# 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 M C C 118.96 5.28 13.86 20.46 110.10 -166.90 -91.43 114.17 99.78 0.14 0.09 99.69 0.10 0.07 0.05 0.01 0.00 0.06 0.02 1 V C C 76.03 8.69 10.28 20.15 116.94 -166.53 -98.73 137.38 79.46 1.72 18.82 74.87 1.07 3.20 18.28 1.08 0.00 0.87 0.61 2 D C C 96.55 3.40 14.40 18.93 110.82 -128.99 -85.91 124.43 68.36 1.51 30.13 56.72 4.78 4.86 30.64 1.74 0.00 0.73 0.52 3 I H H 81.47 11.51 10.84 22.62 97.30 -142.88 -71.06 -23.93 27.16 0.59 72.25 19.23 3.92 5.22 68.19 2.94 0.00 0.29 0.20 4 A H H 64.47 2.86 16.23 19.43 95.01 69.76 -65.98 -37.67 17.46 0.37 82.17 11.26 2.70 4.50 78.28 2.93 0.00 0.19 0.12 5 A H H 48.53 5.50 16.80 23.37 93.23 51.03 -66.77 -36.63 12.89 0.29 86.81 8.38 1.94 3.52 83.51 2.39 0.00 0.16 0.10 6 V H H 21.75 18.01 13.13 31.19 92.24 53.54 -64.68 -41.72 5.29 0.07 94.64 3.17 0.79 1.54 93.65 0.80 0.00 0.03 0.03 7 D H H 71.49 6.92 18.63 26.35 91.74 52.47 -63.50 -40.92 2.15 0.02 97.82 1.11 0.27 0.75 97.53 0.32 0.00 0.01 0.01 8 E H H 106.73 1.87 21.63 21.72 92.06 49.95 -64.72 -41.17 1.40 0.01 98.59 0.48 0.16 0.68 98.41 0.27 0.00 0.00 0.00 9 T H H 27.45 13.03 17.70 31.61 91.94 49.55 -64.76 -42.43 1.29 0.01 98.70 0.34 0.13 0.71 98.60 0.21 0.00 0.00 0.00 10 F H H 35.23 18.77 16.09 34.49 91.66 50.61 -63.73 -41.64 0.76 0.00 99.23 0.17 0.07 0.41 99.20 0.15 0.00 0.00 0.00 11 K H H 123.12 2.67 21.40 23.86 91.34 51.72 -62.89 -40.94 0.76 0.00 99.23 0.15 0.06 0.44 99.10 0.25 0.00 0.00 0.00 12 R H H 124.13 3.26 20.90 23.88 91.77 50.03 -64.81 -41.34 1.34 0.01 98.65 0.19 0.10 0.92 98.12 0.66 0.00 0.00 0.00 13 L H H 16.37 20.18 13.43 33.61 92.17 49.78 -66.29 -38.12 2.18 0.01 97.81 0.21 0.15 1.67 96.57 1.38 0.00 0.00 0.00 14 Q H H 86.07 11.50 15.55 27.39 91.14 58.03 -68.04 -22.25 21.06 0.04 78.90 0.68 0.66 19.81 77.18 1.62 0.02 0.01 0.02 15 S C T 91.51 1.06 18.55 18.11 92.92 58.38 -83.26 -7.99 73.83 0.08 26.10 2.13 2.75 68.06 25.04 1.92 0.01 0.03 0.06 16 H C S 69.14 12.40 9.50 22.64 117.14 97.62 -84.71 135.73 99.05 0.56 0.39 26.06 72.37 0.57 0.33 0.06 0.00 0.13 0.48 17 K C T 169.42 0.92 17.90 17.59 110.58 -109.64 -65.46 133.79 98.95 0.21 0.84 0.65 4.19 94.33 0.08 0.56 0.00 0.11 0.07 18 G C T 36.64 8.20 17.55 26.52 95.56 22.09 86.17 -3.75 99.65 0.14 0.21 0.85 3.59 95.23 0.01 0.19 0.00 0.11 0.01 19 V E E 19.28 21.64 12.55 34.06 112.25 124.08 -79.79 123.30 27.41 72.43 0.16 25.62 1.49 0.17 0.07 0.10 0.00 69.84 2.71 20 L E E 72.20 8.59 24.01 33.24 99.27 176.60 -96.71 -25.89 26.90 73.00 0.11 21.47 3.93 0.88 0.02 0.10 0.00 73.15 0.46 21 G E E 5.98 14.88 23.94 39.70 146.47 -33.32 172.94 173.12 15.71 84.19 0.10 9.72 3.78 1.49 0.01 0.08 0.00 84.78 0.12 22 I E E 20.68 21.21 23.05 43.59 131.33 -119.27 -136.02 144.03 2.46 97.53 0.01 2.36 0.10 0.01 0.00 0.00 0.00 97.48 0.05 23 I E E 11.82 21.68 24.06 45.27 120.56 -158.94 -115.68 128.22 0.36 99.63 0.00 0.33 0.01 0.00 0.00 0.00 0.00 99.65 0.01 24 V E E 25.51 16.28 25.44 41.69 116.91 -156.88 -105.60 125.40 0.15 99.85 0.00 0.13 0.00 0.00 0.00 0.00 0.00 99.86 0.00 25 I E E 19.68 18.87 17.89 37.04 127.83 -172.81 -120.69 147.52 0.65 99.35 0.00 0.65 0.02 0.00 0.00 0.00 0.00 99.23 0.10 26 N C C 48.46 7.84 19.62 28.47 124.25 -124.49 -80.58 174.43 76.37 23.58 0.05 75.99 0.61 0.08 0.01 0.02 0.00 22.59 0.70 27 A C T 69.04 9.82 14.52 25.30 90.45 -93.14 -63.52 -20.59 98.02 0.68 1.31 0.69 4.76 92.59 0.04 1.30 0.00 0.53 0.10 28 E C T 138.87 1.65 18.99 19.78 92.27 56.24 -88.27 0.52 98.50 0.13 1.38 0.52 3.83 94.10 0.04 1.42 0.00 0.07 0.03 29 G C S 17.27 16.32 13.29 29.87 96.33 -106.01 84.83 8.41 98.05 0.92 1.03 25.77 69.63 2.78 0.09 0.92 0.00 0.48 0.32 30 I C C 78.26 5.46 21.09 27.54 115.48 144.93 -85.17 131.79 79.03 20.90 0.07 78.58 2.39 0.09 0.03 0.03 0.00 10.65 8.22 31 A E E 33.04 18.56 13.13 31.27 110.17 -116.03 -68.62 128.97 1.75 98.23 0.01 1.74 0.08 0.01 0.01 0.00 0.00 94.22 3.94 32 I E E 81.26 7.80 19.31 27.78 102.72 176.34 -99.72 -29.52 3.32 96.67 0.01 2.62 0.44 0.04 0.00 0.01 0.00 96.84 0.06 33 R E E 119.75 5.33 20.56 26.88 135.72 0.95 -151.43 149.07 3.56 96.42 0.02 2.89 0.48 0.05 0.01 0.01 0.00 96.37 0.20 34 T E E 47.06 17.77 11.03 27.66 134.42 173.99 -142.31 149.88 18.89 81.02 0.09 16.94 1.56 0.18 0.03 0.05 0.00 80.39 0.85 35 T C S 91.54 3.97 17.58 22.46 101.94 -158.58 -102.44 -2.07 84.29 15.63 0.08 32.64 49.73 1.33 0.01 0.08 0.00 15.78 0.42 36 F C S 86.46 9.17 11.69 22.20 125.88 77.78 -106.07 159.11 94.70 5.17 0.13 21.40 72.40 1.41 0.03 0.08 0.00 4.02 0.67 37 D C C 96.93 2.98 16.69 20.04 111.28 -94.42 -73.08 134.91 98.81 0.91 0.28 94.15 3.96 0.86 0.12 0.11 0.00 0.55 0.25 38 N H H 90.44 9.00 11.87 21.91 95.96 -130.01 -66.63 -35.12 36.14 0.36 63.50 19.28 9.21 7.98 61.46 1.75 0.01 0.12 0.18 39 D H H 111.58 1.21 18.28 18.06 92.99 55.14 -65.70 -38.58 12.00 0.10 87.90 3.37 2.18 6.29 86.86 1.20 0.02 0.03 0.04 40 L H H 68.76 6.39 17.37 24.92 92.44 49.66 -66.44 -39.97 3.96 0.05 95.99 1.42 0.52 1.90 95.37 0.75 0.01 0.02 0.01 41 T H H 12.87 19.14 13.17 32.38 91.81 51.70 -63.79 -42.58 0.89 0.01 99.10 0.39 0.10 0.33 98.99 0.18 0.00 0.01 0.00 42 V H H 69.74 6.97 20.52 28.03 91.90 50.15 -64.36 -41.71 0.22 0.00 99.78 0.06 0.02 0.09 99.79 0.04 0.00 0.00 0.00 43 Q H H 107.30 2.25 24.16 25.05 91.84 49.56 -64.55 -41.99 0.13 0.00 99.87 0.02 0.01 0.06 99.88 0.02 0.00 0.00 0.00 44 Y H H 48.19 15.47 20.38 35.63 92.10 48.19 -64.74 -42.10 0.12 0.00 99.88 0.01 0.00 0.07 99.89 0.02 0.00 0.00 0.00 45 A H H 11.43 19.38 18.07 37.40 91.40 51.94 -62.98 -41.88 0.09 0.00 99.91 0.01 0.00 0.05 99.93 0.01 0.00 0.00 0.00 46 A H H 56.59 3.67 24.58 27.82 91.38 51.26 -63.58 -40.85 0.13 0.00 99.87 0.01 0.00 0.09 99.89 0.01 0.00 0.00 0.00 47 L H H 65.05 7.31 23.47 31.07 91.59 50.26 -64.31 -42.14 0.21 0.00 99.79 0.01 0.00 0.15 99.82 0.02 0.00 0.00 0.00 48 V H H 11.27 21.70 18.64 40.21 91.62 50.05 -64.42 -42.13 0.18 0.00 99.82 0.01 0.01 0.12 99.85 0.02 0.00 0.00 0.00 49 S H H 39.76 11.69 21.36 33.10 91.50 51.77 -62.74 -41.60 0.21 0.00 99.79 0.02 0.01 0.13 99.83 0.02 0.00 0.00 0.00 50 H H H 115.74 2.42 24.99 26.22 91.69 50.14 -64.93 -40.89 0.22 0.00 99.78 0.01 0.01 0.16 99.79 0.03 0.00 0.00 0.00 51 F H H 43.21 14.23 20.67 35.13 91.96 49.92 -64.47 -42.33 0.16 0.00 99.84 0.01 0.01 0.11 99.85 0.03 0.00 0.00 0.00 52 T H H 18.73 19.41 18.63 37.58 91.55 50.73 -63.35 -42.36 0.16 0.00 99.84 0.01 0.01 0.10 99.86 0.02 0.00 0.00 0.00 53 V H H 78.72 4.39 24.01 28.23 91.45 49.95 -64.10 -41.58 0.13 0.00 99.87 0.01 0.01 0.09 99.87 0.02 0.00 0.00 0.00 54 K H H 107.39 3.94 24.44 27.88 91.58 49.55 -64.64 -41.20 0.19 0.00 99.81 0.01 0.01 0.14 99.80 0.04 0.00 0.00 0.00 55 A H H 10.23 18.83 17.56 36.92 91.49 50.38 -64.00 -42.44 0.28 0.00 99.72 0.02 0.01 0.19 99.71 0.06 0.00 0.00 0.00 56 R H H 85.50 13.72 20.75 33.76 91.55 51.27 -62.59 -41.85 0.37 0.00 99.63 0.04 0.02 0.24 99.62 0.08 0.00 0.00 0.00 57 S H H 57.98 2.54 23.41 24.72 91.61 50.26 -63.88 -41.88 0.88 0.00 99.12 0.08 0.05 0.63 99.08 0.15 0.00 0.00 0.00 58 A H H 33.13 7.40 19.92 28.42 91.75 50.21 -64.50 -42.19 1.43 0.00 98.57 0.15 0.11 1.02 98.48 0.23 0.00 0.00 0.00 59 V H H 18.22 17.11 14.17 31.98 91.96 49.88 -64.39 -41.31 1.72 0.01 98.27 0.26 0.19 1.14 97.95 0.44 0.00 0.01 0.00 60 R H H 120.94 6.52 16.03 23.73 91.87 52.03 -64.48 -38.19 3.03 0.02 96.94 0.47 0.29 2.18 96.03 1.00 0.01 0.01 0.01 61 K H H 153.68 1.13 17.49 17.41 92.59 50.33 -67.69 -35.87 7.04 0.03 92.93 0.50 0.50 5.98 92.15 0.83 0.01 0.01 0.01 62 L H H 87.87 6.64 14.16 21.64 97.84 40.28 -83.90 -32.41 13.67 0.06 86.28 0.63 1.85 11.14 85.69 0.61 0.04 0.01 0.03 63 D C C 65.32 8.28 11.98 21.51 113.95 14.29 -133.07 86.11 90.88 0.58 8.54 58.60 24.17 7.35 8.33 0.81 0.00 0.15 0.58 64 G C T 55.08 3.12 11.88 16.91 95.28 -160.38 -64.53 -15.42 91.23 0.32 8.45 10.38 11.72 67.65 0.70 9.21 0.00 0.18 0.15 65 D C T 118.87 1.21 15.09 15.57 99.55 57.96 -90.44 -1.10 90.27 0.46 9.28 7.31 15.70 65.62 0.64 10.23 0.00 0.24 0.26 66 N C C 70.94 11.98 11.45 23.53 107.14 84.75 -76.48 96.60 93.47 0.91 5.62 51.39 32.90 7.89 0.56 6.29 0.00 0.44 0.52 67 D C C 75.65 6.59 18.61 26.02 105.35 149.62 -93.64 40.98 97.37 1.87 0.76 85.78 9.54 1.96 0.19 0.61 0.00 1.05 0.87 68 L C C 33.28 20.58 12.49 32.27 111.54 -119.51 -82.16 122.80 83.96 15.81 0.23 82.48 1.69 0.32 0.06 0.12 0.00 14.13 1.19 69 K C S 101.29 7.16 21.48 29.42 100.58 176.15 -97.14 -27.20 81.69 18.25 0.06 33.52 47.39 0.71 0.01 0.05 0.00 17.97 0.35 70 F E E 68.47 10.66 21.95 33.20 136.31 13.15 -147.78 146.20 6.17 93.79 0.03 4.76 1.24 0.09 0.01 0.02 0.00 93.72 0.15 71 L E E 21.91 21.89 17.28 38.71 126.06 -169.01 -129.93 133.39 0.77 99.22 0.01 0.72 0.03 0.00 0.00 0.00 0.00 99.23 0.02 72 R E E 84.34 10.75 24.33 35.21 119.32 -163.21 -114.76 126.39 0.27 99.73 0.00 0.26 0.01 0.00 0.00 0.00 0.00 99.73 0.00 73 I E E 22.66 19.82 17.77 37.73 120.32 -168.08 -115.69 128.50 0.36 99.63 0.00 0.33 0.01 0.00 0.00 0.00 0.00 99.65 0.01 74 R E E 109.29 8.25 20.04 29.18 121.27 -168.48 -117.63 130.16 3.09 96.89 0.01 2.72 0.19 0.02 0.00 0.00 0.00 96.94 0.11 75 S C C 30.52 11.61 13.06 25.81 130.45 171.32 -126.90 172.93 71.83 28.14 0.03 68.54 1.58 0.09 0.00 0.02 0.00 29.43 0.33 76 K C S 162.23 1.58 15.56 17.23 93.67 -90.53 -64.48 -33.17 99.25 0.55 0.20 4.85 80.38 14.10 0.02 0.15 0.00 0.41 0.08 77 K C S 135.41 3.10 15.70 19.51 103.13 18.45 -103.67 -22.41 99.15 0.65 0.21 3.98 80.31 14.93 0.02 0.17 0.00 0.50 0.09 78 H E E 50.93 12.60 14.74 28.37 136.80 23.03 -145.23 153.51 45.83 54.08 0.10 37.39 5.76 0.60 0.01 0.09 0.00 55.75 0.39 79 E E E 56.34 12.22 19.81 32.86 123.50 -149.30 -117.38 135.34 3.21 96.78 0.00 2.99 0.10 0.01 0.00 0.00 0.00 96.84 0.05 80 I E E 11.21 21.10 19.39 40.74 123.35 -167.55 -120.41 133.04 0.21 99.79 0.00 0.19 0.00 0.00 0.00 0.00 0.00 99.80 0.00 81 M E E 33.86 14.12 26.08 40.47 119.33 -160.53 -107.49 130.66 0.12 99.88 0.00 0.10 0.00 0.00 0.00 0.00 0.00 99.89 0.00 82 I E E 6.26 24.14 21.53 45.61 121.89 -167.92 -118.30 130.89 0.53 99.47 0.00 0.48 0.02 0.00 0.00 0.00 0.00 99.47 0.02 83 A E E 15.80 15.36 24.86 40.47 126.58 -172.53 -127.53 139.94 19.50 80.41 0.09 18.30 0.67 0.07 0.03 0.03 0.00 80.69 0.22 84 P E E 22.47 18.29 18.98 37.03 113.98 -116.09 -71.15 144.77 38.66 57.82 3.51 31.25 5.28 2.39 1.26 1.78 0.00 57.23 0.80 85 E C C 72.74 10.65 18.96 30.24 112.73 -136.38 -94.06 125.62 58.78 33.77 7.45 44.73 9.05 5.49 2.99 4.20 0.02 31.09 2.42 86 F C C 90.56 11.00 13.52 25.24 111.44 -157.18 -95.22 115.89 62.38 27.37 10.25 42.18 12.72 8.45 4.52 5.57 0.07 23.19 3.29 87 E C C 117.18 4.75 13.06 19.20 107.97 79.19 -90.86 88.07 69.15 21.19 9.66 42.31 15.69 12.28 4.61 4.92 0.08 16.57 3.54 88 R C T 161.67 3.07 12.54 16.74 101.61 25.39 -78.31 -7.28 85.00 5.42 9.58 28.73 19.81 37.52 3.44 5.35 0.02 3.75 1.38 89 S C T 78.55 3.85 12.98 17.87 101.51 13.58 -83.24 12.87 91.91 2.09 6.00 27.28 22.89 42.25 1.46 4.17 0.00 1.32 0.63 90 H C C 90.99 9.59 12.82 23.26 113.62 100.47 -98.26 119.15 83.28 12.24 4.49 39.54 23.32 21.34 0.76 3.71 0.00 9.70 1.62 91 E C C 82.72 9.92 17.49 28.00 113.63 -147.98 -95.55 121.00 67.53 30.26 2.21 45.50 13.64 8.23 0.38 1.92 0.00 28.92 1.40 92 Y E E 39.59 16.58 17.89 34.67 131.05 70.43 -128.67 149.61 35.94 63.47 0.59 29.30 5.09 1.34 0.13 0.42 0.00 62.78 0.93 93 Y E E 27.65 18.20 21.82 39.96 125.58 -157.91 -121.31 138.85 9.77 90.09 0.14 8.38 0.99 0.17 0.05 0.06 0.00 90.11 0.25 94 L E E 17.28 19.53 23.99 43.20 119.14 -152.57 -108.65 128.27 2.90 97.06 0.04 2.64 0.17 0.03 0.01 0.01 0.00 97.09 0.05 95 V E E 11.22 20.92 23.54 44.06 118.87 -163.79 -112.37 126.68 1.18 98.80 0.02 1.13 0.05 0.01 0.01 0.00 0.00 98.78 0.02 96 V E E 17.32 17.90 24.27 42.14 119.41 -165.47 -112.93 127.58 0.84 99.15 0.01 0.82 0.02 0.00 0.00 0.00 0.00 99.13 0.02 97 V E E 22.12 17.69 22.61 40.27 118.65 -163.24 -109.58 126.95 1.57 98.42 0.01 1.47 0.06 0.01 0.00 0.00 0.00 98.39 0.07 98 Q E E 47.55 14.52 20.10 34.71 122.65 -166.90 -112.20 137.57 11.47 88.49 0.04 10.30 0.91 0.07 0.02 0.02 0.00 88.12 0.56 99 D C C 48.30 10.85 17.68 29.77 109.09 -141.24 -99.90 108.35 85.01 14.92 0.07 82.03 2.14 0.13 0.01 0.04 0.00 15.25 0.40 100 P C C 58.74 11.09 13.45 25.89 94.74 -160.86 -67.69 -17.51 84.34 3.36 12.30 37.64 11.46 34.91 1.57 11.21 0.00 2.60 0.60 101 S C T 75.90 3.76 13.78 18.76 97.43 67.48 -83.01 -5.21 83.08 2.54 14.38 24.36 18.61 40.28 1.84 12.53 0.00 1.46 0.92 102 R C C 139.93 5.19 10.46 17.31 107.51 90.23 -86.63 86.15 80.16 4.38 15.46 46.21 21.13 12.61 2.62 13.25 0.00 2.45 1.72 103 E C C 135.43 3.12 9.87 14.92 113.49 112.61 -89.33 131.13 93.19 2.27 4.54 88.19 1.43 4.72 1.49 1.98 0.00 1.26 0.93 104 A C C 77.63 4.69 10.48 16.99 110.89 -115.85 -77.01 134.30 99.92 0.04 0.04 99.80 0.08 0.07 0.02 0.00 0.00 0.02 0.00