#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 1.75 -3.60 4.61 0.00 -1.26 -4.85 120.51 117.16 2ksm n ALA 74 Ca 0.00 -1.08 -0.27 0.00 0.00 0.00 0.00 53.44 52.08 2ksm n ALA 74 Cb 0.00 -0.40 -0.16 0.00 0.00 0.00 0.00 19.45 18.88 2ksm n ALA 74 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2ksm s SER 75 N -5.41 2.90 -0.30 0.00 0.15 -1.26 -5.10 113.70 104.68 2ksm s SER 75 Ca -0.09 -0.92 -0.18 0.00 0.70 0.00 0.00 55.95 55.47 2ksm s SER 75 Cb 0.08 -0.35 0.20 0.00 -1.71 0.00 0.00 66.02 64.24 2ksm s SER 75 CO 0.84 -0.38 1.28 0.00 1.20 0.00 0.00 173.24 176.18 2ksm s ALA 76 N 2.07 -3.04 -1.87 5.45 0.00 -1.26 -5.00 121.76 118.11 2ksm s ALA 76 Ca 0.04 1.87 0.24 0.00 0.00 0.00 0.00 51.96 54.11 2ksm s ALA 76 Cb -0.16 -2.17 1.41 0.00 0.00 0.00 0.00 23.12 22.19 2ksm s ALA 76 CO -0.19 -0.70 1.82 1.28 0.00 0.00 0.00 175.76 177.97 2ksm n LEU 77 N 3.94 0.00 -4.63 0.00 4.32 -1.26 -4.76 117.00 114.61 2ksm n LEU 77 Ca -0.11 0.06 -0.43 0.00 -0.02 0.00 0.00 56.01 55.52 2ksm n LEU 77 Cb 0.56 -0.06 -0.03 0.00 -1.62 0.00 0.00 43.42 42.27 2ksm n LEU 77 CO -0.00 -0.01 1.49 -0.44 -1.22 0.00 0.00 177.39 177.20 2ksm s SER 78 N -2.13 6.25 0.74 -1.43 0.01 -1.26 -4.95 113.70 110.93 2ksm s SER 78 Ca 0.34 1.87 -0.15 0.00 1.31 0.00 0.00 55.95 59.31 2ksm s SER 78 Cb 0.17 -2.53 0.01 0.00 0.21 0.00 0.00 66.02 63.88 2ksm s SER 78 CO 0.30 -1.33 0.93 0.18 0.41 0.00 0.00 173.24 173.73 2ksm n LEU 79 N 8.79 3.18 -3.15 2.44 4.32 -1.26 -5.00 117.00 126.32 2ksm n LEU 79 Ca 0.21 0.63 0.04 0.00 -0.02 0.00 0.00 56.01 56.87 2ksm n LEU 79 Cb 0.44 -1.39 -0.01 0.00 -1.62 0.00 0.00 43.42 40.84 2ksm n LEU 79 CO 0.65 -2.18 0.16 -0.55 -1.22 0.00 0.00 177.39 174.25 2ksm s SER 80 N -1.70 -1.42 0.01 -1.43 0.15 -1.26 -4.72 113.70 103.33 2ksm s SER 80 Ca 0.72 0.75 0.01 0.00 0.70 0.00 0.00 55.95 58.13 2ksm s SER 80 Cb -0.33 2.13 -0.01 0.00 -1.71 0.00 0.00 66.02 66.11 2ksm s SER 80 CO 0.52 -0.26 -0.03 -0.22 1.20 0.00 0.00 173.24 174.44 2ksm s LEU 81 N 2.86 2.06 -0.31 3.45 2.96 -1.26 -4.63 118.68 123.80 2ksm s LEU 81 Ca 0.19 -0.15 0.02 0.00 -0.22 0.00 0.00 54.13 53.97 2ksm s LEU 81 Cb -0.14 -0.11 0.16 0.00 0.50 0.00 0.00 46.19 46.60 2ksm s LEU 81 CO -0.22 -0.03 0.40 -0.22 -1.32 0.00 0.00 176.35 174.97 2ksm s LEU 82 N -0.38 -0.66 -0.05 -0.68 2.96 -1.15 -1.21 118.68 117.51 2ksm s LEU 82 Ca -0.02 -0.62 0.02 0.00 -0.22 0.00 0.00 54.13 53.30 2ksm s LEU 82 Cb -0.03 1.00 0.01 0.00 0.50 0.00 0.00 46.19 47.68 2ksm s LEU 82 CO -0.00 -0.34 -0.10 -0.55 -1.32 0.00 0.00 176.35 174.04 2ksm s SER 83 N 2.33 1.47 -0.06 3.68 0.15 -0.44 -1.89 113.70 118.95 2ksm s SER 83 Ca 0.11 -0.24 0.03 0.00 0.70 0.00 0.00 55.95 56.55 2ksm s SER 83 Cb -0.12 -0.61 0.01 0.00 -1.71 0.00 0.00 66.02 63.58 2ksm s SER 83 CO -0.26 0.03 -0.13 -0.63 1.20 0.00 0.00 173.24 173.45 2ksm s ILE 84 N 0.58 1.16 -0.04 6.45 1.01 -0.88 -1.41 121.20 128.06 2ksm s ILE 84 Ca -0.11 -0.52 0.06 0.00 0.00 0.00 0.00 60.65 60.08 2ksm s ILE 84 Cb -0.14 -1.04 -0.02 0.00 0.01 0.00 0.00 42.46 41.28 2ksm s ILE 84 CO 0.02 0.35 -0.22 -0.94 0.00 0.00 0.00 174.94 174.15 2ksm s SER 85 N 0.47 3.32 -0.14 3.58 1.04 0.29 -2.69 113.70 119.57 2ksm s SER 85 Ca -0.11 -0.42 -0.03 0.00 0.48 0.00 0.00 55.95 55.87 2ksm s SER 85 Cb -0.14 -0.68 0.05 0.00 0.10 0.00 0.00 66.02 65.35 2ksm s SER 85 CO 0.03 0.29 0.04 -0.13 0.98 0.00 0.00 173.24 174.46 2ksm s ARG 86 N -0.44 0.42 -0.13 4.02 1.81 -0.60 -2.10 118.95 121.94 2ksm s ARG 86 Ca 0.05 -0.12 -0.07 0.00 -1.72 0.00 0.00 55.73 53.87 2ksm s ARG 86 Cb -0.12 -1.59 -0.06 0.00 -0.45 0.00 0.00 34.95 32.74 2ksm s ARG 86 CO 0.01 -0.53 -0.17 0.43 -0.68 0.00 0.00 175.30 174.36 2ksm n SER 87 N 5.16 0.97 0.00 0.23 7.64 0.21 -1.73 113.62 126.09 2ksm n SER 87 Ca -0.07 0.17 0.00 0.00 1.01 0.00 0.00 58.87 59.97 2ksm n SER 87 Cb 0.49 -0.40 0.00 0.00 -1.01 0.00 0.00 64.21 63.28 2ksm n SER 87 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ksm n GLY 88 N 2.16 -1.27 0.33 0.23 0.00 -1.17 -4.04 105.19 101.43 2ksm n GLY 88 Ca -0.26 0.48 -0.09 0.00 0.00 0.00 0.00 46.02 46.15 2ksm n GLY 88 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2ksm h ASN 89 N 0.00 -1.66 -2.83 1.61 -0.00 -1.94 -3.41 115.58 107.37 2ksm h ASN 89 Ca 0.00 0.25 -0.59 0.00 -0.00 0.00 0.00 56.30 55.96 2ksm h ASN 89 Cb 0.00 0.73 -0.09 0.00 -0.00 0.00 0.00 38.32 38.96 2ksm h ASN 89 CO 0.00 -0.20 -0.61 0.42 -0.00 0.00 0.00 177.43 177.05 2ksm s THR 90 N -4.95 4.19 -0.01 -3.57 -4.23 -1.26 -2.56 115.64 103.26 2ksm s THR 90 Ca -0.10 -1.18 0.08 0.00 -1.18 0.00 0.00 61.69 59.31 2ksm s THR 90 Cb 0.08 -3.11 -0.02 0.00 1.34 0.00 0.00 72.50 70.78 2ksm s THR 90 CO 0.48 -0.08 -0.24 -0.69 -0.54 0.00 0.00 174.62 173.55 2ksm s VAL 91 N -1.70 2.27 -0.25 2.29 1.01 -1.09 -4.03 120.40 118.90 2ksm s VAL 91 Ca 0.29 -1.12 0.02 0.00 0.00 0.00 0.00 61.98 61.17 2ksm s VAL 91 Cb -0.10 -1.83 0.06 0.00 0.00 0.00 0.00 36.38 34.51 2ksm s VAL 91 CO 0.21 0.52 -0.09 -0.89 0.00 0.00 0.00 175.10 174.86 2ksm s THR 92 N -0.69 1.93 -0.07 3.92 2.01 -0.89 -2.33 115.64 119.53 2ksm s THR 92 Ca 0.11 -1.50 0.02 0.00 0.31 0.00 0.00 61.69 60.63 2ksm s THR 92 Cb -0.10 -2.11 0.01 0.00 0.01 0.00 0.00 72.50 70.31 2ksm s THR 92 CO 0.00 -0.07 -0.13 -0.76 -0.69 0.00 0.00 174.62 172.98 2ksm s LEU 93 N 1.21 1.66 -0.12 4.42 1.02 -1.08 0.11 118.68 125.89 2ksm s LEU 93 Ca -0.07 -0.30 -0.07 0.00 0.02 0.00 0.00 54.13 53.70 2ksm s LEU 93 Cb -0.20 -0.84 0.05 0.00 0.02 0.00 0.00 46.19 45.22 2ksm s LEU 93 CO -0.06 0.04 0.28 0.27 0.02 0.00 0.00 176.35 176.90 2ksm s ILE 94 N 0.64 -0.03 -2.00 -0.59 -4.36 -0.50 -1.94 121.20 112.42 2ksm s ILE 94 Ca -0.15 0.11 0.00 0.00 -0.26 0.00 0.00 60.65 60.36 2ksm s ILE 94 Cb -0.16 -0.42 0.00 0.00 1.25 0.00 0.00 42.46 43.13 2ksm s ILE 94 CO 0.04 0.05 0.00 0.61 0.24 0.00 0.00 174.94 175.87 2ksm n GLY 95 N 4.02 -1.45 3.24 6.27 0.00 -1.24 -1.33 105.19 114.70 2ksm n GLY 95 Ca -0.23 -1.02 -0.33 0.00 0.00 0.00 0.00 46.02 44.45 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 -2.90 3.41 0.26 1.61 1.11 -0.35 -2.52 116.67 117.30 2ksm s ASP 96 Ca 0.00 -0.51 0.09 0.00 0.18 0.00 0.00 52.55 52.31 2ksm s ASP 96 Cb 0.00 -1.50 -0.04 0.00 1.07 0.00 0.00 42.92 42.45 2ksm s ASP 96 CO 0.00 0.11 0.03 -0.36 1.18 0.00 0.00 175.17 176.13 2ksm s PHE 97 N 0.64 2.77 0.03 4.23 0.40 0.45 -4.67 117.98 121.83 2ksm s PHE 97 Ca -0.10 -0.20 -0.17 0.00 -0.60 0.00 0.00 56.93 55.86 2ksm s PHE 97 Cb -0.16 -1.24 -0.27 0.00 0.51 0.00 0.00 43.02 41.86 2ksm s PHE 97 CO 0.02 0.60 1.09 -1.00 0.70 0.00 0.00 175.22 176.63 2ksm h PRO 98 N 1.90 0.53 0.00 0.24 0.13 -1.84 0.53 132.00 133.50 2ksm h PRO 98 Ca -0.45 -0.66 -0.45 0.00 -0.87 0.00 0.00 66.00 63.57 2ksm h PRO 98 Cb 1.24 0.21 -0.11 0.00 0.13 0.00 0.00 31.00 32.47 2ksm h PRO 98 CO 0.60 1.27 -0.41 -0.25 -0.23 0.00 0.00 178.00 178.98 2ksm n ASP 99 N -3.98 0.13 -0.07 1.44 8.00 -1.26 -3.91 116.55 116.90 2ksm n ASP 99 Ca -0.12 -2.92 -0.08 0.00 0.71 0.00 0.00 54.79 52.37 2ksm n ASP 99 Cb 0.85 1.24 -0.15 0.00 -0.02 0.00 0.00 41.12 43.04 2ksm n ASP 99 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2ksm n GLU 100 N -0.66 0.67 0.21 -1.24 -0.58 -1.26 -4.17 120.64 113.61 2ksm n GLU 100 Ca 0.02 0.08 0.06 0.00 -0.42 0.00 0.00 57.16 56.90 2ksm n GLU 100 Cb 0.53 -1.61 0.54 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 1.06 1.80 -0.79 0.62 0.00 -2.03 -1.66 119.26 118.26 2ksm h ALA 101 Ca -0.44 -0.09 0.23 0.00 0.00 0.00 0.00 54.91 54.61 2ksm h ALA 101 Cb 2.11 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 19.84 2ksm h ALA 101 CO 0.04 0.15 0.64 0.00 0.00 0.00 0.00 179.25 180.09 2ksm h ALA 102 N 1.87 2.67 -0.31 0.00 0.00 -2.00 0.57 119.26 122.06 2ksm h ALA 102 Ca 0.01 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 2ksm h ALA 102 Cb 0.17 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2ksm h ALA 102 CO 0.01 -1.05 -0.08 1.57 0.00 0.00 0.00 179.25 179.70 2ksm h LYS 103 N 0.00 0.50 -0.91 0.00 2.10 -1.55 -2.84 116.57 113.86 2ksm h LYS 103 Ca 0.38 -0.13 0.07 0.00 -2.00 0.00 0.00 60.65 58.96 2ksm h LYS 103 Cb 1.66 -0.06 -0.06 0.00 -0.90 0.00 0.00 32.23 32.86 2ksm h LYS 103 CO -0.00 0.59 0.58 0.00 -2.00 0.00 0.00 179.45 178.61 2ksm h ALA 104 N 1.45 1.27 -0.49 0.07 0.00 -0.00 1.13 119.26 122.68 2ksm h ALA 104 Ca 0.09 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 2ksm h ALA 104 Cb 0.44 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2ksm h ALA 104 CO 0.02 0.33 -0.05 0.00 0.00 0.00 0.00 179.25 179.55 2ksm h ALA 105 N 1.43 0.99 0.07 0.00 0.00 -1.57 -2.19 119.26 117.99 2ksm h ALA 105 Ca 0.40 -0.30 -0.11 0.00 0.00 0.00 0.00 54.91 54.90 2ksm h ALA 105 Cb 0.19 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 17.79 2ksm h ALA 105 CO -0.18 0.61 -0.52 1.25 0.00 0.00 0.00 179.25 180.41 2ksm h LEU 106 N 0.78 0.24 -0.68 0.00 6.46 -1.35 -3.34 115.31 117.42 2ksm h LEU 106 Ca 0.14 -0.95 0.14 0.00 -0.12 0.00 0.00 57.88 57.09 2ksm h LEU 106 Cb 0.54 -0.08 -0.13 0.00 -0.73 0.00 0.00 40.66 40.27 2ksm h LEU 106 CO 0.03 1.24 -0.11 0.24 -0.62 0.00 0.00 178.44 179.22 2ksm h MET 107 N -0.67 0.03 -0.43 1.25 2.86 0.13 1.43 114.93 119.54 2ksm h MET 107 Ca -0.10 -0.00 0.12 0.00 -2.06 0.00 0.00 59.70 57.66 2ksm h MET 107 Cb 1.36 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.99 2ksm h MET 107 CO 0.07 0.02 0.70 1.15 1.06 0.00 0.00 176.91 179.90 2ksm h THR 108 N 0.04 0.14 0.06 2.22 2.02 -1.51 1.20 112.91 117.07 2ksm h THR 108 Ca 0.34 0.00 -0.28 0.00 0.77 0.00 0.00 66.41 67.24 2ksm h THR 108 Cb 0.55 0.40 0.03 0.00 -1.74 0.00 0.00 68.15 67.38 2ksm h THR 108 CO -0.66 0.00 -1.14 0.00 0.37 0.00 0.00 175.52 174.09 2ksm h ALA 109 N 1.01 0.05 -0.65 6.16 0.00 0.18 -3.23 119.26 122.79 2ksm h ALA 109 Ca 0.20 -0.73 0.05 0.00 0.00 0.00 0.00 54.91 54.43 2ksm h ALA 109 Cb 1.59 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 19.43 2ksm h ALA 109 CO -0.00 0.67 0.43 -0.07 0.00 0.00 0.00 179.25 180.28 2ksm h LEU 110 N 0.32 0.63 -0.81 0.00 3.38 0.17 -1.61 115.31 117.38 2ksm h LEU 110 Ca -0.16 -0.00 0.15 0.00 0.09 0.00 0.00 57.88 57.96 2ksm h LEU 110 Cb 1.80 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 42.39 2ksm h LEU 110 CO 0.22 0.42 1.01 0.78 0.09 0.00 0.00 178.44 180.96 2ksm h ASN 111 N 0.72 0.00 0.67 -0.43 4.21 -1.48 2.44 115.58 121.70 2ksm h ASN 111 Ca 0.27 0.00 -0.27 0.00 1.21 0.00 0.00 56.30 57.51 2ksm h ASN 111 Cb 0.15 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.34 2ksm h ASN 111 CO -0.08 0.00 -1.31 1.23 -1.29 0.00 0.00 177.43 175.98 2ksm h GLY 112 N 0.00 0.18 1.12 2.83 0.00 -1.50 -3.33 103.07 102.38 2ksm h GLY 112 Ca 0.25 -0.47 -0.23 0.00 0.00 0.00 0.00 47.33 46.88 2ksm h GLY 112 CO -0.00 0.41 -1.48 1.41 0.00 0.00 0.00 176.54 176.88 2ksm h LEU 113 N 0.04 0.00 -7.84 3.11 3.38 0.37 -3.46 115.31 110.92 2ksm h LEU 113 Ca -0.15 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.20 2ksm h LEU 113 Cb 1.93 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 42.62 2ksm h LEU 113 CO 0.16 0.82 1.50 0.18 0.09 0.00 0.00 178.44 181.19 2ksm n LEU 114 N -3.02 0.52 -4.67 1.67 7.99 0.15 -4.89 117.00 114.75 2ksm n LEU 114 Ca -0.12 0.43 -0.23 0.00 -0.01 0.00 0.00 56.01 56.08 2ksm n LEU 114 Cb 0.95 -0.89 -0.07 0.00 -0.11 0.00 0.00 43.42 43.30 2ksm n LEU 114 CO 0.44 -0.73 -0.29 0.00 -1.51 0.00 0.00 177.39 175.31 2ksm s ALA 115 N 7.30 3.27 -0.16 -1.18 0.00 -1.26 -5.01 121.76 124.72 2ksm s ALA 115 Ca 1.25 -1.74 -0.29 0.00 0.00 0.00 0.00 51.96 51.18 2ksm s ALA 115 Cb -1.36 -0.71 -0.04 0.00 0.00 0.00 0.00 23.12 21.01 2ksm s ALA 115 CO 0.57 0.17 1.75 -1.25 0.00 0.00 0.00 175.76 177.00 2ksm s PRO 116 N -3.73 3.82 0.00 0.00 0.04 -1.26 -2.01 135.00 131.86 2ksm s PRO 116 Ca 0.34 1.93 0.00 0.00 0.04 0.00 0.00 61.00 63.30 2ksm s PRO 116 Cb -0.04 -4.09 0.00 0.00 0.04 0.00 0.00 34.50 30.41 2ksm s PRO 116 CO 0.21 -1.28 0.00 0.41 0.04 0.00 0.00 177.00 176.37 2ksm n GLY 117 N 4.70 0.53 3.73 0.56 0.00 -1.26 -5.03 105.19 108.42 2ksm n GLY 117 Ca 0.20 -0.52 -0.41 0.00 0.00 0.00 0.00 46.02 45.29 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 -2.00 4.52 -0.08 1.61 0.11 -0.85 -5.04 120.40 118.67 2ksm s VAL 118 Ca 0.00 2.07 -0.07 0.00 -2.93 0.00 0.00 61.98 61.06 2ksm s VAL 118 Cb 0.00 -4.32 -0.04 0.00 -1.53 0.00 0.00 36.38 30.48 2ksm s VAL 118 CO 0.00 0.31 0.18 0.20 -3.33 0.00 0.00 175.10 172.45 2ksm s ASN 119 N 0.06 6.42 -0.02 3.54 0.01 -1.06 -4.92 114.94 118.97 2ksm s ASN 119 Ca 0.47 0.48 0.07 0.00 -0.71 0.00 0.00 52.86 53.17 2ksm s ASN 119 Cb -0.23 -2.07 -0.02 0.00 0.41 0.00 0.00 41.25 39.34 2ksm s ASN 119 CO 0.30 0.36 -0.23 0.54 -1.51 0.00 0.00 177.10 176.56 2ksm s VAL 120 N -1.12 1.84 -0.42 1.60 0.11 -1.26 -2.66 120.40 118.49 2ksm s VAL 120 Ca 0.19 -0.99 0.04 0.00 -2.93 0.00 0.00 61.98 58.30 2ksm s VAL 120 Cb -0.13 -1.53 0.18 0.00 -1.53 0.00 0.00 36.38 33.37 2ksm s VAL 120 CO 0.09 0.52 0.36 -0.38 -3.33 0.00 0.00 175.10 172.36 2ksm n ILE 121 N 2.57 -1.03 -3.93 7.04 5.41 -0.98 -4.92 119.36 123.52 2ksm n ILE 121 Ca -0.16 -3.55 -0.35 0.00 1.00 0.00 0.00 62.75 59.70 2ksm n ILE 121 Cb 0.52 -1.70 -0.14 0.00 -0.71 0.00 0.00 39.64 37.60 2ksm n ILE 121 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2ksm s ASP 122 N -0.13 4.23 -0.28 4.38 2.15 -1.26 -2.65 116.67 123.11 2ksm s ASP 122 Ca 0.33 -0.57 0.02 0.00 0.43 0.00 0.00 52.55 52.75 2ksm s ASP 122 Cb 0.05 -1.70 0.08 0.00 -0.30 0.00 0.00 42.92 41.05 2ksm s ASP 122 CO -0.19 -0.06 -0.01 -1.10 -0.17 0.00 0.00 175.17 173.64 2ksm s GLN 123 N 1.42 1.55 0.01 4.34 -1.52 -0.82 -5.00 119.66 119.64 2ksm s GLN 123 Ca 0.04 -1.35 0.08 0.00 -1.95 0.00 0.00 55.36 52.18 2ksm s GLN 123 Cb -0.15 -2.75 -0.02 0.00 -0.22 0.00 0.00 33.01 29.87 2ksm s GLN 123 CO -0.04 -0.76 -0.26 0.42 -0.25 0.00 0.00 175.29 174.40 2ksm s ILE 124 N 1.22 2.04 0.09 1.08 1.01 -1.26 -3.73 121.20 121.64 2ksm s ILE 124 Ca 0.01 -1.22 0.02 0.00 0.00 0.00 0.00 60.65 59.47 2ksm s ILE 124 Cb -0.19 -1.72 -0.04 0.00 0.01 0.00 0.00 42.46 40.53 2ksm s ILE 124 CO -0.09 0.46 0.16 -2.28 0.00 0.00 0.00 174.94 173.19 2ksm s HIS 125 N -0.69 3.35 0.16 3.97 2.46 -1.05 -4.89 115.29 118.60 2ksm s HIS 125 Ca 0.10 0.14 -0.17 0.00 0.47 0.00 0.00 55.06 55.61 2ksm s HIS 125 Cb -0.10 -1.67 -0.07 0.00 -0.13 0.00 0.00 32.58 30.61 2ksm s HIS 125 CO 0.00 0.55 0.61 0.08 -2.47 0.00 0.00 174.74 173.51 2ksm s VAL 126 N -1.51 4.75 -0.49 0.89 1.01 -1.26 -0.42 120.40 123.37 2ksm s VAL 126 Ca 0.32 1.03 0.07 0.00 0.00 0.00 0.00 61.98 63.41 2ksm s VAL 126 Cb -0.12 -3.80 0.19 0.00 0.00 0.00 0.00 36.38 32.65 2ksm s VAL 126 CO 0.25 0.28 0.71 -1.81 0.00 0.00 0.00 175.10 174.54 2ksm s ASP 127 N -1.60 -1.44 0.00 3.32 1.01 0.18 -4.90 116.67 113.23 2ksm s ASP 127 Ca 0.38 -1.48 0.00 0.00 0.71 0.00 0.00 52.55 52.17 2ksm s ASP 127 Cb -0.16 1.88 0.00 0.00 1.01 0.00 0.00 42.92 45.65 2ksm s ASP 127 CO 0.20 -0.08 0.37 -2.65 0.21 0.00 0.00 175.17 173.22 2ksm n PRO 128 N 3.29 0.00 -0.13 8.23 -0.02 -1.25 -2.05 135.00 143.07 2ksm n PRO 128 Ca 0.16 0.00 -0.24 0.00 -2.02 0.00 0.00 63.50 61.40 2ksm n PRO 128 Cb 0.56 -1.41 -0.10 0.00 -0.02 0.00 0.00 33.50 32.53 2ksm n PRO 128 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2ksm n VAL 129 N -0.86 1.44 -0.25 -1.45 0.31 -1.26 -4.99 118.33 111.26 2ksm n VAL 129 Ca 0.00 -0.43 0.00 0.00 -0.01 0.00 0.00 64.34 63.90 2ksm n VAL 129 Cb 0.00 -1.68 0.00 0.00 -0.91 0.00 0.00 33.84 31.25 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 -3.83 0.00 -3.90 2.52 0.24 -0.87 -5.09 118.33 107.40 2ksm n VAL 130 Ca -0.49 0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 61.71 2ksm n VAL 130 Cb 0.90 -1.05 -0.09 0.00 -1.47 0.00 0.00 33.84 32.14 2ksm n VAL 130 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2ksm s ARG 131 N -1.44 0.62 0.19 7.34 1.70 -1.26 -4.93 118.95 121.16 2ksm s ARG 131 Ca 0.00 -0.69 0.00 0.00 -0.47 0.00 0.00 55.73 54.57 2ksm s ARG 131 Cb 0.00 0.25 -0.04 0.00 -0.57 0.00 0.00 34.95 34.58 2ksm s ARG 131 CO 0.00 -0.16 0.06 -1.12 -1.08 0.00 0.00 175.30 173.00 2ksm s SER 132 N -2.06 0.79 0.45 -2.89 0.01 -1.26 -4.81 113.70 103.92 2ksm s SER 132 Ca -0.06 -1.27 -0.24 0.00 1.31 0.00 0.00 55.95 55.69 2ksm s SER 132 Cb -0.02 0.22 -0.07 0.00 0.21 0.00 0.00 66.02 66.36 2ksm s SER 132 CO -0.04 -0.70 1.25 -0.22 0.41 0.00 0.00 173.24 173.95 2ksm s LEU 133 N -3.17 4.08 -0.62 2.44 2.96 -1.26 -4.96 118.68 118.15 2ksm s LEU 133 Ca 0.30 2.53 -0.23 0.00 -0.22 0.00 0.00 54.13 56.51 2ksm s LEU 133 Cb 0.07 -4.09 0.06 0.00 0.50 0.00 0.00 46.19 42.73 2ksm s LEU 133 CO 0.07 -0.99 0.92 -1.81 -1.32 0.00 0.00 176.35 173.22 2ksm s ASP 134 N -1.02 6.22 0.00 3.68 1.11 -1.26 -4.87 116.67 120.53 2ksm s ASP 134 Ca 0.62 -0.82 0.16 0.00 0.18 0.00 0.00 52.55 52.69 2ksm s ASP 134 Cb -0.35 -2.41 0.57 0.00 1.07 0.00 0.00 42.92 41.80 2ksm s ASP 134 CO 0.43 -1.33 1.43 2.22 1.18 0.00 0.00 175.17 179.09 2ksm n PHE 135 N 7.49 0.31 -0.52 4.23 1.16 -1.26 -4.35 117.46 124.52 2ksm n PHE 135 Ca -0.03 -0.15 0.44 0.00 -1.87 0.00 0.00 57.45 55.84 2ksm n PHE 135 Cb 0.46 0.00 0.73 0.00 -1.61 0.00 0.00 39.48 39.05 2ksm n PHE 135 CO 0.00 0.00 0.00 1.03 -1.87 0.00 0.00 176.76 175.92 2ksm h SER 136 N 2.04 0.00 -0.41 5.98 0.87 -1.94 1.78 113.55 121.87 2ksm h SER 136 Ca 0.00 0.00 -0.30 0.00 -1.23 0.00 0.00 61.79 60.26 2ksm h SER 136 Cb 0.45 0.00 -0.26 0.00 -0.44 0.00 0.00 62.40 62.15 2ksm h SER 136 CO 0.00 0.00 -0.73 -1.54 -0.53 0.00 0.00 176.83 174.03 2ksm n SER 137 N -3.80 3.29 0.08 6.23 3.41 -1.26 -4.65 113.62 116.93 2ksm n SER 137 Ca 0.36 -3.61 0.02 0.00 -0.26 0.00 0.00 58.87 55.38 2ksm n SER 137 Cb 1.77 -0.42 -0.03 0.00 -0.26 0.00 0.00 64.21 65.27 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 1.70 0.65 0.08 7.33 0.00 0.25 -3.23 119.26 126.03 2ksm h ALA 138 Ca 0.17 -0.61 0.01 0.00 0.00 0.00 0.00 54.91 54.47 2ksm h ALA 138 Cb 1.34 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.19 2ksm h ALA 138 CO 0.40 0.72 -0.36 0.93 0.00 0.00 0.00 179.25 180.94 2ksm h GLU 139 N 0.00 -0.49 -0.98 0.00 4.39 -1.83 2.43 114.58 118.11 2ksm h GLU 139 Ca -0.08 0.03 0.14 0.00 0.34 0.00 0.00 59.36 59.79 2ksm h GLU 139 Cb 1.45 0.11 -0.09 0.00 -0.10 0.00 0.00 28.75 30.12 2ksm h GLU 139 CO 0.05 -0.33 0.60 -1.00 -1.16 0.00 0.00 179.01 177.17 2ksm h PRO 140 N -0.51 0.87 0.10 2.33 0.13 -1.94 0.24 132.00 133.22 2ksm h PRO 140 Ca -0.00 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 65.07 2ksm h PRO 140 Cb 0.52 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 31.45 2ksm h PRO 140 CO -0.20 0.57 -0.05 0.28 -0.23 0.00 0.00 178.00 178.37 2ksm h VAL 141 N 0.89 0.00 -1.01 1.56 2.07 -1.28 -2.75 116.25 115.73 2ksm h VAL 141 Ca 0.51 -0.28 0.32 0.00 0.82 0.00 0.00 66.70 68.07 2ksm h VAL 141 Cb 0.59 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.21 2ksm h VAL 141 CO -0.30 0.00 0.58 0.15 0.02 0.00 0.00 177.57 178.02 2ksm h PHE 142 N -0.42 0.92 -0.13 1.57 3.57 0.41 1.73 116.94 124.58 2ksm h PHE 142 Ca -0.01 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.47 2ksm h PHE 142 Cb 0.11 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.59 2ksm h PHE 142 CO 0.04 -0.17 -0.17 1.79 -2.23 0.00 0.00 178.31 177.57 2ksm h THR 143 N 0.32 1.19 0.00 4.41 1.35 -0.60 -0.42 112.91 119.15 2ksm h THR 143 Ca 0.74 -0.86 -0.00 0.00 -0.55 0.00 0.00 66.41 65.74 2ksm h THR 143 Cb 1.70 1.28 -0.00 0.00 -1.73 0.00 0.00 68.15 69.40 2ksm h THR 143 CO -0.59 0.26 -0.01 0.00 -0.25 0.00 0.00 175.52 174.93 2ksm h ALA 144 N 1.63 1.01 -0.18 6.62 0.00 0.29 -2.30 119.26 126.34 2ksm h ALA 144 Ca 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.94 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 0.01 0.00 0.45 0.00 0.00 0.00 179.25 179.74 2ksm n SER 145 N -3.12 2.41 -0.09 0.00 2.88 -0.50 -4.65 113.62 110.55 2ksm n SER 145 Ca -0.00 -1.74 -0.11 0.00 -1.33 0.00 0.00 58.87 55.68 2ksm n SER 145 Cb 0.25 -0.12 -0.04 0.00 -0.75 0.00 0.00 64.21 63.55 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 1.92 1.27 0.00 2.46 2.07 -0.52 -3.06 116.25 120.39 2ksm h VAL 146 Ca 0.00 -1.01 0.00 0.00 0.82 0.00 0.00 66.70 66.51 2ksm h VAL 146 Cb 0.58 1.41 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 2ksm h VAL 146 CO 0.00 0.32 0.00 -0.81 0.02 0.00 0.00 177.57 177.10 2ksm n PRO 147 N -4.57 0.01 -2.78 1.57 -0.04 -1.26 -3.09 135.00 124.85 2ksm n PRO 147 Ca -0.03 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.35 2ksm n PRO 147 Cb 0.28 -1.00 0.03 0.00 -0.04 0.00 0.00 33.50 32.76 2ksm n PRO 147 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 2ksm n ILE 148 N 0.41 -0.04 0.10 0.52 0.00 -1.16 -5.02 119.36 114.18 2ksm n ILE 148 Ca 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 62.75 61.35 2ksm n ILE 148 Cb 0.00 1.15 0.00 0.00 0.00 0.00 0.00 39.64 40.79 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 2.19 0.34 -0.78 9.51 -0.04 -1.18 -3.40 135.00 141.64 2ksm n PRO 149 Ca 0.13 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.61 2ksm n PRO 149 Cb 0.60 -1.33 0.19 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 1.30 2.13 0.00 3.54 8.00 -1.04 -0.62 116.55 129.87 2ksm n ASP 150 Ca 0.00 -3.89 0.00 0.00 0.71 0.00 0.00 54.79 51.61 2ksm n ASP 150 Cb 0.17 -0.51 0.00 0.00 -0.02 0.00 0.00 41.12 40.76 2ksm n ASP 150 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 2ksm n PHE 151 N -1.07 0.00 -3.63 1.24 -1.74 -0.70 -3.71 117.46 107.85 2ksm n PHE 151 Ca 0.22 0.00 -0.01 0.00 -0.56 0.00 0.00 57.45 57.10 2ksm n PHE 151 Cb 0.73 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 41.72 2ksm n PHE 151 CO 0.00 0.00 0.00 0.20 -0.56 0.00 0.00 176.76 176.40 2ksm s GLY 152 N 0.00 -0.25 -0.06 4.97 0.00 -0.86 -1.55 107.32 109.56 2ksm s GLY 152 Ca 0.00 1.74 0.05 0.00 0.00 0.00 0.00 44.72 46.51 2ksm s GLY 152 CO 0.00 0.55 -0.21 1.08 0.00 0.00 0.00 173.10 174.53 2ksm s LEU 153 N -2.20 2.32 -0.08 0.66 2.01 -1.09 -3.27 118.68 117.04 2ksm s LEU 153 Ca 0.12 -0.40 0.00 0.00 0.01 0.00 0.00 54.13 53.86 2ksm s LEU 153 Cb 0.01 -1.45 0.02 0.00 0.01 0.00 0.00 46.19 44.78 2ksm s LEU 153 CO -0.03 0.27 -0.05 -0.75 1.01 0.00 0.00 176.35 176.79 2ksm s LYS 154 N -0.28 1.12 -0.01 1.70 2.36 -0.95 -2.07 119.74 121.61 2ksm s LYS 154 Ca 0.00 -0.14 0.01 0.00 -2.55 0.00 0.00 55.97 53.29 2ksm s LYS 154 Cb -0.13 -1.20 0.01 0.00 -1.05 0.00 0.00 37.83 35.46 2ksm s LYS 154 CO 0.03 -0.19 -0.02 0.08 1.55 0.00 0.00 175.35 176.80 2ksm s VAL 155 N 1.43 0.22 -0.15 4.02 1.01 -0.79 -1.50 120.40 124.64 2ksm s VAL 155 Ca -0.02 -0.06 -0.30 0.00 0.00 0.00 0.00 61.98 61.60 2ksm s VAL 155 Cb -0.13 -0.23 0.13 0.00 0.00 0.00 0.00 36.38 36.14 2ksm s VAL 155 CO -0.04 0.10 1.00 -0.70 0.00 0.00 0.00 175.10 175.46 2ksm s GLU 156 N 0.30 0.60 6.32 2.72 2.12 -1.15 -2.95 118.70 126.66 2ksm s GLU 156 Ca -0.03 0.09 0.00 0.00 0.36 0.00 0.00 54.97 55.39 2ksm s GLU 156 Cb -0.05 0.28 0.00 0.00 0.26 0.00 0.00 34.13 34.62 2ksm s GLU 156 CO -0.01 -0.20 0.00 0.54 -0.54 0.00 0.00 175.26 175.06 2ksm n ARG 157 N 0.59 0.00 -0.59 4.30 1.74 -1.26 -2.17 116.66 119.27 2ksm n ARG 157 Ca -0.09 0.00 0.05 0.00 -0.77 0.00 0.00 57.85 57.04 2ksm n ARG 157 Cb 0.58 0.00 0.09 0.00 -1.02 0.00 0.00 32.46 32.11 2ksm n ARG 157 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2ksm n ASP 158 N 9.45 1.27 -4.12 0.55 2.03 -1.26 -4.89 116.55 119.58 2ksm n ASP 158 Ca 0.00 -2.73 -0.13 0.00 0.52 0.00 0.00 54.79 52.45 2ksm n ASP 158 Cb 0.00 -0.36 -0.11 0.00 -0.72 0.00 0.00 41.12 39.93 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 -1.56 0.70 -0.04 5.18 2.01 -0.92 -4.07 115.64 116.94 2ksm s THR 159 Ca 0.24 -1.38 0.02 0.00 0.31 0.00 0.00 61.69 60.89 2ksm s THR 159 Cb 0.24 -1.01 0.01 0.00 0.01 0.00 0.00 72.50 71.75 2ksm s THR 159 CO -0.04 -0.50 -0.09 -0.69 -0.69 0.00 0.00 174.62 172.61 2ksm s VAL 160 N -2.02 0.86 -0.02 3.82 1.01 0.67 -2.93 120.40 121.79 2ksm s VAL 160 Ca -0.02 -0.35 0.07 0.00 0.00 0.00 0.00 61.98 61.68 2ksm s VAL 160 Cb -0.06 -0.80 -0.02 0.00 0.00 0.00 0.00 36.38 35.51 2ksm s VAL 160 CO -0.01 0.28 -0.25 0.42 0.00 0.00 0.00 175.10 175.55 2ksm s THR 161 N 0.52 1.95 -0.08 3.92 -4.23 -0.57 -2.33 115.64 114.83 2ksm s THR 161 Ca -0.09 -1.05 0.04 0.00 -1.18 0.00 0.00 61.69 59.40 2ksm s THR 161 Cb -0.13 -1.62 0.00 0.00 1.34 0.00 0.00 72.50 72.10 2ksm s THR 161 CO 0.02 0.55 -0.20 -0.22 -0.54 0.00 0.00 174.62 174.23 2ksm s LEU 162 N -0.55 1.94 -0.03 4.79 0.20 -0.87 -2.23 118.68 121.93 2ksm s LEU 162 Ca 0.09 -0.45 -0.01 0.00 0.69 0.00 0.00 54.13 54.45 2ksm s LEU 162 Cb -0.10 -1.18 0.03 0.00 -0.43 0.00 0.00 46.19 44.52 2ksm s LEU 162 CO -0.01 0.14 0.05 0.42 -0.29 0.00 0.00 176.35 176.66 2ksm s THR 163 N 0.31 -0.05 -0.19 3.68 -4.23 -1.20 0.02 115.64 113.98 2ksm s THR 163 Ca -0.13 0.20 -0.16 0.00 -1.18 0.00 0.00 61.69 60.41 2ksm s THR 163 Cb -0.16 -0.11 0.05 0.00 1.34 0.00 0.00 72.50 73.62 2ksm s THR 163 CO 0.06 0.08 0.50 -0.83 -0.54 0.00 0.00 174.62 173.89 2ksm s GLY 164 N 1.02 -0.38 -0.09 3.99 0.00 -1.26 -2.03 107.32 108.56 2ksm s GLY 164 Ca -0.08 1.49 -0.30 0.00 0.00 0.00 0.00 44.72 45.83 2ksm s GLY 164 CO -0.03 1.36 1.44 -0.51 0.00 0.00 0.00 173.10 175.35 2ksm s THR 165 N 0.51 3.90 -0.49 0.90 -4.23 -1.24 -3.30 115.64 111.69 2ksm s THR 165 Ca -0.02 1.14 0.03 0.00 -1.18 0.00 0.00 61.69 61.66 2ksm s THR 165 Cb -0.04 -3.74 0.15 0.00 1.34 0.00 0.00 72.50 70.21 2ksm s THR 165 CO -0.02 -0.08 0.32 0.00 -0.54 0.00 0.00 174.62 174.30 2ksm s ALA 166 N 3.45 2.28 -0.53 3.99 0.00 -1.26 -4.93 121.76 124.76 2ksm s ALA 166 Ca 0.64 -2.82 0.00 0.00 0.00 0.00 0.00 51.96 49.78 2ksm s ALA 166 Cb -0.28 -1.86 0.00 0.00 0.00 0.00 0.00 23.12 20.98 2ksm s ALA 166 CO 0.23 -2.05 0.63 -2.30 0.00 0.00 0.00 175.76 172.27 2ksm n PRO 167 N 3.01 0.00 0.00 0.00 -0.02 -1.26 -3.74 135.00 132.99 2ksm n PRO 167 Ca 0.17 0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 2ksm n PRO 167 Cb 0.38 -1.72 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 -1.13 0.00 0.00 2.55 7.64 -1.26 -5.10 113.62 116.32 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 0.22 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.42 2ksm n SER 168 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2ksm n SER 169 N 0.00 0.00 0.21 6.43 3.41 -1.25 -4.93 113.62 117.49 2ksm n SER 169 Ca 0.00 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.73 2ksm n SER 169 Cb 0.00 0.00 0.42 0.00 -0.26 0.00 0.00 64.21 64.37 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 -0.54 4.33 5.08 -2.00 -0.01 114.58 121.44 2ksm h GLU 170 Ca 0.00 0.00 0.16 0.00 -1.00 0.00 0.00 59.36 58.52 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 0.89 0.45 -1.00 0.00 0.00 179.01 179.35 2ksm h HIS 171 N 0.00 0.00 0.00 4.33 3.86 -1.94 2.09 115.15 123.50 2ksm h HIS 171 Ca 0.11 0.00 -0.21 0.00 -1.16 0.00 0.00 60.37 59.11 2ksm h HIS 171 Cb 1.64 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 30.08 2ksm h HIS 171 CO 0.00 0.00 -1.09 1.57 0.86 0.00 0.00 177.93 179.27 2ksm h LYS 172 N 0.00 0.00 0.11 2.45 2.10 -1.39 -3.34 116.57 116.50 2ksm h LYS 172 Ca 0.26 0.00 0.01 0.00 -2.00 0.00 0.00 60.65 58.91 2ksm h LYS 172 Cb 2.03 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 33.32 2ksm h LYS 172 CO -0.00 0.79 -0.41 0.22 -2.00 0.00 0.00 179.45 178.05 2ksm h ASP 173 N 0.00 -1.22 -0.81 7.07 1.82 0.32 0.65 116.42 124.26 2ksm h ASP 173 Ca -0.07 0.13 0.10 0.00 -0.39 0.00 0.00 57.03 56.79 2ksm h ASP 173 Cb 1.75 0.45 -0.07 0.00 0.68 0.00 0.00 39.33 42.13 2ksm h ASP 173 CO 0.11 -0.43 0.45 0.00 -1.61 0.00 0.00 179.24 177.75 2ksm h ALA 174 N -0.80 1.15 -0.52 -0.78 0.00 -1.73 0.34 119.26 116.91 2ksm h ALA 174 Ca -0.01 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2ksm h ALA 174 Cb 0.59 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2ksm h ALA 174 CO -0.21 0.07 0.21 0.28 0.00 0.00 0.00 179.25 179.60 2ksm h VAL 175 N 0.75 1.21 -0.10 0.00 2.07 -1.53 -0.92 116.25 117.73 2ksm h VAL 175 Ca 0.39 -0.66 -0.05 0.00 0.82 0.00 0.00 66.70 67.20 2ksm h VAL 175 Cb 0.38 0.68 -0.00 0.00 -1.52 0.00 0.00 31.29 30.82 2ksm h VAL 175 CO -0.26 0.25 -0.12 0.50 0.02 0.00 0.00 177.57 177.97 2ksm h LYS 176 N 0.70 0.27 -0.39 1.57 3.11 0.12 -1.80 116.57 120.16 2ksm h LYS 176 Ca 0.17 -0.15 0.04 0.00 -2.81 0.00 0.00 60.65 57.91 2ksm h LYS 176 Cb 0.19 0.01 -0.04 0.00 -1.00 0.00 0.00 32.23 31.39 2ksm h LYS 176 CO -0.01 0.70 0.15 -0.09 -2.81 0.00 0.00 179.45 177.39 2ksm h ARG 177 N -0.15 0.31 -0.65 1.90 2.43 -0.32 0.50 114.38 118.41 2ksm h ARG 177 Ca 0.01 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 2ksm h ARG 177 Cb 0.66 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.11 2ksm h ARG 177 CO 0.03 0.21 0.32 0.00 -1.51 0.00 0.00 179.97 179.02 2ksm h ALA 178 N 1.24 0.84 -0.12 2.80 0.00 -1.19 -1.59 119.26 121.23 2ksm h ALA 178 Ca 0.17 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2ksm h ALA 178 Cb 0.13 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 2ksm h ALA 178 CO -0.16 0.40 -0.01 0.00 0.00 0.00 0.00 179.25 179.47 2ksm h ALA 179 N 1.15 0.16 -0.49 0.00 0.00 -0.65 -2.80 119.26 116.63 2ksm h ALA 179 Ca 0.22 -0.21 0.05 0.00 0.00 0.00 0.00 54.91 54.98 2ksm h ALA 179 Cb 0.11 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 2ksm h ALA 179 CO -0.03 -0.12 0.21 1.79 0.00 0.00 0.00 179.25 181.10 2ksm h THR 180 N -0.08 0.90 0.00 0.00 1.35 0.12 0.02 112.91 115.21 2ksm h THR 180 Ca 0.03 -0.14 -0.01 0.00 -0.55 0.00 0.00 66.41 65.74 2ksm h THR 180 Cb 0.41 0.45 -0.00 0.00 -1.73 0.00 0.00 68.15 67.27 2ksm h THR 180 CO 0.01 0.08 -0.06 0.77 -0.25 0.00 0.00 175.52 176.06 2ksm h SER 181 N 0.41 0.00 0.98 5.36 4.64 -1.28 0.59 113.55 124.26 2ksm h SER 181 Ca 0.22 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.37 2ksm h SER 181 Cb 0.19 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.25 2ksm h SER 181 CO -0.19 0.06 -1.08 0.71 -0.87 0.00 0.00 176.83 175.45 2ksm h THR 182 N 0.00 0.95 -1.63 2.95 1.35 -0.85 -3.39 112.91 112.29 2ksm h THR 182 Ca -0.00 -2.51 -0.46 0.00 -0.55 0.00 0.00 66.41 62.89 2ksm h THR 182 Cb 0.16 2.41 -0.35 0.00 -1.73 0.00 0.00 68.15 68.64 2ksm h THR 182 CO 0.01 0.54 -1.04 0.79 -0.25 0.00 0.00 175.52 175.57 2ksm n TRP 183 N -3.13 -0.56 0.15 4.73 8.01 -0.17 -4.97 117.44 121.51 2ksm n TRP 183 Ca -0.05 -3.42 0.00 0.00 -1.31 0.00 0.00 57.50 52.73 2ksm n TRP 183 Cb 0.87 -0.03 0.20 0.00 -2.01 0.00 0.00 31.31 30.34 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 3.33 0.00 -0.22 -0.99 0.13 -0.08 -3.08 132.00 131.10 2ksm h PRO 184 Ca 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 2ksm h PRO 184 Cb 0.96 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.09 2ksm h PRO 184 CO 0.43 0.56 0.00 -0.25 -0.23 0.00 0.00 178.00 178.52 2ksm n ASP 185 N -3.70 1.84 -4.35 1.44 8.00 -1.26 -4.82 116.55 113.70 2ksm n ASP 185 Ca -0.01 -1.78 -0.33 0.00 0.71 0.00 0.00 54.79 53.39 2ksm n ASP 185 Cb 0.60 -0.14 -0.15 0.00 -0.02 0.00 0.00 41.12 41.41 2ksm n ASP 185 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2ksm s MET 186 N -1.72 3.28 -0.80 -1.24 -1.94 -1.16 -5.03 119.30 110.69 2ksm s MET 186 Ca 0.31 -0.72 -0.32 0.00 -1.71 0.00 0.00 55.69 53.26 2ksm s MET 186 Cb 0.17 -2.56 -0.18 0.00 2.01 0.00 0.00 34.83 34.26 2ksm s MET 186 CO 0.25 0.24 2.54 1.63 -0.01 0.00 0.00 175.02 179.67 2ksm n LYS 187 N 3.45 0.25 -3.91 2.03 5.02 -1.26 -4.75 118.16 118.99 2ksm n LYS 187 Ca -0.18 0.02 -0.35 0.00 -2.02 0.00 0.00 58.31 55.78 2ksm n LYS 187 Cb 0.53 -1.90 -0.13 0.00 -0.02 0.00 0.00 35.03 33.51 2ksm n LYS 187 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2ksm s ILE 188 N 9.02 3.71 -0.27 -0.18 -1.09 -1.26 -0.24 121.20 130.91 2ksm s ILE 188 Ca 1.26 -0.38 -0.02 0.00 -2.23 0.00 0.00 60.65 59.28 2ksm s ILE 188 Cb -1.08 -2.70 0.09 0.00 -1.58 0.00 0.00 42.46 37.18 2ksm s ILE 188 CO 0.47 0.40 0.08 0.54 -1.23 0.00 0.00 174.94 175.21 2ksm s VAL 189 N 1.41 0.59 -0.41 2.92 0.11 -0.98 -5.04 120.40 118.99 2ksm s VAL 189 Ca 0.05 -0.99 -0.19 0.00 -2.93 0.00 0.00 61.98 57.91 2ksm s VAL 189 Cb -0.15 -1.33 0.02 0.00 -1.53 0.00 0.00 36.38 33.40 2ksm s VAL 189 CO -0.00 -0.52 0.57 0.20 -3.33 0.00 0.00 175.10 172.02 2ksm s ASN 190 N 1.78 6.30 -0.54 3.54 -0.87 -1.26 -2.05 114.94 121.84 2ksm s ASN 190 Ca 0.06 -0.34 0.04 0.00 -1.57 0.00 0.00 52.86 51.04 2ksm s ASN 190 Cb -0.17 -2.29 0.14 0.00 -0.02 0.00 0.00 41.25 38.91 2ksm s ASN 190 CO -0.21 -0.67 0.30 0.20 -2.57 0.00 0.00 177.10 174.14 2ksm s ASN 191 N 1.91 4.28 0.45 -1.22 0.01 0.10 -4.95 114.94 115.52 2ksm s ASN 191 Ca 0.19 -3.11 -0.23 0.00 -0.71 0.00 0.00 52.86 49.00 2ksm s ASN 191 Cb -0.15 -1.55 -0.08 0.00 0.41 0.00 0.00 41.25 39.88 2ksm s ASN 191 CO 0.17 -0.21 1.15 0.27 -1.51 0.00 0.00 177.10 176.97 2ksm s ILE 192 N -0.41 3.19 -0.20 0.60 -4.36 -1.26 -4.44 121.20 114.32 2ksm s ILE 192 Ca 0.19 0.89 -0.03 0.00 -0.26 0.00 0.00 60.65 61.44 2ksm s ILE 192 Cb -0.22 -3.45 0.06 0.00 1.25 0.00 0.00 42.46 40.10 2ksm s ILE 192 CO -0.03 -0.01 0.04 -1.83 0.24 0.00 0.00 174.94 173.35 2ksm s GLU 193 N -2.67 0.64 -0.34 0.37 -1.05 -1.21 -4.92 118.70 109.52 2ksm s GLU 193 Ca 0.63 -0.45 -0.29 0.00 -0.15 0.00 0.00 54.97 54.71 2ksm s GLU 193 Cb -0.28 -2.09 -0.00 0.00 -0.44 0.00 0.00 34.13 31.32 2ksm s GLU 193 CO 0.34 -0.66 1.48 0.14 0.95 0.00 0.00 175.26 177.50 2ksm s VAL 194 N 1.86 3.86 0.24 1.83 -7.23 -1.26 -4.30 120.40 115.40 2ksm s VAL 194 Ca -0.00 0.92 -0.29 0.00 -1.81 0.00 0.00 61.98 60.80 2ksm s VAL 194 Cb -0.17 -4.02 -0.15 0.00 0.56 0.00 0.00 36.38 32.60 2ksm s VAL 194 CO -0.09 -0.56 0.98 0.41 -0.31 0.00 0.00 175.10 175.53 2ksm n THR 195 N 6.79 1.70 0.00 5.32 -1.04 -1.26 -4.46 114.28 121.33 2ksm n THR 195 Ca 0.17 -0.43 0.00 0.00 -2.04 0.00 0.00 64.05 61.76 2ksm n THR 195 Cb 0.47 -0.81 0.00 0.00 -1.82 0.00 0.00 70.33 68.17 2ksm n THR 195 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2ksm n GLY 196 N 1.54 0.04 3.30 3.41 0.00 -1.26 -5.02 105.19 107.20 2ksm n GLY 196 Ca 0.12 0.19 -0.24 0.00 0.00 0.00 0.00 46.02 46.09 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 -0.94 -1.05 1.61 1.13 -1.26 -5.04 117.38 111.83 2ksm n GLN 197 Ca 0.00 -1.85 -0.31 0.00 -1.94 0.00 0.00 57.00 52.91 2ksm n GLN 197 Cb 0.00 -1.08 0.13 0.00 0.11 0.00 0.00 30.24 29.40 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 -3.84 1.75 0.74 -1.58 0.00 -1.26 -5.01 121.76 112.57 2ksm s ALA 198 Ca 0.63 0.28 -0.11 0.00 0.00 0.00 0.00 51.96 52.76 2ksm s ALA 198 Cb -0.02 -3.31 0.04 0.00 0.00 0.00 0.00 23.12 19.83 2ksm s ALA 198 CO 0.44 -2.28 1.08 -1.25 0.00 0.00 0.00 175.76 173.75 2ksm s PRO 199 N -4.81 2.52 0.17 0.00 0.04 -1.26 -4.95 135.00 126.71 2ksm s PRO 199 Ca 0.64 1.05 -0.27 0.00 0.04 0.00 0.00 61.00 62.46 2ksm s PRO 199 Cb -0.19 -1.93 0.02 0.00 0.04 0.00 0.00 34.50 32.43 2ksm s PRO 199 CO 0.57 -1.42 1.55 -1.35 0.04 0.00 0.00 177.00 176.39 2ksm h PRO 200 N -0.96 -0.07 0.00 0.56 0.11 -2.00 -3.45 132.00 126.19 2ksm h PRO 200 Ca -0.44 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2ksm h PRO 200 Cb 1.22 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2ksm h PRO 200 CO 0.54 -0.05 0.00 0.41 -0.21 0.00 0.00 178.00 178.69 2ksm n GLY 201 N -1.34 -1.80 3.19 -0.55 0.00 -1.26 -5.15 105.19 98.28 2ksm n GLY 201 Ca 0.03 0.44 -0.35 0.00 0.00 0.00 0.00 46.02 46.14 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 -3.03 -0.05 0.00 1.61 -0.02 -1.26 -5.24 135.00 127.01 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 0.00 -1.32 0.48 0.00 -0.02 0.00 0.00 33.50 32.64 2ksm n PRO 202 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13