#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ksm h ALA 74 N 0.00 -0.54 -2.45 4.61 0.00 -2.08 -3.44 119.26 115.36 2ksm h ALA 74 Ca 0.00 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 2ksm h ALA 74 Cb 0.00 0.71 -0.25 0.00 0.00 0.00 0.00 17.79 18.26 2ksm h ALA 74 CO 0.00 -0.60 -0.19 0.45 0.00 0.00 0.00 179.25 178.91 2ksm s SER 75 N -3.23 -0.64 0.08 0.00 0.15 -1.26 -5.16 113.70 103.64 2ksm s SER 75 Ca -0.04 1.08 -0.03 0.00 0.70 0.00 0.00 55.95 57.66 2ksm s SER 75 Cb 0.02 0.97 -0.05 0.00 -1.71 0.00 0.00 66.02 65.26 2ksm s SER 75 CO 0.17 -0.20 0.27 0.00 1.20 0.00 0.00 173.24 174.68 2ksm s ALA 76 N 1.33 3.91 -0.25 5.45 0.00 -1.26 -4.72 121.76 126.22 2ksm s ALA 76 Ca -0.09 -0.71 -0.09 0.00 0.00 0.00 0.00 51.96 51.07 2ksm s ALA 76 Cb -0.07 -1.96 0.01 0.00 0.00 0.00 0.00 23.12 21.10 2ksm s ALA 76 CO -0.13 0.75 0.22 1.28 0.00 0.00 0.00 175.76 177.88 2ksm n LEU 77 N 0.34 -5.64 -4.05 0.00 4.77 -1.26 -5.03 117.00 106.13 2ksm n LEU 77 Ca -0.05 0.68 -0.09 0.00 -0.03 0.00 0.00 56.01 56.52 2ksm n LEU 77 Cb 0.52 -2.49 -0.09 0.00 -2.33 0.00 0.00 43.42 39.02 2ksm n LEU 77 CO 0.49 -1.95 -0.23 -0.94 -1.33 0.00 0.00 177.39 173.43 2ksm s SER 78 N -1.57 0.28 0.02 -1.43 1.04 -1.26 -5.15 113.70 105.63 2ksm s SER 78 Ca 0.11 -1.00 -0.14 0.00 0.48 0.00 0.00 55.95 55.40 2ksm s SER 78 Cb -0.02 0.30 -0.06 0.00 0.10 0.00 0.00 66.02 66.35 2ksm s SER 78 CO 0.54 -0.72 0.41 -0.76 0.98 0.00 0.00 173.24 173.69 2ksm s LEU 79 N -2.97 4.44 -0.41 2.42 1.02 -1.26 -5.05 118.68 116.88 2ksm s LEU 79 Ca 0.15 0.94 0.05 0.00 0.02 0.00 0.00 54.13 55.29 2ksm s LEU 79 Cb 0.06 -2.70 0.18 0.00 0.02 0.00 0.00 46.19 43.76 2ksm s LEU 79 CO -0.04 0.28 0.70 -0.44 0.02 0.00 0.00 176.35 176.88 2ksm s SER 80 N -1.25 -1.34 0.13 2.29 0.01 -1.26 -4.96 113.70 107.32 2ksm s SER 80 Ca 0.26 -0.77 0.03 0.00 1.31 0.00 0.00 55.95 56.78 2ksm s SER 80 Cb -0.16 1.72 -0.04 0.00 0.21 0.00 0.00 66.02 67.75 2ksm s SER 80 CO 0.15 -0.14 -0.07 -1.48 0.41 0.00 0.00 173.24 172.11 2ksm s LEU 81 N 1.77 2.47 0.08 2.44 2.34 -1.26 -4.49 118.68 122.02 2ksm s LEU 81 Ca 0.17 -1.03 0.07 0.00 0.06 0.00 0.00 54.13 53.40 2ksm s LEU 81 Cb -0.02 -0.19 -0.03 0.00 -0.56 0.00 0.00 46.19 45.39 2ksm s LEU 81 CO -0.08 -0.42 -0.19 -0.76 -1.06 0.00 0.00 176.35 173.83 2ksm s LEU 82 N -3.12 2.25 -0.05 1.48 1.02 -1.20 -4.39 118.68 114.67 2ksm s LEU 82 Ca 0.16 -0.62 -0.01 0.00 0.02 0.00 0.00 54.13 53.68 2ksm s LEU 82 Cb 0.04 -0.83 0.03 0.00 0.02 0.00 0.00 46.19 45.44 2ksm s LEU 82 CO -0.01 0.06 -0.00 -0.44 0.02 0.00 0.00 176.35 175.98 2ksm s SER 83 N -1.64 1.18 -0.04 2.29 0.01 -0.97 -1.95 113.70 112.58 2ksm s SER 83 Ca 0.05 -0.07 -0.02 0.00 1.31 0.00 0.00 55.95 57.23 2ksm s SER 83 Cb -0.10 -0.37 0.03 0.00 0.21 0.00 0.00 66.02 65.80 2ksm s SER 83 CO 0.03 -0.15 0.05 -0.63 0.41 0.00 0.00 173.24 172.95 2ksm s ILE 84 N 1.59 -0.05 -0.04 1.44 1.01 -0.98 -2.35 121.20 121.81 2ksm s ILE 84 Ca -0.01 0.38 0.06 0.00 0.00 0.00 0.00 60.65 61.08 2ksm s ILE 84 Cb -0.13 -0.19 -0.01 0.00 0.01 0.00 0.00 42.46 42.14 2ksm s ILE 84 CO -0.03 0.18 -0.22 -0.94 0.00 0.00 0.00 174.94 173.93 2ksm s SER 85 N 2.08 2.73 -0.16 3.58 1.04 -1.02 -2.17 113.70 119.77 2ksm s SER 85 Ca 0.04 -0.45 -0.04 0.00 0.48 0.00 0.00 55.95 55.98 2ksm s SER 85 Cb -0.12 -0.65 0.07 0.00 0.10 0.00 0.00 66.02 65.42 2ksm s SER 85 CO -0.03 0.23 0.13 -0.13 0.98 0.00 0.00 173.24 174.42 2ksm s ARG 86 N -0.20 0.09 -0.31 4.02 0.52 -1.05 -2.97 118.95 119.05 2ksm s ARG 86 Ca -0.01 0.08 0.05 0.00 -0.52 0.00 0.00 55.73 55.33 2ksm s ARG 86 Cb -0.12 -1.45 0.19 0.00 0.52 0.00 0.00 34.95 34.09 2ksm s ARG 86 CO 0.02 -0.62 1.14 0.45 0.02 0.00 0.00 175.30 176.32 2ksm n SER 87 N 5.30 -1.29 0.00 0.23 2.88 -0.98 -1.69 113.62 118.06 2ksm n SER 87 Ca -0.06 -1.89 0.00 0.00 -1.33 0.00 0.00 58.87 55.59 2ksm n SER 87 Cb 0.49 0.87 0.00 0.00 -0.75 0.00 0.00 64.21 64.82 2ksm n SER 87 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ksm n GLY 88 N -0.59 0.52 0.41 0.46 0.00 -1.26 -4.98 105.19 99.75 2ksm n GLY 88 Ca -0.16 -0.73 0.20 0.00 0.00 0.00 0.00 46.02 45.33 2ksm n GLY 88 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2ksm h ASN 89 N 0.00 0.00 -2.69 1.61 2.35 -1.96 -3.39 115.58 111.49 2ksm h ASN 89 Ca 0.00 0.00 -0.59 0.00 -0.55 0.00 0.00 56.30 55.16 2ksm h ASN 89 Cb 0.00 0.00 -0.11 0.00 0.05 0.00 0.00 38.32 38.26 2ksm h ASN 89 CO 0.00 0.00 -0.66 0.42 -1.65 0.00 0.00 177.43 175.54 2ksm s THR 90 N -4.45 3.61 0.02 2.81 -4.23 -1.26 -3.40 115.64 108.75 2ksm s THR 90 Ca -0.03 -1.58 0.09 0.00 -1.18 0.00 0.00 61.69 58.98 2ksm s THR 90 Cb 0.13 -2.85 -0.03 0.00 1.34 0.00 0.00 72.50 71.10 2ksm s THR 90 CO 0.45 -0.19 -0.25 0.68 -0.54 0.00 0.00 174.62 174.77 2ksm s VAL 91 N -1.89 2.20 -0.22 2.29 -7.23 -1.13 -4.53 120.40 109.88 2ksm s VAL 91 Ca 0.28 -1.28 0.02 0.00 -1.81 0.00 0.00 61.98 59.19 2ksm s VAL 91 Cb -0.08 -1.83 0.04 0.00 0.56 0.00 0.00 36.38 35.06 2ksm s VAL 91 CO 0.19 0.43 -0.15 0.42 -0.31 0.00 0.00 175.10 175.68 2ksm s THR 92 N -0.76 2.20 -0.05 5.32 -4.23 -1.16 -2.61 115.64 114.35 2ksm s THR 92 Ca 0.11 -1.24 0.03 0.00 -1.18 0.00 0.00 61.69 59.42 2ksm s THR 92 Cb -0.10 -2.10 0.00 0.00 1.34 0.00 0.00 72.50 71.64 2ksm s THR 92 CO 0.01 0.27 -0.15 -0.76 -0.54 0.00 0.00 174.62 173.45 2ksm s LEU 93 N 1.22 1.81 -0.16 4.79 1.02 -1.11 -2.45 118.68 123.81 2ksm s LEU 93 Ca -0.01 -0.33 -0.08 0.00 0.02 0.00 0.00 54.13 53.72 2ksm s LEU 93 Cb -0.16 -0.91 0.06 0.00 0.02 0.00 0.00 46.19 45.19 2ksm s LEU 93 CO -0.09 0.10 0.38 0.27 0.02 0.00 0.00 176.35 177.03 2ksm s ILE 94 N 0.32 -0.09 -0.72 -0.59 -4.36 -0.99 -2.19 121.20 112.58 2ksm s ILE 94 Ca -0.09 0.12 0.00 0.00 -0.26 0.00 0.00 60.65 60.41 2ksm s ILE 94 Cb -0.13 -0.57 0.00 0.00 1.25 0.00 0.00 42.46 43.00 2ksm s ILE 94 CO 0.03 0.05 0.00 0.61 0.24 0.00 0.00 174.94 175.87 2ksm n GLY 95 N 4.39 -0.76 2.97 6.27 0.00 -1.24 -2.28 105.19 114.54 2ksm n GLY 95 Ca -0.22 -0.72 -0.22 0.00 0.00 0.00 0.00 46.02 44.85 2ksm n GLY 95 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2ksm s ASP 96 N -4.00 1.38 0.16 1.61 1.11 -1.26 -2.73 116.67 112.94 2ksm s ASP 96 Ca 0.00 -0.22 0.06 0.00 0.18 0.00 0.00 52.55 52.57 2ksm s ASP 96 Cb 0.00 -0.64 -0.04 0.00 1.07 0.00 0.00 42.92 43.31 2ksm s ASP 96 CO 0.00 -0.00 0.09 -0.36 1.18 0.00 0.00 175.17 176.07 2ksm s PHE 97 N 0.73 3.04 0.03 4.23 0.40 0.12 -4.90 117.98 121.63 2ksm s PHE 97 Ca -0.13 -0.06 -0.18 0.00 -0.60 0.00 0.00 56.93 55.97 2ksm s PHE 97 Cb -0.15 -1.47 -0.26 0.00 0.51 0.00 0.00 43.02 41.66 2ksm s PHE 97 CO 0.02 0.52 1.10 -1.00 0.70 0.00 0.00 175.22 176.56 2ksm h PRO 98 N 2.55 0.52 -5.01 0.24 0.13 -1.82 -0.05 132.00 128.55 2ksm h PRO 98 Ca -0.47 -0.61 -0.57 0.00 -0.87 0.00 0.00 66.00 63.48 2ksm h PRO 98 Cb 1.20 0.19 -0.13 0.00 0.13 0.00 0.00 31.00 32.39 2ksm h PRO 98 CO 0.61 1.24 -0.49 -0.51 -0.23 0.00 0.00 178.00 178.62 2ksm s ASP 99 N -7.06 2.76 -0.15 1.44 1.01 -1.26 -3.36 116.67 110.04 2ksm s ASP 99 Ca -0.12 -1.74 0.01 0.00 0.71 0.00 0.00 52.55 51.41 2ksm s ASP 99 Cb 0.04 0.60 -0.23 0.00 1.01 0.00 0.00 42.92 44.34 2ksm s ASP 99 CO 0.87 -1.00 0.22 -1.84 0.21 0.00 0.00 175.17 173.63 2ksm n GLU 100 N -0.92 0.70 0.29 8.23 0.28 -1.26 -4.10 120.64 123.87 2ksm n GLU 100 Ca -0.05 0.21 0.15 0.00 -0.16 0.00 0.00 57.16 57.32 2ksm n GLU 100 Cb 0.64 -1.65 0.90 0.00 1.43 0.00 0.00 31.44 32.76 2ksm n GLU 100 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2ksm h ALA 101 N 0.27 1.46 -0.55 -1.84 0.00 -2.03 -1.26 119.26 115.30 2ksm h ALA 101 Ca -0.46 -0.02 0.12 0.00 0.00 0.00 0.00 54.91 54.55 2ksm h ALA 101 Cb 2.01 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.77 2ksm h ALA 101 CO 0.03 0.03 0.38 0.00 0.00 0.00 0.00 179.25 179.69 2ksm h ALA 102 N 1.98 2.21 -0.57 0.00 0.00 -2.00 0.10 119.26 120.98 2ksm h ALA 102 Ca -0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2ksm h ALA 102 Cb 0.06 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2ksm h ALA 102 CO 0.00 -0.35 0.29 1.57 0.00 0.00 0.00 179.25 180.76 2ksm h LYS 103 N 0.23 0.79 -0.64 0.00 2.10 -1.46 -2.65 116.57 114.94 2ksm h LYS 103 Ca 0.26 -0.09 0.10 0.00 -2.00 0.00 0.00 60.65 58.93 2ksm h LYS 103 Cb 0.73 -0.16 -0.08 0.00 -0.90 0.00 0.00 32.23 31.82 2ksm h LYS 103 CO -0.05 0.60 0.25 0.00 -2.00 0.00 0.00 179.45 178.25 2ksm h ALA 104 N 1.53 0.85 -0.37 0.07 0.00 -0.94 1.02 119.26 121.41 2ksm h ALA 104 Ca 0.20 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.17 2ksm h ALA 104 Cb 0.05 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2ksm h ALA 104 CO -0.03 -0.18 0.10 0.00 0.00 0.00 0.00 179.25 179.14 2ksm h ALA 105 N 1.44 1.48 0.10 0.00 0.00 -1.54 -2.44 119.26 118.30 2ksm h ALA 105 Ca 0.33 -0.14 -0.16 0.00 0.00 0.00 0.00 54.91 54.94 2ksm h ALA 105 Cb 0.42 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 18.06 2ksm h ALA 105 CO -0.32 0.38 -0.73 1.25 0.00 0.00 0.00 179.25 179.84 2ksm h LEU 106 N 0.54 0.34 -0.67 0.00 6.46 -1.12 -3.35 115.31 117.51 2ksm h LEU 106 Ca 0.13 -0.93 0.13 0.00 -0.12 0.00 0.00 57.88 57.08 2ksm h LEU 106 Cb 0.19 -0.11 -0.13 0.00 -0.73 0.00 0.00 40.66 39.88 2ksm h LEU 106 CO -0.01 1.34 -0.24 0.24 -0.62 0.00 0.00 178.44 179.16 2ksm h MET 107 N -0.53 -0.06 -0.77 1.25 2.86 0.12 0.98 114.93 118.79 2ksm h MET 107 Ca -0.14 0.00 0.22 0.00 -2.06 0.00 0.00 59.70 57.73 2ksm h MET 107 Cb 1.50 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 33.15 2ksm h MET 107 CO 0.09 -0.04 0.77 1.79 1.06 0.00 0.00 176.91 180.59 2ksm h THR 108 N -0.06 0.25 -0.14 2.22 1.35 -1.57 1.31 112.91 116.27 2ksm h THR 108 Ca 0.30 0.00 -0.22 0.00 -0.55 0.00 0.00 66.41 65.94 2ksm h THR 108 Cb 0.53 0.39 0.01 0.00 -1.73 0.00 0.00 68.15 67.35 2ksm h THR 108 CO -0.71 0.00 -0.77 0.00 -0.25 0.00 0.00 175.52 173.78 2ksm h ALA 109 N 1.17 0.37 -0.32 6.62 0.00 0.85 -3.23 119.26 124.73 2ksm h ALA 109 Ca 0.36 -0.60 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 2ksm h ALA 109 Cb 1.91 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.66 2ksm h ALA 109 CO -0.00 0.70 0.07 1.25 0.00 0.00 0.00 179.25 181.26 2ksm h LEU 110 N 0.49 0.49 -0.60 0.00 5.85 0.19 -2.08 115.31 119.64 2ksm h LEU 110 Ca -0.05 -0.24 0.00 0.00 0.84 0.00 0.00 57.88 58.43 2ksm h LEU 110 Cb 1.39 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.29 2ksm h LEU 110 CO 0.15 0.60 0.50 -1.13 -0.34 0.00 0.00 178.44 178.23 2ksm h ASN 111 N 0.35 0.00 0.51 1.25 -1.24 -1.30 1.46 115.58 116.61 2ksm h ASN 111 Ca 0.10 0.00 -0.29 0.00 0.71 0.00 0.00 56.30 56.81 2ksm h ASN 111 Cb 0.31 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.34 2ksm h ASN 111 CO 0.00 0.00 -1.56 1.23 -1.29 0.00 0.00 177.43 175.81 2ksm h GLY 112 N 0.00 0.16 0.25 1.57 0.00 -1.48 -3.37 103.07 100.19 2ksm h GLY 112 Ca 0.00 -0.40 -0.35 0.00 0.00 0.00 0.00 47.33 46.57 2ksm h GLY 112 CO 0.00 0.35 -2.23 -0.10 0.00 0.00 0.00 176.54 174.57 2ksm n LEU 113 N -3.32 0.58 -3.61 3.11 7.94 0.43 -4.96 117.00 117.17 2ksm n LEU 113 Ca -0.16 0.09 -0.52 0.00 -1.11 0.00 0.00 56.01 54.32 2ksm n LEU 113 Cb 1.03 0.23 -0.08 0.00 0.53 0.00 0.00 43.42 45.14 2ksm n LEU 113 CO 0.47 0.53 0.92 -0.11 -1.11 0.00 0.00 177.39 178.09 2ksm n LEU 114 N -2.89 0.90 -4.62 -1.96 0.00 0.25 -4.93 117.00 103.76 2ksm n LEU 114 Ca -0.30 0.88 -0.25 0.00 0.00 0.00 0.00 56.01 56.34 2ksm n LEU 114 Cb 1.11 -0.68 -0.09 0.00 0.00 0.00 0.00 43.42 43.77 2ksm n LEU 114 CO 0.42 -0.64 -0.32 0.00 0.00 0.00 0.00 177.39 176.85 2ksm s ALA 115 N 2.48 3.16 -0.23 1.96 0.00 -1.26 -4.98 121.76 122.88 2ksm s ALA 115 Ca 0.81 -1.97 -0.29 0.00 0.00 0.00 0.00 51.96 50.52 2ksm s ALA 115 Cb -1.15 -0.34 -0.02 0.00 0.00 0.00 0.00 23.12 21.61 2ksm s ALA 115 CO 0.62 0.08 1.46 -1.25 0.00 0.00 0.00 175.76 176.67 2ksm s PRO 116 N -3.69 3.92 0.00 0.00 0.04 -1.26 -2.41 135.00 131.59 2ksm s PRO 116 Ca 0.34 1.54 0.00 0.00 0.04 0.00 0.00 61.00 62.93 2ksm s PRO 116 Cb -0.00 -3.94 0.00 0.00 0.04 0.00 0.00 34.50 30.60 2ksm s PRO 116 CO 0.19 -1.13 0.00 0.41 0.04 0.00 0.00 177.00 176.51 2ksm n GLY 117 N 4.36 0.73 3.77 0.56 0.00 -1.26 -5.04 105.19 108.31 2ksm n GLY 117 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 2ksm n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ksm s VAL 118 N -2.82 2.98 -0.10 1.61 0.11 -1.01 -5.02 120.40 116.14 2ksm s VAL 118 Ca 0.00 0.98 -0.05 0.00 -2.93 0.00 0.00 61.98 59.98 2ksm s VAL 118 Cb 0.00 -3.62 -0.04 0.00 -1.53 0.00 0.00 36.38 31.20 2ksm s VAL 118 CO 0.00 0.22 0.10 0.21 -3.33 0.00 0.00 175.10 172.30 2ksm s ASN 119 N -0.66 6.03 -0.01 3.54 3.84 -1.22 -4.93 114.94 121.54 2ksm s ASN 119 Ca 0.48 0.36 0.05 0.00 0.21 0.00 0.00 52.86 53.96 2ksm s ASN 119 Cb -0.37 -1.88 -0.01 0.00 -0.55 0.00 0.00 41.25 38.44 2ksm s ASN 119 CO 0.48 0.39 -0.17 -0.69 -2.79 0.00 0.00 177.10 174.32 2ksm s VAL 120 N -1.01 1.36 -0.42 -5.21 1.01 -1.26 -2.86 120.40 112.01 2ksm s VAL 120 Ca 0.16 -0.73 0.04 0.00 0.00 0.00 0.00 61.98 61.45 2ksm s VAL 120 Cb -0.12 -1.13 0.17 0.00 0.00 0.00 0.00 36.38 35.31 2ksm s VAL 120 CO 0.05 0.38 0.36 -0.38 0.00 0.00 0.00 175.10 175.51 2ksm n ILE 121 N 2.69 -1.12 -4.07 2.22 5.41 -1.07 -4.97 119.36 118.44 2ksm n ILE 121 Ca -0.15 -3.49 -0.34 0.00 1.00 0.00 0.00 62.75 59.76 2ksm n ILE 121 Cb 0.54 -1.68 -0.14 0.00 -0.71 0.00 0.00 39.64 37.65 2ksm n ILE 121 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 176.55 178.06 2ksm s ASP 122 N -0.05 4.15 -0.27 4.38 -4.77 -1.26 -2.73 116.67 116.12 2ksm s ASP 122 Ca 0.33 -0.40 0.01 0.00 -3.30 0.00 0.00 52.55 49.18 2ksm s ASP 122 Cb 0.05 -1.69 0.08 0.00 -1.09 0.00 0.00 42.92 40.26 2ksm s ASP 122 CO -0.19 0.01 0.01 -1.10 0.70 0.00 0.00 175.17 174.60 2ksm s GLN 123 N 1.26 1.27 0.01 2.11 -1.52 -0.93 -5.00 119.66 116.86 2ksm s GLN 123 Ca 0.03 -1.11 0.09 0.00 -1.95 0.00 0.00 55.36 52.42 2ksm s GLN 123 Cb -0.14 -2.49 -0.02 0.00 -0.22 0.00 0.00 33.01 30.13 2ksm s GLN 123 CO -0.03 -0.76 -0.26 0.42 -0.25 0.00 0.00 175.29 174.41 2ksm s ILE 124 N 1.41 2.06 0.07 1.08 1.01 -1.26 -3.60 121.20 121.98 2ksm s ILE 124 Ca 0.01 -1.23 0.01 0.00 0.00 0.00 0.00 60.65 59.44 2ksm s ILE 124 Cb -0.18 -1.73 -0.04 0.00 0.01 0.00 0.00 42.46 40.51 2ksm s ILE 124 CO -0.12 0.46 0.16 -1.00 0.00 0.00 0.00 174.94 174.45 2ksm s HIS 125 N -0.70 3.39 0.15 3.97 3.76 -1.11 -4.86 115.29 119.89 2ksm s HIS 125 Ca 0.11 0.17 -0.16 0.00 -0.15 0.00 0.00 55.06 55.03 2ksm s HIS 125 Cb -0.10 -1.70 -0.07 0.00 1.11 0.00 0.00 32.58 31.82 2ksm s HIS 125 CO 0.01 0.56 0.59 0.08 -0.85 0.00 0.00 174.74 175.12 2ksm s VAL 126 N -1.49 4.78 0.10 -0.90 1.01 -1.26 0.11 120.40 122.75 2ksm s VAL 126 Ca 0.33 0.99 -0.08 0.00 0.00 0.00 0.00 61.98 63.21 2ksm s VAL 126 Cb -0.13 -3.79 -0.00 0.00 0.00 0.00 0.00 36.38 32.46 2ksm s VAL 126 CO 0.26 0.29 0.19 -1.81 0.00 0.00 0.00 175.10 174.03 2ksm s ASP 127 N -1.60 0.12 0.00 3.32 1.11 -0.03 -4.92 116.67 114.67 2ksm s ASP 127 Ca 0.37 -0.69 0.00 0.00 0.18 0.00 0.00 52.55 52.41 2ksm s ASP 127 Cb -0.16 0.35 0.00 0.00 1.07 0.00 0.00 42.92 44.18 2ksm s ASP 127 CO 0.19 -0.75 0.78 -2.65 1.18 0.00 0.00 175.17 173.93 2ksm n PRO 128 N -0.08 0.00 -2.76 8.23 -0.02 -1.26 -4.29 135.00 134.82 2ksm n PRO 128 Ca -0.14 0.78 -0.09 0.00 -2.02 0.00 0.00 63.50 62.03 2ksm n PRO 128 Cb 0.62 -1.27 0.08 0.00 -0.02 0.00 0.00 33.50 32.91 2ksm n PRO 128 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 2ksm n VAL 129 N -2.13 0.14 -1.64 -1.45 0.24 -1.26 -4.75 118.33 107.47 2ksm n VAL 129 Ca 0.00 -2.08 -0.51 0.00 -2.04 0.00 0.00 64.34 59.71 2ksm n VAL 129 Cb 0.00 0.96 -0.06 0.00 -1.47 0.00 0.00 33.84 33.28 2ksm n VAL 129 CO 0.00 0.00 0.00 0.55 -2.14 0.00 0.00 176.83 175.24 2ksm n VAL 130 N -0.13 0.12 -2.00 3.34 3.14 -1.26 -4.80 118.33 116.74 2ksm n VAL 130 Ca 0.05 -0.02 -0.39 0.00 -2.96 0.00 0.00 64.34 61.02 2ksm n VAL 130 Cb 0.78 -1.20 -0.03 0.00 -1.06 0.00 0.00 33.84 32.33 2ksm n VAL 130 CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 2ksm s ARG 131 N 1.57 2.67 0.37 1.45 0.52 -1.26 -4.66 118.95 119.61 2ksm s ARG 131 Ca 0.86 0.76 0.05 0.00 -0.52 0.00 0.00 55.73 56.88 2ksm s ARG 131 Cb -0.87 -4.38 -0.03 0.00 0.52 0.00 0.00 34.95 30.19 2ksm s ARG 131 CO 0.48 -2.67 0.19 -1.54 0.02 0.00 0.00 175.30 171.78 2ksm s SER 132 N 8.16 2.29 0.17 0.23 1.04 -1.26 -4.74 113.70 119.59 2ksm s SER 132 Ca 0.71 -1.70 -0.31 0.00 0.48 0.00 0.00 55.95 55.13 2ksm s SER 132 Cb -0.14 0.53 -0.08 0.00 0.10 0.00 0.00 66.02 66.43 2ksm s SER 132 CO 0.23 -0.98 1.34 -0.76 0.98 0.00 0.00 173.24 174.04 2ksm s LEU 133 N -3.51 4.40 -0.81 2.42 1.02 -1.26 -4.89 118.68 116.05 2ksm s LEU 133 Ca 0.30 2.38 -0.25 0.00 0.02 0.00 0.00 54.13 56.58 2ksm s LEU 133 Cb 0.02 -3.60 -0.06 0.00 0.02 0.00 0.00 46.19 42.58 2ksm s LEU 133 CO 0.19 -0.58 2.03 -1.81 0.02 0.00 0.00 176.35 176.20 2ksm s ASP 134 N 0.65 4.92 0.48 2.29 1.01 -1.26 -4.77 116.67 119.99 2ksm s ASP 134 Ca 0.60 -0.28 0.32 0.00 0.71 0.00 0.00 52.55 53.90 2ksm s ASP 134 Cb -0.37 -2.55 1.75 0.00 1.01 0.00 0.00 42.92 42.76 2ksm s ASP 134 CO 0.35 -2.87 1.99 -0.26 0.21 0.00 0.00 175.17 174.59 2ksm h PHE 135 N 12.64 0.00 -1.39 4.23 0.04 -1.93 -2.90 116.94 127.63 2ksm h PHE 135 Ca -0.00 0.00 0.46 0.00 2.80 0.00 0.00 57.97 61.23 2ksm h PHE 135 Cb 1.05 0.00 -0.13 0.00 2.20 0.00 0.00 35.95 39.07 2ksm h PHE 135 CO 1.16 0.00 0.91 0.77 -0.60 0.00 0.00 178.31 180.55 2ksm h SER 136 N 0.00 0.21 -0.34 2.17 0.02 -1.90 0.92 113.55 114.62 2ksm h SER 136 Ca 0.00 0.13 -0.26 0.00 -0.84 0.00 0.00 61.79 60.83 2ksm h SER 136 Cb 0.00 0.13 -0.22 0.00 0.14 0.00 0.00 62.40 62.45 2ksm h SER 136 CO 0.00 -0.19 -0.68 -1.20 -1.14 0.00 0.00 176.83 173.62 2ksm n SER 137 N -4.64 3.09 0.13 3.07 7.64 -1.09 -4.63 113.62 117.19 2ksm n SER 137 Ca 0.39 -3.70 0.05 0.00 1.01 0.00 0.00 58.87 56.61 2ksm n SER 137 Cb 1.52 -0.44 0.03 0.00 -1.01 0.00 0.00 64.21 64.32 2ksm n SER 137 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ksm h ALA 138 N 1.57 0.72 0.38 -0.43 0.00 0.75 -3.23 119.26 119.02 2ksm h ALA 138 Ca 0.15 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 2ksm h ALA 138 Cb 1.28 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 2ksm h ALA 138 CO 0.34 0.48 -0.33 0.93 0.00 0.00 0.00 179.25 180.67 2ksm h GLU 139 N 0.00 -0.67 -1.00 0.00 4.39 -1.79 1.82 114.58 117.32 2ksm h GLU 139 Ca -0.03 0.05 0.21 0.00 0.34 0.00 0.00 59.36 59.92 2ksm h GLU 139 Cb 1.30 0.15 -0.11 0.00 -0.10 0.00 0.00 28.75 29.99 2ksm h GLU 139 CO 0.04 -0.45 0.61 -1.00 -1.16 0.00 0.00 179.01 177.05 2ksm h PRO 140 N -0.70 0.69 0.12 2.33 0.13 -1.93 0.90 132.00 133.55 2ksm h PRO 140 Ca -0.05 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 65.03 2ksm h PRO 140 Cb 0.59 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 31.57 2ksm h PRO 140 CO -0.01 0.46 -0.06 0.28 -0.23 0.00 0.00 178.00 178.44 2ksm h VAL 141 N 0.71 0.00 -1.06 1.56 2.07 -1.42 -2.46 116.25 115.65 2ksm h VAL 141 Ca 0.60 -0.25 0.29 0.00 0.82 0.00 0.00 66.70 68.16 2ksm h VAL 141 Cb 0.99 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.65 2ksm h VAL 141 CO -0.41 0.00 0.66 0.15 0.02 0.00 0.00 177.57 177.99 2ksm h PHE 142 N -0.41 0.78 -0.04 1.57 3.57 0.30 1.54 116.94 124.25 2ksm h PHE 142 Ca -0.02 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.46 2ksm h PHE 142 Cb 0.12 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.63 2ksm h PHE 142 CO 0.05 -0.00 -0.22 1.79 -2.23 0.00 0.00 178.31 177.70 2ksm h THR 143 N 0.40 1.18 0.00 4.41 1.35 0.77 0.12 112.91 121.14 2ksm h THR 143 Ca 0.65 -0.82 0.00 0.00 -0.55 0.00 0.00 66.41 65.69 2ksm h THR 143 Cb 1.58 1.39 0.00 0.00 -1.73 0.00 0.00 68.15 69.39 2ksm h THR 143 CO -0.40 0.24 0.00 0.00 -0.25 0.00 0.00 175.52 175.11 2ksm h ALA 144 N 1.73 1.00 -0.18 6.62 0.00 0.27 -2.37 119.26 126.33 2ksm h ALA 144 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2ksm h ALA 144 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2ksm h ALA 144 CO 0.03 0.00 0.00 0.45 0.00 0.00 0.00 179.25 179.73 2ksm n SER 145 N -2.84 2.38 -0.20 0.00 2.88 -0.10 -4.55 113.62 111.19 2ksm n SER 145 Ca 0.01 -1.77 -0.08 0.00 -1.33 0.00 0.00 58.87 55.70 2ksm n SER 145 Cb 0.28 -0.12 0.02 0.00 -0.75 0.00 0.00 64.21 63.65 2ksm n SER 145 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 2ksm h VAL 146 N 1.68 1.25 0.00 2.46 2.07 -0.29 -2.54 116.25 120.88 2ksm h VAL 146 Ca 0.00 -0.88 0.00 0.00 0.82 0.00 0.00 66.70 66.64 2ksm h VAL 146 Cb 0.57 0.72 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 2ksm h VAL 146 CO 0.00 0.33 0.00 -0.81 0.02 0.00 0.00 177.57 177.11 2ksm n PRO 147 N -4.39 0.56 -3.45 1.57 -0.04 -1.26 -4.02 135.00 123.97 2ksm n PRO 147 Ca 0.03 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.21 2ksm n PRO 147 Cb 0.23 -1.26 -0.11 0.00 -0.04 0.00 0.00 33.50 32.32 2ksm n PRO 147 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2ksm s ILE 148 N -1.09 0.38 -1.96 0.52 1.01 -0.96 -4.97 121.20 114.14 2ksm s ILE 148 Ca 0.00 -2.28 0.00 0.00 0.00 0.00 0.00 60.65 58.37 2ksm s ILE 148 Cb 0.00 -1.28 0.00 0.00 0.01 0.00 0.00 42.46 41.19 2ksm s ILE 148 CO 0.00 -1.10 0.75 -0.81 0.00 0.00 0.00 174.94 173.78 2ksm n PRO 149 N 3.39 0.77 -0.93 2.79 -0.04 -1.26 -2.59 135.00 137.13 2ksm n PRO 149 Ca 0.21 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.67 2ksm n PRO 149 Cb 0.42 -1.02 0.16 0.00 -0.04 0.00 0.00 33.50 33.03 2ksm n PRO 149 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2ksm n ASP 150 N -0.47 2.25 -4.96 3.54 8.00 -1.15 -2.33 116.55 121.43 2ksm n ASP 150 Ca 0.00 -3.76 -0.22 0.00 0.71 0.00 0.00 54.79 51.51 2ksm n ASP 150 Cb 0.01 -0.48 -0.02 0.00 -0.02 0.00 0.00 41.12 40.61 2ksm n ASP 150 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2ksm s PHE 151 N -3.15 3.46 -0.04 1.24 5.36 -0.68 -4.10 117.98 120.07 2ksm s PHE 151 Ca 0.40 0.15 0.02 0.00 -0.96 0.00 0.00 56.93 56.54 2ksm s PHE 151 Cb 0.38 -1.75 0.01 0.00 -0.34 0.00 0.00 43.02 41.32 2ksm s PHE 151 CO -0.05 0.27 -0.08 0.20 -1.46 0.00 0.00 175.22 174.09 2ksm s GLY 152 N -4.02 0.54 -0.14 13.12 0.00 -0.78 -2.52 107.32 113.53 2ksm s GLY 152 Ca 0.37 -0.24 0.01 0.00 0.00 0.00 0.00 44.72 44.86 2ksm s GLY 152 CO 0.32 0.14 -0.15 -2.27 0.00 0.00 0.00 173.10 171.14 2ksm s LEU 153 N 0.53 1.71 -0.04 0.66 1.98 -0.92 -3.22 118.68 119.37 2ksm s LEU 153 Ca -0.08 -0.48 0.01 0.00 -2.89 0.00 0.00 54.13 50.69 2ksm s LEU 153 Cb -0.12 -1.17 0.02 0.00 0.66 0.00 0.00 46.19 45.58 2ksm s LEU 153 CO 0.01 -0.03 -0.06 -0.75 -1.89 0.00 0.00 176.35 173.62 2ksm s LYS 154 N 1.35 0.95 -0.08 1.98 2.47 -1.14 -2.32 119.74 122.95 2ksm s LYS 154 Ca 0.02 -0.18 0.03 0.00 -1.56 0.00 0.00 55.97 54.29 2ksm s LYS 154 Cb -0.13 -0.90 -0.02 0.00 -1.46 0.00 0.00 37.83 35.32 2ksm s LYS 154 CO -0.08 -0.03 -0.18 0.08 0.16 0.00 0.00 175.35 175.29 2ksm s VAL 155 N 0.73 2.63 0.00 4.02 1.01 -0.82 -1.13 120.40 126.84 2ksm s VAL 155 Ca -0.11 -0.85 0.00 0.00 0.00 0.00 0.00 61.98 61.02 2ksm s VAL 155 Cb -0.14 -2.03 0.00 0.00 0.00 0.00 0.00 36.38 34.22 2ksm s VAL 155 CO 0.01 0.56 0.00 -0.62 0.00 0.00 0.00 175.10 175.05 2ksm n GLU 156 N 2.97 3.87 0.10 2.72 1.02 0.14 -3.23 120.64 128.22 2ksm n GLU 156 Ca -0.18 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 56.92 2ksm n GLU 156 Cb 0.52 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.92 2ksm n GLU 156 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2ksm h ARG 157 N 0.00 -0.24 0.00 3.49 3.08 -1.99 -3.38 114.38 115.33 2ksm h ARG 157 Ca 0.00 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.07 2ksm h ARG 157 Cb 0.00 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.11 2ksm h ARG 157 CO 0.00 -0.16 -0.12 -0.25 -1.07 0.00 0.00 179.97 178.36 2ksm n ASP 158 N -2.93 1.54 -4.28 7.04 9.92 -1.26 -4.81 116.55 121.77 2ksm n ASP 158 Ca -0.03 -2.50 -0.15 0.00 -0.53 0.00 0.00 54.79 51.58 2ksm n ASP 158 Cb 0.10 -0.27 -0.10 0.00 -0.64 0.00 0.00 41.12 40.20 2ksm n ASP 158 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 2ksm s THR 159 N -1.66 1.07 -0.03 -3.53 2.01 -1.26 -4.25 115.64 107.98 2ksm s THR 159 Ca 0.17 -2.04 0.01 0.00 0.31 0.00 0.00 61.69 60.13 2ksm s THR 159 Cb 0.15 -2.05 0.02 0.00 0.01 0.00 0.00 72.50 70.63 2ksm s THR 159 CO 0.02 -0.57 -0.02 -0.69 -0.69 0.00 0.00 174.62 172.67 2ksm s VAL 160 N -3.40 0.32 0.01 3.82 1.01 0.70 0.28 120.40 123.14 2ksm s VAL 160 Ca 0.22 -0.00 0.02 0.00 0.00 0.00 0.00 61.98 62.22 2ksm s VAL 160 Cb 0.04 -0.39 -0.04 0.00 0.00 0.00 0.00 36.38 36.00 2ksm s VAL 160 CO 0.04 0.18 -0.01 -0.89 0.00 0.00 0.00 175.10 174.42 2ksm s THR 161 N 0.95 4.09 -0.10 3.92 2.01 -0.28 -2.37 115.64 123.85 2ksm s THR 161 Ca -0.11 -0.68 0.01 0.00 0.31 0.00 0.00 61.69 61.23 2ksm s THR 161 Cb -0.14 -2.84 0.02 0.00 0.01 0.00 0.00 72.50 69.55 2ksm s THR 161 CO -0.01 0.34 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.36 2ksm s LEU 162 N -1.67 1.63 -0.11 4.42 2.01 0.42 -2.88 118.68 122.51 2ksm s LEU 162 Ca 0.20 -0.39 -0.05 0.00 0.01 0.00 0.00 54.13 53.90 2ksm s LEU 162 Cb -0.11 -1.01 0.05 0.00 0.01 0.00 0.00 46.19 45.12 2ksm s LEU 162 CO 0.11 -0.00 0.26 0.42 1.01 0.00 0.00 176.35 178.15 2ksm s THR 163 N 1.05 -0.08 -0.23 5.49 -4.23 -1.20 -1.64 115.64 114.81 2ksm s THR 163 Ca -0.06 0.16 -0.16 0.00 -1.18 0.00 0.00 61.69 60.45 2ksm s THR 163 Cb -0.15 -0.40 0.07 0.00 1.34 0.00 0.00 72.50 73.36 2ksm s THR 163 CO -0.02 0.06 0.58 -0.83 -0.54 0.00 0.00 174.62 173.87 2ksm s GLY 164 N 1.39 -0.49 -0.04 3.99 0.00 -1.26 -1.86 107.32 109.05 2ksm s GLY 164 Ca -0.08 1.92 -0.30 0.00 0.00 0.00 0.00 44.72 46.26 2ksm s GLY 164 CO -0.09 1.88 1.40 -0.51 0.00 0.00 0.00 173.10 175.78 2ksm s THR 165 N 1.12 3.84 -0.51 0.90 -4.23 -1.26 -3.78 115.64 111.72 2ksm s THR 165 Ca -0.06 1.16 0.03 0.00 -1.18 0.00 0.00 61.69 61.63 2ksm s THR 165 Cb -0.06 -3.74 0.13 0.00 1.34 0.00 0.00 72.50 70.17 2ksm s THR 165 CO -0.11 -0.04 0.26 0.00 -0.54 0.00 0.00 174.62 174.19 2ksm s ALA 166 N 2.85 3.30 -0.63 3.99 0.00 -1.26 -4.94 121.76 125.07 2ksm s ALA 166 Ca 0.63 -3.17 0.00 0.00 0.00 0.00 0.00 51.96 49.42 2ksm s ALA 166 Cb -0.29 -2.22 0.00 0.00 0.00 0.00 0.00 23.12 20.61 2ksm s ALA 166 CO 0.24 -1.99 0.60 -2.30 0.00 0.00 0.00 175.76 172.32 2ksm n PRO 167 N 3.33 0.00 0.00 0.00 -0.02 -1.26 -3.37 135.00 133.68 2ksm n PRO 167 Ca 0.05 0.17 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 2ksm n PRO 167 Cb 0.34 -1.68 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 2ksm n PRO 167 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2ksm n SER 168 N -1.10 0.00 0.00 2.55 7.64 -1.26 -5.12 113.62 116.32 2ksm n SER 168 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2ksm n SER 168 Cb 0.18 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.38 2ksm n SER 168 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2ksm n SER 169 N -0.45 0.00 0.28 6.43 7.64 -1.22 -4.93 113.62 121.39 2ksm n SER 169 Ca 0.00 0.00 0.18 0.00 1.01 0.00 0.00 58.87 60.06 2ksm n SER 169 Cb 0.00 0.00 0.93 0.00 -1.01 0.00 0.00 64.21 64.13 2ksm n SER 169 CO 0.00 0.00 0.00 1.05 -3.01 0.00 0.00 175.04 173.08 2ksm h GLU 170 N 0.00 0.00 -0.94 1.43 4.11 -2.01 -1.77 114.58 115.40 2ksm h GLU 170 Ca 0.00 0.00 0.27 0.00 0.07 0.00 0.00 59.36 59.70 2ksm h GLU 170 Cb 0.00 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 2ksm h GLU 170 CO 0.00 0.00 0.70 1.25 0.07 0.00 0.00 179.01 181.03 2ksm h HIS 171 N 0.00 0.00 0.00 2.06 2.76 -1.95 0.86 115.15 118.88 2ksm h HIS 171 Ca 0.04 0.00 -0.12 0.00 -2.20 0.00 0.00 60.37 58.09 2ksm h HIS 171 Cb 0.46 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.40 2ksm h HIS 171 CO 0.00 0.00 -0.74 -0.22 -1.30 0.00 0.00 177.93 175.67 2ksm h LYS 172 N 0.00 0.00 0.20 5.26 3.11 -1.71 -3.37 116.57 120.06 2ksm h LYS 172 Ca 0.45 0.00 0.01 0.00 -2.81 0.00 0.00 60.65 58.30 2ksm h LYS 172 Cb 1.84 0.00 -0.04 0.00 -1.00 0.00 0.00 32.23 33.03 2ksm h LYS 172 CO -0.00 0.43 -0.39 0.22 -2.81 0.00 0.00 179.45 176.89 2ksm h ASP 173 N 0.00 -1.12 -0.96 4.20 1.82 0.61 -1.43 116.42 119.54 2ksm h ASP 173 Ca -0.04 0.12 0.28 0.00 -0.39 0.00 0.00 57.03 56.99 2ksm h ASP 173 Cb 1.42 0.41 -0.04 0.00 0.68 0.00 0.00 39.33 41.80 2ksm h ASP 173 CO 0.06 -0.49 0.70 0.00 -1.61 0.00 0.00 179.24 177.90 2ksm h ALA 174 N -0.19 2.90 -0.12 -0.78 0.00 -1.70 0.29 119.26 119.66 2ksm h ALA 174 Ca 0.01 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.70 2ksm h ALA 174 Cb 0.67 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 2ksm h ALA 174 CO -0.18 -1.19 -0.69 0.28 0.00 0.00 0.00 179.25 177.47 2ksm h VAL 175 N 0.00 1.34 -0.17 0.00 2.07 -1.46 -2.86 116.25 115.17 2ksm h VAL 175 Ca 0.46 -2.01 -0.04 0.00 0.82 0.00 0.00 66.70 65.93 2ksm h VAL 175 Cb 1.85 1.99 -0.01 0.00 -1.52 0.00 0.00 31.29 33.60 2ksm h VAL 175 CO -0.00 0.62 -0.04 0.50 0.02 0.00 0.00 177.57 178.66 2ksm h LYS 176 N 0.37 0.32 -0.93 1.57 3.64 -0.03 -2.85 116.57 118.66 2ksm h LYS 176 Ca -0.02 -0.12 0.05 0.00 -1.27 0.00 0.00 60.65 59.29 2ksm h LYS 176 Cb 1.26 -0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 33.01 2ksm h LYS 176 CO 0.13 0.59 0.61 -0.09 -2.27 0.00 0.00 179.45 178.42 2ksm h ARG 177 N 0.03 1.08 -0.95 1.90 2.43 -1.46 -1.03 114.38 116.39 2ksm h ARG 177 Ca 0.04 -0.07 0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2ksm h ARG 177 Cb 0.47 -0.24 -0.05 0.00 -0.42 0.00 0.00 29.97 29.73 2ksm h ARG 177 CO 0.02 0.72 0.62 0.00 -1.51 0.00 0.00 179.97 179.81 2ksm h ALA 178 N 1.48 1.21 -0.07 2.80 0.00 -1.39 -2.41 119.26 120.87 2ksm h ALA 178 Ca 0.39 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.20 2ksm h ALA 178 Cb 0.12 -0.39 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 2ksm h ALA 178 CO -0.14 0.61 -0.08 0.00 0.00 0.00 0.00 179.25 179.64 2ksm h ALA 179 N 1.34 0.11 -0.48 0.00 0.00 -1.05 -3.01 119.26 116.17 2ksm h ALA 179 Ca 0.35 -0.29 0.10 0.00 0.00 0.00 0.00 54.91 55.06 2ksm h ALA 179 Cb -0.14 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 17.54 2ksm h ALA 179 CO -0.07 -0.07 -0.09 1.79 0.00 0.00 0.00 179.25 180.81 2ksm h THR 180 N -0.26 0.54 0.00 0.00 1.35 -1.04 0.77 112.91 114.28 2ksm h THR 180 Ca 0.01 -0.01 -0.02 0.00 -0.55 0.00 0.00 66.41 65.84 2ksm h THR 180 Cb 0.60 0.52 -0.00 0.00 -1.73 0.00 0.00 68.15 67.53 2ksm h THR 180 CO 0.02 0.00 -0.10 0.77 -0.25 0.00 0.00 175.52 175.96 2ksm h SER 181 N 0.03 0.00 0.50 5.36 4.64 -1.49 -2.05 113.55 120.54 2ksm h SER 181 Ca 0.23 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.27 2ksm h SER 181 Cb 0.36 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.40 2ksm h SER 181 CO -0.47 0.10 -1.70 0.35 -0.87 0.00 0.00 176.83 174.24 2ksm n THR 182 N -3.96 1.60 -3.35 2.95 -2.24 0.37 -4.61 114.28 105.05 2ksm n THR 182 Ca -0.02 -0.79 -0.26 0.00 -2.27 0.00 0.00 64.05 60.71 2ksm n THR 182 Cb 0.19 -1.04 -0.09 0.00 -2.10 0.00 0.00 70.33 67.30 2ksm n THR 182 CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 2ksm n TRP 183 N -3.04 0.31 0.09 4.78 8.01 0.24 -4.92 117.44 122.91 2ksm n TRP 183 Ca -0.17 -3.62 -0.15 0.00 -1.31 0.00 0.00 57.50 52.25 2ksm n TRP 183 Cb 1.05 -0.20 -0.14 0.00 -2.01 0.00 0.00 31.31 30.01 2ksm n TRP 183 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 2ksm h PRO 184 N 4.68 0.24 0.00 -0.99 0.13 -1.61 -3.26 132.00 131.19 2ksm h PRO 184 Ca 0.16 -0.42 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 2ksm h PRO 184 Cb 0.85 0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.13 2ksm h PRO 184 CO 0.50 1.18 0.00 -0.25 -0.23 0.00 0.00 178.00 179.21 2ksm n ASP 185 N -3.50 0.00 -4.43 1.44 9.92 -1.26 -4.70 116.55 114.02 2ksm n ASP 185 Ca -0.09 -0.69 -0.33 0.00 -0.53 0.00 0.00 54.79 53.16 2ksm n ASP 185 Cb 1.02 -0.07 -0.14 0.00 -0.64 0.00 0.00 41.12 41.29 2ksm n ASP 185 CO 0.00 0.00 0.00 -0.04 0.13 0.00 0.00 177.20 177.29 2ksm s MET 186 N -2.14 2.64 0.11 -1.24 -1.94 -1.23 -5.08 119.30 110.41 2ksm s MET 186 Ca 0.38 -0.73 -0.31 0.00 -1.71 0.00 0.00 55.69 53.32 2ksm s MET 186 Cb 0.19 -2.38 -0.09 0.00 2.01 0.00 0.00 34.83 34.56 2ksm s MET 186 CO 0.35 0.52 1.58 0.15 -0.01 0.00 0.00 175.02 177.62 2ksm s LYS 187 N -0.48 4.22 -0.19 2.03 1.02 -1.26 -4.84 119.74 120.24 2ksm s LYS 187 Ca 0.06 2.30 0.01 0.00 0.02 0.00 0.00 55.97 58.36 2ksm s LYS 187 Cb -0.12 -3.40 0.02 0.00 -0.52 0.00 0.00 37.83 33.81 2ksm s LYS 187 CO 0.02 -0.65 -0.19 0.42 -0.92 0.00 0.00 175.35 174.03 2ksm s ILE 188 N 1.93 2.13 -0.32 2.17 1.01 -1.25 -0.22 121.20 126.66 2ksm s ILE 188 Ca 0.71 -0.95 0.03 0.00 0.00 0.00 0.00 60.65 60.45 2ksm s ILE 188 Cb -0.41 -1.92 0.09 0.00 0.01 0.00 0.00 42.46 40.24 2ksm s ILE 188 CO 0.31 0.51 0.01 0.54 0.00 0.00 0.00 174.94 176.31 2ksm s VAL 189 N 1.29 2.29 -0.63 2.92 0.11 -1.00 -4.99 120.40 120.40 2ksm s VAL 189 Ca 0.04 -2.12 -0.16 0.00 -2.93 0.00 0.00 61.98 56.81 2ksm s VAL 189 Cb -0.13 -2.59 0.15 0.00 -1.53 0.00 0.00 36.38 32.27 2ksm s VAL 189 CO -0.12 -0.43 0.61 0.20 -3.33 0.00 0.00 175.10 172.03 2ksm s ASN 190 N 0.99 6.34 -0.69 3.54 -0.87 -1.26 -0.43 114.94 122.55 2ksm s ASN 190 Ca 0.05 -1.96 -0.03 0.00 -1.57 0.00 0.00 52.86 49.35 2ksm s ASN 190 Cb -0.19 -2.23 0.18 0.00 -0.02 0.00 0.00 41.25 38.98 2ksm s ASN 190 CO -0.07 -0.84 0.53 0.20 -2.57 0.00 0.00 177.10 174.35 2ksm s ASN 191 N 3.27 5.47 0.48 -1.22 0.01 -0.65 -5.00 114.94 117.29 2ksm s ASN 191 Ca 0.09 -3.02 -0.23 0.00 -0.71 0.00 0.00 52.86 48.98 2ksm s ASN 191 Cb -0.24 -1.89 -0.08 0.00 0.41 0.00 0.00 41.25 39.45 2ksm s ASN 191 CO 0.00 -0.34 1.20 -0.38 -1.51 0.00 0.00 177.10 176.07 2ksm n ILE 192 N 3.28 2.98 -3.55 0.60 5.41 -1.26 -4.61 119.36 122.20 2ksm n ILE 192 Ca 0.11 -0.50 -0.28 0.00 1.00 0.00 0.00 62.75 63.08 2ksm n ILE 192 Cb 0.38 -1.46 -0.15 0.00 -0.71 0.00 0.00 39.64 37.70 2ksm n ILE 192 CO 0.00 0.00 0.00 -0.70 0.00 0.00 0.00 176.55 175.85 2ksm s GLU 193 N -2.40 0.16 -0.30 0.38 2.12 -1.25 -4.99 118.70 112.42 2ksm s GLU 193 Ca 0.66 -0.41 -0.29 0.00 0.36 0.00 0.00 54.97 55.29 2ksm s GLU 193 Cb -0.48 -1.30 0.00 0.00 0.26 0.00 0.00 34.13 32.61 2ksm s GLU 193 CO 0.54 -0.94 1.33 0.08 -0.54 0.00 0.00 175.26 175.73 2ksm s VAL 194 N 2.12 4.09 0.17 3.70 1.01 -1.26 -4.15 120.40 126.08 2ksm s VAL 194 Ca 0.07 1.23 0.03 0.00 0.00 0.00 0.00 61.98 63.31 2ksm s VAL 194 Cb -0.16 -4.13 -0.05 0.00 0.00 0.00 0.00 36.38 32.04 2ksm s VAL 194 CO -0.30 -0.49 -0.05 0.42 0.00 0.00 0.00 175.10 174.68 2ksm s THR 195 N 4.51 0.95 0.00 3.92 -4.23 -1.26 -4.83 115.64 114.70 2ksm s THR 195 Ca 0.57 -2.02 0.00 0.00 -1.18 0.00 0.00 61.69 59.07 2ksm s THR 195 Cb -0.17 -2.01 0.00 0.00 1.34 0.00 0.00 72.50 71.66 2ksm s THR 195 CO 0.24 -0.60 0.00 0.61 -0.54 0.00 0.00 174.62 174.33 2ksm n GLY 196 N -0.24 1.76 7.00 3.99 0.00 -1.26 -4.96 105.19 111.48 2ksm n GLY 196 Ca -0.08 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.71 2ksm n GLY 196 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2ksm n GLN 197 N 0.00 0.00 -1.90 1.61 1.13 -1.26 -4.52 117.38 112.44 2ksm n GLN 197 Ca 0.00 0.00 -0.31 0.00 -1.94 0.00 0.00 57.00 54.75 2ksm n GLN 197 Cb 0.00 0.00 0.01 0.00 0.11 0.00 0.00 30.24 30.36 2ksm n GLN 197 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2ksm s ALA 198 N -1.45 3.06 0.77 -1.58 0.00 -1.26 -5.05 121.76 116.26 2ksm s ALA 198 Ca 0.00 -0.05 -0.11 0.00 0.00 0.00 0.00 51.96 51.80 2ksm s ALA 198 Cb 0.00 -3.09 0.05 0.00 0.00 0.00 0.00 23.12 20.08 2ksm s ALA 198 CO 0.00 -0.69 1.08 -1.25 0.00 0.00 0.00 175.76 174.90 2ksm s PRO 199 N -5.06 2.29 0.95 0.00 0.04 -1.26 -5.00 135.00 126.96 2ksm s PRO 199 Ca 0.56 1.01 -0.22 0.00 0.04 0.00 0.00 61.00 62.38 2ksm s PRO 199 Cb -0.11 -1.91 -0.10 0.00 0.04 0.00 0.00 34.50 32.41 2ksm s PRO 199 CO 0.52 -1.57 -1.01 -2.30 0.04 0.00 0.00 177.00 172.68 2ksm n PRO 200 N -3.45 -0.39 -3.31 0.56 -0.02 -1.26 -4.97 135.00 122.16 2ksm n PRO 200 Ca 0.08 -0.11 -0.25 0.00 -2.02 0.00 0.00 63.50 61.20 2ksm n PRO 200 Cb 0.54 -1.14 -0.08 0.00 -0.02 0.00 0.00 33.50 32.80 2ksm n PRO 200 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ksm n GLY 201 N 3.14 2.89 3.45 -1.23 0.00 -1.26 -5.13 105.19 107.05 2ksm n GLY 201 Ca -0.01 -1.66 -0.33 0.00 0.00 0.00 0.00 46.02 44.02 2ksm n GLY 201 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2ksm n PRO 202 N 1.82 -0.20 0.00 1.61 -0.02 -1.26 -5.35 135.00 131.60 2ksm n PRO 202 Ca 0.25 -0.01 0.08 0.00 -2.02 0.00 0.00 63.50 61.80 2ksm n PRO 202 Cb 0.49 -1.90 0.50 0.00 -0.02 0.00 0.00 33.50 32.58 2ksm n PRO 202 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13