#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ks0 n ALA 2 N 0.00 0.25 -3.19 1.69 0.00 -1.26 -5.00 120.51 113.00 3ks0 n ALA 2 Ca 0.00 0.14 -0.35 0.00 0.00 0.00 0.00 53.44 53.23 3ks0 n ALA 2 Cb 0.00 -2.10 -0.13 0.00 0.00 0.00 0.00 19.45 17.22 3ks0 n ALA 2 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3ks0 s VAL 3 N -1.38 3.69 -0.27 0.00 1.01 -1.26 -4.90 120.40 117.29 3ks0 s VAL 3 Ca 0.68 -0.40 -0.10 0.00 0.00 0.00 0.00 61.98 62.15 3ks0 s VAL 3 Cb -0.49 -2.65 -0.04 0.00 0.00 0.00 0.00 36.38 33.19 3ks0 s VAL 3 CO 0.53 0.44 0.16 -0.69 0.00 0.00 0.00 175.10 175.54 3ks0 s VAL 4 N 0.99 5.07 -0.09 2.92 1.01 -1.26 -1.06 120.40 127.98 3ks0 s VAL 4 Ca 0.01 0.09 0.03 0.00 0.00 0.00 0.00 61.98 62.10 3ks0 s VAL 4 Cb -0.15 -3.40 -0.02 0.00 0.00 0.00 0.00 36.38 32.82 3ks0 s VAL 4 CO 0.01 0.28 -0.16 0.28 0.00 0.00 0.00 175.10 175.51 3ks0 s THR 5 N 1.66 2.80 0.04 3.92 -1.32 0.17 -3.85 115.64 119.07 3ks0 s THR 5 Ca 0.07 -0.78 -0.12 0.00 -1.21 0.00 0.00 61.69 59.65 3ks0 s THR 5 Cb -0.16 -2.12 0.01 0.00 -1.51 0.00 0.00 72.50 68.73 3ks0 s THR 5 CO 0.09 0.56 0.25 0.00 -2.21 0.00 0.00 174.62 173.31 3ks0 s GLN 6 N -0.10 0.76 0.11 7.08 -2.07 -1.26 -0.90 119.66 123.29 3ks0 s GLN 6 Ca -0.03 -0.58 -0.35 0.00 -1.82 0.00 0.00 55.36 52.58 3ks0 s GLN 6 Cb -0.14 0.32 -0.17 0.00 -1.09 0.00 0.00 33.01 31.93 3ks0 s GLN 6 CO 0.04 -0.24 1.04 0.39 -1.32 0.00 0.00 175.29 175.21 3ks0 n GLU 7 N 0.59 0.59 -0.06 9.60 4.71 -1.26 -4.80 120.64 130.01 3ks0 n GLU 7 Ca -0.19 0.21 -0.04 0.00 -0.01 0.00 0.00 57.16 57.14 3ks0 n GLU 7 Cb 0.59 -1.64 -0.03 0.00 -1.01 0.00 0.00 31.44 29.35 3ks0 n GLU 7 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 3ks0 h SER 8 N 2.98 -0.56 -5.03 1.62 0.87 -1.97 -3.34 113.55 108.12 3ks0 h SER 8 Ca -0.44 0.08 -0.05 0.00 -1.23 0.00 0.00 61.79 60.15 3ks0 h SER 8 Cb 1.39 0.24 -0.15 0.00 -0.44 0.00 0.00 62.40 63.43 3ks0 h SER 8 CO 0.67 -0.10 0.02 0.00 -0.53 0.00 0.00 176.83 176.89 3ks0 s ALA 9 N -4.31 -1.22 -0.11 6.23 0.00 -1.26 -2.52 121.76 118.56 3ks0 s ALA 9 Ca -0.04 0.38 -0.07 0.00 0.00 0.00 0.00 51.96 52.23 3ks0 s ALA 9 Cb 0.03 0.53 0.04 0.00 0.00 0.00 0.00 23.12 23.72 3ks0 s ALA 9 CO 0.18 -0.57 0.28 -0.51 0.00 0.00 0.00 175.76 175.13 3ks0 s LEU 10 N -2.30 0.53 -0.05 0.00 1.43 -0.14 -4.90 118.68 113.25 3ks0 s LEU 10 Ca -0.02 0.58 -0.00 0.00 -1.03 0.00 0.00 54.13 53.66 3ks0 s LEU 10 Cb -0.00 0.88 -0.03 0.00 0.03 0.00 0.00 46.19 47.07 3ks0 s LEU 10 CO -0.06 -0.15 -0.01 -0.89 0.23 0.00 0.00 176.35 175.47 3ks0 s THR 11 N 0.91 4.15 0.26 5.49 2.01 -1.26 -0.08 115.64 127.12 3ks0 s THR 11 Ca -0.06 -0.42 -0.20 0.00 0.31 0.00 0.00 61.69 61.32 3ks0 s THR 11 Cb -0.07 -2.78 0.02 0.00 0.01 0.00 0.00 72.50 69.68 3ks0 s THR 11 CO -0.06 0.52 0.66 0.28 -0.69 0.00 0.00 174.62 175.33 3ks0 s THR 12 N -0.95 0.00 0.23 -0.82 -1.32 0.36 -4.93 115.64 108.22 3ks0 s THR 12 Ca 0.15 -0.98 0.11 0.00 -1.21 0.00 0.00 61.69 59.76 3ks0 s THR 12 Cb -0.11 -1.94 -0.05 0.00 -1.51 0.00 0.00 72.50 68.89 3ks0 s THR 12 CO 0.05 -0.01 -0.20 -0.44 -2.21 0.00 0.00 174.62 171.82 3ks0 s SER 13 N -2.92 3.26 0.39 8.08 0.01 -1.26 0.14 113.70 121.39 3ks0 s SER 13 Ca 0.12 -0.97 -0.26 0.00 1.31 0.00 0.00 55.95 56.15 3ks0 s SER 13 Cb -0.04 -0.24 -0.11 0.00 0.21 0.00 0.00 66.02 65.84 3ks0 s SER 13 CO 0.05 0.01 1.22 -2.65 0.41 0.00 0.00 173.24 172.29 3ks0 n PRO 14 N -0.26 1.86 0.00 12.44 -0.02 -1.26 -2.40 135.00 145.35 3ks0 n PRO 14 Ca -0.08 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 3ks0 n PRO 14 Cb 0.59 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 3ks0 n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ks0 n GLY 15 N 0.88 2.55 3.73 -1.23 0.00 0.21 -4.88 105.19 106.45 3ks0 n GLY 15 Ca 0.07 -0.50 -0.31 0.00 0.00 0.00 0.00 46.02 45.28 3ks0 n GLY 15 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ks0 s GLU 16 N 0.00 1.70 -0.10 1.61 0.41 -1.01 -3.53 118.70 117.79 3ks0 s GLU 16 Ca 0.00 1.35 -0.14 0.00 -0.41 0.00 0.00 54.97 55.77 3ks0 s GLU 16 Cb 0.00 -1.82 -0.05 0.00 -1.78 0.00 0.00 34.13 30.48 3ks0 s GLU 16 CO 0.00 -2.09 0.35 0.99 -0.49 0.00 0.00 175.26 174.02 3ks0 s THR 17 N -2.77 5.21 0.01 3.63 2.01 -1.26 -0.84 115.64 121.63 3ks0 s THR 17 Ca 0.64 0.68 0.06 0.00 0.31 0.00 0.00 61.69 63.38 3ks0 s THR 17 Cb -0.20 -3.67 -0.02 0.00 0.01 0.00 0.00 72.50 68.63 3ks0 s THR 17 CO 0.57 0.46 -0.18 0.54 -0.69 0.00 0.00 174.62 175.32 3ks0 s VAL 18 N -0.15 1.41 -0.07 3.82 0.11 0.84 -4.95 120.40 121.40 3ks0 s VAL 18 Ca 0.20 -0.92 0.05 0.00 -2.93 0.00 0.00 61.98 58.39 3ks0 s VAL 18 Cb -0.14 -1.20 -0.01 0.00 -1.53 0.00 0.00 36.38 33.50 3ks0 s VAL 18 CO 0.08 0.26 -0.25 -0.89 -3.33 0.00 0.00 175.10 170.98 3ks0 s THR 19 N -0.60 2.04 -0.06 5.04 2.01 -1.26 -0.05 115.64 122.77 3ks0 s THR 19 Ca 0.06 -1.04 0.04 0.00 0.31 0.00 0.00 61.69 61.06 3ks0 s THR 19 Cb -0.07 -1.74 -0.02 0.00 0.01 0.00 0.00 72.50 70.67 3ks0 s THR 19 CO 0.00 0.56 -0.17 -0.76 -0.69 0.00 0.00 174.62 173.57 3ks0 s LEU 20 N 0.03 2.55 0.36 4.42 1.02 0.57 -4.99 118.68 122.63 3ks0 s LEU 20 Ca -0.09 -0.29 0.09 0.00 0.02 0.00 0.00 54.13 53.85 3ks0 s LEU 20 Cb -0.15 -1.51 -0.06 0.00 0.02 0.00 0.00 46.19 44.49 3ks0 s LEU 20 CO 0.06 0.31 -0.05 0.42 0.02 0.00 0.00 176.35 177.10 3ks0 s THR 21 N -0.51 2.28 -0.22 5.49 -4.23 -1.26 0.03 115.64 117.22 3ks0 s THR 21 Ca 0.07 -2.12 -0.04 0.00 -1.18 0.00 0.00 61.69 58.42 3ks0 s THR 21 Cb -0.12 -2.74 0.10 0.00 1.34 0.00 0.00 72.50 71.09 3ks0 s THR 21 CO 0.01 -0.17 0.23 0.00 -0.54 0.00 0.00 174.62 174.15 3ks0 s ARG 23 N 2.32 3.67 0.08 0.00 3.52 -0.07 -2.39 118.95 126.07 3ks0 s ARG 23 Ca 0.07 -0.32 -0.05 0.00 -0.13 0.00 0.00 55.73 55.30 3ks0 s ARG 23 Cb -0.16 -3.12 -0.05 0.00 -1.56 0.00 0.00 34.95 30.06 3ks0 s ARG 23 CO -0.16 0.46 0.32 -1.54 -0.81 0.00 0.00 175.30 173.57 3ks0 s SER 24 N -0.16 6.49 0.24 -2.12 1.04 -1.26 0.44 113.70 118.38 3ks0 s SER 24 Ca 0.07 0.56 0.04 0.00 0.48 0.00 0.00 55.95 57.10 3ks0 s SER 24 Cb -0.12 -2.08 0.28 0.00 0.10 0.00 0.00 66.02 64.20 3ks0 s SER 24 CO 0.01 0.15 1.58 0.77 0.98 0.00 0.00 173.24 176.74 3ks0 h SER 25 N 3.37 0.29 1.38 7.02 4.64 -1.44 -3.31 113.55 125.49 3ks0 h SER 25 Ca -0.48 -0.16 -0.11 0.00 -0.47 0.00 0.00 61.79 60.58 3ks0 h SER 25 Cb 1.18 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 63.17 3ks0 h SER 25 CO 0.70 0.79 -0.64 0.71 -0.87 0.00 0.00 176.83 177.53 3ks0 h THR 26 N 0.20 0.74 -0.32 2.95 1.35 -1.96 -3.49 112.91 112.39 3ks0 h THR 26 Ca -0.00 -2.10 0.00 0.00 -0.55 0.00 0.00 66.41 63.76 3ks0 h THR 26 Cb 1.05 2.32 0.00 0.00 -1.73 0.00 0.00 68.15 69.79 3ks0 h THR 26 CO 0.09 0.42 0.00 0.61 -0.25 0.00 0.00 175.52 176.39 3ks0 n GLY 27 N 1.24 0.83 3.82 5.82 0.00 -1.25 -5.15 105.19 110.51 3ks0 n GLY 27 Ca 0.00 -0.65 -0.38 0.00 0.00 0.00 0.00 46.02 44.99 3ks0 n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ks0 s ALA 28 N -1.00 3.55 -0.21 4.61 0.00 -1.26 -4.34 121.76 123.11 3ks0 s ALA 28 Ca 0.00 0.03 -0.27 0.00 0.00 0.00 0.00 51.96 51.72 3ks0 s ALA 28 Cb 0.00 -2.65 0.00 0.00 0.00 0.00 0.00 23.12 20.47 3ks0 s ALA 28 CO 0.00 0.40 0.95 0.08 0.00 0.00 0.00 175.76 177.19 3ks0 s VAL 29 N -1.25 4.76 0.38 0.00 1.01 -1.01 -5.01 120.40 119.27 3ks0 s VAL 29 Ca 0.33 1.86 0.02 0.00 0.00 0.00 0.00 61.98 64.19 3ks0 s VAL 29 Cb -0.18 -4.24 0.02 0.00 0.00 0.00 0.00 36.38 31.98 3ks0 s VAL 29 CO 0.20 -0.11 0.19 0.35 0.00 0.00 0.00 175.10 175.73 3ks0 n THR 30 N 5.15 0.00 0.34 3.92 -2.24 -1.26 -4.54 114.28 115.66 3ks0 n THR 30 Ca 0.09 -1.60 0.14 0.00 -2.27 0.00 0.00 64.05 60.41 3ks0 n THR 30 Cb 0.47 0.02 0.59 0.00 -2.10 0.00 0.00 70.33 69.31 3ks0 n THR 30 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ks0 h THR 31 N 0.82 0.00 0.00 4.28 1.03 -1.98 -1.58 112.91 115.48 3ks0 h THR 31 Ca -0.27 -0.32 0.00 0.00 -0.01 0.00 0.00 66.41 65.81 3ks0 h THR 31 Cb 0.90 1.16 0.00 0.00 -1.07 0.00 0.00 68.15 69.14 3ks0 h THR 31 CO 0.43 0.00 0.00 -1.20 -0.01 0.00 0.00 175.52 174.74 3ks0 n SER 32 N -2.58 0.00 -0.21 0.00 7.64 -1.26 -1.92 113.62 115.29 3ks0 n SER 32 Ca 0.01 0.03 0.13 0.00 1.01 0.00 0.00 58.87 60.05 3ks0 n SER 32 Cb 0.25 -0.25 0.32 0.00 -1.01 0.00 0.00 64.21 63.52 3ks0 n SER 32 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3ks0 n ASN 33 N -1.25 0.98 -3.99 6.43 5.03 -0.59 -4.90 115.26 116.97 3ks0 n ASN 33 Ca 0.07 -0.81 -0.33 0.00 0.87 0.00 0.00 54.58 54.38 3ks0 n ASN 33 Cb 0.10 0.20 -0.02 0.00 -1.02 0.00 0.00 39.78 39.04 3ks0 n ASN 33 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 3ks0 n TYR 34 N -0.80 -1.04 -1.46 3.10 4.02 -0.81 -1.14 117.16 119.04 3ks0 n TYR 34 Ca 0.11 0.18 -0.42 0.00 -0.01 0.00 0.00 57.90 57.76 3ks0 n TYR 34 Cb 0.35 -2.16 0.01 0.00 -0.02 0.00 0.00 39.34 37.52 3ks0 n TYR 34 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3ks0 n ALA 35 N -4.07 -1.45 -2.88 -0.72 0.00 -1.26 -4.14 120.51 106.00 3ks0 n ALA 35 Ca -0.14 0.17 -0.12 0.00 0.00 0.00 0.00 53.44 53.35 3ks0 n ALA 35 Cb 0.47 -1.78 -0.13 0.00 0.00 0.00 0.00 19.45 18.01 3ks0 n ALA 35 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3ks0 s ASN 36 N -0.94 0.20 -0.06 0.00 3.04 -0.27 -0.94 114.94 115.97 3ks0 s ASN 36 Ca 0.63 -0.16 0.01 0.00 0.04 0.00 0.00 52.86 53.38 3ks0 s ASN 36 Cb -0.60 0.01 0.02 0.00 -1.54 0.00 0.00 41.25 39.14 3ks0 s ASN 36 CO 0.58 -0.07 -0.04 0.26 -3.04 0.00 0.00 177.10 174.79 3ks0 s TRP 37 N -0.43 0.86 0.08 0.43 0.52 -0.48 -0.71 118.94 119.20 3ks0 s TRP 37 Ca -0.04 -0.27 0.07 0.00 0.02 0.00 0.00 56.10 55.87 3ks0 s TRP 37 Cb -0.03 -0.78 -0.03 0.00 -1.15 0.00 0.00 33.47 31.48 3ks0 s TRP 37 CO -0.00 -0.26 -0.18 0.14 0.02 0.00 0.00 176.95 176.68 3ks0 s VAL 38 N 1.18 1.41 -0.10 4.03 -7.23 -0.12 -1.00 120.40 118.57 3ks0 s VAL 38 Ca -0.07 -1.37 -0.03 0.00 -1.81 0.00 0.00 61.98 58.70 3ks0 s VAL 38 Cb -0.14 -1.30 -0.03 0.00 0.56 0.00 0.00 36.38 35.46 3ks0 s VAL 38 CO -0.01 -0.10 0.01 -1.58 -0.31 0.00 0.00 175.10 173.10 3ks0 s GLN 39 N -1.72 3.17 -0.20 4.82 0.74 0.30 -0.63 119.66 126.14 3ks0 s GLN 39 Ca 0.03 -0.40 -0.00 0.00 0.05 0.00 0.00 55.36 55.03 3ks0 s GLN 39 Cb -0.10 -2.86 0.02 0.00 1.10 0.00 0.00 33.01 31.17 3ks0 s GLN 39 CO 0.03 0.61 -0.14 -2.00 -0.55 0.00 0.00 175.29 173.24 3ks0 s GLU 40 N -0.63 3.01 0.33 1.67 2.12 0.04 -0.84 118.70 124.41 3ks0 s GLU 40 Ca 0.10 -0.83 0.07 0.00 0.36 0.00 0.00 54.97 54.67 3ks0 s GLU 40 Cb -0.12 -2.74 -0.02 0.00 0.26 0.00 0.00 34.13 31.51 3ks0 s GLU 40 CO 0.02 -0.25 0.36 0.15 -0.54 0.00 0.00 175.26 175.00 3ks0 s LYS 41 N 1.33 2.87 0.71 4.30 -0.14 0.16 -1.84 119.74 127.13 3ks0 s LYS 41 Ca 0.04 -1.19 -0.16 0.00 -1.36 0.00 0.00 55.97 53.30 3ks0 s LYS 41 Cb -0.14 -2.60 0.01 0.00 -1.68 0.00 0.00 37.83 33.42 3ks0 s LYS 41 CO -0.09 0.09 1.06 -0.35 -0.76 0.00 0.00 175.35 175.29 3ks0 n PRO 42 N -1.47 0.60 -2.62 -1.68 -0.05 -1.26 -2.62 135.00 125.90 3ks0 n PRO 42 Ca -0.01 0.26 -0.05 0.00 -0.05 0.00 0.00 63.50 63.65 3ks0 n PRO 42 Cb 0.59 -2.30 0.02 0.00 -0.05 0.00 0.00 33.50 31.76 3ks0 n PRO 42 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 175.50 175.20 3ks0 n ASP 43 N -1.88 -2.69 -3.24 3.54 9.92 -1.26 -4.26 116.55 116.68 3ks0 n ASP 43 Ca 0.14 -0.13 -0.23 0.00 -0.53 0.00 0.00 54.79 54.04 3ks0 n ASP 43 Cb 0.49 -1.57 0.01 0.00 -0.64 0.00 0.00 41.12 39.41 3ks0 n ASP 43 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 3ks0 n HIS 44 N -2.64 -1.85 -3.32 1.24 8.25 -1.25 -4.92 115.22 110.73 3ks0 n HIS 44 Ca -0.02 0.48 -0.41 0.00 -0.26 0.00 0.00 57.72 57.52 3ks0 n HIS 44 Cb 0.52 -3.47 -0.08 0.00 1.12 0.00 0.00 29.99 28.07 3ks0 n HIS 44 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3ks0 s LEU 45 N -6.55 4.30 -0.03 2.41 1.43 -1.08 -4.99 118.68 114.18 3ks0 s LEU 45 Ca 0.36 0.00 0.06 0.00 -1.03 0.00 0.00 54.13 53.53 3ks0 s LEU 45 Cb -0.18 -2.48 -0.01 0.00 0.03 0.00 0.00 46.19 43.54 3ks0 s LEU 45 CO 0.45 -0.37 -0.22 -0.36 0.23 0.00 0.00 176.35 176.08 3ks0 s PHE 46 N 2.21 2.05 -0.04 0.29 0.40 -1.26 -0.67 117.98 120.97 3ks0 s PHE 46 Ca 0.16 -0.45 0.00 0.00 -0.60 0.00 0.00 56.93 56.04 3ks0 s PHE 46 Cb -0.16 -1.33 0.03 0.00 0.51 0.00 0.00 43.02 42.07 3ks0 s PHE 46 CO 0.12 -0.08 -0.01 0.99 0.70 0.00 0.00 175.22 176.94 3ks0 s THR 47 N -0.40 0.29 0.10 0.64 2.01 -0.02 -4.97 115.64 113.28 3ks0 s THR 47 Ca 0.05 0.04 -0.30 0.00 0.31 0.00 0.00 61.69 61.79 3ks0 s THR 47 Cb -0.10 -0.38 -0.06 0.00 0.01 0.00 0.00 72.50 71.98 3ks0 s THR 47 CO 0.00 0.18 1.08 -0.83 -0.69 0.00 0.00 174.62 174.36 3ks0 s GLY 48 N 1.13 2.76 0.02 4.40 0.00 -1.26 -0.54 107.32 113.82 3ks0 s GLY 48 Ca -0.08 0.73 -0.04 0.00 0.00 0.00 0.00 44.72 45.33 3ks0 s GLY 48 CO -0.02 1.74 -0.08 1.04 0.00 0.00 0.00 173.10 175.79 3ks0 n LEU 49 N 3.18 1.17 -4.21 0.66 4.32 -0.17 -4.69 117.00 117.26 3ks0 n LEU 49 Ca 0.05 0.17 -0.22 0.00 -0.02 0.00 0.00 56.01 55.98 3ks0 n LEU 49 Cb 0.48 -0.39 -0.13 0.00 -1.62 0.00 0.00 43.42 41.75 3ks0 n LEU 49 CO 0.53 -0.53 -0.49 -0.63 -1.22 0.00 0.00 177.39 175.05 3ks0 s ILE 50 N -2.19 1.42 0.13 -0.08 -1.09 -0.97 -0.91 121.20 117.51 3ks0 s ILE 50 Ca -0.07 -1.22 -0.07 0.00 -2.23 0.00 0.00 60.65 57.06 3ks0 s ILE 50 Cb 0.01 -1.27 -0.01 0.00 -1.58 0.00 0.00 42.46 39.61 3ks0 s ILE 50 CO 0.10 0.02 0.21 -0.83 -1.23 0.00 0.00 174.94 173.21 3ks0 s GLY 51 N -1.39 0.41 -1.47 6.18 0.00 -0.60 -1.38 107.32 109.05 3ks0 s GLY 51 Ca 0.04 -0.88 -0.06 0.00 0.00 0.00 0.00 44.72 43.82 3ks0 s GLY 51 CO 0.02 -0.91 0.63 0.61 0.00 0.00 0.00 173.10 173.45 3ks0 n GLY 52 N -0.13 -0.32 5.00 0.20 0.00 -1.10 -0.67 105.19 108.16 3ks0 n GLY 52 Ca -0.10 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3ks0 n GLY 52 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3ks0 n THR 53 N -4.42 0.00 -2.31 2.61 -1.04 -0.12 -4.14 114.28 104.86 3ks0 n THR 53 Ca -0.17 0.00 -0.09 0.00 -2.04 0.00 0.00 64.05 61.74 3ks0 n THR 53 Cb 0.62 0.00 0.05 0.00 -1.82 0.00 0.00 70.33 69.18 3ks0 n THR 53 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 3ks0 n ASN 54 N 2.22 3.01 -4.29 8.00 6.94 -1.16 -4.23 115.26 125.75 3ks0 n ASN 54 Ca 0.00 -2.99 -0.36 0.00 -0.02 0.00 0.00 54.58 51.21 3ks0 n ASN 54 Cb 0.00 -0.41 -0.14 0.00 -2.36 0.00 0.00 39.78 36.88 3ks0 n ASN 54 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 3ks0 s LYS 55 N -3.30 3.12 0.09 -3.83 2.47 0.15 -4.73 119.74 113.71 3ks0 s LYS 55 Ca 0.39 -0.81 -0.31 0.00 -1.56 0.00 0.00 55.97 53.69 3ks0 s LYS 55 Cb 0.37 -3.12 -0.06 0.00 -1.46 0.00 0.00 37.83 33.56 3ks0 s LYS 55 CO -0.02 -0.34 1.21 1.03 0.16 0.00 0.00 175.35 177.40 3ks0 s ARG 56 N 1.44 4.44 0.71 4.03 0.52 -1.26 -1.56 118.95 127.27 3ks0 s ARG 56 Ca 0.03 1.81 -0.15 0.00 -0.52 0.00 0.00 55.73 56.91 3ks0 s ARG 56 Cb -0.16 -3.32 0.03 0.00 0.52 0.00 0.00 34.95 32.02 3ks0 s ARG 56 CO -0.02 -0.24 1.16 0.00 0.02 0.00 0.00 175.30 176.22 3ks0 s ALA 57 N 0.85 2.22 0.54 2.13 0.00 -0.09 -4.95 121.76 122.47 3ks0 s ALA 57 Ca 0.58 0.71 -0.21 0.00 0.00 0.00 0.00 51.96 53.04 3ks0 s ALA 57 Cb -0.31 -3.40 -0.05 0.00 0.00 0.00 0.00 23.12 19.36 3ks0 s ALA 57 CO 0.31 -1.69 1.25 -2.14 0.00 0.00 0.00 175.76 173.48 3ks0 s PRO 58 N -4.06 3.22 0.00 0.00 0.02 -1.26 -3.04 135.00 129.88 3ks0 s PRO 58 Ca 0.70 1.95 0.00 0.00 0.02 0.00 0.00 61.00 63.68 3ks0 s PRO 58 Cb -0.25 -2.16 0.00 0.00 0.02 0.00 0.00 34.50 32.11 3ks0 s PRO 58 CO 0.45 -1.04 0.00 0.41 -0.33 0.00 0.00 177.00 176.48 3ks0 n GLY 59 N 0.58 0.63 3.63 0.52 0.00 -1.26 -5.02 105.19 104.26 3ks0 n GLY 59 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 3ks0 n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ks0 s VAL 60 N -2.18 5.04 0.12 1.61 1.01 -1.17 -5.05 120.40 119.79 3ks0 s VAL 60 Ca 0.00 0.07 -0.35 0.00 0.00 0.00 0.00 61.98 61.70 3ks0 s VAL 60 Cb 0.00 -3.33 -0.17 0.00 0.00 0.00 0.00 36.38 32.89 3ks0 s VAL 60 CO 0.00 0.39 1.18 -2.65 0.00 0.00 0.00 175.10 174.01 3ks0 n PRO 61 N 4.09 0.93 0.29 2.72 -0.02 -1.26 -4.87 135.00 136.88 3ks0 n PRO 61 Ca -0.16 0.33 0.18 0.00 -2.02 0.00 0.00 63.50 61.84 3ks0 n PRO 61 Cb 0.52 -1.85 0.97 0.00 -0.02 0.00 0.00 33.50 33.12 3ks0 n PRO 61 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ks0 h ALA 62 N 3.60 1.07 0.00 3.55 0.00 -2.00 -2.14 119.26 123.35 3ks0 h ALA 62 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3ks0 h ALA 62 Cb 1.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.15 3ks0 h ALA 62 CO 0.71 -0.07 0.00 2.89 0.00 0.00 0.00 179.25 182.78 3ks0 n ARG 63 N -2.81 0.02 -3.48 0.00 1.85 -1.26 -4.49 116.66 106.49 3ks0 n ARG 63 Ca -0.02 0.50 -0.38 0.00 -1.00 0.00 0.00 57.85 56.94 3ks0 n ARG 63 Cb 0.13 -1.56 -0.09 0.00 -1.05 0.00 0.00 32.46 29.89 3ks0 n ARG 63 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 3ks0 s PHE 64 N -3.07 3.27 0.04 2.89 0.40 -0.81 -1.21 117.98 119.50 3ks0 s PHE 64 Ca 0.00 0.34 0.01 0.00 -0.60 0.00 0.00 56.93 56.69 3ks0 s PHE 64 Cb 0.02 -2.47 -0.03 0.00 0.51 0.00 0.00 43.02 41.05 3ks0 s PHE 64 CO 0.05 -0.14 -0.06 -1.54 0.70 0.00 0.00 175.22 174.23 3ks0 s SER 65 N 1.50 0.69 0.12 1.36 1.04 -0.11 -4.92 113.70 113.37 3ks0 s SER 65 Ca 0.13 -0.59 0.10 0.00 0.48 0.00 0.00 55.95 56.06 3ks0 s SER 65 Cb -0.15 0.07 -0.04 0.00 0.10 0.00 0.00 66.02 66.00 3ks0 s SER 65 CO 0.09 -0.27 -0.25 -0.83 0.98 0.00 0.00 173.24 172.96 3ks0 s GLY 66 N -1.73 1.45 0.38 7.32 0.00 -1.26 0.59 107.32 114.08 3ks0 s GLY 66 Ca -0.09 -1.38 -0.10 0.00 0.00 0.00 0.00 44.72 43.14 3ks0 s GLY 66 CO -0.01 -1.36 0.69 -1.14 0.00 0.00 0.00 173.10 171.28 3ks0 n SER 67 N 1.01 -1.99 -4.18 1.64 3.41 -0.42 -4.42 113.62 108.67 3ks0 n SER 67 Ca -0.18 -2.69 -0.40 0.00 -0.26 0.00 0.00 58.87 55.33 3ks0 n SER 67 Cb 0.53 3.40 -0.09 0.00 -0.26 0.00 0.00 64.21 67.80 3ks0 n SER 67 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3ks0 s LEU 68 N 0.00 5.62 -0.24 1.04 1.02 -1.26 -1.19 118.68 123.67 3ks0 s LEU 68 Ca 0.20 -2.14 -0.10 0.00 0.02 0.00 0.00 54.13 52.12 3ks0 s LEU 68 Cb -0.04 -1.97 -0.05 0.00 0.02 0.00 0.00 46.19 44.16 3ks0 s LEU 68 CO 0.15 -0.61 0.14 -0.63 0.02 0.00 0.00 176.35 175.42 3ks0 s ILE 69 N 1.01 5.13 0.00 -0.59 1.01 -0.28 -4.93 121.20 122.55 3ks0 s ILE 69 Ca 0.09 0.10 0.00 0.00 0.00 0.00 0.00 60.65 60.84 3ks0 s ILE 69 Cb -0.23 -3.39 0.00 0.00 0.01 0.00 0.00 42.46 38.85 3ks0 s ILE 69 CO -0.02 0.35 0.00 0.61 0.00 0.00 0.00 174.94 175.88 3ks0 n GLY 70 N 4.35 2.67 1.97 6.18 0.00 -1.26 -0.76 105.19 118.33 3ks0 n GLY 70 Ca -0.15 0.18 -0.06 0.00 0.00 0.00 0.00 46.02 45.99 3ks0 n GLY 70 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ks0 n ASP 71 N 2.88 4.74 -3.96 1.61 8.00 -1.26 -4.86 116.55 123.70 3ks0 n ASP 71 Ca 0.00 -3.16 -0.09 0.00 0.71 0.00 0.00 54.79 52.25 3ks0 n ASP 71 Cb 0.00 -0.74 -0.08 0.00 -0.02 0.00 0.00 41.12 40.28 3ks0 n ASP 71 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 3ks0 s LYS 72 N -2.87 0.90 0.59 -1.24 0.00 0.06 -2.41 119.74 114.77 3ks0 s LYS 72 Ca 0.53 -1.12 -0.16 0.00 0.00 0.00 0.00 55.97 55.22 3ks0 s LYS 72 Cb 0.42 0.32 -0.04 0.00 0.00 0.00 0.00 37.83 38.53 3ks0 s LYS 72 CO 0.13 -0.28 1.06 0.00 0.00 0.00 0.00 175.35 176.26 3ks0 s ALA 73 N -3.92 2.75 -0.02 0.59 0.00 -1.01 -1.13 121.76 119.02 3ks0 s ALA 73 Ca 0.11 0.40 0.01 0.00 0.00 0.00 0.00 51.96 52.48 3ks0 s ALA 73 Cb 0.05 -3.23 0.01 0.00 0.00 0.00 0.00 23.12 19.95 3ks0 s ALA 73 CO -0.06 -0.79 -0.04 0.00 0.00 0.00 0.00 175.76 174.87 3ks0 s ALA 74 N -2.44 0.49 -0.32 0.00 0.00 -0.33 -0.32 121.76 118.84 3ks0 s ALA 74 Ca 0.64 -0.08 -0.12 0.00 0.00 0.00 0.00 51.96 52.40 3ks0 s ALA 74 Cb -0.16 -0.25 -0.02 0.00 0.00 0.00 0.00 23.12 22.68 3ks0 s ALA 74 CO 0.36 0.04 0.21 -1.17 0.00 0.00 0.00 175.76 175.20 3ks0 s LEU 75 N 0.45 4.31 -0.20 0.00 2.96 0.10 -1.30 118.68 125.00 3ks0 s LEU 75 Ca -0.05 -0.33 -0.07 0.00 -0.22 0.00 0.00 54.13 53.45 3ks0 s LEU 75 Cb -0.09 -2.11 -0.04 0.00 0.50 0.00 0.00 46.19 44.46 3ks0 s LEU 75 CO -0.00 -0.18 0.06 -0.89 -1.32 0.00 0.00 176.35 174.02 3ks0 s THR 76 N 1.71 4.57 -0.31 3.68 2.01 0.20 -0.32 115.64 127.19 3ks0 s THR 76 Ca 0.06 -0.10 -0.05 0.00 0.31 0.00 0.00 61.69 61.91 3ks0 s THR 76 Cb -0.17 -3.08 0.03 0.00 0.01 0.00 0.00 72.50 69.29 3ks0 s THR 76 CO 0.10 0.42 0.05 -0.63 -0.69 0.00 0.00 174.62 173.86 3ks0 s ILE 77 N 0.80 3.48 -0.49 1.82 1.01 0.92 -0.93 121.20 127.81 3ks0 s ILE 77 Ca 0.03 -1.09 -0.15 0.00 0.00 0.00 0.00 60.65 59.44 3ks0 s ILE 77 Cb -0.14 -2.91 0.09 0.00 0.01 0.00 0.00 42.46 39.51 3ks0 s ILE 77 CO 0.02 -0.05 0.42 -0.89 0.00 0.00 0.00 174.94 174.45 3ks0 s THR 78 N 1.37 5.19 0.00 2.92 2.01 -0.35 -0.11 115.64 126.67 3ks0 s THR 78 Ca -0.01 -1.21 0.00 0.00 0.31 0.00 0.00 61.69 60.78 3ks0 s THR 78 Cb -0.19 -4.17 0.00 0.00 0.01 0.00 0.00 72.50 68.15 3ks0 s THR 78 CO 0.01 -0.66 0.00 0.61 -0.69 0.00 0.00 174.62 173.88 3ks0 n GLY 79 N 5.21 -0.00 3.78 4.40 0.00 -0.83 -4.72 105.19 113.02 3ks0 n GLY 79 Ca -0.13 -0.32 -0.37 0.00 0.00 0.00 0.00 46.02 45.20 3ks0 n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ks0 s ALA 80 N -2.78 3.11 0.21 4.61 0.00 -0.02 -4.58 121.76 122.30 3ks0 s ALA 80 Ca 0.00 0.78 0.08 0.00 0.00 0.00 0.00 51.96 52.82 3ks0 s ALA 80 Cb 0.00 -3.30 -0.04 0.00 0.00 0.00 0.00 23.12 19.78 3ks0 s ALA 80 CO 0.00 -0.30 -0.01 -0.65 0.00 0.00 0.00 175.76 174.80 3ks0 s GLN 81 N -2.41 2.32 0.51 0.00 -0.21 -1.26 -0.61 119.66 117.99 3ks0 s GLN 81 Ca 0.57 -1.24 0.24 0.00 0.02 0.00 0.00 55.36 54.95 3ks0 s GLN 81 Cb -0.25 -2.26 1.34 0.00 1.00 0.00 0.00 33.01 32.85 3ks0 s GLN 81 CO 0.31 0.42 1.96 1.79 -2.12 0.00 0.00 175.29 177.64 3ks0 h THR 82 N 2.29 0.71 0.00 -0.19 1.35 -1.92 0.25 112.91 115.39 3ks0 h THR 82 Ca -0.46 -0.03 0.00 0.00 -0.55 0.00 0.00 66.41 65.37 3ks0 h THR 82 Cb 1.22 0.61 0.00 0.00 -1.73 0.00 0.00 68.15 68.25 3ks0 h THR 82 CO 0.58 0.02 0.00 -1.84 -0.25 0.00 0.00 175.52 174.03 3ks0 n GLU 83 N -4.38 0.11 0.00 4.72 0.00 -1.26 -2.34 120.64 117.49 3ks0 n GLU 83 Ca 0.13 0.03 0.13 0.00 0.00 0.00 0.00 57.16 57.44 3ks0 n GLU 83 Cb 0.66 -1.50 0.74 0.00 0.00 0.00 0.00 31.44 31.35 3ks0 n GLU 83 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 3ks0 n ASP 84 N -1.44 0.00 -4.57 -1.84 8.00 0.87 -4.73 116.55 112.84 3ks0 n ASP 84 Ca 0.08 -0.61 -0.40 0.00 0.71 0.00 0.00 54.79 54.58 3ks0 n ASP 84 Cb 0.29 -0.08 -0.03 0.00 -0.02 0.00 0.00 41.12 41.28 3ks0 n ASP 84 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3ks0 s GLU 85 N -2.16 2.77 -0.08 -1.24 2.12 -0.99 -4.88 118.70 114.24 3ks0 s GLU 85 Ca 0.35 1.03 -0.31 0.00 0.36 0.00 0.00 54.97 56.41 3ks0 s GLU 85 Cb 0.18 -4.36 0.11 0.00 0.26 0.00 0.00 34.13 30.32 3ks0 s GLU 85 CO 0.33 -2.54 1.37 0.00 -0.54 0.00 0.00 175.26 173.87 3ks0 s ALA 86 N 8.92 -2.66 -0.16 6.30 0.00 -1.02 -4.92 121.76 128.22 3ks0 s ALA 86 Ca 0.77 0.33 -0.18 0.00 0.00 0.00 0.00 51.96 52.89 3ks0 s ALA 86 Cb -0.17 0.77 -0.04 0.00 0.00 0.00 0.00 23.12 23.68 3ks0 s ALA 86 CO 0.26 -1.15 0.47 0.42 0.00 0.00 0.00 175.76 175.77 3ks0 s ILE 87 N -2.03 5.17 -0.19 0.00 1.01 -0.77 -1.79 121.20 122.60 3ks0 s ILE 87 Ca 0.27 0.91 -0.05 0.00 0.00 0.00 0.00 60.65 61.78 3ks0 s ILE 87 Cb 0.02 -3.81 -0.03 0.00 0.01 0.00 0.00 42.46 38.65 3ks0 s ILE 87 CO -0.03 0.27 0.01 -0.31 0.00 0.00 0.00 174.94 174.88 3ks0 s TYR 88 N 1.01 3.08 -0.15 3.97 1.51 0.20 -0.78 117.35 126.19 3ks0 s TYR 88 Ca 0.24 -0.32 -0.05 0.00 -1.01 0.00 0.00 57.07 55.93 3ks0 s TYR 88 Cb -0.15 -2.07 -0.04 0.00 -0.11 0.00 0.00 41.96 39.60 3ks0 s TYR 88 CO 0.09 -0.13 0.03 -0.06 -1.11 0.00 0.00 175.55 174.37 3ks0 s PHE 89 N 0.79 3.19 0.06 2.71 0.08 0.19 0.26 117.98 125.27 3ks0 s PHE 89 Ca 0.01 0.04 -0.01 0.00 0.12 0.00 0.00 56.93 57.08 3ks0 s PHE 89 Cb -0.14 -1.97 -0.04 0.00 -0.57 0.00 0.00 43.02 40.29 3ks0 s PHE 89 CO 0.02 0.22 0.23 0.00 -0.10 0.00 0.00 175.22 175.59 3ks0 s ALA 91 N -1.49 -0.20 -0.02 0.00 0.00 0.11 -1.96 121.76 118.21 3ks0 s ALA 91 Ca 0.34 0.40 0.06 0.00 0.00 0.00 0.00 51.96 52.76 3ks0 s ALA 91 Cb -0.13 -0.26 -0.01 0.00 0.00 0.00 0.00 23.12 22.72 3ks0 s ALA 91 CO 0.25 -0.09 -0.20 -0.51 0.00 0.00 0.00 175.76 175.22 3ks0 s LEU 92 N 0.52 2.04 -0.67 0.00 1.43 0.12 -1.11 118.68 121.00 3ks0 s LEU 92 Ca -0.04 -0.36 -0.27 0.00 -1.03 0.00 0.00 54.13 52.43 3ks0 s LEU 92 Cb -0.06 -1.01 0.01 0.00 0.03 0.00 0.00 46.19 45.17 3ks0 s LEU 92 CO -0.02 0.24 1.45 0.26 0.23 0.00 0.00 176.35 178.51 3ks0 s TRP 93 N -0.45 2.13 -0.08 0.29 0.52 -0.29 0.90 118.94 121.95 3ks0 s TRP 93 Ca 0.07 0.28 0.04 0.00 0.02 0.00 0.00 56.10 56.51 3ks0 s TRP 93 Cb -0.08 -4.44 -0.00 0.00 -1.15 0.00 0.00 33.47 27.80 3ks0 s TRP 93 CO -0.01 -2.11 -0.22 0.34 0.02 0.00 0.00 176.95 174.97 3ks0 s ASP 94 N 4.98 2.86 -1.26 2.95 -1.08 0.12 -4.52 116.67 120.72 3ks0 s ASP 94 Ca 0.47 -0.50 -0.14 0.00 -0.52 0.00 0.00 52.55 51.85 3ks0 s ASP 94 Cb -0.10 -1.18 0.00 0.00 -1.46 0.00 0.00 42.92 40.18 3ks0 s ASP 94 CO 0.19 0.16 0.63 -1.20 0.52 0.00 0.00 175.17 175.46 3ks0 n SER 95 N 3.43 -3.15 -1.24 -0.34 7.64 -1.26 -0.98 113.62 117.72 3ks0 n SER 95 Ca -0.19 -1.05 -0.11 0.00 1.01 0.00 0.00 58.87 58.53 3ks0 n SER 95 Cb 0.53 -3.05 -0.05 0.00 -1.01 0.00 0.00 64.21 60.63 3ks0 n SER 95 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3ks0 n ASN 96 N -2.74 -3.06 -4.15 6.43 5.03 -1.26 -4.92 115.26 110.59 3ks0 n ASN 96 Ca -0.18 0.27 -0.28 0.00 0.87 0.00 0.00 54.58 55.25 3ks0 n ASN 96 Cb 0.63 -2.85 -0.16 0.00 -1.02 0.00 0.00 39.78 36.37 3ks0 n ASN 96 CO 0.00 0.00 0.00 -1.00 -1.83 0.00 0.00 177.26 174.43 3ks0 s HIS 97 N -1.88 1.96 -0.21 3.10 3.76 -0.15 -5.13 115.29 116.75 3ks0 s HIS 97 Ca 0.00 -0.66 -0.23 0.00 -0.15 0.00 0.00 55.06 54.02 3ks0 s HIS 97 Cb 0.00 -1.33 -0.01 0.00 1.11 0.00 0.00 32.58 32.35 3ks0 s HIS 97 CO 0.00 -0.25 0.76 -1.17 -0.85 0.00 0.00 174.74 173.23 3ks0 s LEU 98 N 0.19 4.12 -0.13 0.89 2.96 -1.26 -0.71 118.68 124.74 3ks0 s LEU 98 Ca -0.09 0.99 0.01 0.00 -0.22 0.00 0.00 54.13 54.82 3ks0 s LEU 98 Cb -0.14 -3.09 0.02 0.00 0.50 0.00 0.00 46.19 43.48 3ks0 s LEU 98 CO 0.04 -0.41 -0.14 -0.69 -1.32 0.00 0.00 176.35 173.83 3ks0 s VAL 99 N 2.38 1.51 0.40 1.68 1.01 0.26 -4.93 120.40 122.71 3ks0 s VAL 99 Ca 0.33 -0.61 -0.23 0.00 0.00 0.00 0.00 61.98 61.47 3ks0 s VAL 99 Cb -0.16 -1.41 -0.10 0.00 0.00 0.00 0.00 36.38 34.72 3ks0 s VAL 99 CO 0.10 0.45 1.00 -0.36 0.00 0.00 0.00 175.10 176.29 3ks0 s PHE 100 N 1.30 3.33 0.26 5.22 2.99 -1.26 -0.71 117.98 129.11 3ks0 s PHE 100 Ca 0.00 1.66 -0.01 0.00 0.00 0.00 0.00 56.93 58.58 3ks0 s PHE 100 Cb -0.14 -3.02 0.05 0.00 0.00 0.00 0.00 43.02 39.92 3ks0 s PHE 100 CO -0.07 -0.36 0.36 0.41 -0.00 0.00 0.00 175.22 175.56 3ks0 n GLY 101 N 0.10 0.33 0.30 4.36 0.00 -0.83 -4.54 105.19 104.92 3ks0 n GLY 101 Ca 0.05 -1.92 0.01 0.00 0.00 0.00 0.00 46.02 44.17 3ks0 n GLY 101 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ks0 n GLY 102 N 2.37 -0.03 1.09 -0.02 0.00 -1.26 -4.81 105.19 102.55 3ks0 n GLY 102 Ca 0.06 -0.11 0.10 0.00 0.00 0.00 0.00 46.02 46.06 3ks0 n GLY 102 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ks0 n GLY 103 N 0.53 -3.32 3.45 -0.02 0.00 -1.26 -4.98 105.19 99.59 3ks0 n GLY 103 Ca 0.03 -1.11 -0.33 0.00 0.00 0.00 0.00 46.02 44.62 3ks0 n GLY 103 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ks0 s THR 104 N -4.21 3.00 -0.41 2.61 2.01 0.14 -4.64 115.64 114.14 3ks0 s THR 104 Ca 0.00 -0.73 -0.18 0.00 0.31 0.00 0.00 61.69 61.09 3ks0 s THR 104 Cb 0.00 -2.19 0.02 0.00 0.01 0.00 0.00 72.50 70.34 3ks0 s THR 104 CO 0.00 0.58 0.48 -0.75 -0.69 0.00 0.00 174.62 174.24 3ks0 s LYS 105 N -0.51 3.22 -0.28 4.92 2.47 -1.05 0.59 119.74 129.10 3ks0 s LYS 105 Ca 0.07 -0.60 -0.10 0.00 -1.56 0.00 0.00 55.97 53.78 3ks0 s LYS 105 Cb -0.12 -3.94 -0.03 0.00 -1.46 0.00 0.00 37.83 32.29 3ks0 s LYS 105 CO 0.02 -0.84 0.15 -1.17 0.16 0.00 0.00 175.35 173.67 3ks0 s LEU 106 N 2.29 3.92 -0.18 5.43 2.96 -0.74 -0.96 118.68 131.40 3ks0 s LEU 106 Ca 0.15 -0.24 -0.12 0.00 -0.22 0.00 0.00 54.13 53.70 3ks0 s LEU 106 Cb -0.16 -2.04 -0.05 0.00 0.50 0.00 0.00 46.19 44.44 3ks0 s LEU 106 CO 0.14 -0.10 0.22 -0.89 -1.32 0.00 0.00 176.35 174.41 3ks0 s THR 107 N 1.68 5.35 -0.35 3.68 2.01 0.88 -2.43 115.64 126.45 3ks0 s THR 107 Ca 0.06 0.40 0.04 0.00 0.31 0.00 0.00 61.69 62.49 3ks0 s THR 107 Cb -0.16 -3.56 0.10 0.00 0.01 0.00 0.00 72.50 68.89 3ks0 s THR 107 CO 0.08 0.41 0.07 -0.69 -0.69 0.00 0.00 174.62 173.80 3ks0 s VAL 108 N 0.42 2.17 -0.43 3.82 1.01 -1.24 -0.48 120.40 125.67 3ks0 s VAL 108 Ca 0.13 -2.35 -0.32 0.00 0.00 0.00 0.00 61.98 59.44 3ks0 s VAL 108 Cb -0.12 -2.60 -0.11 0.00 0.00 0.00 0.00 36.38 33.55 3ks0 s VAL 108 CO 0.01 -0.63 2.29 0.18 0.00 0.00 0.00 175.10 176.96 3ks0 n LEU 109 N 4.20 2.12 -1.25 3.92 4.77 0.36 -4.62 117.00 126.50 3ks0 n LEU 109 Ca 0.04 0.18 0.11 0.00 -0.03 0.00 0.00 56.01 56.31 3ks0 n LEU 109 Cb 0.41 -1.33 0.30 0.00 -2.33 0.00 0.00 43.42 40.47 3ks0 n LEU 109 CO 0.22 -0.89 0.75 0.61 -1.33 0.00 0.00 177.39 176.76 3ks0 n GLY 110 N 6.34 2.16 0.00 -0.72 0.00 -1.26 -4.33 105.19 107.38 3ks0 n GLY 110 Ca 0.42 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.69 3ks0 n GLY 110 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ks0 n GLN 111 N 1.50 0.00 -1.66 1.61 10.64 -1.26 -5.15 117.38 123.05 3ks0 n GLN 111 Ca 0.23 0.00 -0.36 0.00 -1.83 0.00 0.00 57.00 55.04 3ks0 n GLN 111 Cb 0.58 0.00 0.07 0.00 -0.86 0.00 0.00 30.24 30.03 3ks0 n GLN 111 CO 0.00 0.00 0.00 -2.14 -1.83 0.00 0.00 177.06 173.09 3ks0 s PRO 112 N -2.00 2.44 0.59 2.61 0.02 -1.26 -4.94 135.00 132.46 3ks0 s PRO 112 Ca 0.00 1.94 -0.20 0.00 0.02 0.00 0.00 61.00 62.77 3ks0 s PRO 112 Cb 0.00 -1.85 -0.03 0.00 0.02 0.00 0.00 34.50 32.64 3ks0 s PRO 112 CO 0.00 -1.65 1.29 1.63 -0.33 0.00 0.00 177.00 177.94 3ks0 n LYS 113 N -2.15 1.36 -4.06 5.54 5.02 -1.26 -4.94 118.16 117.67 3ks0 n LYS 113 Ca 0.15 0.51 -0.13 0.00 -2.02 0.00 0.00 58.31 56.82 3ks0 n LYS 113 Cb 0.49 -2.51 -0.12 0.00 -0.02 0.00 0.00 35.03 32.87 3ks0 n LYS 113 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3ks0 s SER 114 N -1.14 0.69 0.46 4.39 1.04 -0.55 -4.96 113.70 113.63 3ks0 s SER 114 Ca 0.77 -0.44 -0.10 0.00 0.48 0.00 0.00 55.95 56.65 3ks0 s SER 114 Cb -0.40 0.03 -0.06 0.00 0.10 0.00 0.00 66.02 65.68 3ks0 s SER 114 CO 0.45 -0.16 0.84 -0.94 0.98 0.00 0.00 173.24 174.41 3ks0 s SER 115 N -1.24 6.44 0.76 7.02 1.04 -1.26 -1.69 113.70 124.78 3ks0 s SER 115 Ca -0.08 1.19 -0.11 0.00 0.48 0.00 0.00 55.95 57.42 3ks0 s SER 115 Cb -0.08 -2.35 0.05 0.00 0.10 0.00 0.00 66.02 63.74 3ks0 s SER 115 CO 0.00 -0.52 1.10 -2.84 0.98 0.00 0.00 173.24 171.96 3ks0 s PRO 116 N -4.24 2.26 -0.44 4.02 0.02 -1.26 -4.50 135.00 130.86 3ks0 s PRO 116 Ca 0.52 1.25 0.03 0.00 0.02 0.00 0.00 61.00 62.83 3ks0 s PRO 116 Cb -0.10 -1.89 0.12 0.00 0.02 0.00 0.00 34.50 32.65 3ks0 s PRO 116 CO 0.37 -1.65 0.19 0.45 -0.33 0.00 0.00 177.00 176.02 3ks0 s SER 117 N -3.15 4.26 0.04 2.53 0.15 -0.58 -4.95 113.70 111.99 3ks0 s SER 117 Ca 0.63 -2.60 -0.13 0.00 0.70 0.00 0.00 55.95 54.56 3ks0 s SER 117 Cb -0.18 -1.44 -0.06 0.00 -1.71 0.00 0.00 66.02 62.63 3ks0 s SER 117 CO 0.53 -0.29 0.41 -0.69 1.20 0.00 0.00 173.24 174.40 3ks0 s VAL 118 N 0.31 5.06 -0.11 4.45 1.01 -1.26 -2.57 120.40 127.29 3ks0 s VAL 118 Ca 0.15 0.67 -0.04 0.00 0.00 0.00 0.00 61.98 62.76 3ks0 s VAL 118 Cb -0.23 -3.68 0.05 0.00 0.00 0.00 0.00 36.38 32.52 3ks0 s VAL 118 CO -0.04 0.45 0.22 -0.89 0.00 0.00 0.00 175.10 174.84 3ks0 s THR 119 N -1.22 -0.27 -0.28 3.92 2.01 -0.30 -4.97 115.64 114.52 3ks0 s THR 119 Ca 0.28 0.27 -0.10 0.00 0.31 0.00 0.00 61.69 62.45 3ks0 s THR 119 Cb -0.15 -0.38 -0.03 0.00 0.01 0.00 0.00 72.50 71.95 3ks0 s THR 119 CO 0.15 0.11 0.16 -0.22 -0.69 0.00 0.00 174.62 174.13 3ks0 s LEU 120 N 2.05 3.92 -0.18 4.42 2.96 -1.26 -1.43 118.68 129.15 3ks0 s LEU 120 Ca -0.01 -0.18 -0.09 0.00 -0.22 0.00 0.00 54.13 53.62 3ks0 s LEU 120 Cb -0.12 -2.05 -0.05 0.00 0.50 0.00 0.00 46.19 44.48 3ks0 s LEU 120 CO -0.08 -0.09 0.13 -0.36 -1.32 0.00 0.00 176.35 174.63 3ks0 s PHE 121 N 1.69 3.43 1.14 5.38 0.08 -0.20 -4.97 117.98 124.53 3ks0 s PHE 121 Ca 0.06 0.34 -0.17 0.00 0.12 0.00 0.00 56.93 57.29 3ks0 s PHE 121 Cb -0.16 -2.11 0.26 0.00 -0.57 0.00 0.00 43.02 40.43 3ks0 s PHE 121 CO 0.08 0.36 1.10 -2.14 -0.10 0.00 0.00 175.22 174.52 3ks0 s PRO 122 N 0.12 -0.72 0.30 0.24 0.02 -1.26 -1.91 135.00 131.79 3ks0 s PRO 122 Ca 0.09 0.14 -0.29 0.00 0.02 0.00 0.00 61.00 60.96 3ks0 s PRO 122 Cb -0.11 -1.64 -0.10 0.00 0.02 0.00 0.00 34.50 32.67 3ks0 s PRO 122 CO -0.01 -3.42 1.20 -1.25 -0.33 0.00 0.00 177.00 173.19 3ks0 s PRO 123 N -5.23 4.51 0.58 5.54 0.05 -1.25 -4.70 135.00 134.49 3ks0 s PRO 123 Ca 0.69 2.00 -0.17 0.00 0.05 0.00 0.00 61.00 63.56 3ks0 s PRO 123 Cb -0.13 -3.14 -0.04 0.00 0.05 0.00 0.00 34.50 31.24 3ks0 s PRO 123 CO 0.57 0.02 1.09 -1.54 0.05 0.00 0.00 177.00 177.18 3ks0 s SER 124 N -0.66 5.70 0.43 6.66 1.04 -1.26 -4.93 113.70 120.68 3ks0 s SER 124 Ca 0.47 1.99 0.15 0.00 0.48 0.00 0.00 55.95 59.03 3ks0 s SER 124 Cb -0.36 -2.56 0.94 0.00 0.10 0.00 0.00 66.02 64.15 3ks0 s SER 124 CO 0.46 -1.23 1.94 0.77 0.98 0.00 0.00 173.24 176.17 3ks0 h SER 125 N 0.77 0.00 -0.48 7.02 4.64 -2.00 -2.10 113.55 121.40 3ks0 h SER 125 Ca -0.48 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.77 3ks0 h SER 125 Cb 1.24 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.31 3ks0 h SER 125 CO 0.57 0.24 0.03 -0.33 -0.87 0.00 0.00 176.83 176.47 3ks0 h GLU 126 N 0.00 0.83 -0.18 4.77 5.08 -2.00 -3.08 114.58 120.00 3ks0 h GLU 126 Ca -0.00 -0.25 -0.03 0.00 -1.00 0.00 0.00 59.36 58.08 3ks0 h GLU 126 Cb 0.43 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 3ks0 h GLU 126 CO 0.03 0.86 -0.03 1.49 -1.00 0.00 0.00 179.01 180.36 3ks0 h GLU 127 N 0.69 0.26 -0.06 2.33 4.81 -1.72 -2.76 114.58 118.12 3ks0 h GLU 127 Ca 0.14 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.27 3ks0 h GLU 127 Cb 0.46 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 3ks0 h GLU 127 CO 0.02 0.31 -0.24 -0.07 -0.73 0.00 0.00 179.01 178.29 3ks0 h LEU 128 N 0.25 0.11 -0.26 1.64 3.38 -1.36 -2.21 115.31 116.86 3ks0 h LEU 128 Ca 0.06 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3ks0 h LEU 128 Cb 0.22 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.95 3ks0 h LEU 128 CO 0.01 0.36 0.00 -0.62 0.09 0.00 0.00 178.44 178.27 3ks0 n GLU 129 N -4.21 0.27 0.00 1.13 1.02 -1.04 -0.48 120.64 117.32 3ks0 n GLU 129 Ca -0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 3ks0 n GLU 129 Cb 0.32 -1.03 0.00 0.00 -0.02 0.00 0.00 31.44 30.71 3ks0 n GLU 129 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3ks0 n THR 130 N -0.27 0.39 -1.94 2.62 -2.24 -0.83 -4.97 114.28 107.04 3ks0 n THR 130 Ca 0.00 -0.66 -0.16 0.00 -2.27 0.00 0.00 64.05 60.96 3ks0 n THR 130 Cb 0.02 0.84 -0.03 0.00 -2.10 0.00 0.00 70.33 69.06 3ks0 n THR 130 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3ks0 n ASN 131 N -0.20 -4.76 -4.32 3.42 3.02 0.36 -4.96 115.26 107.83 3ks0 n ASN 131 Ca 0.00 0.15 -0.20 0.00 -0.03 0.00 0.00 54.58 54.50 3ks0 n ASN 131 Cb 0.12 -3.78 -0.11 0.00 -0.61 0.00 0.00 39.78 35.40 3ks0 n ASN 131 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3ks0 s LYS 132 N -4.16 1.24 -0.12 3.52 -0.14 -1.24 -0.73 119.74 118.11 3ks0 s LYS 132 Ca 0.00 -1.42 -0.11 0.00 -1.36 0.00 0.00 55.97 53.08 3ks0 s LYS 132 Cb 0.00 -1.22 0.03 0.00 -1.68 0.00 0.00 37.83 34.96 3ks0 s LYS 132 CO 0.00 0.24 0.33 0.00 -0.76 0.00 0.00 175.35 175.15 3ks0 s ALA 133 N -2.25 -0.81 -0.22 5.17 0.00 0.09 -3.36 121.76 120.38 3ks0 s ALA 133 Ca 0.16 0.95 -0.04 0.00 0.00 0.00 0.00 51.96 53.03 3ks0 s ALA 133 Cb -0.05 -0.55 0.09 0.00 0.00 0.00 0.00 23.12 22.61 3ks0 s ALA 133 CO 0.06 -0.16 0.20 0.99 0.00 0.00 0.00 175.76 176.85 3ks0 s THR 134 N 0.26 -0.28 0.33 0.00 2.01 -1.26 -0.55 115.64 116.15 3ks0 s THR 134 Ca -0.01 -0.23 -0.26 0.00 0.31 0.00 0.00 61.69 61.51 3ks0 s THR 134 Cb -0.03 -0.73 -0.10 0.00 0.01 0.00 0.00 72.50 71.65 3ks0 s THR 134 CO -0.00 -0.30 0.95 -0.76 -0.69 0.00 0.00 174.62 173.82 3ks0 s LEU 135 N 2.28 4.33 -0.10 4.42 1.43 -0.78 -3.84 118.68 126.42 3ks0 s LEU 135 Ca 0.07 1.86 0.01 0.00 -1.03 0.00 0.00 54.13 55.03 3ks0 s LEU 135 Cb -0.16 -4.02 0.02 0.00 0.03 0.00 0.00 46.19 42.06 3ks0 s LEU 135 CO -0.16 -0.10 -0.11 -0.69 0.23 0.00 0.00 176.35 175.52 3ks0 s VAL 136 N -1.61 1.22 -0.37 -1.59 1.01 -0.80 -1.47 120.40 116.79 3ks0 s VAL 136 Ca 0.51 -0.46 -0.03 0.00 0.00 0.00 0.00 61.98 62.00 3ks0 s VAL 136 Cb -0.19 -1.16 0.09 0.00 0.00 0.00 0.00 36.38 35.11 3ks0 s VAL 136 CO 0.24 0.39 0.14 0.00 0.00 0.00 0.00 175.10 175.87 3ks0 s THR 138 N 1.20 5.14 -0.28 0.00 -4.23 -0.51 -0.37 115.64 116.58 3ks0 s THR 138 Ca 0.04 1.00 -0.00 0.00 -1.18 0.00 0.00 61.69 61.55 3ks0 s THR 138 Cb -0.22 -3.85 0.05 0.00 1.34 0.00 0.00 72.50 69.83 3ks0 s THR 138 CO -0.03 0.26 -0.04 -0.63 -0.54 0.00 0.00 174.62 173.64 3ks0 s ILE 139 N 1.00 2.69 0.24 2.99 1.01 0.74 -1.16 121.20 128.73 3ks0 s ILE 139 Ca 0.26 -1.44 0.10 0.00 0.00 0.00 0.00 60.65 59.58 3ks0 s ILE 139 Cb -0.15 -2.54 -0.05 0.00 0.01 0.00 0.00 42.46 39.73 3ks0 s ILE 139 CO 0.11 -0.05 -0.11 0.42 0.00 0.00 0.00 174.94 175.31 3ks0 s THR 140 N 1.21 2.99 -1.57 2.92 -4.23 -1.06 0.17 115.64 116.06 3ks0 s THR 140 Ca -0.06 -2.02 0.00 0.00 -1.18 0.00 0.00 61.69 58.43 3ks0 s THR 140 Cb -0.20 -2.55 0.00 0.00 1.34 0.00 0.00 72.50 71.10 3ks0 s THR 140 CO -0.03 -0.30 0.00 0.47 -0.54 0.00 0.00 174.62 174.22 3ks0 n ASP 141 N -0.49 -4.88 -4.85 3.99 8.00 -0.62 -1.53 116.55 116.16 3ks0 n ASP 141 Ca -0.08 0.22 -0.35 0.00 0.71 0.00 0.00 54.79 55.30 3ks0 n ASP 141 Cb 0.58 -3.89 -0.06 0.00 -0.02 0.00 0.00 41.12 37.74 3ks0 n ASP 141 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 3ks0 s PHE 142 N -2.69 3.59 -0.26 1.24 -0.71 -0.51 -4.51 117.98 114.13 3ks0 s PHE 142 Ca 0.00 0.94 -0.09 0.00 -1.04 0.00 0.00 56.93 56.74 3ks0 s PHE 142 Cb 0.00 -2.28 0.11 0.00 -1.21 0.00 0.00 43.02 39.65 3ks0 s PHE 142 CO 0.00 0.46 0.57 -0.47 -1.34 0.00 0.00 175.22 174.44 3ks0 s TYR 143 N -1.45 -1.13 0.63 3.49 5.04 -0.68 -0.43 117.35 122.81 3ks0 s TYR 143 Ca 0.36 2.03 -0.12 0.00 -2.44 0.00 0.00 57.07 56.90 3ks0 s TYR 143 Cb -0.14 0.62 -0.03 0.00 0.35 0.00 0.00 41.96 42.76 3ks0 s TYR 143 CO 0.19 -0.59 1.04 -2.14 -1.34 0.00 0.00 175.55 172.70 3ks0 s PRO 144 N 2.71 3.38 0.00 4.97 0.02 -1.26 -1.49 135.00 143.33 3ks0 s PRO 144 Ca -0.05 0.91 0.00 0.00 0.02 0.00 0.00 61.00 61.88 3ks0 s PRO 144 Cb -0.12 -2.05 0.00 0.00 0.02 0.00 0.00 34.50 32.35 3ks0 s PRO 144 CO -0.17 -0.75 0.41 0.41 -0.33 0.00 0.00 177.00 176.58 3ks0 n GLY 145 N -2.10 0.81 3.58 0.52 0.00 -1.26 -4.80 105.19 101.94 3ks0 n GLY 145 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 3ks0 n GLY 145 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ks0 s VAL 146 N 0.64 4.39 -0.21 1.61 1.01 -1.26 -4.72 120.40 121.86 3ks0 s VAL 146 Ca 0.00 -0.18 -0.10 0.00 0.00 0.00 0.00 61.98 61.70 3ks0 s VAL 146 Cb 0.00 -2.95 0.08 0.00 0.00 0.00 0.00 36.38 33.51 3ks0 s VAL 146 CO 0.00 0.48 0.48 0.54 0.00 0.00 0.00 175.10 176.60 3ks0 s VAL 147 N 0.29 -0.34 -0.13 2.92 0.11 -1.26 -4.75 120.40 117.23 3ks0 s VAL 147 Ca 0.01 0.10 -0.06 0.00 -2.93 0.00 0.00 61.98 59.09 3ks0 s VAL 147 Cb -0.13 -0.73 -0.04 0.00 -1.53 0.00 0.00 36.38 33.95 3ks0 s VAL 147 CO 0.01 0.04 0.09 0.42 -3.33 0.00 0.00 175.10 172.33 3ks0 s THR 148 N 2.01 5.05 -0.05 5.04 -4.23 -1.20 -5.00 115.64 117.25 3ks0 s THR 148 Ca -0.07 0.04 0.06 0.00 -1.18 0.00 0.00 61.69 60.55 3ks0 s THR 148 Cb -0.09 -3.21 -0.01 0.00 1.34 0.00 0.00 72.50 70.52 3ks0 s THR 148 CO -0.15 0.56 -0.24 -0.69 -0.54 0.00 0.00 174.62 173.57 3ks0 s VAL 149 N -0.54 2.17 0.11 2.29 1.01 -1.26 -1.38 120.40 122.79 3ks0 s VAL 149 Ca 0.11 -1.03 0.04 0.00 0.00 0.00 0.00 61.98 61.10 3ks0 s VAL 149 Cb -0.12 -1.79 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 3ks0 s VAL 149 CO 0.02 0.57 -0.10 -1.81 0.00 0.00 0.00 175.10 173.78 3ks0 s ASP 150 N -0.25 1.51 0.04 3.32 1.01 0.16 -4.95 116.67 117.51 3ks0 s ASP 150 Ca -0.01 -0.87 0.07 0.00 0.71 0.00 0.00 52.55 52.46 3ks0 s ASP 150 Cb -0.13 0.01 -0.02 0.00 1.01 0.00 0.00 42.92 43.78 3ks0 s ASP 150 CO 0.03 -0.29 -0.20 0.26 0.21 0.00 0.00 175.17 175.18 3ks0 s TRP 151 N -2.70 1.78 -0.10 4.23 0.52 -1.26 0.56 118.94 121.97 3ks0 s TRP 151 Ca 0.08 -0.37 0.00 0.00 0.02 0.00 0.00 56.10 55.83 3ks0 s TRP 151 Cb -0.01 -1.06 0.02 0.00 -1.15 0.00 0.00 33.47 31.27 3ks0 s TRP 151 CO -0.00 0.08 -0.09 0.15 0.02 0.00 0.00 176.95 177.11 3ks0 s LYS 152 N -1.16 1.62 -0.25 4.98 1.02 -0.66 -1.56 119.74 123.73 3ks0 s LYS 152 Ca 0.07 -0.31 -0.09 0.00 0.02 0.00 0.00 55.97 55.66 3ks0 s LYS 152 Cb -0.09 -1.57 -0.04 0.00 -0.52 0.00 0.00 37.83 35.62 3ks0 s LYS 152 CO 0.02 -0.19 0.11 0.08 -0.92 0.00 0.00 175.35 174.45 3ks0 s VAL 153 N 1.41 4.74 -1.58 3.17 1.01 -0.67 -1.17 120.40 127.32 3ks0 s VAL 153 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 61.95 3ks0 s VAL 153 Cb -0.13 -3.22 0.00 0.00 0.00 0.00 0.00 36.38 33.03 3ks0 s VAL 153 CO -0.05 0.33 0.00 0.47 0.00 0.00 0.00 175.10 175.85 3ks0 n ASP 154 N 4.73 -4.96 0.00 3.32 8.00 0.10 -1.70 116.55 126.05 3ks0 n ASP 154 Ca -0.15 0.16 0.00 0.00 0.71 0.00 0.00 54.79 55.51 3ks0 n ASP 154 Cb 0.52 -4.23 0.00 0.00 -0.02 0.00 0.00 41.12 37.39 3ks0 n ASP 154 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ks0 n GLY 155 N -0.78 0.69 3.63 0.44 0.00 -1.26 -4.97 105.19 102.94 3ks0 n GLY 155 Ca -0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.48 3ks0 n GLY 155 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ks0 s THR 156 N -2.56 4.70 0.20 2.61 2.01 -0.69 -5.03 115.64 116.88 3ks0 s THR 156 Ca 0.00 -0.07 -0.31 0.00 0.31 0.00 0.00 61.69 61.62 3ks0 s THR 156 Cb 0.00 -3.11 -0.16 0.00 0.01 0.00 0.00 72.50 69.24 3ks0 s THR 156 CO 0.00 0.47 1.00 -2.65 -0.69 0.00 0.00 174.62 172.75 3ks0 n PRO 157 N 3.48 0.93 -3.32 4.92 -0.02 -1.26 -1.67 135.00 138.06 3ks0 n PRO 157 Ca -0.17 0.33 -0.38 0.00 -2.02 0.00 0.00 63.50 61.26 3ks0 n PRO 157 Cb 0.52 -1.71 -0.07 0.00 -0.02 0.00 0.00 33.50 32.23 3ks0 n PRO 157 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3ks0 s VAL 158 N -0.54 5.16 -0.06 -1.45 1.01 -0.60 -4.85 120.40 119.07 3ks0 s VAL 158 Ca 0.69 0.86 -0.00 0.00 0.00 0.00 0.00 61.98 63.53 3ks0 s VAL 158 Cb -0.85 -3.79 -0.00 0.00 0.00 0.00 0.00 36.38 31.73 3ks0 s VAL 158 CO 0.55 0.24 -0.00 0.74 0.00 0.00 0.00 175.10 176.63 3ks0 h THR 159 N 4.98 0.00 -2.49 3.92 2.02 -1.93 -3.45 112.91 115.96 3ks0 h THR 159 Ca -0.36 -0.57 -0.54 0.00 0.77 0.00 0.00 66.41 65.70 3ks0 h THR 159 Cb 1.16 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 67.52 3ks0 h THR 159 CO 0.74 0.00 -0.53 -1.10 0.37 0.00 0.00 175.52 174.99 3ks0 s GLN 160 N -1.32 2.99 0.00 6.66 1.11 -1.26 -4.66 119.66 123.18 3ks0 s GLN 160 Ca -0.00 -0.90 0.00 0.00 0.01 0.00 0.00 55.36 54.47 3ks0 s GLN 160 Cb 0.00 -2.66 0.00 0.00 -1.01 0.00 0.00 33.01 29.34 3ks0 s GLN 160 CO 0.00 0.46 0.00 0.41 0.01 0.00 0.00 175.29 176.17 3ks0 n GLY 161 N -0.70 0.76 3.46 3.09 0.00 -1.26 -4.99 105.19 105.54 3ks0 n GLY 161 Ca -0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.63 3ks0 n GLY 161 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3ks0 s MET 162 N -0.59 2.11 -0.02 1.61 0.00 -1.26 -1.91 119.30 119.24 3ks0 s MET 162 Ca 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 55.69 54.74 3ks0 s MET 162 Cb 0.00 -2.20 0.02 0.00 0.00 0.00 0.00 34.83 32.65 3ks0 s MET 162 CO 0.00 0.55 0.00 -2.00 0.00 0.00 0.00 175.02 173.57 3ks0 s GLU 163 N -1.36 0.21 0.07 3.16 2.12 -0.97 -5.02 118.70 116.91 3ks0 s GLU 163 Ca 0.14 0.07 0.07 0.00 0.36 0.00 0.00 54.97 55.61 3ks0 s GLU 163 Cb -0.10 -0.38 -0.04 0.00 0.26 0.00 0.00 34.13 33.87 3ks0 s GLU 163 CO 0.05 -0.11 -0.16 0.99 -0.54 0.00 0.00 175.26 175.49 3ks0 s THR 164 N 0.83 2.95 0.57 -1.70 2.01 -1.26 -0.91 115.64 118.12 3ks0 s THR 164 Ca -0.08 -1.26 -0.07 0.00 0.31 0.00 0.00 61.69 60.60 3ks0 s THR 164 Cb -0.11 -2.30 -0.01 0.00 0.01 0.00 0.00 72.50 70.09 3ks0 s THR 164 CO -0.02 0.24 0.89 0.42 -0.69 0.00 0.00 174.62 175.47 3ks0 s THR 165 N -1.03 4.12 0.04 -0.82 -4.23 -0.07 -5.00 115.64 108.65 3ks0 s THR 165 Ca 0.17 0.18 -0.30 0.00 -1.18 0.00 0.00 61.69 60.55 3ks0 s THR 165 Cb -0.11 -3.62 -0.05 0.00 1.34 0.00 0.00 72.50 70.06 3ks0 s THR 165 CO 0.08 -0.66 1.16 -1.58 -0.54 0.00 0.00 174.62 173.08 3ks0 s GLN 166 N -4.96 4.45 -0.13 3.99 2.00 -1.26 -4.67 119.66 119.08 3ks0 s GLN 166 Ca 0.52 1.70 -0.38 0.00 -2.00 0.00 0.00 55.36 55.20 3ks0 s GLN 166 Cb -0.11 -3.38 -0.15 0.00 0.80 0.00 0.00 33.01 30.17 3ks0 s GLN 166 CO 0.46 -0.23 1.65 -2.30 -0.50 0.00 0.00 175.29 174.38 3ks0 n PRO 167 N 3.98 1.35 -4.55 1.67 -0.02 -1.26 -4.88 135.00 131.29 3ks0 n PRO 167 Ca 0.08 0.49 -0.32 0.00 -2.02 0.00 0.00 63.50 61.73 3ks0 n PRO 167 Cb 0.47 -2.19 -0.11 0.00 -0.02 0.00 0.00 33.50 31.65 3ks0 n PRO 167 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3ks0 s SER 168 N 2.68 4.42 -0.12 2.55 1.04 -0.65 -4.95 113.70 118.67 3ks0 s SER 168 Ca 0.93 -0.19 -0.29 0.00 0.48 0.00 0.00 55.95 56.88 3ks0 s SER 168 Cb -0.97 -0.98 -0.03 0.00 0.10 0.00 0.00 66.02 64.14 3ks0 s SER 168 CO 0.57 0.29 1.45 -0.75 0.98 0.00 0.00 173.24 175.79 3ks0 s LYS 169 N -1.31 4.19 0.59 4.02 2.20 -1.26 -1.51 119.74 126.66 3ks0 s LYS 169 Ca 0.16 1.89 -0.17 0.00 -0.36 0.00 0.00 55.97 57.49 3ks0 s LYS 169 Cb -0.11 -3.88 -0.03 0.00 -1.51 0.00 0.00 37.83 32.30 3ks0 s LYS 169 CO 0.06 -0.80 1.11 -0.65 -0.36 0.00 0.00 175.35 174.71 3ks0 s GLN 170 N 3.80 3.13 0.52 4.03 -0.21 0.41 -4.95 119.66 126.39 3ks0 s GLN 170 Ca 0.64 1.48 0.35 0.00 0.02 0.00 0.00 55.36 57.85 3ks0 s GLN 170 Cb -0.27 -1.99 1.51 0.00 1.00 0.00 0.00 33.01 33.26 3ks0 s GLN 170 CO 0.22 -1.00 1.76 0.66 -2.12 0.00 0.00 175.29 174.81 3ks0 h SER 171 N 0.66 0.08 -0.27 5.90 4.64 -1.97 0.15 113.55 122.74 3ks0 h SER 171 Ca -0.48 0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 60.85 3ks0 h SER 171 Cb 1.25 0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 63.35 3ks0 h SER 171 CO 0.56 0.00 0.01 -0.46 -0.87 0.00 0.00 176.83 176.07 3ks0 n ASN 172 N -4.25 3.20 -0.20 4.97 0.23 -1.26 -4.95 115.26 113.00 3ks0 n ASN 172 Ca 0.28 -2.44 -0.03 0.00 -0.53 0.00 0.00 54.58 51.87 3ks0 n ASN 172 Cb 1.29 -0.59 -0.01 0.00 -2.08 0.00 0.00 39.78 38.39 3ks0 n ASN 172 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 3ks0 n ASN 173 N 0.28 -5.69 -3.31 0.53 5.03 0.52 -5.00 115.26 107.62 3ks0 n ASN 173 Ca 0.13 0.06 -0.12 0.00 0.87 0.00 0.00 54.58 55.52 3ks0 n ASN 173 Cb 0.70 -3.42 0.07 0.00 -1.02 0.00 0.00 39.78 36.11 3ks0 n ASN 173 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 3ks0 n LYS 174 N 0.24 0.16 -4.26 3.52 5.02 -1.26 -4.86 118.16 116.71 3ks0 n LYS 174 Ca -0.03 -1.40 -0.19 0.00 -2.02 0.00 0.00 58.31 54.67 3ks0 n LYS 174 Cb 0.48 -0.38 -0.11 0.00 -0.02 0.00 0.00 35.03 35.00 3ks0 n LYS 174 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3ks0 s TYR 175 N -1.60 1.51 0.10 2.13 1.51 0.43 -0.44 117.35 120.99 3ks0 s TYR 175 Ca 0.35 -0.52 0.04 0.00 -1.01 0.00 0.00 57.07 55.92 3ks0 s TYR 175 Cb -0.02 -0.79 -0.04 0.00 -0.11 0.00 0.00 41.96 41.01 3ks0 s TYR 175 CO 0.24 0.19 -0.10 0.00 -1.11 0.00 0.00 175.55 174.77 3ks0 s MET 176 N -2.63 0.84 0.19 -0.62 0.23 -0.57 -1.42 119.30 115.33 3ks0 s MET 176 Ca 0.10 -1.16 -0.20 0.00 -1.03 0.00 0.00 55.69 53.39 3ks0 s MET 176 Cb -0.06 -0.51 0.04 0.00 -1.53 0.00 0.00 34.83 32.78 3ks0 s MET 176 CO 0.04 0.07 0.58 0.00 -2.03 0.00 0.00 175.02 173.69 3ks0 s ALA 177 N -2.51 -1.25 0.05 3.16 0.00 0.13 -1.64 121.76 119.70 3ks0 s ALA 177 Ca 0.06 0.05 0.06 0.00 0.00 0.00 0.00 51.96 52.12 3ks0 s ALA 177 Cb -0.02 0.86 -0.02 0.00 0.00 0.00 0.00 23.12 23.93 3ks0 s ALA 177 CO -0.00 -0.83 -0.17 -1.54 0.00 0.00 0.00 175.76 173.22 3ks0 s SER 178 N -2.83 1.99 -0.07 0.00 1.04 -1.26 -0.18 113.70 112.38 3ks0 s SER 178 Ca 0.06 -0.50 0.04 0.00 0.48 0.00 0.00 55.95 56.04 3ks0 s SER 178 Cb -0.02 -0.14 -0.00 0.00 0.10 0.00 0.00 66.02 65.96 3ks0 s SER 178 CO -0.05 0.07 -0.21 -0.55 0.98 0.00 0.00 173.24 173.48 3ks0 s SER 179 N -1.22 2.71 -0.11 7.02 0.15 0.50 -0.89 113.70 121.85 3ks0 s SER 179 Ca 0.04 -0.47 -0.02 0.00 0.70 0.00 0.00 55.95 56.20 3ks0 s SER 179 Cb -0.08 -0.98 -0.03 0.00 -1.71 0.00 0.00 66.02 63.21 3ks0 s SER 179 CO 0.02 0.17 -0.02 -0.31 1.20 0.00 0.00 173.24 174.30 3ks0 s TYR 180 N 0.16 3.09 -0.48 3.44 2.02 -0.09 -0.47 117.35 125.01 3ks0 s TYR 180 Ca -0.10 0.03 0.02 0.00 -0.37 0.00 0.00 57.07 56.65 3ks0 s TYR 180 Cb -0.15 -1.83 0.13 0.00 -0.40 0.00 0.00 41.96 39.70 3ks0 s TYR 180 CO 0.05 0.30 0.23 -1.17 -1.57 0.00 0.00 175.55 173.39 3ks0 s LEU 181 N -0.49 4.66 -0.06 -1.29 2.96 -0.54 -2.30 118.68 121.62 3ks0 s LEU 181 Ca 0.08 -2.68 -0.26 0.00 -0.22 0.00 0.00 54.13 51.05 3ks0 s LEU 181 Cb -0.12 -1.69 -0.03 0.00 0.50 0.00 0.00 46.19 44.85 3ks0 s LEU 181 CO 0.02 -0.32 0.80 -0.89 -1.32 0.00 0.00 176.35 174.65 3ks0 s THR 182 N 0.18 4.97 0.23 3.68 2.01 -0.80 -1.86 115.64 124.05 3ks0 s THR 182 Ca 0.15 1.66 0.00 0.00 0.31 0.00 0.00 61.69 63.81 3ks0 s THR 182 Cb -0.23 -4.14 -0.05 0.00 0.01 0.00 0.00 72.50 68.09 3ks0 s THR 182 CO -0.03 0.20 0.11 -0.76 -0.69 0.00 0.00 174.62 173.45 3ks0 s LEU 183 N 1.02 1.43 0.53 4.42 1.43 0.29 -4.79 118.68 123.01 3ks0 s LEU 183 Ca 0.42 -1.39 -0.10 0.00 -1.03 0.00 0.00 54.13 52.04 3ks0 s LEU 183 Cb -0.19 0.17 -0.05 0.00 0.03 0.00 0.00 46.19 46.16 3ks0 s LEU 183 CO 0.21 -0.78 0.90 0.42 0.23 0.00 0.00 176.35 177.33 3ks0 s THR 184 N -3.92 4.77 0.34 5.49 -4.23 -1.26 -0.74 115.64 116.09 3ks0 s THR 184 Ca 0.38 0.65 0.06 0.00 -1.18 0.00 0.00 61.69 61.60 3ks0 s THR 184 Cb 0.07 -3.83 0.31 0.00 1.34 0.00 0.00 72.50 70.39 3ks0 s THR 184 CO 0.13 -0.91 1.90 0.00 -0.54 0.00 0.00 174.62 175.20 3ks0 h ALA 185 N 0.23 1.73 -0.23 3.99 0.00 -1.13 -2.17 119.26 121.67 3ks0 h ALA 185 Ca -0.46 -0.00 0.06 0.00 0.00 0.00 0.00 54.91 54.51 3ks0 h ALA 185 Cb 1.19 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.75 3ks0 h ALA 185 CO 0.62 0.08 -0.17 0.07 0.00 0.00 0.00 179.25 179.85 3ks0 h ARG 186 N 0.78 -0.16 -0.11 0.00 -0.00 -1.94 -2.15 114.38 110.80 3ks0 h ARG 186 Ca 0.40 0.01 0.01 0.00 -0.00 0.00 0.00 59.98 60.41 3ks0 h ARG 186 Cb 0.49 0.04 -0.01 0.00 -0.00 0.00 0.00 29.97 30.49 3ks0 h ARG 186 CO -0.17 -0.11 0.02 0.00 -0.00 0.00 0.00 179.97 179.72 3ks0 h ALA 187 N 0.96 0.11 -0.76 0.08 0.00 -1.79 -1.31 119.26 116.56 3ks0 h ALA 187 Ca 0.13 0.02 0.17 0.00 0.00 0.00 0.00 54.91 55.23 3ks0 h ALA 187 Cb 0.37 0.02 -0.12 0.00 0.00 0.00 0.00 17.79 18.06 3ks0 h ALA 187 CO -0.33 -0.43 0.17 2.35 0.00 0.00 0.00 179.25 181.00 3ks0 h TRP 188 N 0.07 0.26 -0.16 0.00 2.91 -1.39 -0.92 115.95 116.72 3ks0 h TRP 188 Ca 0.05 0.04 -0.15 0.00 1.13 0.00 0.00 58.89 59.96 3ks0 h TRP 188 Cb 0.04 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 28.69 3ks0 h TRP 188 CO -0.11 -0.11 -0.54 0.93 -1.03 0.00 0.00 178.44 177.57 3ks0 h GLU 189 N 0.25 0.47 -0.18 2.65 5.08 -1.04 -3.26 114.58 118.54 3ks0 h GLU 189 Ca 0.43 -0.29 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3ks0 h GLU 189 Cb 0.76 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.04 3ks0 h GLU 189 CO -0.54 0.89 0.00 0.54 -1.00 0.00 0.00 179.01 178.90 3ks0 n ARG 190 N -3.95 1.19 -4.04 2.33 1.74 -0.38 -4.80 116.66 108.76 3ks0 n ARG 190 Ca -0.03 -0.26 -0.08 0.00 -0.77 0.00 0.00 57.85 56.72 3ks0 n ARG 190 Cb 0.59 -1.12 -0.09 0.00 -1.02 0.00 0.00 32.46 30.82 3ks0 n ARG 190 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 3ks0 s HIS 191 N -1.81 0.46 -0.05 -1.55 3.76 -1.06 -5.04 115.29 110.00 3ks0 s HIS 191 Ca 0.05 -0.97 0.02 0.00 -0.15 0.00 0.00 55.06 54.01 3ks0 s HIS 191 Cb 0.03 -0.32 -0.04 0.00 1.11 0.00 0.00 32.58 33.36 3ks0 s HIS 191 CO 0.03 -0.43 -0.01 0.45 -0.85 0.00 0.00 174.74 173.93 3ks0 n SER 192 N 0.05 3.82 -4.34 1.40 2.88 -1.26 -4.92 113.62 111.25 3ks0 n SER 192 Ca -0.14 -0.01 -0.30 0.00 -1.33 0.00 0.00 58.87 57.09 3ks0 n SER 192 Cb 0.62 0.31 -0.15 0.00 -0.75 0.00 0.00 64.21 64.24 3ks0 n SER 192 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 3ks0 s SER 193 N -3.94 3.17 -0.02 -3.46 0.15 -1.26 -4.14 113.70 104.20 3ks0 s SER 193 Ca -0.04 -0.59 -0.01 0.00 0.70 0.00 0.00 55.95 56.00 3ks0 s SER 193 Cb 0.01 -0.29 0.01 0.00 -1.71 0.00 0.00 66.02 64.05 3ks0 s SER 193 CO 0.15 0.26 0.05 -0.31 1.20 0.00 0.00 173.24 174.59 3ks0 s TYR 194 N -0.81 -0.05 -0.09 3.44 1.51 -0.25 0.02 117.35 121.12 3ks0 s TYR 194 Ca 0.12 0.16 -0.13 0.00 -1.01 0.00 0.00 57.07 56.20 3ks0 s TYR 194 Cb -0.10 -0.03 0.03 0.00 -0.11 0.00 0.00 41.96 41.75 3ks0 s TYR 194 CO 0.02 -0.05 0.34 -1.12 -1.11 0.00 0.00 175.55 173.64 3ks0 s SER 195 N 0.28 -0.31 -0.13 2.29 0.01 -0.31 -0.02 113.70 115.51 3ks0 s SER 195 Ca -0.02 0.51 0.02 0.00 1.31 0.00 0.00 55.95 57.77 3ks0 s SER 195 Cb -0.03 0.59 0.00 0.00 0.21 0.00 0.00 66.02 66.79 3ks0 s SER 195 CO -0.01 -0.23 -0.20 0.00 0.41 0.00 0.00 173.24 173.21 3ks0 s GLN 197 N 0.61 2.50 -0.31 0.00 -0.21 0.19 -2.31 119.66 120.13 3ks0 s GLN 197 Ca -0.11 -0.67 -0.06 0.00 0.02 0.00 0.00 55.36 54.55 3ks0 s GLN 197 Cb -0.16 -2.27 0.03 0.00 1.00 0.00 0.00 33.01 31.60 3ks0 s GLN 197 CO 0.03 -0.24 0.08 0.08 -2.12 0.00 0.00 175.29 173.11 3ks0 s VAL 198 N 1.42 3.74 -0.26 1.09 1.01 0.18 -0.67 120.40 126.91 3ks0 s VAL 198 Ca 0.05 -0.98 -0.18 0.00 0.00 0.00 0.00 61.98 60.87 3ks0 s VAL 198 Cb -0.13 -3.03 -0.03 0.00 0.00 0.00 0.00 36.38 33.19 3ks0 s VAL 198 CO -0.11 -0.05 0.52 -0.89 0.00 0.00 0.00 175.10 174.57 3ks0 s THR 199 N 1.42 5.06 -0.01 3.92 2.01 -0.48 0.11 115.64 127.67 3ks0 s THR 199 Ca -0.00 0.90 0.01 0.00 0.31 0.00 0.00 61.69 62.91 3ks0 s THR 199 Cb -0.18 -3.84 0.01 0.00 0.01 0.00 0.00 72.50 68.50 3ks0 s THR 199 CO 0.02 0.08 -0.04 -2.28 -0.69 0.00 0.00 174.62 171.72 3ks0 s HIS 200 N 2.30 0.45 -0.91 4.92 5.04 -0.52 -3.25 115.29 123.32 3ks0 s HIS 200 Ca 0.22 -0.08 -0.18 0.00 -1.54 0.00 0.00 55.06 53.48 3ks0 s HIS 200 Cb -0.16 -0.36 0.02 0.00 0.04 0.00 0.00 32.58 32.13 3ks0 s HIS 200 CO 0.09 -0.06 0.56 0.39 -2.34 0.00 0.00 174.74 173.38 3ks0 n GLU 201 N 3.37 -0.74 0.00 2.88 -0.58 -1.26 -2.75 120.64 121.56 3ks0 n GLU 201 Ca -0.18 0.26 0.00 0.00 -0.42 0.00 0.00 57.16 56.82 3ks0 n GLU 201 Cb 0.55 -1.94 0.00 0.00 -0.57 0.00 0.00 31.44 29.48 3ks0 n GLU 201 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3ks0 n GLY 202 N -1.76 2.03 3.87 0.62 0.00 -1.26 -4.97 105.19 103.71 3ks0 n GLY 202 Ca -0.18 -0.32 -0.30 0.00 0.00 0.00 0.00 46.02 45.22 3ks0 n GLY 202 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3ks0 s HIS 203 N 0.00 3.28 -0.15 1.61 -3.43 -1.11 -5.03 115.29 110.46 3ks0 s HIS 203 Ca 0.00 1.11 -0.00 0.00 -0.80 0.00 0.00 55.06 55.37 3ks0 s HIS 203 Cb 0.00 -3.02 -0.01 0.00 -1.43 0.00 0.00 32.58 28.12 3ks0 s HIS 203 CO 0.00 -1.21 -0.14 0.99 -2.00 0.00 0.00 174.74 172.38 3ks0 s THR 204 N -3.29 2.81 -0.23 -5.38 2.01 -1.26 -1.44 115.64 108.87 3ks0 s THR 204 Ca 0.58 -0.72 -0.12 0.00 0.31 0.00 0.00 61.69 61.74 3ks0 s THR 204 Cb -0.12 -2.19 -0.05 0.00 0.01 0.00 0.00 72.50 70.15 3ks0 s THR 204 CO 0.53 0.51 0.23 -0.69 -0.69 0.00 0.00 174.62 174.50 3ks0 s VAL 205 N 0.75 5.32 -0.09 3.82 1.01 0.29 -4.89 120.40 126.61 3ks0 s VAL 205 Ca -0.06 0.33 0.04 0.00 0.00 0.00 0.00 61.98 62.30 3ks0 s VAL 205 Cb -0.15 -3.57 -0.00 0.00 0.00 0.00 0.00 36.38 32.66 3ks0 s VAL 205 CO 0.01 0.32 -0.22 -0.70 0.00 0.00 0.00 175.10 174.51 3ks0 s GLU 206 N 1.10 2.76 -0.07 2.72 2.12 -1.26 -0.65 118.70 125.42 3ks0 s GLU 206 Ca 0.11 -0.82 0.05 0.00 0.36 0.00 0.00 54.97 54.67 3ks0 s GLU 206 Cb -0.14 -2.14 -0.01 0.00 0.26 0.00 0.00 34.13 32.10 3ks0 s GLU 206 CO 0.05 0.19 -0.22 0.15 -0.54 0.00 0.00 175.26 174.90 3ks0 s LYS 207 N 0.29 2.72 0.13 4.30 3.01 -0.98 -5.02 119.74 124.19 3ks0 s LYS 207 Ca -0.16 -0.85 0.05 0.00 -1.01 0.00 0.00 55.97 54.00 3ks0 s LYS 207 Cb -0.17 -2.27 -0.04 0.00 -1.01 0.00 0.00 37.83 34.34 3ks0 s LYS 207 CO 0.07 0.36 -0.11 0.45 0.51 0.00 0.00 175.35 176.63 3ks0 s SER 208 N -0.10 1.76 0.07 2.83 0.15 -1.26 -1.43 113.70 115.71 3ks0 s SER 208 Ca -0.05 -0.90 -0.26 0.00 0.70 0.00 0.00 55.95 55.44 3ks0 s SER 208 Cb -0.14 -0.02 0.08 0.00 -1.71 0.00 0.00 66.02 64.23 3ks0 s SER 208 CO 0.04 -0.26 0.73 -0.22 1.20 0.00 0.00 173.24 174.73 3ks0 s LEU 209 N -2.77 -0.49 0.02 3.45 2.96 0.98 -4.98 118.68 117.84 3ks0 s LEU 209 Ca 0.11 0.07 0.01 0.00 -0.22 0.00 0.00 54.13 54.11 3ks0 s LEU 209 Cb -0.01 2.36 -0.01 0.00 0.50 0.00 0.00 46.19 49.02 3ks0 s LEU 209 CO 0.01 -0.79 -0.05 -0.44 -1.32 0.00 0.00 176.35 173.76 3ks0 s SER 210 N -2.47 0.48 -0.11 3.68 0.01 -1.26 -1.09 113.70 112.93 3ks0 s SER 210 Ca 0.01 -0.35 -0.29 0.00 1.31 0.00 0.00 55.95 56.63 3ks0 s SER 210 Cb -0.01 0.03 -0.03 0.00 0.21 0.00 0.00 66.02 66.22 3ks0 s SER 210 CO -0.09 -0.14 1.42 -2.16 0.41 0.00 0.00 173.24 172.67 3ks0 s PRO 211 N -0.97 4.22 0.00 12.44 0.04 -1.26 -5.09 135.00 144.38 3ks0 s PRO 211 Ca -0.07 1.88 0.00 0.00 0.04 0.00 0.00 61.00 62.84 3ks0 s PRO 211 Cb -0.07 -3.83 0.00 0.00 0.04 0.00 0.00 34.50 30.64 3ks0 s PRO 211 CO -0.00 -0.75 0.00 0.00 0.04 0.00 0.00 177.00 176.29