#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k4t n ALA 2 N 0.00 5.08 -3.51 -5.12 0.00 -1.26 -5.01 120.51 110.69 2k4t n ALA 2 Ca 0.00 -4.38 -0.13 0.00 0.00 0.00 0.00 53.44 48.93 2k4t n ALA 2 Cb 0.00 -0.65 -0.14 0.00 0.00 0.00 0.00 19.45 18.67 2k4t n ALA 2 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2k4t s VAL 3 N -5.34 -0.03 0.96 0.00 0.11 -1.26 -5.16 120.40 109.67 2k4t s VAL 3 Ca 0.48 0.12 -0.12 0.00 -2.93 0.00 0.00 61.98 59.53 2k4t s VAL 3 Cb 0.38 -0.26 0.17 0.00 -1.53 0.00 0.00 36.38 35.14 2k4t s VAL 3 CO -0.19 0.05 1.09 -2.16 -3.33 0.00 0.00 175.10 170.56 2k4t s PRO 4 N 0.84 0.74 -0.33 1.54 0.04 -1.26 -4.94 135.00 131.62 2k4t s PRO 4 Ca -0.06 0.64 -0.29 0.00 0.04 0.00 0.00 61.00 61.33 2k4t s PRO 4 Cb -0.08 -1.76 -0.01 0.00 0.04 0.00 0.00 34.50 32.68 2k4t s PRO 4 CO -0.04 -2.55 1.69 -1.25 0.04 0.00 0.00 177.00 174.89 2k4t s PRO 5 N -4.95 3.45 -0.11 0.56 0.04 -1.26 -4.82 135.00 127.91 2k4t s PRO 5 Ca 0.65 1.35 0.01 0.00 0.04 0.00 0.00 61.00 63.04 2k4t s PRO 5 Cb -0.18 -4.14 -0.07 0.00 0.04 0.00 0.00 34.50 30.15 2k4t s PRO 5 CO 0.57 -1.72 -0.10 0.25 0.04 0.00 0.00 177.00 176.05 2k4t n THR 6 N 7.23 0.63 0.12 1.26 -2.24 -1.26 -3.95 114.28 116.07 2k4t n THR 6 Ca 0.21 -0.24 -0.00 0.00 -2.27 0.00 0.00 64.05 61.75 2k4t n THR 6 Cb 0.47 -0.91 0.02 0.00 -2.10 0.00 0.00 70.33 67.81 2k4t n THR 6 CO 0.00 0.00 0.00 0.10 -0.57 0.00 0.00 175.07 174.60 2k4t h TYR 7 N -0.01 0.00 0.00 4.78 -0.00 -1.97 -3.18 116.97 116.59 2k4t h TYR 7 Ca -0.25 0.00 -0.12 0.00 0.00 0.00 0.00 58.73 58.36 2k4t h TYR 7 Cb 1.38 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 38.09 2k4t h TYR 7 CO 0.01 0.64 -1.32 0.00 -0.00 0.00 0.00 178.16 177.49 2k4t n ALA 8 N -2.28 2.09 0.19 0.10 0.00 -1.26 -3.52 120.51 115.83 2k4t n ALA 8 Ca 0.01 -0.46 0.06 0.00 0.00 0.00 0.00 53.44 53.05 2k4t n ALA 8 Cb 0.77 -0.99 0.35 0.00 0.00 0.00 0.00 19.45 19.57 2k4t n ALA 8 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 2k4t h ASP 9 N 0.00 0.00 0.88 0.00 3.58 -1.68 -3.02 116.42 116.18 2k4t h ASP 9 Ca -0.12 0.00 -0.18 0.00 0.42 0.00 0.00 57.03 57.15 2k4t h ASP 9 Cb 1.43 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 42.45 2k4t h ASP 9 CO 0.03 0.36 -1.21 0.17 -2.88 0.00 0.00 179.24 175.71 2k4t h LEU 10 N 0.00 0.00 0.00 2.28 8.10 -1.67 -3.48 115.31 120.54 2k4t h LEU 10 Ca -0.00 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.99 2k4t h LEU 10 Cb 0.88 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.10 2k4t h LEU 10 CO 0.05 0.68 0.00 0.61 -4.11 0.00 0.00 178.44 175.67 2k4t n GLY 11 N 1.38 5.42 3.42 0.17 0.00 -1.14 -4.82 105.19 109.62 2k4t n GLY 11 Ca -0.07 -1.76 -0.18 0.00 0.00 0.00 0.00 46.02 44.01 2k4t n GLY 11 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2k4t n LYS 12 N 0.00 -4.03 -3.71 1.61 5.02 -1.26 -4.86 118.16 110.94 2k4t n LYS 12 Ca 0.00 0.79 -0.22 0.00 -2.02 0.00 0.00 58.31 56.86 2k4t n LYS 12 Cb 0.00 -5.59 -0.04 0.00 -0.02 0.00 0.00 35.03 29.39 2k4t n LYS 12 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2k4t n SER 13 N -3.12 2.82 -2.96 4.39 7.64 -1.26 -4.87 113.62 116.27 2k4t n SER 13 Ca -0.18 -2.50 -0.13 0.00 1.01 0.00 0.00 58.87 57.06 2k4t n SER 13 Cb 0.64 0.19 0.06 0.00 -1.01 0.00 0.00 64.21 64.10 2k4t n SER 13 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k4t n ALA 14 N -1.94 -1.92 -0.03 -0.43 0.00 -1.26 -4.96 120.51 109.97 2k4t n ALA 14 Ca -0.14 0.04 -0.02 0.00 0.00 0.00 0.00 53.44 53.32 2k4t n ALA 14 Cb 0.45 -3.62 -0.06 0.00 0.00 0.00 0.00 19.45 16.22 2k4t n ALA 14 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2k4t n ARG 15 N -3.21 2.31 -4.36 0.00 0.63 -1.26 -5.03 116.66 105.73 2k4t n ARG 15 Ca -0.14 -0.02 -0.25 0.00 -0.92 0.00 0.00 57.85 56.53 2k4t n ARG 15 Cb 0.62 -1.18 -0.12 0.00 0.45 0.00 0.00 32.46 32.23 2k4t n ARG 15 CO 0.00 0.00 0.00 0.16 -2.51 0.00 0.00 177.63 175.28 2k4t s ASP 16 N -3.65 2.98 -0.26 6.15 -4.77 -1.26 -5.12 116.67 110.73 2k4t s ASP 16 Ca -0.03 -0.83 -0.03 0.00 -3.30 0.00 0.00 52.55 48.36 2k4t s ASP 16 Cb 0.03 -0.19 0.09 0.00 -1.09 0.00 0.00 42.92 41.75 2k4t s ASP 16 CO 0.29 0.05 0.10 -0.69 0.70 0.00 0.00 175.17 175.62 2k4t s VAL 17 N -1.68 0.33 0.11 2.11 1.01 -1.26 -5.12 120.40 115.89 2k4t s VAL 17 Ca 0.16 -0.84 -0.18 0.00 0.00 0.00 0.00 61.98 61.12 2k4t s VAL 17 Cb -0.08 -1.15 0.04 0.00 0.00 0.00 0.00 36.38 35.19 2k4t s VAL 17 CO 0.07 -0.56 0.44 -0.36 0.00 0.00 0.00 175.10 174.69 2k4t s PHE 18 N 1.91 -0.27 -0.25 5.22 0.08 -1.26 -5.15 117.98 118.26 2k4t s PHE 18 Ca 0.06 0.05 -0.02 0.00 0.12 0.00 0.00 56.93 57.14 2k4t s PHE 18 Cb -0.17 0.29 0.13 0.00 -0.57 0.00 0.00 43.02 42.71 2k4t s PHE 18 CO -0.25 -0.69 0.37 0.95 -0.10 0.00 0.00 175.22 175.50 2k4t s THR 19 N -3.44 -0.58 0.30 0.64 -4.23 -1.26 -5.15 115.64 101.91 2k4t s THR 19 Ca 0.01 -0.12 0.01 0.00 -1.18 0.00 0.00 61.69 60.40 2k4t s THR 19 Cb 0.01 -0.84 -0.02 0.00 1.34 0.00 0.00 72.50 72.99 2k4t s THR 19 CO -0.10 -0.16 0.32 -0.54 -0.54 0.00 0.00 174.62 173.60 2k4t s LYS 20 N 2.53 1.67 0.00 3.99 -0.14 -1.26 -5.12 119.74 121.40 2k4t s LYS 20 Ca 0.12 -1.79 0.00 0.00 -1.36 0.00 0.00 55.97 52.94 2k4t s LYS 20 Cb -0.15 0.36 0.00 0.00 -1.68 0.00 0.00 37.83 36.36 2k4t s LYS 20 CO -0.18 -0.64 0.00 0.41 -0.76 0.00 0.00 175.35 174.18 2k4t n GLY 21 N -0.51 0.49 3.29 -3.33 0.00 -1.26 -5.06 105.19 98.82 2k4t n GLY 21 Ca 0.04 -1.11 -0.15 0.00 0.00 0.00 0.00 46.02 44.79 2k4t n GLY 21 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2k4t n TYR 22 N 0.00 -2.46 -3.63 1.61 4.01 -1.26 -5.03 117.16 110.40 2k4t n TYR 22 Ca 0.00 0.84 -0.11 0.00 -0.16 0.00 0.00 57.90 58.47 2k4t n TYR 22 Cb 0.00 -4.00 -0.05 0.00 -0.31 0.00 0.00 39.34 34.98 2k4t n TYR 22 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2k4t s GLY 23 N -3.33 -0.29 0.31 2.72 0.00 -1.26 -5.18 107.32 100.30 2k4t s GLY 23 Ca 0.38 0.03 0.09 0.00 0.00 0.00 0.00 44.72 45.22 2k4t s GLY 23 CO 0.76 -0.23 0.05 -0.11 0.00 0.00 0.00 173.10 173.57 2k4t s PHE 24 N -3.58 2.65 -0.21 1.90 -0.71 -1.26 -4.94 117.98 111.84 2k4t s PHE 24 Ca 0.01 -0.34 -0.09 0.00 -1.04 0.00 0.00 56.93 55.48 2k4t s PHE 24 Cb 0.01 -1.44 0.03 0.00 -1.21 0.00 0.00 43.02 40.42 2k4t s PHE 24 CO -0.10 0.48 0.18 0.41 -1.34 0.00 0.00 175.22 174.84 2k4t n GLY 25 N -1.00 -4.82 3.41 1.99 0.00 -1.26 -4.08 105.19 99.42 2k4t n GLY 25 Ca -0.05 1.40 -0.33 0.00 0.00 0.00 0.00 46.02 47.05 2k4t n GLY 25 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2k4t s LEU 26 N -0.91 2.75 -0.05 0.99 2.96 0.50 -1.77 118.68 123.14 2k4t s LEU 26 Ca -0.20 -0.28 -0.00 0.00 -0.22 0.00 0.00 54.13 53.42 2k4t s LEU 26 Cb 0.01 -1.60 0.03 0.00 0.50 0.00 0.00 46.19 45.12 2k4t s LEU 26 CO 0.76 0.21 -0.01 -0.63 -1.32 0.00 0.00 176.35 175.37 2k4t s ILE 27 N 0.06 0.37 0.17 6.68 1.09 -0.23 -1.09 121.20 128.25 2k4t s ILE 27 Ca -0.05 0.04 0.10 0.00 -1.10 0.00 0.00 60.65 59.65 2k4t s ILE 27 Cb -0.14 -0.47 -0.04 0.00 -1.06 0.00 0.00 42.46 40.74 2k4t s ILE 27 CO 0.04 0.22 -0.23 -1.59 -0.10 0.00 0.00 174.94 173.29 2k4t s LYS 28 N 1.43 1.41 -0.01 2.79 0.00 0.18 -0.13 119.74 125.41 2k4t s LYS 28 Ca -0.03 -1.45 -0.03 0.00 0.00 0.00 0.00 55.97 54.46 2k4t s LYS 28 Cb -0.13 -1.69 -0.00 0.00 0.00 0.00 0.00 37.83 36.01 2k4t s LYS 28 CO -0.03 0.37 0.05 -0.48 0.00 0.00 0.00 175.35 175.26 2k4t s LEU 29 N -2.53 1.84 -0.05 2.77 2.34 0.87 -0.93 118.68 122.99 2k4t s LEU 29 Ca 0.17 -0.09 -0.20 0.00 0.06 0.00 0.00 54.13 54.08 2k4t s LEU 29 Cb -0.08 0.28 -0.05 0.00 -0.56 0.00 0.00 46.19 45.78 2k4t s LEU 29 CO 0.08 -0.16 0.56 -0.62 -1.06 0.00 0.00 176.35 175.15 2k4t s ASP 30 N -0.61 6.87 0.13 1.48 -1.08 -0.08 -1.00 116.67 122.37 2k4t s ASP 30 Ca -0.07 1.03 0.09 0.00 -0.52 0.00 0.00 52.55 53.08 2k4t s ASP 30 Cb -0.04 -2.34 -0.04 0.00 -1.46 0.00 0.00 42.92 39.04 2k4t s ASP 30 CO 0.00 0.05 -0.22 -0.76 0.52 0.00 0.00 175.17 174.77 2k4t s LEU 31 N 0.16 2.34 -0.21 -1.34 1.43 0.91 -3.92 118.68 118.05 2k4t s LEU 31 Ca 0.30 -0.74 -0.04 0.00 -1.03 0.00 0.00 54.13 52.61 2k4t s LEU 31 Cb -0.17 -0.95 -0.02 0.00 0.03 0.00 0.00 46.19 45.08 2k4t s LEU 31 CO 0.15 0.07 -0.02 -0.54 0.23 0.00 0.00 176.35 176.23 2k4t s LYS 32 N -2.16 3.50 -0.38 1.70 -0.14 -1.26 -0.78 119.74 120.22 2k4t s LYS 32 Ca 0.10 -0.57 -0.21 0.00 -1.36 0.00 0.00 55.97 53.93 2k4t s LYS 32 Cb -0.09 -3.03 0.01 0.00 -1.68 0.00 0.00 37.83 33.04 2k4t s LYS 32 CO 0.05 -0.07 0.68 0.99 -0.76 0.00 0.00 175.35 176.24 2k4t s THR 33 N 1.18 4.83 -0.13 2.17 2.01 -1.25 -4.82 115.64 119.63 2k4t s THR 33 Ca 0.03 0.52 0.01 0.00 0.31 0.00 0.00 61.69 62.56 2k4t s THR 33 Cb -0.14 -4.15 0.02 0.00 0.01 0.00 0.00 72.50 68.23 2k4t s THR 33 CO 0.00 -0.43 -0.17 -1.59 -0.69 0.00 0.00 174.62 171.74 2k4t s LYS 34 N 2.86 2.51 0.25 4.92 0.00 -1.26 -1.66 119.74 127.35 2k4t s LYS 34 Ca 0.26 -0.66 0.02 0.00 0.00 0.00 0.00 55.97 55.59 2k4t s LYS 34 Cb -0.14 -2.14 -0.05 0.00 0.00 0.00 0.00 37.83 35.50 2k4t s LYS 34 CO 0.17 -0.11 0.05 -1.12 0.00 0.00 0.00 175.35 174.34 2k4t s SER 35 N 1.11 1.47 -1.30 0.03 0.01 -1.26 -5.06 113.70 108.70 2k4t s SER 35 Ca -0.03 -1.31 -0.08 0.00 1.31 0.00 0.00 55.95 55.85 2k4t s SER 35 Cb -0.14 0.09 0.15 0.00 0.21 0.00 0.00 66.02 66.33 2k4t s SER 35 CO -0.05 -0.64 2.06 1.21 0.41 0.00 0.00 173.24 176.22 2k4t n GLU 36 N -0.44 3.95 0.00 12.44 2.13 -1.26 -4.06 120.64 133.40 2k4t n GLU 36 Ca -0.02 -3.50 0.00 0.00 0.66 0.00 0.00 57.16 54.30 2k4t n GLU 36 Cb 0.65 -2.82 0.00 0.00 0.27 0.00 0.00 31.44 29.54 2k4t n GLU 36 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2k4t n ASN 37 N 3.13 0.00 0.00 4.31 5.03 -1.26 -5.07 115.26 121.39 2k4t n ASN 37 Ca 0.48 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.93 2k4t n ASN 37 Cb 0.32 0.28 0.00 0.00 -1.02 0.00 0.00 39.78 39.37 2k4t n ASN 37 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2k4t n GLY 38 N -0.58 0.60 3.94 7.41 0.00 -1.26 -5.16 105.19 110.14 2k4t n GLY 38 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 2k4t n GLY 38 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2k4t s LEU 39 N 0.00 3.70 -0.08 0.99 -0.00 -1.26 -4.60 118.68 117.42 2k4t s LEU 39 Ca 0.00 -0.42 -0.21 0.00 -0.00 0.00 0.00 54.13 53.50 2k4t s LEU 39 Cb 0.00 -2.48 -0.04 0.00 -0.00 0.00 0.00 46.19 43.67 2k4t s LEU 39 CO 0.00 -0.53 0.58 -0.70 -0.00 0.00 0.00 176.35 175.70 2k4t s GLU 40 N -4.17 4.38 -0.71 1.48 2.56 0.29 -4.78 118.70 117.75 2k4t s GLU 40 Ca 0.47 0.66 -0.26 0.00 0.00 0.00 0.00 54.97 55.84 2k4t s GLU 40 Cb -0.08 -3.43 -0.02 0.00 2.00 0.00 0.00 34.13 32.61 2k4t s GLU 40 CO 0.30 0.14 1.77 -0.59 -0.56 0.00 0.00 175.26 176.32 2k4t s PHE 41 N 0.62 1.83 -0.28 5.30 -0.12 -0.66 -2.64 117.98 122.03 2k4t s PHE 41 Ca 0.31 0.54 -0.02 0.00 -0.05 0.00 0.00 56.93 57.71 2k4t s PHE 41 Cb -0.16 -4.19 0.09 0.00 -0.63 0.00 0.00 43.02 38.12 2k4t s PHE 41 CO 0.14 -2.14 0.09 0.99 -0.05 0.00 0.00 175.22 174.26 2k4t s THR 42 N 8.58 0.52 0.01 -4.49 2.01 -0.65 -3.86 115.64 117.76 2k4t s THR 42 Ca 0.62 -1.01 -0.03 0.00 0.31 0.00 0.00 61.69 61.58 2k4t s THR 42 Cb -0.10 -1.31 -0.01 0.00 0.01 0.00 0.00 72.50 71.09 2k4t s THR 42 CO 0.14 -0.58 0.05 -0.94 -0.69 0.00 0.00 174.62 172.61 2k4t s SER 43 N 1.81 0.12 -0.04 3.53 1.04 0.04 0.46 113.70 120.67 2k4t s SER 43 Ca 0.07 -0.31 -0.01 0.00 0.48 0.00 0.00 55.95 56.17 2k4t s SER 43 Cb -0.17 0.15 0.03 0.00 0.10 0.00 0.00 66.02 66.13 2k4t s SER 43 CO -0.24 -0.31 0.08 -0.44 0.98 0.00 0.00 173.24 173.31 2k4t s SER 44 N -1.29 -0.01 -0.02 7.02 0.01 -0.36 -0.06 113.70 118.98 2k4t s SER 44 Ca -0.14 0.15 0.07 0.00 1.31 0.00 0.00 55.95 57.34 2k4t s SER 44 Cb -0.08 0.05 -0.02 0.00 0.21 0.00 0.00 66.02 66.18 2k4t s SER 44 CO 0.00 -0.12 -0.25 -0.83 0.41 0.00 0.00 173.24 172.45 2k4t s GLY 45 N 0.97 1.30 0.09 3.44 0.00 -0.17 0.02 107.32 112.97 2k4t s GLY 45 Ca -0.08 -1.10 0.06 0.00 0.00 0.00 0.00 44.72 43.60 2k4t s GLY 45 CO -0.04 -0.91 -0.16 -0.56 0.00 0.00 0.00 173.10 171.43 2k4t s SER 46 N -0.63 1.95 0.01 1.64 0.01 0.08 -0.09 113.70 116.67 2k4t s SER 46 Ca 0.10 -0.66 -0.15 0.00 1.31 0.00 0.00 55.95 56.55 2k4t s SER 46 Cb -0.10 -0.08 0.02 0.00 0.21 0.00 0.00 66.02 66.08 2k4t s SER 46 CO -0.01 -0.05 0.32 0.00 0.41 0.00 0.00 173.24 173.92 2k4t s ALA 47 N -1.36 -0.78 -0.26 1.44 0.00 0.82 -0.03 121.76 121.59 2k4t s ALA 47 Ca 0.02 0.23 0.00 0.00 0.00 0.00 0.00 51.96 52.21 2k4t s ALA 47 Cb -0.09 0.18 0.04 0.00 0.00 0.00 0.00 23.12 23.25 2k4t s ALA 47 CO 0.03 -0.33 -0.08 1.21 0.00 0.00 0.00 175.76 176.59 2k4t s ASN 48 N -1.64 4.35 -1.17 0.00 2.47 -1.23 -1.06 114.94 116.66 2k4t s ASN 48 Ca -0.10 -1.13 0.00 0.00 0.42 0.00 0.00 52.86 52.05 2k4t s ASN 48 Cb -0.03 -1.61 0.00 0.00 -1.45 0.00 0.00 41.25 38.16 2k4t s ASN 48 CO 0.01 -0.16 0.00 0.35 -3.72 0.00 0.00 177.10 173.58 2k4t n THR 49 N 4.57 -0.23 -4.30 -5.21 -2.24 -0.73 -1.47 114.28 104.67 2k4t n THR 49 Ca -0.15 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.25 2k4t n THR 49 Cb 0.45 -1.36 -0.04 0.00 -2.10 0.00 0.00 70.33 67.27 2k4t n THR 49 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2k4t n GLU 50 N -2.19 -2.44 -2.72 -0.78 4.07 -1.26 -4.84 120.64 110.49 2k4t n GLU 50 Ca -0.13 0.30 -0.42 0.00 -0.06 0.00 0.00 57.16 56.86 2k4t n GLU 50 Cb 0.48 -4.99 0.02 0.00 -0.06 0.00 0.00 31.44 26.88 2k4t n GLU 50 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 2k4t n THR 51 N -4.27 5.87 -2.46 6.31 -2.24 -0.54 -4.74 114.28 112.20 2k4t n THR 51 Ca 0.09 -5.91 -0.12 0.00 -2.27 0.00 0.00 64.05 55.84 2k4t n THR 51 Cb 0.48 -1.72 -0.01 0.00 -2.10 0.00 0.00 70.33 66.98 2k4t n THR 51 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2k4t n THR 52 N 0.41 -0.56 -2.29 4.28 -1.04 -1.26 -4.83 114.28 108.99 2k4t n THR 52 Ca 0.41 0.00 -0.20 0.00 -2.04 0.00 0.00 64.05 62.23 2k4t n THR 52 Cb 0.28 -1.65 0.02 0.00 -1.82 0.00 0.00 70.33 67.16 2k4t n THR 52 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 2k4t n LYS 53 N -2.81 3.11 -3.35 -2.82 3.00 -1.26 -5.02 118.16 109.02 2k4t n LYS 53 Ca -0.13 -4.08 -0.43 0.00 -0.00 0.00 0.00 58.31 53.66 2k4t n LYS 53 Cb 0.60 -2.10 -0.08 0.00 0.00 0.00 0.00 35.03 33.45 2k4t n LYS 53 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 2k4t s VAL 54 N -4.58 5.13 -0.16 3.15 1.01 -1.26 -3.50 120.40 120.19 2k4t s VAL 54 Ca 0.45 -0.63 -0.08 0.00 0.00 0.00 0.00 61.98 61.72 2k4t s VAL 54 Cb 0.40 -4.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.66 2k4t s VAL 54 CO -0.02 -0.50 0.10 -0.89 0.00 0.00 0.00 175.10 173.79 2k4t s THR 55 N 1.97 5.14 -0.21 3.92 2.01 0.95 -4.94 115.64 124.48 2k4t s THR 55 Ca 0.09 0.08 -0.04 0.00 0.31 0.00 0.00 61.69 62.13 2k4t s THR 55 Cb -0.20 -3.29 -0.01 0.00 0.01 0.00 0.00 72.50 69.01 2k4t s THR 55 CO 0.11 0.51 -0.04 -0.83 -0.69 0.00 0.00 174.62 173.67 2k4t s GLY 56 N -0.15 1.61 -0.17 4.40 0.00 -1.26 -0.74 107.32 111.01 2k4t s GLY 56 Ca 0.09 -1.13 -0.12 0.00 0.00 0.00 0.00 44.72 43.56 2k4t s GLY 56 CO 0.01 0.37 0.22 -0.45 0.00 0.00 0.00 173.10 173.25 2k4t s SER 57 N 1.36 6.35 -0.12 1.64 0.15 0.10 -4.52 113.70 118.66 2k4t s SER 57 Ca 0.04 0.40 -0.01 0.00 0.70 0.00 0.00 55.95 57.08 2k4t s SER 57 Cb -0.14 -2.14 -0.03 0.00 -1.71 0.00 0.00 66.02 62.00 2k4t s SER 57 CO -0.02 0.14 -0.07 -0.22 1.20 0.00 0.00 173.24 174.27 2k4t s LEU 58 N 0.37 3.11 -0.08 3.45 1.98 -0.59 -1.23 118.68 125.69 2k4t s LEU 58 Ca 0.13 -0.13 -0.04 0.00 -2.89 0.00 0.00 54.13 51.20 2k4t s LEU 58 Cb -0.12 -1.71 0.04 0.00 0.66 0.00 0.00 46.19 45.06 2k4t s LEU 58 CO 0.02 0.25 0.18 -0.70 -1.89 0.00 0.00 176.35 174.21 2k4t s GLU 59 N -0.10 0.14 -0.13 1.98 2.12 0.17 -0.09 118.70 122.80 2k4t s GLU 59 Ca 0.01 0.43 0.02 0.00 0.36 0.00 0.00 54.97 55.78 2k4t s GLU 59 Cb -0.13 -0.15 0.01 0.00 0.26 0.00 0.00 34.13 34.12 2k4t s GLU 59 CO 0.03 -0.16 -0.18 0.95 -0.54 0.00 0.00 175.26 175.36 2k4t s THR 60 N 1.16 1.73 -0.34 -1.70 -4.23 -0.39 -1.63 115.64 110.25 2k4t s THR 60 Ca -0.09 -0.77 -0.12 0.00 -1.18 0.00 0.00 61.69 59.53 2k4t s THR 60 Cb -0.11 -1.56 -0.01 0.00 1.34 0.00 0.00 72.50 72.16 2k4t s THR 60 CO -0.07 0.49 0.21 -0.75 -0.54 0.00 0.00 174.62 173.96 2k4t s LYS 61 N 0.98 3.39 0.08 3.99 2.20 -1.08 -1.55 119.74 127.74 2k4t s LYS 61 Ca -0.05 -0.71 0.07 0.00 -0.36 0.00 0.00 55.97 54.92 2k4t s LYS 61 Cb -0.15 -3.73 -0.04 0.00 -1.51 0.00 0.00 37.83 32.40 2k4t s LYS 61 CO -0.03 -0.46 -0.12 -0.47 -0.36 0.00 0.00 175.35 173.91 2k4t s TYR 62 N 1.68 2.72 0.04 4.03 6.14 0.68 0.11 117.35 132.74 2k4t s TYR 62 Ca 0.05 -0.16 0.00 0.00 0.64 0.00 0.00 57.07 57.60 2k4t s TYR 62 Cb -0.17 -1.46 -0.00 0.00 0.42 0.00 0.00 41.96 40.74 2k4t s TYR 62 CO 0.09 0.38 0.01 -2.13 0.64 0.00 0.00 175.55 174.54 2k4t n ARG 63 N 1.02 1.49 0.00 4.97 0.63 -1.26 -1.39 116.66 122.12 2k4t n ARG 63 Ca -0.14 -0.32 0.00 0.00 -0.92 0.00 0.00 57.85 56.47 2k4t n ARG 63 Cb 0.52 0.12 0.00 0.00 0.45 0.00 0.00 32.46 33.55 2k4t n ARG 63 CO 0.00 0.00 0.00 1.87 -2.51 0.00 0.00 177.63 176.99 2k4t n TRP 64 N -0.10 0.00 -4.11 -0.14 -0.00 -1.26 -4.97 117.44 106.87 2k4t n TRP 64 Ca -0.01 -0.09 -0.33 0.00 -0.00 0.00 0.00 57.50 57.07 2k4t n TRP 64 Cb 0.06 -0.01 -0.08 0.00 -0.00 0.00 0.00 31.31 31.28 2k4t n TRP 64 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 177.69 175.32 2k4t n THR 65 N -0.09 -0.35 0.00 5.87 5.66 -1.26 -4.61 114.28 119.50 2k4t n THR 65 Ca 0.00 -0.18 0.00 0.00 -3.05 0.00 0.00 64.05 60.82 2k4t n THR 65 Cb 0.40 -0.61 0.00 0.00 -1.55 0.00 0.00 70.33 68.58 2k4t n THR 65 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2k4t n GLU 66 N -3.79 0.00 -0.09 1.09 1.02 -1.26 -5.16 120.64 112.46 2k4t n GLU 66 Ca -0.06 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.08 2k4t n GLU 66 Cb 0.48 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.90 2k4t n GLU 66 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2k4t n TYR 67 N -1.58 -0.09 -1.23 -0.32 4.01 -1.26 -4.99 117.16 111.70 2k4t n TYR 67 Ca 0.00 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.54 2k4t n TYR 67 Cb 0.00 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 38.95 2k4t n TYR 67 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2k4t n GLY 68 N 5.00 3.83 3.69 2.72 0.00 -0.28 -4.80 105.19 115.35 2k4t n GLY 68 Ca 0.00 -1.50 -0.40 0.00 0.00 0.00 0.00 46.02 44.11 2k4t n GLY 68 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k4t s LEU 69 N -1.39 4.23 -0.21 0.99 1.02 -1.26 -0.29 118.68 121.77 2k4t s LEU 69 Ca 0.55 1.10 -0.01 0.00 0.02 0.00 0.00 54.13 55.79 2k4t s LEU 69 Cb 0.33 -3.09 0.06 0.00 0.02 0.00 0.00 46.19 43.51 2k4t s LEU 69 CO -0.12 -0.25 -0.01 0.42 0.02 0.00 0.00 176.35 176.41 2k4t s THR 70 N 1.52 1.02 -0.38 5.49 -4.23 0.10 -4.28 115.64 114.89 2k4t s THR 70 Ca 0.36 -0.86 -0.08 0.00 -1.18 0.00 0.00 61.69 59.93 2k4t s THR 70 Cb -0.17 -1.39 0.06 0.00 1.34 0.00 0.00 72.50 72.34 2k4t s THR 70 CO 0.14 -0.13 0.18 -0.36 -0.54 0.00 0.00 174.62 173.91 2k4t s PHE 71 N 1.63 3.31 -0.33 3.99 0.08 -0.49 -1.57 117.98 124.61 2k4t s PHE 71 Ca -0.03 -1.48 -0.04 0.00 0.12 0.00 0.00 56.93 55.50 2k4t s PHE 71 Cb -0.18 -2.61 0.05 0.00 -0.57 0.00 0.00 43.02 39.71 2k4t s PHE 71 CO -0.07 -0.78 0.06 0.99 -0.10 0.00 0.00 175.22 175.32 2k4t s THR 72 N 1.41 3.31 -0.30 0.64 2.01 -0.07 -0.23 115.64 122.41 2k4t s THR 72 Ca 0.01 -1.37 -0.11 0.00 0.31 0.00 0.00 61.69 60.53 2k4t s THR 72 Cb -0.21 -2.93 -0.03 0.00 0.01 0.00 0.00 72.50 69.33 2k4t s THR 72 CO 0.02 -0.20 0.19 -0.70 -0.69 0.00 0.00 174.62 173.24 2k4t s GLU 73 N 1.29 3.73 -0.16 4.92 2.12 -0.60 -1.23 118.70 128.77 2k4t s GLU 73 Ca -0.02 -0.47 -0.05 0.00 0.36 0.00 0.00 54.97 54.79 2k4t s GLU 73 Cb -0.20 -3.65 -0.03 0.00 0.26 0.00 0.00 34.13 30.50 2k4t s GLU 73 CO -0.00 -0.28 0.00 -1.59 -0.54 0.00 0.00 175.26 172.86 2k4t s LYS 74 N 1.72 3.74 -0.13 4.30 -2.85 -0.13 -1.26 119.74 125.13 2k4t s LYS 74 Ca 0.06 -0.44 0.01 0.00 -1.00 0.00 0.00 55.97 54.60 2k4t s LYS 74 Cb -0.16 -3.02 0.02 0.00 -2.06 0.00 0.00 37.83 32.61 2k4t s LYS 74 CO 0.10 0.29 -0.14 -0.46 0.10 0.00 0.00 175.35 175.24 2k4t s TRP 75 N 0.26 2.01 0.00 1.78 -0.11 0.88 -0.68 118.94 123.07 2k4t s TRP 75 Ca -0.00 -1.05 0.04 0.00 1.22 0.00 0.00 56.10 56.31 2k4t s TRP 75 Cb -0.13 -1.48 -0.01 0.00 -1.50 0.00 0.00 33.47 30.34 2k4t s TRP 75 CO 0.02 -0.58 -0.12 1.21 -4.62 0.00 0.00 176.95 172.86 2k4t s ASN 76 N 1.32 1.44 -1.95 5.86 2.47 -0.47 -1.54 114.94 122.08 2k4t s ASN 76 Ca 0.01 -0.27 0.00 0.00 0.42 0.00 0.00 52.86 53.02 2k4t s ASN 76 Cb -0.14 -0.14 0.00 0.00 -1.45 0.00 0.00 41.25 39.52 2k4t s ASN 76 CO -0.07 0.12 0.00 0.41 -3.72 0.00 0.00 177.10 173.84 2k4t n THR 77 N 2.59 -0.07 -2.53 -5.21 -1.04 -1.26 -0.62 114.28 106.15 2k4t n THR 77 Ca -0.15 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.74 2k4t n THR 77 Cb 0.56 -1.84 -0.00 0.00 -1.82 0.00 0.00 70.33 67.22 2k4t n THR 77 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2k4t n ASP 78 N -1.19 -3.72 0.00 8.00 9.92 -1.26 -4.59 116.55 123.71 2k4t n ASP 78 Ca -0.19 0.16 0.00 0.00 -0.53 0.00 0.00 54.79 54.23 2k4t n ASP 78 Cb 0.62 -3.16 0.00 0.00 -0.64 0.00 0.00 41.12 37.94 2k4t n ASP 78 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 2k4t n ASN 79 N -1.83 0.00 -4.61 -2.24 3.02 -0.71 -5.06 115.26 103.83 2k4t n ASN 79 Ca -0.12 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.00 2k4t n ASN 79 Cb 0.60 0.07 -0.02 0.00 -0.61 0.00 0.00 39.78 39.81 2k4t n ASN 79 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2k4t s THR 80 N -1.45 3.97 -0.12 3.41 2.01 0.21 -4.27 115.64 119.40 2k4t s THR 80 Ca 0.00 1.04 -0.01 0.00 0.31 0.00 0.00 61.69 63.02 2k4t s THR 80 Cb 0.00 -4.16 -0.03 0.00 0.01 0.00 0.00 72.50 68.33 2k4t s THR 80 CO 0.00 -0.63 -0.06 -0.76 -0.69 0.00 0.00 174.62 172.48 2k4t s LEU 81 N 5.05 3.17 -0.32 4.42 2.01 -0.54 -1.37 118.68 131.11 2k4t s LEU 81 Ca 0.60 -0.10 -0.02 0.00 0.01 0.00 0.00 54.13 54.63 2k4t s LEU 81 Cb -0.15 -1.73 0.11 0.00 0.01 0.00 0.00 46.19 44.43 2k4t s LEU 81 CO 0.29 0.25 0.13 -0.83 1.01 0.00 0.00 176.35 177.21 2k4t s GLY 82 N -0.15 0.91 -0.38 -3.19 0.00 0.14 -0.15 107.32 104.50 2k4t s GLY 82 Ca 0.02 -1.58 -0.18 0.00 0.00 0.00 0.00 44.72 42.98 2k4t s GLY 82 CO 0.03 1.81 0.52 -0.51 0.00 0.00 0.00 173.10 174.95 2k4t s THR 83 N 1.61 5.00 -0.42 0.90 -4.23 -0.01 -0.95 115.64 117.53 2k4t s THR 83 Ca 0.11 0.14 -0.02 0.00 -1.18 0.00 0.00 61.69 60.74 2k4t s THR 83 Cb -0.18 -4.02 0.11 0.00 1.34 0.00 0.00 72.50 69.75 2k4t s THR 83 CO -0.24 -0.33 0.20 -0.70 -0.54 0.00 0.00 174.62 173.01 2k4t s GLU 84 N 2.41 1.97 -0.24 3.99 2.56 -0.37 -1.17 118.70 127.87 2k4t s GLU 84 Ca 0.18 -1.89 -0.05 0.00 0.00 0.00 0.00 54.97 53.22 2k4t s GLU 84 Cb -0.16 -3.55 -0.01 0.00 2.00 0.00 0.00 34.13 32.42 2k4t s GLU 84 CO 0.14 -1.07 -0.01 0.96 -0.56 0.00 0.00 175.26 174.73 2k4t s ILE 85 N 1.01 3.57 -0.05 -3.70 -4.36 0.22 -0.89 121.20 117.00 2k4t s ILE 85 Ca 0.09 -0.49 0.01 0.00 -0.26 0.00 0.00 60.65 60.00 2k4t s ILE 85 Cb -0.22 -2.67 0.02 0.00 1.25 0.00 0.00 42.46 40.84 2k4t s ILE 85 CO -0.05 0.36 -0.03 0.42 0.24 0.00 0.00 174.94 175.88 2k4t s THR 86 N 1.50 0.48 -0.09 8.37 -4.23 -0.61 -0.39 115.64 120.67 2k4t s THR 86 Ca 0.05 -0.06 0.00 0.00 -1.18 0.00 0.00 61.69 60.51 2k4t s THR 86 Cb -0.15 -0.54 -0.03 0.00 1.34 0.00 0.00 72.50 73.13 2k4t s THR 86 CO -0.02 0.23 -0.08 0.68 -0.54 0.00 0.00 174.62 174.89 2k4t s VAL 87 N 1.14 3.55 0.01 2.29 -7.23 0.25 0.03 120.40 120.44 2k4t s VAL 87 Ca -0.08 -0.52 0.08 0.00 -1.81 0.00 0.00 61.98 59.65 2k4t s VAL 87 Cb -0.14 -2.46 -0.02 0.00 0.56 0.00 0.00 36.38 34.32 2k4t s VAL 87 CO -0.01 0.57 -0.24 -1.61 -0.31 0.00 0.00 175.10 173.51 2k4t s GLU 88 N -0.48 1.77 -1.18 4.82 2.02 0.60 -1.17 118.70 125.08 2k4t s GLU 88 Ca 0.07 -0.92 -0.01 0.00 0.02 0.00 0.00 54.97 54.13 2k4t s GLU 88 Cb -0.12 -1.80 0.00 0.00 0.10 0.00 0.00 34.13 32.31 2k4t s GLU 88 CO 0.02 0.48 0.99 -0.25 0.02 0.00 0.00 175.26 176.53 2k4t n ASP 89 N 2.22 -2.49 0.05 -0.19 8.00 -1.07 -1.12 116.55 121.94 2k4t n ASP 89 Ca -0.16 -0.60 -0.14 0.00 0.71 0.00 0.00 54.79 54.60 2k4t n ASP 89 Cb 0.52 -5.00 -0.14 0.00 -0.02 0.00 0.00 41.12 36.48 2k4t n ASP 89 CO 0.00 0.00 0.00 -0.61 -0.39 0.00 0.00 177.20 176.20 2k4t h GLN 90 N -1.93 0.18 0.00 -1.24 -0.00 -1.86 -3.43 115.11 106.83 2k4t h GLN 90 Ca -0.57 -0.31 0.00 0.00 -0.00 0.00 0.00 58.65 57.76 2k4t h GLN 90 Cb 1.33 0.12 0.00 0.00 0.00 0.00 0.00 27.48 28.93 2k4t h GLN 90 CO 0.49 1.02 -0.08 1.28 0.00 0.00 0.00 178.83 181.54 2k4t n LEU 91 N -3.38 0.88 0.00 -2.39 7.99 -1.26 -5.12 117.00 113.72 2k4t n LEU 91 Ca -0.15 0.16 -0.14 0.00 -0.01 0.00 0.00 56.01 55.88 2k4t n LEU 91 Cb 1.03 -0.23 -0.02 0.00 -0.11 0.00 0.00 43.42 44.09 2k4t n LEU 91 CO 0.49 -0.70 -0.06 0.00 -1.51 0.00 0.00 177.39 175.61 2k4t n ALA 92 N -3.45 0.26 -1.18 -1.18 0.00 -1.26 -5.03 120.51 108.66 2k4t n ALA 92 Ca 0.00 -1.01 -0.29 0.00 0.00 0.00 0.00 53.44 52.14 2k4t n ALA 92 Cb 0.04 0.51 0.09 0.00 0.00 0.00 0.00 19.45 20.09 2k4t n ALA 92 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2k4t n ARG 93 N -0.75 2.42 -0.72 0.00 1.74 -1.26 -4.14 116.66 113.96 2k4t n ARG 93 Ca -0.07 -2.86 -0.04 0.00 -0.77 0.00 0.00 57.85 54.12 2k4t n ARG 93 Cb 0.29 -2.12 -0.04 0.00 -1.02 0.00 0.00 32.46 29.57 2k4t n ARG 93 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2k4t n GLY 94 N -0.69 0.25 2.96 -0.13 0.00 -1.26 -4.90 105.19 101.43 2k4t n GLY 94 Ca 0.55 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.26 2k4t n GLY 94 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2k4t s LEU 95 N 0.00 2.76 -0.26 0.99 2.96 -1.26 -2.85 118.68 121.02 2k4t s LEU 95 Ca 0.00 -1.23 -0.01 0.00 -0.22 0.00 0.00 54.13 52.66 2k4t s LEU 95 Cb 0.00 -1.25 0.04 0.00 0.50 0.00 0.00 46.19 45.47 2k4t s LEU 95 CO 0.00 -0.23 -0.05 -0.54 -1.32 0.00 0.00 176.35 174.21 2k4t s LYS 96 N 1.33 2.67 -0.28 1.98 1.02 -0.17 -2.61 119.74 123.67 2k4t s LYS 96 Ca -0.06 -1.09 -0.10 0.00 0.02 0.00 0.00 55.97 54.73 2k4t s LYS 96 Cb -0.19 -3.04 -0.04 0.00 -0.52 0.00 0.00 37.83 34.04 2k4t s LYS 96 CO -0.06 -0.48 0.17 -1.17 -0.92 0.00 0.00 175.35 172.89 2k4t s LEU 97 N 1.29 3.98 -0.27 3.17 2.96 -0.31 -1.31 118.68 128.19 2k4t s LEU 97 Ca -0.02 -0.14 -0.00 0.00 -0.22 0.00 0.00 54.13 53.74 2k4t s LEU 97 Cb -0.18 -2.08 0.04 0.00 0.50 0.00 0.00 46.19 44.48 2k4t s LEU 97 CO -0.03 -0.08 -0.05 -0.89 -1.32 0.00 0.00 176.35 173.97 2k4t s THR 98 N 1.72 2.72 -0.23 3.68 2.01 0.22 -0.58 115.64 125.17 2k4t s THR 98 Ca 0.07 -1.32 -0.03 0.00 0.31 0.00 0.00 61.69 60.72 2k4t s THR 98 Cb -0.16 -2.50 0.01 0.00 0.01 0.00 0.00 72.50 69.85 2k4t s THR 98 CO 0.09 0.03 -0.05 0.12 -0.69 0.00 0.00 174.62 174.12 2k4t s PHE 99 N 1.24 2.99 -0.10 4.92 2.19 0.48 -0.12 117.98 129.57 2k4t s PHE 99 Ca -0.04 -1.20 0.04 0.00 0.33 0.00 0.00 56.93 56.06 2k4t s PHE 99 Cb -0.19 -2.08 -0.00 0.00 -1.31 0.00 0.00 43.02 39.44 2k4t s PHE 99 CO -0.03 -0.63 -0.24 0.34 1.83 0.00 0.00 175.22 176.48 2k4t s ASP 100 N 1.41 3.10 -0.04 6.13 -1.08 -0.47 -0.61 116.67 125.10 2k4t s ASP 100 Ca 0.04 -0.56 -0.01 0.00 -0.52 0.00 0.00 52.55 51.50 2k4t s ASP 100 Cb -0.15 -1.41 0.03 0.00 -1.46 0.00 0.00 42.92 39.93 2k4t s ASP 100 CO -0.04 0.16 0.02 -0.55 0.52 0.00 0.00 175.17 175.28 2k4t s SER 101 N 0.34 0.81 0.11 -0.34 0.15 -0.31 -1.37 113.70 113.08 2k4t s SER 101 Ca -0.19 0.00 0.07 0.00 0.70 0.00 0.00 55.95 56.53 2k4t s SER 101 Cb -0.18 -0.22 -0.04 0.00 -1.71 0.00 0.00 66.02 63.87 2k4t s SER 101 CO 0.09 -0.17 -0.09 -0.44 1.20 0.00 0.00 173.24 173.84 2k4t s SER 102 N 1.56 4.48 -0.11 5.45 0.01 -0.24 -0.83 113.70 124.01 2k4t s SER 102 Ca -0.02 -0.36 -0.01 0.00 1.31 0.00 0.00 55.95 56.86 2k4t s SER 102 Cb -0.13 -0.88 0.03 0.00 0.21 0.00 0.00 66.02 65.25 2k4t s SER 102 CO -0.03 0.17 -0.03 -0.36 0.41 0.00 0.00 173.24 173.41 2k4t s PHE 103 N -1.25 1.08 -0.40 2.43 0.40 0.79 -1.28 117.98 119.76 2k4t s PHE 103 Ca 0.22 -0.53 0.04 0.00 -0.60 0.00 0.00 56.93 56.06 2k4t s PHE 103 Cb -0.11 -1.02 0.11 0.00 0.51 0.00 0.00 43.02 42.51 2k4t s PHE 103 CO 0.14 -0.45 0.12 -1.12 0.70 0.00 0.00 175.22 174.61 2k4t s SER 104 N 1.84 4.67 0.00 1.36 0.01 -0.32 -1.46 113.70 119.79 2k4t s SER 104 Ca 0.04 -2.40 0.14 0.00 1.31 0.00 0.00 55.95 55.04 2k4t s SER 104 Cb -0.13 -1.64 0.63 0.00 0.21 0.00 0.00 66.02 65.09 2k4t s SER 104 CO -0.07 -0.34 1.45 -0.81 0.41 0.00 0.00 173.24 173.87 2k4t n PRO 105 N 3.94 0.04 -0.01 12.44 -0.04 -1.26 -1.93 135.00 148.17 2k4t n PRO 105 Ca 0.04 0.23 -0.09 0.00 -0.04 0.00 0.00 63.50 63.64 2k4t n PRO 105 Cb 0.39 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.33 2k4t n PRO 105 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 2k4t h ASN 106 N 0.00 -0.63 0.00 3.54 -1.24 -1.92 -3.13 115.58 112.20 2k4t h ASN 106 Ca 0.00 0.11 -0.01 0.00 0.71 0.00 0.00 56.30 57.11 2k4t h ASN 106 Cb 0.22 0.29 -0.02 0.00 0.73 0.00 0.00 38.32 39.54 2k4t h ASN 106 CO 0.00 -0.25 -0.30 0.41 -1.29 0.00 0.00 177.43 176.00 2k4t n THR 107 N -5.34 1.79 -3.41 -3.57 -1.04 -1.23 -5.01 114.28 96.47 2k4t n THR 107 Ca -0.02 -2.45 -0.14 0.00 -2.04 0.00 0.00 64.05 59.39 2k4t n THR 107 Cb 0.26 -0.12 0.01 0.00 -1.82 0.00 0.00 70.33 68.66 2k4t n THR 107 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2k4t n GLY 108 N -1.10 -1.21 3.17 3.41 0.00 -1.12 -5.02 105.19 103.32 2k4t n GLY 108 Ca 0.16 0.52 -0.12 0.00 0.00 0.00 0.00 46.02 46.57 2k4t n GLY 108 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k4t s LYS 109 N -4.23 0.57 0.06 1.61 2.47 -0.81 -5.03 119.74 114.37 2k4t s LYS 109 Ca 0.12 -0.27 0.03 0.00 -1.56 0.00 0.00 55.97 54.28 2k4t s LYS 109 Cb -0.04 0.25 -0.03 0.00 -1.46 0.00 0.00 37.83 36.55 2k4t s LYS 109 CO 0.81 -0.15 -0.09 -1.59 0.16 0.00 0.00 175.35 174.50 2k4t s LYS 110 N -1.31 0.67 -0.05 4.03 0.00 -1.26 -1.17 119.74 120.65 2k4t s LYS 110 Ca -0.14 -0.94 0.05 0.00 0.00 0.00 0.00 55.97 54.94 2k4t s LYS 110 Cb -0.06 -0.39 -0.01 0.00 0.00 0.00 0.00 37.83 37.37 2k4t s LYS 110 CO 0.03 0.06 -0.21 1.21 0.00 0.00 0.00 175.35 176.44 2k4t s ASN 111 N -1.98 2.61 -0.09 0.03 2.47 -0.40 -4.99 114.94 112.59 2k4t s ASN 111 Ca -0.03 -0.43 -0.00 0.00 0.42 0.00 0.00 52.86 52.82 2k4t s ASN 111 Cb -0.06 -0.67 0.02 0.00 -1.45 0.00 0.00 41.25 39.09 2k4t s ASN 111 CO -0.00 0.21 -0.07 0.00 -3.72 0.00 0.00 177.10 173.52 2k4t s ALA 112 N -0.12 1.14 -0.02 1.71 0.00 -1.26 -1.08 121.76 122.14 2k4t s ALA 112 Ca -0.02 -0.40 0.01 0.00 0.00 0.00 0.00 51.96 51.54 2k4t s ALA 112 Cb -0.12 -0.78 0.01 0.00 0.00 0.00 0.00 23.12 22.23 2k4t s ALA 112 CO 0.02 -0.30 -0.01 -1.59 0.00 0.00 0.00 175.76 173.88 2k4t s LYS 113 N 1.50 0.27 -0.16 0.00 -2.85 -0.47 -1.46 119.74 116.57 2k4t s LYS 113 Ca 0.00 -0.01 0.01 0.00 -1.00 0.00 0.00 55.97 54.97 2k4t s LYS 113 Cb -0.13 -0.36 0.02 0.00 -2.06 0.00 0.00 37.83 35.30 2k4t s LYS 113 CO -0.05 -0.04 -0.19 -1.50 0.10 0.00 0.00 175.35 173.68 2k4t s ILE 114 N 0.48 1.90 -0.19 3.79 1.10 -0.52 -1.37 121.20 126.39 2k4t s ILE 114 Ca -0.05 -0.85 -0.03 0.00 -0.51 0.00 0.00 60.65 59.21 2k4t s ILE 114 Cb -0.08 -1.72 -0.01 0.00 0.15 0.00 0.00 42.46 40.80 2k4t s ILE 114 CO -0.01 0.51 -0.06 -0.75 -2.11 0.00 0.00 174.94 172.52 2k4t s LYS 115 N 1.24 3.41 -0.27 3.50 2.20 0.83 -0.60 119.74 130.04 2k4t s LYS 115 Ca 0.02 -0.63 -0.04 0.00 -0.36 0.00 0.00 55.97 54.96 2k4t s LYS 115 Cb -0.13 -2.91 0.02 0.00 -1.51 0.00 0.00 37.83 33.30 2k4t s LYS 115 CO -0.10 -0.06 0.00 0.95 -0.36 0.00 0.00 175.35 175.79 2k4t s THR 116 N 1.10 3.35 -0.09 3.43 -4.23 0.83 -0.61 115.64 119.42 2k4t s THR 116 Ca 0.01 -0.91 0.01 0.00 -1.18 0.00 0.00 61.69 59.62 2k4t s THR 116 Cb -0.15 -2.73 -0.02 0.00 1.34 0.00 0.00 72.50 70.94 2k4t s THR 116 CO -0.01 0.13 -0.10 -0.83 -0.54 0.00 0.00 174.62 173.26 2k4t s GLY 117 N 1.40 1.60 -0.12 3.99 0.00 -0.42 -0.02 107.32 113.75 2k4t s GLY 117 Ca 0.01 -0.90 0.02 0.00 0.00 0.00 0.00 44.72 43.84 2k4t s GLY 117 CO -0.01 -0.46 -0.17 -0.19 0.00 0.00 0.00 173.10 172.26 2k4t s TYR 118 N -0.25 2.19 -0.22 1.90 2.02 0.81 -1.00 117.35 122.78 2k4t s TYR 118 Ca 0.02 -1.04 -0.09 0.00 -0.37 0.00 0.00 57.07 55.59 2k4t s TYR 118 Cb -0.13 -1.54 -0.04 0.00 -0.40 0.00 0.00 41.96 39.85 2k4t s TYR 118 CO 0.03 -0.51 0.12 0.21 -1.57 0.00 0.00 175.55 173.83 2k4t s LYS 119 N 0.90 4.00 0.05 -0.62 2.20 -1.13 -1.16 119.74 123.98 2k4t s LYS 119 Ca -0.07 -0.31 0.00 0.00 -0.36 0.00 0.00 55.97 55.22 2k4t s LYS 119 Cb -0.15 -3.42 0.00 0.00 -1.51 0.00 0.00 37.83 32.75 2k4t s LYS 119 CO -0.01 0.09 0.02 -2.13 -0.36 0.00 0.00 175.35 172.96 2k4t n ARG 120 N 4.15 1.68 -0.01 4.03 3.00 -0.29 -4.59 116.66 124.63 2k4t n ARG 120 Ca -0.16 -0.36 -0.06 0.00 -0.00 0.00 0.00 57.85 57.28 2k4t n ARG 120 Cb 0.52 0.07 -0.04 0.00 0.00 0.00 0.00 32.46 33.01 2k4t n ARG 120 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 2k4t h GLU 121 N 0.00 -0.21 0.00 -0.14 5.08 -2.00 -3.34 114.58 113.96 2k4t h GLU 121 Ca -0.04 0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 58.22 2k4t h GLU 121 Cb 0.13 0.05 -0.25 0.00 0.50 0.00 0.00 28.75 29.17 2k4t h GLU 121 CO 0.06 -0.14 -0.84 0.72 -1.00 0.00 0.00 179.01 177.81 2k4t n HIS 122 N -3.70 0.00 -3.67 4.33 8.25 -1.26 -5.02 115.22 114.15 2k4t n HIS 122 Ca -0.02 -0.78 -0.12 0.00 -0.26 0.00 0.00 57.72 56.54 2k4t n HIS 122 Cb 0.15 -0.17 -0.12 0.00 1.12 0.00 0.00 29.99 30.96 2k4t n HIS 122 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 2k4t s ILE 123 N -0.99 -0.44 -0.14 1.59 1.10 -1.26 -4.56 121.20 116.50 2k4t s ILE 123 Ca 0.34 0.24 0.02 0.00 -0.51 0.00 0.00 60.65 60.73 2k4t s ILE 123 Cb 0.37 -0.51 0.00 0.00 0.15 0.00 0.00 42.46 42.47 2k4t s ILE 123 CO -0.13 0.10 -0.20 0.21 -2.11 0.00 0.00 174.94 172.81 2k4t s ASN 124 N 2.36 3.33 0.11 4.50 3.84 0.10 -1.14 114.94 128.04 2k4t s ASN 124 Ca -0.01 -0.54 0.07 0.00 0.21 0.00 0.00 52.86 52.59 2k4t s ASN 124 Cb -0.12 -1.49 -0.04 0.00 -0.55 0.00 0.00 41.25 39.06 2k4t s ASN 124 CO -0.10 0.09 -0.10 -0.22 -2.79 0.00 0.00 177.10 173.99 2k4t s LEU 125 N 0.74 3.04 -0.39 3.21 2.96 -0.31 -0.09 118.68 127.84 2k4t s LEU 125 Ca -0.08 -0.41 0.01 0.00 -0.22 0.00 0.00 54.13 53.44 2k4t s LEU 125 Cb -0.16 -1.82 0.14 0.00 0.50 0.00 0.00 46.19 44.86 2k4t s LEU 125 CO 0.00 0.17 0.25 -0.83 -1.32 0.00 0.00 176.35 174.62 2k4t s GLY 126 N -2.29 1.18 -0.43 7.98 0.00 0.90 -0.14 107.32 114.53 2k4t s GLY 126 Ca 0.22 -2.21 -0.22 0.00 0.00 0.00 0.00 44.72 42.51 2k4t s GLY 126 CO 0.14 1.93 0.73 0.00 0.00 0.00 0.00 173.10 175.89 2k4t s ASP 128 N 2.03 2.93 -0.02 0.00 2.15 -0.38 -0.12 116.67 123.26 2k4t s ASP 128 Ca 0.27 -0.59 0.00 0.00 0.43 0.00 0.00 52.55 52.67 2k4t s ASP 128 Cb -0.13 -0.25 0.02 0.00 -0.30 0.00 0.00 42.92 42.27 2k4t s ASP 128 CO 0.20 0.21 0.00 0.00 -0.17 0.00 0.00 175.17 175.41 2k4t s MET 129 N -1.34 0.23 0.04 4.34 0.23 0.23 -0.04 119.30 122.99 2k4t s MET 129 Ca 0.10 0.07 0.05 0.00 -1.03 0.00 0.00 55.69 54.88 2k4t s MET 129 Cb -0.10 -0.39 -0.04 0.00 -1.53 0.00 0.00 34.83 32.78 2k4t s MET 129 CO 0.02 -0.11 -0.08 -0.51 -2.03 0.00 0.00 175.02 172.31 2k4t s ASP 130 N 0.85 4.49 -0.38 -1.18 1.11 -0.31 -1.43 116.67 119.82 2k4t s ASP 130 Ca -0.08 -0.24 -0.10 0.00 0.18 0.00 0.00 52.55 52.30 2k4t s ASP 130 Cb -0.11 -0.97 0.03 0.00 1.07 0.00 0.00 42.92 42.94 2k4t s ASP 130 CO -0.02 0.25 0.20 0.12 1.18 0.00 0.00 175.17 176.90 2k4t s PHE 131 N -1.06 3.25 0.53 4.23 5.36 -0.54 -1.30 117.98 128.46 2k4t s PHE 131 Ca 0.18 -1.07 0.03 0.00 -0.96 0.00 0.00 56.93 55.12 2k4t s PHE 131 Cb -0.11 -2.47 0.02 0.00 -0.34 0.00 0.00 43.02 40.11 2k4t s PHE 131 CO 0.10 -0.68 0.19 0.34 -1.46 0.00 0.00 175.22 173.70 2k4t s ASP 132 N 1.59 4.36 -0.06 6.13 2.15 -1.23 -4.31 116.67 125.30 2k4t s ASP 132 Ca 0.02 -1.49 -0.09 0.00 0.43 0.00 0.00 52.55 51.41 2k4t s ASP 132 Cb -0.20 0.55 -0.05 0.00 -0.30 0.00 0.00 42.92 42.92 2k4t s ASP 132 CO 0.06 -1.00 0.38 0.40 -0.17 0.00 0.00 175.17 174.84 2k4t h ILE 133 N 1.05 0.05 -0.83 4.11 5.03 -1.97 -3.28 117.51 121.65 2k4t h ILE 133 Ca -0.41 -0.80 0.24 0.00 -0.12 0.00 0.00 64.86 63.78 2k4t h ILE 133 Cb 1.31 0.08 -0.03 0.00 -3.03 0.00 0.00 36.82 35.15 2k4t h ILE 133 CO 0.66 0.01 0.60 0.00 -0.68 0.00 0.00 178.15 178.75 2k4t h ALA 134 N -1.05 2.78 0.00 1.87 0.00 -2.03 -3.45 119.26 117.38 2k4t h ALA 134 Ca -0.03 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2k4t h ALA 134 Cb 0.26 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2k4t h ALA 134 CO 0.05 -1.03 0.00 0.41 0.00 0.00 0.00 179.25 178.68 2k4t n GLY 135 N -1.70 2.91 3.77 0.00 0.00 -1.24 -4.99 105.19 103.94 2k4t n GLY 135 Ca 0.17 -1.08 -0.36 0.00 0.00 0.00 0.00 46.02 44.75 2k4t n GLY 135 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2k4t s PRO 136 N -2.10 3.60 -0.05 1.61 0.04 -1.26 -3.52 135.00 133.32 2k4t s PRO 136 Ca 0.00 1.70 0.05 0.00 0.04 0.00 0.00 61.00 62.80 2k4t s PRO 136 Cb 0.00 -2.24 -0.01 0.00 0.04 0.00 0.00 34.50 32.29 2k4t s PRO 136 CO 0.00 -0.67 -0.22 -1.12 0.04 0.00 0.00 177.00 175.03 2k4t s SER 137 N -1.53 2.66 -0.34 6.66 0.01 -0.42 -4.10 113.70 116.64 2k4t s SER 137 Ca 0.67 -0.44 -0.05 0.00 1.31 0.00 0.00 55.95 57.44 2k4t s SER 137 Cb -0.27 -0.68 0.05 0.00 0.21 0.00 0.00 66.02 65.33 2k4t s SER 137 CO 0.31 0.21 0.10 -0.63 0.41 0.00 0.00 173.24 173.65 2k4t s ILE 138 N -0.13 3.63 -0.34 1.44 1.09 -0.15 -1.16 121.20 125.58 2k4t s ILE 138 Ca -0.02 -1.26 -0.12 0.00 -1.10 0.00 0.00 60.65 58.15 2k4t s ILE 138 Cb -0.12 -3.10 -0.01 0.00 -1.06 0.00 0.00 42.46 38.17 2k4t s ILE 138 CO 0.03 -0.22 0.23 -0.13 -0.10 0.00 0.00 174.94 174.74 2k4t s ARG 139 N 1.36 3.38 -0.29 2.79 0.52 0.94 -0.09 118.95 127.56 2k4t s ARG 139 Ca -0.01 -0.72 -0.09 0.00 -0.52 0.00 0.00 55.73 54.39 2k4t s ARG 139 Cb -0.20 -3.77 -0.01 0.00 0.52 0.00 0.00 34.95 31.49 2k4t s ARG 139 CO 0.02 -0.48 0.12 0.20 0.02 0.00 0.00 175.30 175.18 2k4t s GLY 140 N 1.69 1.83 -0.11 -3.53 0.00 0.76 -1.24 107.32 106.72 2k4t s GLY 140 Ca 0.05 -1.34 0.02 0.00 0.00 0.00 0.00 44.72 43.45 2k4t s GLY 140 CO 0.09 0.65 -0.17 0.00 0.00 0.00 0.00 173.10 173.68 2k4t s ALA 141 N 1.59 2.49 -0.13 3.20 0.00 -0.45 -0.73 121.76 127.74 2k4t s ALA 141 Ca 0.05 -0.93 -0.02 0.00 0.00 0.00 0.00 51.96 51.05 2k4t s ALA 141 Cb -0.17 -1.05 -0.03 0.00 0.00 0.00 0.00 23.12 21.88 2k4t s ALA 141 CO 0.05 0.32 -0.06 -1.17 0.00 0.00 0.00 175.76 174.90 2k4t s LEU 142 N 0.15 3.15 -0.05 0.00 0.20 0.60 -0.07 118.68 122.66 2k4t s LEU 142 Ca -0.09 -0.13 0.04 0.00 0.69 0.00 0.00 54.13 54.64 2k4t s LEU 142 Cb -0.15 -1.73 0.00 0.00 -0.43 0.00 0.00 46.19 43.87 2k4t s LEU 142 CO 0.05 0.22 -0.16 -0.69 -0.29 0.00 0.00 176.35 175.48 2k4t s VAL 143 N 0.06 1.38 -0.08 1.68 1.01 0.87 -0.10 120.40 125.22 2k4t s VAL 143 Ca -0.01 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.32 2k4t s VAL 143 Cb -0.14 -1.20 0.02 0.00 0.00 0.00 0.00 36.38 35.05 2k4t s VAL 143 CO 0.03 0.40 -0.12 -0.76 0.00 0.00 0.00 175.10 174.66 2k4t s LEU 144 N 0.24 1.57 -0.21 3.92 1.43 0.83 -0.72 118.68 125.74 2k4t s LEU 144 Ca -0.08 -0.31 -0.02 0.00 -1.03 0.00 0.00 54.13 52.68 2k4t s LEU 144 Cb -0.13 -0.86 0.00 0.00 0.03 0.00 0.00 46.19 45.23 2k4t s LEU 144 CO 0.03 0.00 -0.09 -0.83 0.23 0.00 0.00 176.35 175.69 2k4t s GLY 145 N 0.88 1.54 0.20 -3.19 0.00 -1.26 -1.12 107.32 104.37 2k4t s GLY 145 Ca -0.10 -1.18 0.10 0.00 0.00 0.00 0.00 44.72 43.54 2k4t s GLY 145 CO 0.01 0.37 -0.20 -0.19 0.00 0.00 0.00 173.10 173.10 2k4t s TYR 146 N 1.41 2.03 -1.00 1.90 2.02 -0.10 -4.88 117.35 118.73 2k4t s TYR 146 Ca 0.05 -0.42 -0.24 0.00 -0.37 0.00 0.00 57.07 56.09 2k4t s TYR 146 Cb -0.14 -0.98 -0.08 0.00 -0.40 0.00 0.00 41.96 40.36 2k4t s TYR 146 CO -0.06 0.45 1.99 -1.21 -1.57 0.00 0.00 175.55 175.15 2k4t s GLU 147 N -2.96 2.36 0.00 -0.62 2.02 -1.26 -2.93 118.70 115.31 2k4t s GLU 147 Ca 0.20 -0.53 0.00 0.00 0.02 0.00 0.00 54.97 54.66 2k4t s GLU 147 Cb -0.06 -5.09 0.00 0.00 0.10 0.00 0.00 34.13 29.08 2k4t s GLU 147 CO 0.09 -3.81 0.00 0.41 0.02 0.00 0.00 175.26 171.97 2k4t n GLY 148 N 6.45 3.26 3.42 -1.39 0.00 -1.26 -5.08 105.19 110.60 2k4t n GLY 148 Ca 0.42 -1.08 -0.26 0.00 0.00 0.00 0.00 46.02 45.10 2k4t n GLY 148 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2k4t s TRP 149 N 0.00 2.25 -0.00 1.61 -2.14 -1.15 -2.20 118.94 117.31 2k4t s TRP 149 Ca 0.00 -0.37 0.01 0.00 2.66 0.00 0.00 56.10 58.40 2k4t s TRP 149 Cb 0.00 -1.10 -0.00 0.00 -3.10 0.00 0.00 33.47 29.27 2k4t s TRP 149 CO 0.00 0.52 -0.03 -0.51 -2.66 0.00 0.00 176.95 174.27 2k4t s LEU 150 N -2.79 1.99 -0.05 -4.66 1.43 0.96 -0.92 118.68 114.64 2k4t s LEU 150 Ca 0.22 -0.06 0.05 0.00 -1.03 0.00 0.00 54.13 53.31 2k4t s LEU 150 Cb -0.07 -0.16 -0.02 0.00 0.03 0.00 0.00 46.19 45.97 2k4t s LEU 150 CO 0.10 0.04 -0.19 0.00 0.23 0.00 0.00 176.35 176.53 2k4t s ALA 151 N -0.05 2.44 -0.01 4.21 0.00 -0.28 -1.29 121.76 126.78 2k4t s ALA 151 Ca 0.01 -1.02 0.01 0.00 0.00 0.00 0.00 51.96 50.96 2k4t s ALA 151 Cb -0.01 -0.82 0.00 0.00 0.00 0.00 0.00 23.12 22.28 2k4t s ALA 151 CO -0.00 0.50 -0.05 0.20 0.00 0.00 0.00 175.76 176.41 2k4t s GLY 152 N -0.50 0.30 0.01 0.00 0.00 0.07 -0.12 107.32 107.08 2k4t s GLY 152 Ca 0.06 -0.17 0.02 0.00 0.00 0.00 0.00 44.72 44.63 2k4t s GLY 152 CO 0.01 -0.03 -0.06 -0.19 0.00 0.00 0.00 173.10 172.84 2k4t s TYR 153 N 0.14 0.51 -0.04 1.90 1.51 0.86 -0.54 117.35 121.69 2k4t s TYR 153 Ca -0.01 -0.25 0.00 0.00 -1.01 0.00 0.00 57.07 55.80 2k4t s TYR 153 Cb -0.05 -0.32 0.03 0.00 -0.11 0.00 0.00 41.96 41.50 2k4t s TYR 153 CO -0.00 -0.04 -0.00 -0.65 -1.11 0.00 0.00 175.55 173.74 2k4t s GLN 154 N -0.70 0.38 0.01 -0.62 1.11 0.87 -0.29 119.66 120.42 2k4t s GLN 154 Ca -0.03 0.07 -0.01 0.00 0.01 0.00 0.00 55.36 55.41 2k4t s GLN 154 Cb -0.05 -0.58 -0.02 0.00 -1.01 0.00 0.00 33.01 31.35 2k4t s GLN 154 CO 0.00 -0.16 -0.01 -1.64 0.01 0.00 0.00 175.29 173.49 2k4t s MET 155 N 1.18 0.28 -0.13 2.91 -1.94 0.09 -1.35 119.30 120.34 2k4t s MET 155 Ca -0.08 -0.50 -0.00 0.00 -1.71 0.00 0.00 55.69 53.41 2k4t s MET 155 Cb -0.13 0.10 0.02 0.00 2.01 0.00 0.00 34.83 36.83 2k4t s MET 155 CO -0.02 -0.05 -0.10 1.21 -0.01 0.00 0.00 175.02 176.05 2k4t s ASN 156 N -1.22 2.40 -0.07 3.03 3.84 -1.25 -0.17 114.94 121.49 2k4t s ASN 156 Ca -0.13 -0.38 0.04 0.00 0.21 0.00 0.00 52.86 52.59 2k4t s ASN 156 Cb -0.08 -0.99 -0.02 0.00 -0.55 0.00 0.00 41.25 39.61 2k4t s ASN 156 CO -0.01 -0.09 -0.17 0.12 -2.79 0.00 0.00 177.10 174.16 2k4t s PHE 157 N 1.61 2.64 -0.18 0.43 5.36 0.87 -3.05 117.98 125.66 2k4t s PHE 157 Ca 0.05 -0.41 -0.03 0.00 -0.96 0.00 0.00 56.93 55.58 2k4t s PHE 157 Cb -0.13 -1.66 -0.02 0.00 -0.34 0.00 0.00 43.02 40.88 2k4t s PHE 157 CO -0.09 -0.00 -0.05 -2.00 -1.46 0.00 0.00 175.22 171.61 2k4t s GLU 158 N -0.37 3.51 0.18 10.12 2.12 -1.26 -0.98 118.70 132.02 2k4t s GLU 158 Ca 0.03 -0.59 0.15 0.00 0.36 0.00 0.00 54.97 54.93 2k4t s GLU 158 Cb -0.12 -2.92 -0.04 0.00 0.26 0.00 0.00 34.13 31.31 2k4t s GLU 158 CO 0.02 0.05 1.18 0.00 -0.54 0.00 0.00 175.26 175.97 2k4t h THR 159 N 5.43 0.78 0.06 -1.70 1.03 -1.95 0.25 112.91 116.80 2k4t h THR 159 Ca -0.34 -2.22 -0.28 0.00 -0.01 0.00 0.00 66.41 63.56 2k4t h THR 159 Cb 1.18 2.30 0.03 0.00 -1.07 0.00 0.00 68.15 70.59 2k4t h THR 159 CO 0.60 0.44 -1.14 0.00 -0.01 0.00 0.00 175.52 175.41 2k4t h ALA 160 N 1.43 0.06 0.00 0.00 0.00 -1.94 -3.33 119.26 115.48 2k4t h ALA 160 Ca -0.07 -0.73 -0.19 0.00 0.00 0.00 0.00 54.91 53.92 2k4t h ALA 160 Cb 1.49 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 19.33 2k4t h ALA 160 CO 0.06 0.69 -1.88 1.17 0.00 0.00 0.00 179.25 179.28 2k4t n LYS 161 N -3.83 0.65 -3.01 0.00 3.00 -1.25 -5.03 118.16 108.69 2k4t n LYS 161 Ca -0.12 0.04 -0.07 0.00 -0.00 0.00 0.00 58.31 58.16 2k4t n LYS 161 Cb 0.93 -1.64 0.03 0.00 0.00 0.00 0.00 35.03 34.35 2k4t n LYS 161 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2k4t n SER 162 N -2.68 -6.81 -3.16 3.14 2.88 0.86 -5.04 113.62 102.81 2k4t n SER 162 Ca -0.16 -0.35 0.04 0.00 -1.33 0.00 0.00 58.87 57.07 2k4t n SER 162 Cb 0.87 -4.89 -0.04 0.00 -0.75 0.00 0.00 64.21 59.41 2k4t n SER 162 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2k4t s ARG 163 N -3.62 0.01 -0.01 -1.46 1.70 -1.19 -5.01 118.95 109.38 2k4t s ARG 163 Ca 0.20 0.02 -0.30 0.00 -0.47 0.00 0.00 55.73 55.19 2k4t s ARG 163 Cb -0.03 0.01 -0.05 0.00 -0.57 0.00 0.00 34.95 34.31 2k4t s ARG 163 CO 0.68 -0.00 1.43 0.08 -1.08 0.00 0.00 175.30 176.41 2k4t s VAL 164 N 2.12 3.70 0.00 4.99 1.01 -1.26 -4.09 120.40 126.87 2k4t s VAL 164 Ca -0.00 1.05 0.00 0.00 0.00 0.00 0.00 61.98 63.03 2k4t s VAL 164 Cb -0.01 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.69 2k4t s VAL 164 CO -0.15 -0.02 0.79 0.41 0.00 0.00 0.00 175.10 176.13 2k4t n THR 165 N 4.80 0.00 -3.77 3.92 -1.04 -1.17 -4.94 114.28 112.08 2k4t n THR 165 Ca 0.14 1.29 -0.10 0.00 -2.04 0.00 0.00 64.05 63.34 2k4t n THR 165 Cb 0.43 -2.23 -0.06 0.00 -1.82 0.00 0.00 70.33 66.65 2k4t n THR 165 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 2k4t s GLN 166 N -2.17 0.92 -0.06 -2.82 -0.21 -1.26 -5.10 119.66 108.97 2k4t s GLN 166 Ca 0.00 -0.81 0.04 0.00 0.02 0.00 0.00 55.36 54.61 2k4t s GLN 166 Cb 0.00 0.39 -0.00 0.00 1.00 0.00 0.00 33.01 34.40 2k4t s GLN 166 CO 0.00 -0.32 -0.19 -1.54 -2.12 0.00 0.00 175.29 171.13 2k4t s SER 167 N -2.74 2.36 0.11 5.90 1.04 -1.26 -3.93 113.70 115.18 2k4t s SER 167 Ca 0.03 -0.40 0.06 0.00 0.48 0.00 0.00 55.95 56.12 2k4t s SER 167 Cb 0.03 -0.77 -0.04 0.00 0.10 0.00 0.00 66.02 65.34 2k4t s SER 167 CO -0.10 0.15 -0.14 0.20 0.98 0.00 0.00 173.24 174.33 2k4t s ASN 168 N 0.13 1.93 -0.15 7.02 0.02 -0.46 -1.37 114.94 122.07 2k4t s ASN 168 Ca -0.07 -0.77 -0.11 0.00 -1.02 0.00 0.00 52.86 50.88 2k4t s ASN 168 Cb -0.13 -0.06 0.05 0.00 0.02 0.00 0.00 41.25 41.12 2k4t s ASN 168 CO 0.04 -0.13 0.39 0.72 0.02 0.00 0.00 177.10 178.13 2k4t s PHE 169 N -1.95 -0.48 0.20 2.20 -0.12 -0.25 -0.09 117.98 117.48 2k4t s PHE 169 Ca 0.07 1.11 0.10 0.00 -0.05 0.00 0.00 56.93 58.15 2k4t s PHE 169 Cb -0.06 0.18 -0.04 0.00 -0.63 0.00 0.00 43.02 42.47 2k4t s PHE 169 CO 0.03 -0.26 -0.19 0.00 -0.05 0.00 0.00 175.22 174.75 2k4t s ALA 170 N 0.70 2.24 -0.04 1.99 0.00 0.30 -0.09 121.76 126.85 2k4t s ALA 170 Ca -0.04 -1.61 0.01 0.00 0.00 0.00 0.00 51.96 50.32 2k4t s ALA 170 Cb -0.05 -0.21 0.02 0.00 0.00 0.00 0.00 23.12 22.88 2k4t s ALA 170 CO -0.05 0.25 -0.06 0.08 0.00 0.00 0.00 175.76 175.99 2k4t s VAL 171 N -2.20 0.63 -0.13 0.00 1.01 -0.04 -0.76 120.40 118.91 2k4t s VAL 171 Ca 0.20 -0.19 -0.01 0.00 0.00 0.00 0.00 61.98 61.99 2k4t s VAL 171 Cb -0.05 -0.63 0.03 0.00 0.00 0.00 0.00 36.38 35.73 2k4t s VAL 171 CO 0.09 0.24 -0.05 -0.83 0.00 0.00 0.00 175.10 174.55 2k4t s GLY 172 N 0.81 0.79 -0.04 4.51 0.00 -0.41 -0.22 107.32 112.77 2k4t s GLY 172 Ca -0.12 -0.57 -0.06 0.00 0.00 0.00 0.00 44.72 43.97 2k4t s GLY 172 CO 0.01 0.96 0.15 -2.52 0.00 0.00 0.00 173.10 171.70 2k4t s TYR 173 N 1.75 -0.09 -0.19 1.90 -0.85 -0.05 -0.02 117.35 119.78 2k4t s TYR 173 Ca 0.03 0.22 0.01 0.00 -0.52 0.00 0.00 57.07 56.81 2k4t s TYR 173 Cb -0.14 0.02 0.02 0.00 0.38 0.00 0.00 41.96 42.24 2k4t s TYR 173 CO -0.07 -0.15 -0.17 -1.59 -1.52 0.00 0.00 175.55 172.05 2k4t s LYS 174 N -0.42 2.95 0.03 -3.49 -2.85 -0.93 -0.37 119.74 114.66 2k4t s LYS 174 Ca -0.05 -0.86 -0.01 0.00 -1.00 0.00 0.00 55.97 54.05 2k4t s LYS 174 Cb -0.03 -2.66 -0.02 0.00 -2.06 0.00 0.00 37.83 33.05 2k4t s LYS 174 CO 0.01 -0.25 -0.02 -0.08 0.10 0.00 0.00 175.35 175.11 2k4t s THR 175 N 1.29 0.13 -1.30 3.79 -1.32 -0.52 -4.86 115.64 112.86 2k4t s THR 175 Ca 0.04 -1.10 -0.05 0.00 -1.21 0.00 0.00 61.69 59.36 2k4t s THR 175 Cb -0.14 -0.57 0.01 0.00 -1.51 0.00 0.00 72.50 70.29 2k4t s THR 175 CO -0.11 -0.61 1.10 -0.67 -2.21 0.00 0.00 174.62 172.12 2k4t n ASP 176 N 1.24 -4.50 -2.09 8.08 -0.08 -1.26 -1.40 116.55 116.53 2k4t n ASP 176 Ca -0.22 -0.59 -0.17 0.00 -1.51 0.00 0.00 54.79 52.30 2k4t n ASP 176 Cb 0.56 -5.01 -0.03 0.00 2.34 0.00 0.00 41.12 38.98 2k4t n ASP 176 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 2k4t n GLU 177 N -4.64 -1.72 -4.34 -0.67 4.71 -1.26 -4.95 120.64 107.77 2k4t n GLU 177 Ca -0.11 0.91 -0.20 0.00 -0.01 0.00 0.00 57.16 57.74 2k4t n GLU 177 Cb 0.60 -5.43 -0.10 0.00 -1.01 0.00 0.00 31.44 25.50 2k4t n GLU 177 CO 0.00 0.00 0.00 -0.06 0.09 0.00 0.00 177.13 177.16 2k4t s PHE 178 N -2.72 1.76 -0.22 -0.32 0.08 -0.50 -4.46 117.98 111.60 2k4t s PHE 178 Ca 0.00 -0.52 -0.01 0.00 0.12 0.00 0.00 56.93 56.52 2k4t s PHE 178 Cb 0.00 -0.84 0.02 0.00 -0.57 0.00 0.00 43.02 41.62 2k4t s PHE 178 CO 0.00 0.36 -0.10 -0.65 -0.10 0.00 0.00 175.22 174.73 2k4t s GLN 179 N -3.28 3.02 -0.18 0.44 -0.21 0.18 -1.43 119.66 118.19 2k4t s GLN 179 Ca 0.20 -0.84 -0.04 0.00 0.02 0.00 0.00 55.36 54.70 2k4t s GLN 179 Cb -0.03 -2.86 -0.02 0.00 1.00 0.00 0.00 33.01 31.10 2k4t s GLN 179 CO 0.07 -0.29 -0.04 -1.17 -2.12 0.00 0.00 175.29 171.74 2k4t s LEU 180 N 1.35 3.10 -0.13 2.90 1.98 0.51 -1.03 118.68 127.35 2k4t s LEU 180 Ca 0.03 -0.23 -0.02 0.00 -2.89 0.00 0.00 54.13 51.02 2k4t s LEU 180 Cb -0.15 -1.76 0.04 0.00 0.66 0.00 0.00 46.19 44.98 2k4t s LEU 180 CO -0.07 0.10 0.02 -1.00 -1.89 0.00 0.00 176.35 173.51 2k4t s HIS 181 N 0.78 0.83 0.17 5.38 3.76 -0.15 -0.87 115.29 125.19 2k4t s HIS 181 Ca -0.02 -0.48 0.11 0.00 -0.15 0.00 0.00 55.06 54.52 2k4t s HIS 181 Cb -0.15 -0.91 -0.04 0.00 1.11 0.00 0.00 32.58 32.59 2k4t s HIS 181 CO 0.02 -0.46 -0.24 0.99 -0.85 0.00 0.00 174.74 174.20 2k4t s THR 182 N 1.92 2.25 -0.06 1.30 2.01 0.69 -0.13 115.64 123.62 2k4t s THR 182 Ca 0.02 -1.93 -0.03 0.00 0.31 0.00 0.00 61.69 60.06 2k4t s THR 182 Cb -0.14 -2.04 0.04 0.00 0.01 0.00 0.00 72.50 70.36 2k4t s THR 182 CO -0.07 -0.08 0.14 0.54 -0.69 0.00 0.00 174.62 174.46 2k4t s ASN 183 N -2.49 0.08 -0.11 3.53 2.20 0.52 -0.86 114.94 117.81 2k4t s ASN 183 Ca 0.18 0.28 0.01 0.00 -0.94 0.00 0.00 52.86 52.39 2k4t s ASN 183 Cb -0.08 0.18 -0.01 0.00 -2.00 0.00 0.00 41.25 39.33 2k4t s ASN 183 CO 0.08 -0.17 -0.15 -0.69 -2.94 0.00 0.00 177.10 173.23 2k4t s VAL 184 N 1.39 2.87 -0.44 3.54 1.01 0.87 -0.79 120.40 128.84 2k4t s VAL 184 Ca -0.07 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.20 2k4t s VAL 184 Cb -0.12 -2.17 0.12 0.00 0.00 0.00 0.00 36.38 34.21 2k4t s VAL 184 CO -0.06 0.54 0.18 0.20 0.00 0.00 0.00 175.10 175.96 2k4t s ASN 185 N 0.15 4.68 -1.72 3.32 0.02 -1.18 -1.08 114.94 119.12 2k4t s ASN 185 Ca -0.08 -2.53 0.00 0.00 -1.02 0.00 0.00 52.86 49.23 2k4t s ASN 185 Cb -0.15 -1.67 0.00 0.00 0.02 0.00 0.00 41.25 39.45 2k4t s ASN 185 CO 0.05 -0.34 0.00 -0.67 0.02 0.00 0.00 177.10 176.16 2k4t n ASP 186 N 3.78 -5.16 -1.27 -1.22 2.03 -0.47 -1.80 116.55 112.44 2k4t n ASP 186 Ca 0.04 0.23 -0.17 0.00 0.52 0.00 0.00 54.79 55.42 2k4t n ASP 186 Cb 0.38 -4.23 -0.07 0.00 -0.72 0.00 0.00 41.12 36.48 2k4t n ASP 186 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2k4t n GLY 187 N -0.90 1.57 0.05 0.27 0.00 -1.26 -4.84 105.19 100.08 2k4t n GLY 187 Ca -0.19 -0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.79 2k4t n GLY 187 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2k4t n THR 188 N -2.31 0.83 -3.68 2.61 -1.04 -0.74 -4.91 114.28 105.04 2k4t n THR 188 Ca -0.17 0.32 -0.39 0.00 -2.04 0.00 0.00 64.05 61.78 2k4t n THR 188 Cb 0.65 -1.99 -0.12 0.00 -1.82 0.00 0.00 70.33 67.05 2k4t n THR 188 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 2k4t s GLU 189 N -1.92 3.12 -0.20 -2.82 2.56 -1.24 -2.26 118.70 115.94 2k4t s GLU 189 Ca -0.13 -0.86 -0.15 0.00 0.00 0.00 0.00 54.97 53.83 2k4t s GLU 189 Cb 0.02 -3.54 -0.04 0.00 2.00 0.00 0.00 34.13 32.57 2k4t s GLU 189 CO 0.19 -0.50 0.36 -0.06 -0.56 0.00 0.00 175.26 174.70 2k4t s PHE 190 N 1.55 3.39 -0.08 5.30 0.40 0.02 -3.12 117.98 125.44 2k4t s PHE 190 Ca 0.03 0.59 0.03 0.00 -0.60 0.00 0.00 56.93 56.97 2k4t s PHE 190 Cb -0.18 -2.47 -0.02 0.00 0.51 0.00 0.00 43.02 40.86 2k4t s PHE 190 CO 0.05 0.04 -0.16 0.20 0.70 0.00 0.00 175.22 176.05 2k4t s GLY 191 N 0.94 1.48 0.02 4.36 0.00 0.03 0.05 107.32 114.19 2k4t s GLY 191 Ca 0.18 -0.96 0.03 0.00 0.00 0.00 0.00 44.72 43.97 2k4t s GLY 191 CO 0.07 -0.52 -0.10 -0.32 0.00 0.00 0.00 173.10 172.23 2k4t s GLY 192 N -0.19 0.56 -0.05 0.20 0.00 -0.45 -0.35 107.32 107.03 2k4t s GLY 192 Ca -0.01 -0.59 -0.03 0.00 0.00 0.00 0.00 44.72 44.09 2k4t s GLY 192 CO 0.03 -0.56 0.12 -1.35 0.00 0.00 0.00 173.10 171.34 2k4t s SER 193 N -0.76 -0.10 -0.00 1.64 1.04 0.81 -0.19 113.70 116.14 2k4t s SER 193 Ca 0.00 0.25 0.07 0.00 0.48 0.00 0.00 55.95 56.75 2k4t s SER 193 Cb -0.06 0.19 -0.02 0.00 0.10 0.00 0.00 66.02 66.23 2k4t s SER 193 CO 0.00 -0.09 -0.23 -0.63 0.98 0.00 0.00 173.24 173.27 2k4t s ILE 194 N 0.60 1.82 -0.10 -1.02 1.09 0.22 -0.98 121.20 122.84 2k4t s ILE 194 Ca -0.04 -1.06 -0.02 0.00 -1.10 0.00 0.00 60.65 58.43 2k4t s ILE 194 Cb -0.06 -1.53 0.03 0.00 -1.06 0.00 0.00 42.46 39.84 2k4t s ILE 194 CO -0.03 0.45 0.01 -0.47 -0.10 0.00 0.00 174.94 174.80 2k4t s TYR 195 N -0.61 0.78 -0.05 3.97 5.04 -0.20 -1.43 117.35 124.85 2k4t s TYR 195 Ca 0.09 -0.34 0.03 0.00 -2.44 0.00 0.00 57.07 54.41 2k4t s TYR 195 Cb -0.09 -0.87 0.01 0.00 0.35 0.00 0.00 41.96 41.36 2k4t s TYR 195 CO -0.00 -0.40 -0.13 1.14 -1.34 0.00 0.00 175.55 174.82 2k4t s GLN 196 N 1.94 1.53 -0.49 4.97 -2.07 -0.22 -0.64 119.66 124.67 2k4t s GLN 196 Ca 0.04 -0.43 -0.08 0.00 -1.82 0.00 0.00 55.36 53.07 2k4t s GLN 196 Cb -0.13 -1.31 0.13 0.00 -1.09 0.00 0.00 33.01 30.60 2k4t s GLN 196 CO -0.06 0.10 0.35 0.21 -1.32 0.00 0.00 175.29 174.57 2k4t s LYS 197 N 0.39 2.46 0.64 9.60 2.20 -1.26 -0.94 119.74 132.82 2k4t s LYS 197 Ca -0.09 -1.88 -0.18 0.00 -0.36 0.00 0.00 55.97 53.45 2k4t s LYS 197 Cb -0.13 -3.87 -0.02 0.00 -1.51 0.00 0.00 37.83 32.30 2k4t s LYS 197 CO 0.02 -1.18 1.28 0.08 -0.36 0.00 0.00 175.35 175.19 2k4t s VAL 198 N 1.13 2.15 0.31 4.02 1.01 -1.25 -4.89 120.40 122.89 2k4t s VAL 198 Ca 0.08 0.10 0.07 0.00 0.00 0.00 0.00 61.98 62.22 2k4t s VAL 198 Cb -0.24 -3.03 0.31 0.00 0.00 0.00 0.00 36.38 33.41 2k4t s VAL 198 CO -0.02 -0.02 1.80 0.78 0.00 0.00 0.00 175.10 177.63 2k4t h ASN 199 N 0.61 0.76 -2.85 3.32 2.35 -1.98 -3.41 115.58 114.38 2k4t h ASN 199 Ca -0.51 0.08 -0.46 0.00 -0.55 0.00 0.00 56.30 54.86 2k4t h ASN 199 Cb 1.33 -0.06 0.23 0.00 0.05 0.00 0.00 38.32 39.87 2k4t h ASN 199 CO 0.53 0.30 -0.61 1.17 -1.65 0.00 0.00 177.43 177.17 2k4t n LYS 200 N -4.71 -1.64 -1.64 0.81 3.00 -1.26 -4.77 118.16 107.94 2k4t n LYS 200 Ca 0.22 -0.45 -0.41 0.00 -0.00 0.00 0.00 58.31 57.67 2k4t n LYS 200 Cb 0.56 -1.90 -0.03 0.00 0.00 0.00 0.00 35.03 33.65 2k4t n LYS 200 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2k4t n LYS 201 N -3.04 2.20 -4.02 1.64 4.01 -1.26 -4.77 118.16 112.92 2k4t n LYS 201 Ca 0.03 -2.36 0.04 0.00 -0.51 0.00 0.00 58.31 55.51 2k4t n LYS 201 Cb 0.58 -3.22 0.01 0.00 -0.51 0.00 0.00 35.03 31.89 2k4t n LYS 201 CO 0.00 0.00 0.00 -0.48 -1.11 0.00 0.00 177.40 175.81 2k4t s LEU 202 N 3.09 0.00 -0.06 -0.35 0.05 -1.26 -3.71 118.68 116.45 2k4t s LEU 202 Ca 0.55 -0.05 -0.06 0.00 0.05 0.00 0.00 54.13 54.62 2k4t s LEU 202 Cb 0.11 1.07 0.01 0.00 -2.05 0.00 0.00 46.19 45.34 2k4t s LEU 202 CO 0.04 -0.07 0.16 -1.61 -0.55 0.00 0.00 176.35 174.32 2k4t s GLU 203 N -2.01 0.20 -0.11 1.48 2.02 0.86 -3.90 118.70 117.25 2k4t s GLU 203 Ca 0.31 0.18 0.03 0.00 0.02 0.00 0.00 54.97 55.52 2k4t s GLU 203 Cb 0.00 0.10 -0.00 0.00 0.10 0.00 0.00 34.13 34.33 2k4t s GLU 203 CO -0.03 -0.03 -0.22 0.99 0.02 0.00 0.00 175.26 176.00 2k4t s THR 204 N -0.01 2.26 0.06 3.63 2.01 -0.11 -0.87 115.64 122.61 2k4t s THR 204 Ca -0.01 -0.94 0.02 0.00 0.31 0.00 0.00 61.69 61.07 2k4t s THR 204 Cb -0.02 -1.88 -0.03 0.00 0.01 0.00 0.00 72.50 70.58 2k4t s THR 204 CO 0.00 0.55 -0.08 0.00 -0.69 0.00 0.00 174.62 174.41 2k4t s ALA 205 N 0.37 0.71 -0.04 7.40 0.00 -0.34 -1.06 121.76 128.81 2k4t s ALA 205 Ca -0.17 -0.95 -0.07 0.00 0.00 0.00 0.00 51.96 50.77 2k4t s ALA 205 Cb -0.17 0.08 0.01 0.00 0.00 0.00 0.00 23.12 23.03 2k4t s ALA 205 CO 0.08 -0.08 0.17 0.54 0.00 0.00 0.00 175.76 176.47 2k4t s VAL 206 N -2.07 0.03 0.00 0.00 0.11 -0.51 -0.09 120.40 117.87 2k4t s VAL 206 Ca -0.03 -0.28 0.06 0.00 -2.93 0.00 0.00 61.98 58.80 2k4t s VAL 206 Cb -0.05 -0.35 -0.02 0.00 -1.53 0.00 0.00 36.38 34.43 2k4t s VAL 206 CO -0.01 -0.16 -0.20 0.54 -3.33 0.00 0.00 175.10 171.94 2k4t s ASN 207 N -0.53 2.37 0.09 3.54 2.20 -0.48 -0.61 114.94 121.52 2k4t s ASN 207 Ca -0.06 -0.41 0.04 0.00 -0.94 0.00 0.00 52.86 51.49 2k4t s ASN 207 Cb -0.04 -0.24 -0.03 0.00 -2.00 0.00 0.00 41.25 38.93 2k4t s ASN 207 CO 0.01 0.22 -0.11 -1.48 -2.94 0.00 0.00 177.10 172.80 2k4t s LEU 208 N -0.68 2.37 0.01 3.54 2.34 0.73 -1.35 118.68 125.65 2k4t s LEU 208 Ca 0.08 -0.76 0.01 0.00 0.06 0.00 0.00 54.13 53.51 2k4t s LEU 208 Cb -0.08 -0.34 -0.01 0.00 -0.56 0.00 0.00 46.19 45.20 2k4t s LEU 208 CO -0.00 -0.22 -0.03 0.00 -1.06 0.00 0.00 176.35 175.04 2k4t s ALA 209 N -2.16 0.19 -0.17 1.48 0.00 0.94 -1.34 121.76 120.70 2k4t s ALA 209 Ca 0.03 -0.25 -0.00 0.00 0.00 0.00 0.00 51.96 51.74 2k4t s ALA 209 Cb -0.05 0.01 0.04 0.00 0.00 0.00 0.00 23.12 23.12 2k4t s ALA 209 CO 0.01 -0.01 -0.06 -0.46 0.00 0.00 0.00 175.76 175.24 2k4t s TRP 210 N -0.46 1.81 -0.30 0.00 -0.11 0.11 -1.51 118.94 118.47 2k4t s TRP 210 Ca -0.04 -1.15 -0.12 0.00 1.22 0.00 0.00 56.10 56.01 2k4t s TRP 210 Cb -0.04 -1.36 -0.04 0.00 -1.50 0.00 0.00 33.47 30.53 2k4t s TRP 210 CO -0.00 -0.63 0.21 0.95 -4.62 0.00 0.00 176.95 172.86 2k4t s THR 211 N 1.60 5.30 -0.59 5.86 -4.23 -1.26 -0.80 115.64 121.52 2k4t s THR 211 Ca 0.01 0.04 -0.28 0.00 -1.18 0.00 0.00 61.69 60.27 2k4t s THR 211 Cb -0.15 -3.60 -0.11 0.00 1.34 0.00 0.00 72.50 69.97 2k4t s THR 211 CO -0.08 0.15 2.45 0.00 -0.54 0.00 0.00 174.62 176.61 2k4t n ALA 212 N 5.09 0.75 0.00 3.99 0.00 -0.96 -3.94 120.51 125.43 2k4t n ALA 212 Ca -0.13 -0.65 0.00 0.00 0.00 0.00 0.00 53.44 52.66 2k4t n ALA 212 Cb 0.51 -2.90 0.00 0.00 0.00 0.00 0.00 19.45 17.06 2k4t n ALA 212 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k4t n GLY 213 N 6.18 0.00 3.64 0.00 0.00 -1.26 -4.97 105.19 108.78 2k4t n GLY 213 Ca 0.44 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.25 2k4t n GLY 213 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2k4t n ASN 214 N 0.00 -1.67 -4.90 1.61 3.02 -1.26 -5.00 115.26 107.06 2k4t n ASN 214 Ca 0.00 -0.79 -0.26 0.00 -0.03 0.00 0.00 54.58 53.50 2k4t n ASN 214 Cb 0.00 -4.25 -0.01 0.00 -0.61 0.00 0.00 39.78 34.91 2k4t n ASN 214 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2k4t s SER 215 N -4.29 4.64 0.00 6.41 0.01 -1.25 -5.13 113.70 114.08 2k4t s SER 215 Ca 0.04 -1.23 -0.02 0.00 1.31 0.00 0.00 55.95 56.05 2k4t s SER 215 Cb -0.01 0.36 -0.04 0.00 0.21 0.00 0.00 66.02 66.54 2k4t s SER 215 CO 0.80 -1.08 0.18 0.20 0.41 0.00 0.00 173.24 173.75 2k4t s ASN 216 N -4.27 6.34 -0.33 2.44 0.01 -1.26 -4.90 114.94 112.97 2k4t s ASN 216 Ca 0.35 0.33 -0.25 0.00 -0.71 0.00 0.00 52.86 52.57 2k4t s ASN 216 Cb -0.02 -1.98 0.01 0.00 0.41 0.00 0.00 41.25 39.67 2k4t s ASN 216 CO 0.21 0.25 0.90 -0.89 -1.51 0.00 0.00 177.10 176.06 2k4t s THR 217 N -1.35 4.67 -0.10 1.60 2.01 -1.26 -4.68 115.64 116.53 2k4t s THR 217 Ca 0.28 1.32 -0.33 0.00 0.31 0.00 0.00 61.69 63.27 2k4t s THR 217 Cb -0.13 -4.27 0.15 0.00 0.01 0.00 0.00 72.50 68.27 2k4t s THR 217 CO 0.20 -0.39 1.44 -0.60 -0.69 0.00 0.00 174.62 174.58 2k4t s ARG 218 N 3.27 0.03 0.11 4.92 3.52 -0.57 -4.78 118.95 125.46 2k4t s ARG 218 Ca 0.37 -0.02 0.00 0.00 -0.13 0.00 0.00 55.73 55.95 2k4t s ARG 218 Cb -0.13 0.01 0.00 0.00 -1.56 0.00 0.00 34.95 33.27 2k4t s ARG 218 CO 0.15 -0.01 0.00 0.34 -0.81 0.00 0.00 175.30 174.96 2k4t n PHE 219 N -0.49 -2.77 -3.94 5.12 -0.00 -1.10 -0.04 117.46 114.24 2k4t n PHE 219 Ca -0.10 0.39 0.01 0.00 -0.00 0.00 0.00 57.45 57.76 2k4t n PHE 219 Cb 0.64 1.30 0.01 0.00 -0.00 0.00 0.00 39.48 41.42 2k4t n PHE 219 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2k4t n GLY 220 N -1.48 0.41 3.17 7.13 0.00 -0.46 -0.07 105.19 113.90 2k4t n GLY 220 Ca 0.00 -0.93 -0.15 0.00 0.00 0.00 0.00 46.02 44.94 2k4t n GLY 220 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2k4t s ILE 221 N -2.08 0.97 -0.06 -0.61 1.09 0.11 -1.38 121.20 119.24 2k4t s ILE 221 Ca 0.15 -1.57 0.02 0.00 -1.10 0.00 0.00 60.65 58.15 2k4t s ILE 221 Cb -0.00 -1.29 0.01 0.00 -1.06 0.00 0.00 42.46 40.12 2k4t s ILE 221 CO -0.00 -0.49 -0.11 0.00 -0.10 0.00 0.00 174.94 174.24 2k4t s ALA 222 N -2.20 1.13 -0.09 9.38 0.00 0.87 -1.56 121.76 129.29 2k4t s ALA 222 Ca 0.04 -0.34 0.04 0.00 0.00 0.00 0.00 51.96 51.70 2k4t s ALA 222 Cb -0.04 -0.53 -0.00 0.00 0.00 0.00 0.00 23.12 22.55 2k4t s ALA 222 CO 0.01 0.10 -0.24 0.00 0.00 0.00 0.00 175.76 175.62 2k4t s ALA 223 N 0.68 2.15 -0.20 0.00 0.00 -0.45 -1.19 121.76 122.75 2k4t s ALA 223 Ca -0.14 -0.98 0.01 0.00 0.00 0.00 0.00 51.96 50.86 2k4t s ALA 223 Cb -0.15 -0.78 0.04 0.00 0.00 0.00 0.00 23.12 22.23 2k4t s ALA 223 CO 0.03 0.32 -0.11 0.21 0.00 0.00 0.00 175.76 176.21 2k4t s LYS 224 N 0.23 2.08 0.00 0.00 2.20 -0.05 -1.36 119.74 122.85 2k4t s LYS 224 Ca -0.16 -0.86 0.06 0.00 -0.36 0.00 0.00 55.97 54.66 2k4t s LYS 224 Cb -0.17 -2.43 -0.02 0.00 -1.51 0.00 0.00 37.83 33.70 2k4t s LYS 224 CO 0.08 -0.42 -0.19 -0.47 -0.36 0.00 0.00 175.35 173.99 2k4t s TYR 225 N 1.38 1.70 -0.31 4.03 5.04 0.80 -0.10 117.35 129.90 2k4t s TYR 225 Ca -0.01 -0.34 0.04 0.00 -2.44 0.00 0.00 57.07 54.32 2k4t s TYR 225 Cb -0.16 -1.07 0.08 0.00 0.35 0.00 0.00 41.96 41.17 2k4t s TYR 225 CO -0.08 0.01 -0.02 1.14 -1.34 0.00 0.00 175.55 175.26 2k4t s GLN 226 N -0.68 1.80 0.23 4.97 -2.07 -1.24 -0.27 119.66 122.40 2k4t s GLN 226 Ca 0.07 -1.66 0.14 0.00 -1.82 0.00 0.00 55.36 52.09 2k4t s GLN 226 Cb -0.08 -3.08 -0.00 0.00 -1.09 0.00 0.00 33.01 28.76 2k4t s GLN 226 CO 0.00 -0.79 1.37 0.97 -1.32 0.00 0.00 175.29 175.52 2k4t h ILE 227 N 6.68 1.00 -4.13 3.63 -0.00 -1.91 -3.47 117.51 119.30 2k4t h ILE 227 Ca -0.10 -2.43 -0.16 0.00 -0.00 0.00 0.00 64.86 62.17 2k4t h ILE 227 Cb 1.03 2.48 -0.15 0.00 -0.00 0.00 0.00 36.82 40.18 2k4t h ILE 227 CO 0.50 0.57 -0.68 -1.81 -0.00 0.00 0.00 178.15 176.72 2k4t s ASP 228 N -6.46 0.67 0.02 2.19 1.11 -1.25 -5.01 116.67 107.95 2k4t s ASP 228 Ca 0.03 -1.03 0.15 0.00 0.18 0.00 0.00 52.55 51.88 2k4t s ASP 228 Cb 0.08 0.18 0.64 0.00 1.07 0.00 0.00 42.92 44.89 2k4t s ASP 228 CO 0.76 -0.58 1.48 -0.81 1.18 0.00 0.00 175.17 177.20 2k4t n PRO 229 N 0.03 0.02 0.00 8.23 -0.04 -1.26 -2.49 135.00 139.49 2k4t n PRO 229 Ca -0.12 0.27 0.00 0.00 -0.04 0.00 0.00 63.50 63.61 2k4t n PRO 229 Cb 0.61 -1.54 0.00 0.00 -0.04 0.00 0.00 33.50 32.54 2k4t n PRO 229 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2k4t n ASP 230 N -1.57 0.42 -4.48 3.54 8.00 -1.26 -5.03 116.55 116.17 2k4t n ASP 230 Ca 0.03 -0.71 -0.33 0.00 0.71 0.00 0.00 54.79 54.50 2k4t n ASP 230 Cb 0.17 0.47 -0.13 0.00 -0.02 0.00 0.00 41.12 41.61 2k4t n ASP 230 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2k4t s ALA 231 N -0.47 2.67 0.03 2.24 0.00 -1.04 -4.22 121.76 120.97 2k4t s ALA 231 Ca 0.00 -1.00 0.04 0.00 0.00 0.00 0.00 51.96 51.00 2k4t s ALA 231 Cb 0.00 -0.95 -0.02 0.00 0.00 0.00 0.00 23.12 22.15 2k4t s ALA 231 CO 0.00 0.56 -0.11 0.00 0.00 0.00 0.00 175.76 176.21 2k4t s PHE 233 N -0.80 1.94 -0.15 0.00 5.36 0.62 -0.09 117.98 124.86 2k4t s PHE 233 Ca -0.00 -1.49 0.00 0.00 -0.96 0.00 0.00 56.93 54.48 2k4t s PHE 233 Cb -0.07 -1.43 0.03 0.00 -0.34 0.00 0.00 43.02 41.21 2k4t s PHE 233 CO 0.01 -0.73 -0.12 -1.54 -1.46 0.00 0.00 175.22 171.38 2k4t s SER 234 N 1.55 2.74 0.10 6.13 1.04 0.62 -0.14 113.70 125.73 2k4t s SER 234 Ca -0.03 -0.54 0.09 0.00 0.48 0.00 0.00 55.95 55.95 2k4t s SER 234 Cb -0.18 -1.11 -0.03 0.00 0.10 0.00 0.00 66.02 64.79 2k4t s SER 234 CO -0.08 -0.09 -0.23 0.00 0.98 0.00 0.00 173.24 173.82 2k4t s ALA 235 N 1.52 2.00 -0.02 5.32 0.00 -0.46 -0.06 121.76 130.06 2k4t s ALA 235 Ca 0.04 -1.29 0.01 0.00 0.00 0.00 0.00 51.96 50.72 2k4t s ALA 235 Cb -0.14 -0.31 0.02 0.00 0.00 0.00 0.00 23.12 22.69 2k4t s ALA 235 CO -0.10 0.43 -0.01 -1.59 0.00 0.00 0.00 175.76 174.50 2k4t s LYS 236 N -1.80 0.25 -0.00 0.00 -2.85 0.76 -1.34 119.74 114.76 2k4t s LYS 236 Ca 0.09 0.02 0.00 0.00 -1.00 0.00 0.00 55.97 55.08 2k4t s LYS 236 Cb -0.10 -0.36 -0.00 0.00 -2.06 0.00 0.00 37.83 35.31 2k4t s LYS 236 CO 0.04 -0.06 -0.02 0.54 0.10 0.00 0.00 175.35 175.95 2k4t s VAL 237 N 0.60 0.12 0.22 1.79 0.11 -0.60 -0.34 120.40 122.31 2k4t s VAL 237 Ca -0.06 -0.08 -0.00 0.00 -2.93 0.00 0.00 61.98 58.91 2k4t s VAL 237 Cb -0.09 -0.11 0.04 0.00 -1.53 0.00 0.00 36.38 34.69 2k4t s VAL 237 CO -0.01 0.03 0.30 0.59 -3.33 0.00 0.00 175.10 172.68 2k4t n ASN 238 N 3.02 0.40 -3.63 3.54 3.02 0.72 0.04 115.26 122.37 2k4t n ASN 238 Ca -0.12 -1.34 -0.43 0.00 -0.03 0.00 0.00 54.58 52.66 2k4t n ASN 238 Cb 0.59 -0.20 -0.05 0.00 -0.61 0.00 0.00 39.78 39.52 2k4t n ASN 238 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2k4t n ASN 239 N -2.98 2.84 -1.25 6.41 0.23 0.91 -4.08 115.26 117.34 2k4t n ASN 239 Ca 0.05 -2.70 -0.16 0.00 -0.53 0.00 0.00 54.58 51.24 2k4t n ASN 239 Cb 0.18 -1.21 -0.07 0.00 -2.08 0.00 0.00 39.78 36.59 2k4t n ASN 239 CO 0.00 0.00 0.00 -0.24 -0.93 0.00 0.00 177.26 176.09 2k4t n SER 240 N 7.13 -5.47 -0.07 0.53 2.88 -1.26 -4.81 113.62 112.55 2k4t n SER 240 Ca 0.50 0.40 -0.07 0.00 -1.33 0.00 0.00 58.87 58.37 2k4t n SER 240 Cb 0.39 -4.41 -0.15 0.00 -0.75 0.00 0.00 64.21 59.29 2k4t n SER 240 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2k4t n SER 241 N -1.16 0.18 -3.64 -3.46 2.88 -1.26 -4.69 113.62 102.48 2k4t n SER 241 Ca -0.16 0.09 -0.04 0.00 -1.33 0.00 0.00 58.87 57.43 2k4t n SER 241 Cb 0.62 0.88 -0.07 0.00 -0.75 0.00 0.00 64.21 64.90 2k4t n SER 241 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 2k4t s LEU 242 N -5.51 -0.43 -0.18 2.46 1.98 -1.26 -4.32 118.68 111.42 2k4t s LEU 242 Ca -0.09 0.73 -0.00 0.00 -2.89 0.00 0.00 54.13 51.89 2k4t s LEU 242 Cb 0.07 1.69 0.01 0.00 0.66 0.00 0.00 46.19 48.62 2k4t s LEU 242 CO 0.84 -0.12 -0.16 0.27 -1.89 0.00 0.00 176.35 175.28 2k4t s ILE 243 N 0.97 2.40 -0.01 6.68 -0.00 -0.73 -0.20 121.20 130.31 2k4t s ILE 243 Ca -0.05 -0.83 0.04 0.00 -0.00 0.00 0.00 60.65 59.81 2k4t s ILE 243 Cb -0.04 -2.03 -0.01 0.00 -0.00 0.00 0.00 42.46 40.38 2k4t s ILE 243 CO -0.12 0.51 -0.13 -0.83 -0.00 0.00 0.00 174.94 174.37 2k4t s GLY 244 N 1.27 0.62 -0.08 6.27 0.00 0.54 -1.39 107.32 114.55 2k4t s GLY 244 Ca 0.04 -0.56 0.01 0.00 0.00 0.00 0.00 44.72 44.21 2k4t s GLY 244 CO -0.09 -0.47 -0.08 1.08 0.00 0.00 0.00 173.10 173.54 2k4t s LEU 245 N -0.35 1.29 -0.09 0.66 1.43 -0.39 -0.17 118.68 121.05 2k4t s LEU 245 Ca 0.05 -0.24 0.02 0.00 -1.03 0.00 0.00 54.13 52.92 2k4t s LEU 245 Cb -0.05 -0.72 -0.02 0.00 0.03 0.00 0.00 46.19 45.43 2k4t s LEU 245 CO -0.00 -0.07 -0.14 -0.83 0.23 0.00 0.00 176.35 175.54 2k4t s GLY 246 N 1.27 1.52 -0.14 -3.19 0.00 0.91 -0.20 107.32 107.49 2k4t s GLY 246 Ca -0.04 -0.93 -0.03 0.00 0.00 0.00 0.00 44.72 43.72 2k4t s GLY 246 CO -0.03 -0.45 0.03 -0.47 0.00 0.00 0.00 173.10 172.19 2k4t s TYR 247 N -0.11 0.74 -0.25 1.90 6.14 -0.08 -0.28 117.35 125.41 2k4t s TYR 247 Ca -0.02 -0.48 -0.11 0.00 0.64 0.00 0.00 57.07 57.11 2k4t s TYR 247 Cb -0.14 -0.87 -0.05 0.00 0.42 0.00 0.00 41.96 41.32 2k4t s TYR 247 CO 0.04 -0.47 0.17 0.99 0.64 0.00 0.00 175.55 176.91 2k4t s THR 248 N 1.95 5.34 0.14 4.34 2.01 0.87 -1.15 115.64 129.14 2k4t s THR 248 Ca 0.02 0.18 0.08 0.00 0.31 0.00 0.00 61.69 62.28 2k4t s THR 248 Cb -0.15 -3.50 -0.04 0.00 0.01 0.00 0.00 72.50 68.82 2k4t s THR 248 CO -0.07 0.32 -0.19 -1.58 -0.69 0.00 0.00 174.62 172.41 2k4t s GLN 249 N 1.24 1.19 -0.29 4.92 0.74 -0.28 -1.26 119.66 125.92 2k4t s GLN 249 Ca 0.07 -1.29 -0.05 0.00 0.05 0.00 0.00 55.36 54.15 2k4t s GLN 249 Cb -0.14 -1.30 0.19 0.00 1.10 0.00 0.00 33.01 32.86 2k4t s GLN 249 CO 0.06 0.28 0.87 -0.08 -0.55 0.00 0.00 175.29 175.87 2k4t s THR 250 N -1.72 -0.54 0.10 -0.34 -1.32 -1.26 -1.31 115.64 109.26 2k4t s THR 250 Ca 0.11 0.00 -0.25 0.00 -1.21 0.00 0.00 61.69 60.34 2k4t s THR 250 Cb -0.07 -0.54 -0.11 0.00 -1.51 0.00 0.00 72.50 70.27 2k4t s THR 250 CO 0.05 0.00 1.68 0.25 -2.21 0.00 0.00 174.62 174.40 2k4t h LEU 251 N 7.54 -0.38 -9.29 9.08 5.85 -1.92 -3.44 115.31 122.74 2k4t h LEU 251 Ca -0.06 0.04 -0.61 0.00 0.84 0.00 0.00 57.88 58.09 2k4t h LEU 251 Cb 1.18 0.14 -0.14 0.00 0.37 0.00 0.00 40.66 42.22 2k4t h LEU 251 CO -0.00 -0.20 -0.73 -1.59 -0.34 0.00 0.00 178.44 175.57 2k4t s LYS 252 N -6.14 1.90 0.23 1.25 -2.85 -1.26 -5.02 119.74 107.85 2k4t s LYS 252 Ca -0.15 -1.52 0.22 0.00 -1.00 0.00 0.00 55.97 53.53 2k4t s LYS 252 Cb 0.07 -1.97 0.94 0.00 -2.06 0.00 0.00 37.83 34.81 2k4t s LYS 252 CO 0.66 0.38 1.68 -0.35 0.10 0.00 0.00 175.35 177.81 2k4t n PRO 253 N -0.38 0.17 0.17 1.78 -0.04 -1.26 -2.43 135.00 133.01 2k4t n PRO 253 Ca -0.08 0.41 0.10 0.00 -0.04 0.00 0.00 63.50 63.89 2k4t n PRO 253 Cb 0.58 -1.83 0.10 0.00 -0.04 0.00 0.00 33.50 32.31 2k4t n PRO 253 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2k4t h GLY 254 N 2.24 0.00 -6.29 0.55 0.00 -1.97 -3.45 103.07 94.15 2k4t h GLY 254 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.01 2k4t h GLY 254 CO 0.00 0.00 -0.74 -0.42 0.00 0.00 0.00 176.54 175.38 2k4t s ILE 255 N -3.20 0.11 0.01 2.60 1.01 -1.02 -4.95 121.20 115.76 2k4t s ILE 255 Ca 0.04 0.09 0.01 0.00 0.00 0.00 0.00 60.65 60.80 2k4t s ILE 255 Cb 0.07 -0.20 -0.01 0.00 0.01 0.00 0.00 42.46 42.33 2k4t s ILE 255 CO 0.71 0.11 -0.03 -0.54 0.00 0.00 0.00 174.94 175.20 2k4t s LYS 256 N 0.87 0.27 -0.05 2.79 1.02 -1.26 -4.09 119.74 119.28 2k4t s LYS 256 Ca -0.08 -0.26 -0.04 0.00 0.02 0.00 0.00 55.97 55.61 2k4t s LYS 256 Cb -0.12 -0.17 0.02 0.00 -0.52 0.00 0.00 37.83 37.05 2k4t s LYS 256 CO -0.02 0.04 0.13 -1.17 -0.92 0.00 0.00 175.35 173.41 2k4t s LEU 257 N -0.49 1.24 -0.11 3.17 0.20 -0.43 -3.38 118.68 118.89 2k4t s LEU 257 Ca -0.03 0.26 0.03 0.00 0.69 0.00 0.00 54.13 55.09 2k4t s LEU 257 Cb -0.04 0.40 0.00 0.00 -0.43 0.00 0.00 46.19 46.13 2k4t s LEU 257 CO -0.00 -0.08 -0.22 0.28 -0.29 0.00 0.00 176.35 176.04 2k4t s THR 258 N 0.46 1.96 -0.07 3.68 -1.32 -0.48 -1.12 115.64 118.75 2k4t s THR 258 Ca -0.03 -0.94 0.04 0.00 -1.21 0.00 0.00 61.69 59.55 2k4t s THR 258 Cb -0.05 -1.71 -0.00 0.00 -1.51 0.00 0.00 72.50 69.23 2k4t s THR 258 CO -0.02 0.53 -0.20 -1.48 -2.21 0.00 0.00 174.62 171.24 2k4t s LEU 259 N 0.55 1.96 0.14 9.08 0.05 -0.30 -0.18 118.68 129.98 2k4t s LEU 259 Ca -0.14 -0.44 0.02 0.00 0.05 0.00 0.00 54.13 53.62 2k4t s LEU 259 Cb -0.17 -1.18 -0.04 0.00 -2.05 0.00 0.00 46.19 42.75 2k4t s LEU 259 CO 0.05 0.16 -0.04 -0.44 -0.55 0.00 0.00 176.35 175.52 2k4t s SER 260 N 0.16 1.30 -0.04 1.48 0.01 0.55 -0.90 113.70 116.26 2k4t s SER 260 Ca -0.09 -1.08 0.05 0.00 1.31 0.00 0.00 55.95 56.14 2k4t s SER 260 Cb -0.14 0.08 -0.01 0.00 0.21 0.00 0.00 66.02 66.16 2k4t s SER 260 CO 0.05 -0.48 -0.19 0.00 0.41 0.00 0.00 173.24 173.03 2k4t s ALA 261 N -3.58 1.63 -0.20 1.44 0.00 0.72 -0.89 121.76 120.88 2k4t s ALA 261 Ca 0.18 -0.77 0.01 0.00 0.00 0.00 0.00 51.96 51.37 2k4t s ALA 261 Cb 0.05 -0.50 0.04 0.00 0.00 0.00 0.00 23.12 22.71 2k4t s ALA 261 CO -0.00 0.33 -0.11 -1.17 0.00 0.00 0.00 175.76 174.80 2k4t s LEU 262 N -0.12 2.28 -0.11 0.00 1.98 0.98 -1.26 118.68 122.43 2k4t s LEU 262 Ca -0.01 -0.87 0.03 0.00 -2.89 0.00 0.00 54.13 50.39 2k4t s LEU 262 Cb -0.11 -1.25 0.01 0.00 0.66 0.00 0.00 46.19 45.50 2k4t s LEU 262 CO 0.02 -0.14 -0.20 -0.76 -1.89 0.00 0.00 176.35 173.38 2k4t s LEU 263 N 1.39 1.95 -0.58 -0.68 2.01 -0.49 -1.46 118.68 120.82 2k4t s LEU 263 Ca -0.01 -0.50 -0.19 0.00 0.01 0.00 0.00 54.13 53.43 2k4t s LEU 263 Cb -0.16 -1.26 0.09 0.00 0.01 0.00 0.00 46.19 44.86 2k4t s LEU 263 CO -0.08 0.09 0.72 -0.62 1.01 0.00 0.00 176.35 177.46 2k4t s ASP 264 N 0.65 6.20 0.00 2.29 2.15 -1.26 -1.77 116.67 124.93 2k4t s ASP 264 Ca -0.13 -1.22 0.00 0.00 0.43 0.00 0.00 52.55 51.64 2k4t s ASP 264 Cb -0.16 -2.32 0.00 0.00 -0.30 0.00 0.00 42.92 40.14 2k4t s ASP 264 CO 0.03 -1.10 0.00 0.61 -0.17 0.00 0.00 175.17 174.55 2k4t n GLY 265 N 5.25 0.73 2.63 2.66 0.00 -1.26 -3.43 105.19 111.78 2k4t n GLY 265 Ca -0.08 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.81 2k4t n GLY 265 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2k4t n LYS 266 N -2.40 -1.41 -0.59 1.61 4.76 -1.26 -4.82 118.16 114.04 2k4t n LYS 266 Ca 0.00 0.94 0.02 0.00 -2.87 0.00 0.00 58.31 56.40 2k4t n LYS 266 Cb 0.01 -5.23 0.22 0.00 -1.84 0.00 0.00 35.03 28.20 2k4t n LYS 266 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2k4t n ASN 267 N -0.93 3.13 0.05 4.39 3.02 -1.22 -4.60 115.26 119.09 2k4t n ASN 267 Ca -0.13 -3.38 0.09 0.00 -0.03 0.00 0.00 54.58 51.13 2k4t n ASN 267 Cb 0.55 -0.58 0.39 0.00 -0.61 0.00 0.00 39.78 39.53 2k4t n ASN 267 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 2k4t n VAL 268 N -0.87 0.88 -0.22 2.41 0.24 -1.26 -3.14 118.33 116.37 2k4t n VAL 268 Ca 0.27 0.21 0.29 0.00 -2.04 0.00 0.00 64.34 63.07 2k4t n VAL 268 Cb 0.95 -1.01 0.70 0.00 -1.47 0.00 0.00 33.84 33.00 2k4t n VAL 268 CO 0.00 0.00 0.00 0.78 -2.14 0.00 0.00 176.83 175.47 2k4t h ASN 269 N 0.00 0.06 0.45 -1.34 2.35 -1.96 0.27 115.58 115.41 2k4t h ASN 269 Ca 0.00 0.01 -0.15 0.00 -0.55 0.00 0.00 56.30 55.61 2k4t h ASN 269 Cb 0.31 -0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.66 2k4t h ASN 269 CO 0.00 0.02 -1.68 0.00 -1.65 0.00 0.00 177.43 174.12 2k4t n ALA 270 N -2.69 2.12 0.00 -0.83 0.00 -1.19 -5.02 120.51 112.91 2k4t n ALA 270 Ca 0.20 -0.65 0.00 0.00 0.00 0.00 0.00 53.44 52.99 2k4t n ALA 270 Cb 0.98 -0.78 0.00 0.00 0.00 0.00 0.00 19.45 19.65 2k4t n ALA 270 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k4t n GLY 271 N 1.41 3.42 0.00 0.00 0.00 0.93 -5.06 105.19 105.89 2k4t n GLY 271 Ca -0.12 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.85 2k4t n GLY 271 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k4t n GLY 272 N -0.17 1.51 3.72 -0.02 0.00 -1.25 -4.50 105.19 104.48 2k4t n GLY 272 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2k4t n GLY 272 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2k4t s HIS 273 N -1.78 3.63 0.05 1.61 5.04 -1.26 -4.40 115.29 118.17 2k4t s HIS 273 Ca 0.00 1.61 0.06 0.00 -1.54 0.00 0.00 55.06 55.19 2k4t s HIS 273 Cb 0.00 -3.20 -0.03 0.00 0.04 0.00 0.00 32.58 29.40 2k4t s HIS 273 CO 0.00 -0.34 -0.17 0.21 -2.34 0.00 0.00 174.74 172.11 2k4t s LYS 274 N 0.70 1.07 -0.04 2.88 2.20 -0.54 -4.38 119.74 121.64 2k4t s LYS 274 Ca 0.52 -0.89 0.04 0.00 -0.36 0.00 0.00 55.97 55.29 2k4t s LYS 274 Cb -0.24 -1.15 -0.00 0.00 -1.51 0.00 0.00 37.83 34.93 2k4t s LYS 274 CO 0.29 0.28 -0.15 -0.48 -0.36 0.00 0.00 175.35 174.94 2k4t s LEU 275 N -1.32 1.87 -0.49 5.43 2.34 -1.26 -0.02 118.68 125.23 2k4t s LEU 275 Ca 0.03 -0.31 -0.09 0.00 0.06 0.00 0.00 54.13 53.82 2k4t s LEU 275 Cb -0.09 -0.86 0.12 0.00 -0.56 0.00 0.00 46.19 44.81 2k4t s LEU 275 CO 0.02 0.13 0.37 -0.83 -1.06 0.00 0.00 176.35 174.97 2k4t s GLY 276 N 0.11 2.07 -0.18 -3.48 0.00 -0.07 -0.37 107.32 105.39 2k4t s GLY 276 Ca -0.04 -2.58 -0.09 0.00 0.00 0.00 0.00 44.72 42.01 2k4t s GLY 276 CO 0.02 1.12 0.10 1.08 0.00 0.00 0.00 173.10 175.42 2k4t s LEU 277 N 1.29 4.06 -0.12 0.66 1.02 -0.25 -0.33 118.68 125.01 2k4t s LEU 277 Ca 0.06 0.19 0.01 0.00 0.02 0.00 0.00 54.13 54.41 2k4t s LEU 277 Cb -0.26 -2.04 0.02 0.00 0.02 0.00 0.00 46.19 43.94 2k4t s LEU 277 CO -0.01 0.20 -0.13 -0.83 0.02 0.00 0.00 176.35 175.60 2k4t s GLY 278 N 0.23 1.01 -0.12 -3.19 0.00 0.74 -0.65 107.32 105.35 2k4t s GLY 278 Ca 0.07 -0.74 -0.02 0.00 0.00 0.00 0.00 44.72 44.03 2k4t s GLY 278 CO -0.01 0.44 -0.03 1.08 0.00 0.00 0.00 173.10 174.59 2k4t s LEU 279 N 1.29 3.35 -0.82 0.66 1.43 -0.10 -1.39 118.68 123.09 2k4t s LEU 279 Ca -0.01 -0.02 0.01 0.00 -1.03 0.00 0.00 54.13 53.08 2k4t s LEU 279 Cb -0.14 -1.78 0.22 0.00 0.03 0.00 0.00 46.19 44.52 2k4t s LEU 279 CO -0.06 0.27 0.76 -0.62 0.23 0.00 0.00 176.35 176.93 2k4t n GLU 280 N 2.86 2.56 -3.48 1.70 4.71 -1.22 -0.90 120.64 126.87 2k4t n GLU 280 Ca -0.18 -4.53 -0.43 0.00 -0.01 0.00 0.00 57.16 52.02 2k4t n GLU 280 Cb 0.53 -2.36 -0.10 0.00 -1.01 0.00 0.00 31.44 28.50 2k4t n GLU 280 CO 0.00 0.00 0.00 0.12 0.09 0.00 0.00 177.13 177.34 2k4t s PHE 281 N -1.72 3.24 -0.25 -0.32 2.19 -1.25 -4.50 117.98 115.37 2k4t s PHE 281 Ca 0.29 -0.56 -0.11 0.00 0.33 0.00 0.00 56.93 56.88 2k4t s PHE 281 Cb -0.01 -2.57 -0.05 0.00 -1.31 0.00 0.00 43.02 39.08 2k4t s PHE 281 CO -0.10 -0.56 0.19 -0.65 1.83 0.00 0.00 175.22 175.93 2k4t s GLN 282 N 1.68 4.04 -0.47 10.12 1.11 -1.26 -4.50 119.66 130.39 2k4t s GLN 282 Ca 0.05 -0.24 -0.28 0.00 0.01 0.00 0.00 55.36 54.90 2k4t s GLN 282 Cb -0.19 -3.58 -0.00 0.00 -1.01 0.00 0.00 33.01 28.24 2k4t s GLN 282 CO 0.10 -0.02 1.57 0.00 0.01 0.00 0.00 175.29 176.95 2k4t s ALA 283 N 1.30 2.80 0.08 6.09 0.00 -1.26 -4.75 121.76 126.01 2k4t s ALA 283 Ca 0.08 -0.29 0.00 0.00 0.00 0.00 0.00 51.96 51.75 2k4t s ALA 283 Cb -0.14 -4.06 0.00 0.00 0.00 0.00 0.00 23.12 18.91 2k4t s ALA 283 CO 0.07 -2.85 0.00 -0.11 0.00 0.00 0.00 175.76 172.87 2k4t n LEU 284 N 10.01 0.41 -0.88 0.00 0.00 -1.26 -5.00 117.00 120.28 2k4t n LEU 284 Ca 0.17 0.12 0.12 0.00 0.00 0.00 0.00 56.01 56.42 2k4t n LEU 284 Cb 0.49 -0.08 0.17 0.00 0.00 0.00 0.00 43.42 44.00 2k4t n LEU 284 CO 0.70 -0.64 0.67 -1.84 0.00 0.00 0.00 177.39 176.28