.77 -0.51 0.00 0.00 176.95 178.89 1x33 h SER 116 N 4.22 0.02 -2.20 2.95 0.02 0.52 -3.45 113.55 115.62 1x33 h SER 116 Ca -0.45 -0.65 -0.57 0.00 -0.84 0.00 0.00 61.79 59.27 1x33 h SER 116 Cb 1.18 -0.01 -0.13 0.00 0.14 0.00 0.00 62.40 63.58 1x33 h SER 116 CO 0.40 0.67 -0.58 -0.54 -1.14 0.00 0.00 176.83 175.64 1x33 s LYS 117 N -3.60 1.89 0.30 3.45 1.02 -1.10 -1.59 119.74 120.10 1x33 s LYS 117 Ca -0.17 -2.10 -0.15 0.00 0.02 0.00 0.00 55.97 53.57 1x33 s LYS 117 Cb 0.00 -1.21 0.02 0.00 -0.52 0.00 0.00 37.83 36.13 1x33 s LYS 117 CO 0.68 -0.21 0.63 1.52 -0.92 0.00 0.00 175.35 177.05 1x33 s TYR 118 N -3.02 0.21 -0.15 3.18 1.13 -0.54 -1.64 117.35 116.53 1x33 s TYR 118 Ca 0.29 -0.67 -0.07 0.00 -1.41 0.00 0.00 57.07 55.21 1x33 s TYR 118 Cb 0.07 0.48 0.06 0.00 -1.10 0.00 0.00 41.96 41.47 1x33 s TYR 118 CO 0.14 -1.23 0.35 0.45 -2.51 0.00 0.00 175.55 172.75 1x33 s SER 119 N -3.03 -0.28 0.36 -0.18 0.15 0.05 -1.49 113.70 109.29 1x33 s SER 119 Ca 0.18 0.78 -0.27 0.00 0.70 0.00 0.00 55.95 57.34 1x33 s SER 119 Cb -0.03 0.78 -0.09 0.00 -1.71 0.00 0.00 66.02 64.96 1x33 s SER 119 CO 0.10 -0.20 1.24 0.26 1.20 0.00 0.00 173.24 175.84 1x33 s TRP 120 N 1.73 3.07 0.00 3.44 0.23 -1.26 -1.74 118.94 124.41 1x33 s TRP 120 Ca -0.07 1.49 0.00 0.00 -2.03 0.00 0.00 56.10 55.49 1x33 s TRP 120 Cb -0.10 -3.55 0.00 0.00 0.03 0.00 0.00 33.47 29.85 1x33 s TRP 120 CO -0.11 -1.59 0.00 -0.11 0.96 0.00 0.00 176.95 176.10 1x33 n LEU 121 N 0.50 0.00 -3.24 2.99 7.94 -0.25 -4.91 117.00 120.02 1x33 n LEU 121 Ca 0.02 0.00 0.03 0.00 -1.11 0.00 0.00 56.01 54.95 1x33 n LEU 121 Cb 0.44 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 44.35 1x33 n LEU 121 CO 0.55 0.00 0.77 -0.55 -1.11 0.00 0.00 177.39 177.05 1x33 s SER 122 N -1.97 -0.28 -0.06 1.96 0.15 -1.08 -4.92 113.70 107.50 1x33 s SER 122 Ca 0.00 0.34 0.04 0.00 0.70 0.00 0.00 55.95 57.03 1x33 s SER 122 Cb 0.00 1.30 -0.00 0.00 -1.71 0.00 0.00 66.02 65.61 1x33 s SER 122 CO 0.00 -0.05 -0.19 -0.69 1.20 0.00 0.00 173.24 173.51 1x33 s VAL 123 N 2.36 1.61 -0.12 4.45 1.01 -1.26 -1.60 120.40 126.85 1x33 s VAL 123 Ca -0.01 -0.80 -0.05 0.00 0.00 0.00 0.00 61.98 61.12 1x33 s VAL 123 Cb -0.04 -1.39 0.06 0.00 0.00 0.00 0.00 36.38 35.00 1x33 s VAL 123 CO -0.15 0.46 0.25 -0.60 0.00 0.00 0.00 175.10 175.06 1x33 s ARG 124 N 0.14 0.17 -0.28 2.72 3.52 -0.94 -1.10 118.95 123.19 1x33 s ARG 124 Ca -0.08 0.64 -0.09 0.00 -0.13 0.00 0.00 55.73 56.08 1x33 s ARG 124 Cb -0.14 -0.08 -0.03 0.00 -1.56 0.00 0.00 34.95 33.14 1x33 s ARG 124 CO 0.04 -0.23 0.13 0.71 -0.81 0.00 0.00 175.30 175.13 1x33 s TYR 125 N 1.88 3.15 -0.12 5.12 2.02 -0.70 -0.17 117.35 128.53 1x33 s TYR 125 Ca -0.04 -0.33 0.01 0.00 -0.37 0.00 0.00 57.07 56.34 1x33 s TYR 125 Cb -0.11 -2.31 -0.01 0.00 -0.40 0.00 0.00 41.96 39.13 1x33 s TYR 125 CO -0.08 -0.34 -0.15 0.99 -1.57 0.00 0.00 175.55 174.40 1x33 s THR 126 N 1.65 2.88 -0.04 -0.71 2.01 0.12 -1.66 115.64 119.89 1x33 s THR 126 Ca 0.06 -0.73 -0.11 0.00 0.31 0.00 0.00 61.69 61.22 1x33 s THR 126 Cb -0.16 -2.19 -0.05 0.00 0.01 0.00 0.00 72.50 70.11 1x33 s THR 126 CO 0.06 0.53 0.30 -0.47 -0.69 0.00 0.00 174.62 174.36 1x33 s TYR 127 N 0.27 3.67 -0.05 4.92 5.04 -0.18 -0.62 117.35 130.40 1x33 s TYR 127 Ca -0.11 0.79 -0.02 0.00 -2.44 0.00 0.00 57.07 55.30 1x33 s TYR 127 Cb -0.16 -2.14 0.03 0.00 0.35 0.00 0.00 41.96 40.04 1x33 s TYR 127 CO 0.06 0.67 0.04 0.42 -1.34 0.00 0.00 175.55 175.40 1x33 s ILE 128 N -1.09 0.03 1.08 3.14 1.01 0.35 -4.60 121.20 121.11 1x33 s ILE 128 Ca 0.21 0.32 -0.12 0.00 0.00 0.00 0.00 60.65 61.07 1x33 s ILE 128 Cb -0.15 -0.25 0.23 0.00 0.01 0.00 0.00 42.46 42.30 1x33 s ILE 128 CO 0.11 0.19 1.02 -0.81 0.00 0.00 0.00 174.94 175.45 1x33 n PRO 129 N 5.13 -1.66 -0.09 2.79 -0.04 -1.26 -1.12 135.00 138.75 1x33 n PRO 129 Ca -0.07 -0.44 0.00 0.00 -0.04 0.00 0.00 63.50 62.95 1x33 n PRO 129 Cb 0.50 -2.22 0.00 0.00 -0.04 0.00 0.00 33.50 31.74 1x33 n PRO 129 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1x33 n SER 130 N -4.52 0.00 -4.53 3.54 3.41 -0.54 -4.77 113.62 106.21 1x33 n SER 130 Ca 0.06 -1.04 -0.25 0.00 -0.26 0.00 0.00 58.87 57.39 1x33 n SER 130 Cb 0.53 -0.01 -0.01 0.00 -0.26 0.00 0.00 64.21 64.47 1x33 n SER 130 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1x33 s PRO 132 N -3.96 3.59 0.07 0.00 0.02 -1.26 -4.94 135.00 128.53 1x33 s PRO 132 Ca 0.23 0.34 0.06 0.00 0.02 0.00 0.00 61.00 61.64 1x33 s PRO 132 Cb -0.02 -2.33 0.30 0.00 0.02 0.00 0.00 34.50 32.48 1x33 s PRO 132 CO 0.14 -0.24 1.18 0.43 -0.33 0.00 0.00 177.00 178.19 1x33 n SER 133 N -2.17 0.13 0.01 2.53 7.64 -1.26 -1.33 113.62 119.17 1x33 n SER 133 Ca 0.02 0.56 0.11 0.00 1.01 0.00 0.00 58.87 60.57 1x33 n SER 133 Cb 0.55 -0.58 0.08 0.00 -1.01 0.00 0.00 64.21 63.25 1x33 n SER 133 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1x33 n SER 134 N -1.68 0.67 -4.72 6.43 7.64 -1.26 -4.95 113.62 115.76 1x33 n SER 134 Ca -0.00 -0.44 -0.42 0.00 1.01 0.00 0.00 58.87 59.02 1x33 n SER 134 Cb 0.02 0.61 -0.03 0.00 -1.01 0.00 0.00 64.21 63.80 1x33 n SER 134 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1x33 s THR 135 N -3.06 3.35 0.03 0.44 2.01 -0.44 -5.01 115.64 112.96 1x33 s THR 135 Ca 0.08 1.02 -0.09 0.00 0.31 0.00 0.00 61.69 63.01 1x33 s THR 135 Cb 0.16 -3.65 -0.05 0.00 0.01 0.00 0.00 72.50 68.96 1x33 s THR 135 CO 0.78 0.11 0.34 0.00 -0.69 0.00 0.00 174.62 175.16 1x33 s ALA 136 N 0.71 3.77 0.00 7.40 0.00 -1.26 -4.69 121.76 127.69 1x33 s ALA 136 Ca 0.61 -0.43 0.00 0.00 0.00 0.00 0.00 51.96 52.14 1x33 s ALA 136 Cb -0.36 -2.21 0.00 0.00 0.00 0.00 0.00 23.12 20.55 1x33 s ALA 136 CO 0.33 0.58 0.00 0.41 0.00 0.00 0.00 175.76 177.08 1x33 n GLY 137 N 1.19 4.17 3.14 0.00 0.00 -0.74 -3.91 105.19 109.04 1x33 n GLY 137 Ca -0.11 -1.35 -0.12 0.00 0.00 0.00 0.00 46.02 44.44 1x33 n GLY 137 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x33 s SER 138 N 0.00 1.12 0.14 1.61 1.04 -0.80 -0.59 113.70 116.21 1x33 s SER 138 Ca 0.00 -0.81 0.09 0.00 0.48 0.00 0.00 55.95 55.71 1x33 s SER 138 Cb 0.00 0.06 -0.04 0.00 0.10 0.00 0.00 66.02 66.14 1x33 s SER 138 CO 0.00 -0.33 -0.20 -0.51 0.98 0.00 0.00 173.24 173.18 1x33 s ILE 139 N -2.60 1.83 0.01 -1.02 2.07 -0.20 -2.81 121.20 118.48 1x33 s ILE 139 Ca 0.03 -1.76 -0.01 0.00 -1.41 0.00 0.00 60.65 57.50 1x33 s ILE 139 Cb -0.02 -1.75 -0.01 0.00 0.13 0.00 0.00 42.46 40.81 1x33 s ILE 139 CO -0.02 -0.18 0.01 -1.00 -1.91 0.00 0.00 174.94 171.84 1x33 s HIS 140 N -1.60 0.13 -0.03 3.50 3.76 -0.13 -2.37 115.29 118.55 1x33 s HIS 140 Ca 0.12 -0.27 -0.12 0.00 -0.15 0.00 0.00 55.06 54.65 1x33 s HIS 140 Cb -0.08 -0.10 0.02 0.00 1.11 0.00 0.00 32.58 33.53 1x33 s HIS 140 CO 0.06 -0.13 0.25 -1.64 -0.85 0.00 0.00 174.74 172.43 1x33 s MET 141 N -0.90 0.55 0.28 1.40 -1.94 -0.59 -1.77 119.30 116.32 1x33 s MET 141 Ca -0.10 -0.15 -0.20 0.00 -1.71 0.00 0.00 55.69 53.53 1x33 s MET 141 Cb -0.06 0.24 0.04 0.00 2.01 0.00 0.00 34.83 37.07 1x33 s MET 141 CO -0.00 -0.14 0.82 0.20 -0.01 0.00 0.00 175.02 175.89 1x33 s GLY 142 N -1.07 0.05 0.16 -0.03 0.00 -0.79 -1.90 107.32 103.74 1x33 s GLY 142 Ca -0.11 -0.37 0.09 0.00 0.00 0.00 0.00 44.72 44.32 1x33 s GLY 142 CO 0.03 0.13 -0.13 -1.36 0.00 0.00 0.00 173.10 171.76 1x33 s PHE 143 N -3.11 2.58 0.03 1.90 0.08 -1.06 -0.74 117.98 117.65 1x33 s PHE 143 Ca 0.14 -0.24 0.01 0.00 0.12 0.00 0.00 56.93 56.95 1x33 s PHE 143 Cb -0.05 -1.30 -0.02 0.00 -0.57 0.00 0.00 43.02 41.09 1x33 s PHE 143 CO 0.07 0.47 -0.05 -0.65 -0.10 0.00 0.00 175.22 174.97 1x33 s GLN 144 N -2.58 0.40 0.00 0.44 -0.21 -0.74 -4.19 119.66 112.78 1x33 s GLN 144 Ca 0.22 -0.69 0.00 0.00 0.02 0.00 0.00 55.36 54.92 1x33 s GLN 144 Cb -0.09 -0.02 0.00 0.00 1.00 0.00 0.00 33.01 33.90 1x33 s GLN 144 CO 0.13 -0.02 0.00 0.66 -2.12 0.00 0.00 175.29 173.94 1x33 n TYR 145 N 1.48 0.00 -3.23 0.91 4.01 -1.26 -1.70 117.16 117.38 1x33 n TYR 145 Ca -0.23 0.00 -0.46 0.00 -0.16 0.00 0.00 57.90 57.05 1x33 n TYR 145 Cb 0.55 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.56 1x33 n TYR 145 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1x33 s ASP 146 N -2.16 6.66 0.63 7.72 2.15 -1.26 -4.72 116.67 125.69 1x33 s ASP 146 Ca 0.00 -2.41 0.18 0.00 0.43 0.00 0.00 52.55 50.75 1x33 s ASP 146 Cb 0.00 -2.26 0.67 0.00 -0.30 0.00 0.00 42.92 41.03 1x33 s ASP 146 CO 0.00 -0.73 1.26 0.24 -0.17 0.00 0.00 175.17 175.77 1x33 h MET 147 N 8.17 0.00 0.00 4.34 2.86 -1.93 0.69 114.93 129.06 1x33 h MET 147 Ca 0.07 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 1x33 h MET 147 Cb 1.04 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.70 1x33 h MET 147 CO 0.87 0.00 -0.01 0.00 1.06 0.00 0.00 176.91 178.83 1x33 h ALA 148 N 0.44 1.00 -2.75 6.32 0.00 -1.90 -3.46 119.26 118.91 1x33 h ALA 148 Ca 0.28 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.65 1x33 h ALA 148 Cb 2.38 0.00 0.16 0.00 0.00 0.00 0.00 17.79 20.33 1x33 h ALA 148 CO -0.00 0.00 0.40 -0.51 0.00 0.00 0.00 179.25 179.14 1x33 s ASP 149 N -5.47 4.10 0.21 0.00 -0.00 0.24 -4.94 116.67 110.81 1x33 s ASP 149 Ca 0.09 2.42 -0.30 0.00 -0.00 0.00 0.00 52.55 54.75 1x33 s ASP 149 Cb 0.08 -2.60 -0.08 0.00 -0.00 0.00 0.00 42.92 40.33 1x33 s ASP 149 CO 0.64 -2.33 1.03 -0.89 -0.00 0.00 0.00 175.17 173.62 1x33 s THR 150 N -1.90 3.94 0.09 -1.27 2.01 -1.26 -5.00 115.64 112.26 1x33 s THR 150 Ca 0.76 1.81 -0.30 0.00 0.31 0.00 0.00 61.69 64.26 1x33 s THR 150 Cb -0.31 -4.15 -0.06 0.00 0.01 0.00 0.00 72.50 67.99 1x33 s THR 150 CO 0.46 0.37 1.19 0.54 -0.69 0.00 0.00 174.62 176.48 1x33 s VAL 151 N -0.69 3.95 0.91 3.82 0.11 -1.26 -4.98 120.40 122.26 1x33 s VAL 151 Ca 0.45 1.46 -0.17 0.00 -2.93 0.00 0.00 61.98 60.79 1x33 s VAL 151 Cb -0.28 -3.93 -0.15 0.00 -1.53 0.00 0.00 36.38 30.49 1x33 s VAL 151 CO 0.35 0.15 -0.67 -2.65 -3.33 0.00 0.00 175.10 168.95 1x33 n PRO 152 N 3.53 -0.00 0.00 1.54 -0.02 -1.26 -4.97 135.00 133.82 1x33 n PRO 152 Ca 0.07 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 1x33 n PRO 152 Cb 0.46 -1.02 0.00 0.00 -0.02 0.00 0.00 33.50 32.92 1x33 n PRO 152 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1x33 n VAL 153 N -2.34 0.00 -3.85 -1.45 0.24 -1.26 -4.95 118.33 104.72 1x33 n VAL 153 Ca -0.00 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.19 1x33 n VAL 153 Cb 0.54 1.36 -0.09 0.00 -1.47 0.00 0.00 33.84 34.18 1x33 n VAL 153 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1x33 s SER 154 N 0.00 -0.01 0.39 -1.34 1.04 -1.26 -5.02 113.70 107.51 1x33 s SER 154 Ca 0.00 -0.20 0.08 0.00 0.48 0.00 0.00 55.95 56.31 1x33 s SER 154 Cb 0.00 0.24 0.84 0.00 0.10 0.00 0.00 66.02 67.21 1x33 s SER 154 CO 0.00 -0.43 1.99 0.58 0.98 0.00 0.00 173.24 176.36 1x33 h VAL 155 N 4.00 1.01 0.41 5.02 2.07 -1.98 -2.05 116.25 124.72 1x33 h VAL 155 Ca -0.31 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 1x33 h VAL 155 Cb 1.19 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 1x33 h VAL 155 CO 0.42 0.11 -0.26 -1.13 0.02 0.00 0.00 177.57 176.74 1x33 h ASN 156 N 0.62 -0.64 -0.45 0.57 -1.24 -1.99 -1.66 115.58 110.78 1x33 h ASN 156 Ca 0.27 0.04 0.05 0.00 0.71 0.00 0.00 56.30 57.37 1x33 h ASN 156 Cb 0.26 0.19 -0.05 0.00 0.73 0.00 0.00 38.32 39.45 1x33 h ASN 156 CO -0.08 -0.41 0.17 1.56 -1.29 0.00 0.00 177.43 177.38 1x33 h GLN 157 N -0.64 0.34 0.00 6.67 4.20 -1.80 -1.26 115.11 122.61 1x33 h GLN 157 Ca -0.04 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 1x33 h GLN 157 Cb 0.53 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.23 1x33 h GLN 157 CO 0.04 0.22 -0.03 1.25 -0.67 0.00 0.00 178.83 179.64 1x33 h LEU 158 N 0.35 0.00 -0.33 1.46 6.46 -1.27 -1.18 115.31 120.80 1x33 h LEU 158 Ca 0.21 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.97 1x33 h LEU 158 Cb 0.19 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.12 1x33 h LEU 158 CO -0.21 0.03 0.00 0.77 -0.62 0.00 0.00 178.44 178.42 1x33 h SER 159 N 0.00 0.00 1.78 1.25 4.64 -0.24 -3.15 113.55 117.82 1x33 h SER 159 Ca -0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 1x33 h SER 159 Cb 0.16 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 1x33 h SER 159 CO 0.00 0.00 -0.22 0.78 -0.87 0.00 0.00 176.83 176.53 1x33 h ASN 160 N 0.00 0.00 -4.01 4.97 -0.26 -1.19 -3.45 115.58 111.64 1x33 h ASN 160 Ca 0.00 0.00 -0.49 0.00 -0.56 0.00 0.00 56.30 55.25 1x33 h ASN 160 Cb 0.72 0.00 0.18 0.00 -1.06 0.00 0.00 38.32 38.16 1x33 h ASN 160 CO 0.00 0.22 0.20 -0.76 -1.06 0.00 0.00 177.43 176.03 1x33 s LEU 161 N -6.32 2.28 0.26 1.61 1.43 -1.19 -4.97 118.68 111.78 1x33 s LEU 161 Ca 0.06 1.80 -0.30 0.00 -1.03 0.00 0.00 54.13 54.66 1x33 s LEU 161 Cb 0.06 -4.14 -0.09 0.00 0.03 0.00 0.00 46.19 42.05 1x33 s LEU 161 CO 0.70 -3.05 1.08 -0.60 0.23 0.00 0.00 176.35 174.72 1x33 s ARG 162 N -4.73 4.66 -0.70 1.70 3.52 -1.26 -3.30 118.95 118.83 1x33 s ARG 162 Ca 0.65 1.76 0.00 0.00 -0.13 0.00 0.00 55.73 58.01 1x33 s ARG 162 Cb -0.21 -3.21 0.00 0.00 -1.56 0.00 0.00 34.95 29.97 1x33 s ARG 162 CO 0.59 0.22 0.00 0.41 -0.81 0.00 0.00 175.30 175.71 1x33 n GLY 163 N 1.34 0.72 3.63 8.12 0.00 -1.26 -2.55 105.19 115.19 1x33 n GLY 163 Ca -0.01 -0.70 -0.36 0.00 0.00 0.00 0.00 46.02 44.95 1x33 n GLY 163 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1x33 n TYR 164 N -3.08 0.83 -3.64 1.61 9.36 -1.21 -4.51 117.16 116.52 1x33 n TYR 164 Ca -0.07 0.40 -0.10 0.00 3.32 0.00 0.00 57.90 61.45 1x33 n TYR 164 Cb 0.31 -2.10 -0.07 0.00 -0.63 0.00 0.00 39.34 36.84 1x33 n TYR 164 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1x33 s VAL 165 N -1.79 0.00 0.03 2.97 0.11 -0.80 -4.98 120.40 115.96 1x33 s VAL 165 Ca 0.74 0.00 -0.04 0.00 -2.93 0.00 0.00 61.98 59.75 1x33 s VAL 165 Cb -0.35 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 33.49 1x33 s VAL 165 CO 0.49 0.00 0.06 -0.94 -3.33 0.00 0.00 175.10 171.38 1x33 s SER 166 N 0.60 0.21 -0.08 3.54 1.04 -1.26 -1.55 113.70 116.21 1x33 s SER 166 Ca -0.01 -0.55 -0.32 0.00 0.48 0.00 0.00 55.95 55.55 1x33 s SER 166 Cb -0.05 0.20 0.14 0.00 0.10 0.00 0.00 66.02 66.41 1x33 s SER 166 CO -0.07 -0.47 1.40 -0.83 0.98 0.00 0.00 173.24 174.25 1x33 s GLY 167 N -2.02 -0.47 0.25 7.32 0.00 -1.00 -4.99 107.32 106.41 1x33 s GLY 167 Ca -0.07 0.91 -0.30 0.00 0.00 0.00 0.00 44.72 45.27 1x33 s GLY 167 CO -0.04 0.17 1.36 1.20 0.00 0.00 0.00 173.10 175.80 1x33 s GLN 168 N -2.14 4.33 0.61 2.90 -0.21 -1.26 -1.03 119.66 122.86 1x33 s GLN 168 Ca 0.15 2.19 0.27 0.00 0.02 0.00 0.00 55.36 57.99 1x33 s GLN 168 Cb 0.07 -3.13 1.33 0.00 1.00 0.00 0.00 33.01 32.27 1x33 s GLN 168 CO -0.06 -0.31 1.75 0.28 -2.12 0.00 0.00 175.29 174.83 1x33 h VAL 169 N 3.49 0.21 -0.08 1.09 2.07 -1.16 0.46 116.25 122.33 1x33 h VAL 169 Ca -0.46 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.06 1x33 h VAL 169 Cb 1.22 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 31.47 1x33 h VAL 169 CO 0.75 0.00 0.00 -2.67 0.02 0.00 0.00 177.57 175.67 1x33 n TRP 170 N -3.40 0.08 -2.89 1.57 4.27 -1.26 -4.56 117.44 111.25 1x33 n TRP 170 Ca 0.09 -0.04 -0.20 0.00 -3.89 0.00 0.00 57.50 53.45 1x33 n TRP 170 Cb 0.79 -0.00 0.06 0.00 -1.36 0.00 0.00 31.31 30.80 1x33 n TRP 170 CO 0.00 0.00 0.00 0.45 -2.29 0.00 0.00 177.69 175.85 1x33 s SER 171 N -1.79 5.05 0.00 -0.67 0.15 0.16 -4.72 113.70 111.89 1x33 s SER 171 Ca 0.28 -0.58 0.00 0.00 0.70 0.00 0.00 55.95 56.35 1x33 s SER 171 Cb 0.19 -0.06 0.00 0.00 -1.71 0.00 0.00 66.02 64.44 1x33 s SER 171 CO 0.28 -1.33 0.00 0.61 1.20 0.00 0.00 173.24 174.00 1x33 n GLY 172 N -2.31 0.81 0.00 9.45 0.00 -1.26 -4.18 105.19 107.70 1x33 n GLY 172 Ca 0.13 -0.03 0.04 0.00 0.00 0.00 0.00 46.02 46.17 1x33 n GLY 172 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1x33 n SER 173 N 0.05 0.00 0.15 1.61 3.41 -1.26 -1.54 113.62 116.03 1x33 n SER 173 Ca 0.00 0.30 0.12 0.00 -0.26 0.00 0.00 58.87 59.03 1x33 n SER 173 Cb 0.00 -0.37 0.11 0.00 -0.26 0.00 0.00 64.21 63.69 1x33 n SER 173 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1x33 h ALA 174 N 2.35 0.74 0.00 7.33 0.00 -1.91 -3.25 119.26 124.52 1x33 h ALA 174 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1x33 h ALA 174 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1x33 h ALA 174 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1x33 n GLY 175 N 1.17 -1.09 0.28 0.00 0.00 -0.59 -3.04 105.19 101.92 1x33 n GLY 175 Ca 0.02 0.05 0.06 0.00 0.00 0.00 0.00 46.02 46.15 1x33 n GLY 175 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1x33 h LEU 176 N 0.00 0.26 -1.35 0.99 7.12 -1.75 -1.22 115.31 119.36 1x33 h LEU 176 Ca 0.00 0.11 0.33 0.00 0.13 0.00 0.00 57.88 58.46 1x33 h LEU 176 Cb 0.26 0.10 -0.11 0.00 -0.53 0.00 0.00 40.66 40.38 1x33 h LEU 176 CO 0.00 0.09 0.73 0.00 -0.13 0.00 0.00 178.44 179.12 1x33 h PHE 178 N 0.28 0.00 0.00 0.00 0.04 -1.47 -2.92 116.94 112.86 1x33 h PHE 178 Ca 0.69 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 61.34 1x33 h PHE 178 Cb 1.90 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 40.04 1x33 h PHE 178 CO -0.00 0.23 -0.55 0.82 -0.60 0.00 0.00 178.31 178.21 1x33 h ILE 179 N 0.00 1.11 -2.13 -0.55 2.04 -0.92 -3.29 117.51 113.78 1x33 h ILE 179 Ca -0.00 -2.11 -0.54 0.00 1.00 0.00 0.00 64.86 63.21 1x33 h ILE 179 Cb 0.42 2.24 -0.41 0.00 -0.74 0.00 0.00 36.82 38.33 1x33 h ILE 179 CO 0.03 0.54 -0.92 -0.46 0.00 0.00 0.00 178.15 177.34 1x33 n ASN 180 N -3.47 2.43 0.00 1.72 6.94 -1.17 -4.81 115.26 116.90 1x33 n ASN 180 Ca 0.00 -3.27 0.00 0.00 -0.02 0.00 0.00 54.58 51.29 1x33 n ASN 180 Cb 0.65 -0.60 0.00 0.00 -2.36 0.00 0.00 39.78 37.47 1x33 n ASN 180 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1x33 n GLY 181 N 0.27 0.00 0.00 4.83 0.00 -1.11 -4.89 105.19 104.28 1x33 n GLY 181 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.29 1x33 n GLY 181 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1x33 n THR 182 N 0.00 0.00 -2.92 2.61 5.66 -1.25 -5.06 114.28 113.33 1x33 n THR 182 Ca 0.00 0.00 -0.44 0.00 -3.05 0.00 0.00 64.05 60.56 1x33 n THR 182 Cb 0.00 0.00 -0.01 0.00 -1.55 0.00 0.00 70.33 68.77 1x33 n THR 182 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 1x33 s ARG 183 N 4.69 3.96 -0.57 1.09 3.00 -1.26 -4.97 118.95 124.89 1x33 s ARG 183 Ca 0.00 -2.34 -0.22 0.00 0.00 0.00 0.00 55.73 53.17 1x33 s ARG 183 Cb 0.00 -5.06 0.06 0.00 0.00 0.00 0.00 34.95 29.95 1x33 s ARG 183 CO 0.00 -1.80 0.84 0.00 0.00 0.00 0.00 175.30 174.34 1x33 n SER 185 N 7.09 1.75 -4.41 0.00 7.64 -1.26 -4.82 113.62 119.62 1x33 n SER 185 Ca -0.03 0.31 -0.44 0.00 1.01 0.00 0.00 58.87 59.72 1x33 n SER 185 Cb 0.46 -0.72 0.00 0.00 -1.01 0.00 0.00 64.21 62.94 1x33 n SER 185 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1x33 n ASP 186 N -4.28 5.23 -1.40 6.43 5.75 -1.26 -4.77 116.55 122.25 1x33 n ASP 186 Ca -0.13 -2.99 -0.01 0.00 -0.01 0.00 0.00 54.79 51.65 1x33 n ASP 186 Cb 0.47 -1.56 0.26 0.00 -1.03 0.00 0.00 41.12 39.25 1x33 n ASP 186 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1x33 n THR 187 N 4.43 2.62 -0.26 2.12 -2.24 -1.26 -4.64 114.28 115.05 1x33 n THR 187 Ca 0.37 -2.04 -0.07 0.00 -2.27 0.00 0.00 64.05 60.04 1x33 n THR 187 Cb 0.42 -0.32 0.05 0.00 -2.10 0.00 0.00 70.33 68.38 1x33 n THR 187 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1x33 h SER 188 N 1.84 1.06 1.34 3.42 0.02 -1.97 -2.95 113.55 116.32 1x33 h SER 188 Ca 0.18 -0.21 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 1x33 h SER 188 Cb 1.87 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 64.13 1x33 h SER 188 CO 0.48 0.99 -0.26 0.71 -1.14 0.00 0.00 176.83 177.61 1x33 h THR 189 N 1.07 0.00 -1.70 -2.27 1.35 -1.98 -3.47 112.91 105.91 1x33 h THR 189 Ca 0.23 -0.60 -0.70 0.00 -0.55 0.00 0.00 66.41 64.79 1x33 h THR 189 Cb 0.31 1.44 0.02 0.00 -1.73 0.00 0.00 68.15 68.19 1x33 h THR 189 CO -0.01 0.00 0.92 0.00 -0.25 0.00 0.00 175.52 176.19 1x33 n ALA 190 N -1.88 0.08 -3.18 6.62 0.00 -1.12 -4.21 120.51 116.82 1x33 n ALA 190 Ca 0.04 0.37 -0.46 0.00 0.00 0.00 0.00 53.44 53.39 1x33 n ALA 190 Cb 0.46 -2.29 -0.02 0.00 0.00 0.00 0.00 19.45 17.59 1x33 n ALA 190 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1x33 s ILE 191 N 3.41 5.31 -0.19 0.00 1.01 -1.26 -4.94 121.20 124.53 1x33 s ILE 191 Ca 0.95 -2.19 -0.17 0.00 0.00 0.00 0.00 60.65 59.25 1x33 s ILE 191 Cb -0.95 -4.59 0.05 0.00 0.01 0.00 0.00 42.46 36.98 1x33 s ILE 191 CO 0.60 -1.21 0.51 -0.55 0.00 0.00 0.00 174.94 174.30 1x33 s SER 192 N 2.66 -0.55 0.17 3.58 0.15 -1.26 -1.01 113.70 117.44 1x33 s SER 192 Ca 0.24 1.05 0.07 0.00 0.70 0.00 0.00 55.95 58.01 1x33 s SER 192 Cb -0.08 1.05 -0.04 0.00 -1.71 0.00 0.00 66.02 65.23 1x33 s SER 192 CO -0.09 -0.18 -0.15 0.28 1.20 0.00 0.00 173.24 174.30 1x33 s THR 193 N 0.40 1.64 0.09 6.45 -1.32 -0.66 -5.00 115.64 117.24 1x33 s THR 193 Ca -0.01 -2.01 0.10 0.00 -1.21 0.00 0.00 61.69 58.55 1x33 s THR 193 Cb -0.04 -1.87 -0.03 0.00 -1.51 0.00 0.00 72.50 69.05 1x33 s THR 193 CO -0.01 -0.49 -0.26 0.28 -2.21 0.00 0.00 174.62 171.94 1x33 s THR 194 N -2.55 2.11 0.02 5.08 -1.32 -1.26 -1.72 115.64 116.00 1x33 s THR 194 Ca 0.17 -1.57 -0.20 0.00 -1.21 0.00 0.00 61.69 58.88 1x33 s THR 194 Cb -0.03 -1.85 -0.06 0.00 -1.51 0.00 0.00 72.50 69.06 1x33 s THR 194 CO 0.06 0.17 0.59 -0.22 -2.21 0.00 0.00 174.62 173.01 1x33 s LEU 195 N -1.71 4.45 -1.31 9.08 2.96 -0.26 -4.92 118.68 126.98 1x33 s LEU 195 Ca 0.12 1.20 -0.15 0.00 -0.22 0.00 0.00 54.13 55.08 1x33 s LEU 195 Cb -0.10 -2.93 0.11 0.00 0.50 0.00 0.00 46.19 43.77 1x33 s LEU 195 CO 0.04 0.15 1.80 -0.90 -1.32 0.00 0.00 176.35 176.11 1x33 n ASP 196 N 2.46 4.80 -0.35 3.68 5.75 -1.26 -4.53 116.55 127.10 1x33 n ASP 196 Ca -0.08 -2.95 0.24 0.00 -0.01 0.00 0.00 54.79 51.99 1x33 n ASP 196 Cb 0.51 -1.64 0.48 0.00 -1.03 0.00 0.00 41.12 39.44 1x33 n ASP 196 CO 0.00 0.00 0.00 0.58 -0.11 0.00 0.00 177.20 177.67 1x33 h VAL 197 N 4.67 0.39 -0.90 2.12 2.07 -1.92 -2.32 116.25 120.37 1x33 h VAL 197 Ca 0.43 -0.13 0.07 0.00 0.82 0.00 0.00 66.70 67.89 1x33 h VAL 197 Cb 0.78 -0.02 -0.06 0.00 -1.52 0.00 0.00 31.29 30.47 1x33 h VAL 197 CO 1.53 0.07 0.58 0.77 0.02 0.00 0.00 177.57 180.54 1x33 h SER 198 N 0.38 0.89 -0.89 0.57 4.64 -1.94 -3.14 113.55 114.05 1x33 h SER 198 Ca 0.69 0.01 -0.57 0.00 -0.47 0.00 0.00 61.79 61.45 1x33 h SER 198 Cb 1.63 -0.18 -0.30 0.00 -0.31 0.00 0.00 62.40 63.24 1x33 h SER 198 CO -0.48 0.57 0.48 0.29 -0.87 0.00 0.00 176.83 176.81 1x33 n LYS 199 N -4.49 2.64 -2.44 4.77 4.76 -0.87 -5.01 118.16 117.51 1x33 n LYS 199 Ca 0.14 -3.35 -0.27 0.00 -2.87 0.00 0.00 58.31 51.96 1x33 n LYS 199 Cb 0.21 -2.21 0.03 0.00 -1.84 0.00 0.00 35.03 31.21 1x33 n LYS 199 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1x33 s LEU 200 N -3.62 3.30 0.00 -0.35 1.43 -1.19 -5.00 118.68 113.25 1x33 s LEU 200 Ca 0.59 0.74 0.00 0.00 -1.03 0.00 0.00 54.13 54.43 1x33 s LEU 200 Cb 0.48 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 43.11 1x33 s LEU 200 CO 0.02 -0.98 0.78 0.61 0.23 0.00 0.00 176.35 177.02 1x33 n GLY 201 N -2.52 -3.21 3.58 -3.19 0.00 -1.26 -4.78 105.19 93.80 1x33 n GLY 201 Ca 0.04 0.64 -0.27 0.00 0.00 0.00 0.00 46.02 46.42 1x33 n GLY 201 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1x33 s LYS 202 N -2.26 1.99 -0.17 1.61 -2.85 -1.26 -5.10 119.74 111.71 1x33 s LYS 202 Ca 0.00 -2.23 -0.24 0.00 -1.00 0.00 0.00 55.97 52.50 1x33 s LYS 202 Cb 0.00 -0.86 -0.23 0.00 -2.06 0.00 0.00 37.83 34.68 1x33 s LYS 202 CO 0.00 -0.44 0.47 -0.22 0.10 0.00 0.00 175.35 175.26 1x33 h LYS 203 N 1.68 0.03 -4.71 1.78 3.64 -1.96 -3.45 116.57 113.57 1x33 h LYS 203 Ca -0.38 -0.04 -0.68 0.00 -1.27 0.00 0.00 60.65 58.28 1x33 h LYS 203 Cb 1.28 0.02 -0.19 0.00 -0.41 0.00 0.00 32.23 32.92 1x33 h LYS 203 CO 0.62 1.02 -0.49 -1.58 -2.27 0.00 0.00 179.45 176.75 1x33 s TRP 204 N -2.32 3.22 0.14 1.91 0.52 -1.26 -4.41 118.94 116.75 1x33 s TRP 204 Ca -0.24 -0.27 0.03 0.00 0.02 0.00 0.00 56.10 55.64 1x33 s TRP 204 Cb 0.02 -2.46 -0.04 0.00 -1.15 0.00 0.00 33.47 29.84 1x33 s TRP 204 CO 0.65 -0.38 0.21 0.71 0.02 0.00 0.00 176.95 178.15 1x33 s TYR 205 N 1.71 3.34 0.29 -1.98 2.02 -0.55 -4.90 117.35 117.28 1x33 s TYR 205 Ca 0.06 0.08 -0.13 0.00 -0.37 0.00 0.00 57.07 56.70 1x33 s TYR 205 Cb -0.17 -1.62 -0.08 0.00 -0.40 0.00 0.00 41.96 39.68 1x33 s TYR 205 CO 0.10 0.53 0.68 -1.25 -1.57 0.00 0.00 175.55 174.04 1x33 s PRO 206 N -3.04 3.95 -0.05 -1.71 0.04 -1.26 -1.46 135.00 131.47 1x33 s PRO 206 Ca 0.33 0.56 -0.30 0.00 0.04 0.00 0.00 61.00 61.63 1x33 s PRO 206 Cb -0.11 -2.50 -0.03 0.00 0.04 0.00 0.00 34.50 31.90 1x33 s PRO 206 CO 0.26 0.21 1.16 -0.47 0.04 0.00 0.00 177.00 178.20 1x33 s TYR 207 N -1.93 3.29 0.14 0.56 6.14 -0.62 -4.91 117.35 120.01 1x33 s TYR 207 Ca 0.52 1.30 0.09 0.00 0.64 0.00 0.00 57.07 59.62 1x33 s TYR 207 Cb -0.11 -3.37 -0.04 0.00 0.42 0.00 0.00 41.96 38.86 1x33 s TYR 207 CO 0.18 -1.10 -0.21 0.15 0.64 0.00 0.00 175.55 175.22 1x33 s LYS 208 N 1.99 1.25 0.03 4.97 -0.14 -1.26 -4.50 119.74 122.08 1x33 s LYS 208 Ca 0.55 -1.31 -0.01 0.00 -1.36 0.00 0.00 55.97 53.84 1x33 s LYS 208 Cb -0.24 -1.48 -0.04 0.00 -1.68 0.00 0.00 37.83 34.39 1x33 s LYS 208 CO 0.23 0.33 0.17 0.95 -0.76 0.00 0.00 175.35 176.26 1x33 s THR 209 N -1.52 5.23 0.20 2.17 -4.23 -0.31 -4.50 115.64 112.68 1x33 s THR 209 Ca 0.12 -0.35 -0.18 0.00 -1.18 0.00 0.00 61.69 60.10 1x33 s THR 209 Cb -0.08 -3.49 0.18 0.00 1.34 0.00 0.00 72.50 70.45 1x33 s THR 209 CO 0.06 0.23 1.60 0.28 -0.54 0.00 0.00 174.62 176.25 1x33 h SER 210 N 3.50 -0.95 0.01 3.99 0.02 -1.94 -0.31 113.55 117.87 1x33 h SER 210 Ca -0.47 0.22 0.01 0.00 -0.84 0.00 0.00 61.79 60.71 1x33 h SER 210 Cb 1.17 0.51 -0.03 0.00 0.14 0.00 0.00 62.40 64.20 1x33 h SER 210 CO 0.71 -0.28 -0.30 0.00 -1.14 0.00 0.00 176.83 175.82 1x33 h ALA 211 N 1.26 -0.76 -0.97 3.77 0.00 -1.95 -1.64 119.26 118.98 1x33 h ALA 211 Ca 0.27 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.20 1x33 h ALA 211 Cb 0.53 0.75 -0.07 0.00 0.00 0.00 0.00 17.79 19.00 1x33 h ALA 211 CO -0.69 -0.84 0.63 0.22 0.00 0.00 0.00 179.25 178.57 1x33 h ASP 212 N -0.38 0.98 0.67 0.00 3.58 -1.71 -2.46 116.42 117.10 1x33 h ASP 212 Ca 0.00 0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.43 1x33 h ASP 212 Cb 0.40 -0.19 0.01 0.00 1.72 0.00 0.00 39.33 41.26 1x33 h ASP 212 CO -0.19 0.61 -0.32 0.22 -2.88 0.00 0.00 179.24 176.68 1x33 h TYR 213 N 1.10 -0.83 -0.86 0.28 5.03 -0.85 -2.59 116.97 118.26 1x33 h TYR 213 Ca 0.43 -0.02 0.20 0.00 2.58 0.00 0.00 58.73 61.92 1x33 h TYR 213 Cb 0.22 0.28 -0.12 0.00 1.55 0.00 0.00 36.73 38.66 1x33 h TYR 213 CO -0.00 -0.50 0.33 0.00 -1.32 0.00 0.00 178.16 176.67 1x33 h ALA 214 N -0.64 1.30 -0.49 1.82 0.00 -1.04 -0.17 119.26 120.04 1x33 h ALA 214 Ca -0.09 0.16 0.02 0.00 0.00 0.00 0.00 54.91 55.00 1x33 h ALA 214 Cb 0.70 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 1x33 h ALA 214 CO 0.15 -0.33 0.30 1.15 0.00 0.00 0.00 179.25 180.52 1x33 h THR 215 N 0.37 1.06 -0.17 0.00 2.02 -1.24 -0.71 112.91 114.24 1x33 h THR 215 Ca 0.52 -0.20 -0.12 0.00 0.77 0.00 0.00 66.41 67.37 1x33 h THR 215 Cb 0.95 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 1x33 h THR 215 CO -0.52 0.11 -0.42 0.00 0.37 0.00 0.00 175.52 175.06 1x33 h ALA 216 N 1.21 0.97 0.00 6.16 0.00 -0.70 -2.42 119.26 124.49 1x33 h ALA 216 Ca 0.20 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1x33 h ALA 216 Cb 0.01 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1x33 h ALA 216 CO -0.08 0.62 0.00 0.28 0.00 0.00 0.00 179.25 180.07 1x33 n VAL 217 N -4.02 0.64 0.13 0.00 0.31 -0.39 -2.58 118.33 112.42 1x33 n VAL 217 Ca -0.02 -0.12 -0.01 0.00 -0.01 0.00 0.00 64.34 64.18 1x33 n VAL 217 Cb 0.50 -0.75 0.21 0.00 -0.91 0.00 0.00 33.84 32.89 1x33 n VAL 217 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1x33 h GLY 218 N 3.87 0.09 0.30 2.92 0.00 -0.61 -3.21 103.07 106.43 1x33 h GLY 218 Ca 0.00 -0.10 -0.01 0.00 0.00 0.00 0.00 47.33 47.22 1x33 h GLY 218 CO 0.00 0.09 -0.10 -2.08 0.00 0.00 0.00 176.54 174.45 1x33 h VAL 219 N 0.06 0.51 -1.96 4.60 2.07 -1.52 -3.47 116.25 116.54 1x33 h VAL 219 Ca -0.00 -1.02 -0.01 0.00 0.82 0.00 0.00 66.70 66.49 1x33 h VAL 219 Cb 0.96 0.87 -0.22 0.00 -1.52 0.00 0.00 31.29 31.39 1x33 h VAL 219 CO 0.07 0.14 0.13 -0.62 0.02 0.00 0.00 177.57 177.31 1x33 s ASP 220 N -5.36 -0.78 0.16 0.57 2.15 -1.14 -5.06 116.67 107.21 1x33 s ASP 220 Ca -0.10 1.41 -0.16 0.00 0.43 0.00 0.00 52.55 54.14 1x33 s ASP 220 Cb 0.00 1.39 0.05 0.00 -0.30 0.00 0.00 42.92 44.07 1x33 s ASP 220 CO 0.34 -0.24 1.79 0.58 -0.17 0.00 0.00 175.17 177.47 1x33 h VAL 221 N 4.31 1.01 0.00 1.11 2.07 -1.83 -2.78 116.25 120.13 1x33 h VAL 221 Ca -0.29 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.07 1x33 h VAL 221 Cb 1.18 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.48 1x33 h VAL 221 CO 0.09 0.08 0.31 0.59 0.02 0.00 0.00 177.57 178.66 1x33 n ASN 222 N -4.89 0.27 0.00 0.57 3.02 -1.26 0.24 115.26 113.21 1x33 n ASN 222 Ca 0.01 0.50 0.10 0.00 -0.03 0.00 0.00 54.58 55.16 1x33 n ASN 222 Cb 0.08 -0.44 0.52 0.00 -0.61 0.00 0.00 39.78 39.32 1x33 n ASN 222 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1x33 n ILE 223 N -1.91 0.39 0.07 2.41 5.41 -1.05 -3.43 119.36 121.24 1x33 n ILE 223 Ca -0.01 0.10 -0.15 0.00 1.00 0.00 0.00 62.75 63.69 1x33 n ILE 223 Cb 0.33 -0.75 -0.14 0.00 -0.71 0.00 0.00 39.64 38.37 1x33 n ILE 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1x33 h ALA 224 N 2.95 0.26 -0.32 -1.39 0.00 -0.43 -3.36 119.26 116.96 1x33 h ALA 224 Ca 0.00 -1.04 0.09 0.00 0.00 0.00 0.00 54.91 53.97 1x33 h ALA 224 Cb 0.22 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1x33 h ALA 224 CO 0.00 1.13 0.42 1.79 0.00 0.00 0.00 179.25 182.60 1x33 h THR 225 N 0.06 0.30 -0.02 0.00 1.35 -1.76 0.51 112.91 113.34 1x33 h THR 225 Ca -0.18 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.68 1x33 h THR 225 Cb 1.97 0.65 0.00 0.00 -1.73 0.00 0.00 68.15 69.04 1x33 h THR 225 CO 0.16 0.00 -0.03 -0.81 -0.25 0.00 0.00 175.52 174.60 1x33 n PRO 226 N -3.54 1.68 -0.09 4.72 -0.04 -1.26 -4.24 135.00 132.23 1x33 n PRO 226 Ca 0.05 -1.06 -0.11 0.00 -0.04 0.00 0.00 63.50 62.34 1x33 n PRO 226 Cb 0.57 -1.48 -0.10 0.00 -0.04 0.00 0.00 33.50 32.45 1x33 n PRO 226 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1x33 n LEU 227 N 0.27 1.89 -4.04 1.53 4.32 0.17 -4.68 117.00 116.44 1x33 n LEU 227 Ca 0.18 -0.07 -0.18 0.00 -0.02 0.00 0.00 56.01 55.92 1x33 n LEU 227 Cb 0.39 -0.29 -0.14 0.00 -1.62 0.00 0.00 43.42 41.75 1x33 n LEU 227 CO 0.17 0.66 -0.44 0.68 -1.22 0.00 0.00 177.39 177.25 1x33 s VAL 228 N -2.38 0.76 0.12 4.08 -7.23 -0.73 -4.66 120.40 110.37 1x33 s VAL 228 Ca -0.19 -0.53 -0.11 0.00 -1.81 0.00 0.00 61.98 59.34 1x33 s VAL 228 Cb 0.06 -0.66 -0.11 0.00 0.56 0.00 0.00 36.38 36.23 1x33 s VAL 228 CO 0.51 0.13 1.38 1.55 -0.31 0.00 0.00 175.10 178.36 1x33 h PRO 229 N 5.67 0.82 0.00 4.82 0.13 -1.86 -3.42 132.00 138.16 1x33 h PRO 229 Ca -0.32 -0.57 0.28 0.00 -0.87 0.00 0.00 66.00 64.51 1x33 h PRO 229 Cb 1.18 0.09 -0.05 0.00 0.13 0.00 0.00 31.00 32.35 1x33 h PRO 229 CO 0.48 1.20 0.77 0.00 -0.23 0.00 0.00 178.00 180.22 1x33 n ALA 230 N -2.58 -3.17 -2.98 -0.56 0.00 -1.26 -4.74 120.51 105.22 1x33 n ALA 230 Ca -0.05 -0.83 -0.10 0.00 0.00 0.00 0.00 53.44 52.45 1x33 n ALA 230 Cb 0.67 0.27 -0.12 0.00 0.00 0.00 0.00 19.45 20.27 1x33 n ALA 230 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1x33 s ARG 231 N -2.02 0.25 -0.24 0.00 1.70 -0.69 -0.67 118.95 117.28 1x33 s ARG 231 Ca 0.27 -0.34 -0.14 0.00 -0.47 0.00 0.00 55.73 55.05 1x33 s ARG 231 Cb -0.01 0.10 -0.04 0.00 -0.57 0.00 0.00 34.95 34.42 1x33 s ARG 231 CO 0.01 -0.05 0.30 -1.17 -1.08 0.00 0.00 175.30 173.32 1x33 s LEU 232 N -0.93 4.10 -0.12 -1.89 2.96 0.72 -1.80 118.68 121.72 1x33 s LEU 232 Ca -0.10 0.29 -0.07 0.00 -0.22 0.00 0.00 54.13 54.03 1x33 s LEU 232 Cb -0.06 -2.34 -0.04 0.00 0.50 0.00 0.00 46.19 44.25 1x33 s LEU 232 CO -0.00 -0.06 0.12 0.54 -1.32 0.00 0.00 176.35 175.63 1x33 s VAL 233 N 1.48 5.35 0.01 1.68 0.11 0.08 -1.07 120.40 128.03 1x33 s VAL 233 Ca 0.14 0.15 0.04 0.00 -2.93 0.00 0.00 61.98 59.38 1x33 s VAL 233 Cb -0.15 -3.33 -0.01 0.00 -1.53 0.00 0.00 36.38 31.36 1x33 s VAL 233 CO 0.08 0.60 -0.13 -0.63 -3.33 0.00 0.00 175.10 171.69 1x33 s ILE 234 N -0.88 1.03 -0.00 7.04 1.01 0.39 -1.89 121.20 127.90 1x33 s ILE 234 Ca 0.14 -0.72 0.01 0.00 0.00 0.00 0.00 60.65 60.07 1x33 s ILE 234 Cb -0.12 -0.89 -0.00 0.00 0.01 0.00 0.00 42.46 41.46 1x33 s ILE 234 CO 0.03 0.16 -0.03 0.00 0.00 0.00 0.00 174.94 175.10 1x33 s ALA 235 N -0.53 0.24 -0.10 9.38 0.00 -0.73 -0.29 121.76 129.73 1x33 s ALA 235 Ca 0.03 -0.13 -0.01 0.00 0.00 0.00 0.00 51.96 51.85 1x33 s ALA 235 Cb -0.06 -0.06 0.03 0.00 0.00 0.00 0.00 23.12 23.03 1x33 s ALA 235 CO 0.00 0.06 -0.01 -0.51 0.00 0.00 0.00 175.76 175.30 1x33 s LEU 236 N -0.08 0.80 0.00 0.00 1.43 -1.05 -0.96 118.68 118.82 1x33 s LEU 236 Ca 0.01 -0.24 0.00 0.00 -1.03 0.00 0.00 54.13 52.87 1x33 s LEU 236 Cb -0.01 -0.54 0.00 0.00 0.03 0.00 0.00 46.19 45.67 1x33 s LEU 236 CO -0.00 -0.20 0.00 0.00 0.23 0.00 0.00 176.35 176.38 1x33 n LEU 237 N 5.09 0.00 -2.80 1.79 -0.00 -1.12 -2.79 117.00 117.17 1x33 n LEU 237 Ca -0.08 0.00 -0.18 0.00 -0.00 0.00 0.00 56.01 55.75 1x33 n LEU 237 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.92 1x33 n LEU 237 CO 0.12 0.00 -0.11 0.47 -0.00 0.00 0.00 177.39 177.87 1x33 n ASP 238 N 0.00 -4.49 -4.91 1.45 8.00 -1.26 -1.91 116.55 113.42 1x33 n ASP 238 Ca 0.00 -0.08 -0.27 0.00 0.71 0.00 0.00 54.79 55.15 1x33 n ASP 238 Cb 0.00 -3.74 0.07 0.00 -0.02 0.00 0.00 41.12 37.44 1x33 n ASP 238 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1x33 s GLY 239 N -2.35 1.64 0.00 0.44 0.00 0.93 -1.79 107.32 106.20 1x33 s GLY 239 Ca 0.17 -0.77 0.23 0.00 0.00 0.00 0.00 44.72 44.34 1x33 s GLY 239 CO 0.20 -0.34 1.18 -1.14 0.00 0.00 0.00 173.10 173.00 1x33 n SER 240 N -3.07 2.63 -1.48 1.64 3.41 -1.25 -4.47 113.62 111.03 1x33 n SER 240 Ca 0.08 -1.82 -0.02 0.00 -0.26 0.00 0.00 58.87 56.85 1x33 n SER 240 Cb 0.60 0.15 -0.01 0.00 -0.26 0.00 0.00 64.21 64.69 1x33 n SER 240 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1x33 n SER 241 N 0.89 0.52 0.00 4.04 2.88 -1.26 -5.00 113.62 115.69 1x33 n SER 241 Ca 0.12 -1.20 0.00 0.00 -1.33 0.00 0.00 58.87 56.46 1x33 n SER 241 Cb 0.54 0.12 0.00 0.00 -0.75 0.00 0.00 64.21 64.12 1x33 n SER 241 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1x33 n SER 242 N -2.38 1.03 -3.97 -3.46 3.41 -1.26 -0.53 113.62 106.46 1x33 n SER 242 Ca -0.00 -1.27 -0.26 0.00 -0.26 0.00 0.00 58.87 57.08 1x33 n SER 242 Cb 0.06 0.00 -0.17 0.00 -0.26 0.00 0.00 64.21 63.84 1x33 n SER 242 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1x33 s THR 243 N -0.27 1.12 0.09 6.66 -1.32 -1.26 -4.82 115.64 115.84 1x33 s THR 243 Ca 0.00 -0.40 -0.07 0.00 -1.21 0.00 0.00 61.69 60.01 1x33 s THR 243 Cb 0.00 -1.08 -0.04 0.00 -1.51 0.00 0.00 72.50 69.87 1x33 s THR 243 CO 0.00 0.37 0.08 0.00 -2.21 0.00 0.00 174.62 172.86 1x33 n ALA 244 N 4.43 -1.67 -3.73 11.08 0.00 -1.26 -4.90 120.51 124.46 1x33 n ALA 244 Ca -0.18 0.07 -0.17 0.00 0.00 0.00 0.00 53.44 53.16 1x33 n ALA 244 Cb 0.51 -0.42 -0.17 0.00 0.00 0.00 0.00 19.45 19.37 1x33 n ALA 244 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1x33 s VAL 245 N -0.38 0.04 -0.27 0.00 1.01 -1.08 -4.92 120.40 114.81 1x33 s VAL 245 Ca 0.17 0.21 -0.39 0.00 0.00 0.00 0.00 61.98 61.98 1x33 s VAL 245 Cb -0.21 -0.19 -0.15 0.00 0.00 0.00 0.00 36.38 35.83 1x33 s VAL 245 CO 0.16 0.14 1.84 0.00 0.00 0.00 0.00 175.10 177.25 1x33 n ALA 246 N 4.49 0.16 -0.04 5.51 0.00 -1.26 -1.94 120.51 127.43 1x33 n ALA 246 Ca -0.20 0.30 -0.07 0.00 0.00 0.00 0.00 53.44 53.47 1x33 n ALA 246 Cb 0.50 -2.31 -0.02 0.00 0.00 0.00 0.00 19.45 17.62 1x33 n ALA 246 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1x33 n ALA 247 N 6.26 1.88 -3.00 0.00 0.00 -0.87 -4.58 120.51 120.20 1x33 n ALA 247 Ca 0.29 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1x33 n ALA 247 Cb 0.16 0.16 0.00 0.00 0.00 0.00 0.00 19.45 19.78 1x33 n ALA 247 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1x33 n GLY 248 N 2.32 0.97 3.10 0.00 0.00 -1.19 -1.47 105.19 108.93 1x33 n GLY 248 Ca -0.12 -0.55 -0.08 0.00 0.00 0.00 0.00 46.02 45.27 1x33 n GLY 248 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1x33 s ARG 249 N 1.16 0.59 -0.23 1.61 0.52 -0.28 -0.98 118.95 121.35 1x33 s ARG 249 Ca 0.00 -0.94 -0.03 0.00 -0.52 0.00 0.00 55.73 54.25 1x33 s ARG 249 Cb 0.00 0.22 0.01 0.00 0.52 0.00 0.00 34.95 35.70 1x33 s ARG 249 CO 0.00 -0.13 -0.06 0.42 0.02 0.00 0.00 175.30 175.55 1x33 s ILE 250 N -3.09 3.05 0.11 1.52 1.01 0.20 -0.50 121.20 123.50 1x33 s ILE 250 Ca -0.01 -0.78 0.04 0.00 0.00 0.00 0.00 60.65 59.89 1x33 s ILE 250 Cb 0.02 -2.46 -0.04 0.00 0.01 0.00 0.00 42.46 39.99 1x33 s ILE 250 CO -0.07 0.32 0.10 -0.31 0.00 0.00 0.00 174.94 174.97 1x33 s TYR 251 N 1.39 3.18 -0.12 3.97 1.51 0.21 -0.78 117.35 126.72 1x33 s TYR 251 Ca 0.03 0.05 0.01 0.00 -1.01 0.00 0.00 57.07 56.15 1x33 s TYR 251 Cb -0.15 -1.59 -0.01 0.00 -0.11 0.00 0.00 41.96 40.10 1x33 s TYR 251 CO -0.05 0.52 -0.15 0.00 -1.11 0.00 0.00 175.55 174.76 1x33 s THR 253 N 0.25 2.97 0.36 0.00 2.01 0.76 -1.85 115.64 120.14 1x33 s THR 253 Ca -0.10 -1.75 0.08 0.00 0.31 0.00 0.00 61.69 60.23 1x33 s THR 253 Cb -0.16 -2.88 -0.06 0.00 0.01 0.00 0.00 72.50 69.41 1x33 s THR 253 CO 0.06 -0.37 0.03 -0.72 -0.69 0.00 0.00 174.62 172.93 1x33 s TYR 254 N 1.16 2.54 -0.16 4.92 -0.85 0.70 -2.22 117.35 123.44 1x33 s TYR 254 Ca 0.01 -0.50 -0.04 0.00 -0.52 0.00 0.00 57.07 56.02 1x33 s TYR 254 Cb -0.21 -1.60 0.08 0.00 0.38 0.00 0.00 41.96 40.61 1x33 s TYR 254 CO -0.03 0.44 0.21 0.99 -1.52 0.00 0.00 175.55 175.63 1x33 s THR 255 N -2.57 -0.32 0.06 -3.49 2.01 -0.63 -0.77 115.64 109.93 1x33 s THR 255 Ca 0.36 0.08 0.04 0.00 0.31 0.00 0.00 61.69 62.48 1x33 s THR 255 Cb 0.02 -0.53 -0.03 0.00 0.01 0.00 0.00 72.50 71.97 1x33 s THR 255 CO 0.19 -0.05 -0.11 -0.51 -0.69 0.00 0.00 174.62 173.45 1x33 s ILE 256 N 2.33 0.89 -0.21 1.82 2.07 -0.68 -1.09 121.20 126.33 1x33 s ILE 256 Ca 0.05 -1.26 -0.05 0.00 -1.41 0.00 0.00 60.65 57.97 1x33 s ILE 256 Cb -0.14 -0.94 -0.02 0.00 0.13 0.00 0.00 42.46 41.49 1x33 s ILE 256 CO -0.10 -0.32 0.00 -1.10 -1.91 0.00 0.00 174.94 171.51 1x33 s GLN 257 N -1.80 3.58 0.00 3.50 -0.21 -0.71 -2.48 119.66 121.54 1x33 s GLN 257 Ca -0.04 -0.53 0.05 0.00 0.02 0.00 0.00 55.36 54.86 1x33 s GLN 257 Cb -0.09 -3.10 -0.03 0.00 1.00 0.00 0.00 33.01 30.79 1x33 s GLN 257 CO 0.01 -0.04 -0.15 -1.64 -2.12 0.00 0.00 175.29 171.34 1x33 s MET 258 N 1.15 2.29 0.25 2.91 -1.94 -0.67 -0.77 119.30 122.53 1x33 s MET 258 Ca 0.03 -0.84 -0.02 0.00 -1.71 0.00 0.00 55.69 53.15 1x33 s MET 258 Cb -0.14 -2.29 -0.03 0.00 2.01 0.00 0.00 34.83 34.38 1x33 s MET 258 CO 0.01 0.58 0.26 0.96 -0.01 0.00 0.00 175.02 176.82 1x33 s ILE 259 N -0.86 0.00 -0.74 2.53 -4.36 -0.65 -2.48 121.20 114.65 1x33 s ILE 259 Ca 0.14 -1.85 -0.04 0.00 -0.26 0.00 0.00 60.65 58.63 1x33 s ILE 259 Cb -0.11 -2.46 0.01 0.00 1.25 0.00 0.00 42.46 41.15 1x33 s ILE 259 CO 0.04 0.00 0.65 -0.62 0.24 0.00 0.00 174.94 175.24 1x33 n GLU 260 N -0.39 -1.55 -0.92 0.37 1.02 -1.26 -1.54 120.64 116.37 1x33 n GLU 260 Ca 0.02 1.19 -0.35 0.00 -0.02 0.00 0.00 57.16 58.01 1x33 n GLU 260 Cb 0.64 -3.85 0.08 0.00 -0.02 0.00 0.00 31.44 28.29 1x33 n GLU 260 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1x33 n PRO 261 N -1.94 -0.12 -3.56 3.49 -0.02 -1.26 -0.15 135.00 131.44 1x33 n PRO 261 Ca -0.15 -0.02 -0.11 0.00 -2.02 0.00 0.00 63.50 61.21 1x33 n PRO 261 Cb 0.60 -1.42 -0.04 0.00 -0.02 0.00 0.00 33.50 32.62 1x33 n PRO 261 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 1x33 s THR 262 N -2.18 0.00 0.18 3.45 -1.32 -0.27 -4.57 115.64 110.93 1x33 s THR 262 Ca 0.49 0.00 -0.32 0.00 -1.21 0.00 0.00 61.69 60.65 1x33 s THR 262 Cb -0.21 -1.00 -0.11 0.00 -1.51 0.00 0.00 72.50 69.67 1x33 s THR 262 CO 0.75 0.00 1.72 0.00 -2.21 0.00 0.00 174.62 174.88 1x33 s ALA 263 N -1.59 3.87 0.54 11.08 0.00 -1.26 -4.37 121.76 130.03 1x33 s ALA 263 Ca -0.01 1.52 0.31 0.00 0.00 0.00 0.00 51.96 53.78 1x33 s ALA 263 Cb -0.01 -3.70 1.47 0.00 0.00 0.00 0.00 23.12 20.89 1x33 s ALA 263 CO -0.00 -0.98 1.90 0.66 0.00 0.00 0.00 175.76 177.34 1x33 h SER 264 N 7.24 0.00 0.22 0.00 4.64 -1.87 -0.83 113.55 122.95 1x33 h SER 264 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 1x33 h SER 264 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1x33 h SER 264 CO 0.95 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.91 1x33 n ALA 265 N -2.69 2.35 0.60 5.18 0.00 -1.26 -3.02 120.51 121.67 1x33 n ALA 265 Ca 0.17 -0.14 0.07 0.00 0.00 0.00 0.00 53.44 53.54 1x33 n ALA 265 Cb 0.92 -1.41 -0.02 0.00 0.00 0.00 0.00 19.45 18.94 1x33 n ALA 265 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1x33 n LEU 266 N -1.14 1.27 -4.66 0.00 4.77 -0.32 -4.98 117.00 111.94 1x33 n LEU 266 Ca 0.16 -0.71 -0.43 0.00 -0.03 0.00 0.00 56.01 55.00 1x33 n LEU 266 Cb 0.14 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.21 1x33 n LEU 266 CO 0.16 0.25 0.88 0.21 -1.33 0.00 0.00 177.39 177.57 1x33 s ASN 267 N -1.80 7.08 0.00 -1.43 3.84 -1.17 -5.05 114.94 116.42 1x33 s ASN 267 Ca 0.10 1.35 0.00 0.00 0.21 0.00 0.00 52.86 54.52 1x33 s ASN 267 Cb 0.11 -2.53 0.00 0.00 -0.55 0.00 0.00 41.25 38.28 1x33 s ASN 267 CO 0.38 -0.63 0.40 0.59 -2.79 0.00 0.00 177.10 175.05