#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 -5.18 -4.29 1.61 2.88 -1.26 -5.00 113.62 102.38 1why n SER 75 Ca 0.00 -0.60 -0.17 0.00 -1.33 0.00 0.00 58.87 56.77 1why n SER 75 Cb 0.00 -4.86 -0.10 0.00 -0.75 0.00 0.00 64.21 58.50 1why n SER 75 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1why s SER 76 N -3.55 2.19 0.00 -3.46 0.15 -1.26 -5.14 113.70 102.63 1why s SER 76 Ca 0.47 -0.97 0.00 0.00 0.70 0.00 0.00 55.95 56.15 1why s SER 76 Cb -0.21 -0.08 0.00 0.00 -1.71 0.00 0.00 66.02 64.02 1why s SER 76 CO 0.75 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 175.58 1why n GLY 77 N -0.09 1.77 3.56 9.45 0.00 -1.26 -5.08 105.19 113.53 1why n GLY 77 Ca -0.11 -0.60 -0.36 0.00 0.00 0.00 0.00 46.02 44.96 1why n GLY 77 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1why s SER 78 N 2.00 5.74 0.08 1.61 0.01 -1.26 -4.85 113.70 117.04 1why s SER 78 Ca 0.00 -0.64 -0.29 0.00 1.31 0.00 0.00 55.95 56.33 1why s SER 78 Cb 0.00 -2.56 -0.17 0.00 0.21 0.00 0.00 66.02 63.50 1why s SER 78 CO 0.00 -2.15 1.67 0.77 0.41 0.00 0.00 173.24 173.94 1why h SER 79 N 11.42 -0.48 0.00 2.44 4.64 -2.03 -3.45 113.55 126.09 1why h SER 79 Ca -0.02 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1why h SER 79 Cb 1.05 0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1why h SER 79 CO 1.29 -0.34 0.00 0.61 -0.87 0.00 0.00 176.83 177.52 1why n GLY 80 N -1.33 0.52 3.43 -0.77 0.00 -1.26 -4.91 105.19 100.86 1why n GLY 80 Ca -0.11 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.70 1why n GLY 80 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1why n LYS 81 N 0.00 -7.26 -3.96 1.61 4.81 -1.26 -5.00 118.16 107.10 1why n LYS 81 Ca 0.00 0.78 -0.26 0.00 -0.87 0.00 0.00 58.31 57.96 1why n LYS 81 Cb 0.00 -5.67 -0.17 0.00 0.02 0.00 0.00 35.03 29.22 1why n LYS 81 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 1why s ILE 82 N -3.31 1.01 0.00 3.15 1.01 -1.26 -4.98 121.20 116.82 1why s ILE 82 Ca 0.45 -0.29 0.00 0.00 0.00 0.00 0.00 60.65 60.82 1why s ILE 82 Cb -0.20 -1.02 0.00 0.00 0.01 0.00 0.00 42.46 41.25 1why s ILE 82 CO 0.68 0.36 0.00 0.61 0.00 0.00 0.00 174.94 176.59 1why n GLY 83 N 4.85 -1.48 3.07 6.18 0.00 -1.26 -5.18 105.19 111.36 1why n GLY 83 Ca -0.13 0.53 -0.07 0.00 0.00 0.00 0.00 46.02 46.35 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 0.00 0.46 0.00 1.61 1.51 -1.26 -5.13 117.35 114.54 1why s TYR 84 Ca 0.00 -0.95 0.00 0.00 -1.01 0.00 0.00 57.07 55.11 1why s TYR 84 Cb 0.00 -0.34 0.00 0.00 -0.11 0.00 0.00 41.96 41.51 1why s TYR 84 CO 0.00 -0.35 0.00 0.41 -1.11 0.00 0.00 175.55 174.50 1why n GLY 85 N 0.40 2.16 3.77 0.71 0.00 -1.26 -5.13 105.19 105.84 1why n GLY 85 Ca -0.16 -0.32 -0.31 0.00 0.00 0.00 0.00 46.02 45.22 1why n GLY 85 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1why s LYS 86 N 1.18 2.46 -0.22 1.61 2.20 -1.26 -5.07 119.74 120.64 1why s LYS 86 Ca 0.00 1.20 -0.19 0.00 -0.36 0.00 0.00 55.97 56.62 1why s LYS 86 Cb 0.00 -1.92 0.06 0.00 -1.51 0.00 0.00 37.83 34.46 1why s LYS 86 CO 0.00 -1.49 0.59 0.00 -0.36 0.00 0.00 175.35 174.09 1why s ALA 87 N -2.78 -1.48 0.40 3.13 0.00 -1.26 -5.15 121.76 114.61 1why s ALA 87 Ca 0.62 1.76 -0.25 0.00 0.00 0.00 0.00 51.96 54.08 1why s ALA 87 Cb -0.18 -1.03 -0.08 0.00 0.00 0.00 0.00 23.12 21.83 1why s ALA 87 CO 0.52 -0.29 1.17 -0.80 0.00 0.00 0.00 175.76 176.36 1why s ASN 88 N 0.60 6.53 0.44 0.00 -0.87 -1.26 -4.98 114.94 115.40 1why s ASN 88 Ca -0.02 2.35 -0.24 0.00 -1.57 0.00 0.00 52.86 53.38 1why s ASN 88 Cb -0.05 -2.61 -0.08 0.00 -0.02 0.00 0.00 41.25 38.49 1why s ASN 88 CO -0.03 -0.67 1.17 -2.16 -2.57 0.00 0.00 177.10 172.84 1why s PRO 89 N -2.29 3.86 -0.00 -0.60 0.04 -1.26 -4.84 135.00 129.91 1why s PRO 89 Ca 0.57 1.82 -0.16 0.00 0.04 0.00 0.00 61.00 63.26 1why s PRO 89 Cb -0.31 -2.51 0.03 0.00 0.04 0.00 0.00 34.50 31.75 1why s PRO 89 CO 0.39 -0.48 0.34 -0.08 0.04 0.00 0.00 177.00 177.21 1why s THR 90 N -1.49 0.06 0.50 1.26 -1.32 -1.26 -5.02 115.64 108.37 1why s THR 90 Ca 0.61 -0.48 0.31 0.00 -1.21 0.00 0.00 61.69 60.92 1why s THR 90 Cb -0.30 -0.72 0.50 0.00 -1.51 0.00 0.00 72.50 70.47 1why s THR 90 CO 0.37 -0.26 1.81 0.71 -2.21 0.00 0.00 174.62 175.03 1why h THR 91 N 3.64 0.46 -3.61 5.08 1.35 -1.85 -3.40 112.91 114.58 1why h THR 91 Ca -0.30 -0.04 -0.51 0.00 -0.55 0.00 0.00 66.41 65.01 1why h THR 91 Cb 1.18 0.35 -0.03 0.00 -1.73 0.00 0.00 68.15 67.92 1why h THR 91 CO 0.41 0.02 0.24 -0.60 -0.25 0.00 0.00 175.52 175.34 1why s ARG 92 N -5.09 4.65 -0.02 4.72 3.52 -1.26 -2.77 118.95 122.69 1why s ARG 92 Ca -0.06 1.26 0.02 0.00 -0.13 0.00 0.00 55.73 56.82 1why s ARG 92 Cb 0.23 -3.24 0.00 0.00 -1.56 0.00 0.00 34.95 30.39 1why s ARG 92 CO 0.80 0.54 -0.08 -0.51 -0.81 0.00 0.00 175.30 175.24 1why s LEU 93 N -1.22 1.80 -0.25 -0.88 1.43 -0.05 -2.52 118.68 117.00 1why s LEU 93 Ca 0.38 -0.16 -0.18 0.00 -1.03 0.00 0.00 54.13 53.13 1why s LEU 93 Cb -0.24 -0.49 -0.03 0.00 0.03 0.00 0.00 46.19 45.47 1why s LEU 93 CO 0.28 0.06 0.54 0.86 0.23 0.00 0.00 176.35 178.31 1why s TRP 94 N 0.17 3.29 -0.19 0.29 -0.00 -0.87 -1.35 118.94 120.27 1why s TRP 94 Ca -0.02 0.69 0.01 0.00 -0.00 0.00 0.00 56.10 56.78 1why s TRP 94 Cb -0.08 -2.73 0.03 0.00 -0.00 0.00 0.00 33.47 30.69 1why s TRP 94 CO 0.00 -0.26 -0.17 0.08 -0.00 0.00 0.00 176.95 176.60 1why s VAL 95 N 2.22 2.03 0.00 5.86 1.01 0.99 -2.23 120.40 130.28 1why s VAL 95 Ca 0.23 -1.06 0.00 0.00 0.00 0.00 0.00 61.98 61.15 1why s VAL 95 Cb -0.16 -1.91 0.00 0.00 0.00 0.00 0.00 36.38 34.31 1why s VAL 95 CO 0.09 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.21 1why n GLY 96 N 4.60 4.32 2.28 4.51 0.00 -0.93 -0.17 105.19 119.79 1why n GLY 96 Ca -0.19 -2.10 -0.09 0.00 0.00 0.00 0.00 46.02 43.63 1why n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1why n GLY 97 N 4.12 0.38 3.96 -0.02 0.00 -1.26 -3.66 105.19 108.71 1why n GLY 97 Ca 0.00 -0.34 -0.22 0.00 0.00 0.00 0.00 46.02 45.46 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 -3.32 3.53 0.00 0.99 1.43 -1.26 -4.92 118.68 115.14 1why s LEU 98 Ca 0.21 0.18 0.02 0.00 -1.03 0.00 0.00 54.13 53.50 1why s LEU 98 Cb -0.09 -3.06 -0.01 0.00 0.03 0.00 0.00 46.19 43.06 1why s LEU 98 CO 0.26 -0.84 0.13 0.61 0.23 0.00 0.00 176.35 176.74 1why n GLY 99 N -2.15 3.37 0.23 -3.19 0.00 -1.26 -5.05 105.19 97.13 1why n GLY 99 Ca 0.03 -1.66 -0.13 0.00 0.00 0.00 0.00 46.02 44.26 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 0.76 -0.48 1.61 0.13 -2.03 -3.22 132.00 128.77 1why h PRO 100 Ca -0.09 -0.40 -0.03 0.00 -0.87 0.00 0.00 66.00 64.61 1why h PRO 100 Cb 0.44 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.56 1why h PRO 100 CO 0.13 1.02 0.19 -0.91 -0.23 0.00 0.00 178.00 178.20 1why h ASN 101 N 0.53 0.67 -2.19 1.44 2.35 -2.04 -3.44 115.58 112.89 1why h ASN 101 Ca 0.05 -0.17 -0.61 0.00 -0.55 0.00 0.00 56.30 55.02 1why h ASN 101 Cb 0.88 -0.17 0.15 0.00 0.05 0.00 0.00 38.32 39.22 1why h ASN 101 CO 0.08 0.66 -0.47 0.41 -1.65 0.00 0.00 177.43 176.45 1why n THR 102 N -4.57 1.62 -4.37 2.81 -1.04 -1.22 -4.99 114.28 102.53 1why n THR 102 Ca 0.01 -0.50 -0.23 0.00 -2.04 0.00 0.00 64.05 61.29 1why n THR 102 Cb 0.16 -0.45 -0.13 0.00 -1.82 0.00 0.00 70.33 68.08 1why n THR 102 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1why s SER 103 N -0.95 2.27 0.07 8.00 0.01 -1.26 -4.90 113.70 116.93 1why s SER 103 Ca 0.63 -0.60 -0.23 0.00 1.31 0.00 0.00 55.95 57.05 1why s SER 103 Cb -0.62 -0.14 -0.10 0.00 0.21 0.00 0.00 66.02 65.37 1why s SER 103 CO 0.59 0.06 1.37 0.25 0.41 0.00 0.00 173.24 175.92 1why h LEU 104 N 4.44 -1.04 -0.55 2.44 7.12 -1.99 -2.58 115.31 123.15 1why h LEU 104 Ca -0.43 0.10 0.11 0.00 0.13 0.00 0.00 57.88 57.79 1why h LEU 104 Cb 1.18 0.38 -0.11 0.00 -0.53 0.00 0.00 40.66 41.57 1why h LEU 104 CO 0.41 -0.39 -0.24 0.00 -0.13 0.00 0.00 178.44 178.10 1why h ALA 105 N -0.94 0.16 -0.93 1.25 0.00 -1.97 -0.24 119.26 116.57 1why h ALA 105 Ca -0.01 0.19 0.09 0.00 0.00 0.00 0.00 54.91 55.17 1why h ALA 105 Cb 0.52 0.59 -0.12 0.00 0.00 0.00 0.00 17.79 18.79 1why h ALA 105 CO -0.16 -0.56 -0.58 0.00 0.00 0.00 0.00 179.25 177.95 1why h ALA 106 N 1.26 -0.55 0.50 0.00 0.00 -1.90 0.64 119.26 119.20 1why h ALA 106 Ca 0.25 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.25 1why h ALA 106 Cb 0.50 1.34 0.00 0.00 0.00 0.00 0.00 17.79 19.63 1why h ALA 106 CO -0.61 -0.97 -0.24 -0.07 0.00 0.00 0.00 179.25 177.36 1why h LEU 107 N -0.04 -0.57 -0.02 0.00 3.38 -0.99 -3.05 115.31 114.02 1why h LEU 107 Ca 0.16 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1why h LEU 107 Cb 0.44 0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1why h LEU 107 CO -0.90 -0.31 -0.06 0.00 0.09 0.00 0.00 178.44 177.25 1why h ALA 108 N -0.36 -0.47 -0.73 1.53 0.00 -0.13 -0.20 119.26 118.91 1why h ALA 108 Ca -0.07 -0.01 0.29 0.00 0.00 0.00 0.00 54.91 55.12 1why h ALA 108 Cb 0.57 0.63 -0.13 0.00 0.00 0.00 0.00 17.79 18.86 1why h ALA 108 CO 0.11 -0.49 0.33 -2.13 0.00 0.00 0.00 179.25 177.07 1why n ARG 109 N -2.90 -0.05 0.24 0.00 3.00 0.21 0.38 116.66 117.54 1why n ARG 109 Ca -0.01 1.02 -0.11 0.00 -0.00 0.00 0.00 57.85 58.75 1why n ARG 109 Cb 0.04 -1.79 -0.06 0.00 0.00 0.00 0.00 32.46 30.66 1why n ARG 109 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 1why h GLU 110 N 0.00 -0.63 0.06 -0.14 4.39 -1.07 -3.19 114.58 114.00 1why h GLU 110 Ca 0.59 0.04 0.03 0.00 0.34 0.00 0.00 59.36 60.35 1why h GLU 110 Cb 1.51 0.14 -0.04 0.00 -0.10 0.00 0.00 28.75 30.26 1why h GLU 110 CO -0.58 -0.37 -0.28 0.74 -1.16 0.00 0.00 179.01 177.36 1why h PHE 111 N -1.12 -0.75 -0.95 4.33 0.04 0.16 -1.80 116.94 116.85 1why h PHE 111 Ca -0.07 0.02 0.38 0.00 2.80 0.00 0.00 57.97 61.10 1why h PHE 111 Cb 0.55 0.32 -0.17 0.00 2.20 0.00 0.00 35.95 38.85 1why h PHE 111 CO 0.01 -0.37 0.43 -3.47 -0.60 0.00 0.00 178.31 174.30 1why n ASP 112 N -5.39 0.26 -0.10 2.17 -0.08 0.11 -1.46 116.55 112.06 1why n ASP 112 Ca -0.06 1.59 -0.03 0.00 -1.51 0.00 0.00 54.79 54.79 1why n ASP 112 Cb 0.30 -0.74 -0.02 0.00 2.34 0.00 0.00 41.12 42.99 1why n ASP 112 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1why n ARG 113 N -5.20 -0.11 -0.14 -0.67 1.74 -0.68 0.08 116.66 111.68 1why n ARG 113 Ca 0.34 0.85 -0.06 0.00 -0.77 0.00 0.00 57.85 58.22 1why n ARG 113 Cb 1.15 -1.27 0.01 0.00 -1.02 0.00 0.00 32.46 31.33 1why n ARG 113 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 1why h PHE 114 N 0.00 -0.66 -3.02 -1.55 0.04 -1.43 -3.45 116.94 106.87 1why h PHE 114 Ca 0.04 0.05 0.03 0.00 2.80 0.00 0.00 57.97 60.89 1why h PHE 114 Cb 0.10 0.36 -0.08 0.00 2.20 0.00 0.00 35.95 38.53 1why h PHE 114 CO -0.70 -0.33 0.21 0.20 -0.60 0.00 0.00 178.31 177.09 1why s GLY 115 N -3.06 -0.29 0.09 -1.45 0.00 0.11 -4.94 107.32 97.77 1why s GLY 115 Ca -0.14 0.01 -0.31 0.00 0.00 0.00 0.00 44.72 44.27 1why s GLY 115 CO 0.70 -0.01 1.66 -0.56 0.00 0.00 0.00 173.10 174.89 1why s SER 116 N -2.85 6.58 -0.20 1.64 0.01 -1.25 -4.00 113.70 113.63 1why s SER 116 Ca 0.07 2.53 -0.24 0.00 1.31 0.00 0.00 55.95 59.63 1why s SER 116 Cb -0.04 -2.57 -0.01 0.00 0.21 0.00 0.00 66.02 63.61 1why s SER 116 CO -0.01 -0.89 0.77 -0.63 0.41 0.00 0.00 173.24 172.88 1why s ILE 117 N 2.46 4.91 0.03 1.44 1.01 -1.26 -2.69 121.20 127.09 1why s ILE 117 Ca 0.74 1.47 -0.30 0.00 0.00 0.00 0.00 60.65 62.57 1why s ILE 117 Cb -0.41 -4.07 -0.17 0.00 0.01 0.00 0.00 42.46 37.82 1why s ILE 117 CO 0.33 0.02 1.25 -0.09 0.00 0.00 0.00 174.94 176.44 1why h ARG 118 N 7.51 -1.01 -2.78 2.79 2.43 -0.87 -3.48 114.38 118.99 1why h ARG 118 Ca -0.28 0.07 -0.04 0.00 -0.81 0.00 0.00 59.98 58.92 1why h ARG 118 Cb 1.12 0.23 -0.15 0.00 -0.42 0.00 0.00 29.97 30.75 1why h ARG 118 CO 0.83 -0.66 0.13 -0.08 -1.51 0.00 0.00 179.97 178.67 1why s THR 119 N -5.07 0.02 -0.02 0.20 -1.32 -1.26 -5.05 115.64 103.14 1why s THR 119 Ca -0.16 -0.13 0.01 0.00 -1.21 0.00 0.00 61.69 60.20 1why s THR 119 Cb 0.02 -1.01 0.02 0.00 -1.51 0.00 0.00 72.50 70.02 1why s THR 119 CO 0.48 -0.07 -0.02 -0.63 -2.21 0.00 0.00 174.62 172.17 1why s ILE 120 N -2.87 0.24 -0.19 5.08 1.01 -1.26 -3.26 121.20 119.95 1why s ILE 120 Ca -0.03 -0.02 -0.06 0.00 0.00 0.00 0.00 60.65 60.54 1why s ILE 120 Cb -0.00 -0.28 -0.03 0.00 0.01 0.00 0.00 42.46 42.15 1why s ILE 120 CO -0.05 0.12 0.03 -0.62 0.00 0.00 0.00 174.94 174.42 1why s ASP 121 N 0.59 5.14 0.07 3.58 -1.08 -1.22 -4.95 116.67 118.81 1why s ASP 121 Ca -0.06 -0.09 0.06 0.00 -0.52 0.00 0.00 52.55 51.94 1why s ASP 121 Cb -0.09 -1.88 -0.04 0.00 -1.46 0.00 0.00 42.92 39.45 1why s ASP 121 CO -0.01 0.11 -0.09 -2.28 0.52 0.00 0.00 175.17 173.42 1why s HIS 122 N 0.77 2.79 0.03 -5.34 5.65 -1.26 -2.95 115.29 114.97 1why s HIS 122 Ca 0.01 -0.12 0.01 0.00 0.25 0.00 0.00 55.06 55.21 1why s HIS 122 Cb -0.14 -1.49 -0.02 0.00 -1.18 0.00 0.00 32.58 29.75 1why s HIS 122 CO 0.02 0.40 -0.05 0.08 -0.65 0.00 0.00 174.74 174.54 1why s VAL 123 N -1.15 0.31 -0.10 0.89 1.01 -1.20 -4.99 120.40 115.17 1why s VAL 123 Ca 0.20 -1.08 -0.07 0.00 0.00 0.00 0.00 61.98 61.04 1why s VAL 123 Cb -0.11 -0.54 -0.02 0.00 0.00 0.00 0.00 36.38 35.71 1why s VAL 123 CO 0.12 -0.50 -0.13 0.29 0.00 0.00 0.00 175.10 174.88 1why n LYS 124 N 1.38 0.33 0.19 2.72 5.02 -1.26 -2.78 118.16 123.76 1why n LYS 124 Ca -0.22 0.44 -0.16 0.00 -2.02 0.00 0.00 58.31 56.35 1why n LYS 124 Cb 0.55 -1.43 -0.09 0.00 -0.02 0.00 0.00 35.03 34.05 1why n LYS 124 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1why h GLY 125 N -0.72 -1.20 1.69 0.72 0.00 -2.01 -2.66 103.07 98.89 1why h GLY 125 Ca 0.00 0.59 -0.09 0.00 0.00 0.00 0.00 47.33 47.83 1why h GLY 125 CO 0.00 -0.33 -0.30 -0.55 0.00 0.00 0.00 176.54 175.36 1why h ASP 126 N -0.80 0.36 -5.77 0.19 3.32 -2.01 -3.47 116.42 108.24 1why h ASP 126 Ca -0.04 -0.13 -0.36 0.00 0.02 0.00 0.00 57.03 56.53 1why h ASP 126 Cb 0.74 -0.10 0.14 0.00 0.22 0.00 0.00 39.33 40.33 1why h ASP 126 CO -0.14 0.65 -0.75 -1.54 -1.72 0.00 0.00 179.24 175.74 1why n SER 127 N -4.11 -3.09 -4.74 6.45 3.41 -1.00 -4.99 113.62 105.54 1why n SER 127 Ca -0.01 -0.63 -0.25 0.00 -0.26 0.00 0.00 58.87 57.72 1why n SER 127 Cb 0.41 -4.95 -0.07 0.00 -0.26 0.00 0.00 64.21 59.35 1why n SER 127 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1why s PHE 128 N -3.38 2.52 -0.11 7.33 -0.12 -1.25 -4.20 117.98 118.76 1why s PHE 128 Ca 0.17 -0.62 -0.07 0.00 -0.05 0.00 0.00 56.93 56.36 1why s PHE 128 Cb -0.07 -1.94 0.05 0.00 -0.63 0.00 0.00 43.02 40.42 1why s PHE 128 CO 0.74 0.16 0.28 0.00 -0.05 0.00 0.00 175.22 176.35 1why s ALA 129 N -2.63 -0.66 -0.21 1.99 0.00 0.76 -3.23 121.76 117.79 1why s ALA 129 Ca 0.39 1.05 -0.04 0.00 0.00 0.00 0.00 51.96 53.37 1why s ALA 129 Cb 0.04 -0.65 -0.01 0.00 0.00 0.00 0.00 23.12 22.49 1why s ALA 129 CO 0.22 -0.20 -0.05 0.71 0.00 0.00 0.00 175.76 176.44 1why s TYR 130 N 1.11 2.95 -0.17 0.00 2.02 -1.15 -0.01 117.35 122.10 1why s TYR 130 Ca -0.08 -0.84 -0.07 0.00 -0.37 0.00 0.00 57.07 55.71 1why s TYR 130 Cb -0.09 -2.07 -0.04 0.00 -0.40 0.00 0.00 41.96 39.36 1why s TYR 130 CO -0.08 -0.47 0.07 0.42 -1.57 0.00 0.00 175.55 173.92 1why s ILE 131 N 1.28 4.85 -0.20 2.71 -1.09 -0.46 -3.38 121.20 124.90 1why s ILE 131 Ca 0.03 -0.02 0.01 0.00 -2.23 0.00 0.00 60.65 58.45 1why s ILE 131 Cb -0.14 -3.16 0.03 0.00 -1.58 0.00 0.00 42.46 37.61 1why s ILE 131 CO -0.02 0.49 -0.15 -1.58 -1.23 0.00 0.00 174.94 172.46 1why s GLN 132 N 0.10 2.49 -0.08 2.79 2.00 -1.20 -0.87 119.66 124.89 1why s GLN 132 Ca 0.05 -0.91 -0.08 0.00 -2.00 0.00 0.00 55.36 52.42 1why s GLN 132 Cb -0.12 -2.53 -0.04 0.00 0.80 0.00 0.00 33.01 31.11 1why s GLN 132 CO 0.01 -0.35 0.21 0.71 -0.50 0.00 0.00 175.29 175.37 1why s TYR 133 N 1.30 3.62 0.43 1.67 2.02 -1.11 -0.13 117.35 125.16 1why s TYR 133 Ca 0.00 0.63 0.17 0.00 -0.37 0.00 0.00 57.07 57.50 1why s TYR 133 Cb -0.15 -2.02 1.09 0.00 -0.40 0.00 0.00 41.96 40.48 1why s TYR 133 CO -0.10 0.70 1.92 0.93 -1.57 0.00 0.00 175.55 177.43 1why h GLU 134 N 4.79 0.37 -6.03 -0.62 4.39 -1.87 -3.42 114.58 112.19 1why h GLU 134 Ca -0.54 -0.02 -0.61 0.00 0.34 0.00 0.00 59.36 58.53 1why h GLU 134 Cb 1.22 -0.08 -0.14 0.00 -0.10 0.00 0.00 28.75 29.65 1why h GLU 134 CO 0.60 0.24 -0.71 -1.54 -1.16 0.00 0.00 179.01 176.44 1why s SER 135 N -5.92 3.66 -0.02 1.42 1.04 -1.26 -5.06 113.70 107.55 1why s SER 135 Ca -0.08 -1.14 -0.23 0.00 0.48 0.00 0.00 55.95 54.99 1why s SER 135 Cb 0.21 -0.33 -0.21 0.00 0.10 0.00 0.00 66.02 65.79 1why s SER 135 CO 0.77 -0.12 1.12 0.25 0.98 0.00 0.00 173.24 176.24 1why h LEU 136 N 2.12 0.31 -0.09 2.42 6.46 -1.95 -3.24 115.31 121.33 1why h LEU 136 Ca -0.41 -0.69 0.04 0.00 -0.12 0.00 0.00 57.88 56.69 1why h LEU 136 Cb 1.25 -0.09 -0.05 0.00 -0.73 0.00 0.00 40.66 41.04 1why h LEU 136 CO 0.67 0.95 -0.20 -0.78 -0.62 0.00 0.00 178.44 178.46 1why h ASP 137 N -0.32 -0.60 -1.07 1.25 3.58 -1.97 -0.87 116.42 116.42 1why h ASP 137 Ca -0.03 0.10 0.29 0.00 0.42 0.00 0.00 57.03 57.81 1why h ASP 137 Cb 0.97 0.27 -0.09 0.00 1.72 0.00 0.00 39.33 42.19 1why h ASP 137 CO 0.06 -0.25 0.69 0.00 -2.88 0.00 0.00 179.24 176.86 1why h ALA 138 N 0.71 2.33 -0.20 -0.78 0.00 -1.93 0.28 119.26 119.67 1why h ALA 138 Ca 0.09 0.06 -0.19 0.00 0.00 0.00 0.00 54.91 54.87 1why h ALA 138 Cb 0.39 0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.24 1why h ALA 138 CO -0.25 -0.75 -0.62 0.00 0.00 0.00 0.00 179.25 177.63 1why h ALA 139 N 1.61 0.34 -0.40 0.00 0.00 -1.22 -2.89 119.26 116.70 1why h ALA 139 Ca 0.61 -0.54 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1why h ALA 139 Cb 1.64 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.38 1why h ALA 139 CO -0.29 0.61 -0.14 1.96 0.00 0.00 0.00 179.25 181.39 1why h GLN 140 N 0.50 0.73 0.09 0.00 4.20 0.32 0.15 115.11 121.10 1why h GLN 140 Ca -0.02 -0.25 -0.00 0.00 0.06 0.00 0.00 58.65 58.44 1why h GLN 140 Cb 1.24 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.96 1why h GLN 140 CO 0.13 0.83 -0.04 0.00 -0.67 0.00 0.00 178.83 179.08 1why h ALA 141 N 1.19 -0.12 0.06 3.87 0.00 -0.85 -2.97 119.26 120.43 1why h ALA 141 Ca 0.11 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1why h ALA 141 Cb 0.61 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1why h ALA 141 CO 0.04 -0.51 -0.03 0.00 0.00 0.00 0.00 179.25 178.75 1why h ALA 142 N 0.66 -0.08 -0.88 0.00 0.00 -1.46 -2.76 119.26 114.74 1why h ALA 142 Ca -0.01 -0.25 0.28 0.00 0.00 0.00 0.00 54.91 54.93 1why h ALA 142 Cb 0.20 0.03 -0.16 0.00 0.00 0.00 0.00 17.79 17.86 1why h ALA 142 CO 0.02 -0.28 0.16 0.00 0.00 0.00 0.00 179.25 179.15 1why h ALA 144 N 1.76 -0.31 -0.64 0.00 0.00 -1.54 -2.88 119.26 115.66 1why h ALA 144 Ca 0.60 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.56 1why h ALA 144 Cb 1.38 0.04 -0.10 0.00 0.00 0.00 0.00 17.79 19.11 1why h ALA 144 CO -0.78 -0.30 -0.54 0.87 0.00 0.00 0.00 179.25 178.50 1why h LYS 145 N -0.31 -0.22 -0.69 0.00 6.56 -1.01 0.68 116.57 121.58 1why h LYS 145 Ca -0.01 0.02 0.15 0.00 -1.06 0.00 0.00 60.65 59.74 1why h LYS 145 Cb 0.08 0.05 -0.12 0.00 -0.57 0.00 0.00 32.23 31.67 1why h LYS 145 CO 0.02 -0.15 -0.00 0.52 -2.06 0.00 0.00 179.45 177.78 1why h MET 146 N -0.23 0.11 -5.28 3.15 2.86 -0.08 -3.41 114.93 112.04 1why h MET 146 Ca 0.13 -0.01 -0.64 0.00 -2.06 0.00 0.00 59.70 57.12 1why h MET 146 Cb 0.54 -0.02 -0.05 0.00 0.06 0.00 0.00 31.60 32.12 1why h MET 146 CO -0.73 0.07 1.33 -2.13 1.06 0.00 0.00 176.91 176.51 1why n ARG 147 N -5.32 0.00 -1.91 1.72 0.63 0.23 -0.19 116.66 111.82 1why n ARG 147 Ca 0.11 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.04 1why n ARG 147 Cb 0.41 -1.38 0.00 0.00 0.45 0.00 0.00 32.46 31.94 1why n ARG 147 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1why n GLY 148 N 6.67 0.63 3.77 5.14 0.00 -0.40 -5.00 105.19 116.00 1why n GLY 148 Ca 0.54 -0.48 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.80 3.27 -2.00 1.61 5.36 0.73 -4.72 117.98 119.42 1why s PHE 149 Ca 0.00 1.56 0.07 0.00 -0.96 0.00 0.00 56.93 57.60 1why s PHE 149 Cb 0.00 -3.47 0.42 0.00 -0.34 0.00 0.00 43.02 39.63 1why s PHE 149 CO 0.00 -1.23 0.88 -0.35 -1.46 0.00 0.00 175.22 173.06 1why n PRO 150 N 0.82 0.49 -0.96 10.12 -0.04 -1.26 -2.97 135.00 141.20 1why n PRO 150 Ca 0.00 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.14 1why n PRO 150 Cb 0.44 -1.23 -0.01 0.00 -0.04 0.00 0.00 33.50 32.66 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 -1.49 0.00 1.53 7.94 -1.26 -3.29 117.00 119.71 1why n LEU 151 Ca 0.05 0.69 0.00 0.00 -1.11 0.00 0.00 56.01 55.64 1why n LEU 151 Cb 0.02 -0.65 0.00 0.00 0.53 0.00 0.00 43.42 43.32 1why n LEU 151 CO 0.04 -2.58 0.00 0.61 -1.11 0.00 0.00 177.39 174.35 1why n GLY 152 N 1.55 0.75 0.72 -3.96 0.00 -1.26 -4.45 105.19 98.54 1why n GLY 152 Ca 0.10 0.50 -0.04 0.00 0.00 0.00 0.00 46.02 46.57 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 3.78 0.00 -0.02 0.00 -1.21 -5.01 105.19 102.73 1why n GLY 153 Ca 0.00 -1.72 0.07 0.00 0.00 0.00 0.00 46.02 44.37 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 -0.14 0.21 -0.13 1.61 -0.04 -1.26 -3.12 135.00 132.13 1why n PRO 154 Ca 0.02 0.14 -0.25 0.00 -0.04 0.00 0.00 63.50 63.37 1why n PRO 154 Cb 0.14 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.00 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 -1.28 1.92 -4.63 3.54 5.68 -1.26 -4.90 116.55 115.61 1why n ASP 155 Ca 0.07 0.20 -0.43 0.00 -0.50 0.00 0.00 54.79 54.13 1why n ASP 155 Cb 0.12 -0.67 -0.02 0.00 -1.14 0.00 0.00 41.12 39.40 1why n ASP 155 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 1why s ARG 156 N -2.49 3.89 -0.05 0.11 0.52 -1.18 -5.00 118.95 114.74 1why s ARG 156 Ca -0.36 1.38 0.06 0.00 -0.52 0.00 0.00 55.73 56.29 1why s ARG 156 Cb 0.13 -3.92 -0.01 0.00 0.52 0.00 0.00 34.95 31.67 1why s ARG 156 CO 0.49 -1.16 -0.25 -0.98 0.02 0.00 0.00 175.30 173.43 1why s ARG 157 N 4.29 2.48 0.13 3.54 1.70 -1.26 -4.08 118.95 125.76 1why s ARG 157 Ca 0.60 -0.89 -0.30 0.00 -0.47 0.00 0.00 55.73 54.67 1why s ARG 157 Cb -0.19 -2.12 -0.07 0.00 -0.57 0.00 0.00 34.95 31.99 1why s ARG 157 CO 0.25 0.39 1.20 -0.51 -1.08 0.00 0.00 175.30 175.54 1why s LEU 158 N -0.19 4.42 -0.43 -1.89 1.43 -1.16 -4.82 118.68 116.04 1why s LEU 158 Ca -0.03 2.14 -0.17 0.00 -1.03 0.00 0.00 54.13 55.04 1why s LEU 158 Cb -0.13 -3.59 0.03 0.00 0.03 0.00 0.00 46.19 42.52 1why s LEU 158 CO 0.03 -0.41 0.45 -0.60 0.23 0.00 0.00 176.35 176.05 1why s ARG 159 N 0.34 3.08 -0.17 1.70 6.06 -1.24 -1.27 118.95 127.45 1why s ARG 159 Ca 0.55 -0.82 0.00 0.00 -2.50 0.00 0.00 55.73 52.97 1why s ARG 159 Cb -0.31 -3.99 0.01 0.00 0.06 0.00 0.00 34.95 30.72 1why s ARG 159 CO 0.33 -0.89 -0.17 0.08 -2.50 0.00 0.00 175.30 172.15 1why s VAL 160 N 2.13 2.40 -0.08 7.11 1.01 -1.26 -2.20 120.40 129.52 1why s VAL 160 Ca 0.12 -0.84 -0.03 0.00 0.00 0.00 0.00 61.98 61.22 1why s VAL 160 Cb -0.18 -2.02 0.04 0.00 0.00 0.00 0.00 36.38 34.23 1why s VAL 160 CO 0.13 0.52 0.16 -1.81 0.00 0.00 0.00 175.10 174.10 1why s ASP 161 N 1.12 0.31 -0.37 3.32 1.11 -0.95 -4.76 116.67 116.46 1why s ASP 161 Ca 0.01 0.33 -0.45 0.00 0.18 0.00 0.00 52.55 52.62 1why s ASP 161 Cb -0.14 0.26 -0.20 0.00 1.07 0.00 0.00 42.92 43.90 1why s ASP 161 CO -0.07 -0.20 1.46 0.49 1.18 0.00 0.00 175.17 178.03 1why n PHE 162 N 4.79 1.46 -0.50 4.23 3.72 -1.26 -2.05 117.46 127.85 1why n PHE 162 Ca -0.15 1.13 -0.30 0.00 -0.05 0.00 0.00 57.45 58.07 1why n PHE 162 Cb 0.51 -2.19 0.27 0.00 -0.94 0.00 0.00 39.48 37.13 1why n PHE 162 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1why s ALA 163 N 2.20 -0.54 -0.46 4.37 0.00 -1.05 -4.78 121.76 121.51 1why s ALA 163 Ca 1.01 -0.67 -0.05 0.00 0.00 0.00 0.00 51.96 52.25 1why s ALA 163 Cb -1.44 -3.01 0.12 0.00 0.00 0.00 0.00 23.12 18.80 1why s ALA 163 CO 0.75 -4.31 0.29 0.21 0.00 0.00 0.00 175.76 172.70 1why s LYS 164 N -4.96 2.26 0.05 0.00 2.20 -1.26 -4.79 119.74 113.24 1why s LYS 164 Ca 0.69 -1.89 -0.15 0.00 -0.36 0.00 0.00 55.97 54.26 1why s LYS 164 Cb -0.16 -3.74 -0.25 0.00 -1.51 0.00 0.00 37.83 32.17 1why s LYS 164 CO 0.59 -1.13 1.14 0.66 -0.36 0.00 0.00 175.35 176.25 1why h SER 165 N 8.09 0.84 -5.85 1.43 4.64 -1.94 -3.49 113.55 117.27 1why h SER 165 Ca -0.14 -0.77 -0.16 0.00 -0.47 0.00 0.00 61.79 60.25 1why h SER 165 Cb 1.05 -0.26 0.01 0.00 -0.31 0.00 0.00 62.40 62.89 1why h SER 165 CO 0.76 1.51 -0.86 0.61 -0.87 0.00 0.00 176.83 177.99 1why n GLY 166 N 1.19 -0.86 0.00 -0.77 0.00 -1.26 -4.81 105.19 98.67 1why n GLY 166 Ca -0.12 1.09 0.07 0.00 0.00 0.00 0.00 46.02 47.07 1why n GLY 166 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1why n PRO 167 N -0.08 0.34 -3.19 1.61 -0.04 -1.26 -4.86 135.00 127.52 1why n PRO 167 Ca 0.02 0.08 -0.15 0.00 -0.04 0.00 0.00 63.50 63.41 1why n PRO 167 Cb 0.52 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.54 1why n PRO 167 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1why n SER 168 N -1.15 -3.70 -3.97 3.54 2.88 -1.26 -5.03 113.62 104.93 1why n SER 168 Ca 0.09 -0.43 -0.26 0.00 -1.33 0.00 0.00 58.87 56.94 1why n SER 168 Cb 0.09 -3.88 -0.08 0.00 -0.75 0.00 0.00 64.21 59.59 1why n SER 168 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1why n SER 169 N -2.19 1.20 0.00 -3.46 7.64 -1.26 -5.34 113.62 110.21 1why n SER 169 Ca -0.10 -3.27 0.00 0.00 1.01 0.00 0.00 58.87 56.51 1why n SER 169 Cb 0.58 1.10 0.00 0.00 -1.01 0.00 0.00 64.21 64.88 1why n SER 169 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64