# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 D C C 100.89 3.78 20.32 24.30 104.28 -134.76 -83.06 69.24 99.84 0.16 0.00 99.74 0.12 0.03 0.00 0.00 0.00 0.11 0.00 1 I C C 39.42 19.93 10.65 29.35 117.64 -158.81 -97.15 129.57 64.83 35.10 0.08 63.90 0.53 0.15 0.01 0.04 0.00 34.76 0.61 2 Q E E 98.81 5.15 20.92 27.09 123.24 -169.65 -118.98 138.20 18.74 81.16 0.11 16.98 1.38 0.19 0.03 0.06 0.00 80.69 0.66 3 M E E 48.18 19.85 13.05 31.96 123.31 -160.60 -114.15 136.46 7.18 92.77 0.05 6.82 0.37 0.05 0.02 0.02 0.00 92.16 0.56 4 T E E 63.35 7.77 20.82 29.25 124.41 -170.73 -122.29 142.74 11.51 88.40 0.08 10.23 1.13 0.14 0.03 0.04 0.00 87.29 1.13 5 Q E E 73.98 14.42 15.61 29.76 125.74 -160.36 -125.60 140.07 41.72 58.16 0.12 32.08 9.47 0.57 0.02 0.11 0.00 56.44 1.31 6 S C C 53.08 9.81 17.19 27.68 120.91 -134.78 -94.96 150.20 84.77 15.16 0.07 62.54 21.01 0.59 0.01 0.07 0.00 15.19 0.59 7 P C C 57.98 9.86 16.70 27.24 114.76 -8.34 -71.03 150.20 92.49 7.34 0.16 74.55 15.81 1.46 0.02 0.18 0.00 7.55 0.43 8 V C S 85.52 9.51 16.66 26.85 98.70 -157.57 -89.57 -20.08 86.03 13.89 0.09 27.77 56.20 1.17 0.01 0.09 0.00 14.41 0.35 9 S E E 57.09 6.73 20.22 28.12 134.22 22.87 -140.33 145.62 14.54 85.41 0.06 11.69 2.54 0.19 0.01 0.06 0.00 85.16 0.36 10 L E E 32.77 19.71 14.62 33.70 130.61 -175.94 -137.56 145.37 1.87 98.12 0.00 1.72 0.09 0.01 0.00 0.00 0.00 98.08 0.10 11 S E E 63.95 6.50 23.40 31.14 126.19 -162.97 -123.22 141.53 1.92 98.08 0.00 1.74 0.11 0.01 0.00 0.00 0.00 98.05 0.09 12 A E E 12.42 19.35 14.62 34.15 138.97 167.78 -148.24 160.36 14.32 85.67 0.02 12.91 0.74 0.04 0.00 0.01 0.00 86.00 0.30 13 S E E 54.49 4.94 23.74 28.46 124.13 -115.45 -91.14 159.54 36.73 63.13 0.14 33.35 2.59 0.30 0.06 0.10 0.00 58.07 5.52 14 V C T 61.91 14.82 14.26 29.04 109.19 -80.87 -59.75 134.52 98.73 0.86 0.42 0.36 3.30 95.46 0.02 0.28 0.00 0.48 0.11 15 G C T 45.49 4.29 20.02 25.00 95.75 22.68 89.04 -6.35 99.49 0.25 0.26 0.54 4.08 94.97 0.01 0.21 0.00 0.16 0.03 16 D C C 56.99 9.68 16.70 27.55 121.07 122.12 -78.29 151.63 96.41 3.44 0.15 64.15 32.00 0.58 0.03 0.14 0.00 2.60 0.50 17 R C C 130.03 7.74 19.67 28.65 120.99 -128.41 -103.15 136.77 71.80 28.19 0.01 72.34 0.51 0.03 0.00 0.01 0.00 26.42 0.69 18 V E E 12.00 22.20 14.57 36.74 129.08 -172.92 -128.66 143.79 1.11 98.89 0.00 1.13 0.02 0.00 0.00 0.00 0.00 98.77 0.08 19 T E E 63.15 7.79 25.03 33.29 118.01 -146.08 -108.46 128.66 0.34 99.66 0.00 0.34 0.00 0.00 0.00 0.00 0.00 99.65 0.00 20 I E E 4.94 25.55 16.38 42.75 120.42 -166.52 -115.26 128.94 1.30 98.70 0.00 1.21 0.02 0.00 0.00 0.00 0.00 98.76 0.01 21 T E E 43.96 9.24 27.00 36.97 121.09 -165.10 -113.71 134.35 4.42 95.57 0.00 4.00 0.09 0.00 0.00 0.00 0.00 95.89 0.02 22 C E E 4.10 25.81 16.69 43.03 127.38 -173.43 -126.97 141.55 3.73 96.27 0.00 3.42 0.09 0.00 0.00 0.00 0.00 96.43 0.05 23 R E E 100.92 7.55 27.50 35.89 121.76 -163.38 -119.06 132.51 2.42 97.57 0.01 2.25 0.09 0.01 0.00 0.00 0.00 97.27 0.38 24 A E E 8.49 24.09 14.02 37.85 123.26 -163.85 -109.41 141.35 28.88 70.97 0.15 27.87 0.98 0.15 0.04 0.10 0.00 69.41 1.45 25 S C C 52.87 7.12 20.97 28.47 111.85 -149.91 -87.66 110.47 84.11 15.27 0.62 45.82 34.43 3.67 0.07 0.68 0.00 14.52 0.81 26 Q C S 111.67 5.50 18.92 25.05 104.53 -21.97 -90.02 17.34 93.11 5.36 1.53 18.51 62.33 12.59 0.15 1.43 0.00 4.16 0.84 27 S C C 57.78 9.09 17.41 27.08 118.25 66.99 -95.21 140.19 94.25 3.89 1.86 57.92 25.14 10.97 0.23 2.09 0.00 2.70 0.96 28 I C C 69.12 13.73 17.53 30.91 102.05 -144.96 -88.92 -4.72 91.82 6.01 2.17 53.12 28.80 9.95 0.38 2.05 0.00 3.60 2.09 29 S C C 26.80 15.37 18.21 33.52 124.49 85.29 -113.24 149.02 90.98 7.39 1.63 69.51 15.51 5.76 0.23 1.63 0.00 5.91 1.45 30 T C S 64.08 11.28 22.35 33.48 99.30 -148.19 -88.89 -13.73 91.37 8.09 0.54 17.97 67.91 5.02 0.04 0.53 0.00 8.10 0.43 31 W E E 68.01 14.18 23.54 37.58 123.25 50.07 -121.30 133.78 33.54 66.00 0.46 21.05 10.02 2.63 0.04 0.46 0.00 65.25 0.55 32 L E E 4.05 25.76 20.23 46.11 127.15 -170.28 -124.34 140.61 4.66 95.32 0.02 4.08 0.36 0.03 0.00 0.01 0.00 95.42 0.11 33 A E E 9.53 18.29 27.52 45.60 129.94 -170.36 -126.91 146.80 0.42 99.58 0.00 0.39 0.01 0.00 0.00 0.00 0.00 99.59 0.01 34 W E E 8.26 24.46 23.08 47.36 125.36 -153.89 -115.57 140.44 0.31 99.69 0.00 0.28 0.01 0.00 0.00 0.00 0.00 99.71 0.00 35 Y E E 23.55 17.36 23.73 41.05 131.24 -172.83 -128.34 149.13 0.58 99.42 0.00 0.50 0.02 0.00 0.00 0.00 0.00 99.46 0.01 36 Q E E 38.78 14.68 21.41 36.42 121.55 -147.75 -112.59 136.74 2.40 97.60 0.00 2.01 0.17 0.01 0.00 0.00 0.00 97.75 0.06 37 Q E E 52.87 13.82 15.76 30.20 119.56 -150.85 -103.93 134.24 26.17 73.81 0.02 23.88 1.46 0.07 0.00 0.02 0.00 73.56 1.01 38 K C C 97.43 6.36 15.26 23.00 120.27 -145.21 -95.40 144.96 96.33 3.64 0.03 94.37 2.16 0.18 0.01 0.02 0.00 2.68 0.58 39 P C T 104.59 3.63 11.42 17.09 109.50 -84.88 -58.61 134.28 99.59 0.12 0.29 0.37 3.68 95.58 0.01 0.27 0.00 0.08 0.02 40 G C T 68.97 0.31 12.97 10.73 96.43 17.88 83.08 -3.19 99.62 0.09 0.28 0.44 3.66 95.52 0.01 0.30 0.00 0.06 0.01 41 K C S 110.42 4.27 11.12 17.52 129.37 90.37 -116.91 158.38 91.12 8.51 0.37 31.82 58.07 1.44 0.08 0.29 0.00 3.13 5.17 42 A C C 71.17 3.16 16.74 20.47 116.20 -96.43 -69.56 150.42 96.78 3.20 0.02 87.63 9.23 0.16 0.00 0.02 0.00 2.56 0.39 43 P C C 40.59 18.52 11.11 28.90 115.17 -101.07 -66.04 144.98 91.70 8.28 0.02 90.15 1.64 0.10 0.00 0.02 0.00 7.84 0.25 44 K E E 102.34 6.54 21.58 28.99 123.86 -157.93 -120.38 138.61 9.70 90.26 0.04 8.40 1.14 0.08 0.01 0.02 0.00 89.80 0.55 45 L E E 65.02 15.72 17.33 32.64 110.64 -115.60 -75.60 126.73 0.83 99.17 0.00 0.77 0.03 0.00 0.00 0.00 0.00 99.17 0.03 46 L E E 29.51 16.70 20.12 36.96 101.28 175.99 -96.34 -34.01 2.32 97.67 0.01 1.72 0.49 0.02 0.00 0.00 0.00 97.76 0.01 47 I E E 23.97 18.04 20.79 38.77 136.92 4.89 -149.41 143.01 0.51 99.48 0.00 0.42 0.04 0.00 0.00 0.00 0.00 99.52 0.01 48 Y E E 60.47 17.83 19.97 36.91 128.19 -171.97 -131.94 135.58 2.92 97.05 0.03 2.58 0.15 0.02 0.01 0.01 0.00 97.12 0.11 49 E E E 67.80 12.02 22.26 34.14 118.69 -168.08 -116.50 121.36 27.61 71.00 1.39 23.03 3.75 0.97 0.56 0.73 0.00 70.21 0.76 50 T C C 36.27 16.35 15.71 31.79 114.96 -171.07 -100.23 126.76 53.23 18.21 28.56 36.24 10.17 8.09 8.15 19.03 0.02 16.85 1.46 51 S C G 70.67 5.77 18.57 24.94 99.90 72.91 -84.73 -17.07 55.72 6.79 37.49 23.54 15.18 19.08 11.71 24.10 0.12 4.56 1.71 52 S C C 62.78 6.51 17.78 24.92 102.37 51.55 -93.86 4.17 55.22 6.37 38.41 26.05 12.95 18.08 12.86 24.05 0.10 3.79 2.12 53 L C C 48.80 17.35 10.61 26.76 109.77 99.39 -87.31 118.75 63.72 6.59 29.68 41.85 12.21 9.50 16.71 13.31 0.03 3.79 2.60 54 E C C 128.07 4.10 16.08 21.35 107.44 -119.71 -85.23 94.14 67.16 7.91 24.94 36.74 13.44 17.76 13.56 10.63 0.09 4.46 3.32 55 S C T 75.37 5.12 14.83 21.18 106.59 45.29 -85.68 82.07 81.18 2.62 16.20 16.34 18.72 46.49 7.22 8.38 0.03 1.45 1.36 56 G C T 50.02 4.76 16.55 22.32 101.01 -61.41 85.54 1.29 93.42 2.58 4.00 23.41 27.75 42.66 0.84 2.96 0.00 1.54 0.84 57 V C C 40.71 15.71 12.17 28.12 117.75 118.68 -99.42 130.95 86.15 13.14 0.71 56.15 29.55 1.51 0.30 0.42 0.00 5.42 6.65 58 P C C 58.94 9.04 18.20 28.15 110.89 -109.25 -67.49 146.45 90.31 7.17 2.52 70.33 12.74 6.87 0.61 2.17 0.00 5.50 1.79 59 S C C 55.26 13.05 16.32 28.95 101.92 -130.98 -81.56 4.86 86.64 9.13 4.23 54.48 19.88 12.31 0.63 4.10 0.00 7.29 1.31 60 R C C 113.10 8.90 20.92 30.10 114.81 82.69 -108.55 115.75 66.40 29.99 3.61 40.04 20.33 6.46 0.64 2.91 0.00 28.09 1.52 61 F E E 31.82 22.26 13.56 34.97 124.37 134.84 -113.71 138.54 23.04 76.49 0.47 20.02 2.85 0.57 0.18 0.29 0.00 74.68 1.40 62 S E E 55.90 6.65 23.50 31.35 134.44 -174.78 -138.47 155.74 8.98 90.89 0.13 7.97 0.84 0.15 0.05 0.06 0.00 90.41 0.52 63 G E E 23.73 16.82 16.01 32.00 141.05 156.09 -163.94 171.22 8.33 91.59 0.07 7.00 1.03 0.17 0.02 0.04 0.00 91.37 0.37 64 S E E 66.31 4.87 21.38 27.91 134.52 -159.37 -144.05 154.85 13.95 85.96 0.09 12.00 1.56 0.26 0.02 0.06 0.00 85.62 0.48 65 G E E 29.70 11.55 15.03 27.24 139.62 138.40 -151.97 161.28 31.21 68.62 0.17 21.34 9.56 1.48 0.02 0.18 0.00 66.68 0.74 66 S C E 79.03 2.88 20.50 23.73 114.79 -113.80 -119.57 107.95 54.62 44.86 0.52 35.00 16.58 4.68 0.08 0.57 0.00 40.42 2.66 67 G C S 34.54 9.28 18.80 28.31 109.34 -48.52 66.59 -127.71 98.52 0.94 0.54 2.05 51.43 45.20 0.02 0.52 0.00 0.67 0.11 68 T C S 53.78 14.68 16.49 31.02 97.83 -9.39 -99.34 0.85 98.45 1.14 0.42 2.05 51.90 44.65 0.01 0.39 0.00 0.90 0.10 69 E E E 77.96 8.76 22.39 32.29 121.48 84.41 -107.09 133.95 28.37 71.53 0.10 20.67 7.55 0.69 0.01 0.12 0.00 68.92 2.04 70 F E E 7.53 24.52 15.93 40.94 128.46 -173.82 -126.89 141.77 9.73 90.27 0.00 9.33 0.24 0.01 0.00 0.00 0.00 90.16 0.25 71 T E E 35.02 10.13 27.01 38.25 121.24 -156.91 -116.37 132.18 2.95 97.05 0.00 2.56 0.10 0.00 0.00 0.00 0.00 97.31 0.03 72 L E E 2.99 26.14 18.70 45.81 119.39 -163.85 -112.68 128.67 0.26 99.74 0.00 0.27 0.00 0.00 0.00 0.00 0.00 99.73 0.00 73 T E E 39.48 10.11 27.18 38.11 120.39 -164.88 -115.13 130.38 0.12 99.88 0.00 0.13 0.00 0.00 0.00 0.00 0.00 99.86 0.00 74 I E E 7.70 24.06 16.41 40.99 117.30 -165.68 -114.13 124.06 2.55 97.45 0.00 2.63 0.03 0.00 0.00 0.00 0.00 97.02 0.33 75 S C C 48.37 7.13 22.85 30.23 122.78 -162.61 -106.89 159.27 93.85 6.09 0.06 50.65 38.72 3.46 0.00 0.11 0.00 6.83 0.22 76 S C S 67.86 4.27 23.96 28.32 96.54 10.85 59.80 57.06 99.17 0.80 0.03 11.34 84.04 3.83 0.00 0.04 0.00 0.67 0.08 77 L C C 18.98 23.71 10.30 33.42 113.73 -146.32 -74.82 133.70 99.41 0.58 0.01 97.91 1.55 0.03 0.00 0.00 0.00 0.19 0.30 78 Q C C 80.96 4.56 23.57 28.02 130.23 -173.89 -124.78 157.08 99.89 0.09 0.01 99.44 0.46 0.01 0.00 0.00 0.00 0.02 0.07 79 P H G 74.93 11.39 15.11 26.99 91.00 -104.25 -58.63 -32.24 4.07 0.02 95.91 0.17 0.22 2.66 0.23 96.71 0.00 0.01 0.00 80 D H G 104.27 3.04 20.97 24.50 90.08 62.11 -72.09 -13.26 3.37 0.02 96.61 0.10 0.17 2.32 0.16 97.24 0.00 0.02 0.00 81 D H G 15.62 20.30 15.39 36.07 93.35 63.66 -86.47 -2.80 4.36 0.06 95.58 0.65 0.46 1.79 0.28 96.78 0.00 0.05 0.00 82 F C C 61.25 15.91 19.53 35.36 116.49 107.23 -75.58 137.10 92.33 7.33 0.34 87.24 5.15 0.18 0.04 0.31 0.00 6.68 0.41 83 A E E 16.41 15.35 22.53 37.98 145.58 143.57 -163.01 174.00 10.61 89.37 0.01 9.85 0.63 0.03 0.00 0.01 0.00 88.90 0.57 84 T E E 39.36 12.43 25.07 37.95 119.42 -82.69 -101.22 136.22 0.91 99.09 0.00 0.85 0.04 0.00 0.00 0.00 0.00 99.08 0.03 85 Y E E 7.41 25.23 19.14 44.59 125.93 -165.70 -116.79 140.13 0.47 99.52 0.00 0.41 0.03 0.00 0.00 0.00 0.00 99.54 0.01 86 Y E E 35.04 15.56 27.28 42.86 130.87 -170.89 -128.03 146.91 1.74 98.25 0.01 1.50 0.12 0.01 0.00 0.01 0.00 98.30 0.05 87 C E E 2.94 25.40 21.19 46.92 124.09 -155.07 -114.96 138.97 6.78 93.12 0.10 5.93 0.54 0.08 0.02 0.07 0.00 93.18 0.18 88 Q E E 31.24 15.07 25.87 40.88 129.13 -169.69 -124.50 142.18 5.66 94.15 0.18 5.02 0.42 0.10 0.06 0.09 0.00 93.98 0.34 89 Q E E 28.91 18.38 19.32 37.46 121.35 -153.80 -109.56 136.73 11.48 88.23 0.29 9.55 1.56 0.39 0.07 0.18 0.00 87.73 0.53 90 F E E 68.53 11.73 17.49 30.12 117.04 -155.90 -104.17 128.87 32.99 66.56 0.45 25.92 6.14 1.49 0.09 0.37 0.00 64.83 1.15 91 N C C 72.66 8.78 13.49 23.41 118.44 171.44 -116.78 147.39 72.25 27.04 0.70 45.57 19.46 6.78 0.09 0.71 0.00 26.21 1.17 92 S C S 86.78 2.39 14.74 17.69 98.25 -65.86 -81.07 -10.42 95.85 3.39 0.76 21.81 53.14 20.96 0.07 0.81 0.00 2.72 0.49 93 Y C S 138.01 3.94 12.51 18.14 121.12 44.26 -112.88 138.24 95.33 3.97 0.70 23.27 58.19 13.96 0.07 0.72 0.00 3.15 0.63 94 P C C 83.75 4.93 15.50 21.46 114.06 -86.82 -71.35 145.44 81.10 18.31 0.59 45.06 28.05 7.32 0.07 0.63 0.00 18.04 0.82 95 W E E 91.44 14.78 13.14 27.82 119.44 -130.70 -98.92 136.59 46.70 53.00 0.30 39.54 4.62 1.19 0.05 0.26 0.00 53.50 0.84 96 T E E 53.26 10.57 19.72 30.98 125.72 -164.46 -121.16 138.98 15.70 84.17 0.13 13.98 1.21 0.23 0.05 0.08 0.00 81.86 2.58 97 F E E 62.15 17.36 16.73 33.41 119.72 -145.04 -103.38 137.34 19.35 80.47 0.18 16.06 2.50 0.53 0.06 0.12 0.00 77.26 3.46 98 G C C 18.66 14.10 17.64 31.73 122.14 -135.58 -82.07 172.92 62.90 36.91 0.19 47.84 12.16 1.83 0.03 0.18 0.00 37.05 0.90 99 Q C C 115.15 5.53 22.66 28.53 103.45 -80.32 -77.93 31.94 75.86 23.98 0.16 63.50 9.57 1.19 0.02 0.15 0.00 25.00 0.57 100 G C C 16.43 18.54 16.06 33.35 128.52 -127.26 -73.88 173.23 66.59 33.32 0.09 59.52 4.43 0.42 0.01 0.08 0.00 35.04 0.49 101 T E E 31.88 15.21 19.73 35.22 127.87 -111.48 -121.38 144.68 11.03 88.96 0.01 10.17 0.45 0.02 0.00 0.01 0.00 89.09 0.26 102 K E E 102.54 9.61 22.60 32.53 119.17 -136.69 -100.19 134.17 1.18 98.82 0.00 1.02 0.07 0.00 0.00 0.00 0.00 98.88 0.03 103 V E E 12.29 22.32 14.63 36.90 121.74 -165.65 -116.31 132.50 0.82 99.18 0.00 0.78 0.02 0.00 0.00 0.00 0.00 99.19 0.02 104 E E E 95.98 5.55 23.51 29.42 117.17 -153.06 -104.44 129.31 1.72 98.27 0.00 1.71 0.04 0.00 0.00 0.00 0.00 98.17 0.08 105 I E E 26.61 20.81 10.92 30.97 115.16 -154.47 -99.27 126.66 16.62 83.34 0.04 16.92 0.19 0.03 0.01 0.01 0.00 82.19 0.65 106 K C C 128.75 3.98 19.76 24.50 115.08 -159.14 -100.34 129.32 99.48 0.51 0.00 99.52 0.05 0.01 0.00 0.00 0.00 0.41 0.01