#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 -2.28 -4.44 1.61 7.64 -1.26 -4.93 113.62 109.96 1why n SER 75 Ca 0.00 -1.06 -0.34 0.00 1.01 0.00 0.00 58.87 58.48 1why n SER 75 Cb 0.00 -2.56 -0.13 0.00 -1.01 0.00 0.00 64.21 60.51 1why n SER 75 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1why s SER 76 N -3.55 4.55 0.49 6.43 0.15 -1.26 -5.11 113.70 115.40 1why s SER 76 Ca 0.57 -0.22 -0.19 0.00 0.70 0.00 0.00 55.95 56.82 1why s SER 76 Cb -0.32 -1.74 -0.08 0.00 -1.71 0.00 0.00 66.02 62.17 1why s SER 76 CO 0.94 0.14 1.01 -0.83 1.20 0.00 0.00 173.24 175.70 1why s GLY 77 N 0.54 2.37 -0.15 9.45 0.00 -1.26 -4.93 107.32 113.34 1why s GLY 77 Ca -0.04 0.48 -0.02 0.00 0.00 0.00 0.00 44.72 45.13 1why s GLY 77 CO 0.03 0.78 2.45 1.44 0.00 0.00 0.00 173.10 177.80 1why n SER 78 N -1.13 5.80 -4.89 1.64 7.64 -1.26 -4.90 113.62 116.53 1why n SER 78 Ca 0.08 -2.72 -0.33 0.00 1.01 0.00 0.00 58.87 56.92 1why n SER 78 Cb 0.53 -1.18 -0.05 0.00 -1.01 0.00 0.00 64.21 62.50 1why n SER 78 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1why s SER 79 N 1.25 6.54 0.00 6.43 0.15 -1.26 -4.86 113.70 121.94 1why s SER 79 Ca 0.31 0.65 0.00 0.00 0.70 0.00 0.00 55.95 57.61 1why s SER 79 Cb 0.19 -2.12 0.00 0.00 -1.71 0.00 0.00 66.02 62.38 1why s SER 79 CO -0.03 0.10 0.00 0.61 1.20 0.00 0.00 173.24 175.12 1why n GLY 80 N 0.39 -1.70 3.45 9.45 0.00 -1.26 -5.09 105.19 110.42 1why n GLY 80 Ca -0.05 0.59 -0.44 0.00 0.00 0.00 0.00 46.02 46.13 1why n GLY 80 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1why s LYS 81 N 0.00 3.10 0.00 1.61 2.47 -1.26 -4.89 119.74 120.76 1why s LYS 81 Ca 0.00 -0.89 0.26 0.00 -1.56 0.00 0.00 55.97 53.78 1why s LYS 81 Cb 0.00 -4.05 0.72 0.00 -1.46 0.00 0.00 37.83 33.04 1why s LYS 81 CO 0.00 -1.05 1.57 0.44 0.16 0.00 0.00 175.35 176.47 1why n ILE 82 N 5.50 0.00 -3.78 5.43 -5.35 -1.26 -4.96 119.36 114.94 1why n ILE 82 Ca -0.07 -0.00 -0.23 0.00 -0.27 0.00 0.00 62.75 62.17 1why n ILE 82 Cb 0.46 0.03 0.02 0.00 -1.74 0.00 0.00 39.64 38.41 1why n ILE 82 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1why n GLY 83 N 1.50 -0.32 2.50 3.28 0.00 -1.26 -4.82 105.19 106.07 1why n GLY 83 Ca 0.06 0.16 -0.32 0.00 0.00 0.00 0.00 46.02 45.92 1why n GLY 83 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1why n TYR 84 N -4.29 -1.53 0.00 1.61 4.11 -1.26 -4.84 117.16 110.95 1why n TYR 84 Ca -0.29 0.49 0.00 0.00 -0.00 0.00 0.00 57.90 58.10 1why n TYR 84 Cb 0.68 -1.35 0.00 0.00 -0.00 0.00 0.00 39.34 38.66 1why n TYR 84 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1why n GLY 85 N 1.76 3.41 3.69 -7.48 0.00 -1.26 -5.03 105.19 100.27 1why n GLY 85 Ca 0.09 -1.50 -0.44 0.00 0.00 0.00 0.00 46.02 44.17 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 0.28 2.59 -1.98 1.61 4.76 -1.26 -4.92 118.16 119.24 1why n LYS 86 Ca 0.00 0.94 -0.41 0.00 -2.87 0.00 0.00 58.31 55.97 1why n LYS 86 Cb 0.00 -2.80 -0.02 0.00 -1.84 0.00 0.00 35.03 30.37 1why n LYS 86 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1why s ALA 87 N 2.29 3.63 0.26 7.82 0.00 -1.26 -4.99 121.76 129.51 1why s ALA 87 Ca 0.82 1.36 -0.24 0.00 0.00 0.00 0.00 51.96 53.90 1why s ALA 87 Cb -0.55 -3.56 -0.09 0.00 0.00 0.00 0.00 23.12 18.92 1why s ALA 87 CO 0.38 -0.78 0.85 -0.80 0.00 0.00 0.00 175.76 175.42 1why s ASN 88 N 0.27 7.28 0.10 0.00 0.01 -1.26 -4.89 114.94 116.44 1why s ASN 88 Ca 0.58 1.69 -0.31 0.00 -0.71 0.00 0.00 52.86 54.11 1why s ASN 88 Cb -0.43 -2.52 -0.08 0.00 0.41 0.00 0.00 41.25 38.64 1why s ASN 88 CO 0.46 0.02 1.37 -2.16 -1.51 0.00 0.00 177.10 175.27 1why s PRO 89 N -1.85 4.33 -0.03 -0.60 0.04 -1.26 -4.54 135.00 131.09 1why s PRO 89 Ca 0.45 2.03 -0.10 0.00 0.04 0.00 0.00 61.00 63.43 1why s PRO 89 Cb -0.19 -3.28 0.01 0.00 0.04 0.00 0.00 34.50 31.09 1why s PRO 89 CO 0.24 -0.42 0.22 -0.08 0.04 0.00 0.00 177.00 176.99 1why s THR 90 N 1.17 0.05 0.43 1.26 -1.32 -1.26 -5.03 115.64 110.95 1why s THR 90 Ca 0.64 -0.41 0.29 0.00 -1.21 0.00 0.00 61.69 61.00 1why s THR 90 Cb -0.36 -0.45 0.48 0.00 -1.51 0.00 0.00 72.50 70.66 1why s THR 90 CO 0.30 -0.23 1.63 0.71 -2.21 0.00 0.00 174.62 174.83 1why h THR 91 N 4.31 0.15 -2.90 5.08 1.35 -1.83 -3.37 112.91 115.70 1why h THR 91 Ca -0.29 -0.04 -0.57 0.00 -0.55 0.00 0.00 66.41 64.97 1why h THR 91 Cb 1.19 0.03 -0.04 0.00 -1.73 0.00 0.00 68.15 67.60 1why h THR 91 CO 0.39 0.02 0.94 -0.60 -0.25 0.00 0.00 175.52 176.01 1why s ARG 92 N -5.32 4.18 -0.01 4.72 3.52 -1.26 -2.51 118.95 122.27 1why s ARG 92 Ca -0.08 1.67 0.06 0.00 -0.13 0.00 0.00 55.73 57.25 1why s ARG 92 Cb 0.29 -3.81 -0.03 0.00 -1.56 0.00 0.00 34.95 29.85 1why s ARG 92 CO 0.82 -0.78 -0.20 -0.51 -0.81 0.00 0.00 175.30 173.81 1why s LEU 93 N 3.70 2.43 -0.07 -0.88 1.43 0.60 -4.06 118.68 121.84 1why s LEU 93 Ca 0.57 -0.37 -0.03 0.00 -1.03 0.00 0.00 54.13 53.27 1why s LEU 93 Cb -0.22 -1.45 -0.04 0.00 0.03 0.00 0.00 46.19 44.51 1why s LEU 93 CO 0.17 0.31 0.08 0.86 0.23 0.00 0.00 176.35 178.01 1why s TRP 94 N -0.74 3.37 -0.12 0.29 -0.00 -1.16 -0.11 118.94 120.47 1why s TRP 94 Ca 0.12 0.32 -0.03 0.00 -0.00 0.00 0.00 56.10 56.51 1why s TRP 94 Cb -0.10 -1.83 0.04 0.00 -0.00 0.00 0.00 33.47 31.58 1why s TRP 94 CO 0.01 0.60 0.04 0.08 -0.00 0.00 0.00 176.95 177.68 1why s VAL 95 N -1.06 0.24 0.00 5.86 1.01 0.86 -2.98 120.40 124.33 1why s VAL 95 Ca 0.18 -0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.11 1why s VAL 95 Cb -0.12 -0.60 0.00 0.00 0.00 0.00 0.00 36.38 35.67 1why s VAL 95 CO 0.08 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.81 1why n GLY 96 N 5.18 4.25 3.69 4.51 0.00 -0.77 -1.57 105.19 120.47 1why n GLY 96 Ca -0.07 -2.02 -0.24 0.00 0.00 0.00 0.00 46.02 43.69 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 5.00 -0.43 3.43 -0.02 0.00 -1.26 -3.96 105.19 107.95 1why n GLY 97 Ca 0.00 0.17 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 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 -6.96 3.02 0.00 0.99 1.43 -1.26 -4.84 118.68 111.06 1why s LEU 98 Ca 0.34 -0.23 0.00 0.00 -1.03 0.00 0.00 54.13 53.21 1why s LEU 98 Cb -0.16 -1.72 0.00 0.00 0.03 0.00 0.00 46.19 44.34 1why s LEU 98 CO 0.78 0.14 0.00 0.61 0.23 0.00 0.00 176.35 178.11 1why n GLY 99 N 3.70 3.71 0.00 -3.19 0.00 -1.26 -4.86 105.19 103.29 1why n GLY 99 Ca -0.18 -2.14 0.08 0.00 0.00 0.00 0.00 46.02 43.78 1why n GLY 99 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1why n PRO 100 N -0.33 0.39 -0.12 1.61 -0.04 -1.26 -3.06 135.00 132.18 1why n PRO 100 Ca 0.00 0.05 -0.26 0.00 -0.04 0.00 0.00 63.50 63.25 1why n PRO 100 Cb 0.00 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 31.85 1why n PRO 100 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1why n ASN 101 N -1.10 1.91 -4.74 3.54 5.15 -1.26 -4.94 115.26 113.82 1why n ASN 101 Ca 0.10 0.38 -0.42 0.00 -0.60 0.00 0.00 54.58 54.04 1why n ASN 101 Cb 0.08 -0.89 -0.02 0.00 -0.53 0.00 0.00 39.78 38.42 1why n ASN 101 CO 0.00 0.00 0.00 0.41 1.40 0.00 0.00 177.26 179.07 1why n THR 102 N -4.33 0.80 -4.66 -0.44 -1.04 -1.17 -5.01 114.28 98.43 1why n THR 102 Ca -0.45 -0.20 -0.25 0.00 -2.04 0.00 0.00 64.05 61.12 1why n THR 102 Cb 0.80 -1.96 -0.14 0.00 -1.82 0.00 0.00 70.33 67.21 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 0.64 2.25 0.18 8.00 0.01 -1.26 -4.78 113.70 118.74 1why s SER 103 Ca 0.67 -0.46 -0.12 0.00 1.31 0.00 0.00 55.95 57.34 1why s SER 103 Cb -0.50 -0.20 0.22 0.00 0.21 0.00 0.00 66.02 65.75 1why s SER 103 CO 0.45 0.16 1.20 -0.11 0.41 0.00 0.00 173.24 175.34 1why n LEU 104 N 2.07 -0.46 0.04 2.44 0.00 -1.26 -0.20 117.00 119.63 1why n LEU 104 Ca -0.17 1.34 -0.14 0.00 0.00 0.00 0.00 56.01 57.05 1why n LEU 104 Cb 0.54 -0.32 -0.09 0.00 0.00 0.00 0.00 43.42 43.55 1why n LEU 104 CO 0.23 -1.22 0.51 0.00 0.00 0.00 0.00 177.39 176.91 1why h ALA 105 N 1.15 -0.89 -0.90 1.96 0.00 -1.98 0.21 119.26 118.81 1why h ALA 105 Ca 0.29 -0.07 0.16 0.00 0.00 0.00 0.00 54.91 55.28 1why h ALA 105 Cb 0.48 0.91 -0.16 0.00 0.00 0.00 0.00 17.79 19.02 1why h ALA 105 CO -0.77 -1.03 -0.28 0.00 0.00 0.00 0.00 179.25 177.17 1why n ALA 106 N -2.91 0.07 -0.01 0.00 0.00 0.72 -0.00 120.51 118.38 1why n ALA 106 Ca -0.06 0.95 0.00 0.00 0.00 0.00 0.00 53.44 54.33 1why n ALA 106 Cb 0.34 -0.51 0.00 0.00 0.00 0.00 0.00 19.45 19.28 1why n ALA 106 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1why n LEU 107 N -5.41 0.02 -0.31 0.00 4.77 -0.79 -3.21 117.00 112.07 1why n LEU 107 Ca 0.12 0.76 -0.06 0.00 -0.03 0.00 0.00 56.01 56.80 1why n LEU 107 Cb 0.41 -0.49 -0.04 0.00 -2.33 0.00 0.00 43.42 40.96 1why n LEU 107 CO -0.11 -0.49 0.39 0.00 -1.33 0.00 0.00 177.39 175.84 1why n ALA 108 N -1.98 -0.37 -0.31 -1.18 0.00 0.66 0.14 120.51 117.46 1why n ALA 108 Ca 0.00 0.67 0.13 0.00 0.00 0.00 0.00 53.44 54.24 1why n ALA 108 Cb 0.00 -0.17 0.28 0.00 0.00 0.00 0.00 19.45 19.55 1why n ALA 108 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1why h ARG 109 N 0.00 0.09 0.18 0.00 9.65 -0.55 0.30 114.38 124.05 1why h ARG 109 Ca 0.16 -0.01 -0.01 0.00 -1.10 0.00 0.00 59.98 59.03 1why h ARG 109 Cb 0.35 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.91 1why h ARG 109 CO -0.72 0.06 -0.09 0.93 2.80 0.00 0.00 179.97 182.95 1why h GLU 110 N 0.09 -0.23 -1.30 0.20 4.39 0.12 -3.23 114.58 114.62 1why h GLU 110 Ca 0.56 0.02 0.44 0.00 0.34 0.00 0.00 59.36 60.71 1why h GLU 110 Cb 1.13 0.05 -0.14 0.00 -0.10 0.00 0.00 28.75 29.70 1why h GLU 110 CO -0.78 -0.15 0.83 0.74 -1.16 0.00 0.00 179.01 178.48 1why h PHE 111 N -0.40 0.56 -0.73 4.33 -1.00 -0.66 0.67 116.94 119.70 1why h PHE 111 Ca -0.02 0.03 0.14 0.00 2.81 0.00 0.00 57.97 60.92 1why h PHE 111 Cb 0.18 -0.13 -0.10 0.00 3.61 0.00 0.00 35.95 39.51 1why h PHE 111 CO 0.08 -0.25 0.27 0.22 -1.61 0.00 0.00 178.31 177.02 1why h ASP 112 N 0.07 0.22 -0.97 2.17 1.82 -0.43 -1.64 116.42 117.66 1why h ASP 112 Ca 0.84 0.11 0.19 0.00 -0.39 0.00 0.00 57.03 57.78 1why h ASP 112 Cb 2.58 0.11 -0.18 0.00 0.68 0.00 0.00 39.33 42.51 1why h ASP 112 CO -0.47 0.08 -0.24 0.54 -1.61 0.00 0.00 179.24 177.54 1why n ARG 113 N -5.03 -0.09 0.17 0.28 1.74 0.23 -1.67 116.66 112.29 1why n ARG 113 Ca 0.14 1.51 -0.07 0.00 -0.77 0.00 0.00 57.85 58.66 1why n ARG 113 Cb 0.41 -2.25 -0.03 0.00 -1.02 0.00 0.00 32.46 29.56 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 -0.42 -3.85 -1.55 -1.00 -1.45 -3.48 116.94 105.19 1why h PHE 114 Ca 0.47 -0.01 -0.28 0.00 2.81 0.00 0.00 57.97 60.95 1why h PHE 114 Cb 0.71 0.14 -0.07 0.00 3.61 0.00 0.00 35.95 40.34 1why h PHE 114 CO -0.74 -0.26 -0.22 0.41 -1.61 0.00 0.00 178.31 175.89 1why n GLY 115 N -0.30 2.66 3.73 -1.45 0.00 -0.67 -5.04 105.19 104.12 1why n GLY 115 Ca -0.06 -1.68 -0.40 0.00 0.00 0.00 0.00 46.02 43.88 1why n GLY 115 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1why s SER 116 N -2.76 7.24 0.04 1.61 0.15 -1.26 -3.90 113.70 114.83 1why s SER 116 Ca 0.26 1.49 -0.10 0.00 0.70 0.00 0.00 55.95 58.30 1why s SER 116 Cb 0.00 -2.49 -0.05 0.00 -1.71 0.00 0.00 66.02 61.77 1why s SER 116 CO 0.19 -0.06 0.37 -0.63 1.20 0.00 0.00 173.24 174.31 1why s ILE 117 N 0.25 5.14 -0.18 6.45 1.01 -1.26 -2.26 121.20 130.35 1why s ILE 117 Ca 0.42 0.46 -0.16 0.00 0.00 0.00 0.00 60.65 61.37 1why s ILE 117 Cb -0.21 -3.63 -0.13 0.00 0.01 0.00 0.00 42.46 38.51 1why s ILE 117 CO 0.24 0.37 0.07 -0.09 0.00 0.00 0.00 174.94 175.53 1why h ARG 118 N 4.00 0.00 -2.84 2.79 2.43 -0.79 -3.48 114.38 116.49 1why h ARG 118 Ca -0.50 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 58.66 1why h ARG 118 Cb 1.20 0.00 -0.13 0.00 -0.42 0.00 0.00 29.97 30.62 1why h ARG 118 CO 0.65 0.58 0.24 -0.08 -1.51 0.00 0.00 179.97 179.85 1why s THR 119 N -2.28 0.00 -0.03 0.20 -1.32 -1.26 -5.02 115.64 105.92 1why s THR 119 Ca -0.22 0.00 -0.01 0.00 -1.21 0.00 0.00 61.69 60.25 1why s THR 119 Cb 0.04 -1.00 0.03 0.00 -1.51 0.00 0.00 72.50 70.06 1why s THR 119 CO 0.43 0.00 0.04 -0.63 -2.21 0.00 0.00 174.62 172.26 1why s ILE 120 N -3.48 -0.06 -0.13 5.08 1.01 -1.26 -3.19 121.20 119.17 1why s ILE 120 Ca 0.01 0.33 -0.21 0.00 0.00 0.00 0.00 60.65 60.77 1why s ILE 120 Cb -0.01 -0.15 -0.03 0.00 0.01 0.00 0.00 42.46 42.28 1why s ILE 120 CO -0.11 0.15 0.62 -1.81 0.00 0.00 0.00 174.94 173.79 1why s ASP 121 N 1.71 6.80 -0.03 3.58 1.01 -1.22 -4.94 116.67 123.57 1why s ASP 121 Ca -0.01 0.96 0.02 0.00 0.71 0.00 0.00 52.55 54.24 1why s ASP 121 Cb -0.12 -2.36 -0.03 0.00 1.01 0.00 0.00 42.92 41.42 1why s ASP 121 CO -0.03 -0.14 -0.09 -1.38 0.21 0.00 0.00 175.17 173.74 1why s HIS 122 N 1.15 2.86 -0.20 4.23 -3.43 -1.26 -3.85 115.29 114.79 1why s HIS 122 Ca 0.31 -0.04 -0.14 0.00 -0.80 0.00 0.00 55.06 54.39 1why s HIS 122 Cb -0.16 -1.65 0.06 0.00 -1.43 0.00 0.00 32.58 29.40 1why s HIS 122 CO 0.13 0.32 0.51 0.08 -2.00 0.00 0.00 174.74 173.78 1why s VAL 123 N -0.87 -0.01 -0.09 -5.38 1.01 -1.25 -5.04 120.40 108.77 1why s VAL 123 Ca 0.14 0.04 -0.06 0.00 0.00 0.00 0.00 61.98 62.10 1why s VAL 123 Cb -0.11 -0.73 -0.27 0.00 0.00 0.00 0.00 36.38 35.27 1why s VAL 123 CO 0.04 0.02 0.49 0.07 0.00 0.00 0.00 175.10 175.71 1why h LYS 124 N 6.38 0.27 0.19 2.72 2.10 -1.96 -2.56 116.57 123.71 1why h LYS 124 Ca -0.32 -0.46 -0.00 0.00 -2.00 0.00 0.00 60.65 57.87 1why h LYS 124 Cb 1.19 0.17 -0.01 0.00 -0.90 0.00 0.00 32.23 32.68 1why h LYS 124 CO 0.22 1.16 -0.24 0.78 -2.00 0.00 0.00 179.45 179.38 1why h GLY 125 N 1.28 -1.02 1.62 0.07 0.00 -2.00 -3.20 103.07 99.81 1why h GLY 125 Ca -0.38 0.47 -0.24 0.00 0.00 0.00 0.00 47.33 47.18 1why h GLY 125 CO 0.11 -0.33 -1.04 -0.55 0.00 0.00 0.00 176.54 174.73 1why h ASP 126 N -0.44 0.45 -3.40 0.19 5.19 -2.01 -3.48 116.42 112.92 1why h ASP 126 Ca -0.02 -0.40 -0.11 0.00 -0.62 0.00 0.00 57.03 55.87 1why h ASP 126 Cb 0.39 -0.14 0.06 0.00 0.18 0.00 0.00 39.33 39.82 1why h ASP 126 CO -0.05 1.24 -0.28 -1.20 -3.12 0.00 0.00 179.24 175.82 1why n SER 127 N -3.65 -2.30 -4.48 6.45 7.64 -0.96 -5.05 113.62 111.26 1why n SER 127 Ca -0.07 -0.23 -0.26 0.00 1.01 0.00 0.00 58.87 59.33 1why n SER 127 Cb 0.90 -2.15 -0.10 0.00 -1.01 0.00 0.00 64.21 61.85 1why n SER 127 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1why s PHE 128 N -3.13 2.04 -0.10 1.43 -0.12 -1.24 -4.21 117.98 112.65 1why s PHE 128 Ca 0.03 -0.96 -0.25 0.00 -0.05 0.00 0.00 56.93 55.70 1why s PHE 128 Cb -0.00 -1.43 0.06 0.00 -0.63 0.00 0.00 43.02 41.01 1why s PHE 128 CO 0.26 0.09 0.59 0.00 -0.05 0.00 0.00 175.22 176.11 1why s ALA 129 N -3.07 -1.51 -0.07 1.99 0.00 -0.61 -3.82 121.76 114.67 1why s ALA 129 Ca 0.28 1.26 -0.00 0.00 0.00 0.00 0.00 51.96 53.50 1why s ALA 129 Cb 0.07 -0.30 0.03 0.00 0.00 0.00 0.00 23.12 22.91 1why s ALA 129 CO 0.14 -0.32 -0.02 0.71 0.00 0.00 0.00 175.76 176.26 1why s TYR 130 N -0.75 0.80 -0.17 0.00 2.02 -1.25 -0.10 117.35 117.91 1why s TYR 130 Ca -0.08 -0.26 -0.04 0.00 -0.37 0.00 0.00 57.07 56.33 1why s TYR 130 Cb -0.02 -0.82 -0.03 0.00 -0.40 0.00 0.00 41.96 40.69 1why s TYR 130 CO 0.06 -0.31 -0.03 0.42 -1.57 0.00 0.00 175.55 174.11 1why s ILE 131 N 1.62 3.85 -0.31 2.71 1.01 0.84 -3.45 121.20 127.47 1why s ILE 131 Ca 0.00 -0.37 -0.08 0.00 0.00 0.00 0.00 60.65 60.20 1why s ILE 131 Cb -0.13 -2.70 0.00 0.00 0.01 0.00 0.00 42.46 39.65 1why s ILE 131 CO -0.04 0.48 0.12 -1.58 0.00 0.00 0.00 174.94 173.91 1why s GLN 132 N 0.54 3.18 0.13 2.79 0.74 -1.19 -0.29 119.66 125.55 1why s GLN 132 Ca -0.03 -0.81 -0.16 0.00 0.05 0.00 0.00 55.36 54.41 1why s GLN 132 Cb -0.14 -3.47 -0.07 0.00 1.10 0.00 0.00 33.01 30.43 1why s GLN 132 CO 0.03 -0.45 0.56 0.71 -0.55 0.00 0.00 175.29 175.59 1why s TYR 133 N 1.55 3.66 0.45 1.67 2.02 -1.04 -0.02 117.35 125.63 1why s TYR 133 Ca 0.03 1.14 0.21 0.00 -0.37 0.00 0.00 57.07 58.08 1why s TYR 133 Cb -0.17 -2.42 1.18 0.00 -0.40 0.00 0.00 41.96 40.15 1why s TYR 133 CO 0.04 0.46 1.86 0.93 -1.57 0.00 0.00 175.55 177.28 1why h GLU 134 N 3.81 0.30 -5.11 -0.62 4.39 -1.81 -3.42 114.58 112.10 1why h GLU 134 Ca -0.49 -0.02 -0.34 0.00 0.34 0.00 0.00 59.36 58.85 1why h GLU 134 Cb 1.20 -0.07 -0.16 0.00 -0.10 0.00 0.00 28.75 29.62 1why h GLU 134 CO 0.65 0.20 -0.72 -1.12 -1.16 0.00 0.00 179.01 176.85 1why s SER 135 N -5.62 1.78 -0.02 1.42 0.01 -1.26 -5.07 113.70 104.94 1why s SER 135 Ca -0.07 -0.95 -0.26 0.00 1.31 0.00 0.00 55.95 55.98 1why s SER 135 Cb 0.23 -0.02 -0.20 0.00 0.21 0.00 0.00 66.02 66.24 1why s SER 135 CO 0.78 -0.29 1.26 0.25 0.41 0.00 0.00 173.24 175.65 1why h LEU 136 N 3.03 -0.02 -0.69 2.44 6.46 -1.93 -3.09 115.31 121.50 1why h LEU 136 Ca -0.37 -0.47 0.13 0.00 -0.12 0.00 0.00 57.88 57.05 1why h LEU 136 Cb 1.19 0.00 -0.13 0.00 -0.73 0.00 0.00 40.66 41.00 1why h LEU 136 CO 0.60 0.47 -0.26 -0.78 -0.62 0.00 0.00 178.44 177.84 1why h ASP 137 N -0.50 -0.94 -0.83 1.25 3.58 -1.97 0.25 116.42 117.26 1why h ASP 137 Ca -0.00 0.23 0.10 0.00 0.42 0.00 0.00 57.03 57.78 1why h ASP 137 Cb 0.49 0.53 -0.08 0.00 1.72 0.00 0.00 39.33 41.99 1why h ASP 137 CO 0.00 -0.27 0.46 0.00 -2.88 0.00 0.00 179.24 176.55 1why h ALA 138 N 1.39 1.19 -0.54 -0.78 0.00 -1.96 -1.61 119.26 116.93 1why h ALA 138 Ca 0.30 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.25 1why h ALA 138 Cb 0.55 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1why h ALA 138 CO -0.74 0.07 0.35 0.00 0.00 0.00 0.00 179.25 178.93 1why h ALA 139 N 1.47 0.69 -0.94 0.00 0.00 -0.48 -1.86 119.26 118.15 1why h ALA 139 Ca 0.41 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.31 1why h ALA 139 Cb 0.41 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 17.92 1why h ALA 139 CO -0.26 0.14 0.61 1.96 0.00 0.00 0.00 179.25 181.69 1why h GLN 140 N 0.74 1.12 0.58 0.00 4.20 -0.28 0.43 115.11 121.90 1why h GLN 140 Ca 0.20 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.81 1why h GLN 140 Cb -0.07 -0.25 0.01 0.00 0.30 0.00 0.00 27.48 27.46 1why h GLN 140 CO -0.04 0.74 -0.28 0.00 -0.67 0.00 0.00 178.83 178.58 1why h ALA 141 N 1.40 -0.99 -0.80 3.87 0.00 -0.96 -2.65 119.26 119.12 1why h ALA 141 Ca 0.38 -0.17 0.07 0.00 0.00 0.00 0.00 54.91 55.19 1why h ALA 141 Cb 0.05 0.30 -0.05 0.00 0.00 0.00 0.00 17.79 18.09 1why h ALA 141 CO -0.14 -0.94 0.52 0.00 0.00 0.00 0.00 179.25 178.70 1why h ALA 142 N -1.48 1.64 -0.81 0.00 0.00 -1.28 -1.02 119.26 116.31 1why h ALA 142 Ca -0.08 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 54.90 1why h ALA 142 Cb 0.60 -0.22 -0.07 0.00 0.00 0.00 0.00 17.79 18.10 1why h ALA 142 CO 0.13 0.23 0.46 0.00 0.00 0.00 0.00 179.25 180.07 1why h ALA 144 N 1.45 -0.16 -0.69 0.00 0.00 -0.95 -2.77 119.26 116.14 1why h ALA 144 Ca 0.39 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.35 1why h ALA 144 Cb 0.35 0.05 -0.11 0.00 0.00 0.00 0.00 17.79 18.08 1why h ALA 144 CO -0.24 -0.15 -0.53 0.87 0.00 0.00 0.00 179.25 179.20 1why h LYS 145 N -0.75 -0.19 -0.86 0.00 6.56 -1.22 0.37 116.57 120.49 1why h LYS 145 Ca -0.01 0.01 0.10 0.00 -1.06 0.00 0.00 60.65 59.69 1why h LYS 145 Cb 0.09 0.04 -0.06 0.00 -0.57 0.00 0.00 32.23 31.73 1why h LYS 145 CO 0.02 -0.13 0.56 0.52 -2.06 0.00 0.00 179.45 178.36 1why h MET 146 N -0.20 0.80 -5.44 3.15 2.86 -1.08 -3.42 114.93 111.60 1why h MET 146 Ca 0.15 -0.05 -0.58 0.00 -2.06 0.00 0.00 59.70 57.16 1why h MET 146 Cb 0.53 -0.18 -0.06 0.00 0.06 0.00 0.00 31.60 31.95 1why h MET 146 CO -0.76 0.53 1.60 -2.13 1.06 0.00 0.00 176.91 177.21 1why n ARG 147 N -4.52 0.27 -1.08 1.72 0.63 0.13 0.78 116.66 114.59 1why n ARG 147 Ca 0.15 0.04 0.00 0.00 -0.92 0.00 0.00 57.85 57.11 1why n ARG 147 Cb 0.32 -1.87 0.00 0.00 0.45 0.00 0.00 32.46 31.36 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 6.68 1.12 3.75 5.14 0.00 -1.03 -4.99 105.19 115.85 1why n GLY 148 Ca 0.57 -0.42 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1why n GLY 148 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1why n PHE 149 N -2.17 2.80 0.97 1.61 7.35 0.23 -4.73 117.46 123.53 1why n PHE 149 Ca 0.00 0.43 0.04 0.00 -0.76 0.00 0.00 57.45 57.16 1why n PHE 149 Cb 0.25 -2.52 0.21 0.00 0.35 0.00 0.00 39.48 37.78 1why n PHE 149 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 1why n PRO 150 N 0.82 0.49 -1.09 -7.13 -0.04 -1.26 -3.05 135.00 123.73 1why n PRO 150 Ca 0.04 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.15 1why n PRO 150 Cb 0.38 -1.23 -0.11 0.00 -0.04 0.00 0.00 33.50 32.50 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 0.31 0.00 1.53 0.00 -1.26 -3.24 117.00 113.62 1why n LEU 151 Ca 0.05 0.24 0.00 0.00 0.00 0.00 0.00 56.01 56.30 1why n LEU 151 Cb 0.02 -0.70 0.00 0.00 0.00 0.00 0.00 43.42 42.75 1why n LEU 151 CO 0.04 -0.56 0.00 0.61 0.00 0.00 0.00 177.39 177.48 1why n GLY 152 N 5.15 1.00 3.67 -3.96 0.00 -1.26 -4.49 105.19 105.30 1why n GLY 152 Ca 0.48 -0.74 -0.30 0.00 0.00 0.00 0.00 46.02 45.46 1why n GLY 152 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1why s GLY 153 N 0.00 2.89 0.11 -0.02 0.00 -1.20 -5.02 107.32 104.08 1why s GLY 153 Ca 0.00 -0.67 0.18 0.00 0.00 0.00 0.00 44.72 44.23 1why s GLY 153 CO 0.00 -2.06 1.56 -1.55 0.00 0.00 0.00 173.10 171.05 1why n PRO 154 N -1.14 0.08 -0.09 2.90 -0.04 -1.26 -3.02 135.00 132.43 1why n PRO 154 Ca -0.14 0.33 -0.21 0.00 -0.04 0.00 0.00 63.50 63.44 1why n PRO 154 Cb 0.66 -1.66 -0.12 0.00 -0.04 0.00 0.00 33.50 32.34 1why n PRO 154 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1why n ASP 155 N -1.81 2.01 -4.49 3.54 2.03 -1.26 -4.83 116.55 111.74 1why n ASP 155 Ca 0.03 0.06 -0.43 0.00 0.52 0.00 0.00 54.79 54.97 1why n ASP 155 Cb 0.19 -0.63 -0.06 0.00 -0.72 0.00 0.00 41.12 39.90 1why n ASP 155 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1why s ARG 156 N -2.52 3.23 0.14 -0.67 3.00 -1.17 -5.04 118.95 115.92 1why s ARG 156 Ca -0.32 -0.53 0.06 0.00 0.00 0.00 0.00 55.73 54.95 1why s ARG 156 Cb 0.09 -4.01 -0.04 0.00 0.00 0.00 0.00 34.95 30.99 1why s ARG 156 CO 0.63 -1.13 -0.15 1.03 0.00 0.00 0.00 175.30 175.69 1why s ARG 157 N 2.87 1.09 0.60 3.54 0.52 -1.26 -3.88 118.95 122.44 1why s ARG 157 Ca 0.21 -1.31 -0.16 0.00 -0.52 0.00 0.00 55.73 53.95 1why s ARG 157 Cb -0.16 -0.98 -0.03 0.00 0.52 0.00 0.00 34.95 34.30 1why s ARG 157 CO 0.17 0.19 1.07 -0.51 0.02 0.00 0.00 175.30 176.24 1why s LEU 158 N -2.59 3.51 -0.30 2.53 1.43 -1.17 -4.86 118.68 117.23 1why s LEU 158 Ca 0.11 1.89 0.03 0.00 -1.03 0.00 0.00 54.13 55.13 1why s LEU 158 Cb -0.04 -4.54 0.08 0.00 0.03 0.00 0.00 46.19 41.72 1why s LEU 158 CO 0.04 -1.25 -0.00 -0.13 0.23 0.00 0.00 176.35 175.23 1why s ARG 159 N -3.98 1.62 -0.13 1.70 3.00 -1.25 -2.47 118.95 117.42 1why s ARG 159 Ca 0.65 -1.50 -0.03 0.00 0.00 0.00 0.00 55.73 54.86 1why s ARG 159 Cb -0.17 -2.88 -0.03 0.00 0.00 0.00 0.00 34.95 31.86 1why s ARG 159 CO 0.36 -0.79 -0.03 0.08 0.00 0.00 0.00 175.30 174.92 1why s VAL 160 N 1.12 3.96 0.02 3.52 1.01 -1.26 -1.85 120.40 126.91 1why s VAL 160 Ca 0.03 -0.35 -0.06 0.00 0.00 0.00 0.00 61.98 61.60 1why s VAL 160 Cb -0.19 -2.71 -0.01 0.00 0.00 0.00 0.00 36.38 33.48 1why s VAL 160 CO -0.09 0.53 0.10 1.51 0.00 0.00 0.00 175.10 177.15 1why s ASP 161 N -0.01 0.11 -0.28 3.32 -4.77 -1.16 -4.87 116.67 109.02 1why s ASP 161 Ca 0.01 -0.37 -0.29 0.00 -3.30 0.00 0.00 52.55 48.60 1why s ASP 161 Cb -0.13 0.20 -0.01 0.00 -1.09 0.00 0.00 42.92 41.89 1why s ASP 161 CO 0.03 -0.42 1.38 -0.36 0.70 0.00 0.00 175.17 176.50 1why s PHE 162 N -1.88 2.53 0.83 2.11 0.08 -1.26 -2.99 117.98 117.40 1why s PHE 162 Ca -0.11 0.78 -0.11 0.00 0.12 0.00 0.00 56.93 57.61 1why s PHE 162 Cb -0.05 -3.92 0.09 0.00 -0.57 0.00 0.00 43.02 38.57 1why s PHE 162 CO -0.01 -2.04 1.09 0.00 -0.10 0.00 0.00 175.22 174.16 1why s ALA 163 N 4.58 1.93 -0.05 5.36 0.00 -1.26 -4.64 121.76 127.68 1why s ALA 163 Ca 0.60 0.00 0.03 0.00 0.00 0.00 0.00 51.96 52.59 1why s ALA 163 Cb -0.19 -3.19 0.01 0.00 0.00 0.00 0.00 23.12 19.74 1why s ALA 163 CO 0.25 -2.02 -0.14 0.21 0.00 0.00 0.00 175.76 174.06 1why s LYS 164 N -4.98 1.69 0.16 0.00 2.20 -1.26 -4.60 119.74 112.95 1why s LYS 164 Ca 0.62 -0.48 -0.25 0.00 -0.36 0.00 0.00 55.97 55.50 1why s LYS 164 Cb -0.17 -1.42 0.06 0.00 -1.51 0.00 0.00 37.83 34.79 1why s LYS 164 CO 0.56 0.11 0.94 -1.54 -0.36 0.00 0.00 175.35 175.06 1why s SER 165 N 0.38 -0.19 0.12 1.43 1.04 -1.26 -5.17 113.70 110.05 1why s SER 165 Ca -0.10 -0.40 0.00 0.00 0.48 0.00 0.00 55.95 55.93 1why s SER 165 Cb -0.14 0.50 0.00 0.00 0.10 0.00 0.00 66.02 66.49 1why s SER 165 CO 0.03 -0.92 0.00 0.61 0.98 0.00 0.00 173.24 173.94 1why n GLY 166 N -0.46 1.48 3.69 7.32 0.00 -1.26 -5.04 105.19 110.91 1why n GLY 166 Ca -0.06 -2.05 -0.42 0.00 0.00 0.00 0.00 46.02 43.49 1why n GLY 166 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1why s PRO 167 N -1.26 4.26 -0.03 1.61 0.04 -1.26 -4.94 135.00 133.42 1why s PRO 167 Ca 0.00 2.02 -0.25 0.00 0.04 0.00 0.00 61.00 62.81 1why s PRO 167 Cb 0.00 -3.61 -0.20 0.00 0.04 0.00 0.00 34.50 30.73 1why s PRO 167 CO 0.00 -0.62 1.15 0.66 0.04 0.00 0.00 177.00 178.23 1why h SER 168 N 8.04 -0.07 -3.23 6.66 4.64 -2.07 -3.44 113.55 124.08 1why h SER 168 Ca -0.38 -0.47 -0.28 0.00 -0.47 0.00 0.00 61.79 60.19 1why h SER 168 Cb 1.18 0.02 -0.34 0.00 -0.31 0.00 0.00 62.40 62.94 1why h SER 168 CO 0.91 0.46 -0.63 -0.55 -0.87 0.00 0.00 176.83 176.15 1why s SER 169 N -5.63 0.44 0.00 4.97 0.15 -1.26 -5.34 113.70 107.03 1why s SER 169 Ca -0.15 0.30 0.00 0.00 0.70 0.00 0.00 55.95 56.80 1why s SER 169 Cb 0.01 0.21 0.00 0.00 -1.71 0.00 0.00 66.02 64.54 1why s SER 169 CO 0.63 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 175.47