# 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 N C C 109.47 4.73 14.98 21.08 103.04 55.52 -88.07 47.13 99.81 0.18 0.01 99.69 0.15 0.04 0.00 0.00 0.00 0.12 0.01 1 E C C 108.33 5.68 13.70 20.96 117.01 145.62 -96.81 132.67 64.57 35.20 0.23 61.86 1.12 0.50 0.04 0.14 0.00 35.37 0.97 2 V E E 73.20 10.63 12.28 23.71 118.88 -151.63 -105.13 133.12 29.20 70.71 0.10 25.77 2.57 0.23 0.02 0.07 0.00 70.69 0.65 3 V E E 47.25 11.06 15.19 27.78 120.86 -161.91 -111.56 133.05 8.50 91.47 0.03 7.95 0.38 0.04 0.01 0.02 0.00 91.38 0.23 4 T E E 69.16 11.21 15.89 27.78 124.20 -162.42 -118.04 137.85 4.38 95.61 0.01 4.06 0.20 0.01 0.00 0.00 0.00 95.64 0.08 5 R E E 80.26 11.83 16.61 29.29 129.04 -175.06 -130.17 142.36 2.53 97.46 0.01 2.33 0.12 0.01 0.00 0.00 0.00 97.49 0.05 6 E E E 104.00 8.91 17.58 27.81 122.68 -154.33 -115.48 134.22 2.23 97.76 0.01 2.08 0.08 0.01 0.00 0.00 0.00 97.77 0.05 7 Y E E 47.49 15.22 16.30 32.18 130.76 -175.94 -133.38 147.05 2.50 97.49 0.01 2.36 0.09 0.01 0.00 0.00 0.00 97.50 0.04 8 T E E 67.47 9.32 20.53 30.60 120.29 -147.26 -111.96 131.46 3.15 96.84 0.01 2.90 0.14 0.01 0.00 0.00 0.00 96.88 0.07 9 I E E 15.55 20.79 15.59 36.69 120.03 -165.16 -117.16 126.80 4.69 95.29 0.02 4.34 0.25 0.02 0.01 0.01 0.00 95.20 0.17 10 N E E 64.14 7.19 23.73 31.69 107.30 -137.58 -89.15 109.11 15.23 84.71 0.06 15.09 0.31 0.04 0.03 0.03 0.00 83.98 0.53 11 I C C 8.02 23.90 15.34 39.93 96.59 174.45 -83.92 -15.09 59.95 4.24 35.80 49.60 4.55 5.71 28.07 7.81 0.01 3.47 0.78 12 H H H 63.90 14.94 16.00 30.97 92.06 82.57 -61.48 -32.74 21.13 0.68 78.19 4.74 3.43 11.97 55.77 23.25 0.17 0.42 0.25 13 K H H 140.44 2.13 20.37 22.27 91.81 56.67 -68.88 -28.77 16.44 0.46 83.10 2.43 2.28 10.43 60.25 24.02 0.14 0.29 0.15 14 R H H 99.40 10.30 16.89 27.60 97.04 48.51 -85.42 -18.95 17.70 0.59 81.70 2.93 2.74 11.17 61.14 21.24 0.19 0.38 0.21 15 I H H 23.46 20.10 11.74 31.07 103.73 44.58 -99.12 -1.10 37.80 3.22 58.98 7.30 9.58 22.27 45.65 10.18 1.63 1.47 1.93 16 H C T 118.72 7.09 14.65 23.07 108.44 93.06 -66.04 115.79 75.39 1.34 23.27 5.69 7.64 59.89 19.64 5.34 0.12 0.62 1.06 17 G C T 63.91 0.98 16.30 16.25 95.66 -0.70 81.28 0.47 89.06 0.28 10.66 8.59 12.21 68.37 6.95 3.52 0.00 0.14 0.21 18 V C S 55.20 10.72 10.50 22.32 118.56 113.80 -97.21 142.70 94.27 1.30 4.43 40.20 47.24 6.54 3.17 1.17 0.00 0.38 1.29 19 G C C 31.47 3.73 18.78 22.75 118.67 -108.68 -74.25 160.05 97.49 0.68 1.83 89.27 5.84 2.40 1.24 0.44 0.00 0.24 0.57 20 F H H 83.87 15.32 11.99 26.97 92.37 -105.12 -60.03 -37.95 14.27 0.14 85.59 2.54 3.29 8.97 75.65 9.28 0.12 0.06 0.09 21 K H H 138.10 3.95 17.30 22.34 91.85 53.51 -64.94 -36.70 11.11 0.06 88.83 0.75 1.07 8.76 76.05 13.26 0.06 0.03 0.03 22 K H H 131.83 2.58 19.65 22.05 94.33 44.05 -78.00 -28.58 11.24 0.07 88.68 0.86 1.02 8.77 74.53 14.70 0.05 0.04 0.03 23 R H H 51.85 15.32 15.89 31.21 96.14 46.28 -85.48 -20.11 13.27 0.09 86.64 2.18 1.80 9.42 80.89 5.59 0.04 0.04 0.05 24 A H H 10.58 21.07 15.82 36.78 91.86 76.60 -59.26 -44.97 1.80 0.01 98.19 0.47 0.15 0.95 97.61 0.82 0.00 0.00 0.00 25 P H H 63.05 6.56 23.91 30.71 91.53 50.36 -63.51 -40.93 0.68 0.00 99.31 0.10 0.04 0.44 98.72 0.71 0.00 0.00 0.00 26 R H H 107.58 4.88 26.02 31.01 91.60 49.53 -64.82 -41.16 0.19 0.00 99.81 0.03 0.01 0.11 99.39 0.46 0.00 0.00 0.00 27 A H H 3.39 22.42 19.82 42.53 91.44 50.58 -63.30 -43.65 0.16 0.00 99.84 0.02 0.01 0.09 99.78 0.11 0.00 0.00 0.00 28 L H H 16.80 21.06 21.77 41.98 91.23 50.71 -62.89 -42.27 0.15 0.00 99.85 0.01 0.01 0.10 99.85 0.03 0.00 0.00 0.00 29 K H H 108.44 4.07 26.83 30.87 91.55 50.67 -63.62 -41.90 0.12 0.00 99.88 0.01 0.00 0.08 99.89 0.01 0.00 0.00 0.00 30 E H H 55.08 10.24 24.39 35.10 91.73 49.23 -64.46 -42.24 0.08 0.00 99.92 0.00 0.00 0.05 99.93 0.01 0.00 0.00 0.00 31 I H H 2.19 26.41 19.77 46.47 91.39 49.50 -63.60 -43.74 0.06 0.00 99.94 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 32 R H H 74.36 16.56 22.69 37.67 91.27 51.49 -62.12 -42.30 0.04 0.00 99.96 0.00 0.00 0.02 99.97 0.00 0.00 0.00 0.00 33 K H H 110.79 2.97 26.45 28.74 91.42 49.86 -63.59 -42.78 0.07 0.00 99.93 0.00 0.00 0.04 99.95 0.00 0.00 0.00 0.00 34 F H H 34.77 11.98 22.27 35.20 91.76 48.44 -64.37 -42.90 0.09 0.00 99.91 0.00 0.00 0.06 99.92 0.01 0.00 0.00 0.00 35 A H H 2.69 23.57 15.70 39.91 91.44 50.05 -63.45 -43.18 0.14 0.00 99.86 0.01 0.01 0.09 99.88 0.01 0.00 0.00 0.00 36 M H H 69.83 11.13 18.45 29.94 92.15 48.72 -64.23 -41.86 0.20 0.00 99.80 0.01 0.01 0.16 99.80 0.02 0.00 0.00 0.00 37 K H H 145.92 1.53 20.87 21.37 93.34 45.51 -68.08 -40.87 0.70 0.00 99.30 0.01 0.02 0.68 99.22 0.06 0.00 0.00 0.00 38 E H H 87.18 9.77 18.01 28.06 98.65 36.89 -81.54 -37.95 4.90 0.00 95.10 0.04 0.18 5.02 94.60 0.15 0.01 0.00 0.00 39 M H H 41.66 16.07 14.69 30.79 99.89 25.55 -101.42 -13.37 16.17 0.08 83.74 0.71 2.89 12.28 83.71 0.28 0.05 0.02 0.06 40 G C C 49.37 3.24 21.03 24.50 95.33 -123.41 73.65 19.77 99.48 0.37 0.16 75.03 14.10 10.32 0.05 0.09 0.00 0.14 0.27 41 T C C 24.58 16.09 11.21 27.79 116.93 143.40 -102.88 132.31 99.10 0.81 0.10 92.71 6.09 0.26 0.02 0.07 0.00 0.29 0.55 42 P C T 100.17 3.65 19.29 23.99 93.25 -145.29 -72.40 -16.03 98.94 0.59 0.47 5.50 28.75 64.56 0.02 0.63 0.00 0.43 0.12 43 D C T 84.12 6.36 20.15 27.37 97.24 60.72 -95.61 14.74 95.88 3.63 0.48 12.91 16.02 66.81 0.02 0.70 0.00 3.39 0.17 44 V C C 11.85 24.17 10.93 34.76 115.67 120.19 -84.66 130.93 65.40 34.49 0.12 60.99 4.04 0.19 0.03 0.10 0.00 32.71 1.94 45 R E E 118.63 5.67 26.16 32.54 123.83 -169.33 -122.39 136.46 29.60 70.34 0.07 30.34 0.42 0.05 0.03 0.03 0.00 65.27 3.87 46 I E E 31.51 22.53 14.51 36.33 117.06 -138.41 -95.70 130.19 34.25 65.68 0.07 34.66 0.57 0.04 0.04 0.02 0.00 58.56 6.11 47 D C C 40.23 12.08 17.08 30.34 108.50 -122.45 -74.75 123.05 92.80 7.07 0.13 92.74 0.57 0.06 0.06 0.02 0.00 6.21 0.33 48 T H H 86.76 4.97 17.74 24.12 93.35 -145.62 -64.69 -32.61 6.03 0.03 93.94 1.13 0.80 3.89 92.84 1.32 0.01 0.01 0.01 49 R H H 139.24 2.71 20.25 22.85 91.45 55.86 -63.93 -40.12 2.40 0.01 97.59 0.27 0.23 1.84 96.57 1.09 0.01 0.01 0.00 50 L H H 14.65 19.68 15.56 35.24 92.08 49.27 -65.35 -42.03 0.79 0.01 99.20 0.14 0.08 0.51 98.24 1.02 0.00 0.00 0.00 51 N H H 37.36 17.03 16.98 33.54 91.68 52.80 -62.57 -41.83 0.65 0.00 99.35 0.11 0.05 0.41 98.95 0.48 0.00 0.00 0.00 52 K H H 124.90 2.11 23.13 23.98 91.73 49.81 -64.55 -40.81 0.67 0.00 99.33 0.07 0.04 0.49 99.08 0.32 0.00 0.00 0.00 53 A H H 30.23 7.60 19.61 28.77 91.82 50.19 -64.66 -42.24 1.07 0.01 98.92 0.09 0.07 0.82 98.57 0.45 0.00 0.00 0.00 54 V H H 8.24 21.96 13.92 35.93 91.93 48.78 -64.54 -42.35 2.75 0.02 97.23 0.28 0.23 2.11 96.48 0.88 0.01 0.01 0.01 55 W H H 113.92 10.35 16.91 27.70 92.30 49.59 -65.35 -38.47 6.90 0.07 93.04 0.92 0.61 5.20 90.20 2.98 0.03 0.03 0.02 56 A H H 80.21 1.76 18.27 19.46 92.35 53.48 -67.36 -32.23 18.71 0.11 81.19 1.16 1.47 16.07 78.23 2.90 0.07 0.05 0.06 57 K C H 109.37 5.58 15.48 22.13 96.95 43.75 -91.41 -7.96 50.46 0.45 49.09 2.77 7.47 39.64 45.98 3.45 0.17 0.16 0.35 58 G C T 21.26 6.53 17.21 25.59 124.62 -113.21 94.22 169.00 78.81 1.10 20.10 23.81 10.16 45.31 12.69 6.88 0.01 0.49 0.65 59 I C G 53.94 17.81 11.86 28.88 94.47 -71.98 -66.68 -25.56 51.57 2.64 45.79 16.81 8.77 27.02 6.28 38.13 0.13 1.27 1.59 60 R C T 162.44 3.49 17.72 22.12 93.06 64.35 -68.69 -20.55 57.11 1.10 41.80 4.84 8.35 42.23 3.90 39.37 0.05 0.60 0.67 61 N C T 104.30 4.07 18.26 23.08 98.79 42.21 -98.87 2.02 60.40 1.28 38.32 8.80 12.34 38.18 2.65 36.69 0.01 0.70 0.64 62 V C S 24.60 19.54 11.48 30.75 118.65 98.90 -100.84 131.36 96.93 2.90 0.17 41.02 56.19 0.38 0.07 0.08 0.00 1.13 1.13 63 P C C 56.53 8.40 21.34 30.41 111.95 -115.74 -67.93 139.31 95.85 4.03 0.12 91.66 3.89 0.46 0.03 0.09 0.00 3.24 0.62 64 Y C C 57.64 19.55 15.98 34.40 126.30 172.44 -124.78 148.10 58.55 41.18 0.27 49.26 7.98 0.72 0.07 0.25 0.00 38.86 2.86 65 R E E 97.32 10.17 23.86 34.19 126.19 -145.44 -121.68 138.63 28.67 71.13 0.20 25.38 2.62 0.35 0.04 0.15 0.00 70.77 0.69 66 I E E 8.16 24.76 16.90 42.01 122.54 -161.12 -117.38 131.70 11.22 88.71 0.07 10.65 0.54 0.06 0.02 0.04 0.00 88.43 0.26 67 R E E 81.25 10.02 26.35 36.79 116.74 -157.47 -104.03 126.34 4.66 95.30 0.04 4.42 0.18 0.03 0.01 0.02 0.00 95.26 0.09 68 V E E 5.51 25.22 17.43 43.11 123.80 -170.26 -122.39 134.39 2.82 97.16 0.02 2.74 0.10 0.01 0.01 0.01 0.00 97.04 0.09 69 R E E 84.12 9.58 26.77 36.78 119.48 -161.73 -112.18 129.36 4.77 95.20 0.03 4.62 0.19 0.02 0.01 0.01 0.00 94.91 0.24 70 L E E 12.14 23.61 16.32 40.00 118.58 -154.91 -101.96 132.93 22.59 77.23 0.18 21.45 0.96 0.16 0.06 0.10 0.00 76.53 0.73 71 S E E 36.31 10.05 22.28 32.81 123.62 -169.90 -108.38 148.34 40.93 58.77 0.31 35.12 4.43 0.66 0.09 0.23 0.00 58.04 1.42 72 R E E 93.40 12.91 16.70 29.65 123.79 -139.97 -115.35 139.60 46.70 52.84 0.46 38.26 7.45 0.96 0.14 0.37 0.00 50.57 2.25 73 K C C 104.90 8.48 16.24 25.66 114.75 -119.58 -83.80 136.76 54.65 44.63 0.72 49.29 3.51 0.88 0.29 0.48 0.00 40.32 5.23 74 R C C 122.97 8.26 13.11 22.52 114.29 -139.32 -93.73 134.08 76.61 21.17 2.22 58.72 13.86 3.46 0.84 1.54 0.01 16.27 5.31 75 N C C 74.43 7.84 10.77 20.02 110.88 -135.96 -95.14 106.07 88.89 7.71 3.40 69.52 13.51 5.66 1.01 2.42 0.00 5.37 2.50 76 E C S 139.87 2.82 12.00 16.12 98.91 -163.67 -81.55 -8.46 91.36 3.58 5.06 33.83 34.14 23.83 1.18 3.66 0.01 1.96 1.39 77 D C C 92.19 3.42 10.21 15.18 109.10 79.99 -91.14 100.02 91.79 3.12 5.08 40.38 26.44 25.03 0.96 4.10 0.00 1.38 1.70 78 E C T 129.81 4.25 9.36 15.34 97.59 -137.59 -69.67 -16.94 96.85 0.65 2.49 10.92 22.80 62.92 0.32 2.33 0.00 0.36 0.36 79 D C T 121.16 1.31 11.73 13.32 99.54 56.52 -89.00 5.62 98.40 0.56 1.04 15.08 23.83 59.31 0.11 1.15 0.00 0.33 0.20 80 S C C 41.05 7.21 8.39 17.70 115.10 102.55 -90.84 128.12 96.67 3.04 0.29 61.70 34.05 0.87 0.08 0.21 0.00 1.09 2.00 81 P C T 100.14 3.20 12.46 17.13 95.53 -138.10 -65.26 -22.73 95.27 0.94 3.79 8.52 11.94 74.22 0.39 4.03 0.00 0.60 0.31 82 N C T 91.37 6.70 13.11 20.99 98.26 54.12 -88.64 10.26 93.74 2.27 3.99 9.85 11.56 71.84 0.51 4.00 0.00 1.82 0.42 83 K C C 89.93 9.79 14.68 25.46 112.39 128.28 -84.18 125.88 78.78 16.74 4.47 54.72 18.71 5.65 1.08 3.75 0.01 12.24 3.83 84 L C C 54.30 14.18 15.20 29.49 112.23 -161.33 -97.91 121.05 63.55 33.41 3.04 47.05 12.32 4.02 1.07 2.03 0.01 29.65 3.85 85 Y E E 86.42 12.41 17.53 30.21 126.40 -161.99 -121.38 141.97 37.74 59.61 2.65 29.53 6.58 1.99 1.27 1.62 0.01 54.54 4.47 86 T E E 42.11 14.50 16.81 31.57 123.29 -158.52 -117.90 136.45 32.24 65.55 2.21 26.53 4.71 1.28 1.08 1.12 0.00 63.38 1.90 87 L E E 73.08 10.57 19.22 30.26 114.81 -143.25 -95.49 127.21 29.37 69.11 1.52 24.87 4.04 0.87 0.78 0.70 0.00 66.70 2.05 88 V E E 44.59 16.43 14.29 30.65 119.06 -162.80 -107.98 129.32 31.12 67.68 1.20 26.13 4.44 0.70 0.53 0.52 0.00 66.67 1.02 89 T E E 65.69 7.79 18.93 27.56 122.12 -164.47 -112.23 137.96 25.63 73.64 0.73 21.72 3.29 0.68 0.26 0.37 0.00 72.78 0.89 90 Y E E 114.32 10.92 15.57 26.98 118.05 -137.45 -101.04 128.27 20.21 79.52 0.28 17.64 2.33 0.31 0.11 0.15 0.00 78.02 1.44 91 V E E 46.55 12.67 14.28 28.05 120.32 -170.01 -117.14 128.54 19.94 80.00 0.06 18.38 1.33 0.09 0.02 0.03 0.00 79.24 0.91 92 P E E 84.70 4.60 18.64 24.08 111.88 -117.82 -70.23 135.90 28.68 71.15 0.17 26.33 1.93 0.23 0.06 0.11 0.00 69.78 1.56 93 V C C 43.26 16.17 9.61 25.29 122.88 -171.25 -120.88 136.99 71.18 22.78 6.04 63.43 5.16 2.26 2.43 3.68 0.00 18.79 4.24 94 T C C 101.20 2.53 16.47 19.54 99.93 -165.34 -93.16 -18.34 76.73 7.89 15.38 33.62 27.32 17.49 3.74 10.80 0.05 4.96 2.01 95 T C S 74.11 4.99 16.31 22.24 123.06 37.69 -121.78 142.60 75.29 5.98 18.73 26.41 27.13 23.61 4.20 13.10 0.07 3.36 2.12 96 F C C 72.54 16.20 9.06 24.06 105.78 -148.33 -96.17 37.16 67.87 5.47 26.67 44.59 11.21 11.84 4.14 23.10 0.01 3.31 1.80 97 K C T 145.58 2.44 14.73 18.34 110.28 140.66 -77.86 128.96 74.57 4.21 21.23 10.76 12.67 50.93 3.03 18.28 0.04 2.74 1.56 98 N C T 123.63 2.00 16.17 18.41 96.48 11.69 60.77 29.49 75.80 5.15 19.05 12.71 12.94 50.19 2.20 16.94 0.02 3.93 1.07 99 L C C 57.02 16.35 8.60 23.91 115.69 153.21 -79.88 136.25 70.54 26.52 2.93 61.27 6.77 1.87 0.63 2.23 0.00 25.63 1.60 100 Q E E 109.49 3.95 17.35 22.45 123.93 -166.97 -116.78 143.10 36.54 62.92 0.54 33.30 2.40 0.56 0.20 0.33 0.00 61.74 1.48 101 T E E 76.71 10.99 11.92 23.67 120.72 -139.89 -104.62 136.89 23.06 76.74 0.20 21.40 1.41 0.23 0.06 0.12 0.00 76.01 0.77 102 V E E 77.37 6.39 13.96 22.17 124.11 -167.66 -120.88 138.41 15.10 84.75 0.15 14.34 0.81 0.14 0.06 0.07 0.00 83.34 1.23 103 N E E 101.21 5.21 12.33 19.40 113.21 -129.01 -86.33 126.36 22.98 76.80 0.22 21.13 1.49 0.27 0.08 0.13 0.00 75.44 1.46 104 V C C 83.08 7.58 9.21 18.15 105.01 -168.22 -96.22 2.02 69.54 29.42 1.03 52.79 11.57 3.82 0.25 0.83 0.00 29.47 1.28 105 D C C 108.84 2.57 9.90 14.07 110.04 85.73 -91.01 112.59 84.29 14.80 0.91 75.07 3.91 4.20 0.19 0.68 0.00 14.76 1.19 106 E C C 140.49 2.83 11.47 15.96 109.59 -137.49 -88.35 114.99 99.60 0.37 0.03 99.50 0.14 0.06 0.01 0.00 0.00 0.27 0.02