#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ksm n ALA 74 N 0.00 2.56 -2.03 4.61 0.00 -1.26 -4.30 120.51 120.09 2ksm n ALA 74 Ca 0.00 -0.16 -0.41 0.00 0.00 0.00 0.00 53.44 52.87 2ksm n ALA 74 Cb 0.00 -1.41 -0.00 0.00 0.00 0.00 0.00 19.45 18.04 2ksm n ALA 74 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2ksm n SER 75 N -0.93 6.00 0.00 0.00 7.64 -1.26 -4.76 113.62 120.32 2ksm n SER 75 Ca 0.19 -3.01 0.00 0.00 1.01 0.00 0.00 58.87 57.06 2ksm n SER 75 Cb 0.09 -1.49 0.00 0.00 -1.01 0.00 0.00 64.21 61.80 2ksm n SER 75 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ksm n ALA 76 N 3.69 0.00 -2.78 -0.43 0.00 -1.26 -5.16 120.51 114.57 2ksm n ALA 76 Ca 0.52 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.60 2ksm n ALA 76 Cb 0.32 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.69 2ksm n ALA 76 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2ksm s LEU 77 N 0.00 4.13 0.02 0.00 1.43 -1.26 -5.10 118.68 117.90 2ksm s LEU 77 Ca 0.00 0.25 0.02 0.00 -1.03 0.00 0.00 54.13 53.36 2ksm s LEU 77 Cb 0.00 -2.04 -0.04 0.00 0.03 0.00 0.00 46.19 44.14 2ksm s LEU 77 CO 0.00 0.24 0.02 -0.44 0.23 0.00 0.00 176.35 176.40 2ksm s SER 78 N -0.02 5.24 -0.10 2.29 0.01 -1.26 -5.11 113.70 114.75 2ksm s SER 78 Ca 0.09 -0.01 -0.05 0.00 1.31 0.00 0.00 55.95 57.29 2ksm s SER 78 Cb -0.12 -1.38 0.04 0.00 0.21 0.00 0.00 66.02 64.78 2ksm s SER 78 CO 0.00 0.25 0.23 -0.76 0.41 0.00 0.00 173.24 173.38 2ksm s LEU 79 N -1.77 0.53 0.12 2.44 1.02 -1.26 -4.31 118.68 115.46 2ksm s LEU 79 Ca 0.22 0.49 -0.24 0.00 0.02 0.00 0.00 54.13 54.61 2ksm s LEU 79 Cb -0.12 0.69 0.07 0.00 0.02 0.00 0.00 46.19 46.86 2ksm s LEU 79 CO 0.13 -0.15 0.64 -0.44 0.02 0.00 0.00 176.35 176.55 2ksm s SER 80 N 1.13 -0.55 0.29 2.29 0.01 -1.24 -4.80 113.70 110.82 2ksm s SER 80 Ca -0.08 0.05 0.11 0.00 1.31 0.00 0.00 55.95 57.34 2ksm s SER 80 Cb -0.10 0.57 -0.05 0.00 0.21 0.00 0.00 66.02 66.66 2ksm s SER 80 CO -0.07 -0.90 -0.11 -0.76 0.41 0.00 0.00 173.24 171.81 2ksm s LEU 81 N -2.60 2.83 0.10 2.44 1.02 -1.26 -4.36 118.68 116.86 2ksm s LEU 81 Ca 0.01 -0.91 0.07 0.00 0.02 0.00 0.00 54.13 53.32 2ksm s LEU 81 Cb -0.01 -1.32 -0.03 0.00 0.02 0.00 0.00 46.19 44.85 2ksm s LEU 81 CO -0.11 -0.01 -0.18 -0.22 0.02 0.00 0.00 176.35 175.85 2ksm s LEU 82 N -3.59 2.32 -0.04 1.79 2.96 -0.87 -4.68 118.68 116.57 2ksm s LEU 82 Ca 0.31 -0.70 -0.01 0.00 -0.22 0.00 0.00 54.13 53.51 2ksm s LEU 82 Cb -0.05 -0.72 0.03 0.00 0.50 0.00 0.00 46.19 45.96 2ksm s LEU 82 CO 0.17 -0.02 0.04 -0.55 -1.32 0.00 0.00 176.35 174.67 2ksm s SER 83 N -2.00 0.96 -0.05 3.68 0.15 -1.13 -2.10 113.70 113.21 2ksm s SER 83 Ca 0.05 0.05 -0.01 0.00 0.70 0.00 0.00 55.95 56.74 2ksm s SER 83 Cb -0.09 -0.17 0.03 0.00 -1.71 0.00 0.00 66.02 64.08 2ksm s SER 83 CO 0.04 -0.21 0.01 -0.63 1.20 0.00 0.00 173.24 173.65 2ksm s ILE 84 N 1.87 0.20 -0.04 6.45 1.01 -0.27 -2.31 121.20 128.11 2ksm s ILE 84 Ca 0.01 0.17 0.04 0.00 0.00 0.00 0.00 60.65 60.87 2ksm s ILE 84 Cb -0.12 -0.35 -0.00 0.00 0.01 0.00 0.00 42.46 42.00 2ksm s ILE 84 CO -0.03 0.20 -0.16 -0.94 0.00 0.00 0.00 174.94 174.01 2ksm s SER 85 N 1.61 2.03 -0.16 3.58 1.04 -0.17 -0.66 113.70 120.96 2ksm s SER 85 Ca -0.01 -0.33 -0.04 0.00 0.48 0.00 0.00 55.95 56.04 2ksm s SER 85 Cb -0.13 -0.60 0.06 0.00 0.10 0.00 0.00 66.02 65.45 2ksm s SER 85 CO -0.03 0.13 0.07 -0.13 0.98 0.00 0.00 173.24 174.26 2ksm s ARG 86 N 0.12 0.25 -0.30 4.02 0.52 -0.78 -2.19 118.95 120.59 2ksm s ARG 86 Ca -0.05 -0.15 -0.16 0.00 -0.52 0.00 0.00 55.73 54.86 2ksm s ARG 86 Cb -0.12 -1.80 0.17 0.00 0.52 0.00 0.00 34.95 33.73 2ksm s ARG 86 CO 0.02 -0.62 1.15 0.45 0.02 0.00 0.00 175.30 176.32 2ksm s SER 87 N 2.05 -0.24 0.00 0.23 0.15 -1.18 -1.36 113.70 113.35 2ksm s SER 87 Ca 0.01 0.14 0.00 0.00 0.70 0.00 0.00 55.95 56.81 2ksm s SER 87 Cb -0.16 1.20 0.00 0.00 -1.71 0.00 0.00 66.02 65.35 2ksm s SER 87 CO -0.08 -0.05 0.00 0.61 1.20 0.00 0.00 173.24 174.92 2ksm n GLY 88 N 5.45 0.46 0.10 9.45 0.00 -1.26 -4.75 105.19 114.64 2ksm n GLY 88 Ca -0.07 -2.03 0.03 0.00 0.00 0.00 0.00 46.02 43.95 2ksm n GLY 88 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2ksm n ASN 89 N 0.00 0.81 -4.72 1.61 3.02 -1.26 -4.92 115.26 109.81 2ksm n ASN 89 Ca 0.00 0.35 -0.25 0.00 -0.03 0.00 0.00 54.58 54.64 2ksm n ASN 89 Cb 0.00 0.31 -0.07 0.00 -0.61 0.00 0.00 39.78 39.41 2ksm n ASN 89 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2ksm s THR 90 N -3.04 3.98 0.03 3.41 -4.23 -1.26 -3.19 115.64 111.34 2ksm s THR 90 Ca -0.03 -1.40 0.08 0.00 -1.18 0.00 0.00 61.69 59.16 2ksm s THR 90 Cb 0.09 -3.05 -0.03 0.00 1.34 0.00 0.00 72.50 70.85 2ksm s THR 90 CO 0.81 -0.18 -0.25 -0.69 -0.54 0.00 0.00 174.62 173.77 2ksm s VAL 91 N -1.88 2.01 -0.22 2.29 1.01 -1.13 -4.33 120.40 118.15 2ksm s VAL 91 Ca 0.30 -1.26 0.00 0.00 0.00 0.00 0.00 61.98 61.02 2ksm s VAL 91 Cb -0.09 -1.70 0.06 0.00 0.00 0.00 0.00 36.38 34.64 2ksm s VAL 91 CO 0.21 0.39 -0.05 -0.89 0.00 0.00 0.00 175.10 174.77 2ksm s THR 92 N -0.74 1.37 -0.12 3.92 2.01 -0.93 -2.44 115.64 118.72 2ksm s THR 92 Ca 0.10 -1.04 -0.02 0.00 0.31 0.00 0.00 61.69 61.04 2ksm s THR 92 Cb -0.10 -1.63 0.04 0.00 0.01 0.00 0.00 72.50 70.82 2ksm s THR 92 CO 0.01 -0.06 0.04 -0.76 -0.69 0.00 0.00 174.62 173.16 2ksm s LEU 93 N 1.48 0.63 -0.03 4.42 1.02 -1.16 -1.00 118.68 124.04 2ksm s LEU 93 Ca -0.04 -0.35 0.01 0.00 0.02 0.00 0.00 54.13 53.78 2ksm s LEU 93 Cb -0.18 -0.40 0.01 0.00 0.02 0.00 0.00 46.19 45.65 2ksm s LEU 93 CO -0.07 -0.26 -0.05 -0.63 0.02 0.00 0.00 176.35 175.36 2ksm s ILE 94 N 2.00 0.51 0.00 -0.59 1.01 -0.98 -2.26 121.20 120.90 2ksm s ILE 94 Ca 0.03 -0.16 0.00 0.00 0.00 0.00 0.00 60.65 60.51 2ksm s ILE 94 Cb -0.14 -0.51 0.00 0.00 0.01 0.00 0.00 42.46 41.82 2ksm s ILE 94 CO -0.06 0.20 0.00 0.61 0.00 0.00 0.00 174.94 175.68 2ksm n GLY 95 N 3.67 0.90 3.02 6.18 0.00 -1.23 -2.84 105.19 114.89 2ksm n GLY 95 Ca -0.22 -0.53 -0.28 0.00 0.00 0.00 0.00 46.02 45.00 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 2.00 2.30 0.24 1.61 1.11 -1.26 -2.71 116.67 119.96 2ksm s ASP 96 Ca 0.00 -0.39 0.06 0.00 0.18 0.00 0.00 52.55 52.40 2ksm s ASP 96 Cb 0.00 -1.01 -0.03 0.00 1.07 0.00 0.00 42.92 42.95 2ksm s ASP 96 CO 0.00 -0.01 0.31 -0.36 1.18 0.00 0.00 175.17 176.29 2ksm s PHE 97 N 1.10 3.36 0.07 4.23 0.40 0.14 -4.86 117.98 122.42 2ksm s PHE 97 Ca -0.05 -0.04 -0.16 0.00 -0.60 0.00 0.00 56.93 56.08 2ksm s PHE 97 Cb -0.14 -1.53 -0.16 0.00 0.51 0.00 0.00 43.02 41.70 2ksm s PHE 97 CO -0.03 0.46 1.28 -1.00 0.70 0.00 0.00 175.22 176.64 2ksm h PRO 98 N 1.28 0.65 0.00 0.24 0.13 -1.84 -0.32 132.00 132.15 2ksm h PRO 98 Ca -0.51 -0.50 -0.15 0.00 -0.87 0.00 0.00 66.00 63.98 2ksm h PRO 98 Cb 1.23 0.09 -0.04 0.00 0.13 0.00 0.00 31.00 32.42 2ksm h PRO 98 CO 0.61 1.12 -0.11 -3.47 -0.23 0.00 0.00 178.00 175.91 2ksm n ASP 99 N -4.14 -0.46 0.00 1.44 2.03 -1.26 -3.92 116.55 110.24 2ksm n ASP 99 Ca -0.07 -1.84 -0.20 0.00 0.52 0.00 0.00 54.79 53.20 2ksm n ASP 99 Cb 0.63 0.92 -0.14 0.00 -0.72 0.00 0.00 41.12 41.81 2ksm n ASP 99 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2ksm n GLU 100 N -0.25 0.74 0.30 -0.67 -0.58 -1.26 -4.00 120.64 114.92 2ksm n GLU 100 Ca 0.01 0.27 0.17 0.00 -0.42 0.00 0.00 57.16 57.19 2ksm n GLU 100 Cb 0.25 -1.72 0.94 0.00 -0.57 0.00 0.00 31.44 30.34 2ksm n GLU 100 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2ksm h ALA 101 N 0.21 1.33 -0.32 0.62 0.00 -2.03 -1.74 119.26 117.33 2ksm h ALA 101 Ca -0.40 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2ksm h ALA 101 Cb 2.03 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.80 2ksm h ALA 101 CO 0.09 0.03 0.20 0.00 0.00 0.00 0.00 179.25 179.57 2ksm h ALA 102 N 1.97 1.75 -0.50 0.00 0.00 -1.99 -1.73 119.26 118.76 2ksm h ALA 102 Ca -0.00 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2ksm h ALA 102 Cb 0.09 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2ksm h ALA 102 CO 0.00 0.23 0.25 1.57 0.00 0.00 0.00 179.25 181.30 2ksm h LYS 103 N 0.44 0.69 -0.99 0.00 2.10 -1.53 -2.47 116.57 114.82 2ksm h LYS 103 Ca 0.12 -0.08 0.07 0.00 -2.00 0.00 0.00 60.65 58.76 2ksm h LYS 103 Cb -0.03 -0.14 -0.07 0.00 -0.90 0.00 0.00 32.23 31.10 2ksm h LYS 103 CO -0.02 0.53 0.64 0.00 -2.00 0.00 0.00 179.45 178.60 2ksm h ALA 104 N 1.58 1.39 -0.36 0.07 0.00 -1.45 0.95 119.26 121.42 2ksm h ALA 104 Ca 0.18 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 2ksm h ALA 104 Cb 0.06 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 2ksm h ALA 104 CO -0.03 0.41 -0.08 0.00 0.00 0.00 0.00 179.25 179.55 2ksm h ALA 105 N 1.46 1.18 0.00 0.00 0.00 -1.52 -1.62 119.26 118.76 2ksm h ALA 105 Ca 0.43 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 2ksm h ALA 105 Cb 0.20 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 2ksm h ALA 105 CO -0.18 0.53 -0.14 1.25 0.00 0.00 0.00 179.25 180.70 2ksm h LEU 106 N 0.57 0.00 -0.67 0.00 7.12 -1.21 -3.35 115.31 117.77 2ksm h LEU 106 Ca 0.11 -0.87 0.14 0.00 0.13 0.00 0.00 57.88 57.39 2ksm h LEU 106 Cb 0.48 0.00 -0.12 0.00 -0.53 0.00 0.00 40.66 40.49 2ksm h LEU 106 CO 0.03 1.02 -0.07 0.24 -0.13 0.00 0.00 178.44 179.52 2ksm h MET 107 N -1.00 0.06 -0.19 1.25 2.86 0.89 1.38 114.93 120.17 2ksm h MET 107 Ca -0.04 -0.00 0.06 0.00 -2.06 0.00 0.00 59.70 57.65 2ksm h MET 107 Cb 0.96 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.60 2ksm h MET 107 CO -0.02 0.04 0.62 1.79 1.06 0.00 0.00 176.91 180.40 2ksm h THR 108 N 0.06 0.07 0.18 2.22 1.35 -1.42 1.31 112.91 116.69 2ksm h THR 108 Ca 0.34 0.00 -0.31 0.00 -0.55 0.00 0.00 66.41 65.89 2ksm h THR 108 Cb 0.56 0.42 0.03 0.00 -1.73 0.00 0.00 68.15 67.42 2ksm h THR 108 CO -0.63 0.00 -1.35 0.00 -0.25 0.00 0.00 175.52 173.29 2ksm h ALA 109 N 0.93 -0.06 -0.84 6.62 0.00 0.17 -3.27 119.26 122.82 2ksm h ALA 109 Ca 0.09 -0.82 0.01 0.00 0.00 0.00 0.00 54.91 54.18 2ksm h ALA 109 Cb 1.34 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 19.22 2ksm h ALA 109 CO -0.00 0.73 0.55 -0.07 0.00 0.00 0.00 179.25 180.46 2ksm h LEU 110 N 0.19 0.97 -0.62 0.00 3.38 0.19 -1.29 115.31 118.14 2ksm h LEU 110 Ca -0.21 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.73 2ksm h LEU 110 Cb 2.03 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 42.54 2ksm h LEU 110 CO 0.25 0.71 0.68 -1.13 0.09 0.00 0.00 178.44 179.05 2ksm h ASN 111 N 1.14 0.00 0.61 -0.43 -0.00 -1.47 2.03 115.58 117.47 2ksm h ASN 111 Ca 0.31 0.00 -0.28 0.00 -0.00 0.00 0.00 56.30 56.33 2ksm h ASN 111 Cb -0.12 0.00 -0.02 0.00 -0.00 0.00 0.00 38.32 38.18 2ksm h ASN 111 CO -0.06 0.00 -1.40 1.23 -0.00 0.00 0.00 177.43 177.20 2ksm h GLY 112 N 0.00 0.17 0.27 1.57 0.00 -1.42 -3.35 103.07 100.31 2ksm h GLY 112 Ca 0.00 -0.43 -0.13 0.00 0.00 0.00 0.00 47.33 46.77 2ksm h GLY 112 CO 0.00 0.38 -1.91 1.04 0.00 0.00 0.00 176.54 176.04 2ksm n LEU 113 N -3.37 0.23 -4.48 3.11 4.32 0.62 -4.94 117.00 112.50 2ksm n LEU 113 Ca -0.12 0.10 -0.60 0.00 -0.02 0.00 0.00 56.01 55.37 2ksm n LEU 113 Cb 1.02 0.15 -0.10 0.00 -1.62 0.00 0.00 43.42 42.86 2ksm n LEU 113 CO 0.49 0.15 1.52 -0.11 -1.22 0.00 0.00 177.39 178.22 2ksm n LEU 114 N -2.55 1.32 -4.60 2.23 7.94 0.24 -4.92 117.00 116.66 2ksm n LEU 114 Ca -0.13 0.84 -0.24 0.00 -1.11 0.00 0.00 56.01 55.37 2ksm n LEU 114 Cb 0.78 -0.98 -0.09 0.00 0.53 0.00 0.00 43.42 43.66 2ksm n LEU 114 CO 0.44 -0.73 -0.34 0.00 -1.11 0.00 0.00 177.39 175.65 2ksm s ALA 115 N 5.01 3.11 -0.11 1.96 0.00 -1.26 -4.99 121.76 125.48 2ksm s ALA 115 Ca 1.11 -1.90 -0.29 0.00 0.00 0.00 0.00 51.96 50.88 2ksm s ALA 115 Cb -1.34 -0.41 -0.04 0.00 0.00 0.00 0.00 23.12 21.33 2ksm s ALA 115 CO 0.68 0.14 1.50 -1.25 0.00 0.00 0.00 175.76 176.83 2ksm s PRO 116 N -3.67 4.16 0.00 0.00 0.04 -1.26 -2.26 135.00 132.01 2ksm s PRO 116 Ca 0.33 1.94 0.00 0.00 0.04 0.00 0.00 61.00 63.31 2ksm s PRO 116 Cb -0.02 -3.91 0.00 0.00 0.04 0.00 0.00 34.50 30.61 2ksm s PRO 116 CO 0.19 -0.84 0.00 0.41 0.04 0.00 0.00 177.00 176.80 2ksm n GLY 117 N 3.99 0.70 3.75 0.56 0.00 -1.26 -5.03 105.19 107.90 2ksm n GLY 117 Ca 0.16 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 -2.35 3.76 -0.13 1.61 0.11 -0.96 -5.04 120.40 117.40 2ksm s VAL 118 Ca 0.00 1.69 -0.07 0.00 -2.93 0.00 0.00 61.98 60.67 2ksm s VAL 118 Cb 0.00 -4.08 -0.04 0.00 -1.53 0.00 0.00 36.38 30.73 2ksm s VAL 118 CO 0.00 0.37 0.12 0.20 -3.33 0.00 0.00 175.10 172.46 2ksm s ASN 119 N -0.71 6.21 -0.01 3.54 -0.87 -1.19 -4.93 114.94 116.98 2ksm s ASN 119 Ca 0.45 0.39 0.06 0.00 -1.57 0.00 0.00 52.86 52.19 2ksm s ASN 119 Cb -0.30 -2.01 -0.02 0.00 -0.02 0.00 0.00 41.25 38.91 2ksm s ASN 119 CO 0.37 0.37 -0.20 -0.69 -2.57 0.00 0.00 177.10 174.37 2ksm s VAL 120 N -0.77 1.58 -0.40 1.60 1.01 -1.26 -2.86 120.40 119.31 2ksm s VAL 120 Ca 0.13 -0.87 0.02 0.00 0.00 0.00 0.00 61.98 61.27 2ksm s VAL 120 Cb -0.12 -1.32 0.16 0.00 0.00 0.00 0.00 36.38 35.10 2ksm s VAL 120 CO 0.03 0.44 0.29 -0.63 0.00 0.00 0.00 175.10 175.23 2ksm s ILE 121 N -0.48 0.35 -0.20 2.22 1.01 -1.02 -4.95 121.20 118.13 2ksm s ILE 121 Ca 0.08 -2.33 0.01 0.00 0.00 0.00 0.00 60.65 58.40 2ksm s ILE 121 Cb -0.08 -1.26 0.03 0.00 0.01 0.00 0.00 42.46 41.16 2ksm s ILE 121 CO -0.01 -1.13 -0.17 1.51 0.00 0.00 0.00 174.94 175.15 2ksm s ASP 122 N 0.41 3.52 -0.27 3.58 -4.77 -1.26 -3.00 116.67 114.87 2ksm s ASP 122 Ca 0.27 -0.79 0.01 0.00 -3.30 0.00 0.00 52.55 48.74 2ksm s ASP 122 Cb -0.07 -1.52 0.08 0.00 -1.09 0.00 0.00 42.92 40.32 2ksm s ASP 122 CO -0.12 -0.05 -0.01 -1.10 0.70 0.00 0.00 175.17 174.60 2ksm s GLN 123 N 1.27 1.49 0.02 2.11 -1.52 -0.96 -5.03 119.66 117.04 2ksm s GLN 123 Ca 0.02 -1.25 0.07 0.00 -1.95 0.00 0.00 55.36 52.25 2ksm s GLN 123 Cb -0.15 -2.66 -0.02 0.00 -0.22 0.00 0.00 33.01 29.96 2ksm s GLN 123 CO -0.10 -0.74 -0.21 0.42 -0.25 0.00 0.00 175.29 174.40 2ksm s ILE 124 N 1.29 1.71 0.24 1.08 1.01 -1.26 -3.49 121.20 121.77 2ksm s ILE 124 Ca 0.01 -1.09 0.08 0.00 0.00 0.00 0.00 60.65 59.65 2ksm s ILE 124 Cb -0.19 -1.45 -0.04 0.00 0.01 0.00 0.00 42.46 40.79 2ksm s ILE 124 CO -0.10 0.34 0.09 -1.00 0.00 0.00 0.00 174.94 174.27 2ksm s HIS 125 N -0.67 2.92 0.17 3.97 3.76 -1.10 -4.88 115.29 119.46 2ksm s HIS 125 Ca 0.08 -0.15 -0.17 0.00 -0.15 0.00 0.00 55.06 54.67 2ksm s HIS 125 Cb -0.09 -1.33 -0.07 0.00 1.11 0.00 0.00 32.58 32.20 2ksm s HIS 125 CO 0.01 0.56 0.62 0.08 -0.85 0.00 0.00 174.74 175.15 2ksm s VAL 126 N -2.11 4.73 -0.05 -0.90 1.01 -1.26 0.25 120.40 122.07 2ksm s VAL 126 Ca 0.31 1.06 -0.31 0.00 0.00 0.00 0.00 61.98 63.04 2ksm s VAL 126 Cb -0.08 -3.81 0.07 0.00 0.00 0.00 0.00 36.38 32.57 2ksm s VAL 126 CO 0.22 0.27 0.69 -1.81 0.00 0.00 0.00 175.10 174.47 2ksm s ASP 127 N -1.61 -0.65 -0.16 3.32 1.11 -0.13 -4.89 116.67 113.66 2ksm s ASP 127 Ca 0.39 0.72 -0.29 0.00 0.18 0.00 0.00 52.55 53.54 2ksm s ASP 127 Cb -0.16 0.54 -0.05 0.00 1.07 0.00 0.00 42.92 44.31 2ksm s ASP 127 CO 0.20 -0.60 2.02 -2.16 1.18 0.00 0.00 175.17 175.80 2ksm s PRO 128 N -1.18 3.52 0.00 8.23 0.04 -1.26 -4.04 135.00 140.30 2ksm s PRO 128 Ca -0.11 2.07 0.00 0.00 0.04 0.00 0.00 61.00 63.01 2ksm s PRO 128 Cb -0.00 -4.25 0.00 0.00 0.04 0.00 0.00 34.50 30.29 2ksm s PRO 128 CO 0.10 -1.65 0.00 0.28 0.04 0.00 0.00 177.00 175.77 2ksm n VAL 129 N 6.92 0.00 -0.81 -0.36 0.31 -1.26 -4.78 118.33 118.35 2ksm n VAL 129 Ca 0.25 0.00 -0.33 0.00 -0.01 0.00 0.00 64.34 64.25 2ksm n VAL 129 Cb 0.44 0.00 0.11 0.00 -0.91 0.00 0.00 33.84 33.49 2ksm n VAL 129 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 2ksm n VAL 130 N -0.51 0.02 -2.08 2.52 0.24 -1.26 -4.71 118.33 112.56 2ksm n VAL 130 Ca 0.00 -0.21 -0.29 0.00 -2.04 0.00 0.00 64.34 61.80 2ksm n VAL 130 Cb 0.00 -0.58 -0.05 0.00 -1.47 0.00 0.00 33.84 31.74 2ksm n VAL 130 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 2ksm s ARG 131 N -3.52 2.62 0.19 7.34 6.06 -1.26 -4.87 118.95 125.52 2ksm s ARG 131 Ca 0.56 -0.22 -0.05 0.00 -2.50 0.00 0.00 55.73 53.52 2ksm s ARG 131 Cb -0.21 -4.99 -0.03 0.00 0.06 0.00 0.00 34.95 29.78 2ksm s ARG 131 CO 0.68 -3.23 0.21 0.45 -2.50 0.00 0.00 175.30 170.92 2ksm s SER 132 N 7.84 0.12 0.04 -2.12 0.15 -1.26 -3.71 113.70 114.76 2ksm s SER 132 Ca 0.68 -1.16 -0.30 0.00 0.70 0.00 0.00 55.95 55.87 2ksm s SER 132 Cb -0.07 0.41 -0.06 0.00 -1.71 0.00 0.00 66.02 64.59 2ksm s SER 132 CO 0.01 -0.88 1.30 -0.22 1.20 0.00 0.00 173.24 174.66 2ksm s LEU 133 N -3.07 4.34 -0.62 3.45 2.96 -1.26 -4.96 118.68 119.52 2ksm s LEU 133 Ca 0.28 2.09 -0.28 0.00 -0.22 0.00 0.00 54.13 56.00 2ksm s LEU 133 Cb 0.05 -3.57 0.03 0.00 0.50 0.00 0.00 46.19 43.20 2ksm s LEU 133 CO 0.07 -0.60 1.24 -1.81 -1.32 0.00 0.00 176.35 173.92 2ksm s ASP 134 N 1.38 6.34 0.00 3.68 1.01 -1.26 -4.86 116.67 122.96 2ksm s ASP 134 Ca 0.61 -0.02 0.17 0.00 0.71 0.00 0.00 52.55 54.01 2ksm s ASP 134 Cb -0.31 -2.55 0.85 0.00 1.01 0.00 0.00 42.92 41.91 2ksm s ASP 134 CO 0.28 -1.60 1.48 0.49 0.21 0.00 0.00 175.17 176.02 2ksm n PHE 135 N 8.82 0.00 -0.41 4.23 3.01 -1.26 -3.80 117.46 128.04 2ksm n PHE 135 Ca 0.07 0.00 0.36 0.00 1.01 0.00 0.00 57.45 58.90 2ksm n PHE 135 Cb 0.49 -0.27 0.63 0.00 -0.01 0.00 0.00 39.48 40.32 2ksm n PHE 135 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 2ksm h SER 136 N 0.00 0.26 -0.39 4.37 0.02 -1.89 0.85 113.55 116.77 2ksm h SER 136 Ca 0.00 0.19 -0.29 0.00 -0.84 0.00 0.00 61.79 60.85 2ksm h SER 136 Cb 0.15 0.18 -0.23 0.00 0.14 0.00 0.00 62.40 62.64 2ksm h SER 136 CO 0.00 -0.29 -0.68 -1.54 -1.14 0.00 0.00 176.83 173.18 2ksm n SER 137 N -4.90 3.35 0.14 3.07 3.41 -1.25 -4.62 113.62 112.82 2ksm n SER 137 Ca 0.38 -3.77 0.05 0.00 -0.26 0.00 0.00 58.87 55.28 2ksm n SER 137 Cb 1.42 -0.43 0.05 0.00 -0.26 0.00 0.00 64.21 64.99 2ksm n SER 137 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ksm h ALA 138 N 1.63 0.74 0.24 7.33 0.00 0.52 -3.25 119.26 126.47 2ksm h ALA 138 Ca 0.18 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 2ksm h ALA 138 Cb 1.30 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 2ksm h ALA 138 CO 0.40 0.46 -0.36 0.93 0.00 0.00 0.00 179.25 180.68 2ksm h GLU 139 N 0.00 -0.60 -0.99 0.00 4.39 -1.79 1.83 114.58 117.42 2ksm h GLU 139 Ca -0.02 0.04 0.21 0.00 0.34 0.00 0.00 59.36 59.93 2ksm h GLU 139 Cb 1.29 0.14 -0.10 0.00 -0.10 0.00 0.00 28.75 29.98 2ksm h GLU 139 CO 0.04 -0.40 0.62 -1.00 -1.16 0.00 0.00 179.01 177.11 2ksm h PRO 140 N -0.62 0.58 0.09 2.33 0.13 -1.93 0.56 132.00 133.14 2ksm h PRO 140 Ca -0.03 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 65.06 2ksm h PRO 140 Cb 0.57 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 31.57 2ksm h PRO 140 CO -0.11 0.38 -0.05 0.28 -0.23 0.00 0.00 178.00 178.28 2ksm h VAL 141 N 0.59 0.00 -1.05 1.56 2.07 -1.27 -2.57 116.25 115.58 2ksm h VAL 141 Ca 0.56 -0.28 0.31 0.00 0.82 0.00 0.00 66.70 68.11 2ksm h VAL 141 Cb 1.11 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.75 2ksm h VAL 141 CO -0.32 0.00 0.64 -0.26 0.02 0.00 0.00 177.57 177.64 2ksm h PHE 142 N -0.40 0.84 -0.46 1.57 -1.00 0.29 1.68 116.94 119.45 2ksm h PHE 142 Ca -0.01 0.03 -0.02 0.00 2.81 0.00 0.00 57.97 60.78 2ksm h PHE 142 Cb 0.10 -0.23 -0.02 0.00 3.61 0.00 0.00 35.95 39.40 2ksm h PHE 142 CO 0.04 -0.07 0.19 1.79 -1.61 0.00 0.00 178.31 178.65 2ksm h THR 143 N 0.37 1.17 0.00 -1.55 1.35 0.05 0.95 112.91 115.26 2ksm h THR 143 Ca 0.69 -0.53 0.00 0.00 -0.55 0.00 0.00 66.41 66.02 2ksm h THR 143 Cb 1.65 0.62 0.00 0.00 -1.73 0.00 0.00 68.15 68.69 2ksm h THR 143 CO -0.48 0.21 0.00 0.00 -0.25 0.00 0.00 175.52 175.00 2ksm h ALA 144 N 1.55 1.00 -0.28 6.62 0.00 0.29 -2.55 119.26 125.89 2ksm h ALA 144 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2ksm h ALA 144 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2ksm h ALA 144 CO -0.02 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.10 2ksm n SER 145 N -2.77 2.81 0.01 0.00 3.41 0.05 -4.65 113.62 112.48 2ksm n SER 145 Ca 0.02 -1.85 -0.10 0.00 -0.26 0.00 0.00 58.87 56.68 2ksm n SER 145 Cb 0.31 -0.18 -0.04 0.00 -0.26 0.00 0.00 64.21 64.04 2ksm n SER 145 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2ksm h VAL 146 N 2.69 0.71 0.00 -3.33 2.07 -0.48 -1.72 116.25 116.20 2ksm h VAL 146 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2ksm h VAL 146 Cb 0.72 0.71 0.00 0.00 -1.52 0.00 0.00 31.29 31.21 2ksm h VAL 146 CO 0.00 0.00 0.00 -0.81 0.02 0.00 0.00 177.57 176.78 2ksm n PRO 147 N -5.24 0.19 -3.33 1.57 -0.04 -1.26 -3.68 135.00 123.21 2ksm n PRO 147 Ca -0.04 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.17 2ksm n PRO 147 Cb 0.16 -1.08 -0.09 0.00 -0.04 0.00 0.00 33.50 32.45 2ksm n PRO 147 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 2ksm n ILE 148 N 0.30 -1.11 1.10 0.52 5.41 -0.65 -4.97 119.36 119.97 2ksm n ILE 148 Ca 0.00 -3.20 0.00 0.00 1.00 0.00 0.00 62.75 60.55 2ksm n ILE 148 Cb 0.04 -1.40 0.00 0.00 -0.71 0.00 0.00 39.64 37.57 2ksm n ILE 148 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 2ksm n PRO 149 N 2.83 0.74 -1.02 0.38 -0.04 -1.24 -2.73 135.00 133.91 2ksm n PRO 149 Ca 0.29 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.75 2ksm n PRO 149 Cb 0.49 -1.18 0.15 0.00 -0.04 0.00 0.00 33.50 32.91 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 -0.18 2.12 -4.93 3.54 8.00 -1.22 -3.08 116.55 120.81 2ksm n ASP 150 Ca 0.00 -3.56 -0.27 0.00 0.71 0.00 0.00 54.79 51.67 2ksm n ASP 150 Cb 0.09 -0.47 -0.03 0.00 -0.02 0.00 0.00 41.12 40.69 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 -2.87 3.48 0.01 1.24 2.19 -0.46 -3.86 117.98 117.71 2ksm s PHE 151 Ca 0.39 0.27 0.06 0.00 0.33 0.00 0.00 56.93 57.98 2ksm s PHE 151 Cb 0.38 -1.79 -0.02 0.00 -1.31 0.00 0.00 43.02 40.28 2ksm s PHE 151 CO -0.07 0.43 -0.17 0.20 1.83 0.00 0.00 175.22 177.44 2ksm s GLY 152 N -3.17 0.90 -0.11 13.12 0.00 -0.09 -1.86 107.32 116.12 2ksm s GLY 152 Ca 0.37 -0.84 0.02 0.00 0.00 0.00 0.00 44.72 44.27 2ksm s GLY 152 CO 0.29 -0.75 -0.17 1.08 0.00 0.00 0.00 173.10 173.55 2ksm s LEU 153 N -0.77 1.80 -0.05 0.66 2.01 0.16 -3.07 118.68 119.42 2ksm s LEU 153 Ca 0.06 -0.45 0.01 0.00 0.01 0.00 0.00 54.13 53.75 2ksm s LEU 153 Cb -0.07 -1.15 0.02 0.00 0.01 0.00 0.00 46.19 45.00 2ksm s LEU 153 CO 0.00 0.04 -0.03 -0.75 1.01 0.00 0.00 176.35 176.62 2ksm s LYS 154 N 0.89 0.77 -0.07 1.70 2.36 -1.02 -1.12 119.74 123.26 2ksm s LYS 154 Ca -0.08 -0.06 0.04 0.00 -2.55 0.00 0.00 55.97 53.32 2ksm s LYS 154 Cb -0.15 -0.85 -0.02 0.00 -1.05 0.00 0.00 37.83 35.76 2ksm s LYS 154 CO -0.01 -0.13 -0.20 0.08 1.55 0.00 0.00 175.35 176.65 2ksm s VAL 155 N 1.12 2.53 0.00 4.02 1.01 -0.89 -0.77 120.40 127.42 2ksm s VAL 155 Ca -0.08 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.00 2ksm s VAL 155 Cb -0.14 -1.97 0.00 0.00 0.00 0.00 0.00 36.38 34.27 2ksm s VAL 155 CO -0.01 0.57 0.00 -0.62 0.00 0.00 0.00 175.10 175.04 2ksm n GLU 156 N 2.84 3.85 0.06 2.72 1.02 0.13 -2.04 120.64 129.22 2ksm n GLU 156 Ca -0.17 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 56.94 2ksm n GLU 156 Cb 0.52 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 31.93 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 -0.18 0.00 3.49 3.08 -1.94 -3.38 114.38 115.46 2ksm h ARG 157 Ca 0.00 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.06 2ksm h ARG 157 Cb 0.00 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.09 2ksm h ARG 157 CO 0.00 -0.12 -0.01 -3.47 -1.07 0.00 0.00 179.97 175.31 2ksm n ASP 158 N -2.99 1.95 -4.33 7.04 2.03 -1.26 -4.58 116.55 114.40 2ksm n ASP 158 Ca -0.02 -2.18 -0.18 0.00 0.52 0.00 0.00 54.79 52.93 2ksm n ASP 158 Cb 0.07 -0.09 -0.10 0.00 -0.72 0.00 0.00 41.12 40.28 2ksm n ASP 158 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2ksm s THR 159 N -1.33 1.63 -0.03 5.18 2.01 -1.26 -4.33 115.64 117.50 2ksm s THR 159 Ca 0.07 -2.18 0.01 0.00 0.31 0.00 0.00 61.69 59.89 2ksm s THR 159 Cb 0.06 -2.03 0.03 0.00 0.01 0.00 0.00 72.50 70.56 2ksm s THR 159 CO 0.01 -0.61 -0.01 -0.69 -0.69 0.00 0.00 174.62 172.62 2ksm s VAL 160 N -3.04 0.29 0.04 3.82 1.01 0.79 0.21 120.40 123.52 2ksm s VAL 160 Ca 0.22 0.02 0.06 0.00 0.00 0.00 0.00 61.98 62.28 2ksm s VAL 160 Cb 0.00 -0.36 -0.03 0.00 0.00 0.00 0.00 36.38 35.99 2ksm s VAL 160 CO 0.06 0.17 -0.16 0.42 0.00 0.00 0.00 175.10 175.59 2ksm s THR 161 N 0.98 2.95 -0.10 3.92 -4.23 0.05 -2.58 115.64 116.63 2ksm s THR 161 Ca -0.10 -1.13 0.03 0.00 -1.18 0.00 0.00 61.69 59.30 2ksm s THR 161 Cb -0.14 -2.26 0.01 0.00 1.34 0.00 0.00 72.50 71.45 2ksm s THR 161 CO -0.01 0.33 -0.20 -0.76 -0.54 0.00 0.00 174.62 173.44 2ksm s LEU 162 N -1.49 1.93 -0.03 4.79 1.02 -0.69 -2.44 118.68 121.77 2ksm s LEU 162 Ca 0.15 -0.49 -0.01 0.00 0.02 0.00 0.00 54.13 53.80 2ksm s LEU 162 Cb -0.11 -1.24 0.03 0.00 0.02 0.00 0.00 46.19 44.90 2ksm s LEU 162 CO 0.06 0.09 0.07 0.42 0.02 0.00 0.00 176.35 177.01 2ksm s THR 163 N 0.60 -0.06 -0.25 5.49 -4.23 -1.18 -1.66 115.64 114.36 2ksm s THR 163 Ca -0.14 0.21 -0.14 0.00 -1.18 0.00 0.00 61.69 60.44 2ksm s THR 163 Cb -0.17 -0.13 0.08 0.00 1.34 0.00 0.00 72.50 73.62 2ksm s THR 163 CO 0.04 0.08 0.61 -0.83 -0.54 0.00 0.00 174.62 173.98 2ksm s GLY 164 N 1.11 -0.56 -0.04 3.99 0.00 -1.26 -0.91 107.32 109.65 2ksm s GLY 164 Ca -0.09 2.17 -0.30 0.00 0.00 0.00 0.00 44.72 46.50 2ksm s GLY 164 CO -0.04 2.25 1.32 -0.51 0.00 0.00 0.00 173.10 176.13 2ksm s THR 165 N 1.67 3.97 -0.37 0.90 -4.23 -1.25 -4.18 115.64 112.15 2ksm s THR 165 Ca -0.09 1.30 0.01 0.00 -1.18 0.00 0.00 61.69 61.72 2ksm s THR 165 Cb -0.06 -3.84 0.14 0.00 1.34 0.00 0.00 72.50 70.08 2ksm s THR 165 CO -0.18 -0.02 0.22 0.00 -0.54 0.00 0.00 174.62 174.11 2ksm s ALA 166 N 2.53 1.09 -1.03 3.99 0.00 -1.26 -4.89 121.76 122.19 2ksm s ALA 166 Ca 0.60 -1.98 0.00 0.00 0.00 0.00 0.00 51.96 50.58 2ksm s ALA 166 Cb -0.28 -1.63 0.00 0.00 0.00 0.00 0.00 23.12 21.21 2ksm s ALA 166 CO 0.24 -2.09 0.37 -2.30 0.00 0.00 0.00 175.76 171.97 2ksm n PRO 167 N 3.89 0.00 0.00 0.00 -0.02 -1.26 -4.17 135.00 133.44 2ksm n PRO 167 Ca 0.13 0.05 0.00 0.00 -2.02 0.00 0.00 63.50 61.66 2ksm n PRO 167 Cb 0.38 -1.54 0.00 0.00 -0.02 0.00 0.00 33.50 32.32 2ksm n PRO 167 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2ksm n SER 168 N -0.87 0.00 0.00 2.55 3.41 -1.26 -5.02 113.62 112.43 2ksm n SER 168 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2ksm n SER 168 Cb 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.99 2ksm n SER 168 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2ksm n SER 169 N 0.00 0.00 0.19 4.04 3.41 -1.26 -4.93 113.62 115.07 2ksm n SER 169 Ca 0.00 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.74 2ksm n SER 169 Cb 0.00 0.00 0.43 0.00 -0.26 0.00 0.00 64.21 64.38 2ksm n SER 169 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2ksm h GLU 170 N 0.00 0.00 -0.38 4.33 5.08 -2.00 0.24 114.58 121.85 2ksm h GLU 170 Ca 0.00 0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.47 2ksm h GLU 170 Cb 0.00 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2ksm h GLU 170 CO 0.00 0.00 0.71 1.25 -1.00 0.00 0.00 179.01 179.97 2ksm h HIS 171 N 0.00 0.00 0.00 4.33 2.76 -1.96 1.77 115.15 122.05 2ksm h HIS 171 Ca 0.13 0.00 -0.18 0.00 -2.20 0.00 0.00 60.37 58.12 2ksm h HIS 171 Cb 1.67 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 30.60 2ksm h HIS 171 CO 0.00 0.00 -0.95 -0.22 -1.30 0.00 0.00 177.93 175.46 2ksm h LYS 172 N 0.00 0.00 -0.03 5.26 3.11 -0.90 -3.37 116.57 120.64 2ksm h LYS 172 Ca 0.18 0.00 0.02 0.00 -2.81 0.00 0.00 60.65 58.04 2ksm h LYS 172 Cb 1.60 0.00 -0.05 0.00 -1.00 0.00 0.00 32.23 32.78 2ksm h LYS 172 CO -0.00 0.71 -0.46 0.22 -2.81 0.00 0.00 179.45 177.11 2ksm h ASP 173 N 0.00 -1.42 -0.98 4.20 1.82 0.25 -0.38 116.42 119.91 2ksm h ASP 173 Ca -0.05 0.16 0.22 0.00 -0.39 0.00 0.00 57.03 56.97 2ksm h ASP 173 Cb 1.65 0.54 -0.12 0.00 0.68 0.00 0.00 39.33 42.09 2ksm h ASP 173 CO 0.09 -0.44 0.57 0.00 -1.61 0.00 0.00 179.24 177.86 2ksm h ALA 174 N -0.56 1.68 -0.36 -0.78 0.00 -1.72 0.52 119.26 118.04 2ksm h ALA 174 Ca 0.01 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2ksm h ALA 174 Cb 0.61 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2ksm h ALA 174 CO -0.32 -0.19 0.17 0.28 0.00 0.00 0.00 179.25 179.19 2ksm h VAL 175 N 0.63 1.17 -0.16 0.00 2.07 -1.38 -1.25 116.25 117.31 2ksm h VAL 175 Ca 0.60 -0.47 -0.03 0.00 0.82 0.00 0.00 66.70 67.62 2ksm h VAL 175 Cb 1.06 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.65 2ksm h VAL 175 CO -0.44 0.18 -0.02 0.50 0.02 0.00 0.00 177.57 177.80 2ksm h LYS 176 N 0.44 0.30 -0.81 1.57 3.11 0.55 -1.15 116.57 120.58 2ksm h LYS 176 Ca 0.12 -0.10 0.05 0.00 -2.81 0.00 0.00 60.65 57.91 2ksm h LYS 176 Cb 0.12 -0.02 -0.05 0.00 -1.00 0.00 0.00 32.23 31.27 2ksm h LYS 176 CO -0.02 0.55 0.50 0.00 -2.81 0.00 0.00 179.45 177.67 2ksm h ARG 177 N 0.03 0.91 -0.26 1.90 3.08 -0.93 0.33 114.38 119.45 2ksm h ARG 177 Ca 0.04 -0.06 -0.08 0.00 0.07 0.00 0.00 59.98 59.96 2ksm h ARG 177 Cb 0.42 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 2ksm h ARG 177 CO 0.01 0.61 -0.14 0.00 -1.07 0.00 0.00 179.97 179.37 2ksm h ALA 178 N 1.37 0.36 0.01 0.04 0.00 -1.16 -2.30 119.26 117.57 2ksm h ALA 178 Ca 0.34 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2ksm h ALA 178 Cb 0.10 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2ksm h ALA 178 CO -0.15 0.25 -0.00 0.00 0.00 0.00 0.00 179.25 179.35 2ksm h ALA 179 N 0.72 -0.01 -0.54 0.00 0.00 -0.82 -2.62 119.26 115.99 2ksm h ALA 179 Ca 0.05 -0.16 0.07 0.00 0.00 0.00 0.00 54.91 54.87 2ksm h ALA 179 Cb 0.66 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.40 2ksm h ALA 179 CO 0.04 -0.34 0.21 1.15 0.00 0.00 0.00 179.25 180.31 2ksm h THR 180 N -0.34 0.83 0.00 0.00 2.02 -0.42 0.93 112.91 115.95 2ksm h THR 180 Ca -0.00 -0.14 -0.02 0.00 0.77 0.00 0.00 66.41 67.02 2ksm h THR 180 Cb 0.33 0.40 -0.00 0.00 -1.74 0.00 0.00 68.15 67.13 2ksm h THR 180 CO 0.00 0.07 -0.11 0.77 0.37 0.00 0.00 175.52 176.62 2ksm h SER 181 N 0.40 0.00 0.77 4.18 4.64 -1.40 0.32 113.55 122.47 2ksm h SER 181 Ca 0.26 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.34 2ksm h SER 181 Cb 0.27 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.32 2ksm h SER 181 CO -0.25 0.11 -1.32 0.71 -0.87 0.00 0.00 176.83 175.21 2ksm h THR 182 N 0.00 1.29 -2.05 2.95 1.35 -0.68 -3.39 112.91 112.38 2ksm h THR 182 Ca -0.00 -3.06 -0.52 0.00 -0.55 0.00 0.00 66.41 62.28 2ksm h THR 182 Cb 0.30 2.63 -0.40 0.00 -1.73 0.00 0.00 68.15 68.95 2ksm h THR 182 CO 0.01 0.73 -1.07 0.79 -0.25 0.00 0.00 175.52 175.73 2ksm n TRP 183 N -3.20 0.78 0.11 4.73 8.01 0.15 -4.95 117.44 123.06 2ksm n TRP 183 Ca -0.08 -3.81 -0.04 0.00 -1.31 0.00 0.00 57.50 52.27 2ksm n TRP 183 Cb 0.99 -0.42 0.12 0.00 -2.01 0.00 0.00 31.31 29.98 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 3.26 0.09 -0.06 -0.99 0.13 -0.58 -3.15 132.00 130.69 2ksm h PRO 184 Ca 0.10 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 2ksm h PRO 184 Cb 0.87 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.02 2ksm h PRO 184 CO 0.55 0.72 0.00 -0.40 -0.23 0.00 0.00 178.00 178.65 2ksm n ASP 185 N -3.78 1.34 -4.41 1.44 5.75 -1.26 -4.79 116.55 110.83 2ksm n ASP 185 Ca -0.02 -1.52 -0.34 0.00 -0.01 0.00 0.00 54.79 52.91 2ksm n ASP 185 Cb 0.66 -0.03 -0.13 0.00 -1.03 0.00 0.00 41.12 40.58 2ksm n ASP 185 CO 0.00 0.00 0.00 -0.04 -0.11 0.00 0.00 177.20 177.05 2ksm s MET 186 N -1.93 3.51 -0.73 0.11 -1.94 -1.19 -5.02 119.30 112.11 2ksm s MET 186 Ca 0.37 -0.59 -0.34 0.00 -1.71 0.00 0.00 55.69 53.41 2ksm s MET 186 Cb 0.20 -2.87 -0.18 0.00 2.01 0.00 0.00 34.83 33.99 2ksm s MET 186 CO 0.31 0.10 2.46 1.63 -0.01 0.00 0.00 175.02 179.51 2ksm n LYS 187 N 3.91 0.28 -3.95 2.03 4.01 -1.26 -4.76 118.16 118.42 2ksm n LYS 187 Ca -0.18 0.04 -0.35 0.00 -0.51 0.00 0.00 58.31 57.32 2ksm n LYS 187 Cb 0.52 -1.88 -0.14 0.00 -0.51 0.00 0.00 35.03 33.02 2ksm n LYS 187 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 2ksm s ILE 188 N 8.46 3.06 -0.29 -0.18 -1.09 -1.25 -0.15 121.20 129.76 2ksm s ILE 188 Ca 1.24 -0.71 0.00 0.00 -2.23 0.00 0.00 60.65 58.95 2ksm s ILE 188 Cb -1.13 -2.43 0.09 0.00 -1.58 0.00 0.00 42.46 37.41 2ksm s ILE 188 CO 0.50 0.37 0.04 0.54 -1.23 0.00 0.00 174.94 175.16 2ksm s VAL 189 N 1.41 1.32 -0.56 2.92 0.11 -1.07 -5.03 120.40 119.51 2ksm s VAL 189 Ca 0.04 -1.49 -0.19 0.00 -2.93 0.00 0.00 61.98 57.41 2ksm s VAL 189 Cb -0.15 -1.87 0.09 0.00 -1.53 0.00 0.00 36.38 32.92 2ksm s VAL 189 CO -0.05 -0.47 0.67 0.20 -3.33 0.00 0.00 175.10 172.12 2ksm s ASN 190 N 1.42 6.19 -0.69 3.54 0.01 -1.26 -1.70 114.94 122.46 2ksm s ASN 190 Ca 0.05 -1.29 -0.02 0.00 -0.71 0.00 0.00 52.86 50.89 2ksm s ASN 190 Cb -0.18 -2.29 0.17 0.00 0.41 0.00 0.00 41.25 39.36 2ksm s ASN 190 CO -0.15 -1.03 0.51 0.54 -1.51 0.00 0.00 177.10 175.47 2ksm s ASN 191 N 3.32 5.36 0.28 -1.22 2.20 -0.66 -4.98 114.94 119.24 2ksm s ASN 191 Ca 0.12 -3.09 -0.21 0.00 -0.94 0.00 0.00 52.86 48.74 2ksm s ASN 191 Cb -0.23 -1.86 -0.09 0.00 -2.00 0.00 0.00 41.25 37.07 2ksm s ASN 191 CO 0.08 -0.31 0.81 -0.63 -2.94 0.00 0.00 177.10 174.10 2ksm s ILE 192 N -0.41 4.47 -0.04 0.54 1.09 -1.26 -4.61 121.20 120.98 2ksm s ILE 192 Ca 0.20 1.41 -0.00 0.00 -1.10 0.00 0.00 60.65 61.15 2ksm s ILE 192 Cb -0.17 -3.84 0.03 0.00 -1.06 0.00 0.00 42.46 37.42 2ksm s ILE 192 CO -0.06 0.08 0.02 -1.61 -0.10 0.00 0.00 174.94 173.27 2ksm s GLU 193 N -2.26 0.22 -0.29 2.79 0.41 -1.26 -5.04 118.70 113.27 2ksm s GLU 193 Ca 0.48 0.16 -0.29 0.00 -0.41 0.00 0.00 54.97 54.92 2ksm s GLU 193 Cb -0.16 -0.53 -0.01 0.00 -1.78 0.00 0.00 34.13 31.65 2ksm s GLU 193 CO 0.20 -0.21 1.42 0.14 -0.49 0.00 0.00 175.26 176.33 2ksm s VAL 194 N 1.44 3.96 -0.28 2.63 -7.23 -1.26 -4.20 120.40 115.45 2ksm s VAL 194 Ca -0.04 1.07 -0.33 0.00 -1.81 0.00 0.00 61.98 60.87 2ksm s VAL 194 Cb -0.13 -4.01 -0.10 0.00 0.56 0.00 0.00 36.38 32.70 2ksm s VAL 194 CO -0.03 -0.45 2.16 1.07 -0.31 0.00 0.00 175.10 177.54 2ksm n THR 195 N 6.41 0.28 -0.04 5.32 5.66 -1.26 -3.97 114.28 126.68 2ksm n THR 195 Ca 0.16 -0.30 0.00 0.00 -3.05 0.00 0.00 64.05 60.86 2ksm n THR 195 Cb 0.46 -1.94 0.00 0.00 -1.55 0.00 0.00 70.33 67.30 2ksm n THR 195 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2ksm n GLY 196 N 6.05 -0.12 0.00 1.09 0.00 -1.26 -4.97 105.19 105.98 2ksm n GLY 196 Ca 0.36 -0.71 0.13 0.00 0.00 0.00 0.00 46.02 45.80 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 0.21 -2.13 1.61 1.13 -1.25 -4.82 117.38 112.13 2ksm n GLN 197 Ca 0.00 0.03 -0.29 0.00 -1.94 0.00 0.00 57.00 54.80 2ksm n GLN 197 Cb 0.00 -1.50 0.02 0.00 0.11 0.00 0.00 30.24 28.87 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 -2.77 3.14 0.86 -1.58 0.00 -1.26 -5.06 121.76 115.09 2ksm s ALA 198 Ca 0.20 -0.37 -0.11 0.00 0.00 0.00 0.00 51.96 51.68 2ksm s ALA 198 Cb 0.18 -2.87 0.11 0.00 0.00 0.00 0.00 23.12 20.54 2ksm s ALA 198 CO 0.45 -0.78 1.09 -1.25 0.00 0.00 0.00 175.76 175.27 2ksm s PRO 199 N -5.11 1.54 0.47 0.00 0.04 -1.26 -5.02 135.00 125.66 2ksm s PRO 199 Ca 0.54 0.83 -0.04 0.00 0.04 0.00 0.00 61.00 62.37 2ksm s PRO 199 Cb -0.11 -1.84 0.07 0.00 0.04 0.00 0.00 34.50 32.66 2ksm s PRO 199 CO 0.50 -2.05 0.16 -2.30 0.04 0.00 0.00 177.00 173.35 2ksm n PRO 200 N -3.75 0.29 -2.29 0.56 -0.02 -1.26 -5.05 135.00 123.48 2ksm n PRO 200 Ca 0.07 -0.26 -0.01 0.00 -2.02 0.00 0.00 63.50 61.29 2ksm n PRO 200 Cb 0.55 -0.76 0.01 0.00 -0.02 0.00 0.00 33.50 33.28 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 0.22 0.95 3.38 -1.23 0.00 -1.26 -5.16 105.19 102.08 2ksm n GLY 201 Ca 0.02 -0.97 -0.34 0.00 0.00 0.00 0.00 46.02 44.73 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 -0.25 -0.13 0.00 1.61 -0.02 -1.26 -5.34 135.00 129.61 2ksm n PRO 202 Ca -0.00 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.56 2ksm n PRO 202 Cb 0.19 -1.75 0.50 0.00 -0.02 0.00 0.00 33.50 32.42 2ksm n PRO 202 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13