#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1why n SER 75 N 0.00 -3.83 -3.89 1.61 2.88 -1.26 -5.01 113.62 104.12 1why n SER 75 Ca 0.00 -0.29 -0.30 0.00 -1.33 0.00 0.00 58.87 56.95 1why n SER 75 Cb 0.00 -2.88 -0.14 0.00 -0.75 0.00 0.00 64.21 60.44 1why n SER 75 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1why s SER 76 N -3.28 4.33 0.00 -3.46 1.04 -1.26 -5.03 113.70 106.04 1why s SER 76 Ca 0.24 -2.32 0.00 0.00 0.48 0.00 0.00 55.95 54.35 1why s SER 76 Cb -0.11 -1.37 0.00 0.00 0.10 0.00 0.00 66.02 64.64 1why s SER 76 CO 0.38 -0.34 0.00 0.61 0.98 0.00 0.00 173.24 174.88 1why n GLY 77 N 4.00 0.39 3.89 7.32 0.00 -1.26 -4.96 105.19 114.58 1why n GLY 77 Ca 0.04 -1.49 -0.24 0.00 0.00 0.00 0.00 46.02 44.33 1why n GLY 77 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1why s SER 78 N -0.81 4.73 0.04 1.61 1.04 -1.26 -5.11 113.70 113.94 1why s SER 78 Ca 0.00 -1.10 -0.22 0.00 0.48 0.00 0.00 55.95 55.11 1why s SER 78 Cb 0.00 0.11 -0.06 0.00 0.10 0.00 0.00 66.02 66.18 1why s SER 78 CO 0.00 -0.97 0.67 -0.44 0.98 0.00 0.00 173.24 173.48 1why s SER 79 N -4.24 7.11 -0.61 7.02 0.01 -1.26 -4.94 113.70 116.79 1why s SER 79 Ca 0.40 1.33 -0.35 0.00 1.31 0.00 0.00 55.95 58.63 1why s SER 79 Cb -0.02 -2.41 -0.16 0.00 0.21 0.00 0.00 66.02 63.63 1why s SER 79 CO 0.24 0.11 2.37 0.61 0.41 0.00 0.00 173.24 176.98 1why n GLY 80 N 2.23 -0.03 0.05 3.44 0.00 -1.26 -4.82 105.19 104.80 1why n GLY 80 Ca -0.06 1.02 -0.00 0.00 0.00 0.00 0.00 46.02 46.98 1why n GLY 80 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1why h LYS 81 N 12.30 -0.00 -5.97 1.61 1.57 -2.07 -3.43 116.57 120.57 1why h LYS 81 Ca -0.15 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.07 1why h LYS 81 Cb 1.34 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.64 1why h LYS 81 CO 1.17 -0.00 1.47 0.42 -0.57 0.00 0.00 179.45 181.94 1why s ILE 82 N -1.51 3.12 0.00 1.86 1.01 -1.26 -4.87 121.20 119.55 1why s ILE 82 Ca -0.00 0.12 0.00 0.00 0.00 0.00 0.00 60.65 60.77 1why s ILE 82 Cb 0.00 -3.19 0.00 0.00 0.01 0.00 0.00 42.46 39.28 1why s ILE 82 CO 0.00 -0.14 0.00 0.61 0.00 0.00 0.00 174.94 175.41 1why n GLY 83 N 5.74 1.08 3.40 6.18 0.00 -1.26 -5.19 105.19 115.15 1why n GLY 83 Ca 0.29 -0.47 -0.20 0.00 0.00 0.00 0.00 46.02 45.64 1why n GLY 83 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1why s TYR 84 N -2.00 1.76 0.00 1.61 1.51 -1.26 -5.17 117.35 113.80 1why s TYR 84 Ca 0.00 -1.12 0.00 0.00 -1.01 0.00 0.00 57.07 54.94 1why s TYR 84 Cb 0.00 -1.10 0.00 0.00 -0.11 0.00 0.00 41.96 40.75 1why s TYR 84 CO 0.00 -0.20 0.00 0.41 -1.11 0.00 0.00 175.55 174.65 1why n GLY 85 N -0.64 1.11 4.22 0.71 0.00 -1.26 -4.74 105.19 104.59 1why n GLY 85 Ca -0.02 -1.05 -0.31 0.00 0.00 0.00 0.00 46.02 44.65 1why n GLY 85 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1why n LYS 86 N 0.00 -1.81 -3.46 1.61 5.02 -1.26 -4.89 118.16 113.36 1why n LYS 86 Ca 0.00 0.21 -0.41 0.00 -2.02 0.00 0.00 58.31 56.09 1why n LYS 86 Cb 0.00 -4.08 -0.10 0.00 -0.02 0.00 0.00 35.03 30.83 1why n LYS 86 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1why s ALA 87 N -4.08 3.49 0.45 7.82 0.00 -1.26 -5.06 121.76 123.12 1why s ALA 87 Ca 0.12 -1.42 -0.24 0.00 0.00 0.00 0.00 51.96 50.43 1why s ALA 87 Cb -0.07 -2.79 -0.09 0.00 0.00 0.00 0.00 23.12 20.17 1why s ALA 87 CO 0.96 -1.15 1.19 -1.71 0.00 0.00 0.00 175.76 175.06 1why n ASN 88 N 5.23 2.10 -4.63 0.00 2.85 -1.26 -4.88 115.26 114.67 1why n ASN 88 Ca -0.11 1.05 -0.43 0.00 -0.11 0.00 0.00 54.58 54.98 1why n ASN 88 Cb 0.49 -1.46 -0.03 0.00 1.24 0.00 0.00 39.78 40.02 1why n ASN 88 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 1why s PRO 89 N -2.29 3.74 0.15 1.20 0.04 -1.26 -4.63 135.00 131.95 1why s PRO 89 Ca 0.64 1.61 0.08 0.00 0.04 0.00 0.00 61.00 63.37 1why s PRO 89 Cb -0.50 -4.05 -0.04 0.00 0.04 0.00 0.00 34.50 29.95 1why s PRO 89 CO 0.56 -1.36 -0.09 -0.08 0.04 0.00 0.00 177.00 176.07 1why s THR 90 N 5.37 3.31 0.42 1.26 -1.32 -1.26 -5.01 115.64 118.41 1why s THR 90 Ca 0.72 -1.46 0.21 0.00 -1.21 0.00 0.00 61.69 59.94 1why s THR 90 Cb -0.24 -2.60 0.41 0.00 -1.51 0.00 0.00 72.50 68.56 1why s THR 90 CO 0.30 -0.01 1.80 0.71 -2.21 0.00 0.00 174.62 175.21 1why h THR 91 N 2.96 0.55 -3.84 5.08 1.35 -1.85 -3.40 112.91 113.76 1why h THR 91 Ca -0.48 -0.12 -0.48 0.00 -0.55 0.00 0.00 66.41 64.78 1why h THR 91 Cb 1.19 0.18 -0.01 0.00 -1.73 0.00 0.00 68.15 67.77 1why h THR 91 CO 0.53 0.06 0.37 -0.60 -0.25 0.00 0.00 175.52 175.63 1why s ARG 92 N -5.40 4.65 0.03 4.72 3.52 -1.26 -3.31 118.95 121.90 1why s ARG 92 Ca -0.08 1.45 0.03 0.00 -0.13 0.00 0.00 55.73 56.99 1why s ARG 92 Cb 0.24 -2.99 -0.02 0.00 -1.56 0.00 0.00 34.95 30.63 1why s ARG 92 CO 0.79 0.32 -0.08 -0.51 -0.81 0.00 0.00 175.30 175.01 1why s LEU 93 N -1.74 2.16 -0.11 -0.88 1.43 -0.95 -3.54 118.68 115.06 1why s LEU 93 Ca 0.47 -0.39 -0.11 0.00 -1.03 0.00 0.00 54.13 53.07 1why s LEU 93 Cb -0.23 -0.29 -0.05 0.00 0.03 0.00 0.00 46.19 45.65 1why s LEU 93 CO 0.29 -0.07 0.24 0.86 0.23 0.00 0.00 176.35 177.90 1why s TRP 94 N -0.89 3.58 -0.07 0.29 -0.00 0.12 -2.53 118.94 119.44 1why s TRP 94 Ca -0.04 0.64 0.01 0.00 -0.00 0.00 0.00 56.10 56.71 1why s TRP 94 Cb -0.07 -2.15 0.02 0.00 -0.00 0.00 0.00 33.47 31.27 1why s TRP 94 CO 0.00 0.55 -0.09 0.08 -0.00 0.00 0.00 176.95 177.49 1why s VAL 95 N -0.53 0.91 0.16 5.86 1.01 -0.48 -2.17 120.40 125.16 1why s VAL 95 Ca 0.17 -0.32 -0.05 0.00 0.00 0.00 0.00 61.98 61.77 1why s VAL 95 Cb -0.13 -0.88 -0.02 0.00 0.00 0.00 0.00 36.38 35.35 1why s VAL 95 CO 0.06 0.31 0.20 -0.83 0.00 0.00 0.00 175.10 174.84 1why s GLY 96 N 0.93 0.77 0.00 4.51 0.00 -1.12 -0.81 107.32 111.61 1why s GLY 96 Ca -0.10 -1.19 0.00 0.00 0.00 0.00 0.00 44.72 43.43 1why s GLY 96 CO 0.01 -1.08 0.00 0.61 0.00 0.00 0.00 173.10 172.64 1why n GLY 97 N -0.19 0.99 3.97 0.20 0.00 -1.19 -3.65 105.19 105.32 1why n GLY 97 Ca -0.05 -0.22 -0.18 0.00 0.00 0.00 0.00 46.02 45.57 1why n GLY 97 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1why s LEU 98 N -0.31 3.58 0.00 0.99 1.43 -1.25 -4.95 118.68 118.17 1why s LEU 98 Ca 0.00 -0.51 0.05 0.00 -1.03 0.00 0.00 54.13 52.63 1why s LEU 98 Cb 0.00 -2.47 -0.02 0.00 0.03 0.00 0.00 46.19 43.73 1why s LEU 98 CO 0.00 -0.72 0.17 0.61 0.23 0.00 0.00 176.35 176.65 1why n GLY 99 N -1.75 3.33 0.20 -3.19 0.00 -1.26 -4.95 105.19 97.57 1why n GLY 99 Ca 0.06 -1.83 0.06 0.00 0.00 0.00 0.00 46.02 44.32 1why n GLY 99 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1why h PRO 100 N 0.00 0.00 -0.04 1.61 0.13 -2.00 -3.17 132.00 128.53 1why h PRO 100 Ca -0.15 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.88 1why h PRO 100 Cb 0.77 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.90 1why h PRO 100 CO 0.23 0.33 -0.33 -0.91 -0.23 0.00 0.00 178.00 177.08 1why h ASN 101 N 0.00 0.37 -3.83 1.44 4.21 -2.05 -3.45 115.58 112.27 1why h ASN 101 Ca -0.00 -0.69 -0.55 0.00 1.21 0.00 0.00 56.30 56.27 1why h ASN 101 Cb 0.74 -0.11 0.12 0.00 -1.12 0.00 0.00 38.32 37.95 1why h ASN 101 CO 0.04 1.00 0.69 0.41 -1.29 0.00 0.00 177.43 178.28 1why n THR 102 N -4.43 2.35 -4.69 2.81 -1.04 -1.20 -5.01 114.28 103.08 1why n THR 102 Ca -0.09 -0.50 -0.33 0.00 -2.04 0.00 0.00 64.05 61.09 1why n THR 102 Cb 0.52 -1.84 -0.12 0.00 -1.82 0.00 0.00 70.33 67.07 1why n THR 102 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1why s SER 103 N -0.31 4.39 0.13 8.00 0.15 -1.26 -4.80 113.70 120.00 1why s SER 103 Ca 0.57 -0.12 -0.26 0.00 0.70 0.00 0.00 55.95 56.84 1why s SER 103 Cb -0.48 -1.02 -0.04 0.00 -1.71 0.00 0.00 66.02 62.77 1why s SER 103 CO 0.61 0.34 1.63 0.25 1.20 0.00 0.00 173.24 177.27 1why h LEU 104 N 5.12 -0.82 -0.56 3.45 7.12 -1.97 -2.33 115.31 125.33 1why h LEU 104 Ca -0.48 0.11 0.11 0.00 0.13 0.00 0.00 57.88 57.76 1why h LEU 104 Cb 1.16 0.34 -0.11 0.00 -0.53 0.00 0.00 40.66 41.53 1why h LEU 104 CO 0.52 -0.34 -0.14 0.00 -0.13 0.00 0.00 178.44 178.35 1why h ALA 105 N 0.42 0.37 -0.48 1.25 0.00 -1.98 -0.93 119.26 117.91 1why h ALA 105 Ca 0.07 0.22 0.05 0.00 0.00 0.00 0.00 54.91 55.24 1why h ALA 105 Cb 0.50 0.42 -0.06 0.00 0.00 0.00 0.00 17.79 18.65 1why h ALA 105 CO -0.26 -0.43 -0.35 0.00 0.00 0.00 0.00 179.25 178.21 1why h ALA 106 N 1.56 -0.41 0.40 0.00 0.00 -1.84 0.14 119.26 119.10 1why h ALA 106 Ca 0.27 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.22 1why h ALA 106 Cb 0.41 1.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.33 1why h ALA 106 CO -0.57 -0.63 -0.29 -0.07 0.00 0.00 0.00 179.25 177.68 1why h LEU 107 N -0.08 -0.74 -0.96 0.00 3.38 -1.35 -2.29 115.31 113.27 1why h LEU 107 Ca 0.08 0.05 0.18 0.00 0.09 0.00 0.00 57.88 58.28 1why h LEU 107 Cb 0.28 0.23 -0.18 0.00 0.09 0.00 0.00 40.66 41.09 1why h LEU 107 CO -0.49 -0.44 -0.28 0.00 0.09 0.00 0.00 178.44 177.32 1why h ALA 108 N -0.16 0.50 -0.59 1.53 0.00 -0.46 0.58 119.26 120.67 1why h ALA 108 Ca -0.04 0.35 0.01 0.00 0.00 0.00 0.00 54.91 55.22 1why h ALA 108 Cb 0.58 0.80 -0.03 0.00 0.00 0.00 0.00 17.79 19.14 1why h ALA 108 CO 0.01 -0.45 0.39 -0.09 0.00 0.00 0.00 179.25 179.11 1why h ARG 109 N -0.01 0.77 0.87 0.00 9.65 -0.50 -1.29 114.38 123.88 1why h ARG 109 Ca 0.43 -0.05 -0.04 0.00 -1.10 0.00 0.00 59.98 59.22 1why h ARG 109 Cb 0.67 -0.17 0.01 0.00 -1.39 0.00 0.00 29.97 29.09 1why h ARG 109 CO -0.98 0.51 -0.42 0.93 2.80 0.00 0.00 179.97 182.81 1why h GLU 110 N 0.79 -1.13 -0.59 0.20 4.39 0.61 -3.07 114.58 115.78 1why h GLU 110 Ca 0.21 0.08 0.12 0.00 0.34 0.00 0.00 59.36 60.11 1why h GLU 110 Cb -0.09 0.26 -0.11 0.00 -0.10 0.00 0.00 28.75 28.71 1why h GLU 110 CO -0.05 -0.75 -0.11 0.74 -1.16 0.00 0.00 179.01 177.68 1why h PHE 111 N -1.18 -0.25 -0.99 4.33 -1.00 -0.78 0.67 116.94 117.75 1why h PHE 111 Ca -0.12 0.05 0.35 0.00 2.81 0.00 0.00 57.97 61.06 1why h PHE 111 Cb 0.90 0.20 -0.16 0.00 3.61 0.00 0.00 35.95 40.49 1why h PHE 111 CO 0.03 -0.23 0.49 0.22 -1.61 0.00 0.00 178.31 177.20 1why h ASP 112 N 0.03 0.31 -0.79 2.17 1.82 -1.16 0.11 116.42 118.91 1why h ASP 112 Ca 0.29 0.23 0.26 0.00 -0.39 0.00 0.00 57.03 57.42 1why h ASP 112 Cb 0.45 0.23 -0.15 0.00 0.68 0.00 0.00 39.33 40.55 1why h ASP 112 CO -0.59 -0.29 0.17 0.54 -1.61 0.00 0.00 179.24 177.47 1why n ARG 113 N -5.19 -0.06 0.18 0.28 5.12 0.23 -0.46 116.66 116.77 1why n ARG 113 Ca 0.33 1.15 -0.08 0.00 -1.93 0.00 0.00 57.85 57.31 1why n ARG 113 Cb 1.07 -1.91 -0.04 0.00 -1.16 0.00 0.00 32.46 30.43 1why n ARG 113 CO 0.00 0.00 0.00 0.74 -1.93 0.00 0.00 177.63 176.44 1why h PHE 114 N 0.00 -0.50 -3.72 -1.55 0.04 -0.95 -3.49 116.94 106.78 1why h PHE 114 Ca 0.55 -0.01 -0.07 0.00 2.80 0.00 0.00 57.97 61.23 1why h PHE 114 Cb 1.28 0.16 -0.10 0.00 2.20 0.00 0.00 35.95 39.49 1why h PHE 114 CO -0.26 -0.31 -0.17 0.20 -0.60 0.00 0.00 178.31 177.17 1why s GLY 115 N -2.84 0.51 0.26 -1.45 0.00 0.39 -5.00 107.32 99.19 1why s GLY 115 Ca -0.08 -0.86 -0.30 0.00 0.00 0.00 0.00 44.72 43.48 1why s GLY 115 CO 0.24 -0.67 1.44 -0.56 0.00 0.00 0.00 173.10 173.55 1why s SER 116 N -3.00 6.64 -0.17 1.64 0.01 -1.26 -4.08 113.70 113.47 1why s SER 116 Ca 0.21 2.69 -0.09 0.00 1.31 0.00 0.00 55.95 60.07 1why s SER 116 Cb 0.01 -2.63 -0.05 0.00 0.21 0.00 0.00 66.02 63.56 1why s SER 116 CO 0.06 -0.71 0.14 -0.63 0.41 0.00 0.00 173.24 172.51 1why s ILE 117 N -0.07 5.43 -0.08 1.44 1.01 -1.26 -3.13 121.20 124.54 1why s ILE 117 Ca 0.59 0.21 -0.07 0.00 0.00 0.00 0.00 60.65 61.38 1why s ILE 117 Cb -0.42 -3.46 -0.05 0.00 0.01 0.00 0.00 42.46 38.55 1why s ILE 117 CO 0.44 0.49 0.28 -0.09 0.00 0.00 0.00 174.94 176.07 1why h ARG 118 N 6.17 -0.18 -3.28 2.79 1.12 -1.18 -3.49 114.38 116.32 1why h ARG 118 Ca -0.45 0.01 -0.05 0.00 -1.11 0.00 0.00 59.98 58.38 1why h ARG 118 Cb 1.17 0.04 -0.13 0.00 -0.01 0.00 0.00 29.97 31.04 1why h ARG 118 CO 0.71 -0.06 -0.03 -0.08 -3.11 0.00 0.00 179.97 177.40 1why s THR 119 N -2.26 0.06 0.01 0.20 -1.32 -1.26 -5.03 115.64 106.04 1why s THR 119 Ca -0.04 -0.47 0.01 0.00 -1.21 0.00 0.00 61.69 59.98 1why s THR 119 Cb 0.00 -1.12 -0.01 0.00 -1.51 0.00 0.00 72.50 69.87 1why s THR 119 CO 0.13 -0.26 -0.03 -0.63 -2.21 0.00 0.00 174.62 171.62 1why s ILE 120 N -3.64 0.24 -0.16 5.08 1.01 -1.26 -3.08 121.20 119.39 1why s ILE 120 Ca 0.02 -0.32 -0.11 0.00 0.00 0.00 0.00 60.65 60.24 1why s ILE 120 Cb 0.01 -0.24 -0.05 0.00 0.01 0.00 0.00 42.46 42.19 1why s ILE 120 CO -0.11 -0.05 0.19 -1.81 0.00 0.00 0.00 174.94 173.15 1why s ASP 121 N -0.40 6.33 -0.33 3.58 1.11 -1.22 -4.92 116.67 120.83 1why s ASP 121 Ca -0.02 0.39 -0.04 0.00 0.18 0.00 0.00 52.55 53.05 1why s ASP 121 Cb -0.03 -2.12 0.05 0.00 1.07 0.00 0.00 42.92 41.89 1why s ASP 121 CO -0.00 0.21 0.06 -2.28 1.18 0.00 0.00 175.17 174.34 1why s HIS 122 N 0.05 3.29 -0.04 4.23 5.65 -1.26 -4.03 115.29 123.17 1why s HIS 122 Ca 0.12 -1.72 0.05 0.00 0.25 0.00 0.00 55.06 53.77 1why s HIS 122 Cb -0.12 -2.28 -0.01 0.00 -1.18 0.00 0.00 32.58 28.99 1why s HIS 122 CO 0.01 -0.79 -0.20 0.08 -0.65 0.00 0.00 174.74 173.20 1why s VAL 123 N 1.31 1.61 -0.11 0.89 1.01 -1.20 -5.04 120.40 118.88 1why s VAL 123 Ca -0.03 -0.83 -0.07 0.00 0.00 0.00 0.00 61.98 61.06 1why s VAL 123 Cb -0.20 -1.38 -0.02 0.00 0.00 0.00 0.00 36.38 34.78 1why s VAL 123 CO 0.00 0.46 -0.14 0.29 0.00 0.00 0.00 175.10 175.72 1why n LYS 124 N 3.03 0.34 -0.08 2.72 4.76 -1.26 -2.70 118.16 124.97 1why n LYS 124 Ca -0.18 0.45 -0.04 0.00 -2.87 0.00 0.00 58.31 55.68 1why n LYS 124 Cb 0.53 -1.45 -0.03 0.00 -1.84 0.00 0.00 35.03 32.23 1why n LYS 124 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 1why h GLY 125 N -0.75 -1.87 1.93 0.72 0.00 -2.00 -1.15 103.07 99.95 1why h GLY 125 Ca 0.00 0.91 -0.10 0.00 0.00 0.00 0.00 47.33 48.14 1why h GLY 125 CO 0.00 -0.62 -0.42 -0.55 0.00 0.00 0.00 176.54 174.95 1why h ASP 126 N -0.07 0.08 -4.97 0.19 5.19 -1.93 -3.48 116.42 111.43 1why h ASP 126 Ca 0.03 -0.03 -0.25 0.00 -0.62 0.00 0.00 57.03 56.16 1why h ASP 126 Cb 0.16 -0.02 0.14 0.00 0.18 0.00 0.00 39.33 39.79 1why h ASP 126 CO -0.23 0.50 -0.64 -1.20 -3.12 0.00 0.00 179.24 174.54 1why n SER 127 N -4.03 -2.93 -4.31 6.45 7.64 -0.44 -4.83 113.62 111.18 1why n SER 127 Ca -0.02 -0.52 -0.29 0.00 1.01 0.00 0.00 58.87 59.05 1why n SER 127 Cb 0.46 -4.28 -0.07 0.00 -1.01 0.00 0.00 64.21 59.31 1why n SER 127 CO 0.00 0.00 0.00 2.22 -3.01 0.00 0.00 175.04 174.25 1why n PHE 128 N -3.39 0.58 -3.65 1.43 1.16 -1.22 -3.20 117.46 109.17 1why n PHE 128 Ca -0.19 -2.69 -0.02 0.00 -1.87 0.00 0.00 57.45 52.68 1why n PHE 128 Cb 0.63 -0.14 -0.06 0.00 -1.61 0.00 0.00 39.48 38.29 1why n PHE 128 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1why s ALA 129 N -3.06 -2.34 -0.27 1.98 0.00 0.01 -3.26 121.76 114.83 1why s ALA 129 Ca 0.13 2.17 -0.08 0.00 0.00 0.00 0.00 51.96 54.18 1why s ALA 129 Cb 0.01 -1.75 -0.03 0.00 0.00 0.00 0.00 23.12 21.35 1why s ALA 129 CO 0.09 -0.34 0.10 0.71 0.00 0.00 0.00 175.76 176.32 1why s TYR 130 N 1.30 3.13 -0.24 0.00 2.02 -1.26 -1.39 117.35 120.91 1why s TYR 130 Ca -0.09 -0.39 -0.08 0.00 -0.37 0.00 0.00 57.07 56.13 1why s TYR 130 Cb -0.03 -2.28 -0.04 0.00 -0.40 0.00 0.00 41.96 39.21 1why s TYR 130 CO -0.14 -0.36 0.10 0.42 -1.57 0.00 0.00 175.55 174.00 1why s ILE 131 N 1.63 4.71 -0.16 2.71 1.01 -1.05 -3.37 121.20 126.68 1why s ILE 131 Ca 0.06 -0.04 -0.06 0.00 0.00 0.00 0.00 60.65 60.61 1why s ILE 131 Cb -0.16 -3.19 -0.04 0.00 0.01 0.00 0.00 42.46 39.08 1why s ILE 131 CO 0.05 0.35 0.04 -1.58 0.00 0.00 0.00 174.94 173.80 1why s GLN 132 N 1.29 3.74 0.01 2.79 2.00 -1.18 -2.23 119.66 126.08 1why s GLN 132 Ca 0.06 -0.38 0.02 0.00 -2.00 0.00 0.00 55.36 53.06 1why s GLN 132 Cb -0.15 -3.09 -0.04 0.00 0.80 0.00 0.00 33.01 30.54 1why s GLN 132 CO 0.05 0.36 -0.02 0.71 -0.50 0.00 0.00 175.29 175.89 1why s TYR 133 N 0.10 3.01 0.40 1.67 2.02 -1.21 -0.56 117.35 122.79 1why s TYR 133 Ca 0.04 0.03 0.09 0.00 -0.37 0.00 0.00 57.07 56.86 1why s TYR 133 Cb -0.13 -1.63 0.88 0.00 -0.40 0.00 0.00 41.96 40.68 1why s TYR 133 CO 0.01 0.44 2.01 0.93 -1.57 0.00 0.00 175.55 177.37 1why h GLU 134 N 4.27 0.55 -5.60 -0.62 4.39 -1.92 -3.44 114.58 112.21 1why h GLU 134 Ca -0.49 -0.03 -0.62 0.00 0.34 0.00 0.00 59.36 58.56 1why h GLU 134 Cb 1.17 -0.12 -0.13 0.00 -0.10 0.00 0.00 28.75 29.57 1why h GLU 134 CO 0.57 0.37 -0.60 -1.12 -1.16 0.00 0.00 179.01 177.07 1why s SER 135 N -6.43 3.80 -0.13 1.42 0.01 -1.26 -5.09 113.70 106.01 1why s SER 135 Ca -0.08 -1.39 -0.09 0.00 1.31 0.00 0.00 55.95 55.70 1why s SER 135 Cb 0.19 -0.32 -0.06 0.00 0.21 0.00 0.00 66.02 66.03 1why s SER 135 CO 0.75 -0.48 0.02 0.25 0.41 0.00 0.00 173.24 174.18 1why h LEU 136 N 1.77 0.00 -0.94 2.44 6.46 -1.95 -3.32 115.31 119.77 1why h LEU 136 Ca -0.44 -0.15 0.10 0.00 -0.12 0.00 0.00 57.88 57.28 1why h LEU 136 Cb 1.24 0.00 -0.13 0.00 -0.73 0.00 0.00 40.66 41.05 1why h LEU 136 CO 0.80 0.77 -0.49 0.47 -0.62 0.00 0.00 178.44 179.36 1why n ASP 137 N -4.66 -0.87 -0.27 1.25 9.92 -1.26 0.73 116.55 121.39 1why n ASP 137 Ca -0.08 1.67 0.08 0.00 -0.53 0.00 0.00 54.79 55.93 1why n ASP 137 Cb 0.23 -0.27 0.22 0.00 -0.64 0.00 0.00 41.12 40.66 1why n ASP 137 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1why h ALA 138 N 0.74 1.10 -0.20 2.24 0.00 -1.95 -0.91 119.26 120.28 1why h ALA 138 Ca 0.21 0.16 0.05 0.00 0.00 0.00 0.00 54.91 55.33 1why h ALA 138 Cb 0.44 0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.37 1why h ALA 138 CO -0.90 -0.32 -0.13 0.00 0.00 0.00 0.00 179.25 177.89 1why h ALA 139 N 1.63 0.02 -0.11 0.00 0.00 0.21 -2.10 119.26 118.91 1why h ALA 139 Ca 0.46 0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.49 1why h ALA 139 Cb 0.80 0.30 -0.05 0.00 0.00 0.00 0.00 17.79 18.84 1why h ALA 139 CO -0.51 -0.56 -0.17 1.96 0.00 0.00 0.00 179.25 179.97 1why h GLN 140 N -0.13 -0.22 -0.19 0.00 4.20 -0.51 -0.21 115.11 118.06 1why h GLN 140 Ca 0.12 0.01 0.04 0.00 0.06 0.00 0.00 58.65 58.88 1why h GLN 140 Cb 0.30 0.05 -0.07 0.00 0.30 0.00 0.00 27.48 28.06 1why h GLN 140 CO -0.28 -0.14 -0.53 0.00 -0.67 0.00 0.00 178.83 177.21 1why h ALA 141 N 0.80 -0.82 -0.81 3.87 0.00 -1.00 -0.89 119.26 120.40 1why h ALA 141 Ca 0.09 -0.04 0.09 0.00 0.00 0.00 0.00 54.91 55.06 1why h ALA 141 Cb 0.36 1.00 -0.07 0.00 0.00 0.00 0.00 17.79 19.07 1why h ALA 141 CO -0.25 -1.06 0.46 0.00 0.00 0.00 0.00 179.25 178.41 1why h ALA 142 N -0.17 1.16 0.23 0.00 0.00 -1.16 0.87 119.26 120.19 1why h ALA 142 Ca 0.05 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1why h ALA 142 Cb 0.66 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 1why h ALA 142 CO -0.47 0.09 -0.41 0.00 0.00 0.00 0.00 179.25 178.46 1why h ALA 144 N -0.90 -0.98 -0.27 0.00 0.00 -0.99 0.14 119.26 116.27 1why h ALA 144 Ca -0.03 -0.22 0.04 0.00 0.00 0.00 0.00 54.91 54.70 1why h ALA 144 Cb 0.64 0.38 -0.07 0.00 0.00 0.00 0.00 17.79 18.75 1why h ALA 144 CO -0.15 -1.03 -0.49 0.87 0.00 0.00 0.00 179.25 178.45 1why h LYS 145 N -1.02 -0.40 0.03 0.00 6.56 -0.80 -2.27 116.57 118.67 1why h LYS 145 Ca -0.10 0.03 0.02 0.00 -1.06 0.00 0.00 60.65 59.54 1why h LYS 145 Cb 0.76 0.09 -0.03 0.00 -0.57 0.00 0.00 32.23 32.48 1why h LYS 145 CO 0.16 -0.27 -0.19 0.52 -2.06 0.00 0.00 179.45 177.61 1why h MET 146 N -0.42 -0.32 -3.69 3.15 2.86 -0.24 -3.42 114.93 112.85 1why h MET 146 Ca 0.05 0.02 -0.32 0.00 -2.06 0.00 0.00 59.70 57.39 1why h MET 146 Cb 0.56 0.07 -0.08 0.00 0.06 0.00 0.00 31.60 32.22 1why h MET 146 CO -0.48 -0.21 1.39 0.54 1.06 0.00 0.00 176.91 179.21 1why n ARG 147 N -5.32 0.00 -0.40 1.72 1.74 0.49 0.66 116.66 115.55 1why n ARG 147 Ca -0.05 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.03 1why n ARG 147 Cb 0.24 -0.95 0.00 0.00 -1.02 0.00 0.00 32.46 30.73 1why n ARG 147 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1why n GLY 148 N 4.48 0.96 3.76 -0.13 0.00 -0.32 -4.96 105.19 108.99 1why n GLY 148 Ca 0.49 -0.11 -0.41 0.00 0.00 0.00 0.00 46.02 46.00 1why n GLY 148 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1why s PHE 149 N -2.11 3.29 -2.00 1.61 5.36 0.21 -4.78 117.98 119.57 1why s PHE 149 Ca 0.00 1.54 0.07 0.00 -0.96 0.00 0.00 56.93 57.58 1why s PHE 149 Cb 0.00 -3.50 0.44 0.00 -0.34 0.00 0.00 43.02 39.62 1why s PHE 149 CO 0.00 -1.26 0.89 -0.35 -1.46 0.00 0.00 175.22 173.03 1why n PRO 150 N 1.01 0.49 -1.19 10.12 -0.04 -1.26 -3.31 135.00 140.82 1why n PRO 150 Ca -0.00 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.13 1why n PRO 150 Cb 0.43 -1.23 -0.12 0.00 -0.04 0.00 0.00 33.50 32.54 1why n PRO 150 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1why n LEU 151 N -0.73 0.21 0.00 1.53 0.00 -1.25 -4.01 117.00 112.74 1why n LEU 151 Ca 0.05 0.13 0.00 0.00 0.00 0.00 0.00 56.01 56.20 1why n LEU 151 Cb 0.03 -0.73 0.00 0.00 0.00 0.00 0.00 43.42 42.72 1why n LEU 151 CO 0.04 -0.58 0.00 0.61 0.00 0.00 0.00 177.39 177.46 1why n GLY 152 N 5.15 0.82 3.10 -3.96 0.00 -1.26 -4.51 105.19 104.53 1why n GLY 152 Ca 0.52 -1.15 -0.20 0.00 0.00 0.00 0.00 46.02 45.20 1why n GLY 152 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1why n GLY 153 N 0.00 0.07 0.00 -0.02 0.00 -1.26 -4.95 105.19 99.03 1why n GLY 153 Ca 0.00 -1.93 0.07 0.00 0.00 0.00 0.00 46.02 44.17 1why n GLY 153 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1why n PRO 154 N -2.70 0.27 -0.13 1.61 -0.04 -1.26 -3.14 135.00 129.61 1why n PRO 154 Ca 0.13 0.11 -0.26 0.00 -0.04 0.00 0.00 63.50 63.44 1why n PRO 154 Cb 0.47 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.33 1why n PRO 154 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1why n ASP 155 N -1.22 1.87 -4.55 3.54 5.75 -1.26 -4.85 116.55 115.83 1why n ASP 155 Ca 0.08 0.25 -0.37 0.00 -0.01 0.00 0.00 54.79 54.74 1why n ASP 155 Cb 0.10 -0.71 -0.03 0.00 -1.03 0.00 0.00 41.12 39.45 1why n ASP 155 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1why s ARG 156 N -2.48 2.56 -0.03 0.11 1.81 -1.19 -4.95 118.95 114.78 1why s ARG 156 Ca -0.36 0.64 0.07 0.00 -1.72 0.00 0.00 55.73 54.36 1why s ARG 156 Cb 0.13 -4.45 -0.01 0.00 -0.45 0.00 0.00 34.95 30.17 1why s ARG 156 CO 0.47 -2.84 -0.24 1.03 -0.68 0.00 0.00 175.30 173.04 1why s ARG 157 N 7.19 2.16 0.11 3.54 0.52 -1.26 -3.93 118.95 127.28 1why s ARG 157 Ca 0.71 -0.86 -0.31 0.00 -0.52 0.00 0.00 55.73 54.75 1why s ARG 157 Cb -0.13 -1.96 -0.07 0.00 0.52 0.00 0.00 34.95 33.30 1why s ARG 157 CO 0.20 0.45 1.32 -0.51 0.02 0.00 0.00 175.30 176.78 1why s LEU 158 N -0.37 4.38 -0.47 2.53 1.43 -1.21 -4.81 118.68 120.15 1why s LEU 158 Ca 0.04 2.25 -0.14 0.00 -1.03 0.00 0.00 54.13 55.25 1why s LEU 158 Cb -0.11 -3.59 0.08 0.00 0.03 0.00 0.00 46.19 42.61 1why s LEU 158 CO 0.01 -0.58 0.37 -0.13 0.23 0.00 0.00 176.35 176.25 1why s ARG 159 N 0.95 2.86 -0.20 1.70 3.00 -1.24 -1.17 118.95 124.84 1why s ARG 159 Ca 0.62 -1.44 -0.01 0.00 0.00 0.00 0.00 55.73 54.89 1why s ARG 159 Cb -0.35 -4.05 0.01 0.00 0.00 0.00 0.00 34.95 30.56 1why s ARG 159 CO 0.31 -1.05 -0.13 0.08 0.00 0.00 0.00 175.30 174.51 1why s VAL 160 N 1.57 2.63 0.16 3.52 1.01 -1.26 -2.78 120.40 125.25 1why s VAL 160 Ca 0.04 -0.80 0.08 0.00 0.00 0.00 0.00 61.98 61.30 1why s VAL 160 Cb -0.25 -2.18 -0.04 0.00 0.00 0.00 0.00 36.38 33.91 1why s VAL 160 CO 0.05 0.45 -0.18 -1.81 0.00 0.00 0.00 175.10 173.61 1why s ASP 161 N 1.36 2.61 0.01 3.32 1.01 -0.92 -4.70 116.67 119.35 1why s ASP 161 Ca 0.05 -0.86 -0.30 0.00 0.71 0.00 0.00 52.55 52.14 1why s ASP 161 Cb -0.14 -0.15 -0.05 0.00 1.01 0.00 0.00 42.92 43.59 1why s ASP 161 CO -0.08 -0.05 1.32 -0.36 0.21 0.00 0.00 175.17 176.21 1why s PHE 162 N -2.07 3.07 -1.07 4.23 0.08 -1.26 -0.71 117.98 120.25 1why s PHE 162 Ca 0.15 1.00 -0.06 0.00 0.12 0.00 0.00 56.93 58.13 1why s PHE 162 Cb -0.06 -3.57 0.28 0.00 -0.57 0.00 0.00 43.02 39.10 1why s PHE 162 CO 0.06 -2.00 1.17 0.00 -0.10 0.00 0.00 175.22 174.34 1why n ALA 163 N 4.94 4.43 -1.64 5.36 0.00 -1.23 -4.85 120.51 127.52 1why n ALA 163 Ca 0.12 -4.70 -0.41 0.00 0.00 0.00 0.00 53.44 48.44 1why n ALA 163 Cb 0.44 -2.30 0.01 0.00 0.00 0.00 0.00 19.45 17.61 1why n ALA 163 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1why n LYS 164 N 2.22 1.56 -3.12 0.00 4.81 -1.26 -4.80 118.16 117.57 1why n LYS 164 Ca 0.24 0.56 -0.45 0.00 -0.87 0.00 0.00 58.31 57.79 1why n LYS 164 Cb 0.37 -2.15 -0.02 0.00 0.02 0.00 0.00 35.03 33.26 1why n LYS 164 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 1why s SER 165 N -0.65 6.84 0.25 3.14 0.01 -1.26 -5.03 113.70 117.00 1why s SER 165 Ca 0.62 -2.62 -0.04 0.00 1.31 0.00 0.00 55.95 55.23 1why s SER 165 Cb -0.55 -2.31 -0.05 0.00 0.21 0.00 0.00 66.02 63.32 1why s SER 165 CO 0.57 -0.75 0.49 -0.83 0.41 0.00 0.00 173.24 173.13 1why s GLY 166 N 2.71 1.87 0.22 3.44 0.00 -1.26 -5.06 107.32 109.24 1why s GLY 166 Ca 0.29 -0.64 -0.30 0.00 0.00 0.00 0.00 44.72 44.07 1why s GLY 166 CO -0.08 -0.56 1.29 2.56 0.00 0.00 0.00 173.10 176.31 1why s PRO 167 N -3.40 4.41 -0.04 2.90 0.04 -1.26 -5.04 135.00 132.61 1why s PRO 167 Ca 0.42 2.05 -0.00 0.00 0.04 0.00 0.00 61.00 63.50 1why s PRO 167 Cb -0.11 -3.18 0.03 0.00 0.04 0.00 0.00 34.50 31.28 1why s PRO 167 CO 0.29 -0.21 0.01 -1.12 0.04 0.00 0.00 177.00 176.01 1why s SER 168 N 0.16 0.73 -0.15 6.66 0.01 -1.26 -5.14 113.70 114.72 1why s SER 168 Ca 0.55 -0.01 -0.01 0.00 1.31 0.00 0.00 55.95 57.78 1why s SER 168 Cb -0.36 -0.24 -0.02 0.00 0.21 0.00 0.00 66.02 65.61 1why s SER 168 CO 0.40 -0.14 -0.10 -0.55 0.41 0.00 0.00 173.24 173.26 1why s SER 169 N 1.38 4.19 0.00 2.44 0.15 -1.26 -5.34 113.70 115.27 1why s SER 169 Ca -0.05 -0.30 0.00 0.00 0.70 0.00 0.00 55.95 56.30 1why s SER 169 Cb -0.13 -1.66 0.00 0.00 -1.71 0.00 0.00 66.02 62.52 1why s SER 169 CO -0.03 0.14 0.00 0.61 1.20 0.00 0.00 173.24 175.16