#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k3t s ALA -2 N 0.00 1.86 -0.36 4.61 0.00 -1.26 -4.99 121.76 121.62 2k3t s ALA -2 Ca 0.00 -0.21 0.27 0.00 0.00 0.00 0.00 51.96 52.02 2k3t s ALA -2 Cb 0.00 -3.13 0.81 0.00 0.00 0.00 0.00 23.12 20.80 2k3t s ALA -2 CO 0.00 -2.08 1.76 0.52 0.00 0.00 0.00 175.76 175.96 2k3t h MET -1 N -1.35 0.00 -6.42 0.00 2.86 -1.88 -3.46 114.93 104.68 2k3t h MET -1 Ca -0.49 0.00 -0.54 0.00 -2.06 0.00 0.00 59.70 56.61 2k3t h MET -1 Cb 1.29 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.94 2k3t h MET -1 CO 0.58 0.00 0.54 0.20 1.06 0.00 0.00 176.91 179.29 2k3t s GLY 2427N -3.98 2.48 -0.08 8.32 0.00 -1.04 -4.74 107.32 108.28 2k3t s GLY 2427Ca 0.06 0.70 -0.12 0.00 0.00 0.00 0.00 44.72 45.35 2k3t s GLY 2427CO 0.58 1.97 0.31 0.99 0.00 0.00 0.00 173.10 176.96 2k3t s ASP 2428N 1.13 -0.28 0.52 1.64 1.01 -1.26 -4.99 116.67 114.45 2k3t s ASP 2428Ca 0.56 0.44 0.28 0.00 0.71 0.00 0.00 52.55 54.54 2k3t s ASP 2428Cb -0.26 0.53 1.44 0.00 1.01 0.00 0.00 42.92 45.65 2k3t s ASP 2428CO 0.27 -0.22 2.06 1.55 0.21 0.00 0.00 175.17 179.04 2k3t h PRO 2429N 5.06 0.00 0.00 8.23 0.13 -1.91 -1.82 132.00 141.69 2k3t h PRO 2429Ca -0.27 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.80 2k3t h PRO 2429Cb 1.18 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 2k3t h PRO 2429CO 0.34 0.12 -0.26 0.78 -0.23 0.00 0.00 178.00 178.75 2k3t h GLY 2430N 0.95 0.00 1.15 1.56 0.00 -1.92 -2.01 103.07 102.80 2k3t h GLY 2430Ca -0.00 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.03 2k3t h GLY 2430CO 0.02 0.00 -1.59 1.41 0.00 0.00 0.00 176.54 176.37 2k3t h LEU 2431N 0.00 0.18 -9.80 3.11 -0.00 -1.77 -3.43 115.31 103.60 2k3t h LEU 2431Ca -0.00 -0.30 -0.52 0.00 -0.00 0.00 0.00 57.88 57.06 2k3t h LEU 2431Cb 0.98 -0.06 0.04 0.00 -0.00 0.00 0.00 40.66 41.62 2k3t h LEU 2431CO 0.03 1.26 0.59 -0.69 -0.00 0.00 0.00 178.44 179.63 2k3t s VAL 2432N -2.61 3.12 0.02 1.22 1.01 -0.74 -4.59 120.40 117.82 2k3t s VAL 2432Ca -0.08 1.06 0.00 0.00 0.00 0.00 0.00 61.98 62.97 2k3t s VAL 2432Cb 0.08 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.77 2k3t s VAL 2432CO 0.83 0.22 -0.03 -0.44 0.00 0.00 0.00 175.10 175.68 2k3t s SER 2433N -0.36 0.30 0.07 3.32 0.01 -1.22 -3.04 113.70 112.78 2k3t s SER 2433Ca 0.50 -0.36 -0.02 0.00 1.31 0.00 0.00 55.95 57.38 2k3t s SER 2433Cb -0.36 0.06 -0.04 0.00 0.21 0.00 0.00 66.02 65.88 2k3t s SER 2433CO 0.45 -0.19 0.24 0.00 0.41 0.00 0.00 173.24 174.15 2k3t s ALA 2434N -1.01 3.95 -0.01 1.44 0.00 -1.26 -1.14 121.76 123.73 2k3t s ALA 2434Ca -0.10 -0.76 -0.04 0.00 0.00 0.00 0.00 51.96 51.06 2k3t s ALA 2434Cb -0.07 -1.91 0.00 0.00 0.00 0.00 0.00 23.12 21.14 2k3t s ALA 2434CO -0.00 0.78 0.08 0.71 0.00 0.00 0.00 175.76 177.33 2k3t s TYR 2435N -1.51 0.02 0.00 0.00 2.02 -0.33 -4.96 117.35 112.59 2k3t s TYR 2435Ca 0.35 -0.04 0.00 0.00 -0.37 0.00 0.00 57.07 57.02 2k3t s TYR 2435Cb -0.13 -0.04 0.00 0.00 -0.40 0.00 0.00 41.96 41.39 2k3t s TYR 2435CO 0.26 -0.15 0.00 0.41 -1.57 0.00 0.00 175.55 174.50 2k3t n GLY 2436N 2.24 3.62 0.24 0.71 0.00 -1.26 -0.42 105.19 110.32 2k3t n GLY 2436Ca -0.18 -1.82 0.07 0.00 0.00 0.00 0.00 46.02 44.09 2k3t n GLY 2436CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k3t h ALA 2437N 0.00 1.65 0.00 4.61 0.00 -1.90 -2.88 119.26 120.74 2k3t h ALA 2437Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2k3t h ALA 2437Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2k3t h ALA 2437CO 0.00 0.18 0.00 0.41 0.00 0.00 0.00 179.25 179.84 2k3t n GLY 2438N -1.04 -0.92 0.15 0.00 0.00 -0.10 -1.39 105.19 101.88 2k3t n GLY 2438Ca -0.02 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.03 2k3t n GLY 2438CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2k3t h LEU 2439N 0.00 0.00 0.01 0.99 3.38 -1.74 -3.37 115.31 114.59 2k3t h LEU 2439Ca 0.00 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.63 2k3t h LEU 2439Cb 0.19 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.89 2k3t h LEU 2439CO 0.00 0.49 -2.04 -0.62 0.09 0.00 0.00 178.44 176.35 2k3t n GLU 2440N -3.27 0.67 -1.95 1.13 1.02 -0.49 -3.37 120.64 114.37 2k3t n GLU 2440Ca 0.02 0.17 0.00 0.00 -0.02 0.00 0.00 57.16 57.33 2k3t n GLU 2440Cb 0.70 -1.67 0.00 0.00 -0.02 0.00 0.00 31.44 30.45 2k3t n GLU 2440CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k3t n GLY 2441N 1.73 -0.44 0.00 0.62 0.00 -1.10 -1.26 105.19 104.74 2k3t n GLY 2441Ca -0.27 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 44.77 2k3t n GLY 2441CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k3t n GLY 2442N 0.00 -1.50 3.35 -0.02 0.00 -1.24 -4.24 105.19 101.55 2k3t n GLY 2442Ca 0.00 -1.09 -0.32 0.00 0.00 0.00 0.00 46.02 44.62 2k3t n GLY 2442CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k3t s VAL 2443N -2.81 2.47 0.30 1.61 1.01 -1.26 -1.54 120.40 120.18 2k3t s VAL 2443Ca 0.00 -0.93 -0.30 0.00 0.00 0.00 0.00 61.98 60.75 2k3t s VAL 2443Cb 0.00 -1.92 -0.12 0.00 0.00 0.00 0.00 36.38 34.34 2k3t s VAL 2443CO 0.00 0.58 1.49 0.35 0.00 0.00 0.00 175.10 177.52 2k3t n THR 2444N 2.66 1.32 0.00 3.92 -2.24 -0.72 -2.40 114.28 116.83 2k3t n THR 2444Ca -0.17 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.28 2k3t n THR 2444Cb 0.52 -1.80 0.00 0.00 -2.10 0.00 0.00 70.33 66.95 2k3t n THR 2444CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2k3t n GLY 2445N 1.65 2.94 3.92 3.38 0.00 -0.50 -4.87 105.19 111.71 2k3t n GLY 2445Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 2k3t n GLY 2445CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2k3t s ASN 2446N -3.21 6.38 0.36 1.61 0.01 -1.01 -5.00 114.94 114.08 2k3t s ASN 2446Ca 0.00 0.31 -0.27 0.00 -0.71 0.00 0.00 52.86 52.19 2k3t s ASN 2446Cb 0.00 -1.98 -0.09 0.00 0.41 0.00 0.00 41.25 39.59 2k3t s ASN 2446CO 0.00 0.15 1.18 -2.16 -1.51 0.00 0.00 177.10 174.76 2k3t s PRO 2447N -2.55 4.24 -0.04 -0.60 0.04 -1.26 -4.35 135.00 130.48 2k3t s PRO 2447Ca 0.36 1.89 0.04 0.00 0.04 0.00 0.00 61.00 63.33 2k3t s PRO 2447Cb -0.13 -2.85 -0.00 0.00 0.04 0.00 0.00 34.50 31.56 2k3t s PRO 2447CO 0.28 -0.18 -0.14 0.00 0.04 0.00 0.00 177.00 177.00 2k3t s ALA 2448N -1.32 1.28 0.03 8.56 0.00 0.13 -4.90 121.76 125.54 2k3t s ALA 2448Ca 0.53 -0.55 -0.03 0.00 0.00 0.00 0.00 51.96 51.91 2k3t s ALA 2448Cb -0.32 -0.44 -0.02 0.00 0.00 0.00 0.00 23.12 22.34 2k3t s ALA 2448CO 0.41 0.22 0.04 -1.83 0.00 0.00 0.00 175.76 174.61 2k3t s GLU 2449N 0.12 0.51 0.06 0.00 1.03 -1.26 -1.13 118.70 118.02 2k3t s GLU 2449Ca -0.04 -0.77 -0.25 0.00 0.03 0.00 0.00 54.97 53.94 2k3t s GLU 2449Cb -0.11 0.19 0.06 0.00 -0.80 0.00 0.00 34.13 33.48 2k3t s GLU 2449CO 0.02 -0.11 0.59 -0.59 -1.33 0.00 0.00 175.26 173.83 2k3t s PHE 2450N -2.43 -0.53 -0.15 4.83 -0.12 -0.43 -0.93 117.98 118.23 2k3t s PHE 2450Ca -0.07 0.60 -0.02 0.00 -0.05 0.00 0.00 56.93 57.39 2k3t s PHE 2450Cb -0.02 0.43 -0.02 0.00 -0.63 0.00 0.00 43.02 42.78 2k3t s PHE 2450CO -0.04 -0.70 -0.08 0.08 -0.05 0.00 0.00 175.22 174.43 2k3t s VAL 2451N -2.56 3.50 -0.67 -2.49 1.01 0.44 -0.53 120.40 119.11 2k3t s VAL 2451Ca -0.05 -0.50 -0.25 0.00 0.00 0.00 0.00 61.98 61.19 2k3t s VAL 2451Cb -0.01 -2.51 0.05 0.00 0.00 0.00 0.00 36.38 33.91 2k3t s VAL 2451CO -0.02 0.50 1.10 -0.69 0.00 0.00 0.00 175.10 175.98 2k3t s VAL 2452N 0.43 4.09 -0.14 2.92 1.01 0.53 -1.19 120.40 128.05 2k3t s VAL 2452Ca -0.06 0.12 -0.27 0.00 0.00 0.00 0.00 61.98 61.77 2k3t s VAL 2452Cb -0.15 -4.75 -0.02 0.00 0.00 0.00 0.00 36.38 31.46 2k3t s VAL 2452CO 0.04 -1.54 0.88 0.21 0.00 0.00 0.00 175.10 174.68 2k3t s ASN 2453N 3.51 7.05 0.00 3.32 3.84 -0.29 -1.86 114.94 130.52 2k3t s ASN 2453Ca 0.30 1.29 0.19 0.00 0.21 0.00 0.00 52.86 54.85 2k3t s ASN 2453Cb -0.12 -2.48 0.11 0.00 -0.55 0.00 0.00 41.25 38.20 2k3t s ASN 2453CO 0.15 -0.39 1.06 0.35 -2.79 0.00 0.00 177.10 175.47 2k3t n THR 2454N 4.60 0.00 0.17 -5.21 -2.24 -1.25 -3.38 114.28 106.96 2k3t n THR 2454Ca 0.05 -0.45 0.14 0.00 -2.27 0.00 0.00 64.05 61.52 2k3t n THR 2454Cb 0.49 1.35 0.70 0.00 -2.10 0.00 0.00 70.33 70.77 2k3t n THR 2454CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2k3t h SER 2455N 3.30 0.00 0.79 3.42 0.02 -1.86 0.78 113.55 120.00 2k3t h SER 2455Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2k3t h SER 2455Cb 0.75 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.29 2k3t h SER 2455CO 0.00 0.00 -0.41 0.59 -1.14 0.00 0.00 176.83 175.87 2k3t n ASN 2456N -4.35 0.50 -0.01 3.07 3.02 -1.26 -4.33 115.26 111.90 2k3t n ASN 2456Ca 0.02 0.07 0.02 0.00 -0.03 0.00 0.00 54.58 54.67 2k3t n ASN 2456Cb 0.29 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.40 2k3t n ASN 2456CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2k3t n ALA 2457N -1.63 2.19 0.00 5.41 0.00 -0.07 -4.89 120.51 121.52 2k3t n ALA 2457Ca 0.05 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.23 2k3t n ALA 2457Cb 0.38 -0.19 0.00 0.00 0.00 0.00 0.00 19.45 19.63 2k3t n ALA 2457CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k3t n GLY 2458N 2.15 1.62 3.41 0.00 0.00 0.07 -2.50 105.19 109.94 2k3t n GLY 2458Ca -0.04 -0.38 -0.13 0.00 0.00 0.00 0.00 46.02 45.47 2k3t n GLY 2458CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k3t s ALA 2459N -1.00 -1.43 0.00 4.61 0.00 -1.26 -4.77 121.76 117.91 2k3t s ALA 2459Ca 0.00 0.54 0.00 0.00 0.00 0.00 0.00 51.96 52.50 2k3t s ALA 2459Cb 0.00 0.59 0.00 0.00 0.00 0.00 0.00 23.12 23.71 2k3t s ALA 2459CO 0.00 -0.62 0.00 0.41 0.00 0.00 0.00 175.76 175.55 2k3t n GLY 2460N 0.05 1.86 3.79 0.00 0.00 -1.26 -4.00 105.19 105.62 2k3t n GLY 2460Ca -0.17 -0.98 -0.36 0.00 0.00 0.00 0.00 46.02 44.51 2k3t n GLY 2460CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k3t s ALA 2461N -2.00 3.14 0.00 4.61 0.00 -1.26 -4.91 121.76 121.35 2k3t s ALA 2461Ca 0.00 0.59 0.08 0.00 0.00 0.00 0.00 51.96 52.63 2k3t s ALA 2461Cb 0.00 -3.22 -0.02 0.00 0.00 0.00 0.00 23.12 19.88 2k3t s ALA 2461CO 0.00 0.01 -0.25 -1.17 0.00 0.00 0.00 175.76 174.35 2k3t s LEU 2462N -2.42 2.09 0.00 0.00 2.96 -1.26 -1.04 118.68 119.01 2k3t s LEU 2462Ca 0.55 -0.49 0.00 0.00 -0.22 0.00 0.00 54.13 53.97 2k3t s LEU 2462Cb -0.19 -1.24 0.00 0.00 0.50 0.00 0.00 46.19 45.26 2k3t s LEU 2462CO 0.24 0.28 0.00 -0.24 -1.32 0.00 0.00 176.35 175.31 2k3t n SER 2463N 2.23 0.00 0.00 3.68 2.88 -0.21 -5.01 113.62 117.19 2k3t n SER 2463Ca -0.16 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.38 2k3t n SER 2463Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 2k3t n SER 2463CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2k3t n VAL 2464N 0.00 0.00 -4.44 2.46 0.31 -1.26 -4.89 118.33 110.51 2k3t n VAL 2464Ca 0.00 0.00 -0.20 0.00 -0.01 0.00 0.00 64.34 64.13 2k3t n VAL 2464Cb 0.00 0.00 -0.15 0.00 -0.91 0.00 0.00 33.84 32.78 2k3t n VAL 2464CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2k3t s THR 2465N 0.00 0.82 -0.21 2.52 2.01 -0.84 -5.01 115.64 114.94 2k3t s THR 2465Ca 0.00 -0.43 0.01 0.00 0.31 0.00 0.00 61.69 61.57 2k3t s THR 2465Cb 0.00 -0.70 0.03 0.00 0.01 0.00 0.00 72.50 71.84 2k3t s THR 2465CO 0.00 0.24 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.38 2k3t s ILE 2466N -0.17 2.23 0.37 1.82 1.01 -1.26 -0.45 121.20 124.74 2k3t s ILE 2466Ca 0.03 -1.08 0.02 0.00 0.00 0.00 0.00 60.65 59.62 2k3t s ILE 2466Cb -0.05 -2.04 -0.02 0.00 0.01 0.00 0.00 42.46 40.36 2k3t s ILE 2466CO -0.00 0.38 0.57 -0.62 0.00 0.00 0.00 174.94 175.26 2k3t s ASP 2467N 1.26 6.08 0.00 3.58 2.15 -0.46 -4.87 116.67 124.42 2k3t s ASP 2467Ca 0.02 0.27 0.00 0.00 0.43 0.00 0.00 52.55 53.27 2k3t s ASP 2467Cb -0.15 -1.73 0.00 0.00 -0.30 0.00 0.00 42.92 40.74 2k3t s ASP 2467CO -0.10 -0.44 0.00 0.61 -0.17 0.00 0.00 175.17 175.07 2k3t n GLY 2468N -1.84 -1.07 0.16 2.66 0.00 -1.26 -0.66 105.19 103.18 2k3t n GLY 2468Ca -0.02 -0.99 0.13 0.00 0.00 0.00 0.00 46.02 45.14 2k3t n GLY 2468CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k3t h PRO 2469N 0.00 0.00 -3.55 1.61 0.13 -1.90 -3.46 132.00 124.83 2k3t h PRO 2469Ca 0.00 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.04 2k3t h PRO 2469Cb 0.00 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.07 2k3t h PRO 2469CO 0.00 0.00 -0.00 -1.12 -0.23 0.00 0.00 178.00 176.65 2k3t s SER 2470N -4.60 0.20 0.98 1.44 0.01 -1.26 -5.02 113.70 105.45 2k3t s SER 2470Ca 0.04 -1.10 -0.12 0.00 1.31 0.00 0.00 55.95 56.08 2k3t s SER 2470Cb 0.09 0.69 0.18 0.00 0.21 0.00 0.00 66.02 67.19 2k3t s SER 2470CO 0.44 -1.34 1.09 -0.54 0.41 0.00 0.00 173.24 173.30 2k3t s LYS 2471N -3.32 0.55 0.02 12.44 1.02 -1.26 -4.96 119.74 124.24 2k3t s LYS 2471Ca 0.22 0.70 0.03 0.00 0.02 0.00 0.00 55.97 56.94 2k3t s LYS 2471Cb -0.02 -1.74 -0.02 0.00 -0.52 0.00 0.00 37.83 35.53 2k3t s LYS 2471CO 0.13 -2.69 -0.10 0.14 -0.92 0.00 0.00 175.35 171.91 2k3t s VAL 2472N -2.88 0.75 -1.27 3.17 -7.23 -1.26 -4.39 120.40 107.29 2k3t s VAL 2472Ca 0.65 -0.77 -0.10 0.00 -1.81 0.00 0.00 61.98 59.95 2k3t s VAL 2472Cb -0.19 -0.70 0.17 0.00 0.56 0.00 0.00 36.38 36.21 2k3t s VAL 2472CO 0.58 -0.05 1.83 0.29 -0.31 0.00 0.00 175.10 177.44 2k3t n LYS 2473N 2.13 3.59 -2.25 4.82 4.76 -1.02 -4.91 118.16 125.27 2k3t n LYS 2473Ca -0.18 -3.55 -0.40 0.00 -2.87 0.00 0.00 58.31 51.31 2k3t n LYS 2473Cb 0.56 -2.94 -0.03 0.00 -1.84 0.00 0.00 35.03 30.78 2k3t n LYS 2473CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 2k3t s MET 2474N 0.56 4.38 -0.07 1.97 -1.94 -1.26 -3.44 119.30 119.51 2k3t s MET 2474Ca 0.40 2.02 0.00 0.00 -1.71 0.00 0.00 55.69 56.41 2k3t s MET 2474Cb 0.08 -3.03 0.02 0.00 2.01 0.00 0.00 34.83 33.91 2k3t s MET 2474CO 0.00 -0.09 -0.04 0.34 -0.01 0.00 0.00 175.02 175.22 2k3t s ASP 2475N -0.72 1.42 -0.07 3.03 2.15 0.18 -4.99 116.67 117.67 2k3t s ASP 2475Ca 0.49 -0.16 0.05 0.00 0.43 0.00 0.00 52.55 53.36 2k3t s ASP 2475Cb -0.36 -0.55 -0.00 0.00 -0.30 0.00 0.00 42.92 41.71 2k3t s ASP 2475CO 0.47 -0.10 -0.22 0.00 -0.17 0.00 0.00 175.17 175.15 2k3t s GLN 2477N 0.16 0.44 0.46 0.00 -1.52 -0.51 -5.02 119.66 113.67 2k3t s GLN 2477Ca -0.11 -0.64 -0.19 0.00 -1.95 0.00 0.00 55.36 52.47 2k3t s GLN 2477Cb -0.15 0.17 -0.10 0.00 -0.22 0.00 0.00 33.01 32.71 2k3t s GLN 2477CO 0.05 -0.09 0.97 -1.83 -0.25 0.00 0.00 175.29 174.14 2k3t s GLU 2478N -1.89 4.11 0.29 2.91 -1.05 -1.26 -0.67 118.70 121.14 2k3t s GLU 2478Ca -0.11 1.06 -0.16 0.00 -0.15 0.00 0.00 54.97 55.60 2k3t s GLU 2478Cb -0.06 -2.16 0.02 0.00 -0.44 0.00 0.00 34.13 31.49 2k3t s GLU 2478CO -0.02 -0.13 0.65 0.00 0.95 0.00 0.00 175.26 176.70 2k3t h PRO 2480N 2.08 0.00 -0.00 0.00 0.11 -2.03 -2.36 132.00 129.80 2k3t h PRO 2480Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 2k3t h PRO 2480Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2k3t h PRO 2480CO 0.31 0.00 -0.26 -1.91 -0.21 0.00 0.00 178.00 175.93 2k3t n GLU 2481N -3.96 0.61 0.00 1.05 4.07 -1.26 -4.98 120.64 116.17 2k3t n GLU 2481Ca -0.01 -0.32 0.00 0.00 -0.06 0.00 0.00 57.16 56.77 2k3t n GLU 2481Cb 0.16 -1.49 0.00 0.00 -0.06 0.00 0.00 31.44 30.05 2k3t n GLU 2481CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2k3t n GLY 2482N 1.36 0.27 3.36 8.31 0.00 -0.89 -3.90 105.19 113.71 2k3t n GLY 2482Ca 0.11 -1.38 -0.36 0.00 0.00 0.00 0.00 46.02 44.39 2k3t n GLY 2482CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2k3t s TYR 2483N -0.36 3.08 -0.12 1.61 2.02 -0.78 -0.81 117.35 122.00 2k3t s TYR 2483Ca 0.00 -0.82 -0.17 0.00 -0.37 0.00 0.00 57.07 55.70 2k3t s TYR 2483Cb 0.00 -2.21 -0.04 0.00 -0.40 0.00 0.00 41.96 39.31 2k3t s TYR 2483CO 0.00 -0.51 0.45 0.50 -1.57 0.00 0.00 175.55 174.42 2k3t s ARG 2484N 1.52 4.31 -0.11 -0.62 3.52 0.15 -0.35 118.95 127.38 2k3t s ARG 2484Ca 0.04 0.41 0.01 0.00 -0.13 0.00 0.00 55.73 56.06 2k3t s ARG 2484Cb -0.16 -3.42 -0.02 0.00 -1.56 0.00 0.00 34.95 29.79 2k3t s ARG 2484CO 0.01 0.20 -0.13 0.08 -0.81 0.00 0.00 175.30 174.64 2k3t s VAL 2485N 0.51 3.06 -0.03 7.11 1.01 0.30 -1.43 120.40 130.93 2k3t s VAL 2485Ca 0.25 -0.68 0.05 0.00 0.00 0.00 0.00 61.98 61.60 2k3t s VAL 2485Cb -0.15 -2.26 -0.01 0.00 0.00 0.00 0.00 36.38 33.96 2k3t s VAL 2485CO 0.10 0.54 -0.18 -0.89 0.00 0.00 0.00 175.10 174.67 2k3t s THR 2486N 0.05 1.47 0.02 3.92 2.01 -0.43 -1.31 115.64 121.38 2k3t s THR 2486Ca -0.05 -0.76 -0.06 0.00 0.31 0.00 0.00 61.69 61.13 2k3t s THR 2486Cb -0.14 -1.25 -0.01 0.00 0.01 0.00 0.00 72.50 71.11 2k3t s THR 2486CO 0.04 0.42 0.11 -0.72 -0.69 0.00 0.00 174.62 173.78 2k3t s TYR 2487N -0.17 0.14 -0.22 4.92 1.13 -0.28 -0.65 117.35 122.23 2k3t s TYR 2487Ca 0.01 -0.35 -0.03 0.00 -1.41 0.00 0.00 57.07 55.28 2k3t s TYR 2487Cb -0.10 -0.10 -0.00 0.00 -1.10 0.00 0.00 41.96 40.66 2k3t s TYR 2487CO 0.01 -0.33 -0.07 0.99 -2.51 0.00 0.00 175.55 173.64 2k3t s THR 2488N -2.09 3.16 0.45 -3.49 2.01 -1.22 -0.70 115.64 113.77 2k3t s THR 2488Ca -0.09 -0.59 -0.13 0.00 0.31 0.00 0.00 61.69 61.19 2k3t s THR 2488Cb -0.04 -2.44 -0.07 0.00 0.01 0.00 0.00 72.50 69.96 2k3t s THR 2488CO -0.02 0.43 0.86 -2.16 -0.69 0.00 0.00 174.62 173.03 2k3t s PRO 2489N 1.44 3.84 0.00 4.92 0.04 -1.26 -2.43 135.00 141.55 2k3t s PRO 2489Ca 0.05 0.66 0.00 0.00 0.04 0.00 0.00 61.00 61.76 2k3t s PRO 2489Cb -0.14 -2.29 0.00 0.00 0.04 0.00 0.00 34.50 32.11 2k3t s PRO 2489CO -0.05 -0.14 0.39 0.00 0.04 0.00 0.00 177.00 177.25 2k3t n MET 2490N -1.44 0.91 -3.81 4.56 0.00 -1.26 -1.41 117.12 114.68 2k3t n MET 2490Ca 0.04 -0.40 -0.12 0.00 0.00 0.00 0.00 57.70 57.22 2k3t n MET 2490Cb 0.54 -0.89 -0.10 0.00 0.00 0.00 0.00 33.22 32.77 2k3t n MET 2490CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2k3t s ALA 2491N -0.27 -0.58 0.60 3.17 0.00 -1.26 -1.23 121.76 122.20 2k3t s ALA 2491Ca 0.00 0.21 -0.16 0.00 0.00 0.00 0.00 51.96 52.02 2k3t s ALA 2491Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 23.12 23.10 2k3t s ALA 2491CO 0.01 -0.22 1.08 -1.25 0.00 0.00 0.00 175.76 175.38 2k3t s PRO 2492N -1.10 3.18 0.00 0.00 0.04 -1.26 -4.87 135.00 130.98 2k3t s PRO 2492Ca -0.12 1.33 0.00 0.00 0.04 0.00 0.00 61.00 62.25 2k3t s PRO 2492Cb -0.06 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.48 2k3t s PRO 2492CO 0.03 -0.94 0.00 0.41 0.04 0.00 0.00 177.00 176.53 2k3t n GLY 2493N -0.63 0.82 3.62 0.56 0.00 -0.47 -4.87 105.19 104.22 2k3t n GLY 2493Ca 0.10 -2.00 -0.39 0.00 0.00 0.00 0.00 46.02 43.73 2k3t n GLY 2493CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k3t s SER 2494N -3.95 6.28 -0.23 1.61 0.01 -1.26 -0.45 113.70 115.72 2k3t s SER 2494Ca 0.00 0.33 -0.11 0.00 1.31 0.00 0.00 55.95 57.47 2k3t s SER 2494Cb 0.00 -2.21 -0.05 0.00 0.21 0.00 0.00 66.02 63.97 2k3t s SER 2494CO 0.00 -0.16 0.19 -0.31 0.41 0.00 0.00 173.24 173.37 2k3t s TYR 2495N 1.91 3.34 -0.39 2.43 1.51 -0.04 -4.24 117.35 121.87 2k3t s TYR 2495Ca 0.16 0.31 -0.14 0.00 -1.01 0.00 0.00 57.07 56.39 2k3t s TYR 2495Cb -0.16 -2.29 0.02 0.00 -0.11 0.00 0.00 41.96 39.42 2k3t s TYR 2495CO 0.09 0.10 0.27 -1.17 -1.11 0.00 0.00 175.55 173.73 2k3t s LEU 2496N 0.96 4.93 -0.68 -1.29 2.96 0.16 -0.63 118.68 125.10 2k3t s LEU 2496Ca 0.10 -0.87 -0.17 0.00 -0.22 0.00 0.00 54.13 52.96 2k3t s LEU 2496Cb -0.13 -2.12 0.14 0.00 0.50 0.00 0.00 46.19 44.58 2k3t s LEU 2496CO 0.04 -0.41 0.72 -0.63 -1.32 0.00 0.00 176.35 174.75 2k3t s ILE 2497N 1.65 5.09 -1.19 6.68 1.01 0.17 -1.35 121.20 133.25 2k3t s ILE 2497Ca 0.04 -1.53 -0.19 0.00 0.00 0.00 0.00 60.65 58.97 2k3t s ILE 2497Cb -0.19 -4.49 0.07 0.00 0.01 0.00 0.00 42.46 37.87 2k3t s ILE 2497CO 0.09 -1.09 1.61 -0.44 0.00 0.00 0.00 174.94 175.11 2k3t s SER 2498N 3.28 6.74 -0.37 3.58 0.01 0.40 -1.43 113.70 125.90 2k3t s SER 2498Ca 0.14 -2.15 -0.29 0.00 1.31 0.00 0.00 55.95 54.96 2k3t s SER 2498Cb -0.20 -2.56 0.02 0.00 0.21 0.00 0.00 66.02 63.49 2k3t s SER 2498CO 0.00 -1.25 1.10 -0.63 0.41 0.00 0.00 173.24 172.87 2k3t s ILE 2499N 4.27 4.41 -0.05 1.44 1.01 -1.26 -1.99 121.20 129.03 2k3t s ILE 2499Ca 0.50 1.58 0.03 0.00 0.00 0.00 0.00 60.65 62.76 2k3t s ILE 2499Cb 0.02 -4.47 0.00 0.00 0.01 0.00 0.00 42.46 38.03 2k3t s ILE 2499CO 0.01 -0.64 -0.15 -0.54 0.00 0.00 0.00 174.94 173.63 2k3t s LYS 2500N 3.90 1.70 -0.01 2.79 1.02 -1.26 -1.47 119.74 126.40 2k3t s LYS 2500Ca 0.46 -0.51 -0.02 0.00 0.02 0.00 0.00 55.97 55.92 2k3t s LYS 2500Cb -0.11 -1.44 0.00 0.00 -0.52 0.00 0.00 37.83 35.76 2k3t s LYS 2500CO 0.20 0.15 0.06 -0.47 -0.92 0.00 0.00 175.35 174.37 2k3t s TYR 2501N 0.29 0.00 -0.22 3.18 6.14 -1.15 -1.05 117.35 124.54 2k3t s TYR 2501Ca -0.08 0.00 0.00 0.00 0.64 0.00 0.00 57.07 57.63 2k3t s TYR 2501Cb -0.13 -0.02 0.00 0.00 0.42 0.00 0.00 41.96 42.23 2k3t s TYR 2501CO 0.03 -0.09 0.00 0.41 0.64 0.00 0.00 175.55 176.53 2k3t n GLY 2502N 2.58 0.42 0.00 8.97 0.00 -0.21 -4.29 105.19 112.66 2k3t n GLY 2502Ca -0.16 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.77 2k3t n GLY 2502CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k3t n GLY 2503N -0.99 0.41 0.34 -0.02 0.00 -1.26 -4.97 105.19 98.70 2k3t n GLY 2503Ca -0.02 -1.69 0.01 0.00 0.00 0.00 0.00 46.02 44.32 2k3t n GLY 2503CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2k3t n PRO 2504N 0.00 1.29 -4.26 1.61 -0.04 -1.26 -4.88 135.00 127.45 2k3t n PRO 2504Ca 0.00 -0.33 -0.34 0.00 -0.04 0.00 0.00 63.50 62.79 2k3t n PRO 2504Cb 0.00 -1.26 -0.09 0.00 -0.04 0.00 0.00 33.50 32.11 2k3t n PRO 2504CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2k3t s TYR 2505N -1.63 3.19 0.44 0.54 2.02 -1.26 -5.01 117.35 115.64 2k3t s TYR 2505Ca 0.06 0.19 -0.25 0.00 -0.37 0.00 0.00 57.07 56.70 2k3t s TYR 2505Cb 0.04 -1.76 -0.08 0.00 -0.40 0.00 0.00 41.96 39.76 2k3t s TYR 2505CO 0.03 0.50 1.30 -1.01 -1.57 0.00 0.00 175.55 174.80 2k3t s HIS 2506N -1.01 2.70 1.06 2.71 3.76 -1.26 -2.93 115.29 120.33 2k3t s HIS 2506Ca 0.17 1.41 -0.16 0.00 -0.15 0.00 0.00 55.06 56.33 2k3t s HIS 2506Cb -0.12 -3.67 0.22 0.00 1.11 0.00 0.00 32.58 30.13 2k3t s HIS 2506CO 0.07 -2.21 1.17 0.96 -0.85 0.00 0.00 174.74 173.88 2k3t s ILE 2507N -1.31 1.82 -0.00 0.60 -4.36 -0.54 -4.76 121.20 112.65 2k3t s ILE 2507Ca 0.61 0.00 -0.31 0.00 -0.26 0.00 0.00 60.65 60.69 2k3t s ILE 2507Cb -0.37 -2.68 -0.09 0.00 1.25 0.00 0.00 42.46 40.56 2k3t s ILE 2507CO 0.47 0.00 1.97 0.61 0.24 0.00 0.00 174.94 178.23 2k3t n GLY 2508N -1.99 1.75 1.92 6.27 0.00 -0.76 -1.54 105.19 110.85 2k3t n GLY 2508Ca 0.12 0.83 0.00 0.00 0.00 0.00 0.00 46.02 46.97 2k3t n GLY 2508CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k3t n GLY 2509N 4.59 1.57 3.85 -0.02 0.00 -1.26 -4.43 105.19 109.50 2k3t n GLY 2509Ca 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 2k3t n GLY 2509CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2k3t s SER 2510N -3.19 6.77 0.41 1.61 0.15 -0.59 -4.09 113.70 114.78 2k3t s SER 2510Ca 0.00 1.10 -0.24 0.00 0.70 0.00 0.00 55.95 57.51 2k3t s SER 2510Cb 0.00 -2.30 -0.09 0.00 -1.71 0.00 0.00 66.02 61.93 2k3t s SER 2510CO 0.00 -0.03 1.07 -2.16 1.20 0.00 0.00 173.24 173.32 2k3t s PRO 2511N -2.46 4.09 -0.20 5.44 0.04 -1.26 -4.69 135.00 135.95 2k3t s PRO 2511Ca 0.45 1.54 -0.14 0.00 0.04 0.00 0.00 61.00 62.89 2k3t s PRO 2511Cb -0.13 -2.50 -0.04 0.00 0.04 0.00 0.00 34.50 31.86 2k3t s PRO 2511CO 0.20 -0.21 0.31 -0.06 0.04 0.00 0.00 177.00 177.28 2k3t s PHE 2512N -1.66 3.38 -0.59 0.56 0.40 -0.52 -4.86 117.98 114.69 2k3t s PHE 2512Ca 0.59 0.51 -0.19 0.00 -0.60 0.00 0.00 56.93 57.24 2k3t s PHE 2512Cb -0.23 -2.41 0.10 0.00 0.51 0.00 0.00 43.02 40.99 2k3t s PHE 2512CO 0.28 0.07 0.71 0.21 0.70 0.00 0.00 175.22 177.19 2k3t s LYS 2513N 1.03 3.05 -0.34 0.44 2.20 -1.26 -0.65 119.74 124.21 2k3t s LYS 2513Ca 0.15 -1.29 -0.22 0.00 -0.36 0.00 0.00 55.97 54.25 2k3t s LYS 2513Cb -0.14 -4.26 0.00 0.00 -1.51 0.00 0.00 37.83 31.92 2k3t s LYS 2513CO 0.06 -1.55 0.70 0.00 -0.36 0.00 0.00 175.35 174.21 2k3t s ALA 2514N 2.73 3.47 -0.64 3.13 0.00 0.19 -4.67 121.76 125.98 2k3t s ALA 2514Ca 0.12 -0.69 -0.19 0.00 0.00 0.00 0.00 51.96 51.20 2k3t s ALA 2514Cb -0.24 -3.24 0.11 0.00 0.00 0.00 0.00 23.12 19.75 2k3t s ALA 2514CO 0.06 -1.31 0.77 0.15 0.00 0.00 0.00 175.76 175.43 2k3t s LYS 2515N 2.85 3.13 0.06 0.00 1.02 -0.39 -0.86 119.74 125.54 2k3t s LYS 2515Ca 0.28 -1.38 -0.17 0.00 0.02 0.00 0.00 55.97 54.72 2k3t s LYS 2515Cb -0.14 -4.32 -0.06 0.00 -0.52 0.00 0.00 37.83 32.78 2k3t s LYS 2515CO 0.15 -1.57 0.50 0.08 -0.92 0.00 0.00 175.35 173.59 2k3t s VAL 2516N 2.66 4.87 0.36 3.17 1.01 0.41 -3.69 120.40 129.18 2k3t s VAL 2516Ca 0.14 1.02 0.01 0.00 0.00 0.00 0.00 61.98 63.15 2k3t s VAL 2516Cb -0.21 -3.81 -0.00 0.00 0.00 0.00 0.00 36.38 32.36 2k3t s VAL 2516CO 0.04 0.52 0.05 0.35 0.00 0.00 0.00 175.10 176.06 2k3t n THR 2517N 1.62 0.00 0.00 3.92 -2.24 -0.59 -1.37 114.28 115.62 2k3t n THR 2517Ca -0.11 -1.83 0.00 0.00 -2.27 0.00 0.00 64.05 59.84 2k3t n THR 2517Cb 0.51 0.49 0.00 0.00 -2.10 0.00 0.00 70.33 69.23 2k3t n THR 2517CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2k3t n GLY 2518N 0.18 0.41 3.77 3.38 0.00 -1.26 -1.76 105.19 109.91 2k3t n GLY 2518Ca -0.11 -2.05 -0.39 0.00 0.00 0.00 0.00 46.02 43.46 2k3t n GLY 2518CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2k3t s PRO 2519N -1.17 4.44 0.06 1.61 0.04 -1.26 -4.36 135.00 134.35 2k3t s PRO 2519Ca 0.00 1.78 -0.31 0.00 0.04 0.00 0.00 61.00 62.51 2k3t s PRO 2519Cb 0.00 -2.97 -0.07 0.00 0.04 0.00 0.00 34.50 31.49 2k3t s PRO 2519CO 0.00 0.03 1.49 0.50 0.04 0.00 0.00 177.00 179.06 2k3t s ARG 2520N -1.81 4.26 0.11 4.56 3.52 -1.26 -4.73 118.95 123.60 2k3t s ARG 2520Ca 0.49 2.13 0.11 0.00 -0.13 0.00 0.00 55.73 58.33 2k3t s ARG 2520Cb -0.30 -3.49 -0.15 0.00 -1.56 0.00 0.00 34.95 29.45 2k3t s ARG 2520CO 0.39 -0.60 1.13 -0.07 -0.81 0.00 0.00 175.30 175.34 2k3t h LEU 2521N 7.99 0.00 -0.51 -0.88 3.38 -1.56 -3.49 115.31 120.23 2k3t h LEU 2521Ca -0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.57 2k3t h LEU 2521Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 2k3t h LEU 2521CO 0.90 0.86 0.00 0.55 0.09 0.00 0.00 178.44 180.84