#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k2k n GLU -6 N 0.00 0.00 -3.95 1.57 -0.58 -1.26 -4.98 120.64 111.43 3k2k n GLU -6 Ca 0.00 0.00 -0.35 0.00 -0.42 0.00 0.00 57.16 56.39 3k2k n GLU -6 Cb 0.00 -0.39 -0.14 0.00 -0.57 0.00 0.00 31.44 30.34 3k2k n GLU -6 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 3k2k s ASN -5 N -0.47 4.10 0.45 1.62 0.01 -1.26 -5.00 114.94 114.39 3k2k s ASN -5 Ca 0.00 -0.43 0.32 0.00 -0.71 0.00 0.00 52.86 52.04 3k2k s ASN -5 Cb 0.00 -1.69 1.46 0.00 0.41 0.00 0.00 41.25 41.42 3k2k s ASN -5 CO 0.00 -0.01 1.62 -0.07 -1.51 0.00 0.00 177.10 177.13 3k2k h LEU -4 N 8.06 0.22 -0.80 0.60 3.38 -1.97 0.19 115.31 124.99 3k2k h LEU -4 Ca -0.42 0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.61 3k2k h LEU -4 Cb 1.16 0.12 -0.03 0.00 0.09 0.00 0.00 40.66 42.00 3k2k h LEU -4 CO 0.61 -0.17 0.14 0.22 0.09 0.00 0.00 178.44 179.33 3k2k h TYR -3 N 0.07 1.09 0.00 1.13 3.20 -2.00 -2.53 116.97 117.94 3k2k h TYR -3 Ca 0.83 -0.13 0.00 0.00 3.14 0.00 0.00 58.73 62.57 3k2k h TYR -3 Cb 2.68 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 40.64 3k2k h TYR -3 CO -0.00 0.90 -0.23 0.74 -1.64 0.00 0.00 178.16 177.93 3k2k h PHE -2 N 0.99 0.00 -4.18 -3.82 0.04 -1.01 -3.46 116.94 105.49 3k2k h PHE -2 Ca 0.20 0.00 -0.52 0.00 2.80 0.00 0.00 57.97 60.45 3k2k h PHE -2 Cb 0.37 0.00 0.20 0.00 2.20 0.00 0.00 35.95 38.72 3k2k h PHE -2 CO 0.03 0.00 0.15 0.94 -0.60 0.00 0.00 178.31 178.83 3k2k n GLN -1 N -2.71 -0.42 0.00 1.51 7.27 -0.95 -4.90 117.38 117.18 3k2k n GLN -1 Ca 0.04 -0.06 0.00 0.00 0.07 0.00 0.00 57.00 57.05 3k2k n GLN -1 Cb 0.50 -2.33 0.00 0.00 2.41 0.00 0.00 30.24 30.81 3k2k n GLN -1 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3k2k n GLY 0 N 0.40 1.26 0.00 1.69 0.00 -1.26 -5.06 105.19 102.22 3k2k n GLY 0 Ca 0.12 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.40 3k2k n GLY 0 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3k2k n THR 2 N 0.00 0.00 -2.83 2.61 -1.04 -1.26 -5.07 114.28 106.69 3k2k n THR 2 Ca 0.00 0.00 -0.40 0.00 -2.04 0.00 0.00 64.05 61.61 3k2k n THR 2 Cb 0.00 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.46 3k2k n THR 2 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3k2k s LEU 3 N 0.00 4.55 -0.02 -4.42 1.43 -1.26 -4.36 118.68 114.59 3k2k s LEU 3 Ca 0.00 1.74 0.00 0.00 -1.03 0.00 0.00 54.13 54.84 3k2k s LEU 3 Cb 0.00 -3.47 0.03 0.00 0.03 0.00 0.00 46.19 42.78 3k2k s LEU 3 CO 0.00 0.06 0.02 -0.55 0.23 0.00 0.00 176.35 176.11 3k2k s SER 4 N -0.55 0.17 -0.14 2.29 0.15 -0.99 -4.93 113.70 109.70 3k2k s SER 4 Ca 0.42 0.02 -0.02 0.00 0.70 0.00 0.00 55.95 57.06 3k2k s SER 4 Cb -0.23 -0.12 -0.02 0.00 -1.71 0.00 0.00 66.02 63.94 3k2k s SER 4 CO 0.28 -0.12 -0.07 -0.63 1.20 0.00 0.00 173.24 173.90 3k2k s ILE 5 N 1.05 3.56 0.10 6.45 1.01 -1.26 -1.46 121.20 130.66 3k2k s ILE 5 Ca -0.09 -0.48 0.02 0.00 0.00 0.00 0.00 60.65 60.10 3k2k s ILE 5 Cb -0.13 -2.54 -0.04 0.00 0.01 0.00 0.00 42.46 39.76 3k2k s ILE 5 CO -0.03 0.51 -0.08 0.42 0.00 0.00 0.00 174.94 175.76 3k2k s THR 6 N 0.33 0.79 0.00 2.92 -4.23 -0.54 -4.98 115.64 109.94 3k2k s THR 6 Ca -0.07 -1.85 0.00 0.00 -1.18 0.00 0.00 61.69 58.59 3k2k s THR 6 Cb -0.15 -1.58 0.00 0.00 1.34 0.00 0.00 72.50 72.11 3k2k s THR 6 CO 0.04 -0.77 0.45 -1.54 -0.54 0.00 0.00 174.62 172.26 3k2k n SER 7 N 0.13 0.00 -4.39 3.99 3.41 -1.26 -0.83 113.62 114.67 3k2k n SER 7 Ca -0.13 -1.03 -0.43 0.00 -0.26 0.00 0.00 58.87 57.02 3k2k n SER 7 Cb 0.60 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.54 3k2k n SER 7 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3k2k n ASN 8 N 0.00 5.05 -3.78 4.04 2.85 -1.26 -4.17 115.26 117.99 3k2k n ASN 8 Ca 0.00 -2.97 -0.08 0.00 -0.11 0.00 0.00 54.58 51.43 3k2k n ASN 8 Cb 0.51 -1.62 -0.02 0.00 1.24 0.00 0.00 39.78 39.89 3k2k n ASN 8 CO 0.00 0.00 0.00 0.72 -2.11 0.00 0.00 177.26 175.87 3k2k s PHE 9 N 2.30 -0.24 -0.33 1.20 -0.12 -1.26 -5.04 117.98 114.49 3k2k s PHE 9 Ca 0.46 -0.17 -0.40 0.00 -0.05 0.00 0.00 56.93 56.77 3k2k s PHE 9 Cb 0.02 0.68 -0.15 0.00 -0.63 0.00 0.00 43.02 42.93 3k2k s PHE 9 CO 0.02 -1.15 1.86 -3.47 -0.05 0.00 0.00 175.22 172.43 3k2k n ASP 10 N -0.45 2.11 0.00 1.98 -0.08 -1.26 -0.37 116.55 118.48 3k2k n ASP 10 Ca -0.06 0.92 0.00 0.00 -1.51 0.00 0.00 54.79 54.14 3k2k n ASP 10 Cb 0.60 -1.12 0.00 0.00 2.34 0.00 0.00 41.12 42.94 3k2k n ASP 10 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3k2k n ALA 11 N 6.35 0.00 -1.77 -1.67 0.00 -0.21 -4.98 120.51 118.24 3k2k n ALA 11 Ca 0.32 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.37 3k2k n ALA 11 Cb 0.12 -0.12 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 3k2k n ALA 11 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3k2k s GLY 12 N -2.00 2.91 -0.30 0.00 0.00 0.50 -4.23 107.32 104.21 3k2k s GLY 12 Ca 0.00 1.04 -0.09 0.00 0.00 0.00 0.00 44.72 45.66 3k2k s GLY 12 CO 0.00 1.59 0.81 0.00 0.00 0.00 0.00 173.10 175.50 3k2k s ALA 13 N -1.33 -2.55 -0.13 3.20 0.00 -0.01 -4.33 121.76 116.61 3k2k s ALA 13 Ca 0.55 1.95 -0.30 0.00 0.00 0.00 0.00 51.96 54.16 3k2k s ALA 13 Cb -0.33 -2.10 0.11 0.00 0.00 0.00 0.00 23.12 20.80 3k2k s ALA 13 CO 0.42 -1.15 0.91 -1.50 0.00 0.00 0.00 175.76 174.44 3k2k s ILE 14 N 2.77 0.00 -0.15 0.00 1.10 -1.26 -1.78 121.20 121.88 3k2k s ILE 14 Ca 0.04 0.00 -0.01 0.00 -0.51 0.00 0.00 60.65 60.16 3k2k s ILE 14 Cb -0.11 -1.00 -0.02 0.00 0.15 0.00 0.00 42.46 41.49 3k2k s ILE 14 CO -0.18 0.00 -0.10 -1.81 -2.11 0.00 0.00 174.94 170.74 3k2k s ASP 15 N -1.17 4.18 -0.33 4.50 1.01 -0.26 -4.77 116.67 119.82 3k2k s ASP 15 Ca -0.04 -0.30 -0.13 0.00 0.71 0.00 0.00 52.55 52.79 3k2k s ASP 15 Cb -0.00 -1.66 -0.02 0.00 1.01 0.00 0.00 42.92 42.25 3k2k s ASP 15 CO 0.04 0.14 0.26 -0.69 0.21 0.00 0.00 175.17 175.13 3k2k s VAL 16 N 0.50 5.26 -0.10 -1.27 1.01 -1.26 -0.64 120.40 123.91 3k2k s VAL 16 Ca -0.07 -0.08 -0.13 0.00 0.00 0.00 0.00 61.98 61.69 3k2k s VAL 16 Cb -0.15 -3.71 -0.28 0.00 0.00 0.00 0.00 36.38 32.24 3k2k s VAL 16 CO 0.04 0.02 0.53 0.58 0.00 0.00 0.00 175.10 176.27 3k2k h VAL 17 N 5.48 0.92 -2.00 2.92 2.07 -0.98 -3.48 116.25 121.17 3k2k h VAL 17 Ca -0.32 -2.41 -0.02 0.00 0.82 0.00 0.00 66.70 64.77 3k2k h VAL 17 Cb 1.16 2.66 -0.21 0.00 -1.52 0.00 0.00 31.29 33.38 3k2k h VAL 17 CO 0.63 0.77 0.10 -0.55 0.02 0.00 0.00 177.57 178.54 3k2k s SER 18 N -7.10 -0.80 -0.38 0.57 0.15 -0.26 -4.96 113.70 100.92 3k2k s SER 18 Ca -0.20 1.47 0.12 0.00 0.70 0.00 0.00 55.95 58.04 3k2k s SER 18 Cb 0.05 1.45 0.38 0.00 -1.71 0.00 0.00 66.02 66.19 3k2k s SER 18 CO 0.78 -0.25 1.03 0.00 1.20 0.00 0.00 173.24 176.00 3k2k n GLU 20 N -0.01 0.51 -3.67 0.00 0.00 -1.26 -4.65 120.64 111.57 3k2k n GLU 20 Ca 0.10 0.20 -0.37 0.00 0.00 0.00 0.00 57.16 57.09 3k2k n GLU 20 Cb 0.76 -1.39 -0.06 0.00 0.00 0.00 0.00 31.44 30.74 3k2k n GLU 20 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.13 176.15 3k2k s ARG 21 N -2.84 3.75 0.39 3.44 1.04 -1.26 -4.69 118.95 118.78 3k2k s ARG 21 Ca -0.28 0.15 0.12 0.00 -1.04 0.00 0.00 55.73 54.67 3k2k s ARG 21 Cb 0.05 -3.23 0.79 0.00 -2.04 0.00 0.00 34.95 30.51 3k2k s ARG 21 CO 0.42 0.68 1.88 0.00 -0.04 0.00 0.00 175.30 178.24 3k2k h ALA 22 N 5.04 1.48 -0.18 7.88 0.00 -1.93 -2.07 119.26 129.47 3k2k h ALA 22 Ca -0.52 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.13 3k2k h ALA 22 Cb 1.22 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3k2k h ALA 22 CO 0.62 0.38 0.00 -0.40 0.00 0.00 0.00 179.25 179.85 3k2k n ASP 23 N -4.20 1.13 -2.80 0.00 5.75 -1.24 -1.19 116.55 114.00 3k2k n ASP 23 Ca -0.02 -2.03 -0.01 0.00 -0.01 0.00 0.00 54.79 52.72 3k2k n ASP 23 Cb 0.33 -0.17 0.06 0.00 -1.03 0.00 0.00 41.12 40.31 3k2k n ASP 23 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3k2k n ALA 24 N 0.06 2.69 -2.68 2.12 0.00 -0.78 -4.59 120.51 117.33 3k2k n ALA 24 Ca 0.06 -2.61 -0.41 0.00 0.00 0.00 0.00 53.44 50.48 3k2k n ALA 24 Cb 0.19 -0.88 -0.04 0.00 0.00 0.00 0.00 19.45 18.72 3k2k n ALA 24 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3k2k s ILE 25 N -3.30 4.88 -0.16 0.00 1.01 -0.74 -4.63 121.20 118.27 3k2k s ILE 25 Ca 0.25 1.72 -0.00 0.00 0.00 0.00 0.00 60.65 62.62 3k2k s ILE 25 Cb 0.35 -4.17 -0.01 0.00 0.01 0.00 0.00 42.46 38.64 3k2k s ILE 25 CO -0.04 0.06 -0.13 -0.13 0.00 0.00 0.00 174.94 174.70 3k2k s ARG 26 N 1.86 3.28 0.26 2.79 1.81 0.89 -0.97 118.95 128.88 3k2k s ARG 26 Ca 0.41 -0.72 0.03 0.00 -1.72 0.00 0.00 55.73 53.74 3k2k s ARG 26 Cb -0.17 -2.67 -0.06 0.00 -0.45 0.00 0.00 34.95 31.60 3k2k s ARG 26 CO 0.15 0.04 0.04 -0.51 -0.68 0.00 0.00 175.30 174.34 3k2k s LEU 27 N 0.77 2.06 0.01 2.53 1.43 0.24 -0.30 118.68 125.41 3k2k s LEU 27 Ca -0.05 -1.30 0.01 0.00 -1.03 0.00 0.00 54.13 51.76 3k2k s LEU 27 Cb -0.15 -0.24 -0.01 0.00 0.03 0.00 0.00 46.19 45.82 3k2k s LEU 27 CO 0.01 -0.59 -0.03 -0.13 0.23 0.00 0.00 176.35 175.84 3k2k s ARG 28 N -3.91 0.28 0.16 1.70 0.52 0.19 -1.52 118.95 116.37 3k2k s ARG 28 Ca 0.33 -0.24 -0.32 0.00 -0.52 0.00 0.00 55.73 54.98 3k2k s ARG 28 Cb 0.07 -0.20 -0.10 0.00 0.52 0.00 0.00 34.95 35.24 3k2k s ARG 28 CO 0.12 0.05 1.62 0.08 0.02 0.00 0.00 175.30 177.18 3k2k s VAL 29 N -0.39 2.53 0.12 3.52 1.01 -1.26 -1.10 120.40 124.83 3k2k s VAL 29 Ca -0.02 0.35 -0.12 0.00 0.00 0.00 0.00 61.98 62.19 3k2k s VAL 29 Cb -0.03 -3.22 -0.10 0.00 0.00 0.00 0.00 36.38 33.02 3k2k s VAL 29 CO -0.00 0.02 1.39 -0.09 0.00 0.00 0.00 175.10 176.42 3k2k h ARG 30 N 6.99 0.87 0.00 2.72 2.43 -1.84 -3.44 114.38 122.11 3k2k h ARG 30 Ca -0.43 -0.58 0.00 0.00 -0.81 0.00 0.00 59.98 58.16 3k2k h ARG 30 Cb 1.20 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.83 3k2k h ARG 30 CO 0.93 1.21 0.00 0.41 -1.51 0.00 0.00 179.97 181.00 3k2k n GLY 31 N 0.42 -0.71 3.75 2.80 0.00 -1.26 -4.99 105.19 105.20 3k2k n GLY 31 Ca -0.05 -1.66 -0.34 0.00 0.00 0.00 0.00 46.02 43.97 3k2k n GLY 31 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3k2k s ASP 32 N -2.80 4.90 0.31 1.61 1.11 0.44 -4.91 116.67 117.33 3k2k s ASP 32 Ca 0.00 2.21 0.04 0.00 0.18 0.00 0.00 52.55 54.98 3k2k s ASP 32 Cb 0.00 -2.58 0.51 0.00 1.07 0.00 0.00 42.92 41.92 3k2k s ASP 32 CO 0.00 -1.78 1.79 -0.55 1.18 0.00 0.00 175.17 175.81 3k2k h ASN 33 N 0.23 0.47 -0.90 0.27 -1.07 -1.88 -3.25 115.58 109.44 3k2k h ASN 33 Ca -0.48 -0.13 -0.39 0.00 0.07 0.00 0.00 56.30 55.37 3k2k h ASN 33 Cb 1.27 -0.13 -0.41 0.00 -2.07 0.00 0.00 38.32 36.99 3k2k h ASN 33 CO 0.53 0.64 -1.04 0.54 0.07 0.00 0.00 177.43 178.17 3k2k n ARG 34 N -4.19 2.05 -3.53 4.14 1.74 -1.26 -5.05 116.66 110.56 3k2k n ARG 34 Ca 0.00 -3.67 -0.18 0.00 -0.77 0.00 0.00 57.85 53.23 3k2k n ARG 34 Cb 0.34 -1.67 -0.06 0.00 -1.02 0.00 0.00 32.46 30.05 3k2k n ARG 34 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3k2k s SER 35 N -3.46 -0.64 0.37 0.55 0.15 -1.23 -4.19 113.70 105.25 3k2k s SER 35 Ca 0.34 0.71 0.28 0.00 0.70 0.00 0.00 55.95 57.97 3k2k s SER 35 Cb 0.40 0.54 1.17 0.00 -1.71 0.00 0.00 66.02 66.43 3k2k s SER 35 CO -0.02 -0.60 1.82 -0.33 1.20 0.00 0.00 173.24 175.31 3k2k h GLU 36 N 3.07 0.00 -6.79 5.44 3.07 -1.96 -3.35 114.58 114.06 3k2k h GLU 36 Ca -0.27 0.00 -0.54 0.00 -0.50 0.00 0.00 59.36 58.05 3k2k h GLU 36 Cb 1.14 0.00 0.09 0.00 -0.84 0.00 0.00 28.75 29.14 3k2k h GLU 36 CO 0.39 0.00 0.82 1.19 -1.40 0.00 0.00 179.01 180.01 3k2k n PHE 37 N -2.55 2.78 -3.70 4.33 3.72 -1.26 -4.78 117.46 115.99 3k2k n PHE 37 Ca 0.01 0.31 -0.12 0.00 -0.05 0.00 0.00 57.45 57.60 3k2k n PHE 37 Cb 0.24 -2.57 -0.13 0.00 -0.94 0.00 0.00 39.48 36.09 3k2k n PHE 37 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3k2k s ALA 38 N -0.20 -0.68 0.00 4.37 0.00 -1.26 -0.42 121.76 123.57 3k2k s ALA 38 Ca 0.63 1.10 0.00 0.00 0.00 0.00 0.00 51.96 53.69 3k2k s ALA 38 Cb -0.51 -0.84 0.00 0.00 0.00 0.00 0.00 23.12 21.77 3k2k s ALA 38 CO 0.51 -0.37 0.00 0.94 0.00 0.00 0.00 175.76 176.84 3k2k n GLN 39 N 4.64 0.00 -2.17 0.00 -0.06 -1.26 -0.47 117.38 118.06 3k2k n GLN 39 Ca -0.18 0.00 -0.41 0.00 -2.00 0.00 0.00 57.00 54.40 3k2k n GLN 39 Cb 0.52 0.00 -0.03 0.00 -4.06 0.00 0.00 30.24 26.67 3k2k n GLN 39 CO 0.00 0.00 0.00 -0.46 -0.20 0.00 0.00 177.06 176.40 3k2k s TRP 40 N -1.14 3.19 0.06 3.69 -0.11 -1.26 -4.96 118.94 118.41 3k2k s TRP 40 Ca 0.00 1.25 0.01 0.00 1.22 0.00 0.00 56.10 58.57 3k2k s TRP 40 Cb 0.00 -3.64 -0.03 0.00 -1.50 0.00 0.00 33.47 28.29 3k2k s TRP 40 CO 0.00 -1.96 -0.05 -0.59 -4.62 0.00 0.00 176.95 169.73 3k2k s PHE 41 N -0.22 0.63 -0.30 5.86 -0.71 -1.26 -4.53 117.98 117.46 3k2k s PHE 41 Ca 0.55 -0.80 -0.14 0.00 -1.04 0.00 0.00 56.93 55.50 3k2k s PHE 41 Cb -0.38 -0.40 0.17 0.00 -1.21 0.00 0.00 43.02 41.20 3k2k s PHE 41 CO 0.42 -0.20 1.01 -0.47 -1.34 0.00 0.00 175.22 174.64 3k2k s TYR 42 N -2.83 -0.63 0.13 3.49 5.04 -0.73 -1.83 117.35 119.99 3k2k s TYR 42 Ca 0.01 0.98 -0.16 0.00 -2.44 0.00 0.00 57.07 55.46 3k2k s TYR 42 Cb -0.00 0.34 0.03 0.00 0.35 0.00 0.00 41.96 42.68 3k2k s TYR 42 CO -0.04 -0.32 0.41 -0.59 -1.34 0.00 0.00 175.55 173.67 3k2k s PHE 43 N 2.54 -0.19 -0.11 4.97 -0.71 -0.45 -0.83 117.98 123.20 3k2k s PHE 43 Ca -0.01 -0.13 -0.04 0.00 -1.04 0.00 0.00 56.93 55.71 3k2k s PHE 43 Cb -0.07 0.27 -0.03 0.00 -1.21 0.00 0.00 43.02 41.98 3k2k s PHE 43 CO -0.16 -0.73 0.02 0.50 -1.34 0.00 0.00 175.22 173.51 3k2k s ARG 44 N -3.81 3.28 -0.13 1.99 3.52 -0.01 -1.40 118.95 122.38 3k2k s ARG 44 Ca 0.04 -0.38 0.02 0.00 -0.13 0.00 0.00 55.73 55.28 3k2k s ARG 44 Cb 0.02 -2.92 0.01 0.00 -1.56 0.00 0.00 34.95 30.50 3k2k s ARG 44 CO -0.11 0.59 -0.19 -1.17 -0.81 0.00 0.00 175.30 173.60 3k2k s LEU 45 N -0.54 1.97 0.28 -0.88 2.96 0.32 -1.47 118.68 121.31 3k2k s LEU 45 Ca 0.10 -0.55 0.10 0.00 -0.22 0.00 0.00 54.13 53.56 3k2k s LEU 45 Cb -0.12 -1.32 -0.05 0.00 0.50 0.00 0.00 46.19 45.19 3k2k s LEU 45 CO 0.02 0.05 -0.15 0.42 -1.32 0.00 0.00 176.35 175.37 3k2k s THR 46 N 0.95 2.18 0.00 3.68 -4.23 -0.53 -1.66 115.64 116.02 3k2k s THR 46 Ca -0.05 -2.29 0.00 0.00 -1.18 0.00 0.00 61.69 58.17 3k2k s THR 46 Cb -0.15 -2.35 0.00 0.00 1.34 0.00 0.00 72.50 71.34 3k2k s THR 46 CO -0.03 -0.38 0.00 0.61 -0.54 0.00 0.00 174.62 174.28 3k2k n GLY 47 N -0.61 0.75 1.08 3.99 0.00 -0.14 -2.36 105.19 107.91 3k2k n GLY 47 Ca -0.06 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.04 3k2k n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k2k n ALA 48 N -0.23 2.93 -1.66 4.61 0.00 -1.26 -4.32 120.51 120.58 3k2k n ALA 48 Ca 0.00 -1.87 -0.53 0.00 0.00 0.00 0.00 53.44 51.03 3k2k n ALA 48 Cb 0.00 -0.75 -0.06 0.00 0.00 0.00 0.00 19.45 18.64 3k2k n ALA 48 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3k2k n ARG 49 N 0.15 1.41 -0.87 0.00 0.63 -1.21 -1.03 116.66 115.74 3k2k n ARG 49 Ca 0.21 0.51 0.00 0.00 -0.92 0.00 0.00 57.85 57.65 3k2k n ARG 49 Cb 0.82 -2.22 0.00 0.00 0.45 0.00 0.00 32.46 31.52 3k2k n ARG 49 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3k2k n GLY 50 N 3.61 0.52 3.85 5.14 0.00 0.21 -4.99 105.19 113.54 3k2k n GLY 50 Ca 0.22 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.87 3k2k n GLY 50 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3k2k s GLU 51 N -0.50 3.62 -0.15 1.61 0.41 -0.20 -4.97 118.70 118.53 3k2k s GLU 51 Ca 0.00 -0.05 -0.29 0.00 -0.41 0.00 0.00 54.97 54.21 3k2k s GLU 51 Cb 0.00 -3.23 -0.02 0.00 -1.78 0.00 0.00 34.13 29.10 3k2k s GLU 51 CO 0.00 0.69 1.30 0.50 -0.49 0.00 0.00 175.26 177.26 3k2k s ARG 52 N -0.82 4.24 -0.19 1.61 3.52 -1.26 -3.88 118.95 122.16 3k2k s ARG 52 Ca 0.16 1.72 -0.05 0.00 -0.13 0.00 0.00 55.73 57.42 3k2k s ARG 52 Cb -0.13 -3.77 -0.03 0.00 -1.56 0.00 0.00 34.95 29.47 3k2k s ARG 52 CO 0.05 -0.70 0.00 0.00 -0.81 0.00 0.00 175.30 173.84 3k2k s VAL 54 N 0.86 2.70 0.00 0.00 1.01 -0.33 -1.48 120.40 123.15 3k2k s VAL 54 Ca 0.01 -1.97 0.00 0.00 0.00 0.00 0.00 61.98 60.02 3k2k s VAL 54 Cb -0.14 -2.79 0.00 0.00 0.00 0.00 0.00 36.38 33.44 3k2k s VAL 54 CO 0.02 -0.22 0.00 0.41 0.00 0.00 0.00 175.10 175.31 3k2k n THR 56 N -0.95 0.00 -3.31 3.92 -1.04 -0.14 -1.79 114.28 110.98 3k2k n THR 56 Ca -0.04 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.54 3k2k n THR 56 Cb 0.62 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 69.04 3k2k n THR 56 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 3k2k s PHE 57 N 0.00 3.16 0.21 -1.42 0.40 0.08 -0.59 117.98 119.82 3k2k s PHE 57 Ca 0.00 -0.39 -0.04 0.00 -0.60 0.00 0.00 56.93 55.90 3k2k s PHE 57 Cb 0.00 -2.95 0.17 0.00 0.51 0.00 0.00 43.02 40.75 3k2k s PHE 57 CO 0.00 -0.73 1.58 0.93 0.70 0.00 0.00 175.22 177.70 3k2k h GLU 58 N 8.75 0.67 -0.72 0.44 5.08 -1.58 -3.05 114.58 124.16 3k2k h GLU 58 Ca -0.26 -0.33 -0.03 0.00 -1.00 0.00 0.00 59.36 57.74 3k2k h GLU 58 Cb 1.11 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.34 3k2k h GLU 58 CO 0.81 0.93 0.04 0.27 -1.00 0.00 0.00 179.01 180.06 3k2k n ASN 59 N -4.05 4.40 -0.18 1.42 6.94 -1.26 -4.66 115.26 117.86 3k2k n ASN 59 Ca -0.01 -2.73 -0.01 0.00 -0.02 0.00 0.00 54.58 51.81 3k2k n ASN 59 Cb 0.50 -0.65 0.09 0.00 -2.36 0.00 0.00 39.78 37.37 3k2k n ASN 59 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3k2k h ALA 60 N 3.28 0.68 0.00 -2.53 0.00 -1.59 -0.40 119.26 118.71 3k2k h ALA 60 Ca 0.04 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3k2k h ALA 60 Cb 1.66 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.55 3k2k h ALA 60 CO 0.40 -0.25 0.00 0.27 0.00 0.00 0.00 179.25 179.67 3k2k n ASN 61 N -5.06 0.32 -0.41 0.00 6.94 -0.73 -2.16 115.26 114.17 3k2k n ASN 61 Ca 0.07 0.58 0.14 0.00 -0.02 0.00 0.00 54.58 55.35 3k2k n ASN 61 Cb 0.27 -0.64 0.58 0.00 -2.36 0.00 0.00 39.78 37.62 3k2k n ASN 61 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 3k2k n ASP 62 N -1.85 1.26 -4.68 0.53 8.00 -0.17 -4.81 116.55 114.84 3k2k n ASP 62 Ca 0.03 -1.44 -0.29 0.00 0.71 0.00 0.00 54.79 53.80 3k2k n ASP 62 Cb 0.20 -0.01 0.14 0.00 -0.02 0.00 0.00 41.12 41.43 3k2k n ASP 62 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3k2k h ALA 64 N -1.52 0.44 -2.74 0.00 0.00 -1.10 -3.34 119.26 111.00 3k2k h ALA 64 Ca -0.49 0.11 -0.61 0.00 0.00 0.00 0.00 54.91 53.92 3k2k h ALA 64 Cb 1.32 0.16 -0.40 0.00 0.00 0.00 0.00 17.79 18.87 3k2k h ALA 64 CO 0.59 -0.35 -0.78 0.71 0.00 0.00 0.00 179.25 179.42 3k2k s TYR 65 N -6.16 2.26 0.56 0.00 2.02 -1.26 -4.96 117.35 109.80 3k2k s TYR 65 Ca -0.13 -2.77 0.23 0.00 -0.37 0.00 0.00 57.07 54.02 3k2k s TYR 65 Cb 0.14 -1.79 1.55 0.00 -0.40 0.00 0.00 41.96 41.46 3k2k s TYR 65 CO 0.72 -0.70 2.19 -1.35 -1.57 0.00 0.00 175.55 174.84 3k2k h PRO 66 N 5.65 0.00 0.00 -1.71 0.11 -1.83 0.33 132.00 134.55 3k2k h PRO 66 Ca 0.19 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.29 3k2k h PRO 66 Cb 0.84 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.95 3k2k h PRO 66 CO 0.53 0.00 -0.05 0.00 -0.21 0.00 0.00 178.00 178.28 3k2k h ALA 67 N 1.98 1.44 0.00 -0.75 0.00 -1.95 -2.39 119.26 117.58 3k2k h ALA 67 Ca 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3k2k h ALA 67 Cb 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3k2k h ALA 67 CO -0.00 0.06 0.00 0.78 0.00 0.00 0.00 179.25 180.09 3k2k h GLY 68 N 0.32 0.00 1.18 0.00 0.00 -0.53 -2.03 103.07 102.01 3k2k h GLY 68 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3k2k h GLY 68 CO 0.01 0.00 -0.50 0.79 0.00 0.00 0.00 176.54 176.84 3k2k n TRP 69 N -2.70 0.24 -2.78 5.60 5.03 -0.90 -4.57 117.44 117.36 3k2k n TRP 69 Ca -0.01 0.07 -0.41 0.00 3.03 0.00 0.00 57.50 60.18 3k2k n TRP 69 Cb 0.12 -0.45 -0.04 0.00 -1.03 0.00 0.00 31.31 29.91 3k2k n TRP 69 CO 0.00 0.00 0.00 1.03 -0.03 0.00 0.00 177.69 178.69 3k2k s ARG 70 N -3.07 4.56 -1.48 -0.99 0.52 -0.77 -3.38 118.95 114.34 3k2k s ARG 70 Ca 0.09 1.31 -0.11 0.00 -0.52 0.00 0.00 55.73 56.50 3k2k s ARG 70 Cb 0.16 -3.44 0.07 0.00 0.52 0.00 0.00 34.95 32.26 3k2k s ARG 70 CO 0.69 0.03 0.82 -0.25 0.02 0.00 0.00 175.30 176.61 3k2k n ASP 71 N 3.65 -4.80 -4.51 0.23 8.00 -1.26 -4.99 116.55 112.87 3k2k n ASP 71 Ca 0.04 -0.61 -0.32 0.00 0.71 0.00 0.00 54.79 54.61 3k2k n ASP 71 Cb 0.51 -3.86 -0.12 0.00 -0.02 0.00 0.00 41.12 37.62 3k2k n ASP 71 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 3k2k s TYR 72 N -3.19 2.72 -0.06 1.24 5.04 -1.22 -4.87 117.35 117.01 3k2k s TYR 72 Ca 0.55 -0.15 0.04 0.00 -2.44 0.00 0.00 57.07 55.08 3k2k s TYR 72 Cb -0.28 -1.58 0.00 0.00 0.35 0.00 0.00 41.96 40.46 3k2k s TYR 72 CO 0.68 0.27 -0.18 1.03 -1.34 0.00 0.00 175.55 176.01 3k2k s ARG 73 N -1.15 2.11 0.79 4.97 0.52 -1.26 -4.64 118.95 120.28 3k2k s ARG 73 Ca 0.14 -0.65 -0.12 0.00 -0.52 0.00 0.00 55.73 54.58 3k2k s ARG 73 Cb -0.11 -1.74 0.07 0.00 0.52 0.00 0.00 34.95 33.70 3k2k s ARG 73 CO 0.04 0.19 1.14 0.00 0.02 0.00 0.00 175.30 176.69 3k2k s ALA 74 N 0.24 2.00 0.08 2.13 0.00 -1.25 -4.78 121.76 120.18 3k2k s ALA 74 Ca -0.10 0.54 0.04 0.00 0.00 0.00 0.00 51.96 52.45 3k2k s ALA 74 Cb -0.14 -3.38 -0.04 0.00 0.00 0.00 0.00 23.12 19.56 3k2k s ALA 74 CO 0.04 -2.04 0.03 0.14 0.00 0.00 0.00 175.76 173.92 3k2k s VAL 75 N -2.55 4.20 0.08 0.00 -7.23 -0.87 -0.86 120.40 113.18 3k2k s VAL 75 Ca 0.67 -0.90 0.00 0.00 -1.81 0.00 0.00 61.98 59.94 3k2k s VAL 75 Cb -0.22 -3.01 -0.04 0.00 0.56 0.00 0.00 36.38 33.67 3k2k s VAL 75 CO 0.52 0.13 -0.04 0.00 -0.31 0.00 0.00 175.10 175.40 3k2k s ALA 76 N -1.33 0.77 -0.26 1.32 0.00 0.12 -1.18 121.76 121.19 3k2k s ALA 76 Ca 0.27 -1.30 -0.20 0.00 0.00 0.00 0.00 51.96 50.73 3k2k s ALA 76 Cb -0.12 0.25 0.07 0.00 0.00 0.00 0.00 23.12 23.32 3k2k s ALA 76 CO 0.19 -0.31 0.68 0.45 0.00 0.00 0.00 175.76 176.78 3k2k s SER 77 N -2.99 -0.81 0.32 0.00 0.15 -0.39 -0.69 113.70 109.28 3k2k s SER 77 Ca 0.10 1.42 0.25 0.00 0.70 0.00 0.00 55.95 58.43 3k2k s SER 77 Cb 0.07 1.37 0.61 0.00 -1.71 0.00 0.00 66.02 66.36 3k2k s SER 77 CO -0.07 -0.24 1.70 1.88 1.20 0.00 0.00 173.24 177.72 3k2k h TYR 78 N 5.97 0.00 0.00 3.44 0.05 -1.82 0.16 116.97 124.77 3k2k h TYR 78 Ca -0.30 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.48 3k2k h TYR 78 Cb 1.19 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.93 3k2k h TYR 78 CO 0.24 0.00 0.00 -0.40 -1.05 0.00 0.00 178.16 176.95 3k2k n ASP 79 N -2.65 0.13 0.00 3.88 5.68 -1.26 -4.72 116.55 117.60 3k2k n ASP 79 Ca 0.05 -1.04 0.00 0.00 -0.50 0.00 0.00 54.79 53.30 3k2k n ASP 79 Cb 0.47 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.45 3k2k n ASP 79 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3k2k n ARG 80 N -0.02 -0.29 -0.09 0.11 1.74 -1.26 -4.77 116.66 112.08 3k2k n ARG 80 Ca 0.00 0.07 -0.18 0.00 -0.77 0.00 0.00 57.85 56.98 3k2k n ARG 80 Cb 0.35 -3.81 -0.07 0.00 -1.02 0.00 0.00 32.46 27.91 3k2k n ARG 80 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3k2k n VAL 81 N -2.10 1.01 -4.00 1.55 0.31 -1.26 -4.95 118.33 108.89 3k2k n VAL 81 Ca 0.00 -0.30 -0.35 0.00 -0.01 0.00 0.00 64.34 63.68 3k2k n VAL 81 Cb 0.07 -1.56 -0.13 0.00 -0.91 0.00 0.00 33.84 31.31 3k2k n VAL 81 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 3k2k s ASN 82 N -6.37 4.50 -0.06 4.52 -0.87 -1.26 -5.10 114.94 110.30 3k2k s ASN 82 Ca -0.25 -0.32 0.03 0.00 -1.57 0.00 0.00 52.86 50.75 3k2k s ASN 82 Cb 0.09 -1.77 -0.02 0.00 -0.02 0.00 0.00 41.25 39.52 3k2k s ASN 82 CO 0.35 0.01 -0.16 0.26 -2.57 0.00 0.00 177.10 175.00 3k2k s TRP 83 N 1.28 2.68 0.05 2.20 0.52 -1.26 -4.27 118.94 120.15 3k2k s TRP 83 Ca 0.04 -0.29 -0.01 0.00 0.02 0.00 0.00 56.10 55.85 3k2k s TRP 83 Cb -0.14 -1.65 -0.04 0.00 -1.15 0.00 0.00 33.47 30.48 3k2k s TRP 83 CO -0.01 0.08 -0.02 -0.59 0.02 0.00 0.00 176.95 176.43 3k2k s PHE 84 N -0.51 0.52 0.28 -1.98 -0.71 0.13 -4.86 117.98 110.85 3k2k s PHE 84 Ca 0.07 -1.06 -0.15 0.00 -1.04 0.00 0.00 56.93 54.74 3k2k s PHE 84 Cb -0.12 -0.39 -0.08 0.00 -1.21 0.00 0.00 43.02 41.22 3k2k s PHE 84 CO 0.01 -0.39 0.69 1.03 -1.34 0.00 0.00 175.22 175.23 3k2k s ARG 85 N -3.92 4.03 0.24 1.99 1.81 -0.43 0.12 118.95 122.78 3k2k s ARG 85 Ca 0.08 0.64 0.08 0.00 -1.72 0.00 0.00 55.73 54.81 3k2k s ARG 85 Cb 0.08 -2.59 -0.05 0.00 -0.45 0.00 0.00 34.95 31.94 3k2k s ARG 85 CO -0.10 0.25 -0.12 0.14 -0.68 0.00 0.00 175.30 174.80 3k2k s VAL 86 N -1.83 1.77 0.15 3.52 -7.23 -0.04 -4.89 120.40 111.85 3k2k s VAL 86 Ca 0.50 -2.20 -0.31 0.00 -1.81 0.00 0.00 61.98 58.16 3k2k s VAL 86 Cb -0.12 -2.21 -0.09 0.00 0.56 0.00 0.00 36.38 34.52 3k2k s VAL 86 CO 0.19 -0.48 1.48 -2.84 -0.31 0.00 0.00 175.10 173.14 3k2k s PRO 87 N -3.66 4.27 -0.07 4.82 0.02 -1.26 -3.95 135.00 135.17 3k2k s PRO 87 Ca 0.26 2.22 -0.07 0.00 0.02 0.00 0.00 61.00 63.43 3k2k s PRO 87 Cb 0.00 -3.19 0.02 0.00 0.02 0.00 0.00 34.50 31.35 3k2k s PRO 87 CO 0.09 -0.52 0.19 0.99 -0.33 0.00 0.00 177.00 177.43 3k2k s THR 88 N 1.05 0.00 0.10 0.99 2.01 -1.26 -1.18 115.64 117.35 3k2k s THR 88 Ca 0.67 -0.02 0.00 0.00 0.31 0.00 0.00 61.69 62.65 3k2k s THR 88 Cb -0.40 -0.29 -0.04 0.00 0.01 0.00 0.00 72.50 71.78 3k2k s THR 88 CO 0.31 -0.01 -0.03 -0.94 -0.69 0.00 0.00 174.62 173.26 3k2k s SER 89 N 0.05 0.83 -0.07 3.53 1.04 -0.29 -4.85 113.70 113.94 3k2k s SER 89 Ca -0.01 -1.05 -0.03 0.00 0.48 0.00 0.00 55.95 55.35 3k2k s SER 89 Cb -0.02 0.16 0.04 0.00 0.10 0.00 0.00 66.02 66.30 3k2k s SER 89 CO 0.00 -0.55 0.15 -0.47 0.98 0.00 0.00 173.24 173.35 3k2k s TYR 90 N -3.78 -0.17 -1.04 5.02 5.04 -1.26 -0.33 117.35 120.83 3k2k s TYR 90 Ca 0.13 0.52 0.16 0.00 -2.44 0.00 0.00 57.07 55.43 3k2k s TYR 90 Cb 0.07 -0.12 0.50 0.00 0.35 0.00 0.00 41.96 42.76 3k2k s TYR 90 CO -0.05 -0.19 1.42 -0.40 -1.34 0.00 0.00 175.55 174.99 3k2k n ASP 91 N 4.47 3.71 0.00 4.32 5.75 -1.26 -4.94 116.55 128.59 3k2k n ASP 91 Ca -0.22 -2.27 0.00 0.00 -0.01 0.00 0.00 54.79 52.30 3k2k n ASP 91 Cb 0.51 -0.41 0.00 0.00 -1.03 0.00 0.00 41.12 40.19 3k2k n ASP 91 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3k2k n GLY 92 N 0.70 2.07 0.00 6.12 0.00 -1.26 -5.14 105.19 107.68 3k2k n GLY 92 Ca 0.19 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.22 3k2k n GLY 92 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3k2k n GLN 93 N -2.00 1.10 -3.96 1.61 6.02 -1.26 -4.71 117.38 114.18 3k2k n GLN 93 Ca 0.00 -0.02 -0.15 0.00 -0.01 0.00 0.00 57.00 56.82 3k2k n GLN 93 Cb 0.00 -1.00 -0.15 0.00 1.02 0.00 0.00 30.24 30.11 3k2k n GLN 93 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 3k2k s LEU 95 N -3.04 1.67 -0.11 1.08 2.96 -1.16 -1.77 118.68 118.31 3k2k s LEU 95 Ca -0.01 -0.03 0.01 0.00 -0.22 0.00 0.00 54.13 53.88 3k2k s LEU 95 Cb 0.02 -0.15 0.02 0.00 0.50 0.00 0.00 46.19 46.58 3k2k s LEU 95 CO 0.13 -0.02 -0.13 -0.89 -1.32 0.00 0.00 176.35 174.12 3k2k s THR 96 N 0.37 1.36 -0.18 3.68 2.01 0.56 -0.74 115.64 122.70 3k2k s THR 96 Ca -0.03 -0.54 -0.13 0.00 0.31 0.00 0.00 61.69 61.29 3k2k s THR 96 Cb -0.06 -1.28 -0.05 0.00 0.01 0.00 0.00 72.50 71.13 3k2k s THR 96 CO -0.01 0.42 0.28 -0.63 -0.69 0.00 0.00 174.62 173.99 3k2k s ILE 97 N 1.22 5.30 -0.30 1.82 1.01 -1.26 -1.14 121.20 127.86 3k2k s ILE 97 Ca -0.02 0.51 0.02 0.00 0.00 0.00 0.00 60.65 61.15 3k2k s ILE 97 Cb -0.14 -3.62 0.09 0.00 0.01 0.00 0.00 42.46 38.79 3k2k s ILE 97 CO -0.05 0.36 0.01 -0.62 0.00 0.00 0.00 174.94 174.65 3k2k s ASP 98 N 0.63 4.36 -0.07 3.58 -1.08 -0.32 -4.15 116.67 119.62 3k2k s ASP 98 Ca 0.15 -1.72 -0.15 0.00 -0.52 0.00 0.00 52.55 50.31 3k2k s ASP 98 Cb -0.13 -1.35 0.03 0.00 -1.46 0.00 0.00 42.92 40.00 3k2k s ASP 98 CO 0.04 -0.33 0.35 -2.28 0.52 0.00 0.00 175.17 173.47 3k2k s HIS 99 N 1.19 -0.30 -0.40 -5.34 2.46 -0.55 -4.11 115.29 108.24 3k2k s HIS 99 Ca 0.04 0.60 -0.03 0.00 0.47 0.00 0.00 55.06 56.15 3k2k s HIS 99 Cb -0.19 0.13 0.11 0.00 -0.13 0.00 0.00 32.58 32.50 3k2k s HIS 99 CO -0.11 -0.32 0.19 0.99 -2.47 0.00 0.00 174.74 173.03 3k2k s THR 100 N -0.70 3.25 0.42 0.89 2.01 -1.26 -0.57 115.64 119.66 3k2k s THR 100 Ca -0.08 -2.05 -0.27 0.00 0.31 0.00 0.00 61.69 59.60 3k2k s THR 100 Cb -0.04 -3.22 -0.10 0.00 0.01 0.00 0.00 72.50 69.15 3k2k s THR 100 CO 0.03 -0.68 1.45 -2.84 -0.69 0.00 0.00 174.62 171.90 3k2k s PRO 101 N 1.13 3.89 0.07 4.92 0.02 -1.25 -4.80 135.00 138.97 3k2k s PRO 101 Ca 0.08 2.48 0.24 0.00 0.02 0.00 0.00 61.00 63.83 3k2k s PRO 101 Cb -0.23 -2.80 0.40 0.00 0.02 0.00 0.00 34.50 31.89 3k2k s PRO 101 CO -0.04 -0.68 1.34 -1.91 -0.33 0.00 0.00 177.00 175.38 3k2k n GLU 102 N 0.12 0.18 -4.47 5.54 2.13 -1.26 -0.62 120.64 122.26 3k2k n GLU 102 Ca 0.03 0.04 -0.25 0.00 0.66 0.00 0.00 57.16 57.65 3k2k n GLU 102 Cb 0.41 -1.61 -0.08 0.00 0.27 0.00 0.00 31.44 30.43 3k2k n GLU 102 CO 0.00 0.00 0.00 -0.06 -0.41 0.00 0.00 177.13 176.66 3k2k s PHE 103 N -3.11 1.78 0.08 4.31 0.08 -1.26 -4.65 117.98 115.21 3k2k s PHE 103 Ca 0.08 -1.41 0.19 0.00 0.12 0.00 0.00 56.93 55.90 3k2k s PHE 103 Cb 0.15 -1.05 0.56 0.00 -0.57 0.00 0.00 43.02 42.11 3k2k s PHE 103 CO 0.72 -0.46 1.67 -0.44 -0.10 0.00 0.00 175.22 176.60 3k2k h ASP 104 N 1.83 0.00 -3.44 1.36 3.32 -1.93 -3.20 116.42 114.35 3k2k h ASP 104 Ca -0.32 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 56.37 3k2k h ASP 104 Cb 1.27 0.00 -0.35 0.00 0.22 0.00 0.00 39.33 40.46 3k2k h ASP 104 CO 0.50 0.39 -0.75 -0.55 -1.72 0.00 0.00 179.24 177.12 3k2k s SER 105 N -6.40 0.64 0.03 6.45 0.15 -1.26 -0.97 113.70 112.34 3k2k s SER 105 Ca 0.01 -0.01 0.01 0.00 0.70 0.00 0.00 55.95 56.66 3k2k s SER 105 Cb 0.10 -0.22 -0.02 0.00 -1.71 0.00 0.00 66.02 64.17 3k2k s SER 105 CO 0.69 -0.14 -0.06 -0.51 1.20 0.00 0.00 173.24 174.43 3k2k s ILE 106 N 1.32 0.37 0.02 6.45 2.07 -0.67 -4.64 121.20 126.12 3k2k s ILE 106 Ca -0.06 -0.90 0.05 0.00 -1.41 0.00 0.00 60.65 58.33 3k2k s ILE 106 Cb -0.13 -0.45 -0.03 0.00 0.13 0.00 0.00 42.46 41.98 3k2k s ILE 106 CO -0.02 -0.36 -0.11 -1.00 -1.91 0.00 0.00 174.94 171.54 3k2k s HIS 107 N -1.23 2.76 0.02 3.50 3.76 0.56 -0.52 115.29 124.14 3k2k s HIS 107 Ca -0.10 -0.12 0.09 0.00 -0.15 0.00 0.00 55.06 54.77 3k2k s HIS 107 Cb -0.09 -1.56 -0.03 0.00 1.11 0.00 0.00 32.58 32.02 3k2k s HIS 107 CO -0.00 0.32 -0.26 0.71 -0.85 0.00 0.00 174.74 174.66 3k2k s TYR 108 N -0.96 2.34 0.11 1.40 2.02 -0.50 -1.27 117.35 120.49 3k2k s TYR 108 Ca 0.16 -0.41 -0.13 0.00 -0.37 0.00 0.00 57.07 56.32 3k2k s TYR 108 Cb -0.11 -1.43 0.02 0.00 -0.40 0.00 0.00 41.96 40.04 3k2k s TYR 108 CO 0.07 0.08 0.31 0.00 -1.57 0.00 0.00 175.55 174.44 3k2k s ALA 109 N -0.75 -0.64 0.30 3.71 0.00 -0.33 -1.34 121.76 122.71 3k2k s ALA 109 Ca 0.11 -0.28 0.11 0.00 0.00 0.00 0.00 51.96 51.90 3k2k s ALA 109 Cb -0.10 0.61 0.46 0.00 0.00 0.00 0.00 23.12 24.08 3k2k s ALA 109 CO 0.01 -0.59 1.67 -0.92 0.00 0.00 0.00 175.76 175.94 3k2k h TYR 110 N 2.52 0.02 -2.80 0.00 3.20 -1.66 -2.30 116.97 115.96 3k2k h TYR 110 Ca -0.34 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.51 3k2k h TYR 110 Cb 1.23 -0.00 -0.13 0.00 1.54 0.00 0.00 36.73 39.37 3k2k h TYR 110 CO 0.37 0.56 0.24 0.12 -1.64 0.00 0.00 178.16 177.80 3k2k s PHE 111 N -3.80 -0.54 -0.28 -3.82 5.36 -1.26 -4.63 117.98 109.01 3k2k s PHE 111 Ca -0.02 0.42 -0.34 0.00 -0.96 0.00 0.00 56.93 56.03 3k2k s PHE 111 Cb 0.13 0.54 -0.11 0.00 -0.34 0.00 0.00 43.02 43.24 3k2k s PHE 111 CO 0.75 -0.79 2.12 -1.91 -1.46 0.00 0.00 175.22 173.94 3k2k n GLU 112 N -0.20 1.40 -1.03 10.12 2.13 -1.26 -4.92 120.64 126.87 3k2k n GLU 112 Ca -0.16 0.42 -0.29 0.00 0.66 0.00 0.00 57.16 57.78 3k2k n GLU 112 Cb 0.64 -2.60 0.21 0.00 0.27 0.00 0.00 31.44 29.95 3k2k n GLU 112 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 3k2k s PRO 113 N 5.77 -0.24 -0.22 5.31 0.02 -1.26 -4.79 135.00 139.59 3k2k s PRO 113 Ca 1.05 0.43 -0.04 0.00 0.02 0.00 0.00 61.00 62.46 3k2k s PRO 113 Cb -0.76 -1.67 0.10 0.00 0.02 0.00 0.00 34.50 32.20 3k2k s PRO 113 CO 0.48 -3.17 0.26 -0.47 -0.33 0.00 0.00 177.00 173.77 3k2k s TYR 114 N -2.88 -0.39 0.57 6.54 6.14 -1.26 -5.06 117.35 121.01 3k2k s TYR 114 Ca 0.67 0.32 -0.05 0.00 0.64 0.00 0.00 57.07 58.65 3k2k s TYR 114 Cb -0.18 -0.29 0.01 0.00 0.42 0.00 0.00 41.96 41.92 3k2k s TYR 114 CO 0.58 -0.64 0.87 -1.54 0.64 0.00 0.00 175.55 175.46 3k2k s SER 115 N 2.37 5.59 0.28 4.32 1.04 -1.26 -4.96 113.70 121.08 3k2k s SER 115 Ca 0.08 0.63 -0.03 0.00 0.48 0.00 0.00 55.95 57.11 3k2k s SER 115 Cb -0.16 -1.64 0.38 0.00 0.10 0.00 0.00 66.02 64.71 3k2k s SER 115 CO -0.14 -1.03 1.92 -0.08 0.98 0.00 0.00 173.24 174.88 3k2k h GLU 116 N -0.11 1.08 -0.56 4.02 4.22 -1.97 -2.01 114.58 119.25 3k2k h GLU 116 Ca -0.45 -0.11 -0.04 0.00 0.08 0.00 0.00 59.36 58.84 3k2k h GLU 116 Cb 1.26 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 30.26 3k2k h GLU 116 CO 0.60 0.77 0.19 0.93 -2.18 0.00 0.00 179.01 179.32 3k2k h GLU 117 N 1.09 0.85 -0.81 1.92 4.39 -1.99 -0.27 114.58 119.77 3k2k h GLU 117 Ca 0.28 -0.17 -0.01 0.00 0.34 0.00 0.00 59.36 59.80 3k2k h GLU 117 Cb -0.01 -0.13 -0.04 0.00 -0.10 0.00 0.00 28.75 28.47 3k2k h GLU 117 CO -0.05 0.76 0.46 -0.09 -1.16 0.00 0.00 179.01 178.93 3k2k h ARG 118 N 0.77 1.12 -0.12 2.33 2.43 -1.85 -0.61 114.38 118.45 3k2k h ARG 118 Ca 0.18 -0.12 -0.00 0.00 -0.81 0.00 0.00 59.98 59.23 3k2k h ARG 118 Cb 0.25 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 3k2k h ARG 118 CO -0.01 0.81 0.06 1.25 -1.51 0.00 0.00 179.97 180.57 3k2k h HIS 119 N 1.12 0.18 -0.13 2.20 2.76 -1.07 0.91 115.15 121.11 3k2k h HIS 119 Ca 0.29 -0.01 -0.12 0.00 -2.20 0.00 0.00 60.37 58.33 3k2k h HIS 119 Cb 0.01 -0.05 -0.01 0.00 1.55 0.00 0.00 27.41 28.90 3k2k h HIS 119 CO 0.00 0.23 -0.44 0.77 -1.30 0.00 0.00 177.93 177.19 3k2k h SER 120 N 0.07 0.31 -0.24 3.26 0.02 -0.78 -1.21 113.55 114.99 3k2k h SER 120 Ca 0.04 -0.14 -0.17 0.00 -0.84 0.00 0.00 61.79 60.68 3k2k h SER 120 Cb 0.12 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 62.57 3k2k h SER 120 CO -0.01 0.72 -0.48 -0.33 -1.14 0.00 0.00 176.83 175.59 3k2k h GLU 121 N 0.24 0.81 0.31 3.45 5.08 -0.95 -1.43 114.58 122.09 3k2k h GLU 121 Ca 0.02 -0.48 -0.02 0.00 -1.00 0.00 0.00 59.36 57.89 3k2k h GLU 121 Cb 0.87 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.17 3k2k h GLU 121 CO 0.07 1.11 -0.15 0.35 -1.00 0.00 0.00 179.01 179.39 3k2k h PHE 122 N 0.64 -0.39 -0.15 4.33 3.57 -0.51 -1.91 116.94 122.52 3k2k h PHE 122 Ca 0.03 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.47 3k2k h PHE 122 Cb 1.07 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.92 3k2k h PHE 122 CO 0.06 -0.05 -0.15 -0.07 -2.23 0.00 0.00 178.31 175.88 3k2k h LEU 123 N -0.80 0.22 -1.47 0.59 4.07 -1.33 0.11 115.31 116.70 3k2k h LEU 123 Ca -0.04 -0.05 -0.06 0.00 0.08 0.00 0.00 57.88 57.81 3k2k h LEU 123 Cb 0.51 -0.06 -0.01 0.00 1.08 0.00 0.00 40.66 42.19 3k2k h LEU 123 CO 0.07 0.40 -0.27 1.23 -1.08 0.00 0.00 178.44 178.79 3k2k h GLY 124 N 0.78 0.00 0.30 0.83 0.00 -1.18 -1.78 103.07 102.02 3k2k h GLY 124 Ca 0.04 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.23 3k2k h GLY 124 CO 0.02 0.00 -0.71 0.00 0.00 0.00 0.00 176.54 175.85 3k2k h ALA 125 N 1.73 0.05 -0.99 3.60 0.00 -0.45 -3.39 119.26 119.82 3k2k h ALA 125 Ca -0.00 -0.79 0.09 0.00 0.00 0.00 0.00 54.91 54.22 3k2k h ALA 125 Cb 0.53 0.24 -0.08 0.00 0.00 0.00 0.00 17.79 18.49 3k2k h ALA 125 CO 0.03 0.38 0.63 0.28 0.00 0.00 0.00 179.25 180.57 3k2k h VAL 126 N -0.68 0.99 -0.03 0.00 2.07 -0.72 -1.41 116.25 116.46 3k2k h VAL 126 Ca -0.16 -0.36 0.01 0.00 0.82 0.00 0.00 66.70 67.01 3k2k h VAL 126 Cb 1.38 -0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 30.99 3k2k h VAL 126 CO 0.02 0.19 0.09 0.06 0.02 0.00 0.00 177.57 177.95 3k2k h GLN 127 N 1.06 0.00 -4.12 1.57 3.07 -1.51 -3.43 115.11 111.74 3k2k h GLN 127 Ca 0.46 0.00 -0.71 0.00 0.09 0.00 0.00 58.65 58.49 3k2k h GLN 127 Cb 0.34 0.00 -0.05 0.00 0.08 0.00 0.00 27.48 27.85 3k2k h GLN 127 CO -0.22 0.00 3.02 1.04 0.09 0.00 0.00 178.83 182.75 3k2k n GLN 128 N -3.34 2.91 -0.06 0.06 6.02 -0.54 -4.70 117.38 117.74 3k2k n GLN 128 Ca -0.02 -2.69 -0.05 0.00 -0.01 0.00 0.00 57.00 54.22 3k2k n GLN 128 Cb 0.17 -3.29 -0.09 0.00 1.02 0.00 0.00 30.24 28.04 3k2k n GLN 128 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 3k2k n PRO 130 N 6.18 2.01 -0.13 -1.09 -0.04 -1.26 -4.99 135.00 135.68 3k2k n PRO 130 Ca 0.51 -0.01 0.09 0.00 -0.04 0.00 0.00 63.50 64.05 3k2k n PRO 130 Cb 0.39 -1.30 0.28 0.00 -0.04 0.00 0.00 33.50 32.83 3k2k n PRO 130 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3k2k n GLN 131 N -2.42 1.84 -5.03 0.54 0.00 -1.26 -4.91 117.38 106.14 3k2k n GLN 131 Ca -0.19 -1.28 -0.31 0.00 0.00 0.00 0.00 57.00 55.23 3k2k n GLN 131 Cb 0.86 -1.36 -0.15 0.00 0.00 0.00 0.00 30.24 29.59 3k2k n GLN 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3k2k s ALA 132 N -1.65 2.26 0.09 2.61 0.00 -1.26 -1.80 121.76 122.00 3k2k s ALA 132 Ca 0.30 -1.21 0.04 0.00 0.00 0.00 0.00 51.96 51.10 3k2k s ALA 132 Cb 0.16 -0.53 -0.03 0.00 0.00 0.00 0.00 23.12 22.71 3k2k s ALA 132 CO 0.23 0.54 -0.11 -1.12 0.00 0.00 0.00 175.76 175.29 3k2k s SER 133 N -1.02 1.51 -0.10 0.00 0.01 -0.36 -4.77 113.70 108.97 3k2k s SER 133 Ca 0.11 -0.74 0.03 0.00 1.31 0.00 0.00 55.95 56.67 3k2k s SER 133 Cb -0.10 -0.01 -0.00 0.00 0.21 0.00 0.00 66.02 66.11 3k2k s SER 133 CO 0.01 -0.20 -0.22 -0.69 0.41 0.00 0.00 173.24 172.56 3k2k s VAL 134 N -2.01 2.27 -0.05 3.43 1.01 -1.26 -0.76 120.40 123.03 3k2k s VAL 134 Ca 0.02 -0.95 0.04 0.00 0.00 0.00 0.00 61.98 61.09 3k2k s VAL 134 Cb -0.06 -1.88 -0.00 0.00 0.00 0.00 0.00 36.38 34.44 3k2k s VAL 134 CO 0.01 0.56 -0.17 -0.69 0.00 0.00 0.00 175.10 174.80 3k2k s VAL 135 N 0.26 1.46 -0.48 2.92 1.01 0.32 -4.96 120.40 120.93 3k2k s VAL 135 Ca -0.15 -0.72 -0.17 0.00 0.00 0.00 0.00 61.98 60.93 3k2k s VAL 135 Cb -0.17 -1.26 0.06 0.00 0.00 0.00 0.00 36.38 35.01 3k2k s VAL 135 CO 0.08 0.42 0.50 -0.70 0.00 0.00 0.00 175.10 175.39 3k2k s GLU 136 N 0.12 3.06 0.42 2.72 2.12 -1.26 -0.19 118.70 125.69 3k2k s GLU 136 Ca -0.06 -1.05 0.23 0.00 0.36 0.00 0.00 54.97 54.45 3k2k s GLU 136 Cb -0.12 -4.09 0.75 0.00 0.26 0.00 0.00 34.13 30.93 3k2k s GLU 136 CO 0.03 -1.08 1.75 -0.07 -0.54 0.00 0.00 175.26 175.35 3k2k h LEU 137 N 9.20 0.00 0.00 2.70 3.38 -1.95 -3.49 115.31 125.15 3k2k h LEU 137 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 3k2k h LEU 137 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 3k2k h LEU 137 CO 0.90 0.22 0.00 0.61 0.09 0.00 0.00 178.44 180.26 3k2k n GLY 138 N 0.43 -1.13 3.36 0.83 0.00 -1.26 -4.92 105.19 102.49 3k2k n GLY 138 Ca 0.01 -1.07 -0.29 0.00 0.00 0.00 0.00 46.02 44.68 3k2k n GLY 138 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3k2k s ARG 139 N -1.40 1.47 0.95 1.61 3.00 -1.26 -4.48 118.95 118.85 3k2k s ARG 139 Ca 0.00 -1.24 -0.15 0.00 0.00 0.00 0.00 55.73 54.34 3k2k s ARG 139 Cb 0.00 -1.84 0.17 0.00 0.00 0.00 0.00 34.95 33.28 3k2k s ARG 139 CO 0.00 0.45 1.22 0.95 0.00 0.00 0.00 175.30 177.92 3k2k s THR 140 N -0.99 1.94 0.30 0.02 -4.23 0.40 -4.59 115.64 108.50 3k2k s THR 140 Ca 0.12 0.00 0.05 0.00 -1.18 0.00 0.00 61.69 60.69 3k2k s THR 140 Cb -0.10 -2.88 0.29 0.00 1.34 0.00 0.00 72.50 71.15 3k2k s THR 140 CO 0.05 0.00 1.73 0.58 -0.54 0.00 0.00 174.62 176.44 3k2k h VAL 141 N -1.61 0.57 -0.53 2.29 2.07 -1.91 -1.26 116.25 115.86 3k2k h VAL 141 Ca -0.46 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 66.87 3k2k h VAL 141 Cb 1.28 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 3k2k h VAL 141 CO 0.49 0.10 0.00 -0.62 0.02 0.00 0.00 177.57 177.56 3k2k n GLU 142 N -4.92 4.42 -1.39 1.57 1.02 -1.26 -4.93 120.64 115.14 3k2k n GLU 142 Ca 0.23 -2.83 -0.02 0.00 -0.02 0.00 0.00 57.16 54.53 3k2k n GLU 142 Cb 0.64 -2.15 -0.00 0.00 -0.02 0.00 0.00 31.44 29.90 3k2k n GLU 142 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3k2k n GLY 143 N 0.64 0.43 3.86 0.62 0.00 -0.48 -5.06 105.19 105.20 3k2k n GLY 143 Ca 0.25 -0.95 -0.34 0.00 0.00 0.00 0.00 46.02 44.98 3k2k n GLY 143 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3k2k s ARG 144 N -2.82 3.89 0.00 1.61 0.52 -1.26 -4.79 118.95 116.10 3k2k s ARG 144 Ca 0.00 0.38 0.00 0.00 -0.52 0.00 0.00 55.73 55.59 3k2k s ARG 144 Cb 0.00 -2.80 0.00 0.00 0.52 0.00 0.00 34.95 32.67 3k2k s ARG 144 CO 0.00 0.41 0.00 -0.35 0.02 0.00 0.00 175.30 175.38 3k2k n PRO 145 N 0.39 3.29 0.00 3.54 -0.04 -1.26 -0.45 135.00 140.46 3k2k n PRO 145 Ca -0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.43 3k2k n PRO 145 Cb 0.52 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.98 3k2k n PRO 145 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 3k2k n SER 147 N 0.00 0.00 -4.56 3.54 7.64 -1.26 -4.80 113.62 114.18 3k2k n SER 147 Ca 0.00 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.54 3k2k n SER 147 Cb 0.00 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.09 3k2k n SER 147 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 3k2k s LEU 148 N 0.00 3.45 -0.24 -3.43 2.96 0.74 -4.35 118.68 117.81 3k2k s LEU 148 Ca 0.00 -0.03 -0.08 0.00 -0.22 0.00 0.00 54.13 53.80 3k2k s LEU 148 Cb 0.00 -1.84 -0.03 0.00 0.50 0.00 0.00 46.19 44.82 3k2k s LEU 148 CO 0.00 0.20 0.08 -0.69 -1.32 0.00 0.00 176.35 174.62 3k2k s VAL 149 N 0.16 4.49 -0.25 1.68 1.01 0.16 -0.52 120.40 127.14 3k2k s VAL 149 Ca 0.00 -0.12 -0.06 0.00 0.00 0.00 0.00 61.98 61.81 3k2k s VAL 149 Cb -0.13 -3.09 -0.01 0.00 0.00 0.00 0.00 36.38 33.15 3k2k s VAL 149 CO 0.02 0.35 0.02 -0.69 0.00 0.00 0.00 175.10 174.81 3k2k s VAL 150 N 1.38 3.83 -0.14 2.92 1.01 0.06 -0.79 120.40 128.66 3k2k s VAL 150 Ca 0.05 -0.43 0.02 0.00 0.00 0.00 0.00 61.98 61.63 3k2k s VAL 150 Cb -0.15 -2.81 0.01 0.00 0.00 0.00 0.00 36.38 33.43 3k2k s VAL 150 CO 0.04 0.32 -0.19 -0.76 0.00 0.00 0.00 175.10 174.51 3k2k s LEU 151 N 1.53 1.95 0.00 3.92 1.02 -0.25 -1.22 118.68 125.63 3k2k s LEU 151 Ca 0.05 -0.55 -0.26 0.00 0.02 0.00 0.00 54.13 53.39 3k2k s LEU 151 Cb -0.15 -1.32 0.09 0.00 0.02 0.00 0.00 46.19 44.82 3k2k s LEU 151 CO 0.00 0.03 1.18 0.61 0.02 0.00 0.00 176.35 178.19 3k2k n GLY 152 N 4.31 0.13 3.44 -3.19 0.00 -0.75 -0.60 105.19 108.54 3k2k n GLY 152 Ca -0.19 -0.98 -0.23 0.00 0.00 0.00 0.00 46.02 44.61 3k2k n GLY 152 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3k2k s THR 153 N -2.00 2.33 0.48 2.61 -4.23 -1.26 -4.61 115.64 108.95 3k2k s THR 153 Ca 0.28 -2.37 -0.23 0.00 -1.18 0.00 0.00 61.69 58.20 3k2k s THR 153 Cb -0.00 -2.25 -0.08 0.00 1.34 0.00 0.00 72.50 71.51 3k2k s THR 153 CO -0.02 -0.43 1.07 -2.65 -0.54 0.00 0.00 174.62 172.05 3k2k n PRO 154 N -0.56 1.38 -0.43 3.99 -0.02 -1.26 -5.06 135.00 133.04 3k2k n PRO 154 Ca -0.06 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 3k2k n PRO 154 Cb 0.60 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.90 3k2k n PRO 154 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3k2k n ASP 155 N 0.00 0.00 -4.57 2.55 9.92 -1.26 -5.13 116.55 118.06 3k2k n ASP 155 Ca 0.10 -0.83 -0.25 0.00 -0.53 0.00 0.00 54.79 53.28 3k2k n ASP 155 Cb 0.42 0.00 -0.09 0.00 -0.64 0.00 0.00 41.12 40.81 3k2k n ASP 155 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3k2k s ALA 160 N -2.97 3.02 0.23 2.24 0.00 -1.26 -5.30 121.76 117.72 3k2k s ALA 160 Ca 0.00 -1.93 0.06 0.00 0.00 0.00 0.00 51.96 50.09 3k2k s ALA 160 Cb 0.00 -0.33 -0.03 0.00 0.00 0.00 0.00 23.12 22.76 3k2k s ALA 160 CO 0.00 0.15 0.25 0.15 0.00 0.00 0.00 175.76 176.31 3k2k s LYS 161 N -3.63 3.14 0.27 0.00 3.01 -1.26 -5.04 119.74 116.22 3k2k s LYS 161 Ca 0.33 -0.89 -0.29 0.00 -1.01 0.00 0.00 55.97 54.10 3k2k s LYS 161 Cb -0.02 -2.72 -0.10 0.00 -1.01 0.00 0.00 37.83 33.99 3k2k s LYS 161 CO 0.18 0.43 1.32 0.15 0.51 0.00 0.00 175.35 177.94 3k2k s LYS 162 N -3.73 4.37 -0.36 1.68 1.02 0.42 -4.79 119.74 118.36 3k2k s LYS 162 Ca 0.33 2.15 -0.16 0.00 0.02 0.00 0.00 55.97 58.32 3k2k s LYS 162 Cb -0.09 -3.13 -0.01 0.00 -0.52 0.00 0.00 37.83 34.09 3k2k s LYS 162 CO 0.26 -0.22 0.38 0.15 -0.92 0.00 0.00 175.35 175.00 3k2k s LYS 163 N -0.97 3.47 -0.24 1.68 1.02 -1.26 -1.61 119.74 121.83 3k2k s LYS 163 Ca 0.53 -0.48 -0.08 0.00 0.02 0.00 0.00 55.97 55.96 3k2k s LYS 163 Cb -0.39 -3.84 -0.03 0.00 -0.52 0.00 0.00 37.83 33.05 3k2k s LYS 163 CO 0.46 -0.59 0.08 0.08 -0.92 0.00 0.00 175.35 174.45 3k2k s VAL 164 N 2.05 4.52 -0.13 3.17 1.01 -0.51 -0.24 120.40 130.27 3k2k s VAL 164 Ca 0.12 -0.11 -0.02 0.00 0.00 0.00 0.00 61.98 61.97 3k2k s VAL 164 Cb -0.17 -3.10 -0.03 0.00 0.00 0.00 0.00 36.38 33.09 3k2k s VAL 164 CO 0.12 0.36 -0.04 0.26 0.00 0.00 0.00 175.10 175.80 3k2k s TRP 165 N 1.33 3.02 -0.10 5.22 0.52 0.29 -0.65 118.94 128.56 3k2k s TRP 165 Ca 0.05 -0.18 -0.02 0.00 0.02 0.00 0.00 56.10 55.98 3k2k s TRP 165 Cb -0.15 -1.88 0.04 0.00 -1.15 0.00 0.00 33.47 30.33 3k2k s TRP 165 CO 0.04 0.10 0.02 0.42 0.02 0.00 0.00 176.95 177.55 3k2k s ILE 166 N -0.05 0.35 0.11 2.03 1.01 -0.61 -0.81 121.20 123.23 3k2k s ILE 166 Ca 0.01 0.00 0.09 0.00 0.00 0.00 0.00 60.65 60.75 3k2k s ILE 166 Cb -0.13 -0.60 -0.04 0.00 0.01 0.00 0.00 42.46 41.70 3k2k s ILE 166 CO 0.03 0.14 -0.21 0.27 0.00 0.00 0.00 174.94 175.17 3k2k s ILE 167 N 1.97 2.65 0.02 2.92 -4.36 -0.21 -1.65 121.20 122.55 3k2k s ILE 167 Ca 0.04 -1.52 0.01 0.00 -0.26 0.00 0.00 60.65 58.92 3k2k s ILE 167 Cb -0.13 -2.19 -0.02 0.00 1.25 0.00 0.00 42.46 41.37 3k2k s ILE 167 CO -0.06 0.14 -0.04 0.00 0.24 0.00 0.00 174.94 175.23 3k2k s ALA 168 N -1.08 0.23 -0.90 2.27 0.00 -0.48 -0.56 121.76 121.25 3k2k s ALA 168 Ca 0.16 -0.56 -0.04 0.00 0.00 0.00 0.00 51.96 51.53 3k2k s ALA 168 Cb -0.10 0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.12 3k2k s ALA 168 CO 0.08 -0.10 0.49 -2.13 0.00 0.00 0.00 175.76 174.10 3k2k n ARG 169 N 1.78 -3.59 -0.15 0.00 0.63 -1.15 -3.96 116.66 110.21 3k2k n ARG 169 Ca -0.22 0.53 0.11 0.00 -0.92 0.00 0.00 57.85 57.35 3k2k n ARG 169 Cb 0.56 -4.62 0.44 0.00 0.45 0.00 0.00 32.46 29.29 3k2k n ARG 169 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 3k2k h GLN 170 N -1.11 0.53 -4.68 -0.14 4.20 -1.92 -3.07 115.11 108.92 3k2k h GLN 170 Ca -0.33 -0.03 -0.70 0.00 0.06 0.00 0.00 58.65 57.65 3k2k h GLN 170 Cb 1.22 -0.12 -0.20 0.00 0.30 0.00 0.00 27.48 28.68 3k2k h GLN 170 CO 0.34 0.35 -0.36 -1.01 -0.67 0.00 0.00 178.83 177.48 3k2k s HIS 171 N -5.52 3.22 0.43 2.96 3.76 -1.26 -4.51 115.29 114.37 3k2k s HIS 171 Ca -0.09 -0.40 0.26 0.00 -0.15 0.00 0.00 55.06 54.68 3k2k s HIS 171 Cb 0.20 -2.66 1.44 0.00 1.11 0.00 0.00 32.58 32.67 3k2k s HIS 171 CO 0.76 -0.56 2.08 -1.00 -0.85 0.00 0.00 174.74 175.17 3k2k h PRO 172 N 8.61 0.00 0.00 8.40 0.13 -1.57 -1.55 132.00 146.02 3k2k h PRO 172 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 3k2k h PRO 172 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 3k2k h PRO 172 CO 0.73 0.12 0.00 0.41 -0.23 0.00 0.00 178.00 179.02 3k2k n GLY 173 N -0.77 -1.42 2.59 1.56 0.00 -0.35 -4.22 105.19 102.58 3k2k n GLY 173 Ca -0.02 0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 3k2k n GLY 173 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3k2k n GLU 174 N -2.14 3.87 -0.04 1.61 1.02 -0.58 -4.93 120.64 119.45 3k2k n GLU 174 Ca 0.04 -3.08 -0.01 0.00 -0.02 0.00 0.00 57.16 54.09 3k2k n GLU 174 Cb 0.30 -2.85 -0.00 0.00 -0.02 0.00 0.00 31.44 28.87 3k2k n GLU 174 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3k2k n SER 175 N 3.37 0.22 0.00 1.62 3.41 -1.26 -4.20 113.62 116.78 3k2k n SER 175 Ca 0.58 -1.74 0.00 0.00 -0.26 0.00 0.00 58.87 57.45 3k2k n SER 175 Cb 0.30 -0.25 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 3k2k n SER 175 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3k2k n ALA 177 N 3.81 0.00 0.08 7.33 0.00 -1.26 -2.05 120.51 128.42 3k2k n ALA 177 Ca 0.02 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.38 3k2k n ALA 177 Cb 0.02 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.41 3k2k n ALA 177 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3k2k h GLU 178 N 0.00 0.08 -0.69 0.00 4.81 -1.78 -2.26 114.58 114.74 3k2k h GLU 178 Ca 0.00 -0.11 0.02 0.00 -0.13 0.00 0.00 59.36 59.14 3k2k h GLU 178 Cb 0.00 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.38 3k2k h GLU 178 CO 0.00 0.96 0.44 -1.49 -0.73 0.00 0.00 179.01 178.20 3k2k h TRP 179 N 0.03 0.83 -0.32 0.92 4.06 -1.76 -0.83 115.95 118.88 3k2k h TRP 179 Ca -0.03 0.02 0.03 0.00 2.06 0.00 0.00 58.89 60.97 3k2k h TRP 179 Cb 1.64 -0.28 -0.03 0.00 -1.00 0.00 0.00 29.16 29.49 3k2k h TRP 179 CO 0.01 0.50 0.13 0.35 -3.56 0.00 0.00 178.44 175.87 3k2k h PHE 180 N 0.88 0.24 -0.73 0.49 3.04 -1.69 -1.63 116.94 117.54 3k2k h PHE 180 Ca 0.27 0.02 -0.04 0.00 3.98 0.00 0.00 57.97 62.19 3k2k h PHE 180 Cb -0.03 -0.06 -0.03 0.00 2.56 0.00 0.00 35.95 38.38 3k2k h PHE 180 CO -0.04 0.11 0.28 0.82 -2.02 0.00 0.00 178.31 177.47 3k2k h ILE 181 N 0.28 1.25 -0.33 1.41 1.08 -1.06 -1.78 117.51 118.36 3k2k h ILE 181 Ca 0.14 -0.78 0.01 0.00 -0.39 0.00 0.00 64.86 63.84 3k2k h ILE 181 Cb 0.09 0.39 -0.02 0.00 -3.07 0.00 0.00 36.82 34.21 3k2k h ILE 181 CO -0.13 0.32 0.19 -0.08 -0.69 0.00 0.00 178.15 177.76 3k2k h GLU 182 N 1.05 0.38 -0.63 2.37 4.81 -0.52 0.82 114.58 122.87 3k2k h GLU 182 Ca 0.24 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.43 3k2k h GLU 182 Cb 0.21 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.47 3k2k h GLU 182 CO -0.02 0.25 0.33 0.78 -0.73 0.00 0.00 179.01 179.62 3k2k h GLY 183 N 0.39 0.95 0.96 1.92 0.00 -1.07 -1.18 103.07 105.04 3k2k h GLY 183 Ca 0.13 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 46.99 3k2k h GLY 183 CO -0.06 0.43 0.20 -2.00 0.00 0.00 0.00 176.54 175.11 3k2k h LEU 184 N 0.86 0.57 -0.45 3.11 6.46 -0.86 -2.74 115.31 122.26 3k2k h LEU 184 Ca 0.22 -0.14 -0.12 0.00 -0.12 0.00 0.00 57.88 57.72 3k2k h LEU 184 Cb 0.08 -0.15 -0.01 0.00 -0.73 0.00 0.00 40.66 39.85 3k2k h LEU 184 CO -0.03 0.55 -0.20 0.58 -0.62 0.00 0.00 178.44 178.72 3k2k h VAL 185 N 0.56 1.27 -0.67 1.05 2.07 -0.69 -1.44 116.25 118.40 3k2k h VAL 185 Ca 0.15 -1.35 0.08 0.00 0.82 0.00 0.00 66.70 66.39 3k2k h VAL 185 Cb 0.14 1.18 -0.06 0.00 -1.52 0.00 0.00 31.29 31.03 3k2k h VAL 185 CO -0.02 0.46 0.34 0.11 0.02 0.00 0.00 177.57 178.48 3k2k h LYS 186 N 0.77 0.58 -0.54 1.57 1.57 -1.18 -0.40 116.57 118.93 3k2k h LYS 186 Ca 0.10 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 58.75 3k2k h LYS 186 Cb 0.77 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.93 3k2k h LYS 186 CO 0.06 0.38 -0.03 -0.09 -0.57 0.00 0.00 179.45 179.20 3k2k h ARG 187 N 0.59 0.98 -0.19 3.15 2.43 -1.21 -0.83 114.38 119.30 3k2k h ARG 187 Ca 0.32 -0.33 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 3k2k h ARG 187 Cb 0.30 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 3k2k h ARG 187 CO -0.24 1.00 0.02 -0.07 -1.51 0.00 0.00 179.97 179.17 3k2k h LEU 188 N 0.86 0.24 -1.98 3.80 3.38 -0.11 -2.24 115.31 119.26 3k2k h LEU 188 Ca 0.15 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3k2k h LEU 188 Cb 0.58 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.27 3k2k h LEU 188 CO 0.03 0.28 0.00 1.33 0.09 0.00 0.00 178.44 180.17 3k2k n VAL 189 N -4.40 0.37 -2.36 1.22 0.24 -0.29 -4.88 118.33 108.24 3k2k n VAL 189 Ca -0.00 -0.62 -0.11 0.00 -2.04 0.00 0.00 64.34 61.56 3k2k n VAL 189 Cb 0.16 0.89 0.00 0.00 -1.47 0.00 0.00 33.84 33.42 3k2k n VAL 189 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3k2k n GLY 190 N 1.40 -0.04 3.84 7.63 0.00 -0.63 -5.02 105.19 112.38 3k2k n GLY 190 Ca 0.18 -0.38 -0.32 0.00 0.00 0.00 0.00 46.02 45.50 3k2k n GLY 190 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3k2k s TRP 191 N -2.66 3.37 0.00 1.61 0.51 -0.42 -3.44 118.94 117.92 3k2k s TRP 191 Ca 0.06 1.36 0.00 0.00 -2.12 0.00 0.00 56.10 55.39 3k2k s TRP 191 Cb -0.02 -2.66 0.00 0.00 -0.81 0.00 0.00 33.47 29.98 3k2k s TRP 191 CO 0.07 -0.06 0.00 0.41 -0.51 0.00 0.00 176.95 176.86 3k2k n GLY 192 N -0.72 3.69 0.00 0.98 0.00 -1.26 -1.85 105.19 106.03 3k2k n GLY 192 Ca 0.05 -0.05 0.08 0.00 0.00 0.00 0.00 46.02 46.10 3k2k n GLY 192 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3k2k n ASP 193 N 6.45 0.00 -1.24 1.61 8.00 -1.26 -1.72 116.55 128.40 3k2k n ASP 193 Ca 0.00 -0.36 0.11 0.00 0.71 0.00 0.00 54.79 55.25 3k2k n ASP 193 Cb 0.00 -0.08 0.29 0.00 -0.02 0.00 0.00 41.12 41.31 3k2k n ASP 193 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 3k2k n TRP 194 N -1.08 0.82 0.01 1.24 7.02 -0.77 -4.69 117.44 119.99 3k2k n TRP 194 Ca 0.11 -0.41 -0.12 0.00 -1.02 0.00 0.00 57.50 56.06 3k2k n TRP 194 Cb 0.07 0.00 -0.07 0.00 -2.42 0.00 0.00 31.31 28.89 3k2k n TRP 194 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 3k2k h SER 195 N 4.09 0.04 -0.39 -0.99 0.87 -1.36 -2.95 113.55 112.87 3k2k h SER 195 Ca 0.00 -0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.40 3k2k h SER 195 Cb 0.93 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.88 3k2k h SER 195 CO 0.00 0.19 0.00 0.61 -0.53 0.00 0.00 176.83 177.10 3k2k n GLY 196 N -0.68 1.66 3.72 5.77 0.00 -1.26 -4.93 105.19 109.47 3k2k n GLY 196 Ca -0.07 -0.50 -0.41 0.00 0.00 0.00 0.00 46.02 45.04 3k2k n GLY 196 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3k2k s ASP 197 N -0.74 7.19 0.00 1.61 2.15 -1.12 -4.98 116.67 120.78 3k2k s ASP 197 Ca 0.30 1.43 0.23 0.00 0.43 0.00 0.00 52.55 54.95 3k2k s ASP 197 Cb 0.19 -2.48 0.67 0.00 -0.30 0.00 0.00 42.92 41.00 3k2k s ASP 197 CO 0.15 -0.13 1.52 -0.81 -0.17 0.00 0.00 175.17 175.73 3k2k n PRO 198 N 3.54 1.96 0.06 4.34 -0.04 -1.26 -4.45 135.00 139.16 3k2k n PRO 198 Ca 0.01 -1.43 -0.12 0.00 -0.04 0.00 0.00 63.50 61.92 3k2k n PRO 198 Cb 0.51 -1.45 -0.07 0.00 -0.04 0.00 0.00 33.50 32.46 3k2k n PRO 198 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3k2k h VAL 199 N 3.05 0.91 -0.49 0.52 2.07 -1.97 -1.78 116.25 118.56 3k2k h VAL 199 Ca 0.00 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.61 3k2k h VAL 199 Cb 0.66 0.91 -0.08 0.00 -1.52 0.00 0.00 31.29 31.26 3k2k h VAL 199 CO 0.00 0.00 0.03 0.00 0.02 0.00 0.00 177.57 177.62 3k2k h ALA 200 N 0.88 0.50 -0.61 1.67 0.00 -1.85 0.62 119.26 120.46 3k2k h ALA 200 Ca 0.00 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 3k2k h ALA 200 Cb 0.09 0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 3k2k h ALA 200 CO -0.01 -0.37 0.29 -0.09 0.00 0.00 0.00 179.25 179.08 3k2k h ARG 201 N 0.15 0.87 -0.52 0.00 2.43 -1.78 -0.40 114.38 115.13 3k2k h ARG 201 Ca 0.25 -0.13 -0.02 0.00 -0.81 0.00 0.00 59.98 59.28 3k2k h ARG 201 Cb 0.37 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 3k2k h ARG 201 CO -0.39 0.70 0.26 0.87 -1.51 0.00 0.00 179.97 179.90 3k2k h LYS 202 N 0.83 0.74 -0.93 0.20 1.79 -0.71 -2.92 116.57 115.57 3k2k h LYS 202 Ca 0.21 -0.10 0.09 0.00 -2.18 0.00 0.00 60.65 58.66 3k2k h LYS 202 Cb 0.11 -0.14 -0.07 0.00 -1.58 0.00 0.00 32.23 30.55 3k2k h LYS 202 CO -0.03 0.60 0.57 -0.07 -1.08 0.00 0.00 179.45 179.45 3k2k h LEU 203 N 0.69 0.87 -1.46 2.94 3.38 -0.09 -1.86 115.31 119.77 3k2k h LEU 203 Ca 0.18 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.18 3k2k h LEU 203 Cb 0.10 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.70 3k2k h LEU 203 CO -0.02 0.52 0.00 1.88 0.09 0.00 0.00 178.44 180.90 3k2k h TYR 204 N 0.98 0.00 0.00 1.13 0.05 -0.90 0.29 116.97 118.52 3k2k h TYR 204 Ca 0.43 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 59.13 3k2k h TYR 204 Cb 0.31 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.04 3k2k h TYR 204 CO -0.02 0.00 -0.37 -0.44 -1.05 0.00 0.00 178.16 176.27 3k2k h ASP 205 N 0.00 0.00 0.00 3.88 3.32 -1.36 -3.36 116.42 118.90 3k2k h ASP 205 Ca 0.00 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.89 3k2k h ASP 205 Cb 0.22 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.74 3k2k h ASP 205 CO 0.00 0.37 -1.79 1.41 -1.72 0.00 0.00 179.24 177.51 3k2k n HIS 206 N -3.39 0.00 -3.91 4.55 8.25 0.32 -4.93 115.22 116.11 3k2k n HIS 206 Ca 0.01 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.38 3k2k n HIS 206 Cb 0.56 -0.53 -0.08 0.00 1.12 0.00 0.00 29.99 31.07 3k2k n HIS 206 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3k2k s ALA 207 N -2.51 -0.05 0.00 -1.41 0.00 0.74 -0.44 121.76 118.10 3k2k s ALA 207 Ca -0.06 -0.76 0.07 0.00 0.00 0.00 0.00 51.96 51.22 3k2k s ALA 207 Cb 0.05 0.44 -0.02 0.00 0.00 0.00 0.00 23.12 23.59 3k2k s ALA 207 CO 0.53 -0.48 -0.22 0.99 0.00 0.00 0.00 175.76 176.58 3k2k s THR 208 N -3.88 1.78 -0.14 0.00 2.01 -0.63 -4.29 115.64 110.49 3k2k s THR 208 Ca 0.06 -1.06 -0.06 0.00 0.31 0.00 0.00 61.69 60.94 3k2k s THR 208 Cb 0.06 -1.50 -0.04 0.00 0.01 0.00 0.00 72.50 71.03 3k2k s THR 208 CO -0.11 0.42 0.06 -0.36 -0.69 0.00 0.00 174.62 173.94 3k2k s PHE 209 N -0.61 3.30 -0.28 4.92 0.40 0.23 -1.42 117.98 124.52 3k2k s PHE 209 Ca 0.09 0.20 0.03 0.00 -0.60 0.00 0.00 56.93 56.65 3k2k s PHE 209 Cb -0.09 -1.97 0.08 0.00 0.51 0.00 0.00 43.02 41.55 3k2k s PHE 209 CO 0.00 0.37 -0.03 0.71 0.70 0.00 0.00 175.22 176.97 3k2k s TYR 210 N -0.29 3.13 -0.08 0.36 1.51 0.17 -1.09 117.35 121.05 3k2k s TYR 210 Ca 0.08 -2.38 0.03 0.00 -1.01 0.00 0.00 57.07 53.80 3k2k s TYR 210 Cb -0.12 -2.15 0.01 0.00 -0.11 0.00 0.00 41.96 39.58 3k2k s TYR 210 CO 0.02 -0.88 -0.18 0.42 -1.11 0.00 0.00 175.55 173.81 3k2k s ILE 211 N 1.14 1.61 -0.38 2.71 1.01 0.03 -1.57 121.20 125.75 3k2k s ILE 211 Ca -0.01 -0.76 -0.03 0.00 0.00 0.00 0.00 60.65 59.86 3k2k s ILE 211 Cb -0.19 -1.42 0.09 0.00 0.01 0.00 0.00 42.46 40.95 3k2k s ILE 211 CO -0.08 0.46 0.16 -0.69 0.00 0.00 0.00 174.94 174.80 3k2k s VAL 212 N 0.50 3.28 0.31 2.92 1.01 -0.66 0.40 120.40 128.16 3k2k s VAL 212 Ca -0.17 -1.86 0.17 0.00 0.00 0.00 0.00 61.98 60.12 3k2k s VAL 212 Cb -0.17 -3.15 0.13 0.00 0.00 0.00 0.00 36.38 33.19 3k2k s VAL 212 CO 0.06 -0.55 1.83 -0.65 0.00 0.00 0.00 175.10 175.79 3k2k h PRO 213 N 8.06 0.00 -4.30 2.72 0.11 -1.86 -1.26 132.00 135.47 3k2k h PRO 213 Ca -0.15 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.79 3k2k h PRO 213 Cb 1.05 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.02 3k2k h PRO 213 CO 0.66 0.34 -0.56 1.21 -0.21 0.00 0.00 178.00 179.45 3k2k s ASN 214 N -6.62 0.22 0.00 -2.05 3.84 -1.25 -4.46 114.94 104.61 3k2k s ASN 214 Ca -0.02 -1.15 0.00 0.00 0.21 0.00 0.00 52.86 51.91 3k2k s ASN 214 Cb 0.13 0.35 0.00 0.00 -0.55 0.00 0.00 41.25 41.17 3k2k s ASN 214 CO 0.69 -0.79 0.00 -3.20 -2.79 0.00 0.00 177.10 171.01 3k2k n ASN 216 N -0.15 0.00 -0.28 -4.21 2.85 -1.16 -4.78 115.26 107.53 3k2k n ASN 216 Ca -0.05 0.00 -0.01 0.00 -0.11 0.00 0.00 54.58 54.41 3k2k n ASN 216 Cb 0.64 0.00 0.18 0.00 1.24 0.00 0.00 39.78 41.84 3k2k n ASN 216 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3k2k h PRO 217 N 0.00 1.13 -0.27 1.20 0.11 -1.91 -1.82 132.00 130.44 3k2k h PRO 217 Ca 0.00 -0.08 -0.09 0.00 0.11 0.00 0.00 66.00 65.94 3k2k h PRO 217 Cb 0.00 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 30.86 3k2k h PRO 217 CO 0.00 0.77 -0.18 -0.44 -0.21 0.00 0.00 178.00 177.93 3k2k h ASP 218 N 1.16 0.63 -0.11 -2.05 3.32 -1.96 -2.72 116.42 114.69 3k2k h ASP 218 Ca 0.31 -0.43 -0.06 0.00 0.02 0.00 0.00 57.03 56.86 3k2k h ASP 218 Cb -0.10 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.26 3k2k h ASP 218 CO -0.06 0.93 -0.10 1.23 -1.72 0.00 0.00 179.24 179.52 3k2k h GLY 219 N 0.34 0.46 0.95 2.75 0.00 -1.70 -1.87 103.07 103.99 3k2k h GLY 219 Ca 0.05 -0.30 -0.04 0.00 0.00 0.00 0.00 47.33 47.05 3k2k h GLY 219 CO 0.05 0.28 -0.38 1.76 0.00 0.00 0.00 176.54 178.24 3k2k h SER 220 N 0.40 -0.91 -0.07 0.19 0.02 -1.21 -1.62 113.55 110.36 3k2k h SER 220 Ca 0.08 0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 61.02 3k2k h SER 220 Cb 0.42 0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.19 3k2k h SER 220 CO 0.02 -0.61 -0.03 0.58 -1.14 0.00 0.00 176.83 175.65 3k2k h VAL 221 N -1.15 1.13 0.00 2.27 2.07 -1.37 -0.93 116.25 118.28 3k2k h VAL 221 Ca -0.11 -0.51 0.00 0.00 0.82 0.00 0.00 66.70 66.90 3k2k h VAL 221 Cb 0.84 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.64 3k2k h VAL 221 CO 0.18 0.17 0.00 1.41 0.02 0.00 0.00 177.57 179.35 3k2k n HIS 222 N -4.37 0.37 -2.64 1.57 8.25 -0.72 -1.04 115.22 116.65 3k2k n HIS 222 Ca -0.00 0.14 -0.10 0.00 -0.26 0.00 0.00 57.72 57.49 3k2k n HIS 222 Cb 0.19 -0.72 0.02 0.00 1.12 0.00 0.00 29.99 30.60 3k2k n HIS 222 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3k2k n GLY 223 N 0.33 0.16 3.92 -1.41 0.00 -0.35 -4.76 105.19 103.08 3k2k n GLY 223 Ca 0.04 -0.36 -0.26 0.00 0.00 0.00 0.00 46.02 45.43 3k2k n GLY 223 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3k2k s ASN 224 N -2.90 5.99 -0.24 1.61 0.01 -0.64 -4.78 114.94 113.99 3k2k s ASN 224 Ca 0.15 0.75 -0.18 0.00 -0.71 0.00 0.00 52.86 52.87 3k2k s ASN 224 Cb -0.07 -1.97 -0.15 0.00 0.41 0.00 0.00 41.25 39.48 3k2k s ASN 224 CO 0.18 -0.74 -0.06 -0.11 -1.51 0.00 0.00 177.10 174.86 3k2k n LEU 225 N -2.32 1.90 0.00 0.60 7.94 -1.26 -2.47 117.00 121.39 3k2k n LEU 225 Ca 0.02 0.39 0.00 0.00 -1.11 0.00 0.00 56.01 55.30 3k2k n LEU 225 Cb 0.56 -0.89 0.00 0.00 0.53 0.00 0.00 43.42 43.62 3k2k n LEU 225 CO 0.52 0.39 -0.02 -1.14 -1.11 0.00 0.00 177.39 176.03 3k2k n ARG 226 N -4.35 4.84 -4.26 1.96 0.63 -1.26 -1.21 116.66 113.01 3k2k n ARG 226 Ca -0.42 0.00 -0.15 0.00 -0.92 0.00 0.00 57.85 56.37 3k2k n ARG 226 Cb 0.77 -0.39 -0.10 0.00 0.45 0.00 0.00 32.46 33.19 3k2k n ARG 226 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 3k2k s THR 227 N -0.76 1.23 0.19 5.15 -4.23 -1.26 -4.43 115.64 111.54 3k2k s THR 227 Ca 0.00 -2.06 -0.03 0.00 -1.18 0.00 0.00 61.69 58.42 3k2k s THR 227 Cb 0.00 -1.85 0.04 0.00 1.34 0.00 0.00 72.50 72.03 3k2k s THR 227 CO 0.00 -0.72 0.26 -0.46 -0.54 0.00 0.00 174.62 173.17 3k2k n ASN 228 N -0.18 0.06 0.25 3.99 6.94 -0.59 -4.42 115.26 121.31 3k2k n ASN 228 Ca -0.10 -1.12 0.11 0.00 -0.02 0.00 0.00 54.58 53.45 3k2k n ASN 228 Cb 0.60 -0.20 0.64 0.00 -2.36 0.00 0.00 39.78 38.46 3k2k n ASN 228 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3k2k h ALA 229 N -1.73 1.27 -0.01 -2.53 0.00 -1.90 -2.68 119.26 111.68 3k2k h ALA 229 Ca -0.09 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3k2k h ALA 229 Cb 0.25 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3k2k h ALA 229 CO 0.06 0.21 -0.19 0.00 0.00 0.00 0.00 179.25 179.33 3k2k n ALA 230 N -2.30 2.95 -0.16 0.00 0.00 -1.26 -4.60 120.51 115.14 3k2k n ALA 230 Ca -0.02 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.02 3k2k n ALA 230 Cb 0.28 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.58 3k2k n ALA 230 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k2k n GLY 231 N 1.30 0.67 3.76 0.00 0.00 -1.01 -4.92 105.19 105.00 3k2k n GLY 231 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 3k2k n GLY 231 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k2k s ALA 232 N -2.24 3.39 -0.53 4.61 0.00 -1.26 -4.76 121.76 120.97 3k2k s ALA 232 Ca 0.00 0.48 -0.22 0.00 0.00 0.00 0.00 51.96 52.22 3k2k s ALA 232 Cb 0.00 -3.08 0.05 0.00 0.00 0.00 0.00 23.12 20.09 3k2k s ALA 232 CO 0.00 0.25 0.82 1.21 0.00 0.00 0.00 175.76 178.04 3k2k s ASN 233 N -1.18 6.29 0.53 0.00 3.84 -1.26 -1.54 114.94 121.63 3k2k s ASN 233 Ca 0.38 -0.57 0.21 0.00 0.21 0.00 0.00 52.86 53.10 3k2k s ASN 233 Cb -0.24 -2.38 1.36 0.00 -0.55 0.00 0.00 41.25 39.44 3k2k s ASN 233 CO 0.29 -1.10 2.08 -0.07 -2.79 0.00 0.00 177.10 175.51 3k2k h LEU 234 N 10.49 0.00 -1.53 3.21 3.38 -1.79 0.20 115.31 129.27 3k2k h LEU 234 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 3k2k h LEU 234 Cb 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 3k2k h LEU 234 CO 1.04 0.00 0.00 -3.20 0.09 0.00 0.00 178.44 176.37 3k2k n ASN 235 N -4.41 2.21 -0.23 -0.43 5.15 -1.26 -1.85 115.26 114.44 3k2k n ASN 235 Ca 0.03 -2.17 0.02 0.00 -0.60 0.00 0.00 54.58 51.87 3k2k n ASN 235 Cb 0.35 -0.37 0.06 0.00 -0.53 0.00 0.00 39.78 39.29 3k2k n ASN 235 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3k2k n ARG 236 N 0.33 2.95 -0.23 1.20 5.12 0.05 -3.54 116.66 122.55 3k2k n ARG 236 Ca 0.11 -1.70 0.09 0.00 -1.93 0.00 0.00 57.85 54.42 3k2k n ARG 236 Cb 0.42 -1.10 0.21 0.00 -1.16 0.00 0.00 32.46 30.84 3k2k n ARG 236 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 3k2k n GLU 237 N -0.13 2.54 -0.13 5.56 -0.58 -0.77 -4.82 120.64 122.31 3k2k n GLU 237 Ca 0.04 -2.23 0.00 0.00 -0.42 0.00 0.00 57.16 54.56 3k2k n GLU 237 Cb 0.31 -1.42 0.00 0.00 -0.57 0.00 0.00 31.44 29.77 3k2k n GLU 237 CO 0.00 0.00 0.00 0.91 -0.48 0.00 0.00 177.13 177.56 3k2k n TRP 238 N 1.11 0.00 -0.85 -0.32 7.02 -0.95 -1.59 117.44 121.86 3k2k n TRP 238 Ca 0.17 -0.52 -0.24 0.00 -1.02 0.00 0.00 57.50 55.89 3k2k n TRP 238 Cb 0.52 -0.29 -0.08 0.00 -2.42 0.00 0.00 31.31 29.04 3k2k n TRP 238 CO 0.00 0.00 0.00 -0.85 -2.02 0.00 0.00 177.69 174.82 3k2k n GLU 240 N 0.92 0.01 -1.67 -0.99 0.28 -1.26 -4.96 120.64 112.97 3k2k n GLU 240 Ca 0.00 -0.75 -0.35 0.00 -0.16 0.00 0.00 57.16 55.91 3k2k n GLU 240 Cb 0.40 -2.18 0.07 0.00 1.43 0.00 0.00 31.44 31.15 3k2k n GLU 240 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 3k2k s PRO 241 N 5.97 2.51 -0.01 3.44 0.04 -0.62 -5.03 135.00 141.30 3k2k s PRO 241 Ca 0.46 1.71 0.02 0.00 0.04 0.00 0.00 61.00 63.23 3k2k s PRO 241 Cb 0.06 -1.88 -0.00 0.00 0.04 0.00 0.00 34.50 32.72 3k2k s PRO 241 CO 0.20 -1.54 -0.06 0.34 0.04 0.00 0.00 177.00 175.98 3k2k s ASP 242 N -2.00 0.72 0.48 6.66 2.15 -1.26 -4.90 116.67 118.52 3k2k s ASP 242 Ca 0.74 -0.11 0.14 0.00 0.43 0.00 0.00 52.55 53.75 3k2k s ASP 242 Cb -0.28 -0.11 1.14 0.00 -0.30 0.00 0.00 42.92 43.37 3k2k s ASP 242 CO 0.41 0.06 2.09 0.00 -0.17 0.00 0.00 175.17 177.56 3k2k h ALA 243 N 6.11 1.97 0.00 3.66 0.00 -1.95 -0.70 119.26 128.35 3k2k h ALA 243 Ca -0.30 -0.01 -0.34 0.00 0.00 0.00 0.00 54.91 54.26 3k2k h ALA 243 Cb 1.18 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.86 3k2k h ALA 243 CO 0.50 -0.01 -2.12 0.39 0.00 0.00 0.00 179.25 178.01 3k2k n GLU 244 N -4.50 0.67 -0.11 0.00 -0.58 -1.26 -4.08 120.64 110.79 3k2k n GLU 244 Ca 0.02 0.12 -0.13 0.00 -0.42 0.00 0.00 57.16 56.75 3k2k n GLU 244 Cb 0.17 -1.63 -0.13 0.00 -0.57 0.00 0.00 31.44 29.28 3k2k n GLU 244 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 3k2k n ARG 245 N -2.91 0.73 -2.81 3.49 0.63 -1.19 -4.76 116.66 109.84 3k2k n ARG 245 Ca -0.27 0.07 -0.11 0.00 -0.92 0.00 0.00 57.85 56.61 3k2k n ARG 245 Cb 1.11 -1.49 0.03 0.00 0.45 0.00 0.00 32.46 32.55 3k2k n ARG 245 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 3k2k n SER 246 N -2.98 0.53 0.15 6.15 3.41 -0.33 -4.57 113.62 115.98 3k2k n SER 246 Ca -0.38 -2.83 0.11 0.00 -0.26 0.00 0.00 58.87 55.52 3k2k n SER 246 Cb 1.04 -0.16 0.63 0.00 -0.26 0.00 0.00 64.21 65.47 3k2k n SER 246 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 3k2k h PRO 247 N 2.86 0.06 -0.80 4.33 0.13 -1.54 -1.99 132.00 135.04 3k2k h PRO 247 Ca -0.07 -0.00 0.11 0.00 -0.87 0.00 0.00 66.00 65.16 3k2k h PRO 247 Cb 1.13 -0.01 -0.08 0.00 0.13 0.00 0.00 31.00 32.17 3k2k h PRO 247 CO 0.39 0.04 0.43 0.93 -0.23 0.00 0.00 178.00 179.57 3k2k h GLU 248 N 0.06 0.68 0.14 0.86 3.07 -1.88 -0.17 114.58 117.34 3k2k h GLU 248 Ca 0.10 -0.04 -0.32 0.00 -0.50 0.00 0.00 59.36 58.60 3k2k h GLU 248 Cb 0.32 -0.15 -0.00 0.00 -0.84 0.00 0.00 28.75 28.07 3k2k h GLU 248 CO -0.01 0.45 -1.57 0.28 -1.40 0.00 0.00 179.01 176.76 3k2k h VAL 249 N 0.70 1.11 -0.28 3.13 2.07 -1.80 -3.06 116.25 118.13 3k2k h VAL 249 Ca 0.40 -2.73 0.05 0.00 0.82 0.00 0.00 66.70 65.24 3k2k h VAL 249 Cb 0.43 2.77 -0.08 0.00 -1.52 0.00 0.00 31.29 32.90 3k2k h VAL 249 CO -0.28 0.82 -0.47 0.25 0.02 0.00 0.00 177.57 177.91 3k2k h LEU 250 N 0.08 -1.54 -0.62 2.57 5.85 -0.89 0.25 115.31 121.02 3k2k h LEU 250 Ca -0.26 0.21 -0.15 0.00 0.84 0.00 0.00 57.88 58.52 3k2k h LEU 250 Cb 2.04 0.64 -0.01 0.00 0.37 0.00 0.00 40.66 43.70 3k2k h LEU 250 CO 0.17 -0.42 -0.50 -0.37 -0.34 0.00 0.00 178.44 176.99 3k2k h VAL 251 N -0.44 1.32 -0.09 1.05 -1.51 -1.16 -0.61 116.25 114.82 3k2k h VAL 251 Ca 0.09 -1.72 -0.07 0.00 -1.23 0.00 0.00 66.70 63.76 3k2k h VAL 251 Cb 0.62 1.72 0.00 0.00 -2.13 0.00 0.00 31.29 31.51 3k2k h VAL 251 CO -0.50 0.53 -0.22 0.58 -1.23 0.00 0.00 177.57 176.73 3k2k h VAL 252 N 0.39 1.41 -0.69 7.19 2.07 -1.40 -2.07 116.25 123.14 3k2k h VAL 252 Ca 0.02 -1.55 -0.01 0.00 0.82 0.00 0.00 66.70 65.98 3k2k h VAL 252 Cb 1.01 2.20 -0.03 0.00 -1.52 0.00 0.00 31.29 32.94 3k2k h VAL 252 CO 0.09 0.44 0.41 -0.09 0.02 0.00 0.00 177.57 178.44 3k2k h ARG 253 N -0.17 0.94 -0.90 1.57 2.43 -0.41 -0.89 114.38 116.95 3k2k h ARG 253 Ca -0.00 -0.08 0.02 0.00 -0.81 0.00 0.00 59.98 59.10 3k2k h ARG 253 Cb 0.83 -0.20 -0.05 0.00 -0.42 0.00 0.00 29.97 30.13 3k2k h ARG 253 CO 0.05 0.67 0.59 -0.44 -1.51 0.00 0.00 179.97 179.33 3k2k h ASP 254 N 0.96 1.01 -0.47 -3.80 3.32 -0.95 -1.23 116.42 115.26 3k2k h ASP 254 Ca 0.25 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.23 3k2k h ASP 254 Cb -0.02 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.26 3k2k h ASP 254 CO -0.05 0.72 0.11 0.00 -1.72 0.00 0.00 179.24 178.30 3k2k h ALA 255 N 1.35 0.63 -0.69 3.45 0.00 -0.52 0.12 119.26 123.59 3k2k h ALA 255 Ca 0.34 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 3k2k h ALA 255 Cb -0.09 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 3k2k h ALA 255 CO -0.09 0.32 0.19 0.82 0.00 0.00 0.00 179.25 180.49 3k2k h ILE 256 N 0.64 1.26 -0.75 0.00 2.04 -0.91 -0.07 117.51 119.73 3k2k h ILE 256 Ca 0.15 -0.92 -0.06 0.00 1.00 0.00 0.00 64.86 65.03 3k2k h ILE 256 Cb 0.34 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 36.93 3k2k h ILE 256 CO 0.00 0.35 0.23 0.45 0.00 0.00 0.00 178.15 179.19 3k2k h HIS 257 N 1.02 1.20 0.00 1.37 3.86 -1.02 -0.10 115.15 121.48 3k2k h HIS 257 Ca 0.22 -0.12 0.00 0.00 -1.16 0.00 0.00 60.37 59.31 3k2k h HIS 257 Cb 0.33 -0.35 0.00 0.00 1.06 0.00 0.00 27.41 28.46 3k2k h HIS 257 CO 0.03 0.95 0.00 0.00 0.86 0.00 0.00 177.93 179.76 3k2k h ALA 258 N 1.13 1.00 0.00 2.45 0.00 0.06 -3.35 119.26 120.55 3k2k h ALA 258 Ca 0.24 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.84 3k2k h ALA 258 Cb 0.31 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.04 3k2k h ALA 258 CO -0.01 0.00 -2.18 -0.89 0.00 0.00 0.00 179.25 176.18 3k2k n ILE 259 N -2.92 1.18 0.00 0.00 5.41 -0.12 -5.08 119.36 117.84 3k2k n ILE 259 Ca 0.04 -0.48 0.00 0.00 1.00 0.00 0.00 62.75 63.31 3k2k n ILE 259 Cb 0.47 -1.17 0.00 0.00 -0.71 0.00 0.00 39.64 38.24 3k2k n ILE 259 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3k2k n GLY 260 N 2.45 1.73 3.64 7.39 0.00 -0.06 -5.09 105.19 115.25 3k2k n GLY 260 Ca -0.36 -2.02 -0.07 0.00 0.00 0.00 0.00 46.02 43.57 3k2k n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k2k n ASP 262 N 4.08 4.38 -3.78 0.00 8.00 0.67 -4.87 116.55 125.02 3k2k n ASP 262 Ca -0.19 -0.04 -0.13 0.00 0.71 0.00 0.00 54.79 55.14 3k2k n ASP 262 Cb 0.58 0.95 -0.13 0.00 -0.02 0.00 0.00 41.12 42.51 3k2k n ASP 262 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3k2k s LEU 263 N -2.77 1.02 -0.03 0.64 1.02 -1.03 -4.16 118.68 113.37 3k2k s LEU 263 Ca 0.00 0.38 0.03 0.00 0.02 0.00 0.00 54.13 54.55 3k2k s LEU 263 Cb 0.00 0.58 0.00 0.00 0.02 0.00 0.00 46.19 46.79 3k2k s LEU 263 CO 0.00 -0.10 -0.11 0.12 0.02 0.00 0.00 176.35 176.28 3k2k s PHE 264 N 0.55 1.12 -0.04 0.29 5.36 -0.21 -0.55 117.98 124.51 3k2k s PHE 264 Ca -0.04 -0.30 0.02 0.00 -0.96 0.00 0.00 56.93 55.65 3k2k s PHE 264 Cb -0.05 -0.79 0.01 0.00 -0.34 0.00 0.00 43.02 41.85 3k2k s PHE 264 CO -0.03 -0.12 -0.07 -0.06 -1.46 0.00 0.00 175.22 173.48 3k2k s PHE 265 N 0.20 0.90 -0.28 10.12 0.40 0.01 -1.53 117.98 127.79 3k2k s PHE 265 Ca -0.04 -0.26 -0.01 0.00 -0.60 0.00 0.00 56.93 56.03 3k2k s PHE 265 Cb -0.10 -0.71 0.05 0.00 0.51 0.00 0.00 43.02 42.77 3k2k s PHE 265 CO 0.01 -0.16 -0.03 0.34 0.70 0.00 0.00 175.22 176.08 3k2k s ASP 266 N 0.58 4.72 -0.11 1.36 2.15 -0.60 -1.04 116.67 123.71 3k2k s ASP 266 Ca -0.09 -1.24 -0.19 0.00 0.43 0.00 0.00 52.55 51.46 3k2k s ASP 266 Cb -0.12 -1.67 -0.04 0.00 -0.30 0.00 0.00 42.92 40.79 3k2k s ASP 266 CO 0.01 -0.23 0.52 -0.63 -0.17 0.00 0.00 175.17 174.67 3k2k s ILE 267 N 1.23 5.16 0.25 4.11 -1.09 0.28 -1.26 121.20 129.87 3k2k s ILE 267 Ca -0.05 1.05 0.02 0.00 -2.23 0.00 0.00 60.65 59.43 3k2k s ILE 267 Cb -0.19 -3.86 -0.04 0.00 -1.58 0.00 0.00 42.46 36.79 3k2k s ILE 267 CO -0.02 0.30 0.18 -1.00 -1.23 0.00 0.00 174.94 173.17 3k2k s HIS 268 N 0.71 1.38 0.05 3.97 3.76 0.57 -2.95 115.29 122.77 3k2k s HIS 268 Ca 0.28 -1.48 0.07 0.00 -0.15 0.00 0.00 55.06 53.78 3k2k s HIS 268 Cb -0.16 -0.62 -0.03 0.00 1.11 0.00 0.00 32.58 32.89 3k2k s HIS 268 CO 0.12 -0.72 -0.21 0.20 -0.85 0.00 0.00 174.74 173.28 3k2k s GLY 269 N -3.24 1.14 -0.15 -2.22 0.00 -1.26 -4.15 107.32 97.44 3k2k s GLY 269 Ca 0.40 -1.08 -0.01 0.00 0.00 0.00 0.00 44.72 44.02 3k2k s GLY 269 CO 0.18 -1.02 -0.12 -0.35 0.00 0.00 0.00 173.10 171.79 3k2k s ASP 270 N -1.27 4.03 0.18 1.64 2.15 -1.26 -5.00 116.67 117.15 3k2k s ASP 270 Ca 0.07 -0.35 -0.06 0.00 0.43 0.00 0.00 52.55 52.64 3k2k s ASP 270 Cb -0.09 -1.63 0.09 0.00 -0.30 0.00 0.00 42.92 40.99 3k2k s ASP 270 CO 0.02 0.12 1.53 -0.33 -0.17 0.00 0.00 175.17 176.34 3k2k h GLU 271 N 7.04 0.72 0.00 4.34 3.07 -1.97 -2.88 114.58 124.91 3k2k h GLU 271 Ca -0.30 -0.38 -0.07 0.00 -0.50 0.00 0.00 59.36 58.10 3k2k h GLU 271 Cb 1.20 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 29.11 3k2k h GLU 271 CO 0.57 1.00 -0.70 0.22 -1.40 0.00 0.00 179.01 178.71 3k2k h ASP 272 N 0.59 0.00 -3.13 1.42 3.58 -1.89 -3.39 116.42 113.59 3k2k h ASP 272 Ca 0.04 -0.19 -0.53 0.00 0.42 0.00 0.00 57.03 56.77 3k2k h ASP 272 Cb 0.96 0.00 0.01 0.00 1.72 0.00 0.00 39.33 42.02 3k2k h ASP 272 CO 0.09 0.98 0.61 -0.76 -2.88 0.00 0.00 179.24 177.28 3k2k s LEU 273 N -8.13 4.36 -1.00 2.28 1.43 -1.26 -4.84 118.68 111.53 3k2k s LEU 273 Ca -0.18 2.08 -0.05 0.00 -1.03 0.00 0.00 54.13 54.95 3k2k s LEU 273 Cb 0.03 -3.58 0.08 0.00 0.03 0.00 0.00 46.19 42.75 3k2k s LEU 273 CO 0.34 -0.53 2.57 -0.81 0.23 0.00 0.00 176.35 178.15 3k2k n PRO 274 N 4.04 3.76 -3.78 1.29 -0.04 -1.26 -4.51 135.00 134.49 3k2k n PRO 274 Ca 0.10 -2.98 -0.11 0.00 -0.04 0.00 0.00 63.50 60.47 3k2k n PRO 274 Cb 0.45 -2.45 -0.07 0.00 -0.04 0.00 0.00 33.50 31.39 3k2k n PRO 274 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3k2k s TYR 275 N -1.22 -0.03 -0.16 0.54 2.02 -1.25 -1.01 117.35 116.25 3k2k s TYR 275 Ca 0.57 -0.19 -0.16 0.00 -0.37 0.00 0.00 57.07 56.91 3k2k s TYR 275 Cb 0.26 0.05 -0.04 0.00 -0.40 0.00 0.00 41.96 41.83 3k2k s TYR 275 CO -0.14 -0.51 0.39 0.08 -1.57 0.00 0.00 175.55 173.80 3k2k s VAL 276 N -2.90 5.23 0.16 0.71 1.01 -1.26 -3.96 120.40 119.39 3k2k s VAL 276 Ca -0.02 0.74 -0.16 0.00 0.00 0.00 0.00 61.98 62.54 3k2k s VAL 276 Cb 0.00 -3.73 0.03 0.00 0.00 0.00 0.00 36.38 32.68 3k2k s VAL 276 CO -0.06 0.32 0.43 0.72 0.00 0.00 0.00 175.10 176.52 3k2k s PHE 277 N 0.78 -0.10 0.13 5.22 -0.12 -0.71 -3.02 117.98 120.16 3k2k s PHE 277 Ca 0.21 -0.24 0.11 0.00 -0.05 0.00 0.00 56.93 56.96 3k2k s PHE 277 Cb -0.14 0.27 -0.04 0.00 -0.63 0.00 0.00 43.02 42.48 3k2k s PHE 277 CO 0.07 -0.79 -0.25 0.00 -0.05 0.00 0.00 175.22 174.21 3k2k s ALA 278 N -3.85 2.44 -0.06 1.99 0.00 -1.26 -0.52 121.76 120.50 3k2k s ALA 278 Ca 0.07 -1.44 0.02 0.00 0.00 0.00 0.00 51.96 50.61 3k2k s ALA 278 Cb 0.01 -0.44 0.01 0.00 0.00 0.00 0.00 23.12 22.71 3k2k s ALA 278 CO -0.07 0.55 -0.10 0.00 0.00 0.00 0.00 175.76 176.14 3k2k s ALA 279 N -1.07 1.10 0.00 0.00 0.00 -0.49 -4.96 121.76 116.34 3k2k s ALA 279 Ca 0.15 -0.33 0.00 0.00 0.00 0.00 0.00 51.96 51.78 3k2k s ALA 279 Cb -0.10 -0.52 0.00 0.00 0.00 0.00 0.00 23.12 22.50 3k2k s ALA 279 CO 0.07 0.09 0.00 0.41 0.00 0.00 0.00 175.76 176.33 3k2k n GLY 280 N 3.83 5.41 0.70 0.00 0.00 -1.26 -1.13 105.19 112.73 3k2k n GLY 280 Ca -0.23 -1.96 0.08 0.00 0.00 0.00 0.00 46.02 43.90 3k2k n GLY 280 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3k2k n SER 281 N 0.00 3.40 -2.49 1.61 7.64 -1.26 -4.99 113.62 117.54 3k2k n SER 281 Ca 0.00 -2.74 0.00 0.00 1.01 0.00 0.00 58.87 57.14 3k2k n SER 281 Cb 0.00 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 62.77 3k2k n SER 281 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 3k2k n GLU 282 N -0.37 0.00 -1.54 1.43 0.00 -1.26 -4.79 120.64 114.10 3k2k n GLU 282 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.33 3k2k n GLU 282 Cb 0.72 -1.27 0.00 0.00 0.00 0.00 0.00 31.44 30.89 3k2k n GLU 282 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 3k2k n LEU 284 N 2.43 -2.21 -4.80 -1.84 4.77 -1.26 -4.91 117.00 109.18 3k2k n LEU 284 Ca 0.00 2.97 -0.33 0.00 -0.03 0.00 0.00 56.01 58.62 3k2k n LEU 284 Cb 0.00 -2.87 -0.01 0.00 -2.33 0.00 0.00 43.42 38.21 3k2k n LEU 284 CO 0.14 0.42 0.71 -2.84 -1.33 0.00 0.00 177.39 174.50 3k2k s PRO 285 N -3.87 3.56 0.00 3.23 0.02 -1.26 -3.24 135.00 133.44 3k2k s PRO 285 Ca 0.00 1.24 0.00 0.00 0.02 0.00 0.00 61.00 62.26 3k2k s PRO 285 Cb 0.00 -2.07 0.00 0.00 0.02 0.00 0.00 34.50 32.45 3k2k s PRO 285 CO 0.00 -0.61 0.00 0.41 -0.33 0.00 0.00 177.00 176.47 3k2k n GLY 286 N -0.74 0.79 3.45 0.52 0.00 -1.26 -5.05 105.19 102.90 3k2k n GLY 286 Ca 0.09 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.67 3k2k n GLY 286 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3k2k s PHE 287 N -2.17 3.01 0.88 1.61 5.36 -1.20 -5.04 117.98 120.43 3k2k s PHE 287 Ca 0.00 -0.48 -0.11 0.00 -0.96 0.00 0.00 56.93 55.37 3k2k s PHE 287 Cb 0.00 -3.64 0.12 0.00 -0.34 0.00 0.00 43.02 39.16 3k2k s PHE 287 CO 0.00 -1.10 1.09 0.95 -1.46 0.00 0.00 175.22 174.70 3k2k s THR 288 N 2.84 2.72 0.19 0.12 -4.23 -1.26 -4.88 115.64 111.14 3k2k s THR 288 Ca 0.17 0.24 -0.07 0.00 -1.18 0.00 0.00 61.69 60.85 3k2k s THR 288 Cb -0.18 -2.70 0.03 0.00 1.34 0.00 0.00 72.50 70.98 3k2k s THR 288 CO 0.13 -0.31 1.60 -0.08 -0.54 0.00 0.00 174.62 175.42 3k2k h GLU 289 N -1.52 0.90 0.00 3.99 4.57 -2.00 -2.28 114.58 118.24 3k2k h GLU 289 Ca -0.49 -0.36 -0.04 0.00 -1.18 0.00 0.00 59.36 57.29 3k2k h GLU 289 Cb 1.28 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.82 3k2k h GLU 289 CO 0.54 1.01 -0.19 0.37 -1.18 0.00 0.00 179.01 179.55 3k2k h GLN 290 N 0.78 0.00 -0.41 1.92 5.75 -1.99 -1.37 115.11 119.78 3k2k h GLN 290 Ca 0.11 0.00 -0.14 0.00 -0.15 0.00 0.00 58.65 58.47 3k2k h GLN 290 Cb 0.73 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.28 3k2k h GLN 290 CO 0.06 0.19 -0.30 1.96 -2.65 0.00 0.00 178.83 178.09 3k2k h GLN 291 N 0.00 0.93 -0.44 1.69 4.20 -1.84 -1.66 115.11 118.00 3k2k h GLN 291 Ca -0.00 -0.45 -0.01 0.00 0.06 0.00 0.00 58.65 58.24 3k2k h GLN 291 Cb 0.51 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.27 3k2k h GLN 291 CO 0.03 1.11 0.23 -0.09 -0.67 0.00 0.00 178.83 179.44 3k2k h ARG 292 N 0.76 0.62 -0.37 1.46 2.43 -0.89 -0.84 114.38 117.54 3k2k h ARG 292 Ca 0.08 -0.08 0.01 0.00 -0.81 0.00 0.00 59.98 59.18 3k2k h ARG 292 Cb 0.89 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.30 3k2k h ARG 292 CO 0.08 0.50 0.23 0.28 -1.51 0.00 0.00 179.97 179.55 3k2k h VAL 293 N 0.57 1.06 -0.22 0.20 2.07 -1.17 0.93 116.25 119.70 3k2k h VAL 293 Ca 0.15 -0.16 -0.07 0.00 0.82 0.00 0.00 66.70 67.44 3k2k h VAL 293 Cb 0.07 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 3k2k h VAL 293 CO -0.02 0.09 -0.13 -0.33 0.02 0.00 0.00 177.57 177.20 3k2k h GLU 294 N 0.47 0.47 -0.47 1.57 5.08 -1.18 -1.34 114.58 119.18 3k2k h GLU 294 Ca 0.14 -0.21 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 3k2k h GLU 294 Cb -0.02 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 3k2k h GLU 294 CO -0.05 0.76 0.23 0.37 -1.00 0.00 0.00 179.01 179.31 3k2k h GLN 295 N 0.17 0.68 -0.41 2.33 4.15 -1.01 0.82 115.11 121.83 3k2k h GLN 295 Ca 0.05 -0.10 -0.00 0.00 0.77 0.00 0.00 58.65 59.37 3k2k h GLN 295 Cb 0.63 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.18 3k2k h GLN 295 CO 0.04 0.57 0.25 1.03 -1.93 0.00 0.00 178.83 178.79 3k2k h SER 296 N 0.61 0.49 -0.99 -0.69 0.87 -0.79 -1.28 113.55 111.77 3k2k h SER 296 Ca 0.16 -0.05 0.01 0.00 -1.23 0.00 0.00 61.79 60.68 3k2k h SER 296 Cb 0.12 -0.12 -0.05 0.00 -0.44 0.00 0.00 62.40 61.91 3k2k h SER 296 CO -0.02 0.39 0.66 0.00 -0.53 0.00 0.00 176.83 177.33 3k2k h ALA 297 N 1.12 1.29 -0.30 6.23 0.00 -0.66 -2.31 119.26 124.63 3k2k h ALA 297 Ca 0.15 -0.07 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 3k2k h ALA 297 Cb -0.01 -0.40 -0.00 0.00 0.00 0.00 0.00 17.79 17.37 3k2k h ALA 297 CO -0.03 0.66 -0.35 0.35 0.00 0.00 0.00 179.25 179.88 3k2k h PHE 298 N 1.35 0.93 -0.85 0.00 3.57 -0.43 -1.48 116.94 120.03 3k2k h PHE 298 Ca 0.36 -0.29 0.08 0.00 3.53 0.00 0.00 57.97 61.65 3k2k h PHE 298 Cb -0.16 -0.19 -0.07 0.00 2.79 0.00 0.00 35.95 38.32 3k2k h PHE 298 CO 0.00 1.07 0.51 0.82 -2.23 0.00 0.00 178.31 178.48 3k2k h ILE 299 N 0.53 0.97 -0.54 1.41 1.08 -0.95 -0.55 117.51 119.46 3k2k h ILE 299 Ca 0.04 -0.31 -0.08 0.00 -0.39 0.00 0.00 64.86 64.13 3k2k h ILE 299 Cb 0.94 0.01 -0.02 0.00 -3.07 0.00 0.00 36.82 34.67 3k2k h ILE 299 CO 0.09 0.16 0.04 0.44 -0.69 0.00 0.00 178.15 178.18 3k2k h ASP 300 N 0.89 0.86 -0.44 1.72 3.32 -1.17 -1.59 116.42 120.02 3k2k h ASP 300 Ca 0.39 -0.21 -0.06 0.00 0.02 0.00 0.00 57.03 57.17 3k2k h ASP 300 Cb 0.28 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 3k2k h ASP 300 CO -0.21 0.90 0.06 0.28 -1.72 0.00 0.00 179.24 178.55 3k2k h SER 301 N 0.84 0.76 -0.13 6.45 0.02 -0.19 -2.49 113.55 118.82 3k2k h SER 301 Ca 0.16 -0.16 -0.20 0.00 -0.84 0.00 0.00 61.79 60.76 3k2k h SER 301 Cb 0.45 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.79 3k2k h SER 301 CO 0.02 0.79 -0.66 0.15 -1.14 0.00 0.00 176.83 175.99 3k2k h PHE 302 N 0.76 0.97 -0.68 3.45 3.04 -0.85 -0.45 116.94 123.18 3k2k h PHE 302 Ca 0.16 -0.39 0.01 0.00 3.98 0.00 0.00 57.97 61.73 3k2k h PHE 302 Cb 0.37 -0.17 -0.03 0.00 2.56 0.00 0.00 35.95 38.68 3k2k h PHE 302 CO 0.02 1.20 0.45 0.87 -2.02 0.00 0.00 178.31 178.83 3k2k h LYS 303 N 0.54 0.88 0.00 1.11 1.57 -1.16 -1.36 116.57 118.15 3k2k h LYS 303 Ca -0.02 -0.05 -0.09 0.00 -1.87 0.00 0.00 60.65 58.62 3k2k h LYS 303 Cb 1.26 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 33.36 3k2k h LYS 303 CO 0.14 0.59 -0.41 -0.09 -0.57 0.00 0.00 179.45 179.10 3k2k h ARG 304 N 0.91 0.00 0.08 3.15 2.43 -1.20 -3.20 114.38 116.55 3k2k h ARG 304 Ca 0.25 0.00 -0.25 0.00 -0.81 0.00 0.00 59.98 59.17 3k2k h ARG 304 Cb -0.08 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 3k2k h ARG 304 CO -0.06 0.41 -1.16 0.00 -1.51 0.00 0.00 179.97 177.65 3k2k h ALA 305 N 1.59 0.19 -2.82 2.80 0.00 -0.13 -3.46 119.26 117.41 3k2k h ALA 305 Ca -0.00 -0.90 -0.17 0.00 0.00 0.00 0.00 54.91 53.84 3k2k h ALA 305 Cb 1.04 -0.05 -0.29 0.00 0.00 0.00 0.00 17.79 18.49 3k2k h ALA 305 CO 0.05 1.08 -0.43 0.45 0.00 0.00 0.00 179.25 180.40 3k2k s SER 306 N -6.99 -0.20 0.53 0.00 0.15 -0.61 -4.89 113.70 101.69 3k2k s SER 306 Ca -0.02 0.70 0.19 0.00 0.70 0.00 0.00 55.95 57.51 3k2k s SER 306 Cb 0.08 0.68 1.36 0.00 -1.71 0.00 0.00 66.02 66.44 3k2k s SER 306 CO 0.86 -0.20 2.16 -0.65 1.20 0.00 0.00 173.24 176.61 3k2k h PRO 307 N 7.53 0.00 -0.81 5.44 0.11 -1.87 -2.36 132.00 140.04 3k2k h PRO 307 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 3k2k h PRO 307 Cb 1.15 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.22 3k2k h PRO 307 CO 0.27 0.02 0.52 -0.44 -0.21 0.00 0.00 178.00 178.16 3k2k h ASP 308 N 0.00 0.95 -3.85 -2.05 3.32 -1.94 -3.42 116.42 109.43 3k2k h ASP 308 Ca -0.00 -0.04 -0.51 0.00 0.02 0.00 0.00 57.03 56.50 3k2k h ASP 308 Cb 0.04 -0.24 0.04 0.00 0.22 0.00 0.00 39.33 39.39 3k2k h ASP 308 CO 0.00 0.71 0.56 0.12 -1.72 0.00 0.00 179.24 178.91 3k2k s PHE 309 N -5.88 3.29 0.17 4.55 5.36 -0.89 -4.35 117.98 120.24 3k2k s PHE 309 Ca -0.12 1.55 -0.10 0.00 -0.96 0.00 0.00 56.93 57.31 3k2k s PHE 309 Cb 0.18 -3.49 -0.01 0.00 -0.34 0.00 0.00 43.02 39.37 3k2k s PHE 309 CO 0.80 -1.24 0.31 1.14 -1.46 0.00 0.00 175.22 174.77 3k2k s GLN 310 N -1.67 1.20 -0.02 10.12 1.03 -1.17 -4.75 119.66 124.40 3k2k s GLN 310 Ca 0.47 -1.16 0.04 0.00 0.04 0.00 0.00 55.36 54.75 3k2k s GLN 310 Cb -0.36 0.39 0.05 0.00 0.03 0.00 0.00 33.01 33.13 3k2k s GLN 310 CO 0.47 -0.45 0.87 -0.40 -2.54 0.00 0.00 175.29 173.24 3k2k n ASP 311 N -0.24 1.01 -0.08 12.60 5.75 -1.26 -4.48 116.55 129.86 3k2k n ASP 311 Ca -0.07 -1.88 -0.15 0.00 -0.01 0.00 0.00 54.79 52.68 3k2k n ASP 311 Cb 0.63 -0.12 -0.12 0.00 -1.03 0.00 0.00 41.12 40.48 3k2k n ASP 311 CO 0.00 0.00 0.00 -0.08 -0.11 0.00 0.00 177.20 177.01 3k2k h GLU 312 N 0.00 0.00 -6.11 0.11 4.81 -1.98 -3.46 114.58 107.95 3k2k h GLU 312 Ca 0.00 0.00 -0.58 0.00 -0.13 0.00 0.00 59.36 58.65 3k2k h GLU 312 Cb 0.94 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.28 3k2k h GLU 312 CO 0.00 0.93 -0.36 -1.01 -0.73 0.00 0.00 179.01 177.84 3k2k s HIS 313 N -2.22 3.49 -2.98 0.92 3.76 -1.26 -5.05 115.29 111.95 3k2k s HIS 313 Ca -0.20 0.45 0.00 0.00 -0.15 0.00 0.00 55.06 55.16 3k2k s HIS 313 Cb -0.01 -1.93 0.00 0.00 1.11 0.00 0.00 32.58 31.76 3k2k s HIS 313 CO 0.62 0.46 0.00 0.41 -0.85 0.00 0.00 174.74 175.39 3k2k n GLY 314 N 0.04 -1.17 3.93 -2.22 0.00 -1.26 -4.82 105.19 99.68 3k2k n GLY 314 Ca -0.03 -1.03 -0.26 0.00 0.00 0.00 0.00 46.02 44.70 3k2k n GLY 314 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3k2k s TYR 315 N -3.00 3.49 0.78 1.61 2.02 -1.26 -5.08 117.35 115.90 3k2k s TYR 315 Ca 0.00 0.43 -0.11 0.00 -0.37 0.00 0.00 57.07 57.03 3k2k s TYR 315 Cb 0.00 -1.94 0.06 0.00 -0.40 0.00 0.00 41.96 39.68 3k2k s TYR 315 CO 0.00 0.23 1.09 -1.25 -1.57 0.00 0.00 175.55 174.05 3k2k s PRO 316 N -3.73 2.19 0.15 -1.71 0.04 -1.26 -4.96 135.00 125.72 3k2k s PRO 316 Ca 0.41 1.16 -0.17 0.00 0.04 0.00 0.00 61.00 62.44 3k2k s PRO 316 Cb -0.10 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.55 3k2k s PRO 316 CO 0.32 -1.69 1.81 -1.00 0.04 0.00 0.00 177.00 176.48 3k2k h PRO 317 N -1.16 0.49 -1.33 0.56 0.13 -2.03 -2.72 132.00 125.94 3k2k h PRO 317 Ca -0.44 -0.03 -0.11 0.00 -0.87 0.00 0.00 66.00 64.55 3k2k h PRO 317 Cb 1.23 -0.11 -0.06 0.00 0.13 0.00 0.00 31.00 32.19 3k2k h PRO 317 CO 0.51 0.33 0.15 0.41 -0.23 0.00 0.00 178.00 179.16 3k2k n GLY 318 N -1.20 2.76 0.31 1.56 0.00 -1.26 -4.31 105.19 103.05 3k2k n GLY 318 Ca 0.00 -0.31 -0.08 0.00 0.00 0.00 0.00 46.02 45.63 3k2k n GLY 318 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3k2k h LYS 319 N 0.60 1.09 -0.42 1.61 1.63 -1.86 -3.29 116.57 115.93 3k2k h LYS 319 Ca 0.12 -0.29 -0.29 0.00 -0.85 0.00 0.00 60.65 59.34 3k2k h LYS 319 Cb 1.20 -0.13 -0.38 0.00 -0.60 0.00 0.00 32.23 32.32 3k2k h LYS 319 CO 0.25 1.00 -1.00 0.66 -3.45 0.00 0.00 179.45 176.91 3k2k n TYR 320 N -4.24 1.36 0.26 1.91 4.01 -1.26 -4.79 117.16 114.40 3k2k n TYR 320 Ca 0.04 -1.89 0.09 0.00 -0.16 0.00 0.00 57.90 55.99 3k2k n TYR 320 Cb 0.29 -0.25 0.68 0.00 -0.31 0.00 0.00 39.34 39.75 3k2k n TYR 320 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3k2k h ARG 321 N 2.18 0.00 0.20 -0.72 -0.00 -1.80 -2.82 114.38 111.42 3k2k h ARG 321 Ca -0.02 0.00 -0.01 0.00 -0.50 0.00 0.00 59.98 59.45 3k2k h ARG 321 Cb 1.41 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.38 3k2k h ARG 321 CO 0.30 0.00 -0.10 1.05 0.00 0.00 0.00 179.97 181.22 3k2k h GLU 322 N 0.00 -0.26 0.00 0.04 4.11 -1.86 -3.05 114.58 113.55 3k2k h GLU 322 Ca 0.01 0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.46 3k2k h GLU 322 Cb 0.04 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.35 3k2k h GLU 322 CO -0.00 0.06 0.00 -0.25 0.07 0.00 0.00 179.01 178.89 3k2k n ASP 323 N -5.06 0.00 0.00 3.06 8.00 -1.17 -4.90 116.55 116.49 3k2k n ASP 323 Ca -0.09 0.28 0.00 0.00 0.71 0.00 0.00 54.79 55.69 3k2k n ASP 323 Cb 0.23 -0.39 0.00 0.00 -0.02 0.00 0.00 41.12 40.94 3k2k n ASP 323 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3k2k n ALA 324 N -1.39 0.00 0.47 2.24 0.00 -1.07 -1.50 120.51 119.26 3k2k n ALA 324 Ca 0.05 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.55 3k2k n ALA 324 Cb 0.15 0.00 0.19 0.00 0.00 0.00 0.00 19.45 19.79 3k2k n ALA 324 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3k2k n PHE 325 N 9.27 0.74 0.27 0.00 3.72 -1.26 -3.71 117.46 126.49 3k2k n PHE 325 Ca 0.00 -0.31 0.14 0.00 -0.05 0.00 0.00 57.45 57.23 3k2k n PHE 325 Cb 0.00 -0.11 0.41 0.00 -0.94 0.00 0.00 39.48 38.84 3k2k n PHE 325 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 3k2k h LYS 326 N 2.27 0.00 -6.35 -1.08 1.57 -1.58 -3.37 116.57 108.03 3k2k h LYS 326 Ca 0.00 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.23 3k2k h LYS 326 Cb 0.80 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.07 3k2k h LYS 326 CO 0.09 0.00 0.10 -0.51 -0.57 0.00 0.00 179.45 178.57 3k2k s LEU 327 N -6.03 4.52 0.14 2.94 1.02 -1.23 -2.23 118.68 117.80 3k2k s LEU 327 Ca 0.05 1.45 -0.21 0.00 0.02 0.00 0.00 54.13 55.43 3k2k s LEU 327 Cb 0.07 -3.15 0.01 0.00 0.02 0.00 0.00 46.19 43.14 3k2k s LEU 327 CO 0.60 0.16 1.66 0.00 0.02 0.00 0.00 176.35 178.79 3k2k h ALA 328 N 4.89 -0.03 -0.15 4.21 0.00 -1.86 -0.03 119.26 126.29 3k2k h ALA 328 Ca -0.47 0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.40 3k2k h ALA 328 Cb 1.21 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 3k2k h ALA 328 CO 0.67 -0.59 -0.43 0.66 0.00 0.00 0.00 179.25 179.56 3k2k h SER 329 N -0.17 0.37 -0.29 0.00 4.64 -1.94 -0.22 113.55 115.94 3k2k h SER 329 Ca 0.12 -0.16 -0.06 0.00 -0.47 0.00 0.00 61.79 61.22 3k2k h SER 329 Cb 0.34 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.32 3k2k h SER 329 CO -0.29 0.76 -0.04 0.11 -0.87 0.00 0.00 176.83 176.50 3k2k h LYS 330 N 0.29 0.54 -0.05 4.77 6.56 -1.75 -1.50 116.57 125.43 3k2k h LYS 330 Ca 0.02 -0.19 -0.00 0.00 -1.06 0.00 0.00 60.65 59.42 3k2k h LYS 330 Cb 0.88 -0.04 -0.00 0.00 -0.57 0.00 0.00 32.23 32.50 3k2k h LYS 330 CO 0.07 0.72 0.03 -0.92 -2.06 0.00 0.00 179.45 177.29 3k2k h TYR 331 N 0.32 0.06 -0.47 -1.35 3.20 -0.69 -2.06 116.97 115.99 3k2k h TYR 331 Ca 0.08 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.91 3k2k h TYR 331 Cb 0.50 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.73 3k2k h TYR 331 CO 0.04 0.12 0.14 0.82 -1.64 0.00 0.00 178.16 177.64 3k2k h ILE 332 N -0.01 1.23 -0.70 1.81 1.08 -1.05 0.11 117.51 119.98 3k2k h ILE 332 Ca 0.02 -0.77 0.12 0.00 -0.39 0.00 0.00 64.86 63.84 3k2k h ILE 332 Cb 0.08 0.85 -0.09 0.00 -3.07 0.00 0.00 36.82 34.59 3k2k h ILE 332 CO -0.00 0.28 0.26 1.23 -0.69 0.00 0.00 178.15 179.23 3k2k h GLY 333 N 0.62 1.02 0.86 5.37 0.00 -1.20 0.82 103.07 110.56 3k2k h GLY 333 Ca 0.15 -0.13 -0.17 0.00 0.00 0.00 0.00 47.33 47.18 3k2k h GLY 333 CO -0.00 -0.07 -0.63 0.84 0.00 0.00 0.00 176.54 176.67 3k2k h HIS 334 N 0.42 0.69 -0.51 5.60 -0.00 -0.88 0.42 115.15 120.89 3k2k h HIS 334 Ca 0.37 -0.36 -0.07 0.00 -0.00 0.00 0.00 60.37 60.32 3k2k h HIS 334 Cb 0.53 -0.08 -0.02 0.00 -0.00 0.00 0.00 27.41 27.83 3k2k h HIS 334 CO -0.17 1.17 0.04 -0.09 -0.00 0.00 0.00 177.93 178.88 3k2k h ARG 335 N 0.01 0.83 0.00 5.26 9.65 -0.58 -3.34 114.38 126.21 3k2k h ARG 335 Ca -0.07 -0.21 0.00 0.00 -1.10 0.00 0.00 59.98 58.60 3k2k h ARG 335 Cb 1.32 -0.10 0.00 0.00 -1.39 0.00 0.00 29.97 29.80 3k2k h ARG 335 CO 0.13 0.81 -0.67 1.19 2.80 0.00 0.00 179.97 184.22 3k2k n PHE 336 N -4.23 0.00 -2.21 2.20 3.72 0.25 -5.01 117.46 112.18 3k2k n PHE 336 Ca 0.03 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.24 3k2k n PHE 336 Cb 0.28 -0.05 -0.03 0.00 -0.94 0.00 0.00 39.48 38.74 3k2k n PHE 336 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3k2k n GLY 337 N 1.41 0.05 3.96 1.37 0.00 0.15 -4.98 105.19 107.14 3k2k n GLY 337 Ca 0.01 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 3k2k n GLY 337 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k2k s LEU 339 N -4.44 4.37 -0.11 0.00 2.96 -1.26 -4.72 118.68 115.48 3k2k s LEU 339 Ca 0.47 2.52 -0.04 0.00 -0.22 0.00 0.00 54.13 56.87 3k2k s LEU 339 Cb -0.04 -3.57 0.06 0.00 0.50 0.00 0.00 46.19 43.13 3k2k s LEU 339 CO 0.30 -0.86 0.18 -0.55 -1.32 0.00 0.00 176.35 174.09 3k2k s SER 340 N 1.97 0.89 0.04 3.68 0.15 -1.26 -1.04 113.70 118.14 3k2k s SER 340 Ca 0.72 0.22 0.02 0.00 0.70 0.00 0.00 55.95 57.61 3k2k s SER 340 Cb -0.41 0.31 -0.03 0.00 -1.71 0.00 0.00 66.02 64.18 3k2k s SER 340 CO 0.32 -0.26 -0.06 -0.76 1.20 0.00 0.00 173.24 173.67 3k2k s LEU 341 N 2.30 2.28 -0.18 3.45 1.43 -0.58 -4.47 118.68 122.92 3k2k s LEU 341 Ca 0.03 -0.59 -0.09 0.00 -1.03 0.00 0.00 54.13 52.45 3k2k s LEU 341 Cb -0.13 -0.09 -0.05 0.00 0.03 0.00 0.00 46.19 45.96 3k2k s LEU 341 CO -0.07 -0.26 0.13 -0.89 0.23 0.00 0.00 176.35 175.49 3k2k s THR 342 N -1.67 5.43 -0.10 5.49 2.01 -0.28 -1.56 115.64 124.95 3k2k s THR 342 Ca -0.09 0.19 0.01 0.00 0.31 0.00 0.00 61.69 62.11 3k2k s THR 342 Cb -0.08 -3.44 -0.02 0.00 0.01 0.00 0.00 72.50 68.97 3k2k s THR 342 CO -0.01 0.49 -0.13 -0.22 -0.69 0.00 0.00 174.62 174.06 3k2k s LEU 343 N -0.03 2.75 0.36 4.42 2.96 -0.39 -1.40 118.68 127.35 3k2k s LEU 343 Ca 0.10 -0.27 0.04 0.00 -0.22 0.00 0.00 54.13 53.78 3k2k s LEU 343 Cb -0.11 -1.60 -0.05 0.00 0.50 0.00 0.00 46.19 44.93 3k2k s LEU 343 CO -0.00 0.24 0.08 -0.70 -1.32 0.00 0.00 176.35 174.64 3k2k s GLU 344 N -0.07 1.77 0.08 1.98 2.56 0.32 -0.32 118.70 125.02 3k2k s GLU 344 Ca -0.02 -2.03 0.09 0.00 0.00 0.00 0.00 54.97 53.01 3k2k s GLU 344 Cb -0.14 -0.82 -0.03 0.00 2.00 0.00 0.00 34.13 35.14 3k2k s GLU 344 CO 0.04 -0.29 -0.23 -1.25 -0.56 0.00 0.00 175.26 172.96 3k2k s PRO 346 N -3.83 1.41 0.31 4.30 0.04 -1.25 -1.73 135.00 134.23 3k2k s PRO 346 Ca 0.31 -1.13 0.19 0.00 0.04 0.00 0.00 61.00 60.41 3k2k s PRO 346 Cb 0.06 -1.66 0.14 0.00 0.04 0.00 0.00 34.50 33.08 3k2k s PRO 346 CO 0.14 0.41 1.40 0.74 0.04 0.00 0.00 177.00 179.73 3k2k h PHE 347 N 4.42 0.00 0.00 0.56 0.04 -1.76 -3.42 116.94 116.78 3k2k h PHE 347 Ca -0.46 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.31 3k2k h PHE 347 Cb 1.16 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.31 3k2k h PHE 347 CO 0.55 0.26 0.00 1.63 -0.60 0.00 0.00 178.31 180.15 3k2k n LYS 348 N -3.08 0.00 -3.79 1.51 5.02 -1.26 -4.75 118.16 111.81 3k2k n LYS 348 Ca 0.01 0.00 -0.04 0.00 -2.02 0.00 0.00 58.31 56.26 3k2k n LYS 348 Cb 0.65 -0.22 -0.01 0.00 -0.02 0.00 0.00 35.03 35.44 3k2k n LYS 348 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3k2k s ASP 349 N -1.00 -0.15 -0.56 4.39 -1.08 -1.26 -2.78 116.67 114.24 3k2k s ASP 349 Ca 0.00 -0.51 -0.23 0.00 -0.52 0.00 0.00 52.55 51.29 3k2k s ASP 349 Cb 0.00 0.53 0.05 0.00 -1.46 0.00 0.00 42.92 42.04 3k2k s ASP 349 CO 0.00 -1.00 0.90 0.21 0.52 0.00 0.00 175.17 175.80 3k2k s ASN 350 N -3.02 6.31 0.52 -0.34 3.84 -1.26 -3.84 114.94 117.15 3k2k s ASN 350 Ca 0.14 -0.49 0.23 0.00 0.21 0.00 0.00 52.86 52.94 3k2k s ASN 350 Cb -0.02 -2.42 1.35 0.00 -0.55 0.00 0.00 41.25 39.61 3k2k s ASN 350 CO 0.04 -1.21 2.03 0.00 -2.79 0.00 0.00 177.10 175.17 3k2k h ALA 351 N 9.30 2.36 -0.42 1.71 0.00 -1.49 -0.50 119.26 130.23 3k2k h ALA 351 Ca -0.27 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.53 3k2k h ALA 351 Cb 1.08 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 3k2k h ALA 351 CO 1.08 -0.48 -0.14 -0.91 0.00 0.00 0.00 179.25 178.80 3k2k h ASN 352 N 0.03 0.78 -2.04 0.00 2.35 -1.91 -3.38 115.58 111.40 3k2k h ASN 352 Ca 0.20 -0.24 -0.57 0.00 -0.55 0.00 0.00 56.30 55.14 3k2k h ASN 352 Cb 0.76 -0.21 -0.40 0.00 0.05 0.00 0.00 38.32 38.52 3k2k h ASN 352 CO -0.01 0.93 -1.00 0.18 -1.65 0.00 0.00 177.43 175.88 3k2k n LEU 353 N -4.15 0.97 -4.81 1.61 4.77 -0.28 -5.13 117.00 109.98 3k2k n LEU 353 Ca 0.01 -4.86 -0.30 0.00 -0.03 0.00 0.00 56.01 50.82 3k2k n LEU 353 Cb 0.38 0.36 0.08 0.00 -2.33 0.00 0.00 43.42 41.91 3k2k n LEU 353 CO 0.43 2.08 0.71 -2.16 -1.33 0.00 0.00 177.39 177.12 3k2k s PRO 354 N -1.50 2.37 -0.19 3.23 0.04 -0.67 -4.53 135.00 133.75 3k2k s PRO 354 Ca 0.36 0.75 -0.04 0.00 0.04 0.00 0.00 61.00 62.12 3k2k s PRO 354 Cb 0.17 -1.94 0.08 0.00 0.04 0.00 0.00 34.50 32.85 3k2k s PRO 354 CO -0.09 -1.45 0.21 0.34 0.04 0.00 0.00 177.00 176.05 3k2k s ASP 355 N -3.86 1.37 0.18 6.66 -1.08 -1.26 -5.05 116.67 113.63 3k2k s ASP 355 Ca 0.60 -0.18 -0.12 0.00 -0.52 0.00 0.00 52.55 52.33 3k2k s ASP 355 Cb -0.14 0.33 0.09 0.00 -1.46 0.00 0.00 42.92 41.73 3k2k s ASP 355 CO 0.55 -0.32 1.78 -0.08 0.52 0.00 0.00 175.17 177.61 3k2k h GLU 356 N 8.33 0.87 -0.70 4.34 4.22 -1.97 0.37 114.58 130.03 3k2k h GLU 356 Ca -0.16 -0.12 -0.05 0.00 0.08 0.00 0.00 59.36 59.11 3k2k h GLU 356 Cb 1.15 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 30.20 3k2k h GLU 356 CO 0.26 0.68 0.24 1.25 -2.18 0.00 0.00 179.01 179.26 3k2k h HIS 357 N 0.84 1.11 0.00 0.92 -0.00 -1.96 -3.38 115.15 112.68 3k2k h HIS 357 Ca 0.21 -0.10 0.00 0.00 -0.00 0.00 0.00 60.37 60.48 3k2k h HIS 357 Cb 0.08 -0.32 0.00 0.00 -0.00 0.00 0.00 27.41 27.17 3k2k h HIS 357 CO -0.00 0.88 -0.43 0.44 -0.00 0.00 0.00 177.93 178.82 3k2k n ILE 358 N -4.32 0.00 -3.73 6.26 -5.35 -1.16 -1.31 119.36 109.74 3k2k n ILE 358 Ca 0.05 -0.21 0.00 0.00 -0.27 0.00 0.00 62.75 62.32 3k2k n ILE 358 Cb 0.21 0.72 0.00 0.00 -1.74 0.00 0.00 39.64 38.82 3k2k n ILE 358 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3k2k n GLY 359 N 1.49 1.94 3.78 3.28 0.00 0.11 -4.34 105.19 111.45 3k2k n GLY 359 Ca 0.00 -0.44 -0.37 0.00 0.00 0.00 0.00 46.02 45.20 3k2k n GLY 359 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3k2k s TRP 360 N 0.00 3.74 0.12 1.61 -0.11 -1.12 -4.67 118.94 118.51 3k2k s TRP 360 Ca 0.00 1.71 -0.02 0.00 1.22 0.00 0.00 56.10 59.01 3k2k s TRP 360 Cb 0.00 -2.86 0.01 0.00 -1.50 0.00 0.00 33.47 29.12 3k2k s TRP 360 CO 0.00 0.29 0.20 0.27 -4.62 0.00 0.00 176.95 173.09 3k2k n ASN 361 N 0.78 -0.57 -0.21 5.86 6.94 -1.26 -4.91 115.26 121.90 3k2k n ASN 361 Ca 0.00 -1.58 -0.06 0.00 -0.02 0.00 0.00 54.58 52.92 3k2k n ASN 361 Cb 0.50 1.01 0.03 0.00 -2.36 0.00 0.00 39.78 38.96 3k2k n ASN 361 CO 0.00 0.00 0.00 1.23 -1.03 0.00 0.00 177.26 177.46 3k2k h GLY 362 N 0.65 0.84 1.01 4.83 0.00 -1.95 -1.97 103.07 106.48 3k2k h GLY 362 Ca -0.10 -0.32 -0.06 0.00 0.00 0.00 0.00 47.33 46.85 3k2k h GLY 362 CO 0.13 0.32 0.10 0.00 0.00 0.00 0.00 176.54 177.09 3k2k h ALA 363 N 1.21 0.74 -0.47 3.60 0.00 -1.97 0.82 119.26 123.20 3k2k h ALA 363 Ca 0.22 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.77 3k2k h ALA 363 Cb -0.07 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 3k2k h ALA 363 CO -0.05 0.48 -0.16 0.00 0.00 0.00 0.00 179.25 179.52 3k2k h ARG 364 N 0.82 0.91 -0.36 0.00 3.08 -1.94 -0.31 114.38 116.57 3k2k h ARG 364 Ca 0.17 -0.35 -0.03 0.00 0.07 0.00 0.00 59.98 59.84 3k2k h ARG 364 Cb 0.40 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.38 3k2k h ARG 364 CO 0.01 1.00 0.11 0.77 -1.07 0.00 0.00 179.97 180.78 3k2k h SER 365 N 0.80 0.53 -0.67 7.04 0.02 -0.87 -1.76 113.55 118.64 3k2k h SER 365 Ca 0.12 -0.21 -0.02 0.00 -0.84 0.00 0.00 61.79 60.84 3k2k h SER 365 Cb 0.70 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.07 3k2k h SER 365 CO 0.05 0.60 0.35 0.00 -1.14 0.00 0.00 176.83 176.69 3k2k h ALA 366 N 0.95 1.31 -0.52 3.77 0.00 -0.65 -1.20 119.26 122.92 3k2k h ALA 366 Ca 0.12 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 3k2k h ALA 366 Cb 0.27 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3k2k h ALA 366 CO -0.00 0.54 -0.15 0.77 0.00 0.00 0.00 179.25 180.41 3k2k h SER 367 N 0.97 1.03 -0.81 0.00 0.02 -0.83 -1.71 113.55 112.22 3k2k h SER 367 Ca 0.24 -0.37 -0.03 0.00 -0.84 0.00 0.00 61.79 60.80 3k2k h SER 367 Cb 0.07 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 62.30 3k2k h SER 367 CO -0.03 1.16 0.41 0.25 -1.14 0.00 0.00 176.83 177.48 3k2k h LEU 368 N 0.88 1.05 -0.09 5.07 5.85 -0.88 0.18 115.31 127.37 3k2k h LEU 368 Ca 0.13 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 3k2k h LEU 368 Cb 0.73 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.49 3k2k h LEU 368 CO 0.06 0.87 0.04 1.23 -0.34 0.00 0.00 178.44 180.30 3k2k h GLY 369 N 1.18 0.15 1.15 3.75 0.00 -0.95 -2.38 103.07 105.97 3k2k h GLY 369 Ca 0.28 -0.08 -0.00 0.00 0.00 0.00 0.00 47.33 47.54 3k2k h GLY 369 CO -0.04 0.07 0.52 0.00 0.00 0.00 0.00 176.54 177.09 3k2k h ALA 370 N 0.89 1.33 0.00 3.60 0.00 -1.07 -3.24 119.26 120.77 3k2k h ALA 370 Ca 0.03 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 3k2k h ALA 370 Cb 0.15 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 3k2k h ALA 370 CO -0.00 0.59 0.00 0.00 0.00 0.00 0.00 179.25 179.83 3k2k n ALA 371 N -2.41 2.54 0.00 0.00 0.00 0.03 -4.20 120.51 116.48 3k2k n ALA 371 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.53 3k2k n ALA 371 Cb 0.05 -1.59 0.00 0.00 0.00 0.00 0.00 19.45 17.91 3k2k n ALA 371 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3k2k n LEU 373 N 1.80 0.00 -0.19 0.00 4.77 -1.22 -3.55 117.00 118.62 3k2k n LEU 373 Ca 0.00 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.90 3k2k n LEU 373 Cb 0.21 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.32 3k2k n LEU 373 CO 0.00 0.00 0.97 1.23 -1.33 0.00 0.00 177.39 178.27 3k2k h GLY 374 N 0.00 0.84 1.21 -0.72 0.00 -1.92 -1.05 103.07 101.43 3k2k h GLY 374 Ca 0.00 -0.44 -0.09 0.00 0.00 0.00 0.00 47.33 46.80 3k2k h GLY 374 CO 0.00 0.42 -0.02 0.00 0.00 0.00 0.00 176.54 176.94 3k2k h ALA 375 N 1.07 0.94 -0.43 3.60 0.00 -1.81 -2.10 119.26 120.53 3k2k h ALA 375 Ca 0.18 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 3k2k h ALA 375 Cb 0.17 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3k2k h ALA 375 CO -0.02 0.63 -0.04 0.82 0.00 0.00 0.00 179.25 180.64 3k2k h ILE 376 N 0.86 1.24 -0.27 0.00 2.04 -1.80 -1.34 117.51 118.23 3k2k h ILE 376 Ca 0.15 -1.03 -0.03 0.00 1.00 0.00 0.00 64.86 64.96 3k2k h ILE 376 Cb 0.54 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 37.57 3k2k h ILE 376 CO 0.03 0.36 0.06 0.25 0.00 0.00 0.00 178.15 178.84 3k2k h LEU 377 N 0.67 0.42 -0.30 1.44 5.85 -0.81 -0.45 115.31 122.13 3k2k h LEU 377 Ca 0.13 -0.24 0.06 0.00 0.84 0.00 0.00 57.88 58.66 3k2k h LEU 377 Cb 0.48 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.34 3k2k h LEU 377 CO 0.02 0.56 -0.05 -0.33 -0.34 0.00 0.00 178.44 178.30 3k2k h GLU 378 N 0.27 0.03 0.01 1.25 5.08 -1.19 -1.78 114.58 118.25 3k2k h GLU 378 Ca 0.08 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.44 3k2k h GLU 378 Cb 0.31 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.55 3k2k h GLU 378 CO 0.00 0.02 -0.01 1.25 -1.00 0.00 0.00 179.01 179.27 3k2k h HIS 379 N 0.03 -0.02 -0.59 4.33 2.76 -0.89 -0.61 115.15 120.16 3k2k h HIS 379 Ca 0.15 -0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.30 3k2k h HIS 379 Cb 0.21 0.01 -0.03 0.00 1.55 0.00 0.00 27.41 29.15 3k2k h HIS 379 CO -0.27 0.07 0.30 0.28 -1.30 0.00 0.00 177.93 177.01 3k2k h VAL 380 N -0.10 1.19 -0.23 5.26 2.07 -1.05 -0.28 116.25 123.11 3k2k h VAL 380 Ca -0.00 -0.51 -0.02 0.00 0.82 0.00 0.00 66.70 66.98 3k2k h VAL 380 Cb 0.09 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 3k2k h VAL 380 CO 0.00 0.22 0.05 0.03 0.02 0.00 0.00 177.57 177.89 3k2k h ARG 381 N 0.83 0.38 0.00 1.57 3.08 -0.98 -3.21 114.38 116.04 3k2k h ARG 381 Ca 0.21 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.15 3k2k h ARG 381 Cb 0.06 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.06 3k2k h ARG 381 CO -0.03 0.49 -0.06 0.00 -1.07 0.00 0.00 179.97 179.30 3k2k h ALA 382 N 0.87 1.04 0.00 0.04 0.00 -0.21 -3.52 119.26 117.49 3k2k h ALA 382 Ca 0.07 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3k2k h ALA 382 Cb 0.29 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3k2k h ALA 382 CO 0.00 0.07 0.00 1.19 0.00 0.00 0.00 179.25 180.52