#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kls n HIS 41 N 0.00 -4.52 0.00 -1.77 8.25 -1.26 -5.09 115.22 110.83 3kls n HIS 41 Ca 0.00 2.47 0.00 0.00 -0.26 0.00 0.00 57.72 59.93 3kls n HIS 41 Cb 0.00 -3.41 0.00 0.00 1.12 0.00 0.00 29.99 27.70 3kls n HIS 41 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 3kls n ASP 42 N 1.00 0.00 -0.02 0.41 -0.08 -1.26 -5.04 116.55 111.56 3kls n ASP 42 Ca 0.00 0.00 -0.19 0.00 -1.51 0.00 0.00 54.79 53.09 3kls n ASP 42 Cb 0.00 0.00 -0.14 0.00 2.34 0.00 0.00 41.12 43.32 3kls n ASP 42 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3kls n ILE 43 N -0.94 1.71 -0.13 5.18 3.06 -1.26 -3.93 119.36 123.05 3kls n ILE 43 Ca 0.00 -0.67 -0.07 0.00 -2.50 0.00 0.00 62.75 59.51 3kls n ILE 43 Cb 0.00 -1.56 0.01 0.00 0.54 0.00 0.00 39.64 38.63 3kls n ILE 43 CO 0.00 0.00 0.00 0.03 -2.50 0.00 0.00 176.55 174.08 3kls h ARG 44 N 0.05 0.48 -0.20 9.51 3.08 -1.97 -3.20 114.38 122.14 3kls h ARG 44 Ca -0.43 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 59.55 3kls h ARG 44 Cb 2.02 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 31.95 3kls h ARG 44 CO 0.06 0.32 -0.01 -0.44 -1.07 0.00 0.00 179.97 178.83 3kls h ASP 45 N 0.50 0.35 0.08 7.04 3.32 -1.97 -2.99 116.42 122.75 3kls h ASP 45 Ca 0.17 -0.32 0.00 0.00 0.02 0.00 0.00 57.03 56.90 3kls h ASP 45 Cb 0.01 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.46 3kls h ASP 45 CO -0.07 0.58 0.00 0.18 -1.72 0.00 0.00 179.24 178.21 3kls n LEU 46 N -4.68 0.55 0.03 1.55 4.77 -1.21 0.16 117.00 118.17 3kls n LEU 46 Ca -0.04 0.74 0.12 0.00 -0.03 0.00 0.00 56.01 56.80 3kls n LEU 46 Cb 0.24 -0.79 0.18 0.00 -2.33 0.00 0.00 43.42 40.71 3kls n LEU 46 CO 0.37 -0.89 0.33 1.57 -1.33 0.00 0.00 177.39 177.44 3kls n HIS 47 N -2.22 0.30 -0.10 -1.77 -0.00 -1.13 -3.87 115.22 106.43 3kls n HIS 47 Ca -0.01 0.09 -0.12 0.00 0.46 0.00 0.00 57.72 58.14 3kls n HIS 47 Cb 0.05 -0.47 -0.14 0.00 -0.12 0.00 0.00 29.99 29.31 3kls n HIS 47 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 3kls n ARG 48 N -1.86 0.82 0.09 1.57 1.74 0.12 -4.12 116.66 115.02 3kls n ARG 48 Ca 0.04 0.04 -0.19 0.00 -0.77 0.00 0.00 57.85 56.96 3kls n ARG 48 Cb 0.40 -1.49 -0.11 0.00 -1.02 0.00 0.00 32.46 30.24 3kls n ARG 48 CO 0.00 0.00 0.00 1.88 -1.52 0.00 0.00 177.63 177.99 3kls h TYR 49 N 0.00 0.84 -0.01 -1.55 0.05 -1.54 -3.32 116.97 111.44 3kls h TYR 49 Ca -0.52 -0.53 0.00 0.00 0.05 0.00 0.00 58.73 57.73 3kls h TYR 49 Cb 2.07 -0.07 0.00 0.00 1.01 0.00 0.00 36.73 39.74 3kls h TYR 49 CO 0.01 1.37 -0.17 0.66 -1.05 0.00 0.00 178.16 178.98 3kls n TYR 50 N -3.74 0.00 1.16 4.88 4.01 -1.25 -3.19 117.16 119.03 3kls n TYR 50 Ca -0.11 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.75 3kls n TYR 50 Cb 0.96 -0.12 0.22 0.00 -0.31 0.00 0.00 39.34 40.09 3kls n TYR 50 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 3kls n SER 51 N -0.65 1.62 -3.95 7.72 3.41 -1.25 -4.41 113.62 116.10 3kls n SER 51 Ca 0.14 -1.28 -0.29 0.00 -0.26 0.00 0.00 58.87 57.17 3kls n SER 51 Cb 0.32 0.24 0.26 0.00 -0.26 0.00 0.00 64.21 64.78 3kls n SER 51 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3kls s SER 52 N -2.40 0.15 -0.51 4.04 1.04 -1.19 -4.95 113.70 109.87 3kls s SER 52 Ca 0.24 1.06 -0.25 0.00 0.48 0.00 0.00 55.95 57.48 3kls s SER 52 Cb 0.19 -1.58 0.03 0.00 0.10 0.00 0.00 66.02 64.76 3kls s SER 52 CO 0.51 -4.65 0.94 -1.61 0.98 0.00 0.00 173.24 169.41 3kls s GLU 53 N -4.90 3.43 0.65 4.02 0.41 -1.26 -5.05 118.70 116.00 3kls s GLU 53 Ca 0.69 -0.06 -0.11 0.00 -0.41 0.00 0.00 54.97 55.08 3kls s GLU 53 Cb -0.17 -3.99 -0.02 0.00 -1.78 0.00 0.00 34.13 28.17 3kls s GLU 53 CO 0.60 -1.37 1.04 0.45 -0.49 0.00 0.00 175.26 175.50 3kls s SER 54 N 2.57 5.83 0.13 -0.19 0.15 -1.26 -4.46 113.70 116.47 3kls s SER 54 Ca 0.34 1.53 -0.14 0.00 0.70 0.00 0.00 55.95 58.38 3kls s SER 54 Cb -0.11 -2.49 0.03 0.00 -1.71 0.00 0.00 66.02 61.74 3kls s SER 54 CO 0.23 -1.14 0.37 0.12 1.20 0.00 0.00 173.24 174.01 3kls s PHE 55 N -3.07 -0.10 -0.03 3.44 5.36 -1.06 -4.96 117.98 117.55 3kls s PHE 55 Ca 0.57 -0.24 -0.08 0.00 -0.96 0.00 0.00 56.93 56.22 3kls s PHE 55 Cb -0.13 0.20 0.01 0.00 -0.34 0.00 0.00 43.02 42.76 3kls s PHE 55 CO 0.53 -0.69 0.18 -2.00 -1.46 0.00 0.00 175.22 171.78 3kls s GLU 56 N -3.83 0.39 0.10 10.12 -6.30 -1.26 -0.02 118.70 117.90 3kls s GLU 56 Ca 0.05 -0.07 -0.02 0.00 -2.50 0.00 0.00 54.97 52.42 3kls s GLU 56 Cb 0.02 0.17 -0.03 0.00 0.00 0.00 0.00 34.13 34.29 3kls s GLU 56 CO -0.10 -0.08 0.05 -0.47 0.02 0.00 0.00 175.26 174.68 3kls s TYR 57 N -0.70 0.63 0.32 5.30 6.04 -0.34 -4.87 117.35 123.73 3kls s TYR 57 Ca -0.08 -1.08 -0.13 0.00 0.04 0.00 0.00 57.07 55.82 3kls s TYR 57 Cb -0.05 -0.38 0.02 0.00 -1.04 0.00 0.00 41.96 40.52 3kls s TYR 57 CO 0.01 -0.48 0.62 -1.54 -1.54 0.00 0.00 175.55 172.62 3kls s SER 58 N -2.98 0.15 -0.44 4.32 1.04 -1.26 -0.03 113.70 114.51 3kls s SER 58 Ca 0.15 -1.08 0.00 0.00 0.48 0.00 0.00 55.95 55.51 3kls s SER 58 Cb 0.07 0.72 0.00 0.00 0.10 0.00 0.00 66.02 66.91 3kls s SER 58 CO -0.04 -1.40 0.00 0.59 0.98 0.00 0.00 173.24 173.37 3kls n ASN 59 N -0.98 -5.12 -4.50 7.02 3.02 -1.24 -4.96 115.26 108.50 3kls n ASN 59 Ca -0.04 0.10 -0.43 0.00 -0.03 0.00 0.00 54.58 54.19 3kls n ASN 59 Cb 0.61 -2.99 -0.07 0.00 -0.61 0.00 0.00 39.78 36.72 3kls n ASN 59 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 3kls s VAL 60 N -1.61 4.86 -0.11 2.41 -7.23 -1.26 -4.69 120.40 112.76 3kls s VAL 60 Ca 0.00 -0.03 -0.01 0.00 -1.81 0.00 0.00 61.98 60.13 3kls s VAL 60 Cb 0.00 -4.21 -0.02 0.00 0.56 0.00 0.00 36.38 32.71 3kls s VAL 60 CO 0.00 -0.62 -0.08 -0.55 -0.31 0.00 0.00 175.10 173.54 3kls s SER 61 N 2.09 4.45 0.31 4.85 0.15 -1.26 -2.74 113.70 121.55 3kls s SER 61 Ca 0.20 -0.17 0.05 0.00 0.70 0.00 0.00 55.95 56.74 3kls s SER 61 Cb -0.15 -1.48 -0.03 0.00 -1.71 0.00 0.00 66.02 62.65 3kls s SER 61 CO 0.17 0.24 0.27 -0.83 1.20 0.00 0.00 173.24 174.29 3kls s GLY 62 N -0.05 2.11 -0.10 9.45 0.00 -0.08 -4.93 107.32 113.72 3kls s GLY 62 Ca -0.01 -1.96 -0.01 0.00 0.00 0.00 0.00 44.72 42.74 3kls s GLY 62 CO 0.03 -1.41 -0.01 -1.59 0.00 0.00 0.00 173.10 170.12 3kls s LYS 63 N -3.53 0.84 0.38 2.90 -2.85 -1.26 -2.44 119.74 113.78 3kls s LYS 63 Ca 0.39 -0.05 -0.22 0.00 -1.00 0.00 0.00 55.97 55.09 3kls s LYS 63 Cb 0.03 -1.28 -0.16 0.00 -2.06 0.00 0.00 37.83 34.37 3kls s LYS 63 CO 0.24 -0.34 0.15 1.55 0.10 0.00 0.00 175.35 177.06 3kls n VAL 64 N 5.08 0.84 -3.73 1.79 3.14 -1.13 -5.01 118.33 119.32 3kls n VAL 64 Ca -0.09 -0.50 -0.12 0.00 -2.96 0.00 0.00 64.34 60.68 3kls n VAL 64 Cb 0.50 -0.03 -0.12 0.00 -1.06 0.00 0.00 33.84 33.13 3kls n VAL 64 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 3kls s GLU 65 N -1.03 0.31 -0.40 1.45 8.01 -1.17 -5.06 118.70 120.82 3kls s GLU 65 Ca 0.60 0.59 -0.22 0.00 0.01 0.00 0.00 54.97 55.95 3kls s GLU 65 Cb -0.67 -0.01 0.01 0.00 -4.31 0.00 0.00 34.13 29.16 3kls s GLU 65 CO 0.62 -0.13 0.71 0.54 0.01 0.00 0.00 175.26 177.01 3kls s ASN 66 N 1.00 6.43 0.00 -0.19 4.22 -1.26 -0.83 114.94 124.31 3kls s ASN 66 Ca -0.07 0.03 0.00 0.00 -2.14 0.00 0.00 52.86 50.69 3kls s ASN 66 Cb -0.07 -2.36 0.00 0.00 1.28 0.00 0.00 41.25 40.10 3kls s ASN 66 CO -0.07 -0.75 0.70 0.00 -2.04 0.00 0.00 177.10 174.94 3kls n TYR 67 N 6.37 0.00 0.00 1.54 9.36 -1.22 -4.83 117.16 128.38 3kls n TYR 67 Ca 0.01 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.23 3kls n TYR 67 Cb 0.48 -0.20 0.00 0.00 -0.63 0.00 0.00 39.34 38.99 3kls n TYR 67 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 3kls n ASN 68 N -1.18 0.00 0.02 2.98 0.23 -1.26 -5.00 115.26 111.05 3kls n ASN 68 Ca 0.00 0.00 -0.11 0.00 -0.53 0.00 0.00 54.58 53.94 3kls n ASN 68 Cb 0.00 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 37.66 3kls n ASN 68 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 3kls h GLY 69 N 0.00 -0.46 0.00 4.83 0.00 -2.02 -3.42 103.07 102.00 3kls h GLY 69 Ca 0.00 0.38 0.00 0.00 0.00 0.00 0.00 47.33 47.71 3kls h GLY 69 CO 0.00 -0.22 0.00 1.44 0.00 0.00 0.00 176.54 177.76 3kls n SER 70 N -5.41 0.00 -3.63 0.19 7.64 -1.26 -5.11 113.62 106.05 3kls n SER 70 Ca -0.04 0.00 -0.00 0.00 1.01 0.00 0.00 58.87 59.84 3kls n SER 70 Cb 0.32 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.51 3kls n SER 70 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 3kls s ASN 71 N 0.00 -0.09 0.00 6.43 3.84 -1.26 -4.65 114.94 119.21 3kls s ASN 71 Ca 0.00 -0.13 0.00 0.00 0.21 0.00 0.00 52.86 52.94 3kls s ASN 71 Cb 0.00 0.19 0.00 0.00 -0.55 0.00 0.00 41.25 40.89 3kls s ASN 71 CO 0.00 -0.35 0.00 0.52 -2.79 0.00 0.00 177.10 174.48 3kls n VAL 72 N -0.41 0.00 -4.07 -5.21 0.31 -0.01 -3.38 118.33 105.55 3kls n VAL 72 Ca -0.07 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.22 3kls n VAL 72 Cb 0.62 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 33.53 3kls n VAL 72 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 3kls n VAL 73 N -0.40 0.00 -3.48 2.52 0.24 -0.33 -3.01 118.33 113.86 3kls n VAL 73 Ca 0.00 -0.52 -0.10 0.00 -2.04 0.00 0.00 64.34 61.69 3kls n VAL 73 Cb 0.00 0.24 -0.02 0.00 -1.47 0.00 0.00 33.84 32.59 3kls n VAL 73 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3kls s ARG 74 N -2.30 0.94 -0.26 7.34 1.70 -1.26 -3.25 118.95 121.85 3kls s ARG 74 Ca 0.07 -0.31 -0.25 0.00 -0.47 0.00 0.00 55.73 54.77 3kls s ARG 74 Cb 0.00 0.43 0.07 0.00 -0.57 0.00 0.00 34.95 34.89 3kls s ARG 74 CO 0.05 -0.40 0.74 -0.06 -1.08 0.00 0.00 175.30 174.55 3kls s PHE 75 N -3.16 -0.76 -0.77 5.89 0.08 -1.24 -4.92 117.98 113.10 3kls s PHE 75 Ca 0.03 1.83 -0.18 0.00 0.12 0.00 0.00 56.93 58.74 3kls s PHE 75 Cb -0.01 0.28 0.14 0.00 -0.57 0.00 0.00 43.02 42.86 3kls s PHE 75 CO -0.09 -0.38 0.88 1.21 -0.10 0.00 0.00 175.22 176.74 3kls s ASN 76 N 0.30 6.49 0.04 1.36 3.84 -1.26 -0.89 114.94 124.81 3kls s ASN 76 Ca -0.00 -1.95 0.18 0.00 0.21 0.00 0.00 52.86 51.30 3kls s ASN 76 Cb -0.05 -2.32 0.75 0.00 -0.55 0.00 0.00 41.25 39.08 3kls s ASN 76 CO 0.01 -0.98 1.56 -0.81 -2.79 0.00 0.00 177.10 174.09 3kls n PRO 77 N 5.88 0.03 0.00 0.43 -0.04 -1.25 -4.85 135.00 135.20 3kls n PRO 77 Ca 0.08 0.24 0.00 0.00 -0.04 0.00 0.00 63.50 63.78 3kls n PRO 77 Cb 0.46 -1.55 0.00 0.00 -0.04 0.00 0.00 33.50 32.37 3kls n PRO 77 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 3kls n LYS 78 N -1.61 0.00 0.00 0.54 -0.00 -1.26 -4.92 118.16 110.91 3kls n LYS 78 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.35 3kls n LYS 78 Cb 0.20 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.23 3kls n LYS 78 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 3kls n ASP 79 N 0.00 0.00 0.00 -5.58 -0.08 -1.26 -5.15 116.55 104.48 3kls n ASP 79 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 3kls n ASP 79 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 3kls n ASP 79 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3kls n GLN 80 N -0.09 0.00 -3.37 -0.67 0.00 -1.26 -5.08 117.38 106.90 3kls n GLN 80 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 57.00 56.87 3kls n GLN 80 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 30.24 30.15 3kls n GLN 80 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.06 176.26 3kls s ASN 81 N 1.86 0.84 0.28 2.61 0.01 -1.26 -3.85 114.94 115.42 3kls s ASN 81 Ca 0.00 -0.25 0.00 0.00 -0.71 0.00 0.00 52.86 51.90 3kls s ASN 81 Cb 0.00 0.84 0.00 0.00 0.41 0.00 0.00 41.25 42.50 3kls s ASN 81 CO 0.00 -0.34 0.00 1.41 -1.51 0.00 0.00 177.10 176.66 3kls n HIS 82 N 5.34 -1.34 -3.73 2.20 8.25 -0.07 -4.49 115.22 121.38 3kls n HIS 82 Ca -0.02 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.32 3kls n HIS 82 Cb 0.49 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.53 3kls n HIS 82 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 3kls s GLN 83 N -0.58 0.87 -0.15 -0.41 0.74 -1.22 -3.68 119.66 115.23 3kls s GLN 83 Ca 0.00 -0.57 -0.07 0.00 0.05 0.00 0.00 55.36 54.78 3kls s GLN 83 Cb 0.00 0.38 0.06 0.00 1.10 0.00 0.00 33.01 34.55 3kls s GLN 83 CO 0.00 -0.29 0.33 -1.17 -0.55 0.00 0.00 175.29 173.61 3kls s LEU 84 N -2.26 -0.07 -0.43 3.68 2.96 -1.20 -4.03 118.68 117.33 3kls s LEU 84 Ca -0.03 0.73 -0.13 0.00 -0.22 0.00 0.00 54.13 54.49 3kls s LEU 84 Cb 0.00 1.02 0.06 0.00 0.50 0.00 0.00 46.19 47.78 3kls s LEU 84 CO -0.05 -0.20 0.31 -0.36 -1.32 0.00 0.00 176.35 174.73 3kls s PHE 85 N 1.76 3.27 -0.15 5.38 0.40 -0.47 -1.18 117.98 126.99 3kls s PHE 85 Ca -0.06 -1.08 -0.23 0.00 -0.60 0.00 0.00 56.93 54.96 3kls s PHE 85 Cb -0.10 -2.93 -0.03 0.00 0.51 0.00 0.00 43.02 40.47 3kls s PHE 85 CO -0.11 -0.77 0.69 -1.17 0.70 0.00 0.00 175.22 174.57 3kls s LEU 86 N 1.56 4.20 0.00 -0.37 2.96 -1.26 -3.49 118.68 122.29 3kls s LEU 86 Ca 0.03 1.02 0.00 0.00 -0.22 0.00 0.00 54.13 54.96 3kls s LEU 86 Cb -0.23 -3.02 0.00 0.00 0.50 0.00 0.00 46.19 43.44 3kls s LEU 86 CO 0.06 -0.25 0.77 0.00 -1.32 0.00 0.00 176.35 175.61 3kls n LEU 87 N 4.69 -0.69 -4.97 -0.68 -0.00 -1.26 -4.57 117.00 109.52 3kls n LEU 87 Ca -0.00 -1.55 -0.22 0.00 -0.00 0.00 0.00 56.01 54.24 3kls n LEU 87 Cb 0.50 0.00 0.04 0.00 -0.00 0.00 0.00 43.42 43.96 3kls n LEU 87 CO 0.46 1.27 0.39 -0.83 -0.00 0.00 0.00 177.39 178.69 3kls s GLY 88 N -0.69 1.80 0.59 1.47 0.00 -1.25 -4.64 107.32 104.61 3kls s GLY 88 Ca 0.00 -1.26 0.39 0.00 0.00 0.00 0.00 44.72 43.85 3kls s GLY 88 CO 0.00 -0.97 2.19 1.70 0.00 0.00 0.00 173.10 176.02 3kls h LYS 89 N -0.00 0.00 0.00 2.90 1.63 -1.92 0.48 116.57 119.66 3kls h LYS 89 Ca -0.43 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.37 3kls h LYS 89 Cb 1.30 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.93 3kls h LYS 89 CO 0.53 0.00 -0.14 -0.25 -3.45 0.00 0.00 179.45 176.14 3kls n ASP 90 N -2.87 0.47 0.08 4.20 8.00 -1.26 -3.76 116.55 121.41 3kls n ASP 90 Ca -0.03 0.40 -0.12 0.00 0.71 0.00 0.00 54.79 55.75 3kls n ASP 90 Cb 0.08 -0.44 -0.06 0.00 -0.02 0.00 0.00 41.12 40.67 3kls n ASP 90 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 3kls h LYS 91 N 0.00 0.27 0.00 -1.24 3.64 -0.37 -3.09 116.57 115.78 3kls h LYS 91 Ca 0.00 -0.35 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 3kls h LYS 91 Cb 0.63 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.56 3kls h LYS 91 CO 0.00 1.08 0.00 -1.91 -2.27 0.00 0.00 179.45 176.35 3kls n GLU 92 N -3.63 0.01 -0.09 1.90 4.07 -1.23 0.10 120.64 121.77 3kls n GLU 92 Ca -0.06 0.42 0.10 0.00 -0.06 0.00 0.00 57.16 57.56 3kls n GLU 92 Cb 0.88 -1.54 0.14 0.00 -0.06 0.00 0.00 31.44 30.87 3kls n GLU 92 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 3kls n GLN 93 N -1.57 2.14 -2.73 5.31 6.02 -1.17 -4.66 117.38 120.73 3kls n GLN 93 Ca 0.01 -1.97 -0.04 0.00 -0.01 0.00 0.00 57.00 54.99 3kls n GLN 93 Cb 0.07 -1.43 0.07 0.00 1.02 0.00 0.00 30.24 29.97 3kls n GLN 93 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 3kls n TYR 94 N 1.24 -0.17 1.68 1.08 4.01 0.29 -4.83 117.16 120.45 3kls n TYR 94 Ca 0.15 -2.19 0.14 0.00 -0.16 0.00 0.00 57.90 55.84 3kls n TYR 94 Cb 0.54 0.45 0.81 0.00 -0.31 0.00 0.00 39.34 40.83 3kls n TYR 94 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 3kls n LYS 95 N -0.65 0.79 -0.07 -0.72 5.02 -0.86 -3.93 118.16 117.73 3kls n LYS 95 Ca 0.00 0.01 -0.14 0.00 -2.02 0.00 0.00 58.31 56.16 3kls n LYS 95 Cb 0.83 -1.50 -0.13 0.00 -0.02 0.00 0.00 35.03 34.22 3kls n LYS 95 CO 0.00 0.00 0.00 1.05 -0.52 0.00 0.00 177.40 177.93 3kls h GLU 96 N 0.00 0.00 0.00 1.97 4.11 -1.88 -3.42 114.58 115.36 3kls h GLU 96 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3kls h GLU 96 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 3kls h GLU 96 CO 0.00 0.98 0.00 0.41 0.07 0.00 0.00 179.01 180.47 3kls n GLY 97 N 1.60 1.20 3.71 1.06 0.00 -1.25 -2.86 105.19 108.64 3kls n GLY 97 Ca -0.12 -1.37 -0.37 0.00 0.00 0.00 0.00 46.02 44.17 3kls n GLY 97 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kls s LEU 98 N 0.00 4.21 -0.31 0.99 1.43 -1.02 -4.94 118.68 119.04 3kls s LEU 98 Ca 0.00 0.44 -0.13 0.00 -1.03 0.00 0.00 54.13 53.41 3kls s LEU 98 Cb 0.00 -2.35 -0.03 0.00 0.03 0.00 0.00 46.19 43.84 3kls s LEU 98 CO 0.00 0.07 0.26 -1.10 0.23 0.00 0.00 176.35 175.81 3kls s GLN 99 N 0.69 3.73 0.00 1.70 1.11 -1.26 -0.91 119.66 124.73 3kls s GLN 99 Ca 0.15 -0.40 0.00 0.00 0.01 0.00 0.00 55.36 55.13 3kls s GLN 99 Cb -0.13 -3.74 0.00 0.00 -1.01 0.00 0.00 33.01 28.13 3kls s GLN 99 CO 0.04 -0.35 0.00 0.41 0.01 0.00 0.00 175.29 175.40 3kls n GLY 100 N 5.01 0.00 4.02 3.09 0.00 -1.11 -4.87 105.19 111.33 3kls n GLY 100 Ca -0.12 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.69 3kls n GLY 100 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3kls s GLN 101 N 0.00 1.93 -0.17 1.61 1.11 -1.23 -4.20 119.66 118.71 3kls s GLN 101 Ca 0.00 -1.46 -0.18 0.00 0.01 0.00 0.00 55.36 53.73 3kls s GLN 101 Cb 0.00 -2.49 -0.04 0.00 -1.01 0.00 0.00 33.01 29.47 3kls s GLN 101 CO 0.00 -1.21 0.47 -0.80 0.01 0.00 0.00 175.29 173.76 3kls s ASN 102 N -4.74 6.57 -0.28 5.90 -0.87 -0.94 -3.62 114.94 116.95 3kls s ASN 102 Ca 0.65 0.68 0.02 0.00 -1.57 0.00 0.00 52.86 52.64 3kls s ASN 102 Cb -0.05 -2.27 0.08 0.00 -0.02 0.00 0.00 41.25 38.99 3kls s ASN 102 CO 0.42 -0.09 -0.01 -0.69 -2.57 0.00 0.00 177.10 174.17 3kls s VAL 103 N 1.19 1.79 -1.11 1.60 1.01 0.95 0.25 120.40 126.09 3kls s VAL 103 Ca 0.23 -1.69 -0.25 0.00 0.00 0.00 0.00 61.98 60.27 3kls s VAL 103 Cb -0.15 -2.16 -0.17 0.00 0.00 0.00 0.00 36.38 33.90 3kls s VAL 103 CO 0.09 -0.34 2.06 0.12 0.00 0.00 0.00 175.10 177.03 3kls s PHE 104 N 1.21 1.48 -1.05 5.22 5.36 -0.50 -1.19 117.98 128.51 3kls s PHE 104 Ca 0.01 1.65 -0.21 0.00 -0.96 0.00 0.00 56.93 57.43 3kls s PHE 104 Cb -0.19 -3.57 0.08 0.00 -0.34 0.00 0.00 43.02 39.01 3kls s PHE 104 CO -0.09 -0.88 1.40 0.54 -1.46 0.00 0.00 175.22 174.72 3kls s VAL 105 N 14.85 4.24 -0.09 3.12 0.11 0.97 -4.73 120.40 138.87 3kls s VAL 105 Ca 0.77 -1.27 -0.04 0.00 -2.93 0.00 0.00 61.98 58.51 3kls s VAL 105 Cb -0.04 -4.99 -0.04 0.00 -1.53 0.00 0.00 36.38 29.78 3kls s VAL 105 CO 0.16 -1.81 0.06 0.68 -3.33 0.00 0.00 175.10 170.86 3kls s VAL 106 N 4.03 4.81 0.14 2.04 -7.23 -1.25 -2.57 120.40 120.37 3kls s VAL 106 Ca 0.43 -0.07 -0.30 0.00 -1.81 0.00 0.00 61.98 60.23 3kls s VAL 106 Cb -0.01 -3.07 -0.07 0.00 0.56 0.00 0.00 36.38 33.80 3kls s VAL 106 CO -0.07 0.60 1.09 0.00 -0.31 0.00 0.00 175.10 176.41 3kls s GLN 107 N -0.99 4.58 -0.17 4.82 -2.07 -1.26 -4.63 119.66 119.94 3kls s GLN 107 Ca 0.15 1.68 0.14 0.00 -1.82 0.00 0.00 55.36 55.50 3kls s GLN 107 Cb -0.12 -3.31 -0.20 0.00 -1.09 0.00 0.00 33.01 28.30 3kls s GLN 107 CO 0.04 0.03 0.04 0.39 -1.32 0.00 0.00 175.29 174.47 3kls n GLU 108 N 2.76 1.25 -3.74 9.60 -0.58 -0.65 -5.03 120.64 124.26 3kls n GLU 108 Ca 0.04 0.00 -0.08 0.00 -0.42 0.00 0.00 57.16 56.70 3kls n GLU 108 Cb 0.47 -1.42 -0.02 0.00 -0.57 0.00 0.00 31.44 29.90 3kls n GLU 108 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3kls s LEU 109 N -5.29 -0.33 0.07 -4.62 1.43 -1.24 -5.03 118.68 103.67 3kls s LEU 109 Ca -0.10 -0.45 -0.04 0.00 -1.03 0.00 0.00 54.13 52.52 3kls s LEU 109 Cb 0.05 2.68 -0.03 0.00 0.03 0.00 0.00 46.19 48.92 3kls s LEU 109 CO 0.66 -1.24 0.06 -0.63 0.23 0.00 0.00 176.35 175.42 3kls s ILE 110 N -3.88 0.18 0.13 -0.59 1.01 -1.26 -1.27 121.20 115.52 3kls s ILE 110 Ca 0.08 -1.60 0.05 0.00 0.00 0.00 0.00 60.65 59.19 3kls s ILE 110 Cb -0.05 -1.51 -0.04 0.00 0.01 0.00 0.00 42.46 40.88 3kls s ILE 110 CO 0.02 -0.83 0.08 -0.62 0.00 0.00 0.00 174.94 173.58 3kls s ASP 111 N -2.91 5.34 0.55 3.58 -1.08 0.42 -4.95 116.67 117.62 3kls s ASP 111 Ca 0.08 -0.13 0.30 0.00 -0.52 0.00 0.00 52.55 52.27 3kls s ASP 111 Cb 0.07 -1.36 1.46 0.00 -1.46 0.00 0.00 42.92 41.63 3kls s ASP 111 CO -0.09 0.12 1.90 1.55 0.52 0.00 0.00 175.17 179.17 3kls h PRO 112 N 2.90 0.00 0.00 4.34 0.13 -2.02 -0.64 132.00 136.71 3kls h PRO 112 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3kls h PRO 112 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3kls h PRO 112 CO 0.63 0.00 0.00 0.27 -0.23 0.00 0.00 178.00 178.67 3kls n ASN 113 N -4.10 0.00 0.00 1.44 2.04 -1.26 -4.84 115.26 108.53 3kls n ASN 113 Ca 0.14 -0.80 0.00 0.00 -0.44 0.00 0.00 54.58 53.48 3kls n ASN 113 Cb 0.83 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 38.08 3kls n ASN 113 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3kls n GLY 114 N 0.38 3.39 3.77 4.83 0.00 -0.25 -4.78 105.19 112.53 3kls n GLY 114 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 3kls n GLY 114 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3kls s ARG 115 N -0.82 3.89 -0.02 1.61 1.70 -1.25 -4.80 118.95 119.26 3kls s ARG 115 Ca 0.00 2.18 0.02 0.00 -0.47 0.00 0.00 55.73 57.45 3kls s ARG 115 Cb 0.00 -2.71 0.01 0.00 -0.57 0.00 0.00 34.95 31.68 3kls s ARG 115 CO 0.00 -0.56 -0.05 -0.48 -1.08 0.00 0.00 175.30 173.13 3kls s LEU 116 N -2.53 1.66 0.52 -1.89 0.05 -1.26 -0.43 118.68 114.79 3kls s LEU 116 Ca 0.58 -0.12 -0.19 0.00 0.05 0.00 0.00 54.13 54.45 3kls s LEU 116 Cb -0.38 -0.39 -0.07 0.00 -2.05 0.00 0.00 46.19 43.30 3kls s LEU 116 CO 0.49 0.01 1.05 -0.94 -0.55 0.00 0.00 176.35 176.41 3kls s SER 117 N 0.39 6.17 0.17 1.48 1.04 -0.40 -3.43 113.70 119.12 3kls s SER 117 Ca -0.05 1.91 -0.20 0.00 0.48 0.00 0.00 55.95 58.09 3kls s SER 117 Cb -0.09 -2.55 0.05 0.00 0.10 0.00 0.00 66.02 63.53 3kls s SER 117 CO -0.00 -0.90 0.55 0.28 0.98 0.00 0.00 173.24 174.15 3kls s THR 118 N -2.10 0.02 -0.06 2.02 -1.32 -1.26 -1.63 115.64 111.32 3kls s THR 118 Ca 0.67 -0.38 -0.01 0.00 -1.21 0.00 0.00 61.69 60.75 3kls s THR 118 Cb -0.17 -1.25 0.03 0.00 -1.51 0.00 0.00 72.50 69.60 3kls s THR 118 CO 0.25 -0.09 0.02 0.54 -2.21 0.00 0.00 174.62 173.12 3kls s VAL 119 N -3.80 0.23 0.00 5.08 0.11 -1.26 -1.36 120.40 119.39 3kls s VAL 119 Ca 0.04 0.19 0.00 0.00 -2.93 0.00 0.00 61.98 59.28 3kls s VAL 119 Cb -0.01 -0.40 0.00 0.00 -1.53 0.00 0.00 36.38 34.44 3kls s VAL 119 CO -0.09 0.22 0.00 0.61 -3.33 0.00 0.00 175.10 172.52 3kls n GLY 120 N 5.03 -0.01 1.77 6.54 0.00 -1.23 -4.83 105.19 112.46 3kls n GLY 120 Ca -0.09 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 44.97 3kls n GLY 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kls n GLY 121 N 0.00 0.79 3.80 -0.02 0.00 -0.79 -4.72 105.19 104.25 3kls n GLY 121 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 3kls n GLY 121 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kls s VAL 122 N -3.10 4.39 0.29 1.61 1.01 -1.26 -1.41 120.40 121.94 3kls s VAL 122 Ca 0.00 1.55 0.05 0.00 0.00 0.00 0.00 61.98 63.58 3kls s VAL 122 Cb 0.00 -3.93 -0.03 0.00 0.00 0.00 0.00 36.38 32.42 3kls s VAL 122 CO 0.00 0.17 0.24 0.28 0.00 0.00 0.00 175.10 175.79 3kls s THR 123 N -1.58 0.00 0.00 3.92 -1.32 0.14 -4.57 115.64 112.23 3kls s THR 123 Ca 0.47 -1.99 0.00 0.00 -1.21 0.00 0.00 61.69 58.96 3kls s THR 123 Cb -0.17 -2.50 0.00 0.00 -1.51 0.00 0.00 72.50 68.31 3kls s THR 123 CO 0.22 0.00 0.70 2.29 -2.21 0.00 0.00 174.62 175.62 3kls n LYS 124 N -0.52 0.00 -2.10 7.08 2.85 -1.26 -2.22 118.16 121.99 3kls n LYS 124 Ca 0.06 0.24 0.00 0.00 -1.05 0.00 0.00 58.31 57.56 3kls n LYS 124 Cb 0.63 -1.20 0.00 0.00 -0.65 0.00 0.00 35.03 33.81 3kls n LYS 124 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 3kls n LYS 125 N -1.16 -4.89 -1.73 -1.58 3.00 -1.26 -4.20 118.16 106.34 3kls n LYS 125 Ca 0.00 3.56 -0.43 0.00 -0.00 0.00 0.00 58.31 61.44 3kls n LYS 125 Cb 0.00 -4.14 -0.03 0.00 0.00 0.00 0.00 35.03 30.86 3kls n LYS 125 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.40 176.60 3kls s ASN 126 N -0.51 5.60 -0.42 3.14 0.01 -1.26 -4.75 114.94 116.75 3kls s ASN 126 Ca 0.00 1.72 -0.20 0.00 -0.71 0.00 0.00 52.86 53.66 3kls s ASN 126 Cb 0.00 -2.52 0.02 0.00 0.41 0.00 0.00 41.25 39.16 3kls s ASN 126 CO 0.00 -1.88 0.63 0.21 -1.51 0.00 0.00 177.10 174.55 3kls s ASN 127 N 7.59 6.34 0.17 -1.22 2.47 -1.26 -5.02 114.94 124.01 3kls s ASN 127 Ca 0.94 -0.22 -0.33 0.00 0.42 0.00 0.00 52.86 53.67 3kls s ASN 127 Cb -0.30 -2.32 -0.16 0.00 -1.45 0.00 0.00 41.25 37.03 3kls s ASN 127 CO 0.35 -0.72 1.19 0.29 -3.72 0.00 0.00 177.10 174.49 3kls n LYS 128 N 6.18 1.24 -0.89 0.43 5.02 -1.26 -4.83 118.16 124.05 3kls n LYS 128 Ca -0.02 0.44 -0.14 0.00 -2.02 0.00 0.00 58.31 56.58 3kls n LYS 128 Cb 0.48 -1.96 0.00 0.00 -0.02 0.00 0.00 35.03 33.53 3kls n LYS 128 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 3kls n THR 129 N 1.58 2.69 -1.69 -0.18 -1.04 -1.26 -2.41 114.28 111.96 3kls n THR 129 Ca 0.15 -1.55 -0.35 0.00 -2.04 0.00 0.00 64.05 60.26 3kls n THR 129 Cb 0.25 -1.45 0.07 0.00 -1.82 0.00 0.00 70.33 67.38 3kls n THR 129 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 3kls s SER 130 N 0.73 4.65 -0.33 8.00 0.15 -1.26 -4.86 113.70 120.77 3kls s SER 130 Ca 0.30 2.36 -0.01 0.00 0.70 0.00 0.00 55.95 59.30 3kls s SER 130 Cb 0.21 -2.59 0.12 0.00 -1.71 0.00 0.00 66.02 62.04 3kls s SER 130 CO -0.03 -1.96 0.16 -0.70 1.20 0.00 0.00 173.24 171.91 3kls s GLU 131 N -3.68 0.58 -0.05 5.44 2.12 -1.26 -1.57 118.70 120.29 3kls s GLU 131 Ca 0.76 -1.10 -0.12 0.00 0.36 0.00 0.00 54.97 54.86 3kls s GLU 131 Cb -0.30 -1.60 -0.05 0.00 0.26 0.00 0.00 34.13 32.45 3kls s GLU 131 CO 0.40 -1.08 0.31 -0.08 -0.54 0.00 0.00 175.26 174.27 3kls s THR 132 N 1.45 5.20 -0.70 -1.70 -1.32 -0.13 -4.95 115.64 113.49 3kls s THR 132 Ca 0.13 0.61 -0.15 0.00 -1.21 0.00 0.00 61.69 61.07 3kls s THR 132 Cb -0.19 -3.60 0.18 0.00 -1.51 0.00 0.00 72.50 67.37 3kls s THR 132 CO -0.18 0.59 0.65 0.21 -2.21 0.00 0.00 174.62 173.67 3kls s ASN 133 N -1.00 6.50 -0.10 8.08 2.47 -1.26 -1.96 114.94 127.67 3kls s ASN 133 Ca 0.20 -2.28 -0.16 0.00 0.42 0.00 0.00 52.86 51.04 3kls s ASN 133 Cb -0.15 -2.21 -0.05 0.00 -1.45 0.00 0.00 41.25 37.40 3kls s ASN 133 CO 0.10 -0.70 0.41 0.28 -3.72 0.00 0.00 177.10 173.47 3kls s THR 134 N 0.81 5.19 1.08 -5.21 -1.32 0.23 -4.90 115.64 111.52 3kls s THR 134 Ca 0.11 0.82 -0.19 0.00 -1.21 0.00 0.00 61.69 61.21 3kls s THR 134 Cb -0.19 -3.74 0.04 0.00 -1.51 0.00 0.00 72.50 67.10 3kls s THR 134 CO -0.04 0.40 -0.22 -0.81 -2.21 0.00 0.00 174.62 171.74 3kls n PRO 135 N 3.24 -1.16 0.00 7.08 -0.04 -1.26 -0.94 135.00 141.91 3kls n PRO 135 Ca -0.10 -0.32 0.00 0.00 -0.04 0.00 0.00 63.50 63.04 3kls n PRO 135 Cb 0.52 -1.59 0.00 0.00 -0.04 0.00 0.00 33.50 32.39 3kls n PRO 135 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 3kls n LEU 136 N -0.67 0.00 -4.97 1.53 7.94 -1.23 -3.30 117.00 116.30 3kls n LEU 136 Ca 0.01 0.00 -0.18 0.00 -1.11 0.00 0.00 56.01 54.73 3kls n LEU 136 Cb 0.63 0.00 -0.00 0.00 0.53 0.00 0.00 43.42 44.58 3kls n LEU 136 CO 0.51 0.00 0.10 -0.36 -1.11 0.00 0.00 177.39 176.52 3kls s PHE 137 N 0.00 2.82 -0.26 1.96 0.08 -0.71 -0.54 117.98 121.32 3kls s PHE 137 Ca 0.00 -0.40 -0.03 0.00 0.12 0.00 0.00 56.93 56.62 3kls s PHE 137 Cb 0.00 -2.28 0.15 0.00 -0.57 0.00 0.00 43.02 40.32 3kls s PHE 137 CO 0.00 -0.29 0.46 0.08 -0.10 0.00 0.00 175.22 175.37 3kls s VAL 138 N -2.36 -0.74 -0.21 -0.44 1.01 0.02 -2.06 120.40 115.60 3kls s VAL 138 Ca 0.52 -0.03 -0.05 0.00 0.00 0.00 0.00 61.98 62.42 3kls s VAL 138 Cb -0.08 -0.87 -0.02 0.00 0.00 0.00 0.00 36.38 35.41 3kls s VAL 138 CO 0.31 -0.07 -0.02 0.20 0.00 0.00 0.00 175.10 175.53 3kls s ASN 139 N 2.66 4.56 -0.22 3.32 -0.87 -1.04 0.09 114.94 123.44 3kls s ASN 139 Ca 0.14 -0.31 -0.18 0.00 -1.57 0.00 0.00 52.86 50.94 3kls s ASN 139 Cb -0.15 -1.79 -0.03 0.00 -0.02 0.00 0.00 41.25 39.26 3kls s ASN 139 CO -0.17 0.01 0.52 -0.54 -2.57 0.00 0.00 177.10 174.35 3kls s LYS 140 N 1.31 4.15 0.25 -0.60 1.02 -0.35 -0.98 119.74 124.54 3kls s LYS 140 Ca 0.04 0.39 -0.19 0.00 0.02 0.00 0.00 55.97 56.23 3kls s LYS 140 Cb -0.14 -3.59 -0.09 0.00 -0.52 0.00 0.00 37.83 33.49 3kls s LYS 140 CO -0.00 -0.22 0.74 0.08 -0.92 0.00 0.00 175.35 175.03 3kls s VAL 141 N 1.87 4.58 -0.40 3.17 1.01 0.35 -1.70 120.40 129.29 3kls s VAL 141 Ca 0.23 1.23 0.10 0.00 0.00 0.00 0.00 61.98 63.54 3kls s VAL 141 Cb -0.15 -3.80 0.35 0.00 0.00 0.00 0.00 36.38 32.78 3kls s VAL 141 CO 0.09 0.10 0.91 -3.20 0.00 0.00 0.00 175.10 173.01 3kls n ASN 142 N 0.44 -0.31 0.00 3.32 2.85 0.49 -3.77 115.26 118.28 3kls n ASN 142 Ca -0.01 -3.18 0.00 0.00 -0.11 0.00 0.00 54.58 51.28 3kls n ASN 142 Cb 0.52 0.32 0.00 0.00 1.24 0.00 0.00 39.78 41.85 3kls n ASN 142 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3kls n GLY 143 N 0.23 1.01 0.04 8.20 0.00 -1.26 -1.73 105.19 111.69 3kls n GLY 143 Ca 0.16 0.36 0.12 0.00 0.00 0.00 0.00 46.02 46.66 3kls n GLY 143 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3kls n GLU 144 N 0.00 0.19 -3.35 1.61 -0.58 -1.26 -4.91 120.64 112.34 3kls n GLU 144 Ca 0.00 0.06 -0.31 0.00 -0.42 0.00 0.00 57.16 56.49 3kls n GLU 144 Cb 0.00 -1.63 -0.05 0.00 -0.57 0.00 0.00 31.44 29.19 3kls n GLU 144 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3kls s ASP 145 N -3.81 6.60 -0.24 1.62 1.01 -0.71 -5.09 116.67 116.05 3kls s ASP 145 Ca 0.08 0.92 -0.03 0.00 0.71 0.00 0.00 52.55 54.23 3kls s ASP 145 Cb 0.15 -2.23 0.13 0.00 1.01 0.00 0.00 42.92 41.98 3kls s ASP 145 CO 0.69 -0.12 0.39 -0.22 0.21 0.00 0.00 175.17 176.12 3kls s LEU 146 N -3.02 -0.67 -0.58 1.23 0.20 -1.24 -0.38 118.68 114.23 3kls s LEU 146 Ca 0.47 0.33 -0.14 0.00 0.69 0.00 0.00 54.13 55.48 3kls s LEU 146 Cb -0.11 1.18 0.15 0.00 -0.43 0.00 0.00 46.19 46.97 3kls s LEU 146 CO 0.23 -0.29 0.52 -1.81 -0.29 0.00 0.00 176.35 174.71 3kls s ASP 147 N 2.56 6.18 0.26 3.68 1.01 -0.69 -4.88 116.67 124.80 3kls s ASP 147 Ca 0.12 -2.01 0.07 0.00 0.71 0.00 0.00 52.55 51.43 3kls s ASP 147 Cb -0.15 -2.16 -0.03 0.00 1.01 0.00 0.00 42.92 41.59 3kls s ASP 147 CO -0.16 -0.76 0.27 0.00 0.21 0.00 0.00 175.17 174.73 3kls s ALA 148 N 1.24 3.74 -0.22 5.23 0.00 -1.26 -1.21 121.76 129.28 3kls s ALA 148 Ca 0.07 -1.40 -0.14 0.00 0.00 0.00 0.00 51.96 50.48 3kls s ALA 148 Cb -0.25 -1.42 0.07 0.00 0.00 0.00 0.00 23.12 21.51 3kls s ALA 148 CO -0.00 0.20 0.56 -1.12 0.00 0.00 0.00 175.76 175.40 3kls s SER 149 N -3.92 -0.71 0.25 0.00 0.01 0.11 -4.96 113.70 104.49 3kls s SER 149 Ca 0.35 1.20 -0.19 0.00 1.31 0.00 0.00 55.95 58.62 3kls s SER 149 Cb -0.08 1.11 -0.09 0.00 0.21 0.00 0.00 66.02 67.17 3kls s SER 149 CO 0.27 -0.21 0.74 0.27 0.41 0.00 0.00 173.24 174.72 3kls s ILE 150 N 1.26 4.57 0.00 1.44 -5.25 -1.26 -0.80 121.20 121.15 3kls s ILE 150 Ca -0.08 1.25 0.00 0.00 -0.99 0.00 0.00 60.65 60.83 3kls s ILE 150 Cb -0.06 -3.81 0.00 0.00 2.95 0.00 0.00 42.46 41.54 3kls s ILE 150 CO -0.13 0.11 0.00 -0.67 -1.79 0.00 0.00 174.94 172.47 3kls n ASP 151 N 0.46 1.24 -3.51 4.36 -0.08 0.30 -4.96 116.55 114.35 3kls n ASP 151 Ca -0.01 0.00 -0.14 0.00 -1.51 0.00 0.00 54.79 53.13 3kls n ASP 151 Cb 0.51 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 43.93 3kls n ASP 151 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 3kls s SER 152 N 1.53 -0.55 0.01 1.67 0.01 -1.25 -3.81 113.70 111.31 3kls s SER 152 Ca 0.00 0.47 0.03 0.00 1.31 0.00 0.00 55.95 57.76 3kls s SER 152 Cb 0.00 0.48 -0.01 0.00 0.21 0.00 0.00 66.02 66.70 3kls s SER 152 CO 0.00 -0.61 -0.10 0.12 0.41 0.00 0.00 173.24 173.06 3kls s PHE 153 N -1.77 0.86 -0.44 2.43 5.36 -0.12 -4.94 117.98 119.37 3kls s PHE 153 Ca -0.06 -0.24 -0.10 0.00 -0.96 0.00 0.00 56.93 55.58 3kls s PHE 153 Cb -0.00 -0.54 0.09 0.00 -0.34 0.00 0.00 43.02 42.23 3kls s PHE 153 CO 0.03 -0.01 0.30 -0.51 -1.46 0.00 0.00 175.22 173.56 3kls s LEU 154 N -0.58 5.36 -0.31 6.12 1.43 -1.26 -0.60 118.68 128.84 3kls s LEU 154 Ca 0.01 -1.61 -0.24 0.00 -1.03 0.00 0.00 54.13 51.26 3kls s LEU 154 Cb -0.05 -2.01 0.00 0.00 0.03 0.00 0.00 46.19 44.16 3kls s LEU 154 CO 0.00 -0.60 0.82 -0.63 0.23 0.00 0.00 176.35 176.17 3kls s ILE 155 N 1.43 4.76 -0.41 -0.59 1.01 -0.83 -4.95 121.20 121.63 3kls s ILE 155 Ca 0.04 1.21 0.10 0.00 0.00 0.00 0.00 60.65 62.00 3kls s ILE 155 Cb -0.24 -4.18 0.62 0.00 0.01 0.00 0.00 42.46 38.67 3kls s ILE 155 CO 0.02 -0.29 1.50 1.67 0.00 0.00 0.00 174.94 177.83 3kls n GLN 156 N 6.29 3.74 -4.07 2.79 -0.06 -1.26 -0.95 117.38 123.86 3kls n GLN 156 Ca 0.04 -2.41 -0.14 0.00 -2.00 0.00 0.00 57.00 52.49 3kls n GLN 156 Cb 0.48 -2.07 -0.04 0.00 -4.06 0.00 0.00 30.24 24.55 3kls n GLN 156 CO 0.00 0.00 0.00 0.15 -0.20 0.00 0.00 177.06 177.01 3kls s LYS 157 N -2.38 1.87 -0.16 3.69 -0.14 -0.61 -4.42 119.74 117.60 3kls s LYS 157 Ca 0.42 -1.69 -0.14 0.00 -1.36 0.00 0.00 55.97 53.20 3kls s LYS 157 Cb 0.33 0.45 -0.23 0.00 -1.68 0.00 0.00 37.83 36.69 3kls s LYS 157 CO 0.12 -0.78 0.33 1.49 -0.76 0.00 0.00 175.35 175.75 3kls h GLU 158 N 2.13 0.15 -6.23 1.68 4.57 -1.71 -3.42 114.58 111.76 3kls h GLU 158 Ca -0.28 -0.26 -0.66 0.00 -1.18 0.00 0.00 59.36 56.98 3kls h GLU 158 Cb 1.24 0.10 -0.30 0.00 -0.16 0.00 0.00 28.75 29.63 3kls h GLU 158 CO 0.39 1.12 -0.88 -2.00 -1.18 0.00 0.00 179.01 176.47 3kls s GLU 159 N -2.47 2.05 -0.02 1.92 2.12 -1.26 0.18 118.70 121.22 3kls s GLU 159 Ca -0.25 -0.85 0.01 0.00 0.36 0.00 0.00 54.97 54.24 3kls s GLU 159 Cb 0.06 -1.91 0.02 0.00 0.26 0.00 0.00 34.13 32.56 3kls s GLU 159 CO 0.69 0.47 -0.01 -1.50 -0.54 0.00 0.00 175.26 174.38 3kls s ILE 160 N -0.44 0.19 0.21 -3.70 2.07 0.50 -4.78 121.20 115.25 3kls s ILE 160 Ca 0.06 0.04 -0.30 0.00 -1.41 0.00 0.00 60.65 59.04 3kls s ILE 160 Cb -0.10 -0.27 -0.09 0.00 0.13 0.00 0.00 42.46 42.14 3kls s ILE 160 CO 0.00 0.13 1.26 -0.94 -1.91 0.00 0.00 174.94 173.48 3kls s SER 161 N 0.82 6.97 0.58 4.50 1.04 -1.26 -0.96 113.70 125.39 3kls s SER 161 Ca -0.08 2.35 0.30 0.00 0.48 0.00 0.00 55.95 59.00 3kls s SER 161 Cb -0.12 -2.61 1.78 0.00 0.10 0.00 0.00 66.02 65.17 3kls s SER 161 CO -0.01 -0.45 2.22 0.25 0.98 0.00 0.00 173.24 176.22 3kls h LEU 162 N 5.11 0.00 0.62 2.42 5.85 -1.80 0.55 115.31 128.06 3kls h LEU 162 Ca -0.45 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.24 3kls h LEU 162 Cb 1.21 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.25 3kls h LEU 162 CO 0.75 0.03 -0.30 0.50 -0.34 0.00 0.00 178.44 179.08 3kls h LYS 163 N 0.00 -0.80 -0.30 1.25 3.64 -1.84 0.32 116.57 118.85 3kls h LYS 163 Ca -0.00 0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.41 3kls h LYS 163 Cb 0.09 0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 3kls h LYS 163 CO 0.00 -0.48 0.07 1.49 -2.27 0.00 0.00 179.45 178.26 3kls h GLU 164 N -1.01 0.43 -0.71 1.90 4.81 -1.61 0.12 114.58 118.50 3kls h GLU 164 Ca -0.08 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.04 3kls h GLU 164 Cb 0.68 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.95 3kls h GLU 164 CO 0.14 0.40 0.27 1.25 -0.73 0.00 0.00 179.01 180.34 3kls h LEU 165 N 0.42 0.99 -0.15 1.64 5.85 0.12 -2.71 115.31 121.47 3kls h LEU 165 Ca 0.10 -0.18 -0.21 0.00 0.84 0.00 0.00 57.88 58.43 3kls h LEU 165 Cb 0.18 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 3kls h LEU 165 CO -0.00 0.90 -0.96 -0.78 -0.34 0.00 0.00 178.44 177.26 3kls h ASP 166 N 1.02 0.16 -0.38 1.25 3.58 0.17 -2.34 116.42 119.87 3kls h ASP 166 Ca 0.23 -0.15 -0.09 0.00 0.42 0.00 0.00 57.03 57.45 3kls h ASP 166 Cb 0.23 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.22 3kls h ASP 166 CO -0.02 1.03 -0.11 0.15 -2.88 0.00 0.00 179.24 177.41 3kls h PHE 167 N 0.05 0.86 0.02 0.28 3.04 -0.74 -2.47 116.94 117.97 3kls h PHE 167 Ca -0.04 -0.19 -0.22 0.00 3.98 0.00 0.00 57.97 61.50 3kls h PHE 167 Cb 1.65 -0.21 -0.02 0.00 2.56 0.00 0.00 35.95 39.93 3kls h PHE 167 CO 0.02 0.90 -1.03 0.87 -2.02 0.00 0.00 178.31 177.05 3kls h LYS 168 N 0.56 0.04 0.00 1.11 1.57 -1.56 0.08 116.57 118.38 3kls h LYS 168 Ca 0.09 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.77 3kls h LYS 168 Cb 0.64 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.97 3kls h LYS 168 CO 0.04 1.03 -0.17 0.82 -0.57 0.00 0.00 179.45 180.60 3kls h ILE 169 N 0.01 0.96 0.00 1.86 1.08 -1.43 -2.42 117.51 117.58 3kls h ILE 169 Ca -0.03 -0.63 -0.37 0.00 -0.39 0.00 0.00 64.86 63.44 3kls h ILE 169 Cb 1.80 1.35 -0.07 0.00 -3.07 0.00 0.00 36.82 36.83 3kls h ILE 169 CO 0.14 0.17 -2.40 0.54 -0.69 0.00 0.00 178.15 175.91 3kls n ARG 170 N -4.10 0.68 -0.35 2.37 1.74 -0.93 -3.77 116.66 112.30 3kls n ARG 170 Ca -0.02 0.03 0.06 0.00 -0.77 0.00 0.00 57.85 57.15 3kls n ARG 170 Cb 0.25 -1.52 0.23 0.00 -1.02 0.00 0.00 32.46 30.40 3kls n ARG 170 CO 0.00 0.00 0.00 0.37 -1.52 0.00 0.00 177.63 176.48 3kls h GLN 171 N 0.00 1.00 -0.21 5.56 4.15 -0.95 -0.07 115.11 124.59 3kls h GLN 171 Ca -0.55 -0.06 -0.08 0.00 0.77 0.00 0.00 58.65 58.72 3kls h GLN 171 Cb 2.17 -0.23 -0.00 0.00 0.21 0.00 0.00 27.48 29.63 3kls h GLN 171 CO 0.01 0.66 -0.20 1.96 -1.93 0.00 0.00 178.83 179.32 3kls h GLN 172 N 1.03 0.50 -0.67 1.69 4.20 -1.62 -2.82 115.11 117.41 3kls h GLN 172 Ca 0.47 -0.26 -0.03 0.00 0.06 0.00 0.00 58.65 58.88 3kls h GLN 172 Cb 0.39 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.15 3kls h GLN 172 CO -0.22 0.84 0.30 -0.07 -0.67 0.00 0.00 178.83 179.01 3kls h LEU 173 N 0.18 0.88 -1.44 1.46 3.38 -1.57 -1.24 115.31 116.95 3kls h LEU 173 Ca 0.03 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 3kls h LEU 173 Cb 0.75 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 3kls h LEU 173 CO 0.05 0.76 -0.13 0.58 0.09 0.00 0.00 178.44 179.79 3kls h VAL 174 N 0.96 1.17 -0.01 1.22 2.07 -0.97 -0.96 116.25 119.73 3kls h VAL 174 Ca 0.23 -0.74 0.00 0.00 0.82 0.00 0.00 66.70 67.01 3kls h VAL 174 Cb 0.14 1.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 3kls h VAL 174 CO -0.03 0.23 -0.45 0.59 0.02 0.00 0.00 177.57 177.93 3kls n ASN 175 N -4.29 1.21 0.00 0.57 5.03 -1.07 -4.24 115.26 112.47 3kls n ASN 175 Ca -0.01 -1.10 0.00 0.00 0.87 0.00 0.00 54.58 54.34 3kls n ASN 175 Cb 0.26 0.68 0.00 0.00 -1.02 0.00 0.00 39.78 39.69 3kls n ASN 175 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 3kls n ASN 176 N -0.61 0.00 -0.20 6.41 3.02 -0.49 -4.89 115.26 118.50 3kls n ASN 176 Ca 0.05 0.00 0.05 0.00 -0.03 0.00 0.00 54.58 54.65 3kls n ASN 176 Cb 0.28 0.00 0.07 0.00 -0.61 0.00 0.00 39.78 39.52 3kls n ASN 176 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 3kls n TYR 177 N 0.00 0.00 -3.32 3.10 4.02 -0.44 -5.01 117.16 115.52 3kls n TYR 177 Ca 0.00 -0.55 -0.18 0.00 -0.01 0.00 0.00 57.90 57.17 3kls n TYR 177 Cb 0.00 -0.10 0.07 0.00 -0.02 0.00 0.00 39.34 39.29 3kls n TYR 177 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3kls n GLY 178 N -0.76 -0.24 3.83 2.72 0.00 -1.13 -4.97 105.19 104.64 3kls n GLY 178 Ca 0.08 0.05 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 3kls n GLY 178 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3kls s LEU 179 N -5.91 4.34 -1.46 0.99 2.96 -0.77 -4.19 118.68 114.64 3kls s LEU 179 Ca 0.35 1.23 -0.07 0.00 -0.22 0.00 0.00 54.13 55.41 3kls s LEU 179 Cb -0.15 -3.40 0.02 0.00 0.50 0.00 0.00 46.19 43.15 3kls s LEU 179 CO 0.59 0.08 0.90 -1.22 -1.32 0.00 0.00 176.35 175.37 3kls n TYR 180 N 0.79 -2.42 -3.35 5.38 4.01 -0.24 -4.52 117.16 116.81 3kls n TYR 180 Ca -0.04 0.78 -0.16 0.00 -0.16 0.00 0.00 57.90 58.31 3kls n TYR 180 Cb 0.51 -4.67 -0.07 0.00 -0.31 0.00 0.00 39.34 34.80 3kls n TYR 180 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 3kls s LYS 181 N -6.06 0.64 1.03 -0.72 2.20 -1.19 -4.69 119.74 110.95 3kls s LYS 181 Ca 0.46 -0.81 0.00 0.00 -0.36 0.00 0.00 55.97 55.26 3kls s LYS 181 Cb -0.21 -0.69 0.00 0.00 -1.51 0.00 0.00 37.83 35.42 3kls s LYS 181 CO 0.57 -1.19 0.00 0.41 -0.36 0.00 0.00 175.35 174.78 3kls n GLY 182 N 4.28 0.91 0.00 5.54 0.00 -1.26 -4.20 105.19 110.46 3kls n GLY 182 Ca 0.11 -1.42 0.06 0.00 0.00 0.00 0.00 46.02 44.77 3kls n GLY 182 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3kls n THR 183 N 0.00 0.00 -3.04 2.61 -2.24 -1.26 -4.68 114.28 105.67 3kls n THR 183 Ca 0.00 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.35 3kls n THR 183 Cb 0.00 -0.61 -0.06 0.00 -2.10 0.00 0.00 70.33 67.56 3kls n THR 183 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3kls s SER 184 N -1.86 6.37 0.00 3.42 0.01 -1.26 -4.23 113.70 116.16 3kls s SER 184 Ca 0.17 -0.19 0.00 0.00 1.31 0.00 0.00 55.95 57.24 3kls s SER 184 Cb 0.08 -2.35 0.00 0.00 0.21 0.00 0.00 66.02 63.96 3kls s SER 184 CO 0.13 -0.82 0.00 2.29 0.41 0.00 0.00 173.24 175.25 3kls n LYS 185 N 6.44 0.00 -4.36 12.44 2.85 -1.26 -1.08 118.16 133.20 3kls n LYS 185 Ca 0.00 0.00 -0.35 0.00 -1.05 0.00 0.00 58.31 56.91 3kls n LYS 185 Cb 0.48 0.00 -0.10 0.00 -0.65 0.00 0.00 35.03 34.76 3kls n LYS 185 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 3kls s TYR 186 N -0.03 3.16 -2.57 5.58 4.12 -1.26 -3.31 117.35 123.04 3kls s TYR 186 Ca 0.00 0.15 0.00 0.00 0.02 0.00 0.00 57.07 57.24 3kls s TYR 186 Cb 0.00 -1.82 0.00 0.00 -1.52 0.00 0.00 41.96 38.62 3kls s TYR 186 CO 0.00 0.42 0.00 0.41 0.02 0.00 0.00 175.55 176.40 3kls n GLY 187 N 2.32 -1.93 2.86 0.71 0.00 -1.26 -2.03 105.19 105.86 3kls n GLY 187 Ca -0.18 -1.15 -0.16 0.00 0.00 0.00 0.00 46.02 44.52 3kls n GLY 187 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kls s LYS 188 N -1.85 0.05 -0.43 1.61 -0.14 -1.16 -1.38 119.74 116.44 3kls s LYS 188 Ca 0.00 0.58 -0.22 0.00 -1.36 0.00 0.00 55.97 54.97 3kls s LYS 188 Cb 0.00 -0.24 0.02 0.00 -1.68 0.00 0.00 37.83 35.94 3kls s LYS 188 CO 0.00 -0.30 0.72 0.42 -0.76 0.00 0.00 175.35 175.43 3kls s ILE 189 N 2.26 4.74 -0.86 2.17 1.01 -1.18 -3.29 121.20 126.04 3kls s ILE 189 Ca 0.02 0.35 -0.16 0.00 0.00 0.00 0.00 60.65 60.87 3kls s ILE 189 Cb -0.12 -4.25 0.18 0.00 0.01 0.00 0.00 42.46 38.28 3kls s ILE 189 CO -0.06 -0.62 0.90 -0.51 0.00 0.00 0.00 174.94 174.64 3kls s ILE 190 N 3.06 5.26 0.05 2.92 2.07 -0.27 -3.04 121.20 131.25 3kls s ILE 190 Ca 0.27 -2.09 -0.31 0.00 -1.41 0.00 0.00 60.65 57.11 3kls s ILE 190 Cb -0.13 -4.58 -0.06 0.00 0.13 0.00 0.00 42.46 37.81 3kls s ILE 190 CO 0.20 -1.21 1.37 -0.63 -1.91 0.00 0.00 174.94 172.76 3kls s ILE 191 N 1.18 3.60 0.24 2.00 1.01 -1.20 -2.50 121.20 125.53 3kls s ILE 191 Ca 0.23 1.08 -0.14 0.00 0.00 0.00 0.00 60.65 61.82 3kls s ILE 191 Cb -0.09 -3.70 -0.08 0.00 0.01 0.00 0.00 42.46 38.61 3kls s ILE 191 CO -0.09 0.04 0.64 0.20 0.00 0.00 0.00 174.94 175.74 3kls s ASN 192 N 1.47 6.79 0.00 3.58 0.01 -1.09 -2.74 114.94 122.95 3kls s ASN 192 Ca 0.63 1.15 0.00 0.00 -0.71 0.00 0.00 52.86 53.94 3kls s ASN 192 Cb -0.33 -2.32 0.00 0.00 0.41 0.00 0.00 41.25 39.01 3kls s ASN 192 CO 0.28 -0.06 0.00 0.18 -1.51 0.00 0.00 177.10 175.99 3kls n LEU 193 N 0.12 0.00 -3.79 0.60 4.77 -1.21 -2.90 117.00 114.59 3kls n LEU 193 Ca -0.00 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 55.94 3kls n LEU 193 Cb 0.52 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.61 3kls n LEU 193 CO 0.43 0.00 0.74 -1.59 -1.33 0.00 0.00 177.39 175.64 3kls s LYS 194 N -0.81 1.25 0.63 3.23 -2.85 -1.26 -4.57 119.74 115.36 3kls s LYS 194 Ca 0.00 -0.73 0.21 0.00 -1.00 0.00 0.00 55.97 54.45 3kls s LYS 194 Cb 0.00 0.40 0.89 0.00 -2.06 0.00 0.00 37.83 37.06 3kls s LYS 194 CO 0.00 -0.58 1.42 -0.44 0.10 0.00 0.00 175.35 175.86 3kls h ASP 195 N 2.00 0.00 0.00 0.03 3.32 -2.00 -1.83 116.42 117.94 3kls h ASP 195 Ca -0.25 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.80 3kls h ASP 195 Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 3kls h ASP 195 CO 0.29 0.00 -0.23 -1.84 -1.72 0.00 0.00 179.24 175.74 3kls n GLU 196 N -3.10 0.14 -4.23 3.56 0.00 -1.26 -5.09 120.64 110.65 3kls n GLU 196 Ca 0.11 -0.83 -0.19 0.00 0.00 0.00 0.00 57.16 56.25 3kls n GLU 196 Cb 1.08 -0.55 -0.12 0.00 0.00 0.00 0.00 31.44 31.86 3kls n GLU 196 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 3kls s ASN 197 N -0.58 2.01 -0.27 -1.84 3.84 -0.69 -5.11 114.94 112.30 3kls s ASN 197 Ca 0.01 -0.72 -0.22 0.00 0.21 0.00 0.00 52.86 52.14 3kls s ASN 197 Cb 0.01 -0.08 0.08 0.00 -0.55 0.00 0.00 41.25 40.71 3kls s ASN 197 CO 0.00 -0.08 0.73 -1.59 -2.79 0.00 0.00 177.10 173.38 3kls s LYS 198 N -2.19 0.77 -0.37 0.43 -2.85 -1.26 -3.34 119.74 110.93 3kls s LYS 198 Ca 0.05 1.05 -0.09 0.00 -1.00 0.00 0.00 55.97 55.98 3kls s LYS 198 Cb -0.08 0.30 0.04 0.00 -2.06 0.00 0.00 37.83 36.04 3kls s LYS 198 CO 0.03 -0.11 0.17 0.08 0.10 0.00 0.00 175.35 175.62 3kls s VAL 199 N 0.81 4.16 0.42 1.79 1.01 -1.11 -4.94 120.40 122.55 3kls s VAL 199 Ca -0.03 -1.10 -0.04 0.00 0.00 0.00 0.00 61.98 60.81 3kls s VAL 199 Cb -0.05 -3.38 -0.04 0.00 0.00 0.00 0.00 36.38 32.91 3kls s VAL 199 CO -0.07 -0.27 0.70 -1.61 0.00 0.00 0.00 175.10 173.85 3kls s GLU 200 N 1.46 3.57 -0.24 2.72 2.02 -1.25 -3.26 118.70 123.70 3kls s GLU 200 Ca 0.01 0.08 -0.03 0.00 0.02 0.00 0.00 54.97 55.05 3kls s GLU 200 Cb -0.20 -2.47 0.10 0.00 0.10 0.00 0.00 34.13 31.65 3kls s GLU 200 CO 0.04 -0.06 0.19 0.42 0.02 0.00 0.00 175.26 175.87 3kls s ILE 201 N -2.53 -0.22 0.47 -1.63 1.01 -1.17 -4.94 121.20 112.19 3kls s ILE 201 Ca 0.46 -0.41 -0.23 0.00 0.00 0.00 0.00 60.65 60.47 3kls s ILE 201 Cb -0.10 -0.82 -0.08 0.00 0.01 0.00 0.00 42.46 41.46 3kls s ILE 201 CO 0.40 -0.44 1.17 -0.67 0.00 0.00 0.00 174.94 175.39 3kls n ASP 202 N 5.29 1.96 -0.05 3.58 4.64 -1.26 -3.11 116.55 127.59 3kls n ASP 202 Ca -0.05 1.02 0.10 0.00 -1.38 0.00 0.00 54.79 54.48 3kls n ASP 202 Cb 0.46 -1.46 -0.08 0.00 -1.04 0.00 0.00 41.12 39.01 3kls n ASP 202 CO 0.00 0.00 0.00 0.18 -0.82 0.00 0.00 177.20 176.56 3kls n LEU 203 N -0.07 1.07 0.03 -2.67 4.77 -0.48 -4.34 117.00 115.31 3kls n LEU 203 Ca 0.09 -0.49 0.08 0.00 -0.03 0.00 0.00 56.01 55.66 3kls n LEU 203 Cb 0.42 -0.02 0.36 0.00 -2.33 0.00 0.00 43.42 41.85 3kls n LEU 203 CO 0.56 0.25 0.77 0.61 -1.33 0.00 0.00 177.39 178.25 3kls n GLY 204 N 1.49 -1.09 3.58 -0.72 0.00 -1.21 -4.72 105.19 102.53 3kls n GLY 204 Ca 0.05 -0.02 -0.11 0.00 0.00 0.00 0.00 46.02 45.94 3kls n GLY 204 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3kls s ASP 205 N -3.31 -0.39 -0.72 1.61 2.15 -1.26 -4.29 116.67 110.47 3kls s ASP 205 Ca 0.07 0.46 -0.01 0.00 0.43 0.00 0.00 52.55 53.50 3kls s ASP 205 Cb 0.10 0.36 0.39 0.00 -0.30 0.00 0.00 42.92 43.47 3kls s ASP 205 CO 0.31 -0.33 1.86 0.29 -0.17 0.00 0.00 175.17 177.12 3kls n LYS 206 N 0.87 2.88 -0.11 4.34 5.02 -1.26 -4.75 118.16 125.14 3kls n LYS 206 Ca -0.11 -3.64 0.02 0.00 -2.02 0.00 0.00 58.31 52.57 3kls n LYS 206 Cb 0.58 -2.27 0.07 0.00 -0.02 0.00 0.00 35.03 33.39 3kls n LYS 206 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 3kls n LEU 207 N -0.63 1.21 -2.94 -0.35 7.94 -1.26 -4.54 117.00 116.43 3kls n LEU 207 Ca 0.54 -0.61 -0.34 0.00 -1.11 0.00 0.00 56.01 54.49 3kls n LEU 207 Cb 0.43 -0.25 -0.02 0.00 0.53 0.00 0.00 43.42 44.11 3kls n LEU 207 CO 0.55 0.25 1.79 1.67 -1.11 0.00 0.00 177.39 180.53 3kls n GLN 208 N 0.01 3.35 -0.26 1.96 -0.06 -1.26 -4.70 117.38 116.43 3kls n GLN 208 Ca 0.05 -3.05 -0.03 0.00 -2.00 0.00 0.00 57.00 51.97 3kls n GLN 208 Cb 0.24 -2.33 0.13 0.00 -4.06 0.00 0.00 30.24 24.22 3kls n GLN 208 CO 0.00 0.00 0.00 0.27 -0.20 0.00 0.00 177.06 177.13 3kls h PHE 209 N 3.55 1.10 0.00 3.69 -5.15 -1.98 -3.16 116.94 114.99 3kls h PHE 209 Ca 0.52 -0.05 -0.17 0.00 -0.20 0.00 0.00 57.97 58.07 3kls h PHE 209 Cb 0.46 -0.34 -0.03 0.00 0.22 0.00 0.00 35.95 36.27 3kls h PHE 209 CO 1.45 0.80 -0.89 1.05 -2.00 0.00 0.00 178.31 178.72 3kls h GLU 210 N 1.09 0.00 0.00 6.09 9.09 -1.84 -3.10 114.58 125.91 3kls h GLU 210 Ca 0.26 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.67 3kls h GLU 210 Cb 0.13 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.23 3kls h GLU 210 CO -0.03 0.70 -0.41 -2.13 0.05 0.00 0.00 179.01 177.19 3kls n ARG 211 N -3.24 0.05 0.00 1.06 0.63 -1.25 -3.70 116.66 110.22 3kls n ARG 211 Ca -0.01 0.02 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 3kls n ARG 211 Cb 0.86 -1.53 0.00 0.00 0.45 0.00 0.00 32.46 32.24 3kls n ARG 211 CO 0.00 0.00 0.00 -1.33 -2.51 0.00 0.00 177.63 173.79 3kls n MET 212 N -1.60 0.00 -0.04 -0.14 2.81 -1.17 0.52 117.12 117.49 3kls n MET 212 Ca 0.05 0.06 -0.15 0.00 -1.81 0.00 0.00 57.70 55.86 3kls n MET 212 Cb 0.35 -1.50 -0.14 0.00 -0.71 0.00 0.00 33.22 31.22 3kls n MET 212 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3kls n GLY 213 N -1.04 -0.75 3.27 3.03 0.00 -1.24 -1.88 105.19 106.58 3kls n GLY 213 Ca 0.00 -0.19 -0.39 0.00 0.00 0.00 0.00 46.02 45.44 3kls n GLY 213 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3kls n ASP 214 N -3.18 -3.43 -4.24 1.61 -0.08 0.18 -4.78 116.55 102.64 3kls n ASP 214 Ca -0.29 0.66 -0.15 0.00 -1.51 0.00 0.00 54.79 53.49 3kls n ASP 214 Cb 1.06 -0.88 -0.10 0.00 2.34 0.00 0.00 41.12 43.53 3kls n ASP 214 CO 0.00 0.00 0.00 0.68 0.12 0.00 0.00 177.20 178.00 3kls s VAL 215 N -1.97 1.18 -0.00 5.18 -7.23 -1.26 -2.95 120.40 113.35 3kls s VAL 215 Ca 0.58 -1.93 0.03 0.00 -1.81 0.00 0.00 61.98 58.85 3kls s VAL 215 Cb -0.49 -1.71 -0.01 0.00 0.56 0.00 0.00 36.38 34.74 3kls s VAL 215 CO 0.65 -0.64 -0.10 -0.76 -0.31 0.00 0.00 175.10 173.94 3kls s LEU 216 N -2.91 2.05 -0.30 1.32 2.01 -0.13 -4.93 118.68 115.79 3kls s LEU 216 Ca 0.13 -0.22 -0.29 0.00 0.01 0.00 0.00 54.13 53.76 3kls s LEU 216 Cb -0.00 -0.50 0.01 0.00 0.01 0.00 0.00 46.19 45.72 3kls s LEU 216 CO 0.01 0.10 1.09 0.20 1.01 0.00 0.00 176.35 178.76 3kls s ASN 217 N -0.39 6.95 0.12 2.29 0.01 -1.26 -0.37 114.94 122.29 3kls s ASN 217 Ca 0.03 1.14 -0.29 0.00 -0.71 0.00 0.00 52.86 53.04 3kls s ASN 217 Cb -0.04 -2.54 -0.07 0.00 0.41 0.00 0.00 41.25 39.00 3kls s ASN 217 CO -0.00 -0.85 1.61 0.28 -1.51 0.00 0.00 177.10 176.63 3kls h SER 218 N 8.04 -1.04 0.34 -1.22 0.02 -0.54 -2.25 113.55 116.90 3kls h SER 218 Ca -0.21 0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 3kls h SER 218 Cb 1.06 0.41 0.00 0.00 0.14 0.00 0.00 62.40 64.01 3kls h SER 218 CO 1.02 -0.42 0.00 0.11 -1.14 0.00 0.00 176.83 176.40 3kls h LYS 219 N -0.54 0.00 -0.20 3.45 1.57 -1.90 -2.97 116.57 115.98 3kls h LYS 219 Ca 0.04 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.64 3kls h LYS 219 Cb 0.60 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.92 3kls h LYS 219 CO -0.25 0.00 -0.61 -0.44 -0.57 0.00 0.00 179.45 177.59 3kls h ASP 220 N 0.00 0.88 -1.88 0.86 3.32 -1.75 -3.45 116.42 114.40 3kls h ASP 220 Ca 0.00 -0.59 -0.60 0.00 0.02 0.00 0.00 57.03 55.86 3kls h ASP 220 Cb 0.17 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.47 3kls h ASP 220 CO 0.00 1.31 1.42 -0.38 -1.72 0.00 0.00 179.24 179.87 3kls n ILE 221 N -4.05 0.39 0.04 0.35 5.41 -1.12 -4.67 119.36 115.71 3kls n ILE 221 Ca -0.06 -0.36 -0.20 0.00 1.00 0.00 0.00 62.75 63.13 3kls n ILE 221 Cb 0.66 -2.32 -0.12 0.00 -0.71 0.00 0.00 39.64 37.14 3kls n ILE 221 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 176.55 176.46 3kls h ARG 222 N 13.56 0.53 0.00 0.38 2.43 -1.78 -3.48 114.38 126.02 3kls h ARG 222 Ca -0.40 -0.64 0.00 0.00 -0.81 0.00 0.00 59.98 58.12 3kls h ARG 222 Cb 1.26 0.20 0.00 0.00 -0.42 0.00 0.00 29.97 31.01 3kls h ARG 222 CO 0.97 1.26 0.00 0.41 -1.51 0.00 0.00 179.97 181.09 3kls n GLY 223 N 1.24 1.53 3.78 2.80 0.00 -1.26 -4.67 105.19 108.62 3kls n GLY 223 Ca -0.12 0.34 -0.33 0.00 0.00 0.00 0.00 46.02 45.91 3kls n GLY 223 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kls s ILE 224 N 0.00 3.48 -0.26 -0.61 1.01 -1.21 -2.66 121.20 120.95 3kls s ILE 224 Ca 0.00 0.69 -0.04 0.00 0.00 0.00 0.00 60.65 61.30 3kls s ILE 224 Cb 0.00 -3.21 0.14 0.00 0.01 0.00 0.00 42.46 39.40 3kls s ILE 224 CO 0.00 -0.43 0.48 -0.55 0.00 0.00 0.00 174.94 174.44 3kls s SER 225 N -2.70 -0.47 0.12 3.58 0.15 -1.04 -1.75 113.70 111.59 3kls s SER 225 Ca 0.65 0.71 0.03 0.00 0.70 0.00 0.00 55.95 58.04 3kls s SER 225 Cb -0.19 1.59 -0.04 0.00 -1.71 0.00 0.00 66.02 65.68 3kls s SER 225 CO 0.40 -0.27 0.18 -0.69 1.20 0.00 0.00 173.24 174.06 3kls s VAL 226 N 2.69 4.89 -0.09 4.45 1.01 -0.88 -1.12 120.40 131.35 3kls s VAL 226 Ca 0.10 -0.77 -0.03 0.00 0.00 0.00 0.00 61.98 61.28 3kls s VAL 226 Cb -0.14 -3.45 0.04 0.00 0.00 0.00 0.00 36.38 32.82 3kls s VAL 226 CO -0.17 -0.00 0.05 -0.89 0.00 0.00 0.00 175.10 174.09 3kls s THR 227 N -1.62 0.06 -0.32 3.92 2.01 -1.21 -2.50 115.64 115.99 3kls s THR 227 Ca 0.32 0.13 -0.12 0.00 0.31 0.00 0.00 61.69 62.33 3kls s THR 227 Cb -0.11 -0.42 -0.03 0.00 0.01 0.00 0.00 72.50 71.95 3kls s THR 227 CO 0.25 0.05 0.23 -0.63 -0.69 0.00 0.00 174.62 173.83 3kls s ILE 228 N 2.09 5.29 -0.35 1.82 1.01 -0.15 -2.99 121.20 127.92 3kls s ILE 228 Ca 0.04 -0.08 -0.12 0.00 0.00 0.00 0.00 60.65 60.49 3kls s ILE 228 Cb -0.13 -3.65 0.00 0.00 0.01 0.00 0.00 42.46 38.68 3kls s ILE 228 CO -0.05 0.08 0.21 0.54 0.00 0.00 0.00 174.94 175.72 3kls s ASN 229 N 1.74 5.81 0.00 3.58 4.22 -0.86 0.13 114.94 129.56 3kls s ASN 229 Ca 0.07 -0.67 0.27 0.00 -2.14 0.00 0.00 52.86 50.38 3kls s ASN 229 Cb -0.17 -2.07 0.75 0.00 1.28 0.00 0.00 41.25 41.05 3kls s ASN 229 CO 0.11 -0.29 1.58 0.00 -2.04 0.00 0.00 177.10 176.45