A0A3Q0KJX5_SCHMA Loading...

Serine/threonine-protein

AlphaFold DB , UniProt , Accession A0A3Q0KJX5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 541 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.8	Very low	33.7	Very low	248 Å²	248	148.5 Å²	148.5	100%	1.222	86%	0.857	S	S	*	*				0	132.2	0	-80.6	177	164.8	0	0	108.2
2	S	35.7	Very low	33.6	Very low	128 Å²	128	151.2 Å²	151.2	90%	0.895	87%	0.865	S	S	*	*			trans	78.3	84.1	-176.6	-147.1	0	0	0	0	117.6
3	T	29.9	Very low	33.4	Very low	135 Å²	135	146.3 Å²	146.3	83%	0.828	85%	0.846	S	S	*	*			trans	-82.3	140.9	158.2	45.1	0	0	0	0	110.3
4	A	40.3	Very low	33.1	Very low	108 Å²	108	149.1 Å²	149.1	89%	0.893	86%	0.855	S	S	*	*			trans	-145.5	100.7	157.6	0	0	0	0	0	110
5	S	30.3	Very low	33	Very low	116 Å²	116	146.9 Å²	146.9	81%	0.811	85%	0.845	S	S	*	*			trans	-91.6	142.8	166.3	46.9	0	0	0	0	109.7
6	S	37.2	Very low	32.9	Very low	118 Å²	118	145.9 Å²	145.9	83%	0.825	84%	0.843	S	S	*	*			trans	-162	109	148.6	46	0	0	0	0	110.6
7	H	33.3	Very low	33	Very low	186 Å²	186	143.4 Å²	143.4	86%	0.861	83%	0.825	S	S	*	*			trans	-92.3	153	146.2	-91	33	0	0	0	105.9
8	P	36.4	Very low	33	Very low	101 Å²	101	141.1 Å²	141.1	66%	0.656	82%	0.816	S	S	*	*				-157.7	151.9	69.1	37.6	-15.6	0	0	0	117.5
9	Y	33.5	Very low	33.1	Very low	245 Å²	245	140.4 Å²	140.4	96%	0.961	81%	0.808	S	S	*	*			trans	-137.9	88.2	149.1	-84.5	-76.1	0	0	0	109.2
10	S	30.6	Very low	33.3	Very low	92 Å²	92	139.2 Å²	139.2	64%	0.643	80%	0.804	S	S	*	*			trans	-95.7	152.7	158.1	44.1	0	0	0	0	108.9
11	N	29.1	Very low	33.3	Very low	156 Å²	156	138.6 Å²	138.6	83%	0.834	80%	0.803	S	S	*	*			trans	92.2	80.3	175.3	-55.1	-22.3	0	0	0	117
12	L	32.2	Very low	33.2	Very low	181 Å²	181	133.9 Å²	133.9	95%	0.948	78%	0.781	S	S	*	*			trans	-110.7	92.9	144.4	-99.1	137.9	0	0	0	107.5
13	S	30.4	Very low	33.1	Very low	88 Å²	88	134.1 Å²	134.1	62%	0.615	77%	0.77	S	S	*	*			trans	-55.4	135.8	168.8	49.3	0	0	0	0	110.6	T15	S13-T15 VanDerWaalsContact C-N 3.33Å; S13-T15 PolarHBondContact O-N 3.17Å
14	L	29.3	Very low	33	Very low	186 Å²	186	137 Å²	137	97%	0.974	77%	0.771	S	S	*	*			trans	-48.3	95.9	161.4	-78.2	136.4	0	0	0	109.2
15	T	32.3	Very low	32.8	Very low	115 Å²	115	137.7 Å²	137.7	71%	0.706	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-93.9	126.8	167.9	44.8	0	0	0	0	107.2	S13 D17	S13-T15 VanDerWaalsContact C-N 3.33Å; S13-T15 PolarHBondContact O-N 3.17Å; T15-D17 PolarHBondContact O-N 3.07Å
16	T	32	Very low	32.8	Very low	132 Å²	132	139.1 Å²	139.1	81%	0.81	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-50.4	122.5	176.1	35.8	0	0	0	0	110.8
17	D	34.6	Very low	32.4	Very low	102 Å²	102	140.4 Å²	140.4	55%	0.545	76%	0.761	S	S	.	*	P	Polyproline II helix	trans	-63.6	121	178.5	-156.8	-10	0	0	0	109.4	T15 L19 T20	T15-D17 PolarHBondContact O-N 3.07Å; D17-L19 PolarHBondContact O-N 2.8Å; D17-T20 PolarHBondContact O-N 3.03Å; D17-T20 PolarHBondContact O-OG1 2.97Å; D17-T20 VanDerWaalsContact O-OG1 3.11Å
18	P	32.6	Very low	32.1	Very low	103 Å²	103	139.2 Å²	139.2	67%	0.669	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-65.1	-4.7	-174.1	-4.6	10.8	0	0	0	114.6
19	L	35.5	Very low	31.5	Very low	127 Å²	127	139.3 Å²	139.3	67%	0.665	76%	0.762	S	S	*	*	G	3₁₀ helix	trans	-76.3	-17.4	-178.4	-86.2	153.3	0	0	0	114.4	D17 T21	D17-L19 PolarHBondContact O-N 2.8Å; L19-T21 VanDerWaalsContact C-N 3.29Å; L19-T21 PolarHBondContact O-N 2.95Å
20	T	35.5	Very low	31.3	Very low	117 Å²	117	135.8 Å²	135.8	72%	0.718	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-76.5	-10.6	-179.1	42.2	0	0	0	0	114.5	D17	D17-T20 PolarHBondContact O-N 3.03Å; D17-T20 PolarHBondContact O-OG1 2.97Å; D17-T20 VanDerWaalsContact O-OG1 3.11Å
21	T	34.6	Very low	31.3	Very low	127 Å²	127	136.5 Å²	136.5	78%	0.779	76%	0.762	S	S	*	*	G	3₁₀ helix	trans	-95.6	-8.5	-175	-50.1	0	0	0	0	113.6	L19	L19-T21 VanDerWaalsContact C-N 3.29Å; L19-T21 PolarHBondContact O-N 2.95Å
22	L	33	Very low	31.2	Very low	148 Å²	148	138.6 Å²	138.6	78%	0.775	76%	0.763	S	S	*	*	S	Bend	trans	-107.2	5.7	-167.9	-109.3	138.9	0	0	0	116.1
23	M	32.2	Very low	31.1	Very low	133 Å²	133	137 Å²	137	66%	0.655	76%	0.756	S	S	*	*			trans	-135.4	80.9	-176.5	-66.3	-158.5	172	0	0	113.2
24	K	29.2	Very low	31.1	Very low	195 Å²	195	139 Å²	139	85%	0.848	77%	0.77	S	S	*	*			trans	-88.3	119.2	147.6	-77.5	-174.7	176.4	-179.7	0	107.6	D26	K24-D26 PolarHBondContact O-N 2.73Å
25	P	34.3	Very low	31.1	Very low	123 Å²	123	138.1 Å²	138.1	80%	0.799	76%	0.761	S	S	*	*			trans	-89.3	101	176.1	31.9	-26.4	0	0	0	109.7	I27	P25-I27 PolarHBondContact O-N 2.77Å
26	D	30.3	Very low	31	Very low	146 Å²	146	138.9 Å²	138.9	78%	0.781	77%	0.765	S	S	*	*			trans	-84.3	105.1	161.2	-75.3	-33.8	0	0	0	109	K24	K24-D26 PolarHBondContact O-N 2.73Å
27	I	28.8	Very low	31	Very low	146 Å²	146	140.1 Å²	140.1	75%	0.749	77%	0.765	S	S	*	*			trans	32.6	106.8	136.7	-51.4	170	0	0	0	116.4	P25	P25-I27 PolarHBondContact O-N 2.77Å
28	I	28.5	Very low	31	Very low	161 Å²	161	142.4 Å²	142.4	83%	0.826	78%	0.777	S	S	*	*				-151	105.8	127.6	-57.5	-170.4	0	0	0	108.9
29	S	24.2	Very low	31	Very low	102 Å²	102	141.3 Å²	141.3	71%	0.713	79%	0.785	S	S	*	*			trans	-78.1	138.4	152.3	57	0	0	0	0	107.8
30	M	29.2	Very low	30.7	Very low	172 Å²	172	139.5 Å²	139.5	85%	0.847	80%	0.797	S	S	*	*			trans	-169.8	116.2	146.7	-86.3	-137.9	158.9	0	0	112.5
31	S	29.7	Very low	30.6	Very low	106 Å²	106	138 Å²	138	74%	0.741	81%	0.805	S	S	*	*			trans	41.1	123.9	140.5	66.7	0	0	0	0	122.2
32	K	27.6	Very low	30.6	Very low	200 Å²	200	135.7 Å²	135.7	87%	0.87	81%	0.806	S	S	*	*			trans	-50.6	130.4	150.9	-66.8	172.7	175.3	176.5	0	111.2
33	N	29.2	Very low	30.6	Very low	147 Å²	147	136.1 Å²	136.1	79%	0.786	81%	0.809	S	S	*	*			trans	-167.2	104.7	146.5	-105.7	-5.4	0	0	0	109.7
34	S	30.1	Very low	30.8	Very low	131 Å²	131	138 Å²	138	92%	0.916	82%	0.821	S	S	*	*			trans	-103.7	95.3	157.6	-89.6	0	0	0	0	107.1
35	Q	29.6	Very low	31.1	Very low	168 Å²	168	135 Å²	135	79%	0.785	82%	0.819	S	S	*	*			trans	-82.5	133.6	161.7	-91.1	-174	-23.9	0	0	109.4
36	V	29.6	Very low	31.4	Very low	130 Å²	130	135 Å²	135	79%	0.788	82%	0.823	S	S	*	*			trans	-67.7	129.6	167.9	175.2	0	0	0	0	108.6
37	I	33.1	Very low	31.7	Very low	159 Å²	159	133.5 Å²	133.5	82%	0.815	82%	0.823	S	S	*	*			trans	-115.6	111.2	169.4	-61.8	179.4	0	0	0	108.3
38	N	34.4	Very low	32.3	Very low	149 Å²	149	132.6 Å²	132.6	80%	0.797	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-75.8	144.4	162.6	-94.5	-22.2	0	0	0	109.8
39	G	32.5	Very low	32.6	Very low	81 Å²	81	130.4 Å²	130.4	84%	0.835	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-64.3	146.5	-179.6	0	0	0	0	0	114.2
40	G	29.6	Very low	33.3	Very low	88 Å²	88	132.7 Å²	132.7	91%	0.907	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-98.3	172.3	-179.1	0	0	0	0	0	115
41	G	32.2	Very low	33.6	Very low	87 Å²	87	130.9 Å²	130.9	90%	0.897	84%	0.837	S	S	*	*			trans	-166.4	136.7	165.6	0	0	0	0	0	109.8
42	G	35.2	Very low	34	Very low	78 Å²	78	130.9 Å²	130.9	80%	0.804	84%	0.837	S	S	*	*			trans	142.2	102.3	169	0	0	0	0	0	115.2
43	D	32.6	Very low	34.5	Very low	156 Å²	156	129 Å²	129	83%	0.834	84%	0.836	S	S	*	*			trans	-61.7	158.1	175.5	-65.2	-54.4	0	0	0	115.2
44	L	37.4	Very low	34.8	Very low	173 Å²	173	129.6 Å²	129.6	91%	0.906	84%	0.839	S	S	*	*				170	145.9	119.4	-87.3	155.8	0	0	0	113.4
45	T	35.4	Very low	35.3	Very low	131 Å²	131	135.1 Å²	135.1	80%	0.804	84%	0.84	S	S	*	*			trans	-92.9	148.4	-166.3	51.5	0	0	0	0	114.6
46	S	40.4	Very low	35.8	Very low	125 Å²	125	133.7 Å²	133.7	87%	0.874	84%	0.843	S	S	*	*			trans	-162	127.3	144.3	63.5	0	0	0	0	112.9
47	S	36.5	Very low	36.4	Very low	113 Å²	113	134.8 Å²	134.8	79%	0.79	85%	0.845	S	S	*	*			trans	-85.1	147.5	-177.5	49.4	0	0	0	0	114.3
48	S	41.1	Very low	37	Very low	128 Å²	128	132.7 Å²	132.7	90%	0.895	84%	0.841	S	S	*	*			trans	-156.2	123.9	150.7	-64.6	0	0	0	0	110.1
49	S	35.2	Very low	37.5	Very low	114 Å²	114	130.3 Å²	130.3	80%	0.797	84%	0.836	S	S	*	*			trans	-95.9	136.4	-171	27	0	0	0	0	112.3
50	T	37.8	Very low	38.4	Very low	150 Å²	150	134.2 Å²	134.2	92%	0.92	84%	0.836	S	S	*	*			trans	-144.7	119.5	155	-3.4	0	0	0	0	109.7
51	T	36.4	Very low	39.2	Very low	134 Å²	134	136 Å²	136	82%	0.822	83%	0.825	S	S	*	*			trans	-87.4	132.6	-173.6	-12.3	0	0	0	0	110.5
52	S	38.5	Very low	40.3	Very low	106 Å²	106	136.7 Å²	136.7	74%	0.741	82%	0.816	S	S	*	*			trans	177.9	129.5	134.5	40.1	0	0	0	0	113.6
53	L	38.7	Very low	41.7	Very low	161 Å²	161	139.9 Å²	139.9	84%	0.843	81%	0.814	S	S	*	*			trans	79.7	85.8	147.8	-62.6	157.8	0	0	0	119.8
54	N	35.3	Very low	43.5	Very low	160 Å²	160	140.3 Å²	140.3	86%	0.856	82%	0.816	S	S	*	*			trans	18.2	106.4	132.3	-73.8	-12.2	0	0	0	118.6
55	R	40.4	Very low	45.5	Very low	246 Å²	246	135.2 Å²	135.2	93%	0.928	79%	0.792	S	S	*	*			trans	-142.9	120.9	130.2	-92.5	-175.6	-176.6	-170.4	0.2	108.6	N57	R55-N57 PolarHBondContact O-N 3.03Å; R55-N57 VanDerWaalsContact O-N 3.17Å
56	T	39.1	Very low	47.7	Very low	139 Å²	139	131.8 Å²	131.8	85%	0.853	77%	0.774	S	S	*	*			trans	-58.7	107.6	175.9	47.1	0	0	0	0	110.6
57	N	42.4	Very low	49.6	Very low	153 Å²	153	130.1 Å²	130.1	82%	0.818	76%	0.762	S	S	*	*			trans	-95.1	122.9	154.9	-103.3	-11.1	0	0	0	106.9	R55 S59	R55-N57 PolarHBondContact O-N 3.03Å; R55-N57 VanDerWaalsContact O-N 3.17Å; N57-S59 PolarHBondContact O-N 3.24Å; N57-S59 VanDerWaalsContact O-N 3.07Å
58	P	45.8	Very low	51.5	Low	115 Å²	115	129 Å²	129	75%	0.747	74%	0.744	S	S	*	*			trans	-61.2	119.2	171.1	22.7	-23.4	0	0	0	106.8	I60	P58-I60 PolarHBondContact O-N 2.86Å
59	S	46.1	Very low	53.5	Low	98 Å²	98	125.8 Å²	125.8	69%	0.685	72%	0.719	S	S	*	*			trans	-47.1	115.7	169	49.6	0	0	0	0	107.9	N57 N61	N57-S59 PolarHBondContact O-N 3.24Å; N57-S59 VanDerWaalsContact O-N 3.07Å; S59-N61 PolarHBondContact O-N 2.88Å
60	I	50.1	Low	55.6	Low	164 Å²	164	124.5 Å²	124.5	84%	0.841	70%	0.703	S	S	*	*			trans	-56.8	101.6	162.4	-68.2	172.9	0	0	0	104.3	P58 S62	P58-I60 PolarHBondContact O-N 2.86Å; I60-S62 PolarHBondContact O-N 3.21Å
61	N	47.2	Very low	57.4	Low	124 Å²	124	119.8 Å²	119.8	66%	0.663	67%	0.672	S	S	*	*			trans	-48.7	115.7	171.1	-84	-26.3	0	0	0	106	S59 L63	S59-N61 PolarHBondContact O-N 2.88Å; N61-L63 PolarHBondContact O-N 2.96Å
62	S	55.2	Low	59.5	Low	103 Å²	103	118.2 Å²	118.2	72%	0.72	65%	0.654	S	S	*	*			trans	-57.9	90	162.4	52	0	0	0	0	106.1	I60 N64	I60-S62 PolarHBondContact O-N 3.21Å; S62-N64 PolarHBondContact O-N 3.43Å
63	L	63.7	Low	61.6	Low	145 Å²	145	117.4 Å²	117.4	76%	0.759	64%	0.644	S	S	*	*			trans	-55.5	111.3	174.3	-81.9	153.5	0	0	0	105.7	N61 V65	N61-L63 PolarHBondContact O-N 2.96Å; L63-V65 HydrophobicContact CB-CG2 4.02Å; L63-V65 WeakPolarHBondContact O-CG2 3.49Å; L63-V65 PolarHBondContact O-N 2.95Å
64	N	70.7	Confident	63.4	Low	164 Å²	164	116.1 Å²	116.1	88%	0.877	63%	0.632	S	S	*	*			trans	-68.9	80.3	171.5	-82.1	-19.8	0	0	0	107.8	S62	S62-N64 PolarHBondContact O-N 3.43Å
65	V	78.7	Confident	65.2	Low	66 Å²	66	109.9 Å²	109.9	40%	0.4	60%	0.6	S	S	.	*			trans	-74.6	124.8	177.4	-178.2	0	0	0	0	107.9	L63 T69 L70	L63-V65 HydrophobicContact CB-CG2 4.02Å; L63-V65 WeakPolarHBondContact O-CG2 3.49Å; L63-V65 PolarHBondContact O-N 2.95Å; V65-T69 HydrophobicContact CG1-CG2 3.53Å; V65-L70 HydrophobicContact CB-CD2 4.24Å; V65-L70 HydrophobicContact CB-CG 4.32Å; V65-L70 HydrophobicContact CG1-CD2 3.87Å; V65-L70 HydrophobicContact CG1-CG 3.85Å
66	S	83.1	Confident	67.2	Low	60 Å²	60	100.4 Å²	100.4	42%	0.42	57%	0.574	S	S	.	*			trans	-58.8	148.4	177.7	80.4	0	0	0	0	111.4	H68 T69 L70	S66-H68 PolarHBondContact O-N 3.28Å; S66-T69 WeakPolarHBondContact O-CA 3.48Å; S66-T69 WeakPolarHBondContact O-CB 3.49Å; S66-T69 PolarHBondContact O-N 2.94Å; S66-T69 WeakPolarHBondContact OG-CB 3.34Å; S66-T69 PolarHBondContact OG-N 3.46Å; S66-T69 PolarHBondContact OG-OG1 2.99Å; S66-L70 PolarHBondContact O-N 3.29Å
67	S	79	Confident	69.3	Low	90 Å²	90	99.8 Å²	99.8	63%	0.629	56%	0.559	S	S	*	*	H	α-helix	trans	-53.5	-40.5	174.6	54.2	0	0	0	0	112	T69 L70 D71	S67-T69 VanDerWaalsContact C-N 3.35Å; S67-T69 PolarHBondContact O-N 3.32Å; S67-L70 WeakPolarHBondContact O-CB 3.47Å; S67-L70 PolarHBondContact O-N 3.4Å; S67-D71 PolarHBondContact O-N 2.91Å
68	H	76.3	Confident	70.8	Confident	88 Å²	88	95.8 Å²	95.8	41%	0.407	54%	0.54	S	S	.	.	H	α-helix	trans	-60.9	-39	174.3	169.4	-101.7	0	0	0	113.2	S66 K72	S66-H68 PolarHBondContact O-N 3.28Å; H68-K72 WeakPolarHBondContact CE1-CE 3.07Å; H68-K72 PolarHBondContact CE1-NZ 2.91Å; H68-K72 VanDerWaalsContact CE1-NZ 3.32Å; H68-K72 VanDerWaalsContact NE2-CE 3.29Å; H68-K72 WeakPolarHBondContact NE2-CE 3.49Å; H68-K72 WeakPolarHBondContact O-CB 3.48Å; H68-K72 WeakPolarHBondContact O-CG 3.44Å; H68-K72 PolarHBondContact O-N 3.47Å
69	T	84	Confident	72.2	Confident	61 Å²	61	93.2 Å²	93.2	37%	0.374	52%	0.522	S	S	.	.	H	α-helix	trans	-68.7	-41.4	174.4	-56	0	0	0	0	111.1	V65 S66 S67 D71 K72 V73	V65-T69 HydrophobicContact CG1-CG2 3.53Å; S66-T69 WeakPolarHBondContact O-CA 3.48Å; S66-T69 WeakPolarHBondContact O-CB 3.49Å; S66-T69 PolarHBondContact O-N 2.94Å; S66-T69 WeakPolarHBondContact OG-CB 3.34Å; S66-T69 PolarHBondContact OG-N 3.46Å; S66-T69 PolarHBondContact OG-OG1 2.99Å; S67-T69 VanDerWaalsContact C-N 3.35Å; S67-T69 PolarHBondContact O-N 3.32Å; T69-D71 VanDerWaalsContact C-N 3.33Å; T69-D71 PolarHBondContact O-N 3.1Å; T69-K72 WeakPolarHBondContact O-CB 3.5Å; T69-K72 PolarHBondContact O-N 2.97Å; T69-V73 WeakPolarHBondContact O-CG2 3.41Å; T69-V73 PolarHBondContact O-N 3.34Å
70	L	79.1	Confident	74	Confident	87 Å²	87	93.2 Å²	93.2	46%	0.455	51%	0.514	S	S	.	.	H	α-helix	trans	-61	-41.8	175	-69.4	173.4	0	0	0	111.7	V65 S66 S67 V73 K74	V65-L70 HydrophobicContact CB-CD2 4.24Å; V65-L70 HydrophobicContact CB-CG 4.32Å; V65-L70 HydrophobicContact CG1-CD2 3.87Å; V65-L70 HydrophobicContact CG1-CG 3.85Å; S66-L70 PolarHBondContact O-N 3.29Å; S67-L70 WeakPolarHBondContact O-CB 3.47Å; S67-L70 PolarHBondContact O-N 3.4Å; L70-V73 PolarHBondContact O-N 3.35Å; L70-K74 WeakPolarHBondContact O-CG 3.14Å; L70-K74 PolarHBondContact O-N 3.03Å
71	D	75.2	Confident	75.5	Confident	52 Å²	52	90 Å²	90	28%	0.278	50%	0.496	S	S	.	.	H	α-helix	trans	-63.8	-46.1	175.6	-72.4	-17.3	0	0	0	111	S67 T69 V73 K74 V75	S67-D71 PolarHBondContact O-N 2.91Å; T69-D71 VanDerWaalsContact C-N 3.33Å; T69-D71 PolarHBondContact O-N 3.1Å; D71-V73 VanDerWaalsContact C-N 3.3Å; D71-V73 PolarHBondContact O-N 3.43Å; D71-K74 WeakPolarHBondContact O-CB 3.41Å; D71-K74 PolarHBondContact O-N 3.23Å; D71-K74 VanDerWaalsContact O-N 3.1Å; D71-K74 IonicContact OD1-NZ 3.99Å; D71-V75 WeakPolarHBondContact O-CG2 3.47Å; D71-V75 PolarHBondContact O-N 3.34Å
72	K	80.3	Confident	76.7	Confident	100 Å²	100	87.6 Å²	87.6	44%	0.435	48%	0.478	S	S	.	.	H	α-helix	trans	-54.8	-43.1	173.6	-86	-179	173	-172.4	0	112.9	H68 T69 V75 A76 Y481	H68-K72 WeakPolarHBondContact CE1-CE 3.07Å; H68-K72 PolarHBondContact CE1-NZ 2.91Å; H68-K72 VanDerWaalsContact CE1-NZ 3.32Å; H68-K72 VanDerWaalsContact NE2-CE 3.29Å; H68-K72 WeakPolarHBondContact NE2-CE 3.49Å; H68-K72 WeakPolarHBondContact O-CB 3.48Å; H68-K72 WeakPolarHBondContact O-CG 3.44Å; H68-K72 PolarHBondContact O-N 3.47Å; T69-K72 WeakPolarHBondContact O-CB 3.5Å; T69-K72 PolarHBondContact O-N 2.97Å; K72-V75 WeakPolarHBondContact O-CB 3.29Å; K72-V75 PolarHBondContact O-N 2.86Å; K72-A76 WeakPolarHBondContact O-CB 3.41Å; K72-A76 PolarHBondContact O-N 3.19Å; K72-Y481 HydrophobicContact CG-CE1 4.38Å; K72-Y481 WeakPolarHBondContact CG-OH 3.26Å
73	V	83.7	Confident	77.9	Confident	89 Å²	89	89 Å²	89	54%	0.539	47%	0.468	S	S	.	.	H	α-helix	trans	-65.1	-43	176.7	171.4	0	0	0	0	110.9	T69 L70 D71 V75 A76 K77	T69-V73 WeakPolarHBondContact O-CG2 3.41Å; T69-V73 PolarHBondContact O-N 3.34Å; L70-V73 PolarHBondContact O-N 3.35Å; D71-V73 VanDerWaalsContact C-N 3.3Å; D71-V73 PolarHBondContact O-N 3.43Å; V73-V75 VanDerWaalsContact C-N 3.34Å; V73-V75 PolarHBondContact O-N 3.21Å; V73-A76 PolarHBondContact O-N 3.35Å; V73-K77 WeakPolarHBondContact O-CB 3.36Å; V73-K77 PolarHBondContact O-N 3Å
74	K	77	Confident	78.9	Confident	135 Å²	135	87.7 Å²	87.7	59%	0.587	45%	0.454	S	S	*	.	H	α-helix	trans	-59.9	-43.4	174	-70.3	170.9	-175.3	171.1	0	111.6	L70 D71 K77 V78	L70-K74 WeakPolarHBondContact O-CG 3.14Å; L70-K74 PolarHBondContact O-N 3.03Å; D71-K74 WeakPolarHBondContact O-CB 3.41Å; D71-K74 PolarHBondContact O-N 3.23Å; D71-K74 VanDerWaalsContact O-N 3.1Å; D71-K74 IonicContact OD1-NZ 3.99Å; K74-K77 PolarHBondContact O-N 3.31Å; K74-V78 WeakPolarHBondContact O-CG2 3.4Å; K74-V78 PolarHBondContact O-N 2.95Å
75	V	73.2	Confident	79.4	Confident	29 Å²	29	84.7 Å²	84.7	18%	0.176	44%	0.438	C	S	.	.	H	α-helix	trans	-57.9	-52.6	174.1	-173.9	0	0	0	0	110.7	D71 K72 V73 K77 V78 T79 Y481 L485 I488	D71-V75 WeakPolarHBondContact O-CG2 3.47Å; D71-V75 PolarHBondContact O-N 3.34Å; K72-V75 WeakPolarHBondContact O-CB 3.29Å; K72-V75 PolarHBondContact O-N 2.86Å; V73-V75 VanDerWaalsContact C-N 3.34Å; V73-V75 PolarHBondContact O-N 3.21Å; V75-K77 VanDerWaalsContact C-N 3.3Å; V75-K77 PolarHBondContact O-N 3.48Å; V75-V78 PolarHBondContact O-N 3.35Å; V75-T79 WeakPolarHBondContact O-CB 3.36Å; V75-T79 PolarHBondContact O-N 2.9Å; V75-T79 PolarHBondContact O-OG1 3.44Å; V75-Y481 WeakPolarHBondContact CG2-OH 3.44Å; V75-L485 HydrophobicContact CB-CD2 4.24Å; V75-L485 HydrophobicContact CG1-CD2 4.43Å; V75-L485 HydrophobicContact CG2-CD2 2.97Å; V75-L485 HydrophobicContact CG2-CG 4.43Å; V75-I488 HydrophobicContact CG1-CD1 3.9Å
76	A	81.2	Confident	79.2	Confident	47 Å²	47	83.8 Å²	83.8	39%	0.388	43%	0.431	S	S	.	.	H	α-helix	trans	-59.4	-45.4	-175.6	0	0	0	0	0	110.3	K72 V73 T79 L80	K72-A76 WeakPolarHBondContact O-CB 3.41Å; K72-A76 PolarHBondContact O-N 3.19Å; V73-A76 PolarHBondContact O-N 3.35Å; A76-T79 PolarHBondContact O-N 3.47Å; A76-L80 WeakPolarHBondContact O-CB 3.35Å; A76-L80 VanDerWaalsContact O-CG 3.24Å; A76-L80 WeakPolarHBondContact O-CG 3.45Å; A76-L80 PolarHBondContact O-N 3.03Å
77	K	83.2	Confident	79.3	Confident	126 Å²	126	84.3 Å²	84.3	55%	0.548	43%	0.429	S	S	.	.	H	α-helix	trans	-57	-57.8	175.8	-179.6	176.9	174.9	178	0	111.9	V73 K74 V75 T79 L80 E81	V73-K77 WeakPolarHBondContact O-CB 3.36Å; V73-K77 PolarHBondContact O-N 3Å; K74-K77 PolarHBondContact O-N 3.31Å; V75-K77 VanDerWaalsContact C-N 3.3Å; V75-K77 PolarHBondContact O-N 3.48Å; K77-T79 VanDerWaalsContact C-N 3.26Å; K77-T79 PolarHBondContact O-N 2.68Å; K77-L80 PolarHBondContact O-N 3.4Å; K77-E81 WeakPolarHBondContact CE-OE1 2.83Å; K77-E81 IonicContact NZ-OE1 3.88Å; K77-E81 WeakPolarHBondContact O-CG 3.39Å; K77-E81 PolarHBondContact O-N 2.82Å
78	V	74.5	Confident	79.7	Confident	68 Å²	68	83.2 Å²	83.2	41%	0.412	42%	0.415	S	S	.	.	H	α-helix	trans	-61.4	-37	-178.4	173.1	0	0	0	0	111.6	K74 V75 Y82 I488	K74-V78 WeakPolarHBondContact O-CG2 3.4Å; K74-V78 PolarHBondContact O-N 2.95Å; V75-V78 PolarHBondContact O-N 3.35Å; V78-Y82 VanDerWaalsContact O-CB 3.25Å; V78-Y82 WeakPolarHBondContact O-CB 3.43Å; V78-Y82 PolarHBondContact O-N 3.4Å; V78-Y82 VanDerWaalsContact O-N 3.1Å; V78-I488 HydrophobicContact CG1-CG2 4.4Å
79	T	75.1	Confident	79.9	Confident	61 Å²	61	82.1 Å²	82.1	37%	0.374	41%	0.414	S	S	.	.	H	α-helix	trans	-67	-42.2	178.1	-57	0	0	0	0	111.6	V75 A76 K77 Y83	V75-T79 WeakPolarHBondContact O-CB 3.36Å; V75-T79 PolarHBondContact O-N 2.9Å; V75-T79 PolarHBondContact O-OG1 3.44Å; A76-T79 PolarHBondContact O-N 3.47Å; K77-T79 VanDerWaalsContact C-N 3.26Å; K77-T79 PolarHBondContact O-N 2.68Å; T79-Y83 VanDerWaalsContact O-CB 3.27Å; T79-Y83 WeakPolarHBondContact O-CB 3.4Å; T79-Y83 PolarHBondContact O-N 3.32Å
80	L	84.2	Confident	79.8	Confident	98 Å²	98	81.8 Å²	81.8	51%	0.513	41%	0.408	S	S	.	.	H	α-helix	trans	-70	-46.4	179.3	-74.8	170.2	0	0	0	112	A76 K77 Y82 Y83 Y84	A76-L80 WeakPolarHBondContact O-CB 3.35Å; A76-L80 VanDerWaalsContact O-CG 3.24Å; A76-L80 WeakPolarHBondContact O-CG 3.45Å; A76-L80 PolarHBondContact O-N 3.03Å; K77-L80 PolarHBondContact O-N 3.4Å; L80-Y82 VanDerWaalsContact C-N 3.31Å; L80-Y82 PolarHBondContact O-N 3.41Å; L80-Y83 PolarHBondContact O-N 3.38Å; L80-Y84 HydrophobicContact CD2-CE2 4.46Å; L80-Y84 WeakPolarHBondContact O-CD2 3.2Å; L80-Y84 PolarHBondContact O-N 3.28Å
81	E	80.3	Confident	80.2	Confident	97 Å²	97	84.2 Å²	84.2	45%	0.453	41%	0.413	S	S	.	.	H	α-helix	trans	-53.7	-51.8	174.9	-73.4	172.1	172.8	0	0	110	K77 Y83 Y84 D85	K77-E81 WeakPolarHBondContact CE-OE1 2.83Å; K77-E81 IonicContact NZ-OE1 3.88Å; K77-E81 WeakPolarHBondContact O-CG 3.39Å; K77-E81 PolarHBondContact O-N 2.82Å; E81-Y83 PolarHBondContact O-N 3.48Å; E81-Y84 PolarHBondContact O-N 2.8Å; E81-D85 WeakPolarHBondContact O-CB 3.24Å; E81-D85 VanDerWaalsContact O-CG 3.31Å; E81-D85 PolarHBondContact O-N 3.14Å
82	Y	72.9	Confident	80.9	Confident	74 Å²	74	89.4 Å²	89.4	29%	0.29	43%	0.428	S	S	.	.	H	α-helix	trans	-63.1	-39.2	178.1	-177.6	-106.6	0	0	0	113.6	V78 L80 N86 N489	V78-Y82 VanDerWaalsContact O-CB 3.25Å; V78-Y82 WeakPolarHBondContact O-CB 3.43Å; V78-Y82 PolarHBondContact O-N 3.4Å; V78-Y82 VanDerWaalsContact O-N 3.1Å; L80-Y82 VanDerWaalsContact C-N 3.31Å; L80-Y82 PolarHBondContact O-N 3.41Å; Y82-N86 WeakPolarHBondContact CD1-ND2 3.35Å; Y82-N86 WeakPolarHBondContact CE1-ND2 2.9Å; Y82-N86 WeakPolarHBondContact CE2-ND2 3.2Å; Y82-N86 VanDerWaalsContact O-CB 3.27Å; Y82-N86 WeakPolarHBondContact O-CB 3.25Å; Y82-N86 PolarHBondContact O-N 3.47Å; Y82-N86 PolarHBondContact OH-ND2 3.38Å; Y82-N489 HydrophobicContact CD1-CB 4.16Å; Y82-N489 WeakPolarHBondContact CD1-OD1 3.49Å; Y82-N489 HydrophobicContact CD2-CB 4.46Å; Y82-N489 VanDerWaalsContact CD2-ND2 3.32Å; Y82-N489 WeakPolarHBondContact CD2-ND2 3.29Å; Y82-N489 HydrophobicContact CE1-CB 3.65Å; Y82-N489 WeakPolarHBondContact CE1-OD1 3.45Å; Y82-N489 HydrophobicContact CE2-CB 4.03Å; Y82-N489 VanDerWaalsContact CG-CG 3.45Å; Y82-N489 VanDerWaalsContact CG-ND2 3.26Å
83	Y	79.6	Confident	81.1	Confident	133 Å²	133	88.8 Å²	88.8	52%	0.522	43%	0.427	S	S	.	.	H	α-helix	trans	-59.8	-49.8	178.1	174.5	-96.3	0	0	0	111.1	T79 L80 E81 L87	T79-Y83 VanDerWaalsContact O-CB 3.27Å; T79-Y83 WeakPolarHBondContact O-CB 3.4Å; T79-Y83 PolarHBondContact O-N 3.32Å; L80-Y83 PolarHBondContact O-N 3.38Å; E81-Y83 PolarHBondContact O-N 3.48Å; Y83-L87 HydrophobicContact CE1-CD2 4.28Å; Y83-L87 VanDerWaalsContact O-CB 3.3Å; Y83-L87 WeakPolarHBondContact O-CB 3.33Å; Y83-L87 PolarHBondContact O-N 3Å
84	Y	86.7	Confident	81.2	Confident	117 Å²	117	89 Å²	89	46%	0.459	42%	0.418	S	S	.	.	H	α-helix	trans	-71.4	-39	-179.4	-77.3	-71.6	0	0	0	112.5	L80 E81 N86 L87 I88	L80-Y84 HydrophobicContact CD2-CE2 4.46Å; L80-Y84 WeakPolarHBondContact O-CD2 3.2Å; L80-Y84 PolarHBondContact O-N 3.28Å; E81-Y84 PolarHBondContact O-N 2.8Å; Y84-N86 PolarHBondContact O-N 2.78Å; Y84-L87 HydrophobicContact CD1-CD2 4.3Å; Y84-L87 PolarHBondContact O-N 2.94Å; Y84-I88 VanDerWaalsContact O-CG1 3.29Å; Y84-I88 WeakPolarHBondContact O-CG1 3.25Å; Y84-I88 PolarHBondContact O-N 2.93Å
85	D	79.9	Confident	81.9	Confident	100 Å²	100	86 Å²	86	54%	0.535	41%	0.406	S	S	.	.	H	α-helix	trans	-58	-49	174.1	-77.6	-16.2	0	0	0	111.2	E81 L87 I88 V89	E81-D85 WeakPolarHBondContact O-CB 3.24Å; E81-D85 VanDerWaalsContact O-CG 3.31Å; E81-D85 PolarHBondContact O-N 3.14Å; D85-L87 PolarHBondContact O-N 3.04Å; D85-I88 PolarHBondContact O-N 3.37Å; D85-V89 WeakPolarHBondContact O-CG2 3.32Å; D85-V89 PolarHBondContact O-N 3.19Å
86	N	75.6	Confident	82.7	Confident	47 Å²	47	88.8 Å²	88.8	25%	0.251	42%	0.42	S	S	.	.	H	α-helix	trans	-64.1	-38.9	176.1	-86.3	-19	0	0	0	112.8	Y82 Y84 I88 V89 Q90	Y82-N86 WeakPolarHBondContact CD1-ND2 3.35Å; Y82-N86 WeakPolarHBondContact CE1-ND2 2.9Å; Y82-N86 WeakPolarHBondContact CE2-ND2 3.2Å; Y82-N86 VanDerWaalsContact O-CB 3.27Å; Y82-N86 WeakPolarHBondContact O-CB 3.25Å; Y82-N86 PolarHBondContact O-N 3.47Å; Y82-N86 PolarHBondContact OH-ND2 3.38Å; Y84-N86 PolarHBondContact O-N 2.78Å; N86-I88 VanDerWaalsContact C-N 3.28Å; N86-I88 PolarHBondContact O-N 3.4Å; N86-V89 PolarHBondContact O-N 3.46Å; N86-Q90 VanDerWaalsContact O-CB 3.27Å; N86-Q90 WeakPolarHBondContact O-CB 3.27Å; N86-Q90 WeakPolarHBondContact O-CG 3.48Å; N86-Q90 PolarHBondContact O-N 3.45Å
87	L	84.3	Confident	83.1	Confident	72 Å²	72	89.2 Å²	89.2	38%	0.377	41%	0.412	S	S	.	.	H	α-helix	trans	-60.5	-42.5	179.1	-172.6	67.9	0	0	0	110.4	Y83 Y84 D85 Y91	Y83-L87 HydrophobicContact CE1-CD2 4.28Å; Y83-L87 VanDerWaalsContact O-CB 3.3Å; Y83-L87 WeakPolarHBondContact O-CB 3.33Å; Y83-L87 PolarHBondContact O-N 3Å; Y84-L87 HydrophobicContact CD1-CD2 4.3Å; Y84-L87 PolarHBondContact O-N 2.94Å; D85-L87 PolarHBondContact O-N 3.04Å; L87-Y91 WeakPolarHBondContact O-CB 3.3Å; L87-Y91 PolarHBondContact O-N 3.11Å
88	I	87.3	Confident	83.4	Confident	66 Å²	66	87.6 Å²	87.6	34%	0.338	40%	0.403	S	S	.	.	H	α-helix	trans	-66	-46.8	176.6	-65.3	168.6	0	0	0	111	Y84 D85 N86 Q90 Y91 R92	Y84-I88 VanDerWaalsContact O-CG1 3.29Å; Y84-I88 WeakPolarHBondContact O-CG1 3.25Å; Y84-I88 PolarHBondContact O-N 2.93Å; D85-I88 PolarHBondContact O-N 3.37Å; N86-I88 VanDerWaalsContact C-N 3.28Å; N86-I88 PolarHBondContact O-N 3.4Å; I88-Q90 PolarHBondContact O-N 3.03Å; I88-Y91 PolarHBondContact O-N 3.18Å; I88-R92 WeakPolarHBondContact O-CG 3.08Å; I88-R92 PolarHBondContact O-N 3.42Å
89	V	81.7	Confident	84.2	Confident	65 Å²	65	90.6 Å²	90.6	39%	0.394	41%	0.41	S	S	.	.	H	α-helix	trans	-59.6	-47.7	177.3	171.5	0	0	0	0	110.6	D85 N86 Y91 R92 E93	D85-V89 WeakPolarHBondContact O-CG2 3.32Å; D85-V89 PolarHBondContact O-N 3.19Å; N86-V89 PolarHBondContact O-N 3.46Å; V89-Y91 VanDerWaalsContact C-N 3.34Å; V89-Y91 PolarHBondContact O-N 2.94Å; V89-R92 PolarHBondContact O-N 2.75Å; V89-R92 VanDerWaalsContact O-N 3.16Å; V89-E93 HydrophobicContact CG1-CG 4.28Å; V89-E93 WeakPolarHBondContact O-CG 3.15Å; V89-E93 PolarHBondContact O-N 3.35Å
90	Q	81.3	Confident	84.9	Confident	54 Å²	54	92.3 Å²	92.3	25%	0.252	42%	0.416	S	S	.	.	H	α-helix	trans	-62.1	-40.3	179.3	-72.4	175.1	24.6	0	0	112.5	N86 I88 R94	N86-Q90 VanDerWaalsContact O-CB 3.27Å; N86-Q90 WeakPolarHBondContact O-CB 3.27Å; N86-Q90 WeakPolarHBondContact O-CG 3.48Å; N86-Q90 PolarHBondContact O-N 3.45Å; I88-Q90 PolarHBondContact O-N 3.03Å; Q90-R94 VanDerWaalsContact O-CB 3.31Å; Q90-R94 WeakPolarHBondContact O-CB 3.18Å; Q90-R94 PolarHBondContact O-N 3.1Å
91	Y	87.6	Confident	85.2	Confident	138 Å²	138	89 Å²	89	54%	0.541	40%	0.399	S	S	.	.	H	α-helix	trans	-60.9	-48.3	173.9	176.1	-97.8	0	0	0	110.9	L87 I88 V89 E93 R94 Q95	L87-Y91 WeakPolarHBondContact O-CB 3.3Å; L87-Y91 PolarHBondContact O-N 3.11Å; I88-Y91 PolarHBondContact O-N 3.18Å; V89-Y91 VanDerWaalsContact C-N 3.34Å; V89-Y91 PolarHBondContact O-N 2.94Å; Y91-E93 PolarHBondContact O-N 2.91Å; Y91-R94 PolarHBondContact O-N 2.92Å; Y91-Q95 HydrophobicContact CD1-CG 4.33Å; Y91-Q95 HydrophobicContact CE1-CG 3.93Å; Y91-Q95 HydrophobicContact CE2-CG 4.26Å; Y91-Q95 WeakPolarHBondContact O-CG 3.46Å; Y91-Q95 PolarHBondContact O-N 3.34Å
92	R	89.1	Confident	85.8	Confident	161 Å²	161	85.6 Å²	85.6	61%	0.608	38%	0.383	S	S	*	.	H	α-helix	trans	-60.7	-45.6	177.8	-71.4	176.2	-177.3	171.3	2.7	112.2	I88 V89 R94 Q95 N96	I88-R92 WeakPolarHBondContact O-CG 3.08Å; I88-R92 PolarHBondContact O-N 3.42Å; V89-R92 PolarHBondContact O-N 2.75Å; V89-R92 VanDerWaalsContact O-N 3.16Å; R92-R94 VanDerWaalsContact C-N 3.34Å; R92-R94 PolarHBondContact O-N 3.44Å; R92-Q95 PolarHBondContact O-N 3.3Å; R92-N96 WeakPolarHBondContact O-CB 3.36Å; R92-N96 VanDerWaalsContact O-CG 3.28Å; R92-N96 PolarHBondContact O-N 3.28Å
93	E	84.4	Confident	86.6	Confident	87 Å²	87	85.5 Å²	85.5	41%	0.407	39%	0.393	S	S	.	.	H	α-helix	trans	-61.3	-42.1	177.2	-72.5	177.9	175.2	0	0	112.1	V89 Y91 N96 R97	V89-E93 HydrophobicContact CG1-CG 4.28Å; V89-E93 WeakPolarHBondContact O-CG 3.15Å; V89-E93 PolarHBondContact O-N 3.35Å; Y91-E93 PolarHBondContact O-N 2.91Å; E93-N96 PolarHBondContact O-N 3.25Å; E93-R97 WeakPolarHBondContact O-CG 3.07Å; E93-R97 PolarHBondContact O-N 3.22Å; E93-R97 IonicContact OE2-NH1 3.78Å
94	R	86.9	Confident	87.1	Confident	94 Å²	94	84 Å²	84	36%	0.355	39%	0.392	S	S	.	.	H	α-helix	trans	-62.5	-43.5	176.2	179	171	-176.4	-165.8	2.8	111.8	Q90 Y91 R92 N96 R97 Y98 E126	Q90-R94 VanDerWaalsContact O-CB 3.31Å; Q90-R94 WeakPolarHBondContact O-CB 3.18Å; Q90-R94 PolarHBondContact O-N 3.1Å; Y91-R94 PolarHBondContact O-N 2.92Å; R92-R94 VanDerWaalsContact C-N 3.34Å; R92-R94 PolarHBondContact O-N 3.44Å; R94-N96 VanDerWaalsContact C-N 3.34Å; R94-R97 PolarHBondContact O-N 3.4Å; R94-Y98 WeakPolarHBondContact O-CB 3.33Å; R94-Y98 PolarHBondContact O-N 3.16Å; R94-E126 WeakPolarHBondContact CD-OE2 3.48Å; R94-E126 HydrophobicContact CG-CG 4.32Å; R94-E126 WeakPolarHBondContact CG-OE2 3.41Å; R94-E126 IonicContact NE-OE2 3.77Å
95	Q	90.6	Very high	87.4	Confident	71 Å²	71	78.4 Å²	78.4	33%	0.332	37%	0.37	S	S	.	.	H	α-helix	trans	-62.9	-41.4	174.4	-68	-59.2	-36.8	0	0	111.5	Y91 R92 Y98 K99	Y91-Q95 HydrophobicContact CD1-CG 4.33Å; Y91-Q95 HydrophobicContact CE1-CG 3.93Å; Y91-Q95 HydrophobicContact CE2-CG 4.26Å; Y91-Q95 WeakPolarHBondContact O-CG 3.46Å; Y91-Q95 PolarHBondContact O-N 3.34Å; R92-Q95 PolarHBondContact O-N 3.3Å; Q95-Y98 PolarHBondContact O-N 3.35Å; Q95-K99 WeakPolarHBondContact O-CG 3.43Å; Q95-K99 PolarHBondContact O-N 3.14Å
96	N	89.6	Confident	87.8	Confident	88 Å²	88	79.6 Å²	79.6	47%	0.471	37%	0.372	S	S	.	.	H	α-helix	trans	-65.1	-44.4	177.5	-73.7	-10.8	0	0	0	112.1	R92 E93 R94 Y98 K99 I100	R92-N96 WeakPolarHBondContact O-CB 3.36Å; R92-N96 VanDerWaalsContact O-CG 3.28Å; R92-N96 PolarHBondContact O-N 3.28Å; E93-N96 PolarHBondContact O-N 3.25Å; R94-N96 VanDerWaalsContact C-N 3.34Å; N96-Y98 VanDerWaalsContact C-N 3.29Å; N96-Y98 PolarHBondContact O-N 3.03Å; N96-K99 PolarHBondContact O-N 3.24Å; N96-I100 VanDerWaalsContact O-CG1 3.29Å; N96-I100 WeakPolarHBondContact O-CG1 3.47Å; N96-I100 PolarHBondContact O-N 3.39Å
97	R	89.6	Confident	88.6	Confident	56 Å²	56	82.1 Å²	82.1	21%	0.211	39%	0.394	C	S	.	.	H	α-helix	trans	-59.4	-41.8	174.8	-74.7	-171.5	-64.2	-88.5	-1.6	111.8	E93 R94 I100 L101 E126	E93-R97 WeakPolarHBondContact O-CG 3.07Å; E93-R97 PolarHBondContact O-N 3.22Å; E93-R97 IonicContact OE2-NH1 3.78Å; R94-R97 PolarHBondContact O-N 3.4Å; R97-I100 PolarHBondContact O-N 3.41Å; R97-L101 PolarHBondContact O-N 3.42Å; R97-E126 IonicContact CZ-OE1 2.65Å; R97-E126 IonicContact NE-OE1 3.31Å; R97-E126 PolarHBondContact NE-OE1 2.92Å; R97-E126 IonicContact NH2-OE1 3.63Å; R97-E126 PolarHBondContact NH2-OE1 3.16Å; R97-E126 IonicContact NH2-OE2 3.32Å; R97-E126 PolarHBondContact NH2-OE2 2.73Å
98	Y	90.2	Very high	88.9	Confident	92 Å²	92	83.8 Å²	83.8	36%	0.361	40%	0.399	S	S	.	.	H	α-helix	trans	-62.4	-46.1	175.1	-173.1	-106.7	0	0	0	112.2	R94 Q95 N96 I100 L101 E102 R119	R94-Y98 WeakPolarHBondContact O-CB 3.33Å; R94-Y98 PolarHBondContact O-N 3.16Å; Q95-Y98 PolarHBondContact O-N 3.35Å; N96-Y98 VanDerWaalsContact C-N 3.29Å; N96-Y98 PolarHBondContact O-N 3.03Å; Y98-I100 PolarHBondContact O-N 2.89Å; Y98-L101 WeakPolarHBondContact O-CB 3.38Å; Y98-L101 PolarHBondContact O-N 3.49Å; Y98-E102 HydrophobicContact CD1-CG 4.37Å; Y98-E102 HydrophobicContact CE1-CG 3.93Å; Y98-E102 HydrophobicContact CE2-CG 4.48Å; Y98-E102 WeakPolarHBondContact O-CG 3.22Å; Y98-E102 PolarHBondContact O-N 3.08Å; Y98-E102 PolarHBondContact OH-OE1 2.83Å; Y98-R119 HydrophobicContact CE2-CG 4.45Å
99	K	92	Very high	89	Confident	131 Å²	131	83.7 Å²	83.7	57%	0.57	42%	0.415	S	S	*	.	H	α-helix	trans	-60.7	-42	175.7	-72.9	174.8	-178.4	-178.6	0	113.1	Q95 N96 L101 E102 S103	Q95-K99 WeakPolarHBondContact O-CG 3.43Å; Q95-K99 PolarHBondContact O-N 3.14Å; N96-K99 PolarHBondContact O-N 3.24Å; K99-L101 VanDerWaalsContact C-N 3.33Å; K99-E102 PolarHBondContact O-N 3.49Å; K99-S103 WeakPolarHBondContact O-CB 3.47Å; K99-S103 PolarHBondContact O-N 3.27Å
100	I	89.8	Confident	89.5	Confident	97 Å²	97	82.1 Å²	82.1	50%	0.497	40%	0.404	S	S	.	.	H	α-helix	trans	-61.8	-44.7	176.8	-69.7	165.4	0	0	0	110	N96 R97 Y98 S103 M104	N96-I100 VanDerWaalsContact O-CG1 3.29Å; N96-I100 WeakPolarHBondContact O-CG1 3.47Å; N96-I100 PolarHBondContact O-N 3.39Å; R97-I100 PolarHBondContact O-N 3.41Å; Y98-I100 PolarHBondContact O-N 2.89Å; I100-S103 PolarHBondContact O-N 3.17Å; I100-M104 HydrophobicContact CG2-CE 3.65Å; I100-M104 HydrophobicContact CG2-CG 4.37Å; I100-M104 HydrophobicContact CG2-SD 4Å; I100-M104 WeakPolarHBondContact O-CB 3.44Å; I100-M104 VanDerWaalsContact O-CG 3.31Å; I100-M104 WeakPolarHBondContact O-CG 3.48Å; I100-M104 PolarHBondContact O-N 2.68Å
101	L	89.3	Confident	90	Very high	28 Å²	28	83 Å²	83	15%	0.147	41%	0.414	C	S	.	.	H	α-helix	trans	-59	-48.8	176.1	176.5	68.1	0	0	0	111.6	R97 Y98 K99 S103 M104 M105 K118 H122	R97-L101 PolarHBondContact O-N 3.42Å; Y98-L101 WeakPolarHBondContact O-CB 3.38Å; Y98-L101 PolarHBondContact O-N 3.49Å; K99-L101 VanDerWaalsContact C-N 3.33Å; L101-S103 PolarHBondContact O-N 2.83Å; L101-M104 PolarHBondContact O-N 2.69Å; L101-M105 HydrophobicContact CD1-CG 4.22Å; L101-M105 HydrophobicContact CD1-SD 4.25Å; L101-M105 HydrophobicContact CD2-CE 4.49Å; L101-M105 HydrophobicContact CG-CE 4.01Å; L101-M105 HydrophobicContact CG-CG 4.45Å; L101-M105 HydrophobicContact CG-SD 4.17Å; L101-M105 VanDerWaalsContact O-CG 3.24Å; L101-M105 WeakPolarHBondContact O-CG 3.49Å; L101-M105 PolarHBondContact O-N 2.61Å; L101-K118 HydrophobicContact CD1-CB 4.47Å; L101-H122 HydrophobicContact CD2-CB 3.38Å
102	E	92.4	Very high	90.3	Very high	26 Å²	26	81.7 Å²	81.7	12%	0.121	41%	0.413	C	S	.	.	H	α-helix	trans	-57.8	-48.2	177.9	-67.5	-61.6	146	0	0	111.4	Y98 K99 M104 M105 E106 R119	Y98-E102 HydrophobicContact CD1-CG 4.37Å; Y98-E102 HydrophobicContact CE1-CG 3.93Å; Y98-E102 HydrophobicContact CE2-CG 4.48Å; Y98-E102 WeakPolarHBondContact O-CG 3.22Å; Y98-E102 PolarHBondContact O-N 3.08Å; Y98-E102 PolarHBondContact OH-OE1 2.83Å; K99-E102 PolarHBondContact O-N 3.49Å; E102-M104 PolarHBondContact O-N 2.77Å; E102-M105 VanDerWaalsContact CD-CE 3.41Å; E102-M105 HydrophobicContact CG-CE 4.35Å; E102-M105 PolarHBondContact O-N 3.22Å; E102-M105 WeakPolarHBondContact OE1-CE 3.18Å; E102-M105 WeakPolarHBondContact OE2-CE 3.46Å; E102-E106 WeakPolarHBondContact O-CG 3.46Å; E102-E106 PolarHBondContact O-N 3.05Å; E102-R119 WeakPolarHBondContact OE1-CD 3.37Å; E102-R119 VanDerWaalsContact OE1-CG 3.32Å; E102-R119 WeakPolarHBondContact OE1-CG 3.29Å; E102-R119 IonicContact OE1-CZ 3.74Å; E102-R119 IonicContact OE1-NE 2.79Å; E102-R119 PolarHBondContact OE1-NE 3.01Å; E102-R119 IonicContact OE1-NH2 3.75Å; E102-R119 IonicContact OE2-CZ 2.61Å; E102-R119 IonicContact OE2-NE 2.69Å; E102-R119 PolarHBondContact OE2-NE 3.48Å; E102-R119 IonicContact OE2-NH2 2.62Å; E102-R119 PolarHBondContact OE2-NH2 2.9Å
103	S	91.2	Very high	90.4	Very high	72 Å²	72	81.3 Å²	81.3	50%	0.503	42%	0.417	S	S	.	.	H	α-helix	trans	-62.2	-40.3	178.1	-177.8	0	0	0	0	112.9	K99 I100 L101 E106 S107	K99-S103 WeakPolarHBondContact O-CB 3.47Å; K99-S103 PolarHBondContact O-N 3.27Å; I100-S103 PolarHBondContact O-N 3.17Å; L101-S103 PolarHBondContact O-N 2.83Å; S103-E106 PolarHBondContact O-N 2.75Å; S103-S107 WeakPolarHBondContact O-CB 2.88Å; S103-S107 PolarHBondContact O-N 3.13Å; S103-S107 PolarHBondContact O-OG 2.87Å
104	M	89.9	Confident	90.8	Very high	102 Å²	102	81.5 Å²	81.5	50%	0.502	42%	0.419	S	S	.	.	H	α-helix	trans	-62	-45.8	174.4	-75.6	178	174.1	0	0	111.3	I100 L101 E102 E106 S107 E108	I100-M104 HydrophobicContact CG2-CE 3.65Å; I100-M104 HydrophobicContact CG2-CG 4.37Å; I100-M104 HydrophobicContact CG2-SD 4Å; I100-M104 WeakPolarHBondContact O-CB 3.44Å; I100-M104 VanDerWaalsContact O-CG 3.31Å; I100-M104 WeakPolarHBondContact O-CG 3.48Å; I100-M104 PolarHBondContact O-N 2.68Å; L101-M104 PolarHBondContact O-N 2.69Å; E102-M104 PolarHBondContact O-N 2.77Å; M104-E106 VanDerWaalsContact C-N 3.32Å; M104-E106 PolarHBondContact O-N 3.34Å; M104-S107 PolarHBondContact O-N 3Å; M104-S107 PolarHBondContact O-OG 3.21Å; M104-E108 WeakPolarHBondContact O-CG 3.27Å; M104-E108 PolarHBondContact O-N 3.46Å
105	M	92	Very high	91.1	Very high	0 Å²	0	78.4 Å²	78.4	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-64.8	-34.9	178.8	-69.9	-171.8	-54.3	0	0	113.1	L101 E102 G109 L110 K115 K118 R119	L101-M105 HydrophobicContact CD1-CG 4.22Å; L101-M105 HydrophobicContact CD1-SD 4.25Å; L101-M105 HydrophobicContact CD2-CE 4.49Å; L101-M105 HydrophobicContact CG-CE 4.01Å; L101-M105 HydrophobicContact CG-CG 4.45Å; L101-M105 HydrophobicContact CG-SD 4.17Å; L101-M105 VanDerWaalsContact O-CG 3.24Å; L101-M105 WeakPolarHBondContact O-CG 3.49Å; L101-M105 PolarHBondContact O-N 2.61Å; E102-M105 VanDerWaalsContact CD-CE 3.41Å; E102-M105 HydrophobicContact CG-CE 4.35Å; E102-M105 PolarHBondContact O-N 3.22Å; E102-M105 WeakPolarHBondContact OE1-CE 3.18Å; E102-M105 WeakPolarHBondContact OE2-CE 3.46Å; M105-G109 PolarHBondContact O-N 3.12Å; M105-L110 HydrophobicContact CB-CD1 4.06Å; M105-L110 HydrophobicContact CG-CD1 3.89Å; M105-L110 PolarHBondContact O-N 3.4Å; M105-K115 HydrophobicContact CB-CD 4.27Å; M105-K115 HydrophobicContact CB-CG 4.07Å; M105-K115 HydrophobicContact CE-CB 4.2Å; M105-K115 HydrophobicContact CE-CG 4.46Å; M105-K115 HydrophobicContact SD-CB 3.9Å; M105-K115 HydrophobicContact SD-CG 4.1Å; M105-K118 HydrophobicContact CG-CB 4.41Å; M105-K118 HydrophobicContact CG-CD 3.7Å; M105-K118 HydrophobicContact SD-CB 3.42Å; M105-K118 WeakPolarHBondContact SD-CB 3.27Å; M105-K118 HydrophobicContact SD-CD 3.84Å; M105-K118 HydrophobicContact SD-CG 4.23Å; M105-R119 HydrophobicContact CE-CG 3.91Å
106	E	90	Very high	91.2	Very high	124 Å²	124	80 Å²	80	58%	0.579	42%	0.415	S	S	*	.	H	α-helix	trans	-65.7	-46.9	172.3	-73.6	172.3	-179.1	0	0	111.3	E102 S103 M104 E108 G109	E102-E106 WeakPolarHBondContact O-CG 3.46Å; E102-E106 PolarHBondContact O-N 3.05Å; S103-E106 PolarHBondContact O-N 2.75Å; M104-E106 VanDerWaalsContact C-N 3.32Å; M104-E106 PolarHBondContact O-N 3.34Å; E106-E108 VanDerWaalsContact C-N 3.29Å; E106-E108 PolarHBondContact O-N 3.01Å; E106-G109 PolarHBondContact O-N 3.44Å; E106-G109 VanDerWaalsContact O-N 3.07Å
107	S	91	Very high	91.3	Very high	100 Å²	100	80.1 Å²	80.1	70%	0.699	42%	0.415	S	S	*	.	H	α-helix	trans	-65	-30.6	179.7	72.3	0	0	0	0	113.6	S103 M104 G109	S103-S107 WeakPolarHBondContact O-CB 2.88Å; S103-S107 PolarHBondContact O-N 3.13Å; S103-S107 PolarHBondContact O-OG 2.87Å; M104-S107 PolarHBondContact O-N 3Å; M104-S107 PolarHBondContact O-OG 3.21Å; S107-G109 VanDerWaalsContact C-N 3.27Å; S107-G109 PolarHBondContact O-N 3.47Å
108	E	90.9	Very high	91.3	Very high	107 Å²	107	80.4 Å²	80.4	50%	0.5	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-7.6	175.4	-74.4	177.1	-169	0	0	113.1	M104 E106 L110 K118	M104-E108 WeakPolarHBondContact O-CG 3.27Å; M104-E108 PolarHBondContact O-N 3.46Å; E106-E108 VanDerWaalsContact C-N 3.29Å; E106-E108 PolarHBondContact O-N 3.01Å; E108-L110 VanDerWaalsContact C-N 3.27Å; E108-L110 HydrophobicContact CB-CD1 4.5Å; E108-L110 HydrophobicContact CB-CD2 4.01Å; E108-L110 HydrophobicContact CB-CG 3.83Å; E108-L110 PolarHBondContact O-N 2.83Å; E108-L110 WeakPolarHBondContact OE2-CD1 3.1Å; E108-K118 IonicContact OE1-NZ 4Å; E108-K118 PolarHBondContact OE1-NZ 3.07Å; E108-K118 IonicContact OE2-NZ 2.94Å; E108-K118 PolarHBondContact OE2-NZ 2.96Å
109	G	90.3	Very high	91.5	Very high	65 Å²	65	78.4 Å²	78.4	67%	0.67	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	64	29.2	179.9	0	0	0	0	0	114	M105 E106 S107	M105-G109 PolarHBondContact O-N 3.12Å; E106-G109 PolarHBondContact O-N 3.44Å; E106-G109 VanDerWaalsContact O-N 3.07Å; S107-G109 VanDerWaalsContact C-N 3.27Å; S107-G109 PolarHBondContact O-N 3.47Å
110	L	90.8	Very high	91.5	Very high	31 Å²	31	75.4 Å²	75.4	16%	0.162	40%	0.402	C	S	.	.			trans	-65.1	148.3	-175.7	-61.1	-177.5	0	0	0	112.5	M105 E108 Q114 K115 K118	M105-L110 HydrophobicContact CB-CD1 4.06Å; M105-L110 HydrophobicContact CG-CD1 3.89Å; M105-L110 PolarHBondContact O-N 3.4Å; E108-L110 VanDerWaalsContact C-N 3.27Å; E108-L110 HydrophobicContact CB-CD1 4.5Å; E108-L110 HydrophobicContact CB-CD2 4.01Å; E108-L110 HydrophobicContact CB-CG 3.83Å; E108-L110 PolarHBondContact O-N 2.83Å; E108-L110 WeakPolarHBondContact OE2-CD1 3.1Å; L110-Q114 HydrophobicContact CB-CB 3.97Å; L110-Q114 HydrophobicContact CD1-CB 4.41Å; L110-Q114 HydrophobicContact CD2-CB 4.49Å; L110-K115 HydrophobicContact CB-CG 3.95Å; L110-K115 VanDerWaalsContact O-CE 3.28Å; L110-K115 WeakPolarHBondContact O-CE 3.44Å; L110-K118 HydrophobicContact CD1-CD 3.61Å
111	T	92.9	Very high	91.5	Very high	74 Å²	74	75.3 Å²	75.3	45%	0.454	40%	0.399	S	S	.	.			trans	-66.8	154.3	170.7	70.3	0	0	0	0	110.7	E113 Q114 K115	T111-E113 PolarHBondContact O-N 3.43Å; T111-E113 VanDerWaalsContact O-N 3.16Å; T111-Q114 WeakPolarHBondContact O-CB 3.39Å; T111-Q114 PolarHBondContact O-N 2.97Å; T111-Q114 WeakPolarHBondContact OG1-CG 3.35Å; T111-Q114 PolarHBondContact OG1-N 2.84Å; T111-Q114 PolarHBondContact OG1-OE1 3.23Å; T111-K115 WeakPolarHBondContact O-CG 3.35Å; T111-K115 PolarHBondContact O-N 2.63Å
112	E	92.8	Very high	91.4	Very high	110 Å²	110	75.4 Å²	75.4	51%	0.514	40%	0.399	S	S	.	.	H	α-helix	trans	-58.8	-30.2	178.6	-75.9	-54.4	127.5	0	0	113	K115 Q116 R119	E112-K115 PolarHBondContact O-N 3.09Å; E112-K115 WeakPolarHBondContact OE1-CD 3.46Å; E112-K115 WeakPolarHBondContact OE1-CE 3.37Å; E112-K115 IonicContact OE1-NZ 2.67Å; E112-K115 PolarHBondContact OE1-NZ 3.19Å; E112-Q116 WeakPolarHBondContact O-CB 3.48Å; E112-Q116 PolarHBondContact O-N 2.97Å; E112-R119 IonicContact OE2-NH1 2.68Å; E112-R119 PolarHBondContact OE2-NH1 3.45Å; E112-R119 IonicContact OE2-NH2 3.08Å
113	E	92.7	Very high	91.3	Very high	152 Å²	152	76.4 Å²	76.4	71%	0.71	41%	0.412	S	S	*	.	H	α-helix	trans	-63.2	-47.5	172.3	-174.3	178.9	-169.2	0	0	111.6	T111 K115 Q116 I117	T111-E113 PolarHBondContact O-N 3.43Å; T111-E113 VanDerWaalsContact O-N 3.16Å; E113-K115 VanDerWaalsContact C-N 3.33Å; E113-K115 PolarHBondContact O-N 3.12Å; E113-Q116 PolarHBondContact O-N 2.86Å; E113-I117 HydrophobicContact CG-CD1 4.5Å; E113-I117 WeakPolarHBondContact O-CG1 3.49Å; E113-I117 PolarHBondContact O-N 2.59Å
114	Q	92.3	Very high	91.1	Very high	92 Å²	92	77.9 Å²	77.9	43%	0.43	41%	0.413	S	S	.	.	H	α-helix	trans	-62.9	-40.1	175.8	-71	170.6	-26.8	0	0	111.8	L110 T111 I117 K118	L110-Q114 HydrophobicContact CB-CB 3.97Å; L110-Q114 HydrophobicContact CD1-CB 4.41Å; L110-Q114 HydrophobicContact CD2-CB 4.49Å; T111-Q114 WeakPolarHBondContact O-CB 3.39Å; T111-Q114 PolarHBondContact O-N 2.97Å; T111-Q114 WeakPolarHBondContact OG1-CG 3.35Å; T111-Q114 PolarHBondContact OG1-N 2.84Å; T111-Q114 PolarHBondContact OG1-OE1 3.23Å; Q114-I117 PolarHBondContact O-N 3.08Å; Q114-K118 PolarHBondContact O-N 2.91Å; Q114-K118 VanDerWaalsContact O-N 3.09Å
115	K	92.8	Very high	90.8	Very high	28 Å²	28	76.6 Å²	76.6	12%	0.122	41%	0.405	C	S	.	.	H	α-helix	trans	-62.3	-45.2	174.9	-63.3	-167.4	-166.2	160	0	111.3	M105 L110 T111 E112 E113 I117 K118 R119	M105-K115 HydrophobicContact CB-CD 4.27Å; M105-K115 HydrophobicContact CB-CG 4.07Å; M105-K115 HydrophobicContact CE-CB 4.2Å; M105-K115 HydrophobicContact CE-CG 4.46Å; M105-K115 HydrophobicContact SD-CB 3.9Å; M105-K115 HydrophobicContact SD-CG 4.1Å; L110-K115 HydrophobicContact CB-CG 3.95Å; L110-K115 VanDerWaalsContact O-CE 3.28Å; L110-K115 WeakPolarHBondContact O-CE 3.44Å; T111-K115 WeakPolarHBondContact O-CG 3.35Å; T111-K115 PolarHBondContact O-N 2.63Å; E112-K115 PolarHBondContact O-N 3.09Å; E112-K115 WeakPolarHBondContact OE1-CD 3.46Å; E112-K115 WeakPolarHBondContact OE1-CE 3.37Å; E112-K115 IonicContact OE1-NZ 2.67Å; E112-K115 PolarHBondContact OE1-NZ 3.19Å; E113-K115 VanDerWaalsContact C-N 3.33Å; E113-K115 PolarHBondContact O-N 3.12Å; K115-I117 VanDerWaalsContact C-N 3.32Å; K115-I117 PolarHBondContact O-N 3.31Å; K115-K118 PolarHBondContact O-N 2.84Å; K115-K118 VanDerWaalsContact O-N 3.16Å; K115-R119 VanDerWaalsContact O-CG 3.32Å; K115-R119 WeakPolarHBondContact O-CG 3.49Å; K115-R119 PolarHBondContact O-N 3.39Å
116	Q	93	Very high	90.5	Very high	105 Å²	105	76.7 Å²	76.7	49%	0.491	41%	0.406	S	S	.	.	H	α-helix	trans	-62.4	-38.7	179.9	-172	57.9	25.7	0	0	112.4	E112 E113 T120	E112-Q116 WeakPolarHBondContact O-CB 3.48Å; E112-Q116 PolarHBondContact O-N 2.97Å; E113-Q116 PolarHBondContact O-N 2.86Å; Q116-T120 WeakPolarHBondContact O-CB 3.42Å; Q116-T120 PolarHBondContact O-N 3.44Å; Q116-T120 PolarHBondContact O-OG1 3.44Å
117	I	92	Very high	90.3	Very high	90 Å²	90	73.9 Å²	73.9	46%	0.462	40%	0.399	S	S	.	.	H	α-helix	trans	-60.9	-49.4	173	-67.3	166.3	0	0	0	110.4	E113 Q114 K115 T120 Q121	E113-I117 HydrophobicContact CG-CD1 4.5Å; E113-I117 WeakPolarHBondContact O-CG1 3.49Å; E113-I117 PolarHBondContact O-N 2.59Å; Q114-I117 PolarHBondContact O-N 3.08Å; K115-I117 VanDerWaalsContact C-N 3.32Å; K115-I117 PolarHBondContact O-N 3.31Å; I117-T120 PolarHBondContact O-N 3.12Å; I117-Q121 WeakPolarHBondContact O-CG 3.21Å; I117-Q121 PolarHBondContact O-N 3.01Å
118	K	89.8	Confident	89.7	Confident	62 Å²	62	73.7 Å²	73.7	27%	0.27	39%	0.388	S	S	.	.	H	α-helix	trans	-62.6	-42.5	178.7	-80.9	-170.5	174	-166.8	0	112.5	L101 M105 E108 L110 Q114 K115 T120 Q121 H122	L101-K118 HydrophobicContact CD1-CB 4.47Å; M105-K118 HydrophobicContact CG-CB 4.41Å; M105-K118 HydrophobicContact CG-CD 3.7Å; M105-K118 HydrophobicContact SD-CB 3.42Å; M105-K118 WeakPolarHBondContact SD-CB 3.27Å; M105-K118 HydrophobicContact SD-CD 3.84Å; M105-K118 HydrophobicContact SD-CG 4.23Å; E108-K118 IonicContact OE1-NZ 4Å; E108-K118 PolarHBondContact OE1-NZ 3.07Å; E108-K118 IonicContact OE2-NZ 2.94Å; E108-K118 PolarHBondContact OE2-NZ 2.96Å; L110-K118 HydrophobicContact CD1-CD 3.61Å; Q114-K118 PolarHBondContact O-N 2.91Å; Q114-K118 VanDerWaalsContact O-N 3.09Å; K115-K118 PolarHBondContact O-N 2.84Å; K115-K118 VanDerWaalsContact O-N 3.16Å; K118-T120 PolarHBondContact O-N 3.03Å; K118-Q121 PolarHBondContact O-N 3.41Å; K118-H122 WeakPolarHBondContact O-CB 3.24Å; K118-H122 PolarHBondContact O-N 3.24Å
119	R	92.9	Very high	89	Confident	51 Å²	51	69.1 Å²	69.1	19%	0.192	37%	0.366	C	S	.	.	H	α-helix	trans	-58.6	-45.7	174.1	-71.7	172.5	-175.5	141.4	1.3	111.7	Y98 E102 M105 E112 K115 H122 A123	Y98-R119 HydrophobicContact CE2-CG 4.45Å; E102-R119 WeakPolarHBondContact OE1-CD 3.37Å; E102-R119 VanDerWaalsContact OE1-CG 3.32Å; E102-R119 WeakPolarHBondContact OE1-CG 3.29Å; E102-R119 IonicContact OE1-CZ 3.74Å; E102-R119 IonicContact OE1-NE 2.79Å; E102-R119 PolarHBondContact OE1-NE 3.01Å; E102-R119 IonicContact OE1-NH2 3.75Å; E102-R119 IonicContact OE2-CZ 2.61Å; E102-R119 IonicContact OE2-NE 2.69Å; E102-R119 PolarHBondContact OE2-NE 3.48Å; E102-R119 IonicContact OE2-NH2 2.62Å; E102-R119 PolarHBondContact OE2-NH2 2.9Å; M105-R119 HydrophobicContact CE-CG 3.91Å; E112-R119 IonicContact OE2-NH1 2.68Å; E112-R119 PolarHBondContact OE2-NH1 3.45Å; E112-R119 IonicContact OE2-NH2 3.08Å; K115-R119 VanDerWaalsContact O-CG 3.32Å; K115-R119 WeakPolarHBondContact O-CG 3.49Å; K115-R119 PolarHBondContact O-N 3.39Å; R119-H122 PolarHBondContact O-N 3.14Å; R119-A123 WeakPolarHBondContact O-CB 3.36Å; R119-A123 PolarHBondContact O-N 3.15Å
120	T	92.1	Very high	88.5	Confident	68 Å²	68	68.5 Å²	68.5	42%	0.417	35%	0.347	S	S	.	.	H	α-helix	trans	-63.4	-46.1	178.8	-56.1	0	0	0	0	111.1	Q116 I117 K118 H122 A123 L124	Q116-T120 WeakPolarHBondContact O-CB 3.42Å; Q116-T120 PolarHBondContact O-N 3.44Å; Q116-T120 PolarHBondContact O-OG1 3.44Å; I117-T120 PolarHBondContact O-N 3.12Å; K118-T120 PolarHBondContact O-N 3.03Å; T120-H122 VanDerWaalsContact C-N 3.32Å; T120-H122 PolarHBondContact O-N 3.19Å; T120-A123 PolarHBondContact O-N 2.81Å; T120-L124 HydrophobicContact CG2-CD1 4.46Å; T120-L124 WeakPolarHBondContact O-CG 3.42Å; T120-L124 PolarHBondContact O-N 2.81Å
121	Q	89.5	Confident	87.9	Confident	94 Å²	94	75.8 Å²	75.8	44%	0.439	37%	0.372	S	S	.	.	H	α-helix	trans	-59.6	-42.1	174.9	-72.3	177.4	1.3	0	0	111.9	I117 K118 L124 K125	I117-Q121 WeakPolarHBondContact O-CG 3.21Å; I117-Q121 PolarHBondContact O-N 3.01Å; K118-Q121 PolarHBondContact O-N 3.41Å; Q121-L124 PolarHBondContact O-N 2.86Å; Q121-K125 VanDerWaalsContact O-CG 3.32Å; Q121-K125 WeakPolarHBondContact O-CG 3.47Å; Q121-K125 PolarHBondContact O-N 2.76Å
122	H	88.2	Confident	86.9	Confident	30 Å²	30	73.9 Å²	73.9	14%	0.139	36%	0.359	C	S	.	.	H	α-helix	trans	-64.7	-42.6	176	-178.8	-84.7	0	0	0	112.4	L101 K118 R119 T120 L124 K125 E126	L101-H122 HydrophobicContact CD2-CB 3.38Å; K118-H122 WeakPolarHBondContact O-CB 3.24Å; K118-H122 PolarHBondContact O-N 3.24Å; R119-H122 PolarHBondContact O-N 3.14Å; T120-H122 VanDerWaalsContact C-N 3.32Å; T120-H122 PolarHBondContact O-N 3.19Å; H122-L124 VanDerWaalsContact C-N 3.34Å; H122-L124 PolarHBondContact O-N 3.04Å; H122-K125 WeakPolarHBondContact O-CB 3.42Å; H122-K125 PolarHBondContact O-N 2.84Å; H122-E126 IonicContact CE1-OE1 3.73Å; H122-E126 IonicContact NE2-OE1 2.9Å; H122-E126 WeakPolarHBondContact O-CG 3.48Å; H122-E126 PolarHBondContact O-N 3.42Å
123	A	89.3	Confident	86	Confident	47 Å²	47	71.8 Å²	71.8	39%	0.388	35%	0.348	S	S	.	.	H	α-helix	trans	-63.5	-38.4	177.5	0	0	0	0	0	112.6	R119 T120 S127	R119-A123 WeakPolarHBondContact O-CB 3.36Å; R119-A123 PolarHBondContact O-N 3.15Å; T120-A123 PolarHBondContact O-N 2.81Å; A123-S127 WeakPolarHBondContact O-CB 3.49Å; A123-S127 PolarHBondContact O-N 3.29Å; A123-S127 PolarHBondContact O-OG 3.37Å
124	L	88.5	Confident	85.1	Confident	103 Å²	103	72.9 Å²	72.9	54%	0.539	35%	0.346	S	S	.	.	H	α-helix	trans	-61.4	-49.9	172.3	-71.9	171.7	0	0	0	110.8	T120 Q121 H122 E126 S127 E128	T120-L124 HydrophobicContact CG2-CD1 4.46Å; T120-L124 WeakPolarHBondContact O-CG 3.42Å; T120-L124 PolarHBondContact O-N 2.81Å; Q121-L124 PolarHBondContact O-N 2.86Å; H122-L124 VanDerWaalsContact C-N 3.34Å; H122-L124 PolarHBondContact O-N 3.04Å; L124-E126 VanDerWaalsContact C-N 3.34Å; L124-E126 PolarHBondContact O-N 3Å; L124-S127 PolarHBondContact O-N 3.35Å; L124-S127 VanDerWaalsContact O-N 3.09Å; L124-E128 WeakPolarHBondContact O-CG 3.15Å; L124-E128 PolarHBondContact O-N 3.43Å
125	K	84.1	Confident	84.3	Confident	76 Å²	76	71 Å²	71	33%	0.33	35%	0.346	S	S	.	.	H	α-helix	trans	-56.1	-44.5	176.9	-73.5	-178	179.3	-171.6	0	113.2	Q121 H122 F129 W498 T499	Q121-K125 VanDerWaalsContact O-CG 3.32Å; Q121-K125 WeakPolarHBondContact O-CG 3.47Å; Q121-K125 PolarHBondContact O-N 2.76Å; H122-K125 WeakPolarHBondContact O-CB 3.42Å; H122-K125 PolarHBondContact O-N 2.84Å; K125-F129 WeakPolarHBondContact O-CB 3.42Å; K125-F129 PolarHBondContact O-N 3.02Å; K125-W498 HydrophobicContact CB-CH2 4.16Å; K125-W498 HydrophobicContact CB-CZ3 3.69Å; K125-W498 HydrophobicContact CG-CH2 3.87Å; K125-W498 HydrophobicContact CG-CZ3 3.67Å; K125-T499 HydrophobicContact CD-CG2 4.38Å
126	E	84.7	Confident	83.7	Confident	2 Å²	2	80.7 Å²	80.7	1%	0.009	38%	0.382	C	S	.	.	H	α-helix	trans	-64.1	-40.8	176.2	-75.8	-70.2	162.6	0	0	112.1	R94 R97 H122 L124 F129 L130	R94-E126 WeakPolarHBondContact CD-OE2 3.48Å; R94-E126 HydrophobicContact CG-CG 4.32Å; R94-E126 WeakPolarHBondContact CG-OE2 3.41Å; R94-E126 IonicContact NE-OE2 3.77Å; R97-E126 IonicContact CZ-OE1 2.65Å; R97-E126 IonicContact NE-OE1 3.31Å; R97-E126 PolarHBondContact NE-OE1 2.92Å; R97-E126 IonicContact NH2-OE1 3.63Å; R97-E126 PolarHBondContact NH2-OE1 3.16Å; R97-E126 IonicContact NH2-OE2 3.32Å; R97-E126 PolarHBondContact NH2-OE2 2.73Å; H122-E126 IonicContact CE1-OE1 3.73Å; H122-E126 IonicContact NE2-OE1 2.9Å; H122-E126 WeakPolarHBondContact O-CG 3.48Å; H122-E126 PolarHBondContact O-N 3.42Å; L124-E126 VanDerWaalsContact C-N 3.34Å; L124-E126 PolarHBondContact O-N 3Å; E126-F129 PolarHBondContact O-N 3.22Å; E126-L130 WeakPolarHBondContact O-CG 3.46Å; E126-L130 PolarHBondContact O-N 2.93Å
127	S	85	Confident	83.3	Confident	64 Å²	64	76.6 Å²	76.6	45%	0.448	36%	0.363	S	S	.	.	H	α-helix	trans	-67	-42	179.7	-59.6	0	0	0	0	112	A123 L124 L130 R131	A123-S127 WeakPolarHBondContact O-CB 3.49Å; A123-S127 PolarHBondContact O-N 3.29Å; A123-S127 PolarHBondContact O-OG 3.37Å; L124-S127 PolarHBondContact O-N 3.35Å; L124-S127 VanDerWaalsContact O-N 3.09Å; S127-L130 PolarHBondContact O-N 2.74Å; S127-R131 PolarHBondContact O-N 3.27Å
128	E	78.6	Confident	83.2	Confident	97 Å²	97	75 Å²	75	45%	0.453	36%	0.358	S	S	.	.	H	α-helix	trans	-66.3	-41.2	175.5	-71.5	-176.7	123.3	0	0	111.6	L124 L130 R131 L132 W498	L124-E128 WeakPolarHBondContact O-CG 3.15Å; L124-E128 PolarHBondContact O-N 3.43Å; E128-L130 PolarHBondContact O-N 3.45Å; E128-R131 CarbonylContact O-C 3.47Å; E128-R131 WeakPolarHBondContact O-CA 3.41Å; E128-R131 WeakPolarHBondContact O-CB 3.29Å; E128-R131 PolarHBondContact O-N 3.01Å; E128-R131 VanDerWaalsContact O-N 3.12Å; E128-L132 PolarHBondContact O-N 2.92Å; E128-W498 HydrophobicContact CB-CH2 3.79Å; E128-W498 HydrophobicContact CB-CZ2 3.81Å; E128-W498 HydrophobicContact CB-CZ3 4.39Å; E128-W498 HydrophobicContact CG-CH2 4.4Å; E128-W498 HydrophobicContact CG-CZ2 4.34Å; E128-W498 WeakPolarHBondContact OE2-CH2 3.36Å; E128-W498 WeakPolarHBondContact OE2-CZ2 3.48Å
129	F	76.8	Confident	83.2	Confident	11 Å²	11	72.7 Å²	72.7	5%	0.048	35%	0.349	C	S	.	.	H	α-helix	trans	-60.6	-43.1	173.8	177.4	-116	0	0	0	112.8	K125 E126 R131 L132 K133 F495	K125-F129 WeakPolarHBondContact O-CB 3.42Å; K125-F129 PolarHBondContact O-N 3.02Å; E126-F129 PolarHBondContact O-N 3.22Å; F129-R131 VanDerWaalsContact C-N 3.29Å; F129-R131 PolarHBondContact O-N 2.86Å; F129-L132 WeakPolarHBondContact O-CB 3.45Å; F129-L132 PolarHBondContact O-N 3.35Å; F129-K133 HydrophobicContact CD1-CD 4.33Å; F129-K133 HydrophobicContact CE1-CD 3.79Å; F129-K133 VanDerWaalsContact CE1-CE 3.43Å; F129-K133 HydrophobicContact CE1-CG 4.45Å; F129-K133 HydrophobicContact CE2-CD 4.48Å; F129-K133 HydrophobicContact CE2-CG 4.38Å; F129-K133 HydrophobicContact CZ-CD 3.9Å; F129-K133 HydrophobicContact CZ-CG 4.29Å; F129-K133 PolarHBondContact O-N 3.35Å; F129-F495 HydrophobicContact CB-CD2 3.89Å; F129-F495 HydrophobicContact CB-CE2 3.72Å; F129-F495 AromaticContact CD1-CD2 3.57Å; F129-F495 HydrophobicContact CD1-CD2 3.57Å; F129-F495 AromaticContact CD1-CE2 3.93Å; F129-F495 HydrophobicContact CD1-CE2 3.93Å; F129-F495 HydrophobicContact CD2-CB 4.34Å; F129-F495 AromaticContact CD2-CD2 3.47Å; F129-F495 HydrophobicContact CD2-CD2 3.47Å; F129-F495 VanDerWaalsContact CD2-CD2 3.47Å; F129-F495 HydrophobicContact CD2-CE2 4.2Å; F129-F495 HydrophobicContact CD2-CG 4.3Å; F129-F495 AromaticContact CE1-CD2 3.77Å; F129-F495 HydrophobicContact CE1-CD2 3.77Å; F129-F495 VanDerWaalsContact CE2-CA 3.5Å; F129-F495 HydrophobicContact CE2-CB 3.83Å; F129-F495 AromaticContact CE2-CD2 3.71Å; F129-F495 HydrophobicContact CE2-CD2 3.71Å; F129-F495 HydrophobicContact CE2-CG 4.25Å; F129-F495 AromaticContact CG-CD2 3.37Å; F129-F495 HydrophobicContact CG-CD2 3.37Å; F129-F495 AromaticContact CG-CE2 3.71Å; F129-F495 HydrophobicContact CG-CE2 3.71Å; F129-F495 HydrophobicContact CZ-CB 3.97Å; F129-F495 AromaticContact CZ-CD2 3.8Å; F129-F495 HydrophobicContact CZ-CD2 3.8Å; F129-F495 HydrophobicContact CZ-CG 4.41Å
130	L	79.7	Confident	83.2	Confident	52 Å²	52	75.6 Å²	75.6	27%	0.272	37%	0.368	S	S	.	.	H	α-helix	trans	-63.2	-37.1	174.3	-71.6	173.8	0	0	0	111.7	E126 S127 E128 K133 R134	E126-L130 WeakPolarHBondContact O-CG 3.46Å; E126-L130 PolarHBondContact O-N 2.93Å; S127-L130 PolarHBondContact O-N 2.74Å; E128-L130 PolarHBondContact O-N 3.45Å; L130-K133 PolarHBondContact O-N 3.34Å; L130-R134 WeakPolarHBondContact O-CG 3.33Å; L130-R134 PolarHBondContact O-N 3.35Å; L130-R134 VanDerWaalsContact O-N 3.15Å
131	R	78.6	Confident	83.1	Confident	183 Å²	183	75.1 Å²	75.1	69%	0.691	36%	0.363	S	S	*	.	H	α-helix	trans	-63.9	-44	173.5	-173.1	-178.4	-179.8	-177.2	-0.3	111.4	S127 E128 F129 K133 R134 A135	S127-R131 PolarHBondContact O-N 3.27Å; E128-R131 CarbonylContact O-C 3.47Å; E128-R131 WeakPolarHBondContact O-CA 3.41Å; E128-R131 WeakPolarHBondContact O-CB 3.29Å; E128-R131 PolarHBondContact O-N 3.01Å; E128-R131 VanDerWaalsContact O-N 3.12Å; F129-R131 VanDerWaalsContact C-N 3.29Å; F129-R131 PolarHBondContact O-N 2.86Å; R131-K133 VanDerWaalsContact C-N 3.34Å; R131-K133 PolarHBondContact O-N 3.5Å; R131-R134 WeakPolarHBondContact O-CB 3.38Å; R131-R134 PolarHBondContact O-N 2.99Å; R131-R134 VanDerWaalsContact O-N 3.14Å; R131-A135 PolarHBondContact O-N 2.86Å
132	L	72.3	Confident	83.4	Confident	34 Å²	34	70.7 Å²	70.7	18%	0.178	34%	0.342	C	S	.	.	H	α-helix	trans	-62.4	-40.9	177	-176.5	70.4	0	0	0	111.7	E128 F129 R134 A135 K493 W498	E128-L132 PolarHBondContact O-N 2.92Å; F129-L132 WeakPolarHBondContact O-CB 3.45Å; F129-L132 PolarHBondContact O-N 3.35Å; L132-R134 VanDerWaalsContact C-N 3.26Å; L132-R134 PolarHBondContact O-N 3.16Å; L132-A135 PolarHBondContact O-N 3.4Å; L132-K493 HydrophobicContact CG-CD 4.14Å; L132-K493 PolarHBondContact O-NZ 3.48Å; L132-W498 HydrophobicContact CD2-CB 4.49Å
133	K	72.8	Confident	83.7	Confident	66 Å²	66	73.1 Å²	73.1	29%	0.287	36%	0.356	S	S	.	.	H	α-helix	trans	-61.5	-33.8	174.3	-83.5	-172.5	163	175	0	112.9	F129 L130 R131	F129-K133 HydrophobicContact CD1-CD 4.33Å; F129-K133 HydrophobicContact CE1-CD 3.79Å; F129-K133 VanDerWaalsContact CE1-CE 3.43Å; F129-K133 HydrophobicContact CE1-CG 4.45Å; F129-K133 HydrophobicContact CE2-CD 4.48Å; F129-K133 HydrophobicContact CE2-CG 4.38Å; F129-K133 HydrophobicContact CZ-CD 3.9Å; F129-K133 HydrophobicContact CZ-CG 4.29Å; F129-K133 PolarHBondContact O-N 3.35Å; L130-K133 PolarHBondContact O-N 3.34Å; R131-K133 VanDerWaalsContact C-N 3.34Å; R131-K133 PolarHBondContact O-N 3.5Å
134	R	73.7	Confident	84	Confident	176 Å²	176	72.1 Å²	72.1	66%	0.664	35%	0.345	S	S	*	.	H	α-helix	trans	-73.4	-34.9	174.6	-70.1	-173.5	-63.4	-98.4	4.3	112.8	L130 R131 L132 R136	L130-R134 WeakPolarHBondContact O-CG 3.33Å; L130-R134 PolarHBondContact O-N 3.35Å; L130-R134 VanDerWaalsContact O-N 3.15Å; R131-R134 WeakPolarHBondContact O-CB 3.38Å; R131-R134 PolarHBondContact O-N 2.99Å; R131-R134 VanDerWaalsContact O-N 3.14Å; L132-R134 VanDerWaalsContact C-N 3.26Å; L132-R134 PolarHBondContact O-N 3.16Å; R134-R136 PolarHBondContact O-N 3.48Å
135	A	75.6	Confident	84.2	Confident	51 Å²	51	69.9 Å²	69.9	42%	0.421	33%	0.334	S	S	.	.	S	Bend	trans	-63.7	134.5	176	0	0	0	0	0	110.1	R131 L132 K493	R131-A135 PolarHBondContact O-N 2.86Å; L132-A135 PolarHBondContact O-N 3.4Å; A135-K493 WeakPolarHBondContact O-CE 3.37Å; A135-K493 PolarHBondContact O-NZ 3.29Å
136	R	79.7	Confident	84.6	Confident	233 Å²	233	69.1 Å²	69.1	88%	0.879	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-86.9	121.5	173.1	-61.1	-178.1	90.4	-179.7	5.8	107.7	R134	R134-R136 PolarHBondContact O-N 3.48Å
137	L	85	Confident	85	Confident	19 Å²	19	69.3 Å²	69.3	10%	0.099	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-81.9	137.6	175	-164.5	74.2	0	0	0	108.6	D141 F142 Y207 F209	L137-D141 WeakPolarHBondContact CA-OD2 3.31Å; L137-D141 HydrophobicContact CD1-CB 3.79Å; L137-F142 HydrophobicContact CD1-CE2 4.03Å; L137-F142 HydrophobicContact CD1-CZ 4.33Å; L137-F142 HydrophobicContact CD2-CE2 3.78Å; L137-F142 HydrophobicContact CD2-CZ 3.89Å; L137-F142 HydrophobicContact CG-CE2 3.83Å; L137-F142 HydrophobicContact CG-CZ 4.34Å; L137-Y207 HydrophobicContact CD2-CD1 4.13Å; L137-Y207 HydrophobicContact CD2-CD2 4.11Å; L137-Y207 HydrophobicContact CD2-CG 3.67Å; L137-F209 HydrophobicContact CB-CD1 4.47Å; L137-F209 HydrophobicContact CD2-CD1 3.71Å; L137-F209 HydrophobicContact CD2-CE1 3.89Å; L137-F209 HydrophobicContact CG-CD1 4.21Å; L137-F209 HydrophobicContact CG-CE1 4.31Å
138	T	89.6	Confident	85.3	Confident	56 Å²	56	67 Å²	67	34%	0.344	31%	0.314	S	S	.	.			trans	-133.5	171.9	-176.5	65.3	0	0	0	0	109.9	D140 D141 F142	T138-D140 PolarHBondContact O-N 2.97Å; T138-D140 PolarHBondContact OG1-N 2.65Å; T138-D141 PolarHBondContact N-OD2 3.41Å; T138-D141 PolarHBondContact O-N 2.95Å; T138-D141 PolarHBondContact OG1-OD2 3.23Å; T138-D141 VanDerWaalsContact OG1-OD2 3.12Å; T138-F142 WeakPolarHBondContact O-CD2 3.38Å
139	V	91.5	Very high	85.7	Confident	14 Å²	14	63.2 Å²	63.2	9%	0.085	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-63.6	-26.8	173.3	-67.5	0	0	0	0	112.4	D141 F142 F209 Y216 W471	V139-D141 PolarHBondContact O-N 2.83Å; V139-F142 PolarHBondContact O-N 3.22Å; V139-F142 VanDerWaalsContact O-O 3.06Å; V139-F209 HydrophobicContact CG1-CE2 3.9Å; V139-F209 HydrophobicContact CG1-CZ 4.36Å; V139-Y216 HydrophobicContact CG1-CD1 3.98Å; V139-Y216 HydrophobicContact CG1-CD2 4.46Å; V139-Y216 HydrophobicContact CG1-CE1 3.33Å; V139-Y216 HydrophobicContact CG1-CE2 3.9Å; V139-Y216 HydrophobicContact CG1-CG 4.5Å; V139-Y216 WeakPolarHBondContact CG1-OH 3.4Å; V139-W471 HydrophobicContact CB-CD2 3.77Å; V139-W471 HydrophobicContact CB-CE3 4.14Å; V139-W471 HydrophobicContact CB-CG 4.02Å; V139-W471 HydrophobicContact CB-CZ2 4.34Å; V139-W471 HydrophobicContact CG1-CD2 4.21Å; V139-W471 HydrophobicContact CG1-CE3 4.05Å; V139-W471 HydrophobicContact CG1-CZ3 4.3Å; V139-W471 HydrophobicContact CG2-CB 4.29Å; V139-W471 HydrophobicContact CG2-CD2 4.28Å; V139-W471 HydrophobicContact CG2-CG 3.99Å; V139-W471 PolarHBondContact O-NE1 2.94Å
140	D	91.3	Very high	86	Confident	112 Å²	112	66.9 Å²	66.9	60%	0.599	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-68.8	-15.5	179.7	-58.9	-36.6	0	0	0	112.5	T138 F142 Q162	T138-D140 PolarHBondContact O-N 2.97Å; T138-D140 PolarHBondContact OG1-N 2.65Å; D140-F142 PolarHBondContact O-N 3.34Å; D140-Q162 PolarHBondContact O-NE2 3.21Å
141	D	91.5	Very high	85.8	Confident	57 Å²	57	66.6 Å²	66.6	31%	0.305	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-76.4	-4.5	172.4	-61	-70.6	0	0	0	112.6	L137 T138 V139 Q162	L137-D141 WeakPolarHBondContact CA-OD2 3.31Å; L137-D141 HydrophobicContact CD1-CB 3.79Å; T138-D141 PolarHBondContact N-OD2 3.41Å; T138-D141 PolarHBondContact O-N 2.95Å; T138-D141 PolarHBondContact OG1-OD2 3.23Å; T138-D141 VanDerWaalsContact OG1-OD2 3.12Å; V139-D141 PolarHBondContact O-N 2.83Å; D141-Q162 PolarHBondContact O-N 2.97Å
142	F	94.6	Very high	85.3	Confident	1 Å²	1	59.1 Å²	59.1	0%	0.004	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	131.5	-174.2	-61.7	-87.5	0	0	0	112.3	L137 T138 V139 D140 P144 V159 Q160 K161 Y168 M170 Y207 F209 V218 W471	L137-F142 HydrophobicContact CD1-CE2 4.03Å; L137-F142 HydrophobicContact CD1-CZ 4.33Å; L137-F142 HydrophobicContact CD2-CE2 3.78Å; L137-F142 HydrophobicContact CD2-CZ 3.89Å; L137-F142 HydrophobicContact CG-CE2 3.83Å; L137-F142 HydrophobicContact CG-CZ 4.34Å; T138-F142 WeakPolarHBondContact O-CD2 3.38Å; V139-F142 PolarHBondContact O-N 3.22Å; V139-F142 VanDerWaalsContact O-O 3.06Å; D140-F142 PolarHBondContact O-N 3.34Å; F142-P144 WeakPolarHBondContact O-CD 2.91Å; F142-V159 HydrophobicContact CB-CB 4.23Å; F142-V159 HydrophobicContact CB-CG2 4.45Å; F142-V159 HydrophobicContact CD1-CB 4.36Å; F142-V159 HydrophobicContact CD1-CG2 3.74Å; F142-V159 HydrophobicContact CE1-CG2 4.43Å; F142-V159 HydrophobicContact CG-CG2 4.39Å; F142-Q160 CarbonylContact C-O 3.54Å; F142-Q160 WeakPolarHBondContact CA-O 3.4Å; F142-K161 HydrophobicContact CD1-CB 3.96Å; F142-K161 HydrophobicContact CD1-CG 4.16Å; F142-K161 HydrophobicContact CE1-CB 3.85Å; F142-K161 HydrophobicContact CE1-CD 4.21Å; F142-K161 HydrophobicContact CE1-CG 3.8Å; F142-K161 HydrophobicContact CZ-CD 4.49Å; F142-K161 HydrophobicContact CZ-CG 4.3Å; F142-Y168 HydrophobicContact CE1-CD2 4.16Å; F142-M170 HydrophobicContact CB-CE 3.74Å; F142-M170 HydrophobicContact CD1-CE 3.93Å; F142-M170 HydrophobicContact CD2-CE 3.41Å; F142-M170 VanDerWaalsContact CD2-CE 3.41Å; F142-M170 HydrophobicContact CE1-CE 4.39Å; F142-M170 HydrophobicContact CE2-CE 3.92Å; F142-M170 HydrophobicContact CG-CE 3.4Å; F142-M170 VanDerWaalsContact CG-CE 3.4Å; F142-M170 HydrophobicContact CZ-CE 4.38Å; F142-Y207 HydrophobicContact CZ-CD2 4.16Å; F142-F209 HydrophobicContact CD2-CE1 4.44Å; F142-F209 HydrophobicContact CD2-CZ 4.22Å; F142-F209 AromaticContact CE2-CE1 3.77Å; F142-F209 HydrophobicContact CE2-CE1 3.77Å; F142-F209 AromaticContact CE2-CZ 3.99Å; F142-F209 HydrophobicContact CE2-CZ 3.99Å; F142-F209 HydrophobicContact CZ-CE1 4.47Å; F142-V218 HydrophobicContact CE1-CG1 3.95Å; F142-V218 HydrophobicContact CE1-CG2 4.31Å; F142-V218 HydrophobicContact CE2-CG2 4.31Å; F142-V218 HydrophobicContact CZ-CG1 4.18Å; F142-V218 HydrophobicContact CZ-CG2 3.87Å; F142-W471 HydrophobicContact CB-CZ2 4.24Å; F142-W471 PolarHBondContact O-NE1 3.29Å
143	L	94.9	Very high	85.2	Confident	82 Å²	82	58 Å²	58	43%	0.429	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	115.7	169.3	179.4	66.5	0	0	0	109.3	L145 V159 Q160	L143-L145 HydrophobicContact CD2-CD2 3.96Å; L143-L145 HydrophobicContact CG-CD2 4.09Å; L143-L145 PolarHBondContact O-N 2.87Å; L143-V159 CarbonylContact O-C 3.48Å; L143-V159 VanDerWaalsContact O-CA 3.29Å; L143-V159 WeakPolarHBondContact O-CA 2.81Å; L143-Q160 HydrophobicContact CB-CB 4.4Å; L143-Q160 PolarHBondContact N-O 2.96Å; L143-Q160 PolarHBondContact O-N 3.45Å
144	P	94.8	Very high	85.6	Confident	26 Å²	26	55.6 Å²	55.6	17%	0.169	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	124.9	174.7	28.9	-32.3	0	0	0	110.8	F142 L469 W471	F142-P144 WeakPolarHBondContact O-CD 2.91Å; P144-L469 HydrophobicContact CB-CB 4.48Å; P144-L469 HydrophobicContact CG-CB 4.5Å; P144-L469 VanDerWaalsContact CG-O 3.29Å; P144-L469 WeakPolarHBondContact CG-O 3.46Å; P144-W471 HydrophobicContact CB-CH2 4.25Å; P144-W471 HydrophobicContact CB-CZ2 3.96Å; P144-W471 HydrophobicContact CG-CZ2 3.97Å
145	L	93.3	Very high	86.3	Confident	56 Å²	56	49 Å²	49	29%	0.293	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-48.8	-177.4	-59.4	-177.8	0	0	0	112.5	L143 L158 Q160 I167 L469	L143-L145 HydrophobicContact CD2-CD2 3.96Å; L143-L145 HydrophobicContact CG-CD2 4.09Å; L143-L145 PolarHBondContact O-N 2.87Å; L145-L158 HydrophobicContact CB-CB 4.44Å; L145-L158 HydrophobicContact CB-CD2 4.32Å; L145-L158 HydrophobicContact CB-CG 4.43Å; L145-L158 WeakPolarHBondContact CB-O 3.49Å; L145-L158 HydrophobicContact CD1-CD2 4.13Å; L145-L158 HydrophobicContact CD1-CG 4.28Å; L145-L158 PolarHBondContact N-O 3.06Å; L145-Q160 HydrophobicContact CD1-CB 4.09Å; L145-Q160 HydrophobicContact CD2-CB 4.39Å; L145-Q160 HydrophobicContact CG-CB 4.32Å; L145-I167 HydrophobicContact CD1-CD1 3.62Å; L145-L469 WeakPolarHBondContact O-CD1 3.34Å
146	K	93.3	Very high	87.1	Confident	60 Å²	60	48.2 Å²	48.2	26%	0.261	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	150	-175.9	-168	174.3	171.8	-179.5	0	111.2	R157 L158 T458	K146-R157 CarbonylContact O-C 3.59Å; K146-R157 VanDerWaalsContact O-CA 3.28Å; K146-R157 WeakPolarHBondContact O-CA 3.48Å; K146-L158 HydrophobicContact CB-CB 4.46Å; K146-L158 PolarHBondContact N-O 2.9Å; K146-L158 PolarHBondContact O-N 2.84Å; K146-T458 HydrophobicContact CD-CG2 4.13Å; K146-T458 VanDerWaalsContact CD-OG1 3.28Å; K146-T458 WeakPolarHBondContact CD-OG1 3.37Å; K146-T458 PolarHBondContact NZ-OG1 2.7Å
147	I	92.8	Very high	87.8	Confident	5 Å²	5	37.5 Å²	37.5	3%	0.026	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	125.7	165.5	-53.3	-160.3	0	0	0	108.7	G149 K150 E155 R157 F464 A467 L469	I147-G149 WeakPolarHBondContact CG2-O 3.23Å; I147-K150 HydrophobicContact CG2-CG 4.06Å; I147-E155 WeakPolarHBondContact CD1-OE2 3.16Å; I147-E155 HydrophobicContact CG2-CB 4.49Å; I147-R157 HydrophobicContact CG1-CG 4.34Å; I147-F464 HydrophobicContact CB-CB 4.46Å; I147-F464 HydrophobicContact CB-CD2 4.21Å; I147-F464 HydrophobicContact CG2-CD2 3.9Å; I147-F464 HydrophobicContact CG2-CE2 4.3Å; I147-F464 HydrophobicContact CG2-CG 4.26Å; I147-F464 WeakPolarHBondContact O-CD2 3.22Å; I147-A467 HydrophobicContact CD1-CB 3.49Å; I147-A467 VanDerWaalsContact CD1-CB 3.49Å; I147-A467 HydrophobicContact CG1-CB 3.91Å; I147-L469 HydrophobicContact CG1-CD2 3.72Å
148	I	91.4	Very high	88.4	Confident	15 Å²	15	36.8 Å²	36.8	8%	0.077	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	-10	-179.9	60.3	172.8	0	0	0	112.9	V156 L158 A169 F221 T458 F461	I148-V156 HydrophobicContact CD1-CG1 3.86Å; I148-V156 HydrophobicContact CG1-CB 4.08Å; I148-V156 HydrophobicContact CG1-CG1 3.74Å; I148-V156 WeakPolarHBondContact CG1-O 3.15Å; I148-V156 PolarHBondContact N-O 3.06Å; I148-L158 HydrophobicContact CG2-CB 3.93Å; I148-A169 HydrophobicContact CD1-CB 4.12Å; I148-F221 HydrophobicContact CD1-CD2 3.92Å; I148-F221 HydrophobicContact CD1-CE2 3.88Å; I148-T458 HydrophobicContact CG2-CG2 3.68Å; I148-F461 HydrophobicContact CB-CD1 3.89Å; I148-F461 HydrophobicContact CB-CE1 4.26Å; I148-F461 HydrophobicContact CB-CG 4.15Å; I148-F461 HydrophobicContact CD1-CE1 4.31Å; I148-F461 HydrophobicContact CG2-CG 4.45Å; I148-F461 WeakPolarHBondContact O-CD1 3.44Å
149	G	87.3	Confident	88.7	Confident	19 Å²	19	34.1 Å²	34.1	20%	0.196	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	151.5	174	0	0	0	0	0	112.4	I147 E155 V156	I147-G149 WeakPolarHBondContact CG2-O 3.23Å; G149-E155 CarbonylContact O-C 3.54Å; G149-E155 WeakPolarHBondContact O-CA 3.45Å; G149-E155 WeakPolarHBondContact O-CB 3.36Å; G149-V156 PolarHBondContact N-O 3.09Å; G149-V156 PolarHBondContact O-N 3.38Å
150	K	83.4	Confident	88.8	Confident	88 Å²	88	36.6 Å²	36.6	38%	0.383	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	128.7	172.4	-71.8	-171.3	175.1	-176	0	109.4	I147 E155 Y333 F464	I147-K150 HydrophobicContact CG2-CG 4.06Å; K150-E155 HydrophobicContact CG-CB 4.22Å; K150-Y333 HydrophobicContact CB-CD1 3.96Å; K150-Y333 HydrophobicContact CB-CE1 4.12Å; K150-Y333 WeakPolarHBondContact O-CD1 3.49Å; K150-F464 HydrophobicContact CB-CE1 4.1Å; K150-F464 HydrophobicContact CB-CZ 4.38Å; K150-F464 HydrophobicContact CD-CD1 3.82Å; K150-F464 HydrophobicContact CD-CE1 3.93Å; K150-F464 HydrophobicContact CG-CD1 4.11Å; K150-F464 HydrophobicContact CG-CE1 3.85Å; K150-F464 HydrophobicContact CG-CZ 4.24Å
151	G	73.7	Confident	88.9	Confident	46 Å²	46	31.6 Å²	31.6	47%	0.474	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	-178.1	177	0	0	0	0	0	111.8	F153 G154	G151-F153 PolarHBondContact O-N 3.49Å; G151-G154 PolarHBondContact N-O 3.29Å
152	A	68.8	Low	88.9	Confident	25 Å²	25	35 Å²	35	21%	0.207	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-7.6	178.3	0	0	0	0	0	114.5	T335	A152-T335 HydrophobicContact CB-CG2 4.11Å
153	F	69.6	Low	88.4	Confident	10 Å²	10	40.7 Å²	40.7	4%	0.044	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.7	5.6	-169.3	-64.8	-74.7	0	0	0	114.4	G151 L173 H174 D177 M178 K181 L290	G151-F153 PolarHBondContact O-N 3.49Å; F153-L173 HydrophobicContact CB-CD2 4.14Å; F153-L173 WeakPolarHBondContact O-CA 3.38Å; F153-H174 PolarHBondContact O-CD2 2.92Å; F153-H174 PolarHBondContact O-N 3.31Å; F153-D177 HydrophobicContact CD1-CB 3.66Å; F153-D177 HydrophobicContact CE1-CB 4.12Å; F153-M178 HydrophobicContact CB-CE 3.62Å; F153-M178 HydrophobicContact CD1-CE 3.01Å; F153-M178 HydrophobicContact CD2-CE 4.1Å; F153-M178 HydrophobicContact CE1-CE 3.63Å; F153-M178 HydrophobicContact CG-CE 3.28Å; F153-M178 HydrophobicContact CZ-CE 4.46Å; F153-K181 HydrophobicContact CE1-CD 3.48Å; F153-K181 VanDerWaalsContact CE1-CD 3.48Å; F153-K181 VanDerWaalsContact CE1-CE 3.45Å; F153-K181 HydrophobicContact CE1-CG 4.4Å; F153-K181 HydrophobicContact CZ-CD 3.66Å; F153-L290 HydrophobicContact CD2-CD1 3.75Å; F153-L290 HydrophobicContact CE1-CD1 3.93Å; F153-L290 HydrophobicContact CE1-CD2 4.08Å; F153-L290 HydrophobicContact CE2-CB 3.58Å; F153-L290 HydrophobicContact CE2-CD1 3.13Å; F153-L290 HydrophobicContact CE2-CD2 4.16Å; F153-L290 HydrophobicContact CE2-CG 3.79Å; F153-L290 HydrophobicContact CG-CD1 4.42Å; F153-L290 HydrophobicContact CZ-CB 3.66Å; F153-L290 HydrophobicContact CZ-CD1 3.24Å; F153-L290 HydrophobicContact CZ-CD2 3.45Å; F153-L290 VanDerWaalsContact CZ-CD2 3.45Å; F153-L290 HydrophobicContact CZ-CG 3.62Å
154	G	81.7	Confident	87.9	Confident	16 Å²	16	39.8 Å²	39.8	17%	0.165	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	146.1	-150.2	-174.2	0	0	0	0	0	110.1	G151 I172	G151-G154 PolarHBondContact N-O 3.29Å; G154-I172 VanDerWaalsContact CA-O 3.31Å; G154-I172 WeakPolarHBondContact CA-O 3.49Å
155	E	89.3	Confident	87.7	Confident	39 Å²	39	39.9 Å²	39.9	18%	0.182	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	162.9	-164.7	59.9	-173.6	-153.7	0	0	111.6	I147 G149 K150 R157 I172	I147-E155 WeakPolarHBondContact CD1-OE2 3.16Å; I147-E155 HydrophobicContact CG2-CB 4.49Å; G149-E155 CarbonylContact O-C 3.54Å; G149-E155 WeakPolarHBondContact O-CA 3.45Å; G149-E155 WeakPolarHBondContact O-CB 3.36Å; K150-E155 HydrophobicContact CG-CB 4.22Å; E155-R157 IonicContact OE1-CZ 2.96Å; E155-R157 IonicContact OE1-NE 3.82Å; E155-R157 PolarHBondContact OE1-NE 2.71Å; E155-R157 IonicContact OE1-NH2 2.73Å; E155-R157 PolarHBondContact OE1-NH2 3.46Å; E155-I172 HydrophobicContact CG-CD1 4.16Å; E155-I172 PolarHBondContact N-O 3.47Å; E155-I172 PolarHBondContact O-N 3.1Å
156	V	92.3	Very high	87.5	Confident	33 Å²	33	39.6 Å²	39.6	20%	0.2	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	121.8	176	-170.9	0	0	0	0	107.6	I148 G149 A169 M170 K171	I148-V156 HydrophobicContact CD1-CG1 3.86Å; I148-V156 HydrophobicContact CG1-CB 4.08Å; I148-V156 HydrophobicContact CG1-CG1 3.74Å; I148-V156 WeakPolarHBondContact CG1-O 3.15Å; I148-V156 PolarHBondContact N-O 3.06Å; G149-V156 PolarHBondContact N-O 3.09Å; G149-V156 PolarHBondContact O-N 3.38Å; V156-A169 HydrophobicContact CG1-CB 4.19Å; V156-M170 CarbonylContact C-O 3.53Å; V156-M170 WeakPolarHBondContact CA-O 3.4Å; V156-K171 HydrophobicContact CG2-CB 4.21Å; V156-K171 HydrophobicContact CG2-CG 4.16Å
157	R	94.9	Very high	87.6	Confident	9 Å²	9	37.4 Å²	37.4	3%	0.034	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	138	176.8	-59.4	-171.3	-176.2	-177.7	-5.7	110.1	K146 I147 E155 V159 M170 I172 D468 L469 S470	K146-R157 CarbonylContact O-C 3.59Å; K146-R157 VanDerWaalsContact O-CA 3.28Å; K146-R157 WeakPolarHBondContact O-CA 3.48Å; I147-R157 HydrophobicContact CG1-CG 4.34Å; E155-R157 IonicContact OE1-CZ 2.96Å; E155-R157 IonicContact OE1-NE 3.82Å; E155-R157 PolarHBondContact OE1-NE 2.71Å; E155-R157 IonicContact OE1-NH2 2.73Å; E155-R157 PolarHBondContact OE1-NH2 3.46Å; R157-V159 HydrophobicContact CB-CG1 4.01Å; R157-M170 PolarHBondContact N-O 3.25Å; R157-M170 PolarHBondContact O-N 3.4Å; R157-I172 HydrophobicContact CG-CD1 3.99Å; R157-D468 PolarHBondContact NH2-O 3.43Å; R157-L469 PolarHBondContact NH1-O 3.37Å; R157-S470 PolarHBondContact NH1-O 3.14Å; R157-S470 PolarHBondContact NH2-O 2.9Å
158	L	95.8	Very high	87.7	Confident	3 Å²	3	37.2 Å²	37.2	2%	0.016	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	126.6	157.9	-169.8	71.5	0	0	0	107.9	L145 K146 I148 I167 F221 D456 T458	L145-L158 HydrophobicContact CB-CB 4.44Å; L145-L158 HydrophobicContact CB-CD2 4.32Å; L145-L158 HydrophobicContact CB-CG 4.43Å; L145-L158 WeakPolarHBondContact CB-O 3.49Å; L145-L158 HydrophobicContact CD1-CD2 4.13Å; L145-L158 HydrophobicContact CD1-CG 4.28Å; L145-L158 PolarHBondContact N-O 3.06Å; K146-L158 HydrophobicContact CB-CB 4.46Å; K146-L158 PolarHBondContact N-O 2.9Å; K146-L158 PolarHBondContact O-N 2.84Å; I148-L158 HydrophobicContact CG2-CB 3.93Å; L158-I167 HydrophobicContact CD1-CG2 3.33Å; L158-I167 HydrophobicContact CD2-CG2 4.41Å; L158-I167 HydrophobicContact CG-CG2 3.93Å; L158-F221 HydrophobicContact CD1-CB 4.07Å; L158-F221 HydrophobicContact CD1-CD1 3.67Å; L158-F221 HydrophobicContact CD1-CD2 3.45Å; L158-F221 VanDerWaalsContact CD1-CD2 3.45Å; L158-F221 HydrophobicContact CD1-CE1 3.89Å; L158-F221 HydrophobicContact CD1-CE2 3.7Å; L158-F221 HydrophobicContact CD1-CG 3.44Å; L158-F221 VanDerWaalsContact CD1-CG 3.44Å; L158-F221 HydrophobicContact CD1-CZ 3.9Å; L158-D456 HydrophobicContact CD2-CB 4.03Å; L158-T458 HydrophobicContact CD2-CG2 3.79Å
159	V	96.2	Very high	87.8	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	150.8	-178.3	-57.4	0	0	0	0	110.6	F142 L143 R157 I167 Y168 M170 W471	F142-V159 HydrophobicContact CB-CB 4.23Å; F142-V159 HydrophobicContact CB-CG2 4.45Å; F142-V159 HydrophobicContact CD1-CB 4.36Å; F142-V159 HydrophobicContact CD1-CG2 3.74Å; F142-V159 HydrophobicContact CE1-CG2 4.43Å; F142-V159 HydrophobicContact CG-CG2 4.39Å; L143-V159 CarbonylContact O-C 3.48Å; L143-V159 VanDerWaalsContact O-CA 3.29Å; L143-V159 WeakPolarHBondContact O-CA 2.81Å; R157-V159 HydrophobicContact CB-CG1 4.01Å; V159-I167 WeakPolarHBondContact O-CA 2.99Å; V159-Y168 PolarHBondContact N-O 3.46Å; V159-Y168 PolarHBondContact O-N 2.93Å; V159-M170 HydrophobicContact CB-CB 4.48Å; V159-M170 HydrophobicContact CG1-CB 3.71Å; V159-M170 HydrophobicContact CG1-CE 4.26Å; V159-M170 HydrophobicContact CG1-SD 4.4Å; V159-M170 HydrophobicContact CG2-CB 3.87Å; V159-M170 HydrophobicContact CG2-CE 4.2Å; V159-W471 HydrophobicContact CG1-CH2 4.17Å
160	Q	95.2	Very high	88.2	Confident	66 Å²	66	36 Å²	36	31%	0.308	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	127.3	170	-170.6	174.2	34.5	0	0	109.4	F142 L143 L145 G165 Y166 I167	F142-Q160 CarbonylContact C-O 3.54Å; F142-Q160 WeakPolarHBondContact CA-O 3.4Å; L143-Q160 HydrophobicContact CB-CB 4.4Å; L143-Q160 PolarHBondContact N-O 2.96Å; L143-Q160 PolarHBondContact O-N 3.45Å; L145-Q160 HydrophobicContact CD1-CB 4.09Å; L145-Q160 HydrophobicContact CD2-CB 4.39Å; L145-Q160 HydrophobicContact CG-CB 4.32Å; Q160-G165 VanDerWaalsContact CG-C 3.5Å; Q160-G165 VanDerWaalsContact CG-O 3.31Å; Q160-G165 WeakPolarHBondContact CG-O 2.93Å; Q160-G165 PolarHBondContact NE2-O 2.83Å; Q160-Y166 CarbonylContact C-O 3.57Å; Q160-Y166 WeakPolarHBondContact CA-O 3.34Å; Q160-I167 HydrophobicContact CB-CD1 3.89Å; Q160-I167 HydrophobicContact CG-CD1 3.94Å
161	K	93	Very high	88.6	Confident	7 Å²	7	32.4 Å²	32.4	3%	0.03	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	129.9	175.5	-166.7	-176.7	-173.5	-76.3	0	109.5	F142 D163 N164 G165 Y166 Y168 Y207	F142-K161 HydrophobicContact CD1-CB 3.96Å; F142-K161 HydrophobicContact CD1-CG 4.16Å; F142-K161 HydrophobicContact CE1-CB 3.85Å; F142-K161 HydrophobicContact CE1-CD 4.21Å; F142-K161 HydrophobicContact CE1-CG 3.8Å; F142-K161 HydrophobicContact CZ-CD 4.49Å; F142-K161 HydrophobicContact CZ-CG 4.3Å; K161-D163 WeakPolarHBondContact CD-OD1 3.24Å; K161-D163 VanDerWaalsContact CG-OD1 3.26Å; K161-D163 WeakPolarHBondContact CG-OD1 3.48Å; K161-D163 IonicContact NZ-OD1 3.97Å; K161-D163 PolarHBondContact NZ-OD1 3.03Å; K161-D163 IonicContact NZ-OD2 3.02Å; K161-D163 PolarHBondContact NZ-OD2 2.95Å; K161-D163 PolarHBondContact O-N 3.35Å; K161-N164 WeakPolarHBondContact CB-OD1 3.18Å; K161-G165 VanDerWaalsContact O-CA 3.26Å; K161-G165 WeakPolarHBondContact O-CA 3.46Å; K161-G165 PolarHBondContact O-N 3.09Å; K161-Y166 PolarHBondContact N-O 2.92Å; K161-Y168 HydrophobicContact CB-CD2 4.06Å; K161-Y168 HydrophobicContact CB-CE2 3.66Å; K161-Y168 HydrophobicContact CD-CE2 3.99Å; K161-Y168 HydrophobicContact CG-CE2 4.44Å; K161-Y207 HydrophobicContact CD-CE2 4.32Å
162	Q	91	Very high	89.4	Confident	130 Å²	130	30.3 Å²	30.3	61%	0.607	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-31.4	-164.9	-67.7	-167.8	37.7	0	0	114.5	D140 D141	D140-Q162 PolarHBondContact O-NE2 3.21Å; D141-Q162 PolarHBondContact O-N 2.97Å
163	D	84.8	Confident	90.3	Very high	119 Å²	119	29.5 Å²	29.5	64%	0.636	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-29.6	-175.5	65.2	-24.7	0	0	0	114	K161	K161-D163 WeakPolarHBondContact CD-OD1 3.24Å; K161-D163 VanDerWaalsContact CG-OD1 3.26Å; K161-D163 WeakPolarHBondContact CG-OD1 3.48Å; K161-D163 IonicContact NZ-OD1 3.97Å; K161-D163 PolarHBondContact NZ-OD1 3.03Å; K161-D163 IonicContact NZ-OD2 3.02Å; K161-D163 PolarHBondContact NZ-OD2 2.95Å; K161-D163 PolarHBondContact O-N 3.35Å
164	N	84.6	Confident	91.1	Very high	64 Å²	64	32.3 Å²	32.3	34%	0.342	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.4	-5.5	-176.7	70.5	2.8	0	0	0	114.4	K161 Y166	K161-N164 WeakPolarHBondContact CB-OD1 3.18Å; N164-Y166 PolarHBondContact O-N 3.47Å; N164-Y166 VanDerWaalsContact OD1-CB 3.25Å; N164-Y166 WeakPolarHBondContact OD1-CB 3.34Å; N164-Y166 PolarHBondContact OD1-N 2.97Å
165	G	89	Confident	91.2	Very high	28 Å²	28	31.5 Å²	31.5	29%	0.289	16%	0.162	S	C	.	.			trans	71.1	10.1	179.2	0	0	0	0	0	114.8	Q160 K161	Q160-G165 VanDerWaalsContact CG-C 3.5Å; Q160-G165 VanDerWaalsContact CG-O 3.31Å; Q160-G165 WeakPolarHBondContact CG-O 2.93Å; Q160-G165 PolarHBondContact NE2-O 2.83Å; K161-G165 VanDerWaalsContact O-CA 3.26Å; K161-G165 WeakPolarHBondContact O-CA 3.46Å; K161-G165 PolarHBondContact O-N 3.09Å
166	Y	90.3	Very high	90.9	Very high	50 Å²	50	31.9 Å²	31.9	20%	0.196	17%	0.172	C	C	.	.			trans	-78	142.5	-174.3	-154.5	-83.2	0	0	0	111.9	Q160 K161 N164 Y168 N501 L505	Q160-Y166 CarbonylContact C-O 3.57Å; Q160-Y166 WeakPolarHBondContact CA-O 3.34Å; K161-Y166 PolarHBondContact N-O 2.92Å; N164-Y166 PolarHBondContact O-N 3.47Å; N164-Y166 VanDerWaalsContact OD1-CB 3.25Å; N164-Y166 WeakPolarHBondContact OD1-CB 3.34Å; N164-Y166 PolarHBondContact OD1-N 2.97Å; Y166-Y168 HydrophobicContact CD1-CD1 4.22Å; Y166-Y168 HydrophobicContact CD1-CD2 4.33Å; Y166-Y168 AromaticContact CD1-CE1 3.68Å; Y166-Y168 HydrophobicContact CD1-CE1 3.68Å; Y166-Y168 AromaticContact CD1-CE2 3.82Å; Y166-Y168 HydrophobicContact CD1-CE2 3.82Å; Y166-Y168 AromaticContact CD1-CZ 3.47Å; Y166-Y168 VanDerWaalsContact CD1-CZ 3.47Å; Y166-Y168 HydrophobicContact CE1-CE1 4.16Å; Y166-Y168 HydrophobicContact CG-CE2 4.18Å; Y166-Y168 AromaticContact CG-CZ 3.98Å; Y166-Y168 WeakPolarHBondContact O-CD2 3.47Å; Y166-N501 HydrophobicContact CE2-CB 3.67Å; Y166-N501 PolarHBondContact OH-ND2 3.4Å; Y166-N501 VanDerWaalsContact OH-ND2 3.12Å; Y166-L505 HydrophobicContact CD2-CD1 4.13Å; Y166-L505 HydrophobicContact CE2-CD1 3.12Å; Y166-L505 HydrophobicContact CE2-CG 4.38Å; Y166-L505 WeakPolarHBondContact OH-CD1 3.44Å
167	I	94.3	Very high	90.4	Very high	14 Å²	14	32.4 Å²	32.4	7%	0.072	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	133	-177.7	-57.4	-62.7	0	0	0	110.9	L145 L158 V159 Q160 F221 I455 D456	L145-I167 HydrophobicContact CD1-CD1 3.62Å; L158-I167 HydrophobicContact CD1-CG2 3.33Å; L158-I167 HydrophobicContact CD2-CG2 4.41Å; L158-I167 HydrophobicContact CG-CG2 3.93Å; V159-I167 WeakPolarHBondContact O-CA 2.99Å; Q160-I167 HydrophobicContact CB-CD1 3.89Å; Q160-I167 HydrophobicContact CG-CD1 3.94Å; I167-F221 HydrophobicContact CG2-CB 4.22Å; I167-F221 HydrophobicContact CG2-CD1 4.04Å; I167-F221 HydrophobicContact CG2-CG 4.33Å; I167-I455 HydrophobicContact CG1-CD1 4Å; I167-I455 HydrophobicContact CG1-CG1 4.26Å; I167-D456 HydrophobicContact CD1-CB 4.31Å; I167-D456 HydrophobicContact CG1-CB 4.36Å
168	Y	94.9	Very high	89.6	Confident	1 Å²	1	32.1 Å²	32.1	0%	0.004	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	159.2	178.7	-60.1	-80.8	0	0	0	111.3	F142 V159 K161 Y166 F206 Y207 V218 M219	F142-Y168 HydrophobicContact CE1-CD2 4.16Å; V159-Y168 PolarHBondContact N-O 3.46Å; V159-Y168 PolarHBondContact O-N 2.93Å; K161-Y168 HydrophobicContact CB-CD2 4.06Å; K161-Y168 HydrophobicContact CB-CE2 3.66Å; K161-Y168 HydrophobicContact CD-CE2 3.99Å; K161-Y168 HydrophobicContact CG-CE2 4.44Å; Y166-Y168 HydrophobicContact CD1-CD1 4.22Å; Y166-Y168 HydrophobicContact CD1-CD2 4.33Å; Y166-Y168 AromaticContact CD1-CE1 3.68Å; Y166-Y168 HydrophobicContact CD1-CE1 3.68Å; Y166-Y168 AromaticContact CD1-CE2 3.82Å; Y166-Y168 HydrophobicContact CD1-CE2 3.82Å; Y166-Y168 AromaticContact CD1-CZ 3.47Å; Y166-Y168 VanDerWaalsContact CD1-CZ 3.47Å; Y166-Y168 HydrophobicContact CE1-CE1 4.16Å; Y166-Y168 HydrophobicContact CG-CE2 4.18Å; Y166-Y168 AromaticContact CG-CZ 3.98Å; Y166-Y168 WeakPolarHBondContact O-CD2 3.47Å; Y168-F206 AromaticContact CD1-CD2 3.59Å; Y168-F206 HydrophobicContact CD1-CD2 3.59Å; Y168-F206 AromaticContact CD1-CE2 3.97Å; Y168-F206 HydrophobicContact CD1-CE2 3.97Å; Y168-F206 HydrophobicContact CD1-CG 4.38Å; Y168-F206 HydrophobicContact CE1-CB 4.33Å; Y168-F206 AromaticContact CE1-CD2 3.41Å; Y168-F206 HydrophobicContact CE1-CD2 3.41Å; Y168-F206 VanDerWaalsContact CE1-CD2 3.41Å; Y168-F206 AromaticContact CE1-CE2 3.74Å; Y168-F206 HydrophobicContact CE1-CE2 3.74Å; Y168-F206 AromaticContact CE1-CG 3.86Å; Y168-F206 HydrophobicContact CE1-CG 3.86Å; Y168-F206 HydrophobicContact CE1-CZ 4.44Å; Y168-Y207 HydrophobicContact CE1-CE2 4.38Å; Y168-V218 HydrophobicContact CD1-CG1 3.89Å; Y168-V218 HydrophobicContact CD2-CG1 4.2Å; Y168-V218 HydrophobicContact CG-CG1 3.6Å; Y168-M219 WeakPolarHBondContact CA-O 3.1Å; Y168-M219 WeakPolarHBondContact CB-O 3.41Å
169	A	95	Very high	88.8	Confident	8 Å²	8	34.9 Å²	34.9	7%	0.066	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	119.8	162.7	0	0	0	0	0	108.9	I148 V156 M219 F221	I148-A169 HydrophobicContact CD1-CB 4.12Å; V156-A169 HydrophobicContact CG1-CB 4.19Å; A169-M219 PolarHBondContact N-O 3.06Å; A169-M219 PolarHBondContact O-N 3.27Å; A169-F221 HydrophobicContact CB-CB 4.47Å
170	M	94.5	Very high	87.9	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	113	176.1	-174.6	-175.2	-69.6	0	0	110.2	F142 V156 R157 V159 I172 F209 Y216 L217 V218 W471	F142-M170 HydrophobicContact CB-CE 3.74Å; F142-M170 HydrophobicContact CD1-CE 3.93Å; F142-M170 HydrophobicContact CD2-CE 3.41Å; F142-M170 VanDerWaalsContact CD2-CE 3.41Å; F142-M170 HydrophobicContact CE1-CE 4.39Å; F142-M170 HydrophobicContact CE2-CE 3.92Å; F142-M170 HydrophobicContact CG-CE 3.4Å; F142-M170 VanDerWaalsContact CG-CE 3.4Å; F142-M170 HydrophobicContact CZ-CE 4.38Å; V156-M170 CarbonylContact C-O 3.53Å; V156-M170 WeakPolarHBondContact CA-O 3.4Å; R157-M170 PolarHBondContact N-O 3.25Å; R157-M170 PolarHBondContact O-N 3.4Å; V159-M170 HydrophobicContact CB-CB 4.48Å; V159-M170 HydrophobicContact CG1-CB 3.71Å; V159-M170 HydrophobicContact CG1-CE 4.26Å; V159-M170 HydrophobicContact CG1-SD 4.4Å; V159-M170 HydrophobicContact CG2-CB 3.87Å; V159-M170 HydrophobicContact CG2-CE 4.2Å; M170-I172 HydrophobicContact CG-CG1 4.33Å; M170-I172 HydrophobicContact SD-CG1 4.44Å; M170-F209 HydrophobicContact CE-CE1 4.27Å; M170-F209 HydrophobicContact CE-CZ 3.86Å; M170-F209 HydrophobicContact SD-CZ 4.4Å; M170-Y216 HydrophobicContact CG-CD1 4.27Å; M170-Y216 HydrophobicContact SD-CD1 3.62Å; M170-Y216 HydrophobicContact SD-CE1 4.25Å; M170-L217 CarbonylContact C-O 3.51Å; M170-L217 VanDerWaalsContact CA-O 3.31Å; M170-L217 WeakPolarHBondContact CA-O 3.5Å; M170-V218 HydrophobicContact CE-CG2 4.03Å; M170-V218 HydrophobicContact CG-CG2 4.33Å; M170-W471 HydrophobicContact CE-CH2 4.08Å; M170-W471 HydrophobicContact SD-CH2 3.45Å; M170-W471 WeakPolarHBondContact SD-CH2 3Å; M170-W471 HydrophobicContact SD-CZ2 4.45Å; M170-W471 HydrophobicContact SD-CZ3 3.84Å
171	K	91.5	Very high	86.8	Confident	12 Å²	12	42.1 Å²	42.1	5%	0.052	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	124.9	171.8	-177.8	172.9	175.9	-172.6	0	109.3	V156 L173 E190 Y216 L217 M219 D283	V156-K171 HydrophobicContact CG2-CB 4.21Å; V156-K171 HydrophobicContact CG2-CG 4.16Å; K171-L173 HydrophobicContact CG-CD2 4.29Å; K171-L173 HydrophobicContact CG-CG 4.37Å; K171-E190 IonicContact NZ-OE1 2.78Å; K171-E190 PolarHBondContact NZ-OE1 3.04Å; K171-E190 IonicContact NZ-OE2 3.45Å; K171-E190 PolarHBondContact NZ-OE2 3.41Å; K171-Y216 WeakPolarHBondContact O-CA 3.35Å; K171-L217 HydrophobicContact CB-CB 4.27Å; K171-L217 HydrophobicContact CD-CD1 4.32Å; K171-L217 PolarHBondContact N-O 3.29Å; K171-L217 PolarHBondContact O-N 3.08Å; K171-M219 HydrophobicContact CB-CE 3.76Å; K171-M219 HydrophobicContact CD-CE 4.29Å; K171-D283 IonicContact NZ-OD1 2.66Å; K171-D283 PolarHBondContact NZ-OD1 3.21Å; K171-D283 IonicContact NZ-OD2 3.35Å
172	I	91.5	Very high	85.8	Confident	3 Å²	3	48 Å²	48	2%	0.015	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	125.2	-177.4	-49.9	170.8	0	0	0	107.3	G154 E155 R157 M170 N214 L215 Y216 W471	G154-I172 VanDerWaalsContact CA-O 3.31Å; G154-I172 WeakPolarHBondContact CA-O 3.49Å; E155-I172 HydrophobicContact CG-CD1 4.16Å; E155-I172 PolarHBondContact N-O 3.47Å; E155-I172 PolarHBondContact O-N 3.1Å; R157-I172 HydrophobicContact CG-CD1 3.99Å; M170-I172 HydrophobicContact CG-CG1 4.33Å; M170-I172 HydrophobicContact SD-CG1 4.44Å; I172-N214 HydrophobicContact CG2-CB 3.99Å; I172-L215 WeakPolarHBondContact CA-O 3.21Å; I172-Y216 HydrophobicContact CB-CE1 4.5Å; I172-Y216 HydrophobicContact CG1-CD1 4.07Å; I172-Y216 HydrophobicContact CG1-CE1 4.08Å; I172-Y216 HydrophobicContact CG2-CD1 4.3Å; I172-Y216 HydrophobicContact CG2-CE1 3.86Å; I172-W471 HydrophobicContact CD1-CZ3 3.74Å
173	L	87.1	Confident	85	Confident	8 Å²	8	42.4 Å²	42.4	4%	0.042	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	129.2	-178.9	-58.8	168.8	0	0	0	110.4	F153 K171 K175 N214 L215 L217 L286	F153-L173 HydrophobicContact CB-CD2 4.14Å; F153-L173 WeakPolarHBondContact O-CA 3.38Å; K171-L173 HydrophobicContact CG-CD2 4.29Å; K171-L173 HydrophobicContact CG-CG 4.37Å; L173-K175 PolarHBondContact O-N 2.8Å; L173-N214 CarbonylContact O-C 3.53Å; L173-N214 VanDerWaalsContact O-CA 3.24Å; L173-N214 WeakPolarHBondContact O-CA 3.14Å; L173-L215 HydrophobicContact CB-CB 4.23Å; L173-L215 PolarHBondContact N-O 2.81Å; L173-L215 PolarHBondContact O-N 3.37Å; L173-L217 HydrophobicContact CD1-CD1 4.46Å; L173-L286 HydrophobicContact CD1-CD1 3.55Å
174	H	85.8	Confident	84.6	Confident	68 Å²	68	37.7 Å²	37.7	32%	0.315	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	121.4	178.5	-62.2	-52.6	0	0	0	111.6	F153 A176 D177 M178 N214	F153-H174 PolarHBondContact O-CD2 2.92Å; F153-H174 PolarHBondContact O-N 3.31Å; H174-A176 VanDerWaalsContact C-N 3.26Å; H174-A176 PolarHBondContact O-N 2.85Å; H174-D177 HydrophobicContact CB-CB 4.36Å; H174-D177 IonicContact CD2-OD2 3.25Å; H174-D177 IonicContact CG-OD2 3.6Å; H174-D177 PolarHBondContact O-N 3.17Å; H174-M178 WeakPolarHBondContact O-CG 3.33Å; H174-M178 PolarHBondContact O-N 2.82Å; H174-N214 PolarHBondContact ND1-OD1 3.27Å
175	K	84.9	Confident	83.9	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-59.2	-37.1	179.8	-73.4	-179.7	167.3	-176.4	0	112.6	L173 M178 L179 Q210 D211 V213 N214 L215 N484 F487	L173-K175 PolarHBondContact O-N 2.8Å; K175-M178 PolarHBondContact O-N 3.17Å; K175-L179 WeakPolarHBondContact O-CG 2.99Å; K175-L179 PolarHBondContact O-N 2.83Å; K175-Q210 VanDerWaalsContact CE-OE1 3.32Å; K175-D211 WeakPolarHBondContact CE-O 3.28Å; K175-D211 PolarHBondContact NZ-O 2.83Å; K175-V213 VanDerWaalsContact CB-O 3.22Å; K175-V213 WeakPolarHBondContact CB-O 3.19Å; K175-V213 WeakPolarHBondContact CG-O 3.1Å; K175-V213 PolarHBondContact N-O 3.23Å; K175-N214 WeakPolarHBondContact CE-O 3.49Å; K175-L215 HydrophobicContact CD-CD2 4.35Å; K175-L215 HydrophobicContact CG-CD2 4Å; K175-L215 HydrophobicContact CG-CG 3.9Å; K175-N484 PolarHBondContact NZ-OD1 3.4Å; K175-F487 HydrophobicContact CB-CD2 4.43Å; K175-F487 HydrophobicContact CB-CE2 3.81Å; K175-F487 HydrophobicContact CB-CZ 4.49Å; K175-F487 HydrophobicContact CD-CD2 3.92Å; K175-F487 HydrophobicContact CD-CE2 4.15Å; K175-F487 HydrophobicContact CG-CD2 3.88Å; K175-F487 HydrophobicContact CG-CE2 3.71Å; K175-F487 HydrophobicContact CG-CZ 4.45Å
176	A	83.6	Confident	83	Confident	46 Å²	46	38.3 Å²	38.3	38%	0.38	21%	0.206	S	C	.	.	H	α-helix	trans	-60.7	-46.1	-179.8	0	0	0	0	0	111.3	H174 M178 L179 Q180	H174-A176 VanDerWaalsContact C-N 3.26Å; H174-A176 PolarHBondContact O-N 2.85Å; A176-M178 PolarHBondContact O-N 3.23Å; A176-L179 PolarHBondContact O-N 2.84Å; A176-Q180 WeakPolarHBondContact O-CB 3.31Å; A176-Q180 PolarHBondContact O-N 2.81Å
177	D	80.1	Confident	82.2	Confident	45 Å²	45	36.1 Å²	36.1	24%	0.241	20%	0.198	C	C	.	.	H	α-helix	trans	-69.2	-35.2	-179.5	-60.6	-26.6	0	0	0	112	F153 H174 K181	F153-D177 HydrophobicContact CD1-CB 3.66Å; F153-D177 HydrophobicContact CE1-CB 4.12Å; H174-D177 HydrophobicContact CB-CB 4.36Å; H174-D177 IonicContact CD2-OD2 3.25Å; H174-D177 IonicContact CG-OD2 3.6Å; H174-D177 PolarHBondContact O-N 3.17Å; D177-K181 WeakPolarHBondContact O-CB 3.31Å; D177-K181 WeakPolarHBondContact O-CG 3.45Å; D177-K181 PolarHBondContact O-N 2.68Å
178	M	79.4	Confident	81.2	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-64.2	-41.2	174.9	-66.8	-62.5	93.7	0	0	112.4	F153 H174 K175 A176 D182 Q183 V187 L286 L290 F487	F153-M178 HydrophobicContact CB-CE 3.62Å; F153-M178 HydrophobicContact CD1-CE 3.01Å; F153-M178 HydrophobicContact CD2-CE 4.1Å; F153-M178 HydrophobicContact CE1-CE 3.63Å; F153-M178 HydrophobicContact CG-CE 3.28Å; F153-M178 HydrophobicContact CZ-CE 4.46Å; H174-M178 WeakPolarHBondContact O-CG 3.33Å; H174-M178 PolarHBondContact O-N 2.82Å; K175-M178 PolarHBondContact O-N 3.17Å; A176-M178 PolarHBondContact O-N 3.23Å; M178-D182 PolarHBondContact O-N 2.89Å; M178-Q183 HydrophobicContact CB-CB 4.49Å; M178-Q183 HydrophobicContact CE-CB 4.35Å; M178-Q183 PolarHBondContact O-N 2.78Å; M178-Q183 HydrophobicContact SD-CB 3.83Å; M178-V187 HydrophobicContact CG-CG2 4.02Å; M178-V187 HydrophobicContact SD-CG2 3.51Å; M178-V187 VanDerWaalsContact SD-CG2 3.51Å; M178-L286 HydrophobicContact SD-CD2 4.39Å; M178-L290 HydrophobicContact CE-CD1 4.34Å; M178-F487 HydrophobicContact CB-CE1 4.25Å; M178-F487 HydrophobicContact CB-CZ 3.79Å
179	L	78.6	Confident	80	Confident	61 Å²	61	41.8 Å²	41.8	32%	0.319	23%	0.225	S	C	.	.	H	α-helix	trans	-71.8	-48.1	177.9	-72.9	165.5	0	0	0	111.6	K175 A176 K181 D182 V184 K483 A486 F487	K175-L179 WeakPolarHBondContact O-CG 2.99Å; K175-L179 PolarHBondContact O-N 2.83Å; A176-L179 PolarHBondContact O-N 2.84Å; L179-K181 PolarHBondContact O-N 2.61Å; L179-K181 VanDerWaalsContact O-N 3.16Å; L179-D182 PolarHBondContact O-N 2.62Å; L179-D182 VanDerWaalsContact O-N 3.16Å; L179-V184 HydrophobicContact CD2-CG2 3.89Å; L179-K483 HydrophobicContact CD1-CB 3.77Å; L179-K483 HydrophobicContact CD1-CD 4.29Å; L179-K483 HydrophobicContact CD1-CG 3.59Å; L179-A486 HydrophobicContact CD2-CB 3.57Å; L179-F487 HydrophobicContact CD1-CE2 4.2Å; L179-F487 HydrophobicContact CD2-CE2 4.33Å; L179-F487 HydrophobicContact CD2-CZ 4.38Å; L179-F487 HydrophobicContact CG-CE2 4.04Å; L179-F487 HydrophobicContact CG-CZ 4.13Å
180	Q	77.2	Confident	79	Confident	158 Å²	158	41.5 Å²	41.5	74%	0.738	22%	0.223	S	C	*	.	H	α-helix	trans	-59.8	-29.6	-177.9	-171.9	-178.6	11.5	0	0	112.2	A176	A176-Q180 WeakPolarHBondContact O-CB 3.31Å; A176-Q180 PolarHBondContact O-N 2.81Å
181	K	71	Confident	78.1	Confident	60 Å²	60	42.9 Å²	42.9	26%	0.261	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	11.8	-178.3	-56.2	-167.1	-154.2	166	0	114.3	F153 D177 L179 Q183 L290	F153-K181 HydrophobicContact CE1-CD 3.48Å; F153-K181 VanDerWaalsContact CE1-CD 3.48Å; F153-K181 VanDerWaalsContact CE1-CE 3.45Å; F153-K181 HydrophobicContact CE1-CG 4.4Å; F153-K181 HydrophobicContact CZ-CD 3.66Å; D177-K181 WeakPolarHBondContact O-CB 3.31Å; D177-K181 WeakPolarHBondContact O-CG 3.45Å; D177-K181 PolarHBondContact O-N 2.68Å; L179-K181 PolarHBondContact O-N 2.61Å; L179-K181 VanDerWaalsContact O-N 3.16Å; K181-Q183 HydrophobicContact CB-CG 4.01Å; K181-Q183 WeakPolarHBondContact O-CG 3.35Å; K181-Q183 PolarHBondContact O-NE2 2.69Å; K181-L290 HydrophobicContact CB-CD2 3.61Å; K181-L290 HydrophobicContact CD-CD2 3.75Å; K181-L290 HydrophobicContact CG-CD2 4.32Å
182	D	73.6	Confident	77.2	Confident	132 Å²	132	44.7 Å²	44.7	71%	0.706	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.7	49.6	178.6	-163.1	26	0	0	0	114.3	M178 L179	M178-D182 PolarHBondContact O-N 2.89Å; L179-D182 PolarHBondContact O-N 2.62Å; L179-D182 VanDerWaalsContact O-N 3.16Å
183	Q	74.3	Confident	76.3	Confident	11 Å²	11	44.9 Å²	44.9	5%	0.051	24%	0.239	C	C	.	.			trans	-106.9	5.4	-172.9	-62.6	-57.2	-48.2	0	0	114.8	M178 K181 A185 H186 V187 L290	M178-Q183 HydrophobicContact CB-CB 4.49Å; M178-Q183 HydrophobicContact CE-CB 4.35Å; M178-Q183 PolarHBondContact O-N 2.78Å; M178-Q183 HydrophobicContact SD-CB 3.83Å; K181-Q183 HydrophobicContact CB-CG 4.01Å; K181-Q183 WeakPolarHBondContact O-CG 3.35Å; K181-Q183 PolarHBondContact O-NE2 2.69Å; Q183-A185 PolarHBondContact O-N 3.47Å; Q183-H186 PolarHBondContact O-N 2.85Å; Q183-H186 PolarHBondContact OE1-ND1 3.43Å; Q183-V187 WeakPolarHBondContact O-CG2 3.4Å; Q183-V187 PolarHBondContact O-N 2.87Å; Q183-L290 HydrophobicContact CB-CD1 4.39Å; Q183-L290 HydrophobicContact CG-CD1 3.52Å; Q183-L290 HydrophobicContact CG-CD2 3.26Å; Q183-L290 HydrophobicContact CG-CG 3.66Å
184	V	74.9	Confident	75.7	Confident	20 Å²	20	44.8 Å²	44.8	12%	0.121	24%	0.238	C	C	.	.	H	α-helix	trans	-58	-38.9	-177.4	-179	0	0	0	0	111.1	L179 V187 R188 A486 F487	L179-V184 HydrophobicContact CD2-CG2 3.89Å; V184-V187 PolarHBondContact O-N 3.44Å; V184-R188 WeakPolarHBondContact O-CG 3.38Å; V184-R188 PolarHBondContact O-N 2.85Å; V184-R188 VanDerWaalsContact O-N 3.09Å; V184-A486 HydrophobicContact CG1-CB 3.92Å; V184-A486 WeakPolarHBondContact CG1-O 3.35Å; V184-A486 HydrophobicContact CG2-CB 3.81Å; V184-F487 HydrophobicContact CB-CE1 4.39Å; V184-F487 HydrophobicContact CG1-CD1 4.39Å; V184-F487 HydrophobicContact CG1-CE1 4.19Å; V184-F487 HydrophobicContact CG2-CE1 3.95Å; V184-F487 HydrophobicContact CG2-CZ 3.99Å
185	A	69.6	Low	75.1	Confident	70 Å²	70	43.7 Å²	43.7	58%	0.579	24%	0.236	S	C	*	.	H	α-helix	trans	-63.8	-42.7	176.5	0	0	0	0	0	112.2	Q183 R188 A189	Q183-A185 PolarHBondContact O-N 3.47Å; A185-R188 PolarHBondContact O-N 2.88Å; A185-A189 PolarHBondContact O-N 3.47Å
186	H	70.9	Confident	74.2	Confident	36 Å²	36	50.6 Å²	50.6	17%	0.167	27%	0.266	C	S	.	.	H	α-helix	trans	-66.3	-39.8	177.4	-62.4	101.1	0	0	0	111.8	Q183 R188 A189 E190 G285 L286	Q183-H186 PolarHBondContact O-N 2.85Å; Q183-H186 PolarHBondContact OE1-ND1 3.43Å; H186-R188 VanDerWaalsContact C-N 3.3Å; H186-R188 PolarHBondContact O-N 3.47Å; H186-A189 PolarHBondContact O-N 3.25Å; H186-E190 PolarHBondContact O-N 3.26Å; H186-G285 PolarHBondContact CD2-O 3.18Å; H186-G285 VanDerWaalsContact CD2-O 3.22Å; H186-L286 VanDerWaalsContact C-CD2 3.48Å; H186-L286 HydrophobicContact CB-CD2 3.84Å
187	V	73.7	Confident	72.9	Confident	3 Å²	3	49 Å²	49	2%	0.018	25%	0.253	C	S	.	.	H	α-helix	trans	-58.7	-44.3	174.9	173.5	0	0	0	0	110.9	M178 Q183 V184 R191 L215 L286 F487 Y490	M178-V187 HydrophobicContact CG-CG2 4.02Å; M178-V187 HydrophobicContact SD-CG2 3.51Å; M178-V187 VanDerWaalsContact SD-CG2 3.51Å; Q183-V187 WeakPolarHBondContact O-CG2 3.4Å; Q183-V187 PolarHBondContact O-N 2.87Å; V184-V187 PolarHBondContact O-N 3.44Å; V187-R191 WeakPolarHBondContact O-CB 3.29Å; V187-R191 PolarHBondContact O-N 2.93Å; V187-R191 VanDerWaalsContact O-N 3.09Å; V187-L215 HydrophobicContact CG1-CD1 3.67Å; V187-L215 HydrophobicContact CG2-CD1 4.29Å; V187-L286 HydrophobicContact CB-CD2 3.95Å; V187-L286 HydrophobicContact CG2-CD2 3.43Å; V187-L286 VanDerWaalsContact CG2-CD2 3.43Å; V187-F487 HydrophobicContact CG1-CD1 4.47Å; V187-F487 HydrophobicContact CG2-CE1 4.43Å; V187-Y490 HydrophobicContact CG1-CD2 3.81Å; V187-Y490 HydrophobicContact CG1-CE2 3.42Å; V187-Y490 VanDerWaalsContact CG1-CE2 3.42Å
188	R	73.1	Confident	72.6	Confident	104 Å²	104	53 Å²	53	39%	0.392	28%	0.275	S	S	.	.	H	α-helix	trans	-65.9	-41.4	177.7	-70.4	173.3	-179.7	-169	-0.5	111.4	V184 A185 H186 R191 D192 A486	V184-R188 WeakPolarHBondContact O-CG 3.38Å; V184-R188 PolarHBondContact O-N 2.85Å; V184-R188 VanDerWaalsContact O-N 3.09Å; A185-R188 PolarHBondContact O-N 2.88Å; H186-R188 VanDerWaalsContact C-N 3.3Å; H186-R188 PolarHBondContact O-N 3.47Å; R188-R191 PolarHBondContact O-N 3.31Å; R188-D192 WeakPolarHBondContact O-CB 3.46Å; R188-D192 PolarHBondContact O-N 2.86Å; R188-A486 PolarHBondContact NE-O 3.04Å; R188-A486 PolarHBondContact NH2-O 3.34Å
189	A	70.1	Confident	72.8	Confident	31 Å²	31	53.9 Å²	53.9	26%	0.256	28%	0.279	S	S	.	.	H	α-helix	trans	-63.9	-45.9	177.1	0	0	0	0	0	112.4	A185 H186 R191 D192 I193	A185-A189 PolarHBondContact O-N 3.47Å; H186-A189 PolarHBondContact O-N 3.25Å; A189-R191 PolarHBondContact O-N 3.37Å; A189-D192 PolarHBondContact O-N 3.23Å; A189-D192 VanDerWaalsContact O-N 3.17Å; A189-I193 VanDerWaalsContact O-CG1 3.31Å; A189-I193 WeakPolarHBondContact O-CG1 3.46Å; A189-I193 PolarHBondContact O-N 2.92Å
190	E	73.8	Confident	73.4	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.009	29%	0.285	C	S	.	.	H	α-helix	trans	-58.2	-49.7	176	180	164	141.1	0	0	110.6	K171 H186 D192 I193 L194 L217 F284 L286	K171-E190 IonicContact NZ-OE1 2.78Å; K171-E190 PolarHBondContact NZ-OE1 3.04Å; K171-E190 IonicContact NZ-OE2 3.45Å; K171-E190 PolarHBondContact NZ-OE2 3.41Å; H186-E190 PolarHBondContact O-N 3.26Å; E190-D192 VanDerWaalsContact C-N 3.32Å; E190-D192 PolarHBondContact O-N 3.4Å; E190-I193 PolarHBondContact O-N 3.13Å; E190-L194 HydrophobicContact CG-CD1 3.72Å; E190-L194 HydrophobicContact CG-CG 4.38Å; E190-L194 WeakPolarHBondContact O-CB 3.41Å; E190-L194 WeakPolarHBondContact O-CG 3.26Å; E190-L194 PolarHBondContact O-N 3.12Å; E190-L217 HydrophobicContact CG-CD1 4.48Å; E190-L217 WeakPolarHBondContact OE1-CD1 3.39Å; E190-F284 HydrophobicContact CB-CB 4.47Å; E190-F284 WeakPolarHBondContact CB-O 3.44Å; E190-F284 HydrophobicContact CG-CB 4.34Å; E190-L286 HydrophobicContact CB-CD1 4.28Å; E190-L286 HydrophobicContact CB-CG 3.98Å; E190-L286 HydrophobicContact CG-CD1 4.33Å; E190-L286 HydrophobicContact CG-CG 4.42Å; E190-L286 WeakPolarHBondContact OE2-CB 3.32Å; E190-L286 WeakPolarHBondContact OE2-CD1 3.5Å; E190-L286 WeakPolarHBondContact OE2-CG 3.2Å
191	R	74.8	Confident	74.1	Confident	29 Å²	29	48.3 Å²	48.3	11%	0.109	26%	0.256	C	S	.	.	H	α-helix	trans	-55.6	-47.8	174.8	-174.8	-152.1	66.3	-169.5	-5.9	110.9	V187 R188 A189 I193 L194 V195 M205 N489	V187-R191 WeakPolarHBondContact O-CB 3.29Å; V187-R191 PolarHBondContact O-N 2.93Å; V187-R191 VanDerWaalsContact O-N 3.09Å; R188-R191 PolarHBondContact O-N 3.31Å; A189-R191 PolarHBondContact O-N 3.37Å; R191-I193 PolarHBondContact O-N 3.4Å; R191-L194 PolarHBondContact O-N 2.77Å; R191-V195 HydrophobicContact CG-CG2 4.18Å; R191-V195 WeakPolarHBondContact O-CB 3.41Å; R191-V195 VanDerWaalsContact O-CG2 3.23Å; R191-V195 WeakPolarHBondContact O-CG2 3.45Å; R191-V195 PolarHBondContact O-N 2.99Å; R191-M205 HydrophobicContact CG-CE 4.26Å; R191-N489 PolarHBondContact NH1-O 3.44Å
192	D	73.8	Confident	75.1	Confident	49 Å²	49	45.5 Å²	45.5	26%	0.262	24%	0.244	S	C	.	.	H	α-helix	trans	-66	-37.6	-175.8	-73.3	-10	0	0	0	113.2	R188 A189 E190 K196	R188-D192 WeakPolarHBondContact O-CB 3.46Å; R188-D192 PolarHBondContact O-N 2.86Å; A189-D192 PolarHBondContact O-N 3.23Å; A189-D192 VanDerWaalsContact O-N 3.17Å; E190-D192 VanDerWaalsContact C-N 3.32Å; E190-D192 PolarHBondContact O-N 3.4Å; D192-K196 VanDerWaalsContact O-CB 3.31Å; D192-K196 WeakPolarHBondContact O-CB 3.12Å; D192-K196 VanDerWaalsContact O-CG 3.27Å; D192-K196 WeakPolarHBondContact O-CG 2.93Å; D192-K196 PolarHBondContact O-N 2.94Å; D192-K196 VanDerWaalsContact O-N 3.07Å
193	I	71.9	Confident	76	Confident	7 Å²	7	39.4 Å²	39.4	4%	0.036	21%	0.211	C	C	.	.	H	α-helix	trans	-61.4	-52.1	172.6	-67.5	164.3	0	0	0	109.4	A189 E190 R191 V195 K196 A197 F261 F284	A189-I193 VanDerWaalsContact O-CG1 3.31Å; A189-I193 WeakPolarHBondContact O-CG1 3.46Å; A189-I193 PolarHBondContact O-N 2.92Å; E190-I193 PolarHBondContact O-N 3.13Å; R191-I193 PolarHBondContact O-N 3.4Å; I193-V195 VanDerWaalsContact C-N 3.3Å; I193-V195 PolarHBondContact O-N 2.76Å; I193-K196 PolarHBondContact O-N 3.37Å; I193-A197 WeakPolarHBondContact O-CB 3.27Å; I193-A197 PolarHBondContact O-N 3.47Å; I193-A197 VanDerWaalsContact O-N 3.14Å; I193-F261 HydrophobicContact CD1-CB 3.94Å; I193-F261 HydrophobicContact CD1-CD1 3.44Å; I193-F261 VanDerWaalsContact CD1-CD1 3.44Å; I193-F261 HydrophobicContact CD1-CD2 4.28Å; I193-F261 HydrophobicContact CD1-CE1 3.92Å; I193-F261 HydrophobicContact CD1-CG 3.63Å; I193-F261 HydrophobicContact CG1-CB 4.24Å; I193-F261 HydrophobicContact CG1-CD1 3.32Å; I193-F261 HydrophobicContact CG1-CD2 3.63Å; I193-F261 HydrophobicContact CG1-CE1 3.34Å; I193-F261 HydrophobicContact CG1-CE2 3.66Å; I193-F261 HydrophobicContact CG1-CG 3.45Å; I193-F261 VanDerWaalsContact CG1-CG 3.45Å; I193-F261 HydrophobicContact CG1-CZ 3.5Å; I193-F284 HydrophobicContact CB-CD2 4.5Å; I193-F284 HydrophobicContact CB-CG 4.38Å; I193-F284 HydrophobicContact CD1-CB 3.57Å; I193-F284 HydrophobicContact CD1-CD1 4.1Å; I193-F284 HydrophobicContact CD1-CG 3.88Å; I193-F284 HydrophobicContact CG2-CD1 4Å; I193-F284 HydrophobicContact CG2-CD2 3.97Å; I193-F284 HydrophobicContact CG2-CE1 4.18Å; I193-F284 HydrophobicContact CG2-CE2 4.17Å; I193-F284 HydrophobicContact CG2-CG 3.91Å; I193-F284 HydrophobicContact CG2-CZ 4.29Å
194	L	75.7	Confident	76.6	Confident	6 Å²	6	41.1 Å²	41.1	3%	0.031	22%	0.219	C	C	.	.	H	α-helix	trans	-65.5	-30.4	-176.5	-71.3	175.2	0	0	0	113.2	E190 R191 V202 V203 M205 M219 F284	E190-L194 HydrophobicContact CG-CD1 3.72Å; E190-L194 HydrophobicContact CG-CG 4.38Å; E190-L194 WeakPolarHBondContact O-CB 3.41Å; E190-L194 WeakPolarHBondContact O-CG 3.26Å; E190-L194 PolarHBondContact O-N 3.12Å; R191-L194 PolarHBondContact O-N 2.77Å; L194-V202 HydrophobicContact CD2-CG1 3.89Å; L194-V203 WeakPolarHBondContact CD2-O 3.26Å; L194-M205 HydrophobicContact CB-CB 3.68Å; L194-M205 HydrophobicContact CB-CE 3.91Å; L194-M205 HydrophobicContact CB-CG 4.41Å; L194-M205 HydrophobicContact CB-SD 3.96Å; L194-M205 HydrophobicContact CD1-CB 4.27Å; L194-M205 HydrophobicContact CD1-SD 4.08Å; L194-M205 HydrophobicContact CD2-CB 4.44Å; L194-M205 HydrophobicContact CG-CB 4.36Å; L194-M219 HydrophobicContact CD1-SD 4.39Å; L194-F284 HydrophobicContact CD2-CD2 4.03Å; L194-F284 HydrophobicContact CD2-CE2 3.73Å; L194-F284 HydrophobicContact CG-CD2 4.21Å; L194-F284 HydrophobicContact CG-CE2 4.39Å
195	V	71.8	Confident	77.3	Confident	45 Å²	45	40.3 Å²	40.3	27%	0.273	21%	0.214	S	C	.	.	H	α-helix	trans	-73.7	-44.5	174.5	168.3	0	0	0	0	111.5	R191 I193 A197 M205 Y492	R191-V195 HydrophobicContact CG-CG2 4.18Å; R191-V195 WeakPolarHBondContact O-CB 3.41Å; R191-V195 VanDerWaalsContact O-CG2 3.23Å; R191-V195 WeakPolarHBondContact O-CG2 3.45Å; R191-V195 PolarHBondContact O-N 2.99Å; I193-V195 VanDerWaalsContact C-N 3.3Å; I193-V195 PolarHBondContact O-N 2.76Å; V195-A197 VanDerWaalsContact C-N 3.27Å; V195-A197 PolarHBondContact O-N 3.49Å; V195-M205 HydrophobicContact CB-CE 4.33Å; V195-M205 HydrophobicContact CG2-CE 3.29Å; V195-Y492 HydrophobicContact CB-CE2 4.26Å; V195-Y492 HydrophobicContact CG1-CD2 4.02Å; V195-Y492 HydrophobicContact CG1-CE2 3.51Å; V195-Y492 HydrophobicContact CG2-CD1 3.75Å; V195-Y492 HydrophobicContact CG2-CD2 3.67Å; V195-Y492 HydrophobicContact CG2-CE1 3.87Å; V195-Y492 HydrophobicContact CG2-CE2 3.83Å; V195-Y492 HydrophobicContact CG2-CG 3.62Å
196	K	65.8	Low	78.1	Confident	146 Å²	146	37.2 Å²	37.2	64%	0.635	19%	0.187	S	C	*	.	H	α-helix	trans	-80.8	-8.4	-172.1	-70.5	177.9	178.8	178.6	0	113.4	D192 I193 M259	D192-K196 VanDerWaalsContact O-CB 3.31Å; D192-K196 WeakPolarHBondContact O-CB 3.12Å; D192-K196 VanDerWaalsContact O-CG 3.27Å; D192-K196 WeakPolarHBondContact O-CG 2.93Å; D192-K196 PolarHBondContact O-N 2.94Å; D192-K196 VanDerWaalsContact O-N 3.07Å; I193-K196 PolarHBondContact O-N 3.37Å; K196-M259 HydrophobicContact CB-CE 4.24Å
197	A	58	Low	78.9	Confident	11 Å²	11	35.8 Å²	35.8	9%	0.091	18%	0.18	C	C	.	.			trans	-99.4	94.6	-174.4	0	0	0	0	0	111.7	I193 V195 N199 V202 M259	I193-A197 WeakPolarHBondContact O-CB 3.27Å; I193-A197 PolarHBondContact O-N 3.47Å; I193-A197 VanDerWaalsContact O-N 3.14Å; V195-A197 VanDerWaalsContact C-N 3.27Å; V195-A197 PolarHBondContact O-N 3.49Å; A197-N199 HydrophobicContact CB-CB 3.6Å; A197-N199 PolarHBondContact O-N 3.17Å; A197-N199 VanDerWaalsContact O-N 3.14Å; A197-V202 HydrophobicContact CB-CB 4.41Å; A197-V202 HydrophobicContact CB-CG1 4.3Å; A197-M259 HydrophobicContact CB-CE 4.04Å
198	D	71.9	Confident	79.6	Confident	131 Å²	131	35.7 Å²	35.7	70%	0.701	18%	0.18	S	C	*	.			trans	-80.2	61.4	140.3	-161.9	41.2	0	0	0	107.6	K204	D198-K204 IonicContact OD1-NZ 3.76Å; D198-K204 PolarHBondContact OD1-NZ 2.87Å
199	N	83.8	Confident	80.4	Confident	20 Å²	20	31 Å²	31	11%	0.107	16%	0.162	C	C	.	.			trans	-107.8	116.1	-175.5	-176.4	-20.9	0	0	0	107.7	A197 W201 V202 S255	A197-N199 HydrophobicContact CB-CB 3.6Å; A197-N199 PolarHBondContact O-N 3.17Å; A197-N199 VanDerWaalsContact O-N 3.14Å; N199-W201 PolarHBondContact O-N 3.27Å; N199-W201 VanDerWaalsContact O-N 3.07Å; N199-W201 WeakPolarHBondContact OD1-CB 3.47Å; N199-W201 VanDerWaalsContact OD1-CD1 3.3Å; N199-W201 PolarHBondContact OD1-N 3.37Å; N199-V202 HydrophobicContact CB-CB 4.18Å; N199-V202 HydrophobicContact CB-CG2 4.16Å; N199-V202 PolarHBondContact O-N 3.36Å; N199-V202 VanDerWaalsContact O-N 3.13Å; N199-S255 WeakPolarHBondContact ND2-CB 3.48Å; N199-S255 PolarHBondContact ND2-OG 3.41Å
200	P	91	Very high	81.2	Confident	69 Å²	69	31.9 Å²	31.9	45%	0.448	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-23	-177.4	24.1	-33.5	0	0	0	112.9	K280 R442	P200-K280 WeakPolarHBondContact O-CE 3.48Å; P200-K280 PolarHBondContact O-NZ 3.49Å; P200-R442 PolarHBondContact O-NH2 3.07Å
201	W	93.1	Very high	81.8	Confident	32 Å²	32	33.3 Å²	33.3	12%	0.121	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-3.9	-177.8	-55.6	106.9	0	0	0	114.8	N199 E248 L251 A252 K280 L281 I441 R442	N199-W201 PolarHBondContact O-N 3.27Å; N199-W201 VanDerWaalsContact O-N 3.07Å; N199-W201 WeakPolarHBondContact OD1-CB 3.47Å; N199-W201 VanDerWaalsContact OD1-CD1 3.3Å; N199-W201 PolarHBondContact OD1-N 3.37Å; W201-E248 HydrophobicContact CH2-CB 4.43Å; W201-E248 HydrophobicContact CH2-CG 4.25Å; W201-E248 HydrophobicContact CZ3-CB 3.79Å; W201-E248 HydrophobicContact CZ3-CG 3.95Å; W201-L251 HydrophobicContact CD2-CB 4.16Å; W201-L251 HydrophobicContact CE3-CB 4.45Å; W201-L251 HydrophobicContact CH2-CB 3.97Å; W201-L251 HydrophobicContact CH2-CD1 3.6Å; W201-L251 HydrophobicContact CH2-CG 4.43Å; W201-L251 HydrophobicContact CZ2-CB 3.64Å; W201-L251 HydrophobicContact CZ2-CD1 3.47Å; W201-L251 VanDerWaalsContact CZ2-CD1 3.47Å; W201-L251 HydrophobicContact CZ2-CG 4.18Å; W201-L251 HydrophobicContact CZ3-CB 4.35Å; W201-A252 HydrophobicContact CB-CB 3.7Å; W201-A252 HydrophobicContact CD2-CB 4.32Å; W201-A252 HydrophobicContact CE3-CB 4.13Å; W201-A252 HydrophobicContact CG-CB 4.18Å; W201-K280 CarbonylContact O-C 3.53Å; W201-K280 WeakPolarHBondContact O-CA 3.31Å; W201-L281 PolarHBondContact O-N 2.84Å; W201-I441 HydrophobicContact CH2-CG2 4.1Å; W201-R442 VanDerWaalsContact CE3-NH1 3.26Å; W201-R442 HydrophobicContact CH2-CB 4.14Å; W201-R442 HydrophobicContact CH2-CG 4.36Å
202	V	91.6	Very high	82.2	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.006	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-116.8	145.6	-179.7	170.5	0	0	0	0	108.7	L194 A197 N199 K204 I256 K280 F284	L194-V202 HydrophobicContact CD2-CG1 3.89Å; A197-V202 HydrophobicContact CB-CB 4.41Å; A197-V202 HydrophobicContact CB-CG1 4.3Å; N199-V202 HydrophobicContact CB-CB 4.18Å; N199-V202 HydrophobicContact CB-CG2 4.16Å; N199-V202 PolarHBondContact O-N 3.36Å; N199-V202 VanDerWaalsContact O-N 3.13Å; V202-K204 PolarHBondContact O-N 3.28Å; V202-I256 HydrophobicContact CG2-CG2 3.71Å; V202-K280 PolarHBondContact O-NZ 3.43Å; V202-K280 VanDerWaalsContact O-NZ 3.09Å; V202-F284 HydrophobicContact CB-CE2 4.44Å; V202-F284 HydrophobicContact CB-CZ 3.9Å; V202-F284 HydrophobicContact CG1-CE1 4.38Å; V202-F284 HydrophobicContact CG1-CE2 3.35Å; V202-F284 HydrophobicContact CG1-CZ 3.26Å; V202-F284 HydrophobicContact CG2-CE1 4.08Å; V202-F284 HydrophobicContact CG2-CZ 3.6Å
203	V	91.7	Very high	82.8	Confident	4 Å²	4	32.4 Å²	32.4	2%	0.024	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-58.6	126.2	170.6	174.2	0	0	0	0	109.7	L194 M205 M219 E220 L222 L272 K280 L281	L194-V203 WeakPolarHBondContact CD2-O 3.26Å; V203-M205 PolarHBondContact O-N 3.12Å; V203-M219 HydrophobicContact CG1-CB 3.74Å; V203-M219 HydrophobicContact CG1-CG 4.19Å; V203-M219 HydrophobicContact CG1-SD 4.02Å; V203-E220 HydrophobicContact CG1-CG 3.94Å; V203-L222 HydrophobicContact CG2-CD1 3.79Å; V203-L272 HydrophobicContact CG2-CD1 3.92Å; V203-K280 HydrophobicContact CG2-CB 4.22Å; V203-L281 WeakPolarHBondContact CG2-O 3.4Å; V203-L281 PolarHBondContact N-O 2.65Å
204	K	88.9	Confident	83.6	Confident	47 Å²	47	32.1 Å²	32.1	20%	0.204	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-73.5	125.8	178.5	-170.9	162.4	-172.6	151.5	0	110.4	D198 V202 F206 M219 E220 D496	D198-K204 IonicContact OD1-NZ 3.76Å; D198-K204 PolarHBondContact OD1-NZ 2.87Å; V202-K204 PolarHBondContact O-N 3.28Å; K204-F206 HydrophobicContact CD-CE1 4.17Å; K204-F206 HydrophobicContact CD-CZ 4.21Å; K204-F206 HydrophobicContact CG-CE1 4.32Å; K204-F206 HydrophobicContact CG-CZ 4.26Å; K204-M219 CarbonylContact O-C 3.57Å; K204-M219 VanDerWaalsContact O-CA 3.29Å; K204-M219 WeakPolarHBondContact O-CA 3.41Å; K204-E220 HydrophobicContact CB-CB 4.48Å; K204-E220 HydrophobicContact CB-CG 4.11Å; K204-E220 WeakPolarHBondContact CB-OE1 3.31Å; K204-E220 PolarHBondContact N-OE1 3.02Å; K204-E220 PolarHBondContact O-N 2.75Å; K204-D496 IonicContact NZ-OD2 3.33Å; K204-D496 PolarHBondContact NZ-OD2 3.28Å
205	M	87.7	Confident	84.3	Confident	4 Å²	4	31.8 Å²	31.8	2%	0.02	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	131.7	171.2	-175.5	-173.7	65.3	0	0	110.8	R191 L194 V195 V203 L217 M219 Y492	R191-M205 HydrophobicContact CG-CE 4.26Å; L194-M205 HydrophobicContact CB-CB 3.68Å; L194-M205 HydrophobicContact CB-CE 3.91Å; L194-M205 HydrophobicContact CB-CG 4.41Å; L194-M205 HydrophobicContact CB-SD 3.96Å; L194-M205 HydrophobicContact CD1-CB 4.27Å; L194-M205 HydrophobicContact CD1-SD 4.08Å; L194-M205 HydrophobicContact CD2-CB 4.44Å; L194-M205 HydrophobicContact CG-CB 4.36Å; V195-M205 HydrophobicContact CB-CE 4.33Å; V195-M205 HydrophobicContact CG2-CE 3.29Å; V203-M205 PolarHBondContact O-N 3.12Å; M205-L217 HydrophobicContact SD-CD2 3.68Å; M205-M219 HydrophobicContact CB-CG 4.34Å; M205-M219 HydrophobicContact CG-CG 4.38Å; M205-Y492 HydrophobicContact CE-CD1 3.5Å; M205-Y492 VanDerWaalsContact CE-CD1 3.5Å; M205-Y492 HydrophobicContact CE-CE1 3.9Å; M205-Y492 HydrophobicContact CE-CG 4.23Å
206	F	86.7	Confident	85.2	Confident	5 Å²	5	29.7 Å²	29.7	2%	0.022	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	-44.6	178.6	-65.9	-72.9	0	0	0	112.3	Y168 K204 V218 E220 A494	Y168-F206 AromaticContact CD1-CD2 3.59Å; Y168-F206 HydrophobicContact CD1-CD2 3.59Å; Y168-F206 AromaticContact CD1-CE2 3.97Å; Y168-F206 HydrophobicContact CD1-CE2 3.97Å; Y168-F206 HydrophobicContact CD1-CG 4.38Å; Y168-F206 HydrophobicContact CE1-CB 4.33Å; Y168-F206 AromaticContact CE1-CD2 3.41Å; Y168-F206 HydrophobicContact CE1-CD2 3.41Å; Y168-F206 VanDerWaalsContact CE1-CD2 3.41Å; Y168-F206 AromaticContact CE1-CE2 3.74Å; Y168-F206 HydrophobicContact CE1-CE2 3.74Å; Y168-F206 AromaticContact CE1-CG 3.86Å; Y168-F206 HydrophobicContact CE1-CG 3.86Å; Y168-F206 HydrophobicContact CE1-CZ 4.44Å; K204-F206 HydrophobicContact CD-CE1 4.17Å; K204-F206 HydrophobicContact CD-CZ 4.21Å; K204-F206 HydrophobicContact CG-CE1 4.32Å; K204-F206 HydrophobicContact CG-CZ 4.26Å; F206-V218 PolarHBondContact N-O 3.18Å; F206-E220 HydrophobicContact CE2-CB 3.88Å; F206-A494 WeakPolarHBondContact O-CB 3.5Å; F206-A494 PolarHBondContact O-N 3.06Å
207	Y	87.9	Confident	86.4	Confident	5 Å²	5	22.8 Å²	22.8	2%	0.02	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	150.3	-175.4	-41.2	-71.5	0	0	0	110.5	L137 F142 K161 Y168 V218 Y492 K493 G497	L137-Y207 HydrophobicContact CD2-CD1 4.13Å; L137-Y207 HydrophobicContact CD2-CD2 4.11Å; L137-Y207 HydrophobicContact CD2-CG 3.67Å; F142-Y207 HydrophobicContact CZ-CD2 4.16Å; K161-Y207 HydrophobicContact CD-CE2 4.32Å; Y168-Y207 HydrophobicContact CE1-CE2 4.38Å; Y207-V218 HydrophobicContact CD2-CB 3.8Å; Y207-V218 HydrophobicContact CD2-CG1 3.78Å; Y207-V218 HydrophobicContact CD2-CG2 4.29Å; Y207-V218 HydrophobicContact CE2-CG1 4.43Å; Y207-V218 HydrophobicContact CG-CB 4.4Å; Y207-V218 PolarHBondContact N-O 3.17Å; Y207-V218 PolarHBondContact O-N 3.45Å; Y207-Y492 WeakPolarHBondContact CA-O 3.24Å; Y207-K493 HydrophobicContact CD1-CB 4.24Å; Y207-K493 HydrophobicContact CD1-CG 4.16Å; Y207-G497 PolarHBondContact OH-O 2.91Å
208	S	88.7	Confident	88	Confident	1 Å²	1	22.3 Å²	22.3	1%	0.007	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	141.1	160.1	62.8	0	0	0	0	109.2	Y216 Y490 T491 Y492	S208-Y216 CarbonylContact C-O 3.55Å; S208-Y216 WeakPolarHBondContact CA-O 3.41Å; S208-Y216 WeakPolarHBondContact CB-O 3.44Å; S208-Y490 WeakPolarHBondContact CB-O 3.37Å; S208-Y490 PolarHBondContact OG-O 3.4Å; S208-T491 CarbonylContact O-C 3.46Å; S208-T491 WeakPolarHBondContact O-CA 3.38Å; S208-Y492 PolarHBondContact N-O 3.06Å; S208-Y492 PolarHBondContact O-N 3.33Å; S208-Y492 VanDerWaalsContact OG-CB 3.24Å; S208-Y492 WeakPolarHBondContact OG-CB 3.43Å; S208-Y492 PolarHBondContact OG-N 3.37Å; S208-Y492 VanDerWaalsContact OG-N 3.08Å
209	F	89.2	Confident	89	Confident	5 Å²	5	16.8 Å²	16.8	2%	0.022	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	172.3	179.8	61.7	-86.6	0	0	0	110.2	L137 V139 F142 M170 Y216 V218 Y490	L137-F209 HydrophobicContact CB-CD1 4.47Å; L137-F209 HydrophobicContact CD2-CD1 3.71Å; L137-F209 HydrophobicContact CD2-CE1 3.89Å; L137-F209 HydrophobicContact CG-CD1 4.21Å; L137-F209 HydrophobicContact CG-CE1 4.31Å; V139-F209 HydrophobicContact CG1-CE2 3.9Å; V139-F209 HydrophobicContact CG1-CZ 4.36Å; F142-F209 HydrophobicContact CD2-CE1 4.44Å; F142-F209 HydrophobicContact CD2-CZ 4.22Å; F142-F209 AromaticContact CE2-CE1 3.77Å; F142-F209 HydrophobicContact CE2-CE1 3.77Å; F142-F209 AromaticContact CE2-CZ 3.99Å; F142-F209 HydrophobicContact CE2-CZ 3.99Å; F142-F209 HydrophobicContact CZ-CE1 4.47Å; M170-F209 HydrophobicContact CE-CE1 4.27Å; M170-F209 HydrophobicContact CE-CZ 3.86Å; M170-F209 HydrophobicContact SD-CZ 4.4Å; F209-Y216 AromaticContact CD2-CD2 3.54Å; F209-Y216 HydrophobicContact CD2-CD2 3.54Å; F209-Y216 HydrophobicContact CD2-CE2 4.37Å; F209-Y216 AromaticContact CD2-CG 3.86Å; F209-Y216 HydrophobicContact CD2-CG 3.86Å; F209-Y216 HydrophobicContact CE1-CG 4.35Å; F209-Y216 HydrophobicContact CE2-CD1 4.05Å; F209-Y216 AromaticContact CE2-CD2 3.38Å; F209-Y216 HydrophobicContact CE2-CD2 3.38Å; F209-Y216 HydrophobicContact CE2-CE2 4.06Å; F209-Y216 AromaticContact CE2-CG 3.38Å; F209-Y216 HydrophobicContact CE2-CG 3.38Å; F209-Y216 HydrophobicContact CG-CD2 4.41Å; F209-Y216 HydrophobicContact CZ-CD1 4.13Å; F209-Y216 HydrophobicContact CZ-CD2 4.17Å; F209-Y216 AromaticContact CZ-CG 3.68Å; F209-Y216 HydrophobicContact CZ-CG 3.68Å; F209-Y216 PolarHBondContact N-O 3.47Å; F209-Y216 WeakPolarHBondContact O-CB 3.14Å; F209-Y216 PolarHBondContact O-N 2.98Å; F209-V218 HydrophobicContact CD1-CG2 4.38Å; F209-V218 HydrophobicContact CE1-CG2 3.65Å; F209-Y490 WeakPolarHBondContact O-CD1 3.43Å; F209-Y490 WeakPolarHBondContact O-CE1 3.21Å
210	Q	88.5	Confident	89.4	Confident	50 Å²	50	18 Å²	18	23%	0.234	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	151.9	-174.4	62.2	-178.3	-51.7	0	0	110	K175 N214 L215 F487 Y490	K175-Q210 VanDerWaalsContact CE-OE1 3.32Å; Q210-N214 WeakPolarHBondContact CA-O 3.5Å; Q210-L215 HydrophobicContact CB-CD2 3.73Å; Q210-F487 PolarHBondContact NE2-O 3.1Å; Q210-Y490 HydrophobicContact CB-CD1 4.17Å
211	D	86.1	Confident	89.5	Confident	32 Å²	32	15.7 Å²	15.7	17%	0.171	8%	0.077	C	C	.	.			trans	-117.8	-158.2	169.4	68.4	11.9	0	0	0	110	K175 V213 N214 Y216	K175-D211 WeakPolarHBondContact CE-O 3.28Å; K175-D211 PolarHBondContact NZ-O 2.83Å; D211-V213 VanDerWaalsContact C-N 3.28Å; D211-V213 PolarHBondContact O-N 2.68Å; D211-V213 WeakPolarHBondContact OD1-CA 3.31Å; D211-V213 PolarHBondContact OD1-N 3.15Å; D211-N214 PolarHBondContact N-O 3.15Å; D211-N214 VanDerWaalsContact N-O 3.17Å; D211-N214 PolarHBondContact OD1-N 3.28Å; D211-Y216 HydrophobicContact CB-CE2 4.26Å; D211-Y216 PolarHBondContact OD2-OH 3.48Å
212	S	82.9	Confident	89.6	Confident	14 Å²	14	14.6 Å²	14.6	10%	0.098	7%	0.073	C	C	.	.	S	Bend	trans	-72.6	-17	178.8	65.2	0	0	0	0	114.2	V474 T475 S480	S212-V474 WeakPolarHBondContact OG-CG1 3.42Å; S212-T475 PolarHBondContact OG-O 3.5Å; S212-S480 PolarHBondContact O-OG 3.06Å
213	V	86.3	Confident	89.8	Confident	45 Å²	45	15 Å²	15	27%	0.273	8%	0.076	S	C	.	.	S	Bend	trans	-119.4	-39.9	-167.7	-175	0	0	0	0	112.7	K175 D211	K175-V213 VanDerWaalsContact CB-O 3.22Å; K175-V213 WeakPolarHBondContact CB-O 3.19Å; K175-V213 WeakPolarHBondContact CG-O 3.1Å; K175-V213 PolarHBondContact N-O 3.23Å; D211-V213 VanDerWaalsContact C-N 3.28Å; D211-V213 PolarHBondContact O-N 2.68Å; D211-V213 WeakPolarHBondContact OD1-CA 3.31Å; D211-V213 PolarHBondContact OD1-N 3.15Å
214	N	89.5	Confident	90	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.005	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	160	-166.1	-57.8	-51.7	0	0	0	112.4	I172 L173 H174 K175 Q210 D211 Y216	I172-N214 HydrophobicContact CG2-CB 3.99Å; L173-N214 CarbonylContact O-C 3.53Å; L173-N214 VanDerWaalsContact O-CA 3.24Å; L173-N214 WeakPolarHBondContact O-CA 3.14Å; H174-N214 PolarHBondContact ND1-OD1 3.27Å; K175-N214 WeakPolarHBondContact CE-O 3.49Å; Q210-N214 WeakPolarHBondContact CA-O 3.5Å; D211-N214 PolarHBondContact N-O 3.15Å; D211-N214 VanDerWaalsContact N-O 3.17Å; D211-N214 PolarHBondContact OD1-N 3.28Å; N214-Y216 HydrophobicContact CB-CD2 4.44Å; N214-Y216 HydrophobicContact CB-CE1 4.29Å; N214-Y216 HydrophobicContact CB-CE2 3.65Å; N214-Y216 WeakPolarHBondContact CB-OH 3.32Å; N214-Y216 PolarHBondContact ND2-OH 3.01Å; N214-Y216 VanDerWaalsContact ND2-OH 3.13Å
215	L	88.9	Confident	90.2	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	142.1	164.4	-54.3	174.6	0	0	0	108.5	I172 L173 K175 V187 Q210 F487 Y490	I172-L215 WeakPolarHBondContact CA-O 3.21Å; L173-L215 HydrophobicContact CB-CB 4.23Å; L173-L215 PolarHBondContact N-O 2.81Å; L173-L215 PolarHBondContact O-N 3.37Å; K175-L215 HydrophobicContact CD-CD2 4.35Å; K175-L215 HydrophobicContact CG-CD2 4Å; K175-L215 HydrophobicContact CG-CG 3.9Å; V187-L215 HydrophobicContact CG1-CD1 3.67Å; V187-L215 HydrophobicContact CG2-CD1 4.29Å; Q210-L215 HydrophobicContact CB-CD2 3.73Å; L215-F487 HydrophobicContact CD1-CD1 3.58Å; L215-F487 HydrophobicContact CD1-CE1 3.6Å; L215-F487 HydrophobicContact CD1-CG 4.15Å; L215-F487 HydrophobicContact CD1-CZ 4.19Å; L215-F487 HydrophobicContact CD2-CB 3.88Å; L215-F487 HydrophobicContact CD2-CD1 3.99Å; L215-F487 HydrophobicContact CD2-CD2 4.17Å; L215-F487 HydrophobicContact CD2-CG 3.73Å; L215-F487 HydrophobicContact CG-CD1 4.36Å; L215-F487 HydrophobicContact CG-CG 4.47Å; L215-Y490 HydrophobicContact CB-CD1 4.47Å; L215-Y490 HydrophobicContact CB-CE1 3.77Å; L215-Y490 HydrophobicContact CB-CE2 4.2Å; L215-Y490 WeakPolarHBondContact CB-OH 3.09Å; L215-Y490 HydrophobicContact CD1-CD2 4.37Å; L215-Y490 HydrophobicContact CD1-CE2 4.04Å; L215-Y490 HydrophobicContact CD2-CD1 3.94Å; L215-Y490 HydrophobicContact CD2-CD2 4.27Å; L215-Y490 HydrophobicContact CD2-CE1 4.09Å; L215-Y490 HydrophobicContact CD2-CE2 4.4Å; L215-Y490 HydrophobicContact CD2-CG 4.01Å; L215-Y490 HydrophobicContact CG-CE1 4.46Å; L215-Y490 HydrophobicContact CG-CE2 4.47Å
216	Y	91.5	Very high	90.5	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	128.7	-176.5	-58.8	-87.9	0	0	0	109.7	V139 M170 K171 I172 S208 F209 D211 N214 W471 Y490	V139-Y216 HydrophobicContact CG1-CD1 3.98Å; V139-Y216 HydrophobicContact CG1-CD2 4.46Å; V139-Y216 HydrophobicContact CG1-CE1 3.33Å; V139-Y216 HydrophobicContact CG1-CE2 3.9Å; V139-Y216 HydrophobicContact CG1-CG 4.5Å; V139-Y216 WeakPolarHBondContact CG1-OH 3.4Å; M170-Y216 HydrophobicContact CG-CD1 4.27Å; M170-Y216 HydrophobicContact SD-CD1 3.62Å; M170-Y216 HydrophobicContact SD-CE1 4.25Å; K171-Y216 WeakPolarHBondContact O-CA 3.35Å; I172-Y216 HydrophobicContact CB-CE1 4.5Å; I172-Y216 HydrophobicContact CG1-CD1 4.07Å; I172-Y216 HydrophobicContact CG1-CE1 4.08Å; I172-Y216 HydrophobicContact CG2-CD1 4.3Å; I172-Y216 HydrophobicContact CG2-CE1 3.86Å; S208-Y216 CarbonylContact C-O 3.55Å; S208-Y216 WeakPolarHBondContact CA-O 3.41Å; S208-Y216 WeakPolarHBondContact CB-O 3.44Å; F209-Y216 AromaticContact CD2-CD2 3.54Å; F209-Y216 HydrophobicContact CD2-CD2 3.54Å; F209-Y216 HydrophobicContact CD2-CE2 4.37Å; F209-Y216 AromaticContact CD2-CG 3.86Å; F209-Y216 HydrophobicContact CD2-CG 3.86Å; F209-Y216 HydrophobicContact CE1-CG 4.35Å; F209-Y216 HydrophobicContact CE2-CD1 4.05Å; F209-Y216 AromaticContact CE2-CD2 3.38Å; F209-Y216 HydrophobicContact CE2-CD2 3.38Å; F209-Y216 HydrophobicContact CE2-CE2 4.06Å; F209-Y216 AromaticContact CE2-CG 3.38Å; F209-Y216 HydrophobicContact CE2-CG 3.38Å; F209-Y216 HydrophobicContact CG-CD2 4.41Å; F209-Y216 HydrophobicContact CZ-CD1 4.13Å; F209-Y216 HydrophobicContact CZ-CD2 4.17Å; F209-Y216 AromaticContact CZ-CG 3.68Å; F209-Y216 HydrophobicContact CZ-CG 3.68Å; F209-Y216 PolarHBondContact N-O 3.47Å; F209-Y216 WeakPolarHBondContact O-CB 3.14Å; F209-Y216 PolarHBondContact O-N 2.98Å; D211-Y216 HydrophobicContact CB-CE2 4.26Å; D211-Y216 PolarHBondContact OD2-OH 3.48Å; N214-Y216 HydrophobicContact CB-CD2 4.44Å; N214-Y216 HydrophobicContact CB-CE1 4.29Å; N214-Y216 HydrophobicContact CB-CE2 3.65Å; N214-Y216 WeakPolarHBondContact CB-OH 3.32Å; N214-Y216 PolarHBondContact ND2-OH 3.01Å; N214-Y216 VanDerWaalsContact ND2-OH 3.13Å; Y216-W471 HydrophobicContact CE1-CZ3 4.4Å; Y216-Y490 WeakPolarHBondContact O-CE1 3.28Å; Y216-Y490 PolarHBondContact O-OH 3.04Å
217	L	90.5	Very high	90.9	Very high	2 Å²	2	13.9 Å²	13.9	1%	0.01	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	122.3	168.6	-59.3	170.5	0	0	0	107.6	M170 K171 L173 E190 M205 M219 Y490	M170-L217 CarbonylContact C-O 3.51Å; M170-L217 VanDerWaalsContact CA-O 3.31Å; M170-L217 WeakPolarHBondContact CA-O 3.5Å; K171-L217 HydrophobicContact CB-CB 4.27Å; K171-L217 HydrophobicContact CD-CD1 4.32Å; K171-L217 PolarHBondContact N-O 3.29Å; K171-L217 PolarHBondContact O-N 3.08Å; L173-L217 HydrophobicContact CD1-CD1 4.46Å; E190-L217 HydrophobicContact CG-CD1 4.48Å; E190-L217 WeakPolarHBondContact OE1-CD1 3.39Å; M205-L217 HydrophobicContact SD-CD2 3.68Å; L217-M219 HydrophobicContact CB-CG 4.5Å; L217-Y490 HydrophobicContact CD2-CE1 4.48Å; L217-Y490 HydrophobicContact CD2-CE2 4.26Å; L217-Y490 WeakPolarHBondContact CD2-OH 3.39Å; L217-Y490 WeakPolarHBondContact CG-OH 3.35Å
218	V	92.2	Very high	91.1	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	117.1	177.3	-172.6	0	0	0	0	108.5	F142 Y168 M170 F206 Y207 F209	F142-V218 HydrophobicContact CE1-CG1 3.95Å; F142-V218 HydrophobicContact CE1-CG2 4.31Å; F142-V218 HydrophobicContact CE2-CG2 4.31Å; F142-V218 HydrophobicContact CZ-CG1 4.18Å; F142-V218 HydrophobicContact CZ-CG2 3.87Å; Y168-V218 HydrophobicContact CD1-CG1 3.89Å; Y168-V218 HydrophobicContact CD2-CG1 4.2Å; Y168-V218 HydrophobicContact CG-CG1 3.6Å; M170-V218 HydrophobicContact CE-CG2 4.03Å; M170-V218 HydrophobicContact CG-CG2 4.33Å; F206-V218 PolarHBondContact N-O 3.18Å; Y207-V218 HydrophobicContact CD2-CB 3.8Å; Y207-V218 HydrophobicContact CD2-CG1 3.78Å; Y207-V218 HydrophobicContact CD2-CG2 4.29Å; Y207-V218 HydrophobicContact CE2-CG1 4.43Å; Y207-V218 HydrophobicContact CG-CB 4.4Å; Y207-V218 PolarHBondContact N-O 3.17Å; Y207-V218 PolarHBondContact O-N 3.45Å; F209-V218 HydrophobicContact CD1-CG2 4.38Å; F209-V218 HydrophobicContact CE1-CG2 3.65Å
219	M	91.8	Very high	91.2	Very high	16 Å²	16	15 Å²	15	8%	0.079	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	164.5	-169.2	-61.3	175.8	-62.8	0	0	110.7	Y168 A169 K171 L194 V203 K204 M205 L217 F221	Y168-M219 WeakPolarHBondContact CA-O 3.1Å; Y168-M219 WeakPolarHBondContact CB-O 3.41Å; A169-M219 PolarHBondContact N-O 3.06Å; A169-M219 PolarHBondContact O-N 3.27Å; K171-M219 HydrophobicContact CB-CE 3.76Å; K171-M219 HydrophobicContact CD-CE 4.29Å; L194-M219 HydrophobicContact CD1-SD 4.39Å; V203-M219 HydrophobicContact CG1-CB 3.74Å; V203-M219 HydrophobicContact CG1-CG 4.19Å; V203-M219 HydrophobicContact CG1-SD 4.02Å; K204-M219 CarbonylContact O-C 3.57Å; K204-M219 VanDerWaalsContact O-CA 3.29Å; K204-M219 WeakPolarHBondContact O-CA 3.41Å; M205-M219 HydrophobicContact CB-CG 4.34Å; M205-M219 HydrophobicContact CG-CG 4.38Å; L217-M219 HydrophobicContact CB-CG 4.5Å; M219-F221 PolarHBondContact O-N 3.24Å
220	E	92.2	Very high	91.4	Very high	44 Å²	44	16 Å²	16	21%	0.206	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	138.2	166.8	65.5	-179.5	142	0	0	110.7	V203 K204 F206 L222 K280	V203-E220 HydrophobicContact CG1-CG 3.94Å; K204-E220 HydrophobicContact CB-CB 4.48Å; K204-E220 HydrophobicContact CB-CG 4.11Å; K204-E220 WeakPolarHBondContact CB-OE1 3.31Å; K204-E220 PolarHBondContact N-OE1 3.02Å; K204-E220 PolarHBondContact O-N 2.75Å; F206-E220 HydrophobicContact CE2-CB 3.88Å; E220-L222 HydrophobicContact CG-CD2 3.91Å; E220-L222 HydrophobicContact CG-CG 4.28Å; E220-K280 VanDerWaalsContact OE1-CE 3.32Å; E220-K280 WeakPolarHBondContact OE1-CE 3.35Å; E220-K280 IonicContact OE1-NZ 3.69Å; E220-K280 PolarHBondContact OE1-NZ 3.03Å; E220-K280 IonicContact OE2-NZ 2.81Å
221	F	94.8	Very high	91.6	Very high	22 Å²	22	13.6 Å²	13.6	10%	0.096	8%	0.075	C	C	.	.			trans	-83.5	127.1	170.7	172.7	-121.5	0	0	0	109.3	I148 L158 I167 A169 M219 P223 I455 D457 T458 F461	I148-F221 HydrophobicContact CD1-CD2 3.92Å; I148-F221 HydrophobicContact CD1-CE2 3.88Å; L158-F221 HydrophobicContact CD1-CB 4.07Å; L158-F221 HydrophobicContact CD1-CD1 3.67Å; L158-F221 HydrophobicContact CD1-CD2 3.45Å; L158-F221 VanDerWaalsContact CD1-CD2 3.45Å; L158-F221 HydrophobicContact CD1-CE1 3.89Å; L158-F221 HydrophobicContact CD1-CE2 3.7Å; L158-F221 HydrophobicContact CD1-CG 3.44Å; L158-F221 VanDerWaalsContact CD1-CG 3.44Å; L158-F221 HydrophobicContact CD1-CZ 3.9Å; I167-F221 HydrophobicContact CG2-CB 4.22Å; I167-F221 HydrophobicContact CG2-CD1 4.04Å; I167-F221 HydrophobicContact CG2-CG 4.33Å; A169-F221 HydrophobicContact CB-CB 4.47Å; M219-F221 PolarHBondContact O-N 3.24Å; F221-P223 HydrophobicContact CD1-CB 4.34Å; F221-P223 HydrophobicContact CE1-CB 3.69Å; F221-P223 HydrophobicContact CZ-CB 4.05Å; F221-P223 WeakPolarHBondContact O-CD 3.39Å; F221-I455 WeakPolarHBondContact CD1-O 3.29Å; F221-I455 WeakPolarHBondContact CE1-O 3.43Å; F221-D457 WeakPolarHBondContact CZ-O 3.44Å; F221-T458 HydrophobicContact CZ-CG2 4.16Å; F221-F461 HydrophobicContact CD2-CZ 4.4Å; F221-F461 HydrophobicContact CE2-CD2 4.45Å; F221-F461 HydrophobicContact CE2-CE1 4.5Å; F221-F461 AromaticContact CE2-CE2 3.49Å; F221-F461 HydrophobicContact CE2-CE2 3.49Å; F221-F461 VanDerWaalsContact CE2-CE2 3.49Å; F221-F461 AromaticContact CE2-CZ 3.5Å; F221-F461 HydrophobicContact CE2-CZ 3.5Å; F221-F461 VanDerWaalsContact CE2-CZ 3.5Å; F221-F461 AromaticContact CZ-CE2 3.64Å; F221-F461 HydrophobicContact CZ-CE2 3.64Å; F221-F461 HydrophobicContact CZ-CZ 4.13Å
222	L	95	Very high	91.7	Very high	8 Å²	8	13.6 Å²	13.6	4%	0.042	7%	0.074	C	C	.	.			trans	-108.2	97.9	179.6	-63.4	-174.8	0	0	0	109.9	V203 E220 G224 G225 L272 L273 D274 K280 F461	V203-L222 HydrophobicContact CG2-CD1 3.79Å; E220-L222 HydrophobicContact CG-CD2 3.91Å; E220-L222 HydrophobicContact CG-CG 4.28Å; L222-G224 PolarHBondContact O-N 2.92Å; L222-G224 VanDerWaalsContact O-N 3.14Å; L222-G225 PolarHBondContact O-N 3.37Å; L222-L272 HydrophobicContact CB-CB 4.46Å; L222-L272 HydrophobicContact CD1-CB 3.54Å; L222-L272 HydrophobicContact CD1-CD1 3.98Å; L222-L272 HydrophobicContact CD1-CG 4.41Å; L222-L273 WeakPolarHBondContact CB-O 3.28Å; L222-D274 HydrophobicContact CD2-CB 4.02Å; L222-K280 HydrophobicContact CD1-CB 3.73Å; L222-K280 HydrophobicContact CD1-CD 3.63Å; L222-K280 HydrophobicContact CD1-CG 4.27Å; L222-K280 HydrophobicContact CD2-CD 3.74Å; L222-K280 HydrophobicContact CG-CD 4.34Å; L222-F461 VanDerWaalsContact O-CZ 3.27Å; L222-F461 WeakPolarHBondContact O-CZ 3.37Å
223	P	95.1	Very high	92	Very high	10 Å²	10	18.5 Å²	18.5	7%	0.065	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-5.4	-167.9	32.1	-38.6	0	0	0	114.1	F221 G225 A275 I452 N460	F221-P223 HydrophobicContact CD1-CB 4.34Å; F221-P223 HydrophobicContact CE1-CB 3.69Å; F221-P223 HydrophobicContact CZ-CB 4.05Å; F221-P223 WeakPolarHBondContact O-CD 3.39Å; P223-G225 PolarHBondContact O-N 2.96Å; P223-A275 HydrophobicContact CG-CB 3.78Å; P223-I452 HydrophobicContact CB-CD1 4.47Å; P223-I452 HydrophobicContact CB-CG2 3.86Å; P223-I452 HydrophobicContact CG-CD1 3.95Å; P223-I452 HydrophobicContact CG-CG2 4.3Å; P223-N460 WeakPolarHBondContact O-CB 3.48Å; P223-N460 PolarHBondContact O-ND2 3.41Å
224	G	95	Very high	92.2	Very high	8 Å²	8	21.8 Å²	21.8	8%	0.082	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-11.2	174	0	0	0	0	0	113.9	L222 L273	L222-G224 PolarHBondContact O-N 2.92Å; L222-G224 VanDerWaalsContact O-N 3.14Å; G224-L273 WeakPolarHBondContact CA-O 3.04Å; G224-L273 PolarHBondContact N-O 3.26Å
225	G	94.3	Very high	92.2	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.01	12%	0.122	C	C	.	.			trans	75.5	-150.5	-176.4	0	0	0	0	0	111.7	L222 P223 L272 L273	L222-G225 PolarHBondContact O-N 3.37Å; P223-G225 PolarHBondContact O-N 2.96Å; G225-L272 CarbonylContact O-C 3.6Å; G225-L272 WeakPolarHBondContact O-CA 2.98Å; G225-L273 PolarHBondContact O-N 2.78Å
226	D	93.7	Very high	92.5	Very high	27 Å²	27	28.2 Å²	28.2	14%	0.144	14%	0.138	C	C	.	.	B	Isolated β-bridge	trans	-117.6	160.4	-178.7	64.2	78.1	0	0	0	112.6	M228 T229 L230 L271 L272	D226-M228 PolarHBondContact O-N 2.94Å; D226-M228 WeakPolarHBondContact OD1-CA 3.32Å; D226-M228 WeakPolarHBondContact OD1-CB 2.95Å; D226-M228 PolarHBondContact OD1-N 2.67Å; D226-T229 PolarHBondContact O-N 2.81Å; D226-T229 PolarHBondContact OD1-N 2.83Å; D226-T229 PolarHBondContact OD1-OG1 3Å; D226-T229 PolarHBondContact OD2-OG1 3.44Å; D226-L230 PolarHBondContact O-N 2.98Å; D226-L230 VanDerWaalsContact O-N 3.12Å; D226-L271 CarbonylContact C-O 3.57Å; D226-L271 WeakPolarHBondContact CA-O 3.22Å; D226-L272 HydrophobicContact CB-CD2 3.62Å
227	M	95.2	Very high	92.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-65.3	-27	-179.6	-175.4	59.3	65.8	0	0	112.4	L230 L231 L237 Y245 P268 L271 L273 I279 M368	M227-L230 HydrophobicContact CE-CD2 4.09Å; M227-L230 PolarHBondContact O-N 3.31Å; M227-L230 HydrophobicContact SD-CB 4.32Å; M227-L230 HydrophobicContact SD-CD2 3.79Å; M227-L230 HydrophobicContact SD-CG 4.35Å; M227-L231 HydrophobicContact CG-CD1 4.14Å; M227-L231 HydrophobicContact CG-CG 4.32Å; M227-L231 WeakPolarHBondContact O-CB 3.38Å; M227-L231 VanDerWaalsContact O-CG 3.28Å; M227-L231 WeakPolarHBondContact O-CG 3.28Å; M227-L231 PolarHBondContact O-N 3.49Å; M227-L231 HydrophobicContact SD-CG 4.27Å; M227-L237 HydrophobicContact SD-CD1 4.35Å; M227-Y245 HydrophobicContact CE-CD1 3.58Å; M227-Y245 HydrophobicContact CE-CD2 3.8Å; M227-Y245 HydrophobicContact CE-CE1 3.88Å; M227-Y245 HydrophobicContact CE-CE2 4.08Å; M227-Y245 HydrophobicContact CE-CG 3.53Å; M227-P268 HydrophobicContact CB-CB 4.08Å; M227-P268 VanDerWaalsContact CB-O 3.31Å; M227-P268 WeakPolarHBondContact CB-O 3.37Å; M227-P268 HydrophobicContact CG-CB 4.15Å; M227-P268 PolarHBondContact N-O 2.73Å; M227-L271 HydrophobicContact CB-CB 3.83Å; M227-L271 HydrophobicContact CB-CD1 4.48Å; M227-L271 PolarHBondContact N-O 3.14Å; M227-L273 HydrophobicContact CE-CD2 4.27Å; M227-I279 HydrophobicContact CE-CD1 3.81Å; M227-M368 HydrophobicContact CE-CE 3.93Å; M227-M368 HydrophobicContact CG-CE 3.8Å; M227-M368 HydrophobicContact SD-CE 3.68Å
228	M	91.8	Very high	93	Very high	16 Å²	16	32 Å²	32	8%	0.079	16%	0.161	C	C	.	.	H	α-helix	trans	-64.1	-47.6	175.3	-173.3	178.5	-70.1	0	0	110.8	D226 L230 L231 M232 P268 D269 R328 A332	D226-M228 PolarHBondContact O-N 2.94Å; D226-M228 WeakPolarHBondContact OD1-CA 3.32Å; D226-M228 WeakPolarHBondContact OD1-CB 2.95Å; D226-M228 PolarHBondContact OD1-N 2.67Å; M228-L230 VanDerWaalsContact C-N 3.32Å; M228-L230 PolarHBondContact O-N 3.25Å; M228-L231 PolarHBondContact O-N 3.28Å; M228-M232 HydrophobicContact CG-SD 4.39Å; M228-M232 WeakPolarHBondContact O-CG 3.42Å; M228-M232 PolarHBondContact O-N 2.95Å; M228-P268 HydrophobicContact CB-CB 3.91Å; M228-P268 PolarHBondContact N-O 3.3Å; M228-D269 HydrophobicContact CB-CB 4.26Å; M228-D269 HydrophobicContact CE-CB 3.76Å; M228-D269 VanDerWaalsContact CE-OD1 3.28Å; M228-D269 WeakPolarHBondContact CE-OD1 3.38Å; M228-D269 HydrophobicContact SD-CB 4.32Å; M228-R328 HydrophobicContact SD-CB 4.39Å; M228-A332 HydrophobicContact SD-CB 4.17Å
229	T	90.8	Very high	93.2	Very high	13 Å²	13	35 Å²	35	8%	0.08	18%	0.175	C	C	.	.	H	α-helix	trans	-63	-39.3	177.2	-60.1	0	0	0	0	111	D226 M232 K233 N460	D226-T229 PolarHBondContact O-N 2.81Å; D226-T229 PolarHBondContact OD1-N 2.83Å; D226-T229 PolarHBondContact OD1-OG1 3Å; D226-T229 PolarHBondContact OD2-OG1 3.44Å; T229-M232 PolarHBondContact O-N 3.48Å; T229-K233 WeakPolarHBondContact O-CG 3.4Å; T229-K233 PolarHBondContact O-N 3.5Å; T229-K233 VanDerWaalsContact O-N 3.08Å; T229-N460 WeakPolarHBondContact CG2-O 3.42Å
230	L	93.3	Very high	93.5	Very high	26 Å²	26	38.2 Å²	38.2	14%	0.136	20%	0.199	C	C	.	.	H	α-helix	trans	-62.5	-45.9	173.9	-180	59	0	0	0	112.2	D226 M227 M228 M232 K233 R234 Y245 L273 I448	D226-L230 PolarHBondContact O-N 2.98Å; D226-L230 VanDerWaalsContact O-N 3.12Å; M227-L230 HydrophobicContact CE-CD2 4.09Å; M227-L230 PolarHBondContact O-N 3.31Å; M227-L230 HydrophobicContact SD-CB 4.32Å; M227-L230 HydrophobicContact SD-CD2 3.79Å; M227-L230 HydrophobicContact SD-CG 4.35Å; M228-L230 VanDerWaalsContact C-N 3.32Å; M228-L230 PolarHBondContact O-N 3.25Å; L230-M232 VanDerWaalsContact C-N 3.32Å; L230-M232 PolarHBondContact O-N 2.83Å; L230-K233 PolarHBondContact O-N 3.34Å; L230-K233 VanDerWaalsContact O-N 3.16Å; L230-R234 HydrophobicContact CD1-CG 4.23Å; L230-R234 PolarHBondContact O-N 3.23Å; L230-R234 VanDerWaalsContact O-N 3.1Å; L230-Y245 HydrophobicContact CD2-CE2 4.22Å; L230-L273 HydrophobicContact CD2-CD1 3.8Å; L230-I448 HydrophobicContact CD1-CD1 4.33Å; L230-I448 HydrophobicContact CD2-CD1 4.17Å
231	L	93	Very high	93.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-66.1	-33.3	177.5	-73.2	173.3	0	0	0	112.7	M227 M228 K233 D235 L237 P268 R328 E367 M368	M227-L231 HydrophobicContact CG-CD1 4.14Å; M227-L231 HydrophobicContact CG-CG 4.32Å; M227-L231 WeakPolarHBondContact O-CB 3.38Å; M227-L231 VanDerWaalsContact O-CG 3.28Å; M227-L231 WeakPolarHBondContact O-CG 3.28Å; M227-L231 PolarHBondContact O-N 3.49Å; M227-L231 HydrophobicContact SD-CG 4.27Å; M228-L231 PolarHBondContact O-N 3.28Å; L231-K233 VanDerWaalsContact C-N 3.33Å; L231-D235 VanDerWaalsContact O-CA 3.31Å; L231-D235 WeakPolarHBondContact O-CA 3.49Å; L231-D235 PolarHBondContact O-N 2.76Å; L231-L237 HydrophobicContact CD2-CD1 4.15Å; L231-L237 HydrophobicContact CD2-CD2 4.5Å; L231-L237 HydrophobicContact CD2-CG 3.89Å; L231-P268 HydrophobicContact CD1-CB 4.17Å; L231-P268 HydrophobicContact CD1-CG 4.13Å; L231-R328 PolarHBondContact O-NH1 3.34Å; L231-E367 HydrophobicContact CD1-CG 4.25Å; L231-M368 HydrophobicContact CD1-CG 4.39Å; L231-M368 HydrophobicContact CD2-CB 4.44Å; L231-M368 HydrophobicContact CD2-CG 4.05Å
232	M	88.6	Confident	93.9	Very high	32 Å²	32	36.3 Å²	36.3	16%	0.158	19%	0.191	C	C	.	.	H	α-helix	trans	-67.9	-32.2	172.4	-75.4	176.6	42.8	0	0	113.1	M228 T229 L230 R328 R329	M228-M232 HydrophobicContact CG-SD 4.39Å; M228-M232 WeakPolarHBondContact O-CG 3.42Å; M228-M232 PolarHBondContact O-N 2.95Å; T229-M232 PolarHBondContact O-N 3.48Å; L230-M232 VanDerWaalsContact C-N 3.32Å; L230-M232 PolarHBondContact O-N 2.83Å; M232-R328 HydrophobicContact CG-CB 4.37Å; M232-R328 HydrophobicContact SD-CB 4.02Å; M232-R329 HydrophobicContact CE-CG 3.29Å; M232-R329 HydrophobicContact SD-CG 3.83Å
233	K	88.8	Confident	94	Very high	118 Å²	118	37.3 Å²	37.3	51%	0.513	20%	0.195	S	C	.	.	H	α-helix	trans	-77	-30	178.3	-74.5	176.7	179.7	-179.4	0	112.9	T229 L230 L231 S459 N460	T229-K233 WeakPolarHBondContact O-CG 3.4Å; T229-K233 PolarHBondContact O-N 3.5Å; T229-K233 VanDerWaalsContact O-N 3.08Å; L230-K233 PolarHBondContact O-N 3.34Å; L230-K233 VanDerWaalsContact O-N 3.16Å; L231-K233 VanDerWaalsContact C-N 3.33Å; K233-S459 PolarHBondContact NZ-O 3.35Å; K233-N460 PolarHBondContact NZ-OD1 3.18Å
234	R	91.4	Very high	94.1	Very high	113 Å²	113	38 Å²	38	43%	0.426	20%	0.197	S	C	.	.	H	α-helix	trans	-109.9	-9.2	-173	-63.1	-168.2	71	124	5.5	115.3	L230 T236 L237	L230-R234 HydrophobicContact CD1-CG 4.23Å; L230-R234 PolarHBondContact O-N 3.23Å; L230-R234 VanDerWaalsContact O-N 3.1Å; R234-T236 PolarHBondContact O-N 2.85Å; R234-L237 HydrophobicContact CB-CD2 4.31Å
235	D	89.3	Confident	94.3	Very high	83 Å²	83	37.7 Å²	37.7	44%	0.444	19%	0.193	S	C	.	.	S	Bend	trans	62.8	-56.3	-169.8	-62.4	-47.5	0	0	0	114.1	L231 N325 G371	L231-D235 VanDerWaalsContact O-CA 3.31Å; L231-D235 WeakPolarHBondContact O-CA 3.49Å; L231-D235 PolarHBondContact O-N 2.76Å; D235-N325 PolarHBondContact OD1-ND2 3.36Å; D235-G371 WeakPolarHBondContact O-CA 3.48Å
236	T	94.1	Very high	94.5	Very high	53 Å²	53	37.6 Å²	37.6	33%	0.325	19%	0.193	S	C	.	.	S	Bend	trans	-136.2	163.9	175.5	62.5	0	0	0	0	111.5	R234 M368 M400	R234-T236 PolarHBondContact O-N 2.85Å; T236-M368 CarbonylContact C-O 3.59Å; T236-M368 WeakPolarHBondContact CA-O 3.36Å; T236-M368 WeakPolarHBondContact CB-O 3.46Å; T236-M400 HydrophobicContact CG2-CE 4.36Å
237	L	96.6	Very high	94.7	Very high	7 Å²	7	36.3 Å²	36.3	4%	0.037	19%	0.186	C	C	.	.			trans	-111.6	152.1	172.6	-58.4	-174.4	0	0	0	109.9	M227 L231 R234 Q241 Y245 M368 I448	M227-L237 HydrophobicContact SD-CD1 4.35Å; L231-L237 HydrophobicContact CD2-CD1 4.15Å; L231-L237 HydrophobicContact CD2-CD2 4.5Å; L231-L237 HydrophobicContact CD2-CG 3.89Å; R234-L237 HydrophobicContact CB-CD2 4.31Å; L237-Q241 HydrophobicContact CB-CB 4.06Å; L237-Y245 HydrophobicContact CD1-CD2 3.8Å; L237-Y245 HydrophobicContact CD1-CE2 4.09Å; L237-M368 HydrophobicContact CB-CB 4.44Å; L237-M368 HydrophobicContact CD1-CB 4.33Å; L237-M368 HydrophobicContact CD1-CE 4.4Å; L237-M368 HydrophobicContact CD1-CG 4.01Å; L237-M368 HydrophobicContact CD1-SD 4.19Å; L237-M368 HydrophobicContact CG-CB 4.5Å; L237-M368 PolarHBondContact N-O 3.35Å; L237-I448 HydrophobicContact CD2-CD1 3.88Å
238	T	96.8	Very high	94.8	Very high	76 Å²	76	36.3 Å²	36.3	47%	0.466	19%	0.186	S	C	.	.			trans	-68.5	162	171.6	68.6	0	0	0	0	110.6	S240 Q241 T242	T238-S240 PolarHBondContact O-N 2.75Å; T238-Q241 VanDerWaalsContact N-OE1 3.12Å; T238-Q241 PolarHBondContact O-N 2.88Å; T238-Q241 WeakPolarHBondContact OG1-CG 3.43Å; T238-Q241 PolarHBondContact OG1-N 3.26Å; T238-Q241 PolarHBondContact OG1-OE1 2.84Å; T238-T242 WeakPolarHBondContact O-CB 3.44Å; T238-T242 PolarHBondContact O-N 3.37Å; T238-T242 PolarHBondContact O-OG1 3Å
239	E	96.5	Very high	95.1	Very high	62 Å²	62	35.6 Å²	35.6	29%	0.29	18%	0.182	S	C	.	.	H	α-helix	trans	-59.7	-36.5	176.6	-63.5	-152.2	151.3	0	0	112.4	T242 Q243 L369 S403 S406	E239-T242 PolarHBondContact O-N 3Å; E239-Q243 VanDerWaalsContact O-CB 3.27Å; E239-Q243 WeakPolarHBondContact O-CB 3.37Å; E239-Q243 PolarHBondContact O-N 3.06Å; E239-L369 HydrophobicContact CG-CD2 3.99Å; E239-S403 VanDerWaalsContact CD-OG 3.25Å; E239-S403 VanDerWaalsContact OE1-CB 3.28Å; E239-S403 WeakPolarHBondContact OE1-CB 3.36Å; E239-S403 PolarHBondContact OE1-N 2.91Å; E239-S403 PolarHBondContact OE1-OG 2.84Å; E239-S403 WeakPolarHBondContact OE2-CB 3.46Å; E239-S403 PolarHBondContact OE2-OG 3.08Å; E239-S406 WeakPolarHBondContact OE1-CB 3.33Å; E239-S406 PolarHBondContact OE1-OG 3.27Å; E239-S406 PolarHBondContact OE2-OG 3.36Å
240	S	96.4	Very high	95.5	Very high	84 Å²	84	35 Å²	35	59%	0.587	18%	0.178	S	C	*	.	H	α-helix	trans	-66.5	-42.1	176.6	175.4	0	0	0	0	112.3	T238 Q243 F244	T238-S240 PolarHBondContact O-N 2.75Å; S240-Q243 PolarHBondContact O-N 3.29Å; S240-F244 PolarHBondContact O-N 3.31Å
241	Q	97.4	Very high	95.6	Very high	26 Å²	26	34.4 Å²	34.4	12%	0.121	18%	0.176	C	C	.	.	H	α-helix	trans	-65.4	-42	174.6	-72.8	168.3	-17.9	0	0	111.5	L237 T238 F244 Y245 A447 I448	L237-Q241 HydrophobicContact CB-CB 4.06Å; T238-Q241 VanDerWaalsContact N-OE1 3.12Å; T238-Q241 PolarHBondContact O-N 2.88Å; T238-Q241 WeakPolarHBondContact OG1-CG 3.43Å; T238-Q241 PolarHBondContact OG1-N 3.26Å; T238-Q241 PolarHBondContact OG1-OE1 2.84Å; Q241-F244 PolarHBondContact O-N 3.19Å; Q241-Y245 WeakPolarHBondContact O-CD2 3.25Å; Q241-Y245 PolarHBondContact O-N 2.98Å; Q241-A447 HydrophobicContact CB-CB 4.45Å; Q241-A447 HydrophobicContact CG-CB 4.19Å; Q241-I448 HydrophobicContact CG-CD1 4.32Å; Q241-I448 HydrophobicContact CG-CG1 4.12Å
242	T	98	Very high	95.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-62.9	-44.6	176.3	-57.9	0	0	0	0	110.8	T238 E239 F244 Y245 I246 M365 M368 L369 F432	T238-T242 WeakPolarHBondContact O-CB 3.44Å; T238-T242 PolarHBondContact O-N 3.37Å; T238-T242 PolarHBondContact O-OG1 3Å; E239-T242 PolarHBondContact O-N 3Å; T242-F244 VanDerWaalsContact C-N 3.29Å; T242-F244 PolarHBondContact O-N 2.86Å; T242-Y245 PolarHBondContact O-N 3.35Å; T242-I246 HydrophobicContact CG2-CG1 3.78Å; T242-I246 VanDerWaalsContact O-CB 3.28Å; T242-I246 WeakPolarHBondContact O-CB 3.49Å; T242-I246 WeakPolarHBondContact O-CG1 3.31Å; T242-I246 PolarHBondContact O-N 2.9Å; T242-M365 HydrophobicContact CG2-CG 3.93Å; T242-M368 HydrophobicContact CG2-CB 4.03Å; T242-M368 HydrophobicContact CG2-SD 3.93Å; T242-L369 HydrophobicContact CG2-CD1 4.39Å; T242-L369 HydrophobicContact CG2-CD2 4.08Å; T242-L369 HydrophobicContact CG2-CG 4.05Å; T242-L369 WeakPolarHBondContact OG1-CD2 2.94Å; T242-F432 HydrophobicContact CG2-CZ 4.24Å
243	Q	98.1	Very high	96	Very high	29 Å²	29	32.9 Å²	32.9	14%	0.136	17%	0.168	C	C	.	.	H	α-helix	trans	-55.5	-45.2	177.5	-176.3	-168.3	73.1	0	0	111.4	E239 S240 A247 F432 F433 V436	E239-Q243 VanDerWaalsContact O-CB 3.27Å; E239-Q243 WeakPolarHBondContact O-CB 3.37Å; E239-Q243 PolarHBondContact O-N 3.06Å; S240-Q243 PolarHBondContact O-N 3.29Å; Q243-A247 WeakPolarHBondContact O-CB 3.26Å; Q243-A247 PolarHBondContact O-N 2.99Å; Q243-F432 HydrophobicContact CB-CE1 3.88Å; Q243-F432 HydrophobicContact CB-CZ 3.77Å; Q243-F432 HydrophobicContact CG-CE1 4.13Å; Q243-F432 HydrophobicContact CG-CZ 4.41Å; Q243-F432 PolarHBondContact NE2-O 3.01Å; Q243-F433 HydrophobicContact CG-CD1 4.15Å; Q243-V436 HydrophobicContact CG-CG2 3.56Å
244	F	97.9	Very high	96.3	Very high	24 Å²	24	28.2 Å²	28.2	11%	0.105	15%	0.149	C	C	.	.	H	α-helix	trans	-60.3	-56.2	176.7	176.9	-93.7	0	0	0	112.2	S240 Q241 T242 I246 A247 E248 H278 I441 A446 A447	S240-F244 PolarHBondContact O-N 3.31Å; Q241-F244 PolarHBondContact O-N 3.19Å; T242-F244 VanDerWaalsContact C-N 3.29Å; T242-F244 PolarHBondContact O-N 2.86Å; F244-I246 PolarHBondContact O-N 3.25Å; F244-A247 PolarHBondContact O-N 3.45Å; F244-E248 HydrophobicContact CE1-CG 4.27Å; F244-E248 HydrophobicContact CE2-CG 4.44Å; F244-E248 HydrophobicContact CZ-CG 4.12Å; F244-E248 PolarHBondContact O-N 3.4Å; F244-H278 AromaticContact CZ-CE1 3.87Å; F244-H278 AromaticContact CZ-ND1 3.61Å; F244-I441 HydrophobicContact CD2-CD1 4.1Å; F244-I441 HydrophobicContact CD2-CG1 3.98Å; F244-I441 HydrophobicContact CE2-CD1 4.26Å; F244-I441 HydrophobicContact CE2-CG1 3.72Å; F244-A446 HydrophobicContact CE1-CB 3.88Å; F244-A446 VanDerWaalsContact CZ-CA 3.49Å; F244-A446 HydrophobicContact CZ-CB 3.78Å; F244-A447 HydrophobicContact CB-CB 3.63Å; F244-A447 HydrophobicContact CD1-CB 3.66Å; F244-A447 HydrophobicContact CD2-CB 4.37Å; F244-A447 HydrophobicContact CE1-CB 4.46Å; F244-A447 HydrophobicContact CG-CB 3.62Å
245	Y	98.3	Very high	96.3	Very high	1 Å²	1	23.7 Å²	23.7	0%	0.004	14%	0.135	C	C	.	.	H	α-helix	trans	-68.3	-36.3	-175.8	-68.9	-57.1	0	0	0	113.4	M227 L230 L237 Q241 T242 T249 L273 I279 I448	M227-Y245 HydrophobicContact CE-CD1 3.58Å; M227-Y245 HydrophobicContact CE-CD2 3.8Å; M227-Y245 HydrophobicContact CE-CE1 3.88Å; M227-Y245 HydrophobicContact CE-CE2 4.08Å; M227-Y245 HydrophobicContact CE-CG 3.53Å; L230-Y245 HydrophobicContact CD2-CE2 4.22Å; L237-Y245 HydrophobicContact CD1-CD2 3.8Å; L237-Y245 HydrophobicContact CD1-CE2 4.09Å; Q241-Y245 WeakPolarHBondContact O-CD2 3.25Å; Q241-Y245 PolarHBondContact O-N 2.98Å; T242-Y245 PolarHBondContact O-N 3.35Å; Y245-T249 WeakPolarHBondContact O-CB 3.34Å; Y245-T249 PolarHBondContact O-N 3.22Å; Y245-T249 PolarHBondContact O-OG1 3.21Å; Y245-L273 HydrophobicContact CD1-CD2 4.44Å; Y245-L273 HydrophobicContact CE1-CD2 3.81Å; Y245-I279 HydrophobicContact CD1-CD1 3.9Å; Y245-I279 HydrophobicContact CD1-CG1 3.87Å; Y245-I279 HydrophobicContact CE1-CD1 4.5Å; Y245-I448 HydrophobicContact CE2-CD1 3.98Å; Y245-I448 HydrophobicContact CE2-CG1 4.26Å; Y245-I448 WeakPolarHBondContact OH-CB 3.5Å
246	I	98.3	Very high	96.3	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-66.6	-43.7	174.8	-64.7	-60	0	0	0	109.9	T242 F244 E248 T249 V250 L361 I364 M365 M368 F433	T242-I246 HydrophobicContact CG2-CG1 3.78Å; T242-I246 VanDerWaalsContact O-CB 3.28Å; T242-I246 WeakPolarHBondContact O-CB 3.49Å; T242-I246 WeakPolarHBondContact O-CG1 3.31Å; T242-I246 PolarHBondContact O-N 2.9Å; F244-I246 PolarHBondContact O-N 3.25Å; I246-E248 PolarHBondContact O-N 2.9Å; I246-T249 PolarHBondContact O-N 3Å; I246-V250 HydrophobicContact CG2-CG2 4.45Å; I246-V250 VanDerWaalsContact O-CG2 3.28Å; I246-V250 WeakPolarHBondContact O-CG2 3.42Å; I246-V250 PolarHBondContact O-N 3.25Å; I246-L361 HydrophobicContact CD1-CD1 3.66Å; I246-L361 HydrophobicContact CD1-CG 4.36Å; I246-L361 HydrophobicContact CG2-CD1 4.24Å; I246-L361 HydrophobicContact CG2-CD2 4.24Å; I246-L361 HydrophobicContact CG2-CG 4.32Å; I246-I364 HydrophobicContact CD1-CG2 4.34Å; I246-M365 HydrophobicContact CD1-CB 3.71Å; I246-M365 HydrophobicContact CD1-CG 4.3Å; I246-M365 HydrophobicContact CG1-CB 4.05Å; I246-M365 HydrophobicContact CG1-CG 4.07Å; I246-M368 HydrophobicContact CD1-CE 4.47Å; I246-M368 HydrophobicContact CD1-SD 3.86Å; I246-M368 HydrophobicContact CG1-SD 4.09Å; I246-F433 HydrophobicContact CB-CE1 4.38Å; I246-F433 HydrophobicContact CG2-CE1 3.9Å; I246-F433 HydrophobicContact CG2-CZ 3.69Å
247	A	98.2	Very high	96.1	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-60.6	-45.3	176.6	0	0	0	0	0	112.5	Q243 F244 T249 V250 L251 F433 V436 W438 I441	Q243-A247 WeakPolarHBondContact O-CB 3.26Å; Q243-A247 PolarHBondContact O-N 2.99Å; F244-A247 PolarHBondContact O-N 3.45Å; A247-T249 VanDerWaalsContact C-N 3.33Å; A247-T249 PolarHBondContact O-N 2.75Å; A247-V250 WeakPolarHBondContact O-CB 3.43Å; A247-V250 PolarHBondContact O-N 3.37Å; A247-L251 PolarHBondContact O-N 3Å; A247-L251 VanDerWaalsContact O-N 3.15Å; A247-F433 HydrophobicContact CB-CD1 4.2Å; A247-F433 HydrophobicContact CB-CE1 4.12Å; A247-V436 HydrophobicContact CB-CG1 3.78Å; A247-V436 HydrophobicContact CB-CG2 4.11Å; A247-W438 HydrophobicContact CB-CE3 4.46Å; A247-W438 HydrophobicContact CB-CH2 3.76Å; A247-W438 HydrophobicContact CB-CZ2 4.43Å; A247-W438 HydrophobicContact CB-CZ3 3.77Å; A247-W438 WeakPolarHBondContact O-CZ3 3.27Å; A247-I441 HydrophobicContact CB-CD1 3.69Å
248	E	98	Very high	95.6	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-61.9	-41.5	174.4	-73.5	-151.3	141.5	0	0	112.5	W201 F244 I246 V250 L251 A252 H278 I279 I441 R442	W201-E248 HydrophobicContact CH2-CB 4.43Å; W201-E248 HydrophobicContact CH2-CG 4.25Å; W201-E248 HydrophobicContact CZ3-CB 3.79Å; W201-E248 HydrophobicContact CZ3-CG 3.95Å; F244-E248 HydrophobicContact CE1-CG 4.27Å; F244-E248 HydrophobicContact CE2-CG 4.44Å; F244-E248 HydrophobicContact CZ-CG 4.12Å; F244-E248 PolarHBondContact O-N 3.4Å; I246-E248 PolarHBondContact O-N 2.9Å; E248-V250 VanDerWaalsContact C-N 3.3Å; E248-V250 PolarHBondContact O-N 2.97Å; E248-L251 PolarHBondContact O-N 3.25Å; E248-A252 WeakPolarHBondContact O-CB 3.38Å; E248-A252 PolarHBondContact O-N 2.82Å; E248-H278 IonicContact OE1-CE1 3.04Å; E248-H278 IonicContact OE1-CG 3.96Å; E248-H278 IonicContact OE1-ND1 3.25Å; E248-H278 PolarHBondContact OE1-ND1 3.36Å; E248-H278 WeakPolarHBondContact OE2-CA 3.27Å; E248-H278 IonicContact OE2-ND1 3.48Å; E248-I279 HydrophobicContact CB-CB 4.08Å; E248-I279 HydrophobicContact CB-CG1 4.05Å; E248-I279 PolarHBondContact OE2-N 3.09Å; E248-I441 HydrophobicContact CG-CD1 3.62Å; E248-I441 HydrophobicContact CG-CG1 3.95Å; E248-R442 IonicContact OE1-NH1 2.75Å
249	T	97.9	Very high	94.9	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-66.2	-34.4	178	-52.9	0	0	0	0	111.4	Y245 I246 A247 A252 I253 L271 L361	Y245-T249 WeakPolarHBondContact O-CB 3.34Å; Y245-T249 PolarHBondContact O-N 3.22Å; Y245-T249 PolarHBondContact O-OG1 3.21Å; I246-T249 PolarHBondContact O-N 3Å; A247-T249 VanDerWaalsContact C-N 3.33Å; A247-T249 PolarHBondContact O-N 2.75Å; T249-A252 PolarHBondContact O-N 2.73Å; T249-I253 HydrophobicContact CG2-CD1 3.89Å; T249-I253 HydrophobicContact CG2-CG1 4.25Å; T249-I253 WeakPolarHBondContact O-CB 3.45Å; T249-I253 WeakPolarHBondContact O-CG1 3.38Å; T249-I253 PolarHBondContact O-N 2.88Å; T249-L271 HydrophobicContact CG2-CD1 4.22Å; T249-L271 HydrophobicContact CG2-CD2 3.95Å; T249-L361 HydrophobicContact CG2-CD1 3.6Å
250	V	97.8	Very high	94.2	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-59.7	-47.7	172.4	168.9	0	0	0	0	111	I246 A247 E248 A252 I253 D254 W358 L361 I424 I427 W438	I246-V250 HydrophobicContact CG2-CG2 4.45Å; I246-V250 VanDerWaalsContact O-CG2 3.28Å; I246-V250 WeakPolarHBondContact O-CG2 3.42Å; I246-V250 PolarHBondContact O-N 3.25Å; A247-V250 WeakPolarHBondContact O-CB 3.43Å; A247-V250 PolarHBondContact O-N 3.37Å; E248-V250 VanDerWaalsContact C-N 3.3Å; E248-V250 PolarHBondContact O-N 2.97Å; V250-A252 VanDerWaalsContact C-N 3.29Å; V250-A252 PolarHBondContact O-N 3.03Å; V250-I253 PolarHBondContact O-N 3.14Å; V250-D254 VanDerWaalsContact O-CB 3.31Å; V250-D254 WeakPolarHBondContact O-CB 3.38Å; V250-D254 PolarHBondContact O-N 2.87Å; V250-W358 HydrophobicContact CB-CZ3 4.3Å; V250-W358 HydrophobicContact CG1-CH2 4.21Å; V250-W358 HydrophobicContact CG1-CZ3 4.14Å; V250-W358 HydrophobicContact CG2-CZ3 4.16Å; V250-L361 HydrophobicContact CG2-CD2 3.5Å; V250-L361 VanDerWaalsContact CG2-CD2 3.5Å; V250-I424 HydrophobicContact CG1-CD1 4.17Å; V250-I424 HydrophobicContact CG1-CG1 3.98Å; V250-I427 HydrophobicContact CG1-CG2 4.02Å; V250-I427 HydrophobicContact CG2-CG2 3.77Å; V250-W438 HydrophobicContact CB-CH2 4.31Å; V250-W438 HydrophobicContact CB-CZ3 4.1Å; V250-W438 HydrophobicContact CG1-CH2 4.23Å; V250-W438 HydrophobicContact CG1-CZ3 4.04Å
251	L	96.7	Very high	93.6	Very high	15 Å²	15	22.8 Å²	22.8	8%	0.079	13%	0.125	C	C	.	.	H	α-helix	trans	-62.3	-39.5	176.7	-66.3	174.4	0	0	0	111.6	W201 A247 E248 S255 I424 W438 I441	W201-L251 HydrophobicContact CD2-CB 4.16Å; W201-L251 HydrophobicContact CE3-CB 4.45Å; W201-L251 HydrophobicContact CH2-CB 3.97Å; W201-L251 HydrophobicContact CH2-CD1 3.6Å; W201-L251 HydrophobicContact CH2-CG 4.43Å; W201-L251 HydrophobicContact CZ2-CB 3.64Å; W201-L251 HydrophobicContact CZ2-CD1 3.47Å; W201-L251 VanDerWaalsContact CZ2-CD1 3.47Å; W201-L251 HydrophobicContact CZ2-CG 4.18Å; W201-L251 HydrophobicContact CZ3-CB 4.35Å; A247-L251 PolarHBondContact O-N 3Å; A247-L251 VanDerWaalsContact O-N 3.15Å; E248-L251 PolarHBondContact O-N 3.25Å; L251-S255 WeakPolarHBondContact O-CB 3.45Å; L251-S255 PolarHBondContact O-N 3.38Å; L251-I424 HydrophobicContact CD2-CD1 4.06Å; L251-W438 HydrophobicContact CD1-CE3 4.21Å; L251-W438 HydrophobicContact CD2-CE3 3.91Å; L251-W438 HydrophobicContact CD2-CZ3 4.39Å; L251-W438 HydrophobicContact CG-CE3 3.96Å; L251-W438 HydrophobicContact CG-CZ3 4.17Å; L251-I441 HydrophobicContact CD1-CG2 3.53Å
252	A	95.1	Very high	93	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-65.5	-47.6	178.9	0	0	0	0	0	112.8	W201 E248 T249 V250 S255 I256 L281	W201-A252 HydrophobicContact CB-CB 3.7Å; W201-A252 HydrophobicContact CD2-CB 4.32Å; W201-A252 HydrophobicContact CE3-CB 4.13Å; W201-A252 HydrophobicContact CG-CB 4.18Å; E248-A252 WeakPolarHBondContact O-CB 3.38Å; E248-A252 PolarHBondContact O-N 2.82Å; T249-A252 PolarHBondContact O-N 2.73Å; V250-A252 VanDerWaalsContact C-N 3.29Å; V250-A252 PolarHBondContact O-N 3.03Å; A252-S255 PolarHBondContact O-N 3.02Å; A252-S255 PolarHBondContact O-OG 3.22Å; A252-I256 PolarHBondContact O-N 3.43Å; A252-L281 HydrophobicContact CB-CD1 3.75Å; A252-L281 HydrophobicContact CB-CD2 4.27Å; A252-L281 HydrophobicContact CB-CG 3.76Å
253	I	94.5	Very high	92.5	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62.9	-47.2	177	-68.9	171	0	0	0	110.7	T249 V250 S255 I256 H257 I266 D357 W358 L361	T249-I253 HydrophobicContact CG2-CD1 3.89Å; T249-I253 HydrophobicContact CG2-CG1 4.25Å; T249-I253 WeakPolarHBondContact O-CB 3.45Å; T249-I253 WeakPolarHBondContact O-CG1 3.38Å; T249-I253 PolarHBondContact O-N 2.88Å; V250-I253 PolarHBondContact O-N 3.14Å; I253-S255 VanDerWaalsContact C-N 3.27Å; I253-S255 PolarHBondContact O-N 2.82Å; I253-I256 WeakPolarHBondContact O-CG1 3.46Å; I253-I256 PolarHBondContact O-N 3.27Å; I253-H257 WeakPolarHBondContact CG2-CE1 3.33Å; I253-H257 WeakPolarHBondContact CG2-NE2 3.43Å; I253-H257 PolarHBondContact O-CD2 3.25Å; I253-H257 PolarHBondContact O-N 3.47Å; I253-I266 HydrophobicContact CD1-CD1 4.23Å; I253-I266 HydrophobicContact CD1-CG1 4.23Å; I253-I266 HydrophobicContact CD1-CG2 4.28Å; I253-I266 HydrophobicContact CG1-CD1 4Å; I253-I266 HydrophobicContact CG1-CG1 4.41Å; I253-D357 HydrophobicContact CD1-CB 4.46Å; I253-D357 HydrophobicContact CG2-CB 3.9Å; I253-W358 HydrophobicContact CB-CH2 3.89Å; I253-W358 HydrophobicContact CB-CZ3 3.92Å; I253-W358 HydrophobicContact CD1-CE3 4.35Å; I253-W358 HydrophobicContact CD1-CZ3 4.21Å; I253-W358 HydrophobicContact CG2-CD2 4.35Å; I253-W358 HydrophobicContact CG2-CE3 4.14Å; I253-W358 HydrophobicContact CG2-CH2 3.58Å; I253-W358 HydrophobicContact CG2-CZ2 3.81Å; I253-W358 HydrophobicContact CG2-CZ3 3.76Å; I253-L361 HydrophobicContact CD1-CB 4.33Å
254	D	94.2	Very high	92	Very high	20 Å²	20	26.9 Å²	26.9	11%	0.107	14%	0.142	C	C	.	.	H	α-helix	trans	-59.9	-39.1	177.9	175.8	65	0	0	0	111.8	V250 I256 H257 K258 W358 I424	V250-D254 VanDerWaalsContact O-CB 3.31Å; V250-D254 WeakPolarHBondContact O-CB 3.38Å; V250-D254 PolarHBondContact O-N 2.87Å; D254-I256 VanDerWaalsContact C-N 3.34Å; D254-I256 PolarHBondContact O-N 3.16Å; D254-H257 PolarHBondContact O-N 2.86Å; D254-K258 WeakPolarHBondContact O-CB 3.32Å; D254-K258 WeakPolarHBondContact O-CG 3.38Å; D254-K258 PolarHBondContact O-N 3.41Å; D254-K258 WeakPolarHBondContact OD1-CE 3.46Å; D254-K258 IonicContact OD1-NZ 3.18Å; D254-K258 WeakPolarHBondContact OD2-CE 3.39Å; D254-K258 IonicContact OD2-NZ 3.76Å; D254-K258 PolarHBondContact OD2-NZ 3.36Å; D254-W358 HydrophobicContact CB-CH2 4.39Å; D254-I424 HydrophobicContact CB-CB 4.35Å; D254-I424 HydrophobicContact CB-CD1 3.72Å; D254-I424 WeakPolarHBondContact OD2-CD1 3.29Å
255	S	91.5	Very high	91.5	Very high	18 Å²	18	26.1 Å²	26.1	13%	0.126	14%	0.139	C	C	.	.	H	α-helix	trans	-60.7	-40.7	179.4	79.7	0	0	0	0	112.7	N199 L251 A252 I253 M259	N199-S255 WeakPolarHBondContact ND2-CB 3.48Å; N199-S255 PolarHBondContact ND2-OG 3.41Å; L251-S255 WeakPolarHBondContact O-CB 3.45Å; L251-S255 PolarHBondContact O-N 3.38Å; A252-S255 PolarHBondContact O-N 3.02Å; A252-S255 PolarHBondContact O-OG 3.22Å; I253-S255 VanDerWaalsContact C-N 3.27Å; I253-S255 PolarHBondContact O-N 2.82Å; S255-M259 WeakPolarHBondContact O-CG 3.47Å; S255-M259 PolarHBondContact O-N 3.47Å
256	I	89.1	Confident	91.2	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-78.5	-31.8	178.3	59.5	168.9	0	0	0	112	V202 A252 I253 D254 M259 G260 F261 H263 L281 F284	V202-I256 HydrophobicContact CG2-CG2 3.71Å; A252-I256 PolarHBondContact O-N 3.43Å; I253-I256 WeakPolarHBondContact O-CG1 3.46Å; I253-I256 PolarHBondContact O-N 3.27Å; D254-I256 VanDerWaalsContact C-N 3.34Å; D254-I256 PolarHBondContact O-N 3.16Å; I256-M259 WeakPolarHBondContact O-CB 3.45Å; I256-M259 PolarHBondContact O-N 3.15Å; I256-G260 PolarHBondContact O-N 3.14Å; I256-F261 CarbonylContact C-O 3.6Å; I256-F261 PolarHBondContact O-N 3.02Å; I256-H263 HydrophobicContact CD1-CB 3.68Å; I256-L281 HydrophobicContact CD1-CD1 3.82Å; I256-L281 HydrophobicContact CG1-CD1 4.36Å; I256-L281 HydrophobicContact CG2-CD1 4.38Å; I256-F284 HydrophobicContact CD1-CE1 4.4Å; I256-F284 HydrophobicContact CG2-CE1 3.97Å
257	H	89.8	Confident	91	Very high	24 Å²	24	26.6 Å²	26.6	11%	0.111	14%	0.141	C	C	.	.	H	α-helix	trans	-63.9	-42.4	173.6	-73.6	-170.9	0	0	0	111.3	I253 D254 M259 G260 F261 N354 D357	I253-H257 WeakPolarHBondContact CG2-CE1 3.33Å; I253-H257 WeakPolarHBondContact CG2-NE2 3.43Å; I253-H257 PolarHBondContact O-CD2 3.25Å; I253-H257 PolarHBondContact O-N 3.47Å; D254-H257 PolarHBondContact O-N 2.86Å; H257-M259 PolarHBondContact O-N 3.01Å; H257-G260 WeakPolarHBondContact O-CA 3.49Å; H257-G260 PolarHBondContact O-N 3.32Å; H257-F261 WeakPolarHBondContact CA-O 3.13Å; H257-F261 PolarHBondContact CD2-O 3.39Å; H257-N354 PolarHBondContact CE1-O 3.18Å; H257-N354 PolarHBondContact ND1-ND2 2.76Å; H257-D357 IonicContact CD2-OD2 3.87Å; H257-D357 IonicContact CE1-OD2 3.48Å; H257-D357 IonicContact NE2-OD2 3.84Å; H257-D357 PolarHBondContact NE2-OD2 3.3Å
258	K	88	Confident	90.7	Very high	147 Å²	147	26.6 Å²	26.6	64%	0.639	14%	0.141	S	C	*	.	H	α-helix	trans	-61.9	-27.5	173.9	-77.3	172.5	174.5	164.4	0	113.3	D254 G260	D254-K258 WeakPolarHBondContact O-CB 3.32Å; D254-K258 WeakPolarHBondContact O-CG 3.38Å; D254-K258 PolarHBondContact O-N 3.41Å; D254-K258 WeakPolarHBondContact OD1-CE 3.46Å; D254-K258 IonicContact OD1-NZ 3.18Å; D254-K258 WeakPolarHBondContact OD2-CE 3.39Å; D254-K258 IonicContact OD2-NZ 3.76Å; D254-K258 PolarHBondContact OD2-NZ 3.36Å; K258-G260 PolarHBondContact O-N 2.77Å
259	M	81.2	Confident	90.3	Very high	66 Å²	66	28.2 Å²	28.2	33%	0.325	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-1.5	173.1	-67.1	171.2	68.7	0	0	113.2	K196 A197 S255 I256 H257 F261	K196-M259 HydrophobicContact CB-CE 4.24Å; A197-M259 HydrophobicContact CB-CE 4.04Å; S255-M259 WeakPolarHBondContact O-CG 3.47Å; S255-M259 PolarHBondContact O-N 3.47Å; I256-M259 WeakPolarHBondContact O-CB 3.45Å; I256-M259 PolarHBondContact O-N 3.15Å; H257-M259 PolarHBondContact O-N 3.01Å; M259-F261 HydrophobicContact CB-CD2 3.63Å; M259-F261 HydrophobicContact CB-CE2 3.95Å; M259-F261 HydrophobicContact CE-CE2 4.38Å; M259-F261 WeakPolarHBondContact O-CD2 3.42Å; M259-F261 WeakPolarHBondContact O-CE2 3.32Å
260	G	82.3	Confident	90.1	Very high	67 Å²	67	28.2 Å²	28.2	69%	0.691	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	86.3	17.1	179.5	0	0	0	0	0	114.4	I256 H257 K258	I256-G260 PolarHBondContact O-N 3.14Å; H257-G260 WeakPolarHBondContact O-CA 3.49Å; H257-G260 PolarHBondContact O-N 3.32Å; K258-G260 PolarHBondContact O-N 2.77Å
261	F	82.4	Confident	90	Very high	42 Å²	42	28.2 Å²	28.2	18%	0.184	15%	0.15	C	C	.	.			trans	-110.8	143.9	-178.6	-60.5	-79.1	0	0	0	111.8	I193 I256 H257 M259	I193-F261 HydrophobicContact CD1-CB 3.94Å; I193-F261 HydrophobicContact CD1-CD1 3.44Å; I193-F261 VanDerWaalsContact CD1-CD1 3.44Å; I193-F261 HydrophobicContact CD1-CD2 4.28Å; I193-F261 HydrophobicContact CD1-CE1 3.92Å; I193-F261 HydrophobicContact CD1-CG 3.63Å; I193-F261 HydrophobicContact CG1-CB 4.24Å; I193-F261 HydrophobicContact CG1-CD1 3.32Å; I193-F261 HydrophobicContact CG1-CD2 3.63Å; I193-F261 HydrophobicContact CG1-CE1 3.34Å; I193-F261 HydrophobicContact CG1-CE2 3.66Å; I193-F261 HydrophobicContact CG1-CG 3.45Å; I193-F261 VanDerWaalsContact CG1-CG 3.45Å; I193-F261 HydrophobicContact CG1-CZ 3.5Å; I256-F261 CarbonylContact C-O 3.6Å; I256-F261 PolarHBondContact O-N 3.02Å; H257-F261 WeakPolarHBondContact CA-O 3.13Å; H257-F261 PolarHBondContact CD2-O 3.39Å; M259-F261 HydrophobicContact CB-CD2 3.63Å; M259-F261 HydrophobicContact CB-CE2 3.95Å; M259-F261 HydrophobicContact CE-CE2 4.38Å; M259-F261 WeakPolarHBondContact O-CD2 3.42Å; M259-F261 WeakPolarHBondContact O-CE2 3.32Å
262	I	85.4	Confident	89.9	Confident	56 Å²	56	29.1 Å²	29.1	29%	0.287	15%	0.154	S	C	.	.			trans	-113.5	128	171.3	-49.8	174.3	0	0	0	107.2	R264 N354 D357	I262-R264 HydrophobicContact CB-CG 4.02Å; I262-R264 HydrophobicContact CG2-CG 3.56Å; I262-R264 PolarHBondContact O-NE 3.29Å; I262-N354 HydrophobicContact CD1-CB 4.06Å; I262-N354 HydrophobicContact CG1-CB 3.83Å; I262-N354 HydrophobicContact CG2-CB 4.37Å; I262-D357 WeakPolarHBondContact CG2-OD2 3.34Å
263	H	87.7	Confident	90	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.009	16%	0.156	C	C	.	.			trans	-71	-48	-173.4	-166.4	-79.1	0	0	0	112.1	I256 D265 I266 S282 F284 T288 D357	I256-H263 HydrophobicContact CD1-CB 3.68Å; H263-D265 PolarHBondContact CE1-O 3.4Å; H263-D265 VanDerWaalsContact CE1-O 3.25Å; H263-D265 VanDerWaalsContact ND1-C 3.26Å; H263-D265 PolarHBondContact ND1-N 3.14Å; H263-D265 PolarHBondContact ND1-O 3.37Å; H263-D265 PolarHBondContact O-N 3.43Å; H263-I266 HydrophobicContact CB-CD1 3.66Å; H263-I266 HydrophobicContact CB-CG1 3.75Å; H263-I266 PolarHBondContact ND1-N 3.06Å; H263-S282 PolarHBondContact NE2-O 3.29Å; H263-S282 VanDerWaalsContact NE2-O 3.15Å; H263-F284 AromaticContact CD2-CD1 3.6Å; H263-F284 AromaticContact CD2-CE1 3.85Å; H263-F284 AromaticContact NE2-CD1 3.94Å; H263-T288 WeakPolarHBondContact O-CG2 3.43Å; H263-D357 WeakPolarHBondContact CB-OD2 3.49Å; H263-D357 PolarHBondContact N-OD2 3.09Å
264	R	87.5	Confident	90	Very high	83 Å²	83	30.6 Å²	30.6	31%	0.313	16%	0.162	S	C	.	.			trans	67.4	-12.3	175.6	-53.2	175.2	-86.1	164.6	-6	116.6	I262 T288 Y352 D357	I262-R264 HydrophobicContact CB-CG 4.02Å; I262-R264 HydrophobicContact CG2-CG 3.56Å; I262-R264 PolarHBondContact O-NE 3.29Å; R264-T288 HydrophobicContact CB-CG2 3.46Å; R264-T288 VanDerWaalsContact CB-CG2 3.46Å; R264-Y352 WeakPolarHBondContact CD-OH 3.36Å; R264-Y352 HydrophobicContact CG-CE2 3.93Å; R264-D357 WeakPolarHBondContact CA-OD1 3.43Å; R264-D357 PolarHBondContact N-OD1 3.23Å
265	D	87.5	Confident	90	Very high	7 Å²	7	32 Å²	32	4%	0.037	18%	0.176	C	C	.	.			trans	-127.8	49.9	172.5	-161.9	30.4	0	0	0	110.9	H263 K267 N270 C287 T288 H294	H263-D265 PolarHBondContact CE1-O 3.4Å; H263-D265 VanDerWaalsContact CE1-O 3.25Å; H263-D265 VanDerWaalsContact ND1-C 3.26Å; H263-D265 PolarHBondContact ND1-N 3.14Å; H263-D265 PolarHBondContact ND1-O 3.37Å; H263-D265 PolarHBondContact O-N 3.43Å; D265-K267 PolarHBondContact O-N 2.52Å; D265-K267 WeakPolarHBondContact OD1-CD 3.3Å; D265-K267 WeakPolarHBondContact OD1-CE 3.34Å; D265-K267 IonicContact OD1-NZ 2.74Å; D265-K267 WeakPolarHBondContact OD2-CE 3.37Å; D265-K267 IonicContact OD2-NZ 3.02Å; D265-K267 PolarHBondContact OD2-NZ 3.21Å; D265-N270 PolarHBondContact O-ND2 2.9Å; D265-N270 PolarHBondContact OD2-ND2 2.88Å; D265-C287 WeakPolarHBondContact OD2-CB 3.44Å; D265-T288 HydrophobicContact CB-CG2 3.43Å; D265-T288 VanDerWaalsContact CB-CG2 3.43Å; D265-H294 IonicContact OD1-CE1 3.83Å
266	I	93.3	Very high	90.1	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.201	C	C	.	.			trans	-74.6	119.9	175.1	-67.2	-66.6	0	0	0	108.7	I253 H263 L281 Y341 D357 S360 I364	I253-I266 HydrophobicContact CD1-CD1 4.23Å; I253-I266 HydrophobicContact CD1-CG1 4.23Å; I253-I266 HydrophobicContact CD1-CG2 4.28Å; I253-I266 HydrophobicContact CG1-CD1 4Å; I253-I266 HydrophobicContact CG1-CG1 4.41Å; H263-I266 HydrophobicContact CB-CD1 3.66Å; H263-I266 HydrophobicContact CB-CG1 3.75Å; H263-I266 PolarHBondContact ND1-N 3.06Å; I266-L281 HydrophobicContact CD1-CD2 4.07Å; I266-Y341 WeakPolarHBondContact O-CB 3.5Å; I266-D357 HydrophobicContact CG1-CB 4.08Å; I266-S360 WeakPolarHBondContact O-CB 3.16Å; I266-I364 HydrophobicContact CG2-CD1 3.59Å
267	K	92.3	Very high	90.4	Very high	12 Å²	12	38.3 Å²	38.3	5%	0.052	20%	0.201	C	C	.	.	S	Bend	trans	-166.3	162.1	-176.4	53.2	178.5	-175.1	169	0	109.2	D265 D269 N270 Y341	D265-K267 PolarHBondContact O-N 2.52Å; D265-K267 WeakPolarHBondContact OD1-CD 3.3Å; D265-K267 WeakPolarHBondContact OD1-CE 3.34Å; D265-K267 IonicContact OD1-NZ 2.74Å; D265-K267 WeakPolarHBondContact OD2-CE 3.37Å; D265-K267 IonicContact OD2-NZ 3.02Å; D265-K267 PolarHBondContact OD2-NZ 3.21Å; K267-D269 VanDerWaalsContact C-N 3.32Å; K267-D269 WeakPolarHBondContact CD-OD1 3.45Å; K267-D269 VanDerWaalsContact CE-OD1 3.27Å; K267-D269 WeakPolarHBondContact CE-OD1 3.41Å; K267-D269 WeakPolarHBondContact CE-OD2 3.41Å; K267-D269 WeakPolarHBondContact CG-OD1 3.39Å; K267-D269 IonicContact NZ-OD1 4Å; K267-D269 IonicContact NZ-OD2 2.75Å; K267-D269 PolarHBondContact NZ-OD2 2.96Å; K267-D269 PolarHBondContact O-N 3.36Å; K267-N270 WeakPolarHBondContact CE-ND2 3.27Å; K267-N270 VanDerWaalsContact CE-OD1 3.28Å; K267-N270 WeakPolarHBondContact CE-OD1 2.88Å; K267-N270 HydrophobicContact CG-CB 4.28Å; K267-N270 PolarHBondContact O-N 3.06Å; K267-Y341 HydrophobicContact CB-CD1 4.28Å; K267-Y341 HydrophobicContact CB-CD2 3.6Å; K267-Y341 HydrophobicContact CB-CE2 3.92Å; K267-Y341 HydrophobicContact CB-CG 3.81Å
268	P	93.8	Very high	90.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-59.9	-31.9	-171.6	-27	36.9	0	0	0	115.7	M227 M228 L231 N270 L271 Y341 I364 E367	M227-P268 HydrophobicContact CB-CB 4.08Å; M227-P268 VanDerWaalsContact CB-O 3.31Å; M227-P268 WeakPolarHBondContact CB-O 3.37Å; M227-P268 HydrophobicContact CG-CB 4.15Å; M227-P268 PolarHBondContact N-O 2.73Å; M228-P268 HydrophobicContact CB-CB 3.91Å; M228-P268 PolarHBondContact N-O 3.3Å; L231-P268 HydrophobicContact CD1-CB 4.17Å; L231-P268 HydrophobicContact CD1-CG 4.13Å; P268-N270 PolarHBondContact O-N 3.05Å; P268-L271 PolarHBondContact O-N 2.75Å; P268-Y341 VanDerWaalsContact CD-CZ 3.43Å; P268-Y341 HydrophobicContact CG-CE1 4.12Å; P268-I364 HydrophobicContact CG-CG1 4.23Å; P268-E367 WeakPolarHBondContact CG-OE2 3.45Å
269	D	89.5	Confident	91.3	Very high	33 Å²	33	30.3 Å²	30.3	18%	0.176	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-69.2	-20.4	176.7	48.3	-46	0	0	0	113.5	M228 K267	M228-D269 HydrophobicContact CB-CB 4.26Å; M228-D269 HydrophobicContact CE-CB 3.76Å; M228-D269 VanDerWaalsContact CE-OD1 3.28Å; M228-D269 WeakPolarHBondContact CE-OD1 3.38Å; M228-D269 HydrophobicContact SD-CB 4.32Å; K267-D269 VanDerWaalsContact C-N 3.32Å; K267-D269 WeakPolarHBondContact CD-OD1 3.45Å; K267-D269 VanDerWaalsContact CE-OD1 3.27Å; K267-D269 WeakPolarHBondContact CE-OD1 3.41Å; K267-D269 WeakPolarHBondContact CE-OD2 3.41Å; K267-D269 WeakPolarHBondContact CG-OD1 3.39Å; K267-D269 IonicContact NZ-OD1 4Å; K267-D269 IonicContact NZ-OD2 2.75Å; K267-D269 PolarHBondContact NZ-OD2 2.96Å; K267-D269 PolarHBondContact O-N 3.36Å
270	N	92.1	Very high	91.9	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-96.7	4.1	177	-69.7	-1.3	0	0	0	113	D265 K267 P268 S282	D265-N270 PolarHBondContact O-ND2 2.9Å; D265-N270 PolarHBondContact OD2-ND2 2.88Å; K267-N270 WeakPolarHBondContact CE-ND2 3.27Å; K267-N270 VanDerWaalsContact CE-OD1 3.28Å; K267-N270 WeakPolarHBondContact CE-OD1 2.88Å; K267-N270 HydrophobicContact CG-CB 4.28Å; K267-N270 PolarHBondContact O-N 3.06Å; P268-N270 PolarHBondContact O-N 3.05Å; N270-S282 WeakPolarHBondContact CA-OG 3.28Å; N270-S282 PolarHBondContact O-N 3.2Å; N270-S282 PolarHBondContact O-OG 2.87Å
271	L	95.8	Very high	92.5	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	96.9	174.2	-58.9	-174.2	0	0	0	108.8	D226 M227 T249 P268 I279 L281 I364	D226-L271 CarbonylContact C-O 3.57Å; D226-L271 WeakPolarHBondContact CA-O 3.22Å; M227-L271 HydrophobicContact CB-CB 3.83Å; M227-L271 HydrophobicContact CB-CD1 4.48Å; M227-L271 PolarHBondContact N-O 3.14Å; T249-L271 HydrophobicContact CG2-CD1 4.22Å; T249-L271 HydrophobicContact CG2-CD2 3.95Å; P268-L271 PolarHBondContact O-N 2.75Å; L271-I279 HydrophobicContact CB-CD1 4.19Å; L271-I279 HydrophobicContact CD2-CG2 4.5Å; L271-L281 HydrophobicContact CD2-CD2 3.33Å; L271-I364 HydrophobicContact CD1-CD1 4.01Å; L271-I364 HydrophobicContact CD1-CG2 4.45Å
272	L	96.1	Very high	92.8	Very high	34 Å²	34	23.4 Å²	23.4	18%	0.178	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	154.8	-179.4	-57.3	-170.9	0	0	0	111.8	V203 L222 G225 D226 I279 K280	V203-L272 HydrophobicContact CG2-CD1 3.92Å; L222-L272 HydrophobicContact CB-CB 4.46Å; L222-L272 HydrophobicContact CD1-CB 3.54Å; L222-L272 HydrophobicContact CD1-CD1 3.98Å; L222-L272 HydrophobicContact CD1-CG 4.41Å; G225-L272 CarbonylContact O-C 3.6Å; G225-L272 WeakPolarHBondContact O-CA 2.98Å; D226-L272 HydrophobicContact CB-CD2 3.62Å; L272-I279 CarbonylContact O-C 3.55Å; L272-I279 WeakPolarHBondContact O-CA 3.34Å; L272-K280 PolarHBondContact N-O 3.49Å; L272-K280 PolarHBondContact O-N 3.36Å
273	L	96.6	Very high	92.4	Very high	5 Å²	5	22.6 Å²	22.6	3%	0.026	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	126.1	179.5	-61.9	172	0	0	0	110.4	L222 G224 G225 M227 L230 Y245 H278 I279	L222-L273 WeakPolarHBondContact CB-O 3.28Å; G224-L273 WeakPolarHBondContact CA-O 3.04Å; G224-L273 PolarHBondContact N-O 3.26Å; G225-L273 PolarHBondContact O-N 2.78Å; M227-L273 HydrophobicContact CE-CD2 4.27Å; L230-L273 HydrophobicContact CD2-CD1 3.8Å; Y245-L273 HydrophobicContact CD1-CD2 4.44Å; Y245-L273 HydrophobicContact CE1-CD2 3.81Å; L273-H278 WeakPolarHBondContact CA-O 3.43Å; L273-I279 HydrophobicContact CD2-CD1 3.63Å; L273-I279 HydrophobicContact CD2-CG1 4.34Å
274	D	94.5	Very high	91.6	Very high	25 Å²	25	22.7 Å²	22.7	13%	0.134	11%	0.114	C	C	.	.			trans	-71.3	179.5	173.9	76.4	9.3	0	0	0	112.6	L222 K276 G277 H278	L222-D274 HydrophobicContact CD2-CB 4.02Å; D274-K276 PolarHBondContact O-N 2.94Å; D274-K276 VanDerWaalsContact O-N 3.08Å; D274-K276 WeakPolarHBondContact OD1-CA 3.01Å; D274-K276 WeakPolarHBondContact OD1-CB 3.02Å; D274-K276 PolarHBondContact OD1-N 2.65Å; D274-G277 PolarHBondContact O-N 3.44Å; D274-G277 PolarHBondContact OD1-N 3.12Å; D274-H278 PolarHBondContact N-O 2.94Å; D274-H278 IonicContact OD1-CD2 3.57Å; D274-H278 PolarHBondContact OD1-N 3.18Å
275	A	93.8	Very high	90.2	Very high	49 Å²	49	19 Å²	19	41%	0.405	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-15.6	-179.8	0	0	0	0	0	114.5	P223 I452	P223-A275 HydrophobicContact CG-CB 3.78Å; A275-I452 HydrophobicContact CB-CD1 3.89Å
276	K	94.1	Very high	88.5	Confident	151 Å²	151	18.9 Å²	18.9	66%	0.657	10%	0.101	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-11	177.2	-66.4	178.3	-177.5	-179.6	0	112.4	D274 A446	D274-K276 PolarHBondContact O-N 2.94Å; D274-K276 VanDerWaalsContact O-N 3.08Å; D274-K276 WeakPolarHBondContact OD1-CA 3.01Å; D274-K276 WeakPolarHBondContact OD1-CB 3.02Å; D274-K276 PolarHBondContact OD1-N 2.65Å; K276-A446 VanDerWaalsContact O-CB 3.3Å; K276-A446 WeakPolarHBondContact O-CB 3.43Å
277	G	95.7	Very high	86.3	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.108	C	C	.	.	S	Bend	trans	94.7	15.9	-178.5	0	0	0	0	0	114.8	D274 A446	D274-G277 PolarHBondContact O-N 3.44Å; D274-G277 PolarHBondContact OD1-N 3.12Å; G277-A446 WeakPolarHBondContact O-CB 3.28Å
278	H	97.5	Very high	84.4	Confident	4 Å²	4	20 Å²	20	2%	0.019	11%	0.109	C	C	.	.			trans	-90.8	150.6	176.4	-64.1	-83.9	0	0	0	112.4	F244 E248 L273 D274 R442 R444	F244-H278 AromaticContact CZ-CE1 3.87Å; F244-H278 AromaticContact CZ-ND1 3.61Å; E248-H278 IonicContact OE1-CE1 3.04Å; E248-H278 IonicContact OE1-CG 3.96Å; E248-H278 IonicContact OE1-ND1 3.25Å; E248-H278 PolarHBondContact OE1-ND1 3.36Å; E248-H278 WeakPolarHBondContact OE2-CA 3.27Å; E248-H278 IonicContact OE2-ND1 3.48Å; L273-H278 WeakPolarHBondContact CA-O 3.43Å; D274-H278 PolarHBondContact N-O 2.94Å; D274-H278 IonicContact OD1-CD2 3.57Å; D274-H278 PolarHBondContact OD1-N 3.18Å; H278-R442 HydrophobicContact CB-CG 4.43Å; H278-R442 PolarHBondContact CE1-O 3.28Å; H278-R442 PolarHBondContact NE2-O 3.09Å; H278-R444 PolarHBondContact CE1-O 3.47Å; H278-R444 PolarHBondContact NE2-O 2.84Å
279	I	97.3	Very high	82.2	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	139.8	-176.6	-64.8	-74.1	0	0	0	111.7	M227 Y245 E248 L271 L272 L273 R442	M227-I279 HydrophobicContact CE-CD1 3.81Å; Y245-I279 HydrophobicContact CD1-CD1 3.9Å; Y245-I279 HydrophobicContact CD1-CG1 3.87Å; Y245-I279 HydrophobicContact CE1-CD1 4.5Å; E248-I279 HydrophobicContact CB-CB 4.08Å; E248-I279 HydrophobicContact CB-CG1 4.05Å; E248-I279 PolarHBondContact OE2-N 3.09Å; L271-I279 HydrophobicContact CB-CD1 4.19Å; L271-I279 HydrophobicContact CD2-CG2 4.5Å; L272-I279 CarbonylContact O-C 3.55Å; L272-I279 WeakPolarHBondContact O-CA 3.34Å; L273-I279 HydrophobicContact CD2-CD1 3.63Å; L273-I279 HydrophobicContact CD2-CG1 4.34Å; I279-R442 PolarHBondContact O-NH1 3.06Å; I279-R442 PolarHBondContact O-NH2 3.28Å
280	K	95.5	Very high	80.4	Confident	20 Å²	20	20 Å²	20	9%	0.087	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	134.8	161.6	-77.8	172.9	168.2	-86.8	0	109.6	P200 W201 V202 V203 E220 L222 L272	P200-K280 WeakPolarHBondContact O-CE 3.48Å; P200-K280 PolarHBondContact O-NZ 3.49Å; W201-K280 CarbonylContact O-C 3.53Å; W201-K280 WeakPolarHBondContact O-CA 3.31Å; V202-K280 PolarHBondContact O-NZ 3.43Å; V202-K280 VanDerWaalsContact O-NZ 3.09Å; V203-K280 HydrophobicContact CG2-CB 4.22Å; E220-K280 VanDerWaalsContact OE1-CE 3.32Å; E220-K280 WeakPolarHBondContact OE1-CE 3.35Å; E220-K280 IonicContact OE1-NZ 3.69Å; E220-K280 PolarHBondContact OE1-NZ 3.03Å; E220-K280 IonicContact OE2-NZ 2.81Å; L222-K280 HydrophobicContact CD1-CB 3.73Å; L222-K280 HydrophobicContact CD1-CD 3.63Å; L222-K280 HydrophobicContact CD1-CG 4.27Å; L222-K280 HydrophobicContact CD2-CD 3.74Å; L222-K280 HydrophobicContact CG-CD 4.34Å; L272-K280 PolarHBondContact N-O 3.49Å; L272-K280 PolarHBondContact O-N 3.36Å
281	L	93.9	Very high	78.9	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	133.9	173.7	-63	178.4	0	0	0	110.5	W201 V203 A252 I256 I266 L271 F284	W201-L281 PolarHBondContact O-N 2.84Å; V203-L281 WeakPolarHBondContact CG2-O 3.4Å; V203-L281 PolarHBondContact N-O 2.65Å; A252-L281 HydrophobicContact CB-CD1 3.75Å; A252-L281 HydrophobicContact CB-CD2 4.27Å; A252-L281 HydrophobicContact CB-CG 3.76Å; I256-L281 HydrophobicContact CD1-CD1 3.82Å; I256-L281 HydrophobicContact CG1-CD1 4.36Å; I256-L281 HydrophobicContact CG2-CD1 4.38Å; I266-L281 HydrophobicContact CD1-CD2 4.07Å; L271-L281 HydrophobicContact CD2-CD2 3.33Å; L281-F284 HydrophobicContact CB-CE1 3.83Å; L281-F284 HydrophobicContact CB-CZ 3.71Å; L281-F284 HydrophobicContact CD1-CE1 4.35Å; L281-F284 WeakPolarHBondContact O-CZ 3.09Å
282	S	88.9	Confident	77.4	Confident	10 Å²	10	27.2 Å²	27.2	7%	0.07	15%	0.146	C	C	.	.			trans	-117.3	169.9	169.9	65	0	0	0	0	111.2	H263 N270	H263-S282 PolarHBondContact NE2-O 3.29Å; H263-S282 VanDerWaalsContact NE2-O 3.15Å; N270-S282 WeakPolarHBondContact CA-OG 3.28Å; N270-S282 PolarHBondContact O-N 3.2Å; N270-S282 PolarHBondContact O-OG 2.87Å
283	D	78	Confident	75.9	Confident	39 Å²	39	25.6 Å²	25.6	21%	0.209	14%	0.138	C	C	.	.			trans	57	57.6	168	-70.8	2.5	0	0	0	115.5	K171 G285	K171-D283 IonicContact NZ-OD1 2.66Å; K171-D283 PolarHBondContact NZ-OD1 3.21Å; K171-D283 IonicContact NZ-OD2 3.35Å; D283-G285 PolarHBondContact O-N 3.12Å
284	F	69.5	Low	74.6	Confident	4 Å²	4	26.1 Å²	26.1	2%	0.018	14%	0.14	C	C	.	.			trans	-66.8	99.8	178.4	-57.8	-80	0	0	0	112.8	E190 I193 L194 V202 I256 H263 L281 L286	E190-F284 HydrophobicContact CB-CB 4.47Å; E190-F284 WeakPolarHBondContact CB-O 3.44Å; E190-F284 HydrophobicContact CG-CB 4.34Å; I193-F284 HydrophobicContact CB-CD2 4.5Å; I193-F284 HydrophobicContact CB-CG 4.38Å; I193-F284 HydrophobicContact CD1-CB 3.57Å; I193-F284 HydrophobicContact CD1-CD1 4.1Å; I193-F284 HydrophobicContact CD1-CG 3.88Å; I193-F284 HydrophobicContact CG2-CD1 4Å; I193-F284 HydrophobicContact CG2-CD2 3.97Å; I193-F284 HydrophobicContact CG2-CE1 4.18Å; I193-F284 HydrophobicContact CG2-CE2 4.17Å; I193-F284 HydrophobicContact CG2-CG 3.91Å; I193-F284 HydrophobicContact CG2-CZ 4.29Å; L194-F284 HydrophobicContact CD2-CD2 4.03Å; L194-F284 HydrophobicContact CD2-CE2 3.73Å; L194-F284 HydrophobicContact CG-CD2 4.21Å; L194-F284 HydrophobicContact CG-CE2 4.39Å; V202-F284 HydrophobicContact CB-CE2 4.44Å; V202-F284 HydrophobicContact CB-CZ 3.9Å; V202-F284 HydrophobicContact CG1-CE1 4.38Å; V202-F284 HydrophobicContact CG1-CE2 3.35Å; V202-F284 HydrophobicContact CG1-CZ 3.26Å; V202-F284 HydrophobicContact CG2-CE1 4.08Å; V202-F284 HydrophobicContact CG2-CZ 3.6Å; I256-F284 HydrophobicContact CD1-CE1 4.4Å; I256-F284 HydrophobicContact CG2-CE1 3.97Å; H263-F284 AromaticContact CD2-CD1 3.6Å; H263-F284 AromaticContact CD2-CE1 3.85Å; H263-F284 AromaticContact NE2-CD1 3.94Å; L281-F284 HydrophobicContact CB-CE1 3.83Å; L281-F284 HydrophobicContact CB-CZ 3.71Å; L281-F284 HydrophobicContact CD1-CE1 4.35Å; L281-F284 WeakPolarHBondContact O-CZ 3.09Å; F284-L286 PolarHBondContact O-N 3.26Å
285	G	57.7	Low	73.4	Confident	5 Å²	5	29.2 Å²	29.2	5%	0.052	15%	0.15	C	C	.	.	S	Bend	trans	70.2	-13.1	161	0	0	0	0	0	116.2	H186 D283 C287 T288	H186-G285 PolarHBondContact CD2-O 3.18Å; H186-G285 VanDerWaalsContact CD2-O 3.22Å; D283-G285 PolarHBondContact O-N 3.12Å; G285-C287 PolarHBondContact O-N 3.33Å; G285-T288 PolarHBondContact O-N 2.57Å; G285-T288 VanDerWaalsContact O-N 3.15Å; G285-T288 PolarHBondContact O-OG1 2.79Å
286	L	52.6	Low	72.2	Confident	5 Å²	5	28.4 Å²	28.4	3%	0.026	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-40.6	174	-89.8	-173	0	0	0	111.4	L173 M178 H186 V187 E190 F284 L290	L173-L286 HydrophobicContact CD1-CD1 3.55Å; M178-L286 HydrophobicContact SD-CD2 4.39Å; H186-L286 VanDerWaalsContact C-CD2 3.48Å; H186-L286 HydrophobicContact CB-CD2 3.84Å; V187-L286 HydrophobicContact CB-CD2 3.95Å; V187-L286 HydrophobicContact CG2-CD2 3.43Å; V187-L286 VanDerWaalsContact CG2-CD2 3.43Å; E190-L286 HydrophobicContact CB-CD1 4.28Å; E190-L286 HydrophobicContact CB-CG 3.98Å; E190-L286 HydrophobicContact CG-CD1 4.33Å; E190-L286 HydrophobicContact CG-CG 4.42Å; E190-L286 WeakPolarHBondContact OE2-CB 3.32Å; E190-L286 WeakPolarHBondContact OE2-CD1 3.5Å; E190-L286 WeakPolarHBondContact OE2-CG 3.2Å; F284-L286 PolarHBondContact O-N 3.26Å; L286-L290 WeakPolarHBondContact O-CD1 3.4Å; L286-L290 WeakPolarHBondContact O-CG 3.39Å
287	C	47.7	Very low	71.2	Confident	22 Å²	22	25.9 Å²	25.9	15%	0.149	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-5.9	-176.5	-67.5	0	0	0	0	114.1	D265 G285 G289 L290	D265-C287 WeakPolarHBondContact OD2-CB 3.44Å; G285-C287 PolarHBondContact O-N 3.33Å; C287-G289 PolarHBondContact O-N 3.42Å; C287-L290 WeakPolarHBondContact O-CB 3.27Å; C287-L290 PolarHBondContact O-N 3.49Å
288	T	51.5	Low	70	Confident	14 Å²	14	29 Å²	29	9%	0.086	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	117.5	-171.6	59.3	0	0	0	0	111.1	H263 R264 D265 G285 L290	H263-T288 WeakPolarHBondContact O-CG2 3.43Å; R264-T288 HydrophobicContact CB-CG2 3.46Å; R264-T288 VanDerWaalsContact CB-CG2 3.46Å; D265-T288 HydrophobicContact CB-CG2 3.43Å; D265-T288 VanDerWaalsContact CB-CG2 3.43Å; G285-T288 PolarHBondContact O-N 2.57Å; G285-T288 VanDerWaalsContact O-N 3.15Å; G285-T288 PolarHBondContact O-OG1 2.79Å; T288-L290 PolarHBondContact O-N 2.9Å
289	G	49	Very low	69.1	Low	25 Å²	25	28.9 Å²	28.9	26%	0.258	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	4.7	-172.6	0	0	0	0	0	114.2	C287 R295	C287-G289 PolarHBondContact O-N 3.42Å; G289-R295 WeakPolarHBondContact O-CG 3.43Å; G289-R295 PolarHBondContact O-NE 3.22Å; G289-R295 PolarHBondContact O-NH2 3.23Å
290	L	51.6	Low	67.8	Low	7 Å²	7	34.2 Å²	34.2	4%	0.037	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-35.5	178	-89.2	-176.9	0	0	0	114.2	F153 M178 K181 Q183 L286 C287 T288 K292	F153-L290 HydrophobicContact CD2-CD1 3.75Å; F153-L290 HydrophobicContact CE1-CD1 3.93Å; F153-L290 HydrophobicContact CE1-CD2 4.08Å; F153-L290 HydrophobicContact CE2-CB 3.58Å; F153-L290 HydrophobicContact CE2-CD1 3.13Å; F153-L290 HydrophobicContact CE2-CD2 4.16Å; F153-L290 HydrophobicContact CE2-CG 3.79Å; F153-L290 HydrophobicContact CG-CD1 4.42Å; F153-L290 HydrophobicContact CZ-CB 3.66Å; F153-L290 HydrophobicContact CZ-CD1 3.24Å; F153-L290 HydrophobicContact CZ-CD2 3.45Å; F153-L290 VanDerWaalsContact CZ-CD2 3.45Å; F153-L290 HydrophobicContact CZ-CG 3.62Å; M178-L290 HydrophobicContact CE-CD1 4.34Å; K181-L290 HydrophobicContact CB-CD2 3.61Å; K181-L290 HydrophobicContact CD-CD2 3.75Å; K181-L290 HydrophobicContact CG-CD2 4.32Å; Q183-L290 HydrophobicContact CB-CD1 4.39Å; Q183-L290 HydrophobicContact CG-CD1 3.52Å; Q183-L290 HydrophobicContact CG-CD2 3.26Å; Q183-L290 HydrophobicContact CG-CG 3.66Å; L286-L290 WeakPolarHBondContact O-CD1 3.4Å; L286-L290 WeakPolarHBondContact O-CG 3.39Å; C287-L290 WeakPolarHBondContact O-CB 3.27Å; C287-L290 PolarHBondContact O-N 3.49Å; T288-L290 PolarHBondContact O-N 2.9Å; L290-K292 PolarHBondContact O-N 2.66Å
291	K	60	Low	66.4	Low	20 Å²	20	40.9 Å²	40.9	9%	0.087	21%	0.207	C	C	.	.	S	Bend	trans	-66.1	128.8	167.8	-79.3	171.7	174	-162.9	0	107.4	A293 H294 T335 V336	K291-A293 PolarHBondContact O-N 3.35Å; K291-A293 VanDerWaalsContact O-N 3.15Å; K291-H294 HydrophobicContact CB-CB 4.29Å; K291-H294 WeakPolarHBondContact O-CA 3.28Å; K291-H294 VanDerWaalsContact O-CB 3.31Å; K291-H294 WeakPolarHBondContact O-CB 3.12Å; K291-H294 PolarHBondContact O-N 3.42Å; K291-T335 WeakPolarHBondContact CA-O 3.35Å; K291-V336 CarbonylContact C-O 3.6Å; K291-V336 WeakPolarHBondContact CB-O 3.42Å
292	K	63.1	Low	65.2	Low	132 Å²	132	42.8 Å²	42.8	57%	0.574	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-53.8	-40	-175.9	-73.3	-172	177.4	-177	0	111.5	L290 H294 R295 F298 T335 V336	L290-K292 PolarHBondContact O-N 2.66Å; K292-H294 PolarHBondContact O-N 3.34Å; K292-H294 VanDerWaalsContact O-N 3.17Å; K292-R295 PolarHBondContact O-N 3.13Å; K292-R295 VanDerWaalsContact O-N 3.12Å; K292-F298 HydrophobicContact CB-CD2 3.95Å; K292-F298 HydrophobicContact CB-CE2 4.26Å; K292-F298 WeakPolarHBondContact O-CB 3.13Å; K292-T335 PolarHBondContact N-O 3.35Å; K292-V336 PolarHBondContact N-O 3.22Å
293	A	66.2	Low	63.9	Low	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-68.9	-6	177.7	0	0	0	0	0	114.5	K291 F298 Y299 V336 P380	K291-A293 PolarHBondContact O-N 3.35Å; K291-A293 VanDerWaalsContact O-N 3.15Å; A293-F298 HydrophobicContact CB-CD1 4.47Å; A293-F298 HydrophobicContact CB-CE1 4.38Å; A293-Y299 WeakPolarHBondContact CA-OH 3.33Å; A293-Y299 WeakPolarHBondContact CB-OH 3.46Å; A293-Y299 WeakPolarHBondContact O-CE2 3.34Å; A293-Y299 PolarHBondContact O-OH 3.02Å; A293-V336 HydrophobicContact CB-CG1 4.17Å; A293-V336 WeakPolarHBondContact CB-O 3.35Å; A293-V336 PolarHBondContact N-O 3.39Å; A293-P380 HydrophobicContact CB-CB 3.99Å; A293-P380 HydrophobicContact CB-CG 4.49Å
294	H	68.6	Low	62.8	Low	17 Å²	17	53.4 Å²	53.4	8%	0.079	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-95.4	-6.3	174.4	-63.1	-171.2	0	0	0	112.3	D265 K291 K292 T338 I342	D265-H294 IonicContact OD1-CE1 3.83Å; K291-H294 HydrophobicContact CB-CB 4.29Å; K291-H294 WeakPolarHBondContact O-CA 3.28Å; K291-H294 VanDerWaalsContact O-CB 3.31Å; K291-H294 WeakPolarHBondContact O-CB 3.12Å; K291-H294 PolarHBondContact O-N 3.42Å; K292-H294 PolarHBondContact O-N 3.34Å; K292-H294 VanDerWaalsContact O-N 3.17Å; H294-T338 PolarHBondContact CD2-O 3.06Å; H294-T338 PolarHBondContact NE2-O 3.37Å; H294-I342 HydrophobicContact CB-CD1 3.67Å; H294-I342 WeakPolarHBondContact CD2-CD1 3.42Å; H294-I342 VanDerWaalsContact CG-CD1 3.44Å
295	R	68.4	Low	62	Low	90 Å²	90	55.3 Å²	55.3	34%	0.34	29%	0.29	S	S	.	.	S	Bend	trans	-93.7	136.1	178.6	-60.5	-176	-178.6	-163.5	-9.2	110.6	G289 K292 D297 F298	G289-R295 WeakPolarHBondContact O-CG 3.43Å; G289-R295 PolarHBondContact O-NE 3.22Å; G289-R295 PolarHBondContact O-NH2 3.23Å; K292-R295 PolarHBondContact O-N 3.13Å; K292-R295 VanDerWaalsContact O-N 3.12Å; R295-D297 PolarHBondContact O-N 3.29Å; R295-F298 WeakPolarHBondContact O-CB 3.44Å; R295-F298 PolarHBondContact O-N 3.26Å; R295-F298 VanDerWaalsContact O-N 3.1Å
296	T	70.1	Confident	61.9	Low	31 Å²	31	63.9 Å²	63.9	19%	0.19	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-55.6	-36.1	172	-48.3	0	0	0	0	112.1	F298 Y299 K300 F347	T296-F298 PolarHBondContact O-N 2.78Å; T296-F298 VanDerWaalsContact O-N 3.12Å; T296-Y299 PolarHBondContact O-N 3.35Å; T296-K300 PolarHBondContact O-N 3.18Å; T296-F347 WeakPolarHBondContact CG2-O 3.19Å
297	D	72.4	Confident	61.9	Low	98 Å²	98	65.3 Å²	65.3	52%	0.524	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-54.6	-32.1	178.1	-65.5	-23.6	0	0	0	113.7	R295 Y299 K300	R295-D297 PolarHBondContact O-N 3.29Å; D297-Y299 PolarHBondContact O-N 3.01Å; D297-K300 HydrophobicContact CB-CD 4.49Å; D297-K300 WeakPolarHBondContact OD1-CE 3.46Å; D297-K300 IonicContact OD1-NZ 3.68Å; D297-K300 PolarHBondContact OD1-NZ 3.4Å
298	F	71.7	Confident	62.2	Low	66 Å²	66	68.8 Å²	68.8	29%	0.289	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-69.4	-18.3	-179.2	-174.2	-95.8	0	0	0	113	K292 A293 R295 T296 V336 P380 Q381	K292-F298 HydrophobicContact CB-CD2 3.95Å; K292-F298 HydrophobicContact CB-CE2 4.26Å; K292-F298 WeakPolarHBondContact O-CB 3.13Å; A293-F298 HydrophobicContact CB-CD1 4.47Å; A293-F298 HydrophobicContact CB-CE1 4.38Å; R295-F298 WeakPolarHBondContact O-CB 3.44Å; R295-F298 PolarHBondContact O-N 3.26Å; R295-F298 VanDerWaalsContact O-N 3.1Å; T296-F298 PolarHBondContact O-N 2.78Å; T296-F298 VanDerWaalsContact O-N 3.12Å; F298-V336 HydrophobicContact CZ-CG1 4.32Å; F298-P380 HydrophobicContact CE1-CB 4.21Å; F298-Q381 HydrophobicContact CE1-CG 4.48Å; F298-Q381 VanDerWaalsContact CZ-NE2 3.33Å
299	Y	76.9	Confident	61.8	Low	1 Å²	1	73.7 Å²	73.7	0%	0.004	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-117.6	7.6	-176.7	-53	-75.9	0	0	0	114.1	A293 T296 D297 D301 L302 P339 F347 Y384	A293-Y299 WeakPolarHBondContact CA-OH 3.33Å; A293-Y299 WeakPolarHBondContact CB-OH 3.46Å; A293-Y299 WeakPolarHBondContact O-CE2 3.34Å; A293-Y299 PolarHBondContact O-OH 3.02Å; T296-Y299 PolarHBondContact O-N 3.35Å; D297-Y299 PolarHBondContact O-N 3.01Å; Y299-D301 PolarHBondContact O-N 2.9Å; Y299-D301 VanDerWaalsContact O-N 3.13Å; Y299-L302 PolarHBondContact O-N 2.9Å; Y299-P339 VanDerWaalsContact OH-CG 3.3Å; Y299-P339 WeakPolarHBondContact OH-CG 3.31Å; Y299-F347 HydrophobicContact CD2-CD1 4.07Å; Y299-F347 AromaticContact CD2-CE1 3.96Å; Y299-F347 HydrophobicContact CD2-CE1 3.96Å; Y299-F347 HydrophobicContact CE2-CD1 4.19Å; Y299-F347 AromaticContact CE2-CE1 3.6Å; Y299-F347 HydrophobicContact CE2-CE1 3.6Å; Y299-F347 HydrophobicContact CE2-CZ 4.26Å; Y299-Y384 AromaticContact CD1-CD1 3.81Å; Y299-Y384 HydrophobicContact CD1-CD1 3.81Å; Y299-Y384 AromaticContact CD1-CD2 3.76Å; Y299-Y384 HydrophobicContact CD1-CD2 3.76Å; Y299-Y384 HydrophobicContact CD1-CE1 4.46Å; Y299-Y384 HydrophobicContact CD1-CE2 4.39Å; Y299-Y384 AromaticContact CD1-CG 3.42Å; Y299-Y384 HydrophobicContact CD1-CG 3.42Å; Y299-Y384 VanDerWaalsContact CD1-CG 3.42Å; Y299-Y384 AromaticContact CD2-CD2 3.55Å; Y299-Y384 HydrophobicContact CD2-CD2 3.55Å; Y299-Y384 AromaticContact CD2-CE2 3.83Å; Y299-Y384 HydrophobicContact CD2-CE2 3.83Å; Y299-Y384 HydrophobicContact CD2-CG 4.13Å; Y299-Y384 HydrophobicContact CE1-CD1 4.48Å; Y299-Y384 HydrophobicContact CE1-CD2 4.08Å; Y299-Y384 AromaticContact CE1-CG 3.74Å; Y299-Y384 HydrophobicContact CE1-CG 3.74Å; Y299-Y384 AromaticContact CE2-CD2 3.88Å; Y299-Y384 HydrophobicContact CE2-CD2 3.88Å; Y299-Y384 HydrophobicContact CE2-CG 4.39Å; Y299-Y384 HydrophobicContact CG-CD1 4.02Å; Y299-Y384 AromaticContact CG-CD2 3.47Å; Y299-Y384 HydrophobicContact CG-CD2 3.47Å; Y299-Y384 VanDerWaalsContact CG-CD2 3.47Å; Y299-Y384 HydrophobicContact CG-CE1 4.27Å; Y299-Y384 AromaticContact CG-CE2 3.73Å; Y299-Y384 HydrophobicContact CG-CE2 3.73Å; Y299-Y384 AromaticContact CG-CG 3.63Å; Y299-Y384 HydrophobicContact CG-CG 3.63Å
300	K	69.6	Low	62.1	Low	112 Å²	112	76.4 Å²	76.4	49%	0.487	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-49.6	-43	-175.6	-83.4	176.3	171.9	169.3	0	113.3	T296 D297 L302 S303	T296-K300 PolarHBondContact O-N 3.18Å; D297-K300 HydrophobicContact CB-CD 4.49Å; D297-K300 WeakPolarHBondContact OD1-CE 3.46Å; D297-K300 IonicContact OD1-NZ 3.68Å; D297-K300 PolarHBondContact OD1-NZ 3.4Å; K300-L302 VanDerWaalsContact C-N 3.3Å; K300-L302 PolarHBondContact O-N 3.37Å; K300-S303 PolarHBondContact O-OG 3.39Å
301	D	68.1	Low	62	Low	161 Å²	161	80.8 Å²	80.8	86%	0.861	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-80.8	-7.9	-176.8	-55.1	-33	0	0	0	113.9	Y299	Y299-D301 PolarHBondContact O-N 2.9Å; Y299-D301 VanDerWaalsContact O-N 3.13Å
302	L	68.3	Low	61.5	Low	40 Å²	40	85 Å²	85	21%	0.209	45%	0.453	C	S	.	.	G	3₁₀ helix	trans	-99.4	-7	-177.2	-78.9	120.8	0	0	0	114.1	Y299 K300 Q304 A305 Q381 Y384	Y299-L302 PolarHBondContact O-N 2.9Å; K300-L302 VanDerWaalsContact C-N 3.3Å; K300-L302 PolarHBondContact O-N 3.37Å; L302-Q304 PolarHBondContact O-N 2.92Å; L302-A305 PolarHBondContact O-N 3.44Å; L302-Q381 HydrophobicContact CD1-CB 4.34Å; L302-Q381 HydrophobicContact CD1-CG 3.76Å; L302-Q381 HydrophobicContact CD2-CB 3.97Å; L302-Q381 HydrophobicContact CD2-CG 4.26Å; L302-Y384 HydrophobicContact CB-CE1 4.43Å
303	S	60.3	Low	60.9	Low	88 Å²	88	79.7 Å²	79.7	62%	0.615	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-21.9	-175.7	57.5	0	0	0	0	114.4	K300	K300-S303 PolarHBondContact O-OG 3.39Å
304	Q	54.7	Low	60.3	Low	184 Å²	184	90.5 Å²	90.5	86%	0.86	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	-1.7	179.3	-60.9	-163.5	-1.4	0	0	114.9	L302 K306	L302-Q304 PolarHBondContact O-N 2.92Å; Q304-K306 PolarHBondContact O-N 3.41Å
305	A	53.9	Low	59.7	Low	43 Å²	43	92 Å²	92	36%	0.355	49%	0.493	S	S	.	.			trans	-85.5	111.3	-174.8	0	0	0	0	0	111	L302 K385	L302-A305 PolarHBondContact O-N 3.44Å; A305-K385 WeakPolarHBondContact O-CE 3.15Å
306	K	55.1	Low	59.9	Low	185 Å²	185	91.7 Å²	91.7	80%	0.804	50%	0.498	S	S	*	.			trans	-54.4	145.1	169.9	-70	-173.5	180	-177.8	0	110.3	Q304 S308 K385	Q304-K306 PolarHBondContact O-N 3.41Å; K306-S308 PolarHBondContact O-N 3.31Å; K306-K385 PolarHBondContact O-NZ 3Å
307	P	53	Low	60.3	Low	35 Å²	35	90.4 Å²	90.4	23%	0.227	49%	0.49	C	S	.	.			trans	-58.4	121.5	172.6	-22.1	34.9	0	0	0	109.3	D309 F310 K385 N389	P307-D309 PolarHBondContact O-N 3.44Å; P307-F310 HydrophobicContact CB-CD2 4.1Å; P307-F310 HydrophobicContact CB-CE1 4.36Å; P307-F310 HydrophobicContact CB-CE2 3.63Å; P307-F310 HydrophobicContact CB-CZ 3.79Å; P307-F310 HydrophobicContact CG-CD2 4.46Å; P307-F310 HydrophobicContact CG-CE1 4.42Å; P307-F310 HydrophobicContact CG-CE2 3.53Å; P307-F310 HydrophobicContact CG-CZ 3.51Å; P307-K385 HydrophobicContact CG-CB 4.46Å; P307-N389 WeakPolarHBondContact CG-ND2 3.42Å
308	S	52.9	Low	60.6	Low	96 Å²	96	94 Å²	94	67%	0.671	50%	0.496	S	S	*	.	S	Bend	trans	-73.1	113	167.5	43.9	0	0	0	0	107.4	K306	K306-S308 PolarHBondContact O-N 3.31Å
309	D	45	Very low	61.1	Low	116 Å²	116	99.5 Å²	99.5	62%	0.62	52%	0.515	S	S	*	.			trans	52.2	85.5	175.1	-62.6	-25	0	0	0	117.8	P307 S311 S312	P307-D309 PolarHBondContact O-N 3.44Å; D309-S311 PolarHBondContact O-N 3.48Å; D309-S311 VanDerWaalsContact O-N 3.12Å; D309-S312 PolarHBondContact O-N 2.95Å
310	F	53.8	Low	61.3	Low	82 Å²	82	102.2 Å²	102.2	36%	0.36	53%	0.525	S	S	.	.	G	3₁₀ helix	trans	-55.1	-20.6	153.6	-72.8	-72.3	0	0	0	112.5	P307 N389 E392 A393	P307-F310 HydrophobicContact CB-CD2 4.1Å; P307-F310 HydrophobicContact CB-CE1 4.36Å; P307-F310 HydrophobicContact CB-CE2 3.63Å; P307-F310 HydrophobicContact CB-CZ 3.79Å; P307-F310 HydrophobicContact CG-CD2 4.46Å; P307-F310 HydrophobicContact CG-CE1 4.42Å; P307-F310 HydrophobicContact CG-CE2 3.53Å; P307-F310 HydrophobicContact CG-CZ 3.51Å; F310-N389 HydrophobicContact CZ-CB 4.03Å; F310-E392 WeakPolarHBondContact CE2-OE2 3.47Å; F310-E392 HydrophobicContact CZ-CB 4.31Å; F310-A393 HydrophobicContact CE1-CB 4.17Å
311	S	50.7	Low	61.9	Low	100 Å²	100	97.6 Å²	97.6	70%	0.699	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-67.9	-30.9	-178.3	-33.2	0	0	0	0	113.8	D309 G313	D309-S311 PolarHBondContact O-N 3.48Å; D309-S311 VanDerWaalsContact O-N 3.12Å; S311-G313 PolarHBondContact O-N 3.2Å; S311-G313 VanDerWaalsContact O-N 3.11Å
312	S	48.6	Very low	62.5	Low	107 Å²	107	95.1 Å²	95.1	75%	0.748	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-80.7	9.9	-175.7	-152.3	0	0	0	0	113.2	D309	D309-S312 PolarHBondContact O-N 2.95Å
313	G	49.8	Very low	63.1	Low	22 Å²	22	95.3 Å²	95.3	23%	0.227	50%	0.503	C	S	.	.	G	3₁₀ helix	trans	-115.8	27.5	-168.7	0	0	0	0	0	116	S311 A315 R320	S311-G313 PolarHBondContact O-N 3.2Å; S311-G313 VanDerWaalsContact O-N 3.11Å; G313-A315 VanDerWaalsContact C-N 3.34Å; G313-R320 VanDerWaalsContact C-NH2 3.26Å; G313-R320 VanDerWaalsContact CA-NH2 3.3Å; G313-R320 PolarHBondContact O-NH2 3.26Å
314	R	55	Low	64.1	Low	226 Å²	226	91.5 Å²	91.5	85%	0.853	48%	0.475	S	S	*	.			trans	-101.1	30.3	164.1	-66.6	-172.9	-172.4	168.7	3	112.5	D316	R314-D316 PolarHBondContact O-N 2.95Å
315	A	56.5	Low	65.4	Low	49 Å²	49	84 Å²	84	41%	0.405	44%	0.441	S	S	.	.			trans	-57.6	132.7	166.1	0	0	0	0	0	108.8	G313 S317	G313-A315 VanDerWaalsContact C-N 3.34Å; A315-S317 PolarHBondContact O-N 3.15Å
316	D	71.3	Confident	66.4	Low	83 Å²	83	89 Å²	89	44%	0.444	46%	0.455	S	S	.	.			trans	-37.7	125.7	174.1	178.6	-5.4	0	0	0	110.9	R314 R318 R319 R320	R314-D316 PolarHBondContact O-N 2.95Å; D316-R318 PolarHBondContact O-N 2.79Å; D316-R318 WeakPolarHBondContact OD1-CB 3.37Å; D316-R318 PolarHBondContact OD1-N 3.41Å; D316-R318 VanDerWaalsContact OD1-N 3.08Å; D316-R319 HydrophobicContact CB-CG 4.33Å; D316-R319 WeakPolarHBondContact O-CB 3.49Å; D316-R319 PolarHBondContact O-N 2.86Å; D316-R320 PolarHBondContact O-N 3.23Å
317	S	79.2	Confident	67.6	Low	4 Å²	4	81.8 Å²	81.8	3%	0.028	42%	0.423	C	S	.	.	H	α-helix	trans	-52.6	-31	-178	-70.4	0	0	0	0	113.1	A315 R319 R320 A321 Y372 P397 E399	A315-S317 PolarHBondContact O-N 3.15Å; S317-R319 PolarHBondContact O-N 2.94Å; S317-R320 WeakPolarHBondContact O-CB 3.24Å; S317-R320 PolarHBondContact O-N 2.92Å; S317-A321 PolarHBondContact O-N 3.35Å; S317-Y372 PolarHBondContact OG-OH 3.03Å; S317-P397 WeakPolarHBondContact OG-CB 3.32Å; S317-P397 WeakPolarHBondContact OG-CG 3.41Å; S317-E399 WeakPolarHBondContact CB-OE1 3.32Å; S317-E399 PolarHBondContact N-OE1 3.34Å; S317-E399 VanDerWaalsContact N-OE1 3.14Å; S317-E399 PolarHBondContact OG-OE1 3.26Å
318	R	79.1	Confident	68.9	Low	173 Å²	173	80.2 Å²	80.2	65%	0.653	41%	0.413	S	S	*	.	H	α-helix	trans	-60.4	-45.4	175.1	-171.6	175.4	-177.5	148.8	6	112.3	D316 R320 A321 E322	D316-R318 PolarHBondContact O-N 2.79Å; D316-R318 WeakPolarHBondContact OD1-CB 3.37Å; D316-R318 PolarHBondContact OD1-N 3.41Å; D316-R318 VanDerWaalsContact OD1-N 3.08Å; R318-R320 VanDerWaalsContact C-N 3.28Å; R318-R320 PolarHBondContact O-N 3.48Å; R318-A321 PolarHBondContact O-N 2.67Å; R318-E322 IonicContact NE-OE1 3.27Å; R318-E322 PolarHBondContact NE-OE1 3.34Å; R318-E322 WeakPolarHBondContact O-CG 3.42Å; R318-E322 PolarHBondContact O-N 2.87Å
319	R	81.7	Confident	69.9	Low	183 Å²	183	81.9 Å²	81.9	69%	0.691	40%	0.404	S	S	*	.	H	α-helix	trans	-64.2	-34.8	177.5	-68.2	-174.6	178.3	-152.2	-0.6	111.9	D316 S317 G323	D316-R319 HydrophobicContact CB-CG 4.33Å; D316-R319 WeakPolarHBondContact O-CB 3.49Å; D316-R319 PolarHBondContact O-N 2.86Å; S317-R319 PolarHBondContact O-N 2.94Å; R319-G323 PolarHBondContact O-N 3.23Å
320	R	81.3	Confident	71.3	Confident	57 Å²	57	84 Å²	84	22%	0.215	40%	0.404	C	S	.	.	H	α-helix	trans	-67.2	-46.3	175.4	-72.6	-179.1	162.1	-179.5	-7.3	111.8	G313 D316 S317 R318 G323 W324 Y372	G313-R320 VanDerWaalsContact C-NH2 3.26Å; G313-R320 VanDerWaalsContact CA-NH2 3.3Å; G313-R320 PolarHBondContact O-NH2 3.26Å; D316-R320 PolarHBondContact O-N 3.23Å; S317-R320 WeakPolarHBondContact O-CB 3.24Å; S317-R320 PolarHBondContact O-N 2.92Å; R318-R320 VanDerWaalsContact C-N 3.28Å; R318-R320 PolarHBondContact O-N 3.48Å; R320-G323 PolarHBondContact O-N 3.33Å; R320-W324 VanDerWaalsContact O-CB 3.22Å; R320-W324 WeakPolarHBondContact O-CB 3.28Å; R320-W324 PolarHBondContact O-N 2.9Å; R320-Y372 HydrophobicContact CB-CD1 3.81Å; R320-Y372 HydrophobicContact CB-CD2 4.42Å; R320-Y372 HydrophobicContact CB-CE1 3.65Å; R320-Y372 HydrophobicContact CB-CE2 4.3Å; R320-Y372 HydrophobicContact CB-CG 4.2Å
321	A	81.9	Confident	72.3	Confident	16 Å²	16	81.2 Å²	81.2	13%	0.132	39%	0.392	C	S	.	.	H	α-helix	trans	-59.6	-46.3	176.2	0	0	0	0	0	111.5	S317 R318 W324 N325 Y372	S317-A321 PolarHBondContact O-N 3.35Å; R318-A321 PolarHBondContact O-N 2.67Å; A321-W324 PolarHBondContact O-N 3.16Å; A321-N325 PolarHBondContact O-N 3.31Å; A321-Y372 HydrophobicContact CB-CD1 4.17Å
322	E	80.2	Confident	73.1	Confident	109 Å²	109	77.6 Å²	77.6	51%	0.509	37%	0.368	S	S	.	.	H	α-helix	trans	-61.3	-46.5	176.5	-72.2	171.5	-173.8	0	0	112.3	R318 W324 N325 K326	R318-E322 IonicContact NE-OE1 3.27Å; R318-E322 PolarHBondContact NE-OE1 3.34Å; R318-E322 WeakPolarHBondContact O-CG 3.42Å; R318-E322 PolarHBondContact O-N 2.87Å; E322-W324 VanDerWaalsContact C-N 3.32Å; E322-W324 PolarHBondContact O-N 3.48Å; E322-N325 PolarHBondContact O-N 3.2Å; E322-K326 PolarHBondContact O-N 2.99Å
323	G	80.8	Confident	74	Confident	43 Å²	43	76.6 Å²	76.6	44%	0.443	35%	0.349	S	S	.	.	H	α-helix	trans	-61.8	-40.3	176.2	0	0	0	0	0	112.5	R319 R320 K326 K327	R319-G323 PolarHBondContact O-N 3.23Å; R320-G323 PolarHBondContact O-N 3.33Å; G323-K326 PolarHBondContact O-N 2.97Å; G323-K327 PolarHBondContact O-N 3.46Å; G323-K327 VanDerWaalsContact O-N 3.17Å
324	W	82.6	Confident	75	Confident	9 Å²	9	77.1 Å²	77.1	3%	0.034	35%	0.349	C	S	.	.	H	α-helix	trans	-66.1	-45.7	177	-178.5	-115	0	0	0	111.9	R320 A321 E322 K326 K327 R328 L331 T338 D340 E367 P373 C376	R320-W324 VanDerWaalsContact O-CB 3.22Å; R320-W324 WeakPolarHBondContact O-CB 3.28Å; R320-W324 PolarHBondContact O-N 2.9Å; A321-W324 PolarHBondContact O-N 3.16Å; E322-W324 VanDerWaalsContact C-N 3.32Å; E322-W324 PolarHBondContact O-N 3.48Å; W324-K326 VanDerWaalsContact C-N 3.28Å; W324-K326 PolarHBondContact O-N 3.33Å; W324-K327 HydrophobicContact CE3-CB 4.44Å; W324-K327 HydrophobicContact CE3-CD 4.21Å; W324-K327 HydrophobicContact CZ3-CD 4.15Å; W324-K327 CarbonylContact O-C 3.17Å; W324-K327 WeakPolarHBondContact O-CA 3.37Å; W324-K327 WeakPolarHBondContact O-CB 3.46Å; W324-K327 PolarHBondContact O-N 3.15Å; W324-R328 VanDerWaalsContact CD1-NH2 3.32Å; W324-R328 HydrophobicContact CD2-CG 4.24Å; W324-R328 HydrophobicContact CG-CG 4.26Å; W324-R328 HydrophobicContact CZ2-CG 4.18Å; W324-R328 WeakPolarHBondContact O-CG 3.36Å; W324-R328 PolarHBondContact O-N 2.92Å; W324-L331 HydrophobicContact CH2-CD1 3.9Å; W324-L331 HydrophobicContact CZ3-CD1 3.88Å; W324-T338 HydrophobicContact CH2-CG2 4.45Å; W324-D340 HydrophobicContact CH2-CB 4.4Å; W324-D340 WeakPolarHBondContact CH2-OD2 3.42Å; W324-E367 PolarHBondContact NE1-OE1 3Å; W324-P373 HydrophobicContact CD2-CG 4.45Å; W324-P373 HydrophobicContact CH2-CG 3.87Å; W324-P373 VanDerWaalsContact CZ2-CD 3.47Å; W324-P373 HydrophobicContact CZ2-CG 3.36Å; W324-C376 HydrophobicContact CD2-CB 4.39Å; W324-C376 HydrophobicContact CE3-CB 3.68Å; W324-C376 HydrophobicContact CZ3-CB 3.75Å
325	N	80.3	Confident	75.3	Confident	26 Å²	26	70.2 Å²	70.2	14%	0.139	33%	0.332	C	S	.	.	H	α-helix	trans	-54	-42	175.4	-86.8	-21.9	0	0	0	113	D235 A321 E322 K327 R328	D235-N325 PolarHBondContact OD1-ND2 3.36Å; A321-N325 PolarHBondContact O-N 3.31Å; E322-N325 PolarHBondContact O-N 3.2Å; N325-K327 VanDerWaalsContact C-N 3.3Å; N325-K327 PolarHBondContact O-N 3.24Å; N325-R328 PolarHBondContact OD1-NH1 2.88Å
326	K	76.4	Confident	75.6	Confident	148 Å²	148	70.3 Å²	70.3	64%	0.643	33%	0.328	S	S	*	.	H	α-helix	trans	-70.6	-25.3	175	-169.6	175	-179.8	175.8	0	113	E322 G323 W324 R330	E322-K326 PolarHBondContact O-N 2.99Å; G323-K326 PolarHBondContact O-N 2.97Å; W324-K326 VanDerWaalsContact C-N 3.28Å; W324-K326 PolarHBondContact O-N 3.33Å; K326-R330 PolarHBondContact O-NE 2.79Å
327	K	80	Confident	75.7	Confident	33 Å²	33	66.4 Å²	66.4	14%	0.143	31%	0.307	C	S	.	.	H	α-helix	trans	-82.5	-39.9	178	-156.6	-172.7	176.7	-178.1	0	111.7	G323 W324 N325 R329 R330 L331 S377 A378	G323-K327 PolarHBondContact O-N 3.46Å; G323-K327 VanDerWaalsContact O-N 3.17Å; W324-K327 HydrophobicContact CE3-CB 4.44Å; W324-K327 HydrophobicContact CE3-CD 4.21Å; W324-K327 HydrophobicContact CZ3-CD 4.15Å; W324-K327 CarbonylContact O-C 3.17Å; W324-K327 WeakPolarHBondContact O-CA 3.37Å; W324-K327 WeakPolarHBondContact O-CB 3.46Å; W324-K327 PolarHBondContact O-N 3.15Å; N325-K327 VanDerWaalsContact C-N 3.3Å; N325-K327 PolarHBondContact O-N 3.24Å; K327-R329 PolarHBondContact O-N 3.42Å; K327-R330 PolarHBondContact O-N 2.96Å; K327-L331 HydrophobicContact CB-CD1 4.29Å; K327-L331 HydrophobicContact CD-CD1 3.71Å; K327-L331 HydrophobicContact CD-CG 4.39Å; K327-L331 HydrophobicContact CG-CD1 3.57Å; K327-L331 HydrophobicContact CG-CG 3.89Å; K327-L331 WeakPolarHBondContact O-CG 3.37Å; K327-L331 PolarHBondContact O-N 3.09Å; K327-S377 PolarHBondContact NZ-O 3.2Å; K327-A378 PolarHBondContact NZ-O 2.99Å
328	R	80.8	Confident	75.7	Confident	2 Å²	2	66.9 Å²	66.9	1%	0.008	31%	0.31	C	S	.	.	H	α-helix	trans	-44.9	-59.3	-179.5	-79.4	-178.9	175.7	148.7	7.7	112	M228 L231 M232 W324 N325 R330 L331 A332 E367 G371	M228-R328 HydrophobicContact SD-CB 4.39Å; L231-R328 PolarHBondContact O-NH1 3.34Å; M232-R328 HydrophobicContact CG-CB 4.37Å; M232-R328 HydrophobicContact SD-CB 4.02Å; W324-R328 VanDerWaalsContact CD1-NH2 3.32Å; W324-R328 HydrophobicContact CD2-CG 4.24Å; W324-R328 HydrophobicContact CG-CG 4.26Å; W324-R328 HydrophobicContact CZ2-CG 4.18Å; W324-R328 WeakPolarHBondContact O-CG 3.36Å; W324-R328 PolarHBondContact O-N 2.92Å; N325-R328 PolarHBondContact OD1-NH1 2.88Å; R328-R330 VanDerWaalsContact C-N 3.34Å; R328-R330 PolarHBondContact O-N 3.13Å; R328-L331 PolarHBondContact O-N 3.34Å; R328-L331 VanDerWaalsContact O-N 3.09Å; R328-A332 PolarHBondContact O-N 3.2Å; R328-E367 IonicContact CZ-OE1 3.74Å; R328-E367 IonicContact NE-OE1 2.7Å; R328-E367 PolarHBondContact NE-OE1 3.07Å; R328-E367 VanDerWaalsContact NH2-CG 3.32Å; R328-E367 IonicContact NH2-OE1 3.85Å; R328-E367 PolarHBondContact NH2-OE1 3.37Å; R328-G371 PolarHBondContact NH2-O 2.99Å
329	R	72.2	Confident	76.2	Confident	132 Å²	132	58.7 Å²	58.7	50%	0.498	28%	0.279	S	S	.	.	H	α-helix	trans	-53.1	-47	178.3	-74.9	-171.8	-85.7	-126.5	-1	113.3	M232 K327 L331 Y333	M232-R329 HydrophobicContact CE-CG 3.29Å; M232-R329 HydrophobicContact SD-CG 3.83Å; K327-R329 PolarHBondContact O-N 3.42Å; R329-L331 VanDerWaalsContact C-N 3.34Å; R329-L331 PolarHBondContact O-N 3.07Å; R329-Y333 WeakPolarHBondContact O-CD2 3.03Å; R329-Y333 VanDerWaalsContact O-CE2 3.32Å; R329-Y333 WeakPolarHBondContact O-CE2 3.37Å
330	R	76.1	Confident	76.7	Confident	160 Å²	160	50 Å²	50	60%	0.604	25%	0.246	S	C	*	.	H	α-helix	trans	-69.2	-33.2	-178.5	-71	-176.4	-76	165.1	-0.4	112.4	K326 K327 R328 S334	K326-R330 PolarHBondContact O-NE 2.79Å; K327-R330 PolarHBondContact O-N 2.96Å; R328-R330 VanDerWaalsContact C-N 3.34Å; R328-R330 PolarHBondContact O-N 3.13Å; R330-S334 WeakPolarHBondContact O-CB 3.46Å; R330-S334 PolarHBondContact O-N 3.15Å
331	L	73.5	Confident	77.3	Confident	23 Å²	23	48 Å²	48	12%	0.12	24%	0.239	C	C	.	.	H	α-helix	trans	-75.2	-32.8	-179.5	-74.3	171	0	0	0	113.2	W324 K327 R328 R329 Y333 S334 T338	W324-L331 HydrophobicContact CH2-CD1 3.9Å; W324-L331 HydrophobicContact CZ3-CD1 3.88Å; K327-L331 HydrophobicContact CB-CD1 4.29Å; K327-L331 HydrophobicContact CD-CD1 3.71Å; K327-L331 HydrophobicContact CD-CG 4.39Å; K327-L331 HydrophobicContact CG-CD1 3.57Å; K327-L331 HydrophobicContact CG-CG 3.89Å; K327-L331 WeakPolarHBondContact O-CG 3.37Å; K327-L331 PolarHBondContact O-N 3.09Å; R328-L331 PolarHBondContact O-N 3.34Å; R328-L331 VanDerWaalsContact O-N 3.09Å; R329-L331 VanDerWaalsContact C-N 3.34Å; R329-L331 PolarHBondContact O-N 3.07Å; L331-Y333 VanDerWaalsContact C-N 3.29Å; L331-Y333 PolarHBondContact O-N 2.73Å; L331-S334 PolarHBondContact O-N 3.45Å; L331-T338 HydrophobicContact CD1-CG2 3.78Å; L331-T338 HydrophobicContact CD2-CG2 4.18Å; L331-T338 HydrophobicContact CG-CG2 4.43Å
332	A	67.7	Low	77.8	Confident	24 Å²	24	48 Å²	48	20%	0.198	24%	0.236	C	C	.	.	H	α-helix	trans	-56.4	-46.7	175.1	0	0	0	0	0	110.7	M228 R328	M228-A332 HydrophobicContact SD-CB 4.17Å; R328-A332 PolarHBondContact O-N 3.2Å
333	Y	67.8	Low	78.4	Confident	86 Å²	86	42.8 Å²	42.8	34%	0.337	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-6.2	179.7	-52.6	-57.8	0	0	0	114.9	K150 R329 L331 D462 F464	K150-Y333 HydrophobicContact CB-CD1 3.96Å; K150-Y333 HydrophobicContact CB-CE1 4.12Å; K150-Y333 WeakPolarHBondContact O-CD1 3.49Å; R329-Y333 WeakPolarHBondContact O-CD2 3.03Å; R329-Y333 VanDerWaalsContact O-CE2 3.32Å; R329-Y333 WeakPolarHBondContact O-CE2 3.37Å; L331-Y333 VanDerWaalsContact C-N 3.29Å; L331-Y333 PolarHBondContact O-N 2.73Å; Y333-D462 WeakPolarHBondContact OH-CB 3.32Å; Y333-D462 PolarHBondContact OH-OD2 2.9Å; Y333-F464 HydrophobicContact CD1-CE1 4.35Å; Y333-F464 AromaticContact CE1-CE1 3.48Å; Y333-F464 HydrophobicContact CE1-CE1 3.48Å; Y333-F464 VanDerWaalsContact CE1-CE1 3.48Å; Y333-F464 AromaticContact CE1-CZ 3.56Å; Y333-F464 HydrophobicContact CE1-CZ 3.56Å; Y333-F464 AromaticContact CZ-CE1 3.63Å; Y333-F464 AromaticContact CZ-CZ 3.71Å; Y333-F464 WeakPolarHBondContact OH-CE1 3.33Å; Y333-F464 WeakPolarHBondContact OH-CZ 3.43Å
334	S	70.5	Confident	79	Confident	34 Å²	34	41.1 Å²	41.1	24%	0.238	19%	0.193	C	C	.	.			trans	-79.8	133.5	-174.7	177.5	0	0	0	0	112.7	R330 L331 V336 G337	R330-S334 WeakPolarHBondContact O-CB 3.46Å; R330-S334 PolarHBondContact O-N 3.15Å; L331-S334 PolarHBondContact O-N 3.45Å; S334-V336 VanDerWaalsContact C-N 3.31Å; S334-V336 PolarHBondContact OG-N 3.42Å; S334-V336 VanDerWaalsContact OG-N 3.17Å; S334-G337 PolarHBondContact OG-N 3.01Å
335	T	61.4	Low	79.5	Confident	80 Å²	80	41.2 Å²	41.2	49%	0.491	19%	0.194	S	C	.	.	S	Bend	trans	-73.5	-21.9	171.5	58.5	0	0	0	0	113.2	A152 K291 K292	A152-T335 HydrophobicContact CB-CG2 4.11Å; K291-T335 WeakPolarHBondContact CA-O 3.35Å; K292-T335 PolarHBondContact N-O 3.35Å
336	V	63.4	Low	79.9	Confident	51 Å²	51	41.6 Å²	41.6	31%	0.309	20%	0.197	S	C	.	.	S	Bend	trans	-77	-42.5	175.4	179.2	0	0	0	0	109.6	K291 K292 A293 F298 S334 P380	K291-V336 CarbonylContact C-O 3.6Å; K291-V336 WeakPolarHBondContact CB-O 3.42Å; K292-V336 PolarHBondContact N-O 3.22Å; A293-V336 HydrophobicContact CB-CG1 4.17Å; A293-V336 WeakPolarHBondContact CB-O 3.35Å; A293-V336 PolarHBondContact N-O 3.39Å; F298-V336 HydrophobicContact CZ-CG1 4.32Å; S334-V336 VanDerWaalsContact C-N 3.31Å; S334-V336 PolarHBondContact OG-N 3.42Å; S334-V336 VanDerWaalsContact OG-N 3.17Å; V336-P380 HydrophobicContact CG1-CG 4.39Å
337	G	73.4	Confident	80.3	Confident	2 Å²	2	34.9 Å²	34.9	2%	0.021	17%	0.168	C	C	.	.			trans	71.9	-164.9	-176	0	0	0	0	0	114	S334	S334-G337 PolarHBondContact OG-N 3.01Å
338	T	78.2	Confident	80.3	Confident	14 Å²	14	37.9 Å²	37.9	9%	0.086	18%	0.183	C	C	.	.			trans	-146.9	144	173.8	-169.6	0	0	0	0	108.9	H294 W324 L331 D340	H294-T338 PolarHBondContact CD2-O 3.06Å; H294-T338 PolarHBondContact NE2-O 3.37Å; W324-T338 HydrophobicContact CH2-CG2 4.45Å; L331-T338 HydrophobicContact CD1-CG2 3.78Å; L331-T338 HydrophobicContact CD2-CG2 4.18Å; L331-T338 HydrophobicContact CG-CG2 4.43Å; T338-D340 VanDerWaalsContact CB-OD2 3.22Å; T338-D340 WeakPolarHBondContact CB-OD2 3.08Å; T338-D340 HydrophobicContact CG2-CB 4.3Å; T338-D340 WeakPolarHBondContact CG2-OD2 3.32Å; T338-D340 PolarHBondContact O-N 3.21Å; T338-D340 PolarHBondContact OG1-OD2 2.86Å
339	P	89.2	Confident	79.9	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.215	C	C	.	.			trans	-84.6	13	-177	35.6	-37.5	0	0	0	113.7	Y299 Y341 I342 F347 T383 I387	Y299-P339 VanDerWaalsContact OH-CG 3.3Å; Y299-P339 WeakPolarHBondContact OH-CG 3.31Å; P339-Y341 PolarHBondContact O-N 3.28Å; P339-I342 HydrophobicContact CB-CD1 4.27Å; P339-I342 WeakPolarHBondContact O-CB 3.48Å; P339-I342 PolarHBondContact O-N 2.54Å; P339-F347 HydrophobicContact CB-CE2 4.37Å; P339-F347 HydrophobicContact CB-CZ 3.64Å; P339-T383 HydrophobicContact CG-CG2 3.72Å; P339-I387 HydrophobicContact CB-CD1 4Å; P339-I387 HydrophobicContact CG-CD1 4.07Å; P339-I387 WeakPolarHBondContact O-CD1 3.31Å
340	D	92.7	Very high	80	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-33.2	-166.7	-72.7	-71.7	0	0	0	115.4	W324 T338 V363 P373 C376 T383	W324-D340 HydrophobicContact CH2-CB 4.4Å; W324-D340 WeakPolarHBondContact CH2-OD2 3.42Å; T338-D340 VanDerWaalsContact CB-OD2 3.22Å; T338-D340 WeakPolarHBondContact CB-OD2 3.08Å; T338-D340 HydrophobicContact CG2-CB 4.3Å; T338-D340 WeakPolarHBondContact CG2-OD2 3.32Å; T338-D340 PolarHBondContact O-N 3.21Å; T338-D340 PolarHBondContact OG1-OD2 2.86Å; D340-V363 WeakPolarHBondContact O-CG1 3.34Å; D340-P373 HydrophobicContact CB-CB 4.12Å; D340-P373 HydrophobicContact CB-CG 4.3Å; D340-C376 WeakPolarHBondContact OD1-CA 3.48Å; D340-C376 PolarHBondContact OD1-N 2.83Å; D340-T383 HydrophobicContact CB-CG2 4.44Å; D340-T383 WeakPolarHBondContact OD1-CG2 3.15Å
341	Y	94.6	Very high	79.9	Confident	17 Å²	17	42 Å²	42	7%	0.067	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-4.8	-178.8	-50	-85.7	0	0	0	113.5	I266 K267 P268 P339 S360 V363 I364 E367 P373	I266-Y341 WeakPolarHBondContact O-CB 3.5Å; K267-Y341 HydrophobicContact CB-CD1 4.28Å; K267-Y341 HydrophobicContact CB-CD2 3.6Å; K267-Y341 HydrophobicContact CB-CE2 3.92Å; K267-Y341 HydrophobicContact CB-CG 3.81Å; P268-Y341 VanDerWaalsContact CD-CZ 3.43Å; P268-Y341 HydrophobicContact CG-CE1 4.12Å; P339-Y341 PolarHBondContact O-N 3.28Å; Y341-S360 WeakPolarHBondContact O-CA 3.41Å; Y341-S360 WeakPolarHBondContact O-CB 3.33Å; Y341-S360 PolarHBondContact O-OG 3.24Å; Y341-V363 HydrophobicContact CD1-CB 4.01Å; Y341-V363 HydrophobicContact CD1-CG1 3.39Å; Y341-V363 HydrophobicContact CE1-CG1 3.82Å; Y341-V363 HydrophobicContact CG-CG1 4.17Å; Y341-I364 HydrophobicContact CD1-CG1 3.92Å; Y341-I364 HydrophobicContact CE1-CG1 4.03Å; Y341-E367 VanDerWaalsContact CE1-OE2 3.26Å; Y341-E367 WeakPolarHBondContact CE1-OE2 3.36Å; Y341-E367 VanDerWaalsContact CZ-OE2 3.3Å; Y341-E367 PolarHBondContact OH-OE1 2.74Å; Y341-E367 PolarHBondContact OH-OE2 3.17Å; Y341-P373 HydrophobicContact CE1-CG 4.25Å
342	I	92.3	Very high	80.4	Confident	14 Å²	14	44.9 Å²	44.9	7%	0.072	24%	0.237	C	C	.	.			trans	-80	131.5	-174.7	-61	-177.5	0	0	0	110.4	H294 P339 V346 F347 W359	H294-I342 HydrophobicContact CB-CD1 3.67Å; H294-I342 WeakPolarHBondContact CD2-CD1 3.42Å; H294-I342 VanDerWaalsContact CG-CD1 3.44Å; P339-I342 HydrophobicContact CB-CD1 4.27Å; P339-I342 WeakPolarHBondContact O-CB 3.48Å; P339-I342 PolarHBondContact O-N 2.54Å; I342-V346 HydrophobicContact CG2-CB 3.6Å; I342-V346 HydrophobicContact CG2-CG1 3.77Å; I342-V346 HydrophobicContact CG2-CG2 4.07Å; I342-F347 HydrophobicContact CB-CE2 3.87Å; I342-F347 HydrophobicContact CB-CZ 3.84Å; I342-F347 HydrophobicContact CD1-CZ 4.06Å; I342-F347 HydrophobicContact CG2-CD2 4.15Å; I342-F347 HydrophobicContact CG2-CE1 4.33Å; I342-F347 HydrophobicContact CG2-CE2 3.41Å; I342-F347 VanDerWaalsContact CG2-CE2 3.41Å; I342-F347 HydrophobicContact CG2-CZ 3.51Å; I342-W359 PolarHBondContact O-NE1 3.44Å
343	A	93.5	Very high	81.3	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.008	25%	0.252	C	S	.	.			trans	-68.1	144.9	176.6	0	0	0	0	0	112.2	E345 V346 C356 W359	A343-E345 VanDerWaalsContact C-N 3.25Å; A343-E345 VanDerWaalsContact CB-CD 3.43Å; A343-E345 WeakPolarHBondContact CB-OE1 3.23Å; A343-E345 WeakPolarHBondContact CB-OE2 3.35Å; A343-E345 PolarHBondContact O-N 3.18Å; A343-V346 HydrophobicContact CB-CG2 4.18Å; A343-V346 WeakPolarHBondContact O-CB 3.47Å; A343-V346 PolarHBondContact O-N 3.05Å; A343-C356 HydrophobicContact CB-CB 3.94Å; A343-W359 VanDerWaalsContact CA-CD1 3.42Å; A343-W359 HydrophobicContact CB-CB 3.65Å; A343-W359 HydrophobicContact CB-CD2 4.17Å; A343-W359 HydrophobicContact CB-CG 3.58Å
344	P	93.4	Very high	82.4	Confident	7 Å²	7	46.3 Å²	46.3	5%	0.045	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-58.6	-36	-175.7	22.4	-33.2	0	0	0	112.8	V346 F347 W359 I387 M388	P344-V346 PolarHBondContact O-N 3.03Å; P344-F347 PolarHBondContact O-N 3.25Å; P344-W359 HydrophobicContact CG-CE3 4.42Å; P344-W359 HydrophobicContact CG-CH2 4.02Å; P344-W359 HydrophobicContact CG-CZ2 4.38Å; P344-W359 HydrophobicContact CG-CZ3 4.04Å; P344-I387 HydrophobicContact CB-CG2 4.11Å; P344-M388 HydrophobicContact CB-SD 4.42Å
345	E	91.7	Very high	83.4	Confident	12 Å²	12	44.9 Å²	44.9	6%	0.056	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-66.5	-21.5	179.5	68.3	-82.4	-174.3	0	0	114	A343 F347 Q348 A417 R420	A343-E345 VanDerWaalsContact C-N 3.25Å; A343-E345 VanDerWaalsContact CB-CD 3.43Å; A343-E345 WeakPolarHBondContact CB-OE1 3.23Å; A343-E345 WeakPolarHBondContact CB-OE2 3.35Å; A343-E345 PolarHBondContact O-N 3.18Å; E345-F347 PolarHBondContact O-N 2.98Å; E345-Q348 WeakPolarHBondContact O-CB 3.16Å; E345-Q348 PolarHBondContact O-N 3.48Å; E345-A417 HydrophobicContact CG-CB 4.24Å; E345-R420 IonicContact OE1-CZ 3.38Å; E345-R420 IonicContact OE1-NH1 2.69Å; E345-R420 PolarHBondContact OE1-NH1 3.34Å; E345-R420 IonicContact OE1-NH2 3.97Å; E345-R420 PolarHBondContact OE1-NH2 2.86Å; E345-R420 IonicContact OE2-CZ 3.66Å; E345-R420 IonicContact OE2-NH1 2.6Å; E345-R420 IonicContact OE2-NH2 2.66Å; E345-R420 PolarHBondContact OE2-NH2 2.87Å
346	V	88.6	Confident	85	Confident	33 Å²	33	41.2 Å²	41.2	20%	0.2	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-66	-28.7	177.2	176.5	0	0	0	0	111.3	I342 A343 P344 Q348 Y352 C356	I342-V346 HydrophobicContact CG2-CB 3.6Å; I342-V346 HydrophobicContact CG2-CG1 3.77Å; I342-V346 HydrophobicContact CG2-CG2 4.07Å; A343-V346 HydrophobicContact CB-CG2 4.18Å; A343-V346 WeakPolarHBondContact O-CB 3.47Å; A343-V346 PolarHBondContact O-N 3.05Å; P344-V346 PolarHBondContact O-N 3.03Å; V346-Q348 VanDerWaalsContact C-N 3.34Å; V346-Y352 HydrophobicContact CB-CD1 4.43Å; V346-Y352 HydrophobicContact CG1-CD1 4.49Å; V346-Y352 HydrophobicContact CG1-CE1 4.3Å; V346-Y352 HydrophobicContact CG2-CD1 4.23Å; V346-Y352 HydrophobicContact CG2-CD2 4.27Å; V346-Y352 HydrophobicContact CG2-CG 4.09Å; V346-C356 HydrophobicContact CG2-CB 3.88Å
347	F	84.8	Confident	86.4	Confident	7 Å²	7	38.8 Å²	38.8	3%	0.031	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-85.6	-9.5	174.4	-58	-71.8	0	0	0	113	T296 Y299 P339 I342 P344 E345 Y384 M388	T296-F347 WeakPolarHBondContact CG2-O 3.19Å; Y299-F347 HydrophobicContact CD2-CD1 4.07Å; Y299-F347 AromaticContact CD2-CE1 3.96Å; Y299-F347 HydrophobicContact CD2-CE1 3.96Å; Y299-F347 HydrophobicContact CE2-CD1 4.19Å; Y299-F347 AromaticContact CE2-CE1 3.6Å; Y299-F347 HydrophobicContact CE2-CE1 3.6Å; Y299-F347 HydrophobicContact CE2-CZ 4.26Å; P339-F347 HydrophobicContact CB-CE2 4.37Å; P339-F347 HydrophobicContact CB-CZ 3.64Å; I342-F347 HydrophobicContact CB-CE2 3.87Å; I342-F347 HydrophobicContact CB-CZ 3.84Å; I342-F347 HydrophobicContact CD1-CZ 4.06Å; I342-F347 HydrophobicContact CG2-CD2 4.15Å; I342-F347 HydrophobicContact CG2-CE1 4.33Å; I342-F347 HydrophobicContact CG2-CE2 3.41Å; I342-F347 VanDerWaalsContact CG2-CE2 3.41Å; I342-F347 HydrophobicContact CG2-CZ 3.51Å; P344-F347 PolarHBondContact O-N 3.25Å; E345-F347 PolarHBondContact O-N 2.98Å; F347-Y384 HydrophobicContact CB-CE2 4.01Å; F347-Y384 HydrophobicContact CD1-CD2 4.24Å; F347-Y384 HydrophobicContact CD1-CE2 4.03Å; F347-Y384 HydrophobicContact CD2-CD2 4.23Å; F347-Y384 HydrophobicContact CD2-CE2 4.14Å; F347-Y384 HydrophobicContact CE1-CD2 4.35Å; F347-Y384 HydrophobicContact CE2-CD2 4.32Å; F347-Y384 HydrophobicContact CG-CD2 4.18Å; F347-Y384 AromaticContact CG-CE2 3.79Å; F347-Y384 HydrophobicContact CG-CE2 3.79Å; F347-Y384 HydrophobicContact CZ-CD2 4.39Å; F347-M388 HydrophobicContact CB-CE 3.34Å; F347-M388 HydrophobicContact CD2-CE 3.34Å; F347-M388 HydrophobicContact CE2-CE 4.38Å; F347-M388 HydrophobicContact CG-CE 3.62Å
348	Q	81.5	Confident	87.6	Confident	97 Å²	97	38.8 Å²	38.8	45%	0.453	20%	0.203	S	C	.	.	S	Bend	trans	-85.6	140.8	179.2	-62.1	175	8.4	0	0	109.4	E345 V346 H350	E345-Q348 WeakPolarHBondContact O-CB 3.16Å; E345-Q348 PolarHBondContact O-N 3.48Å; V346-Q348 VanDerWaalsContact C-N 3.34Å; Q348-H350 PolarHBondContact O-N 2.77Å
349	H	71	Confident	88.5	Confident	149 Å²	149	38.1 Å²	38.1	69%	0.69	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.7	0.8	-174.9	-66.9	-64.2	0	0	0	114.8	G351	H349-G351 VanDerWaalsContact C-N 3.29Å; H349-G351 PolarHBondContact O-N 3.17Å
350	H	75.7	Confident	88.8	Confident	181 Å²	181	38.3 Å²	38.3	84%	0.838	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.7	5.2	-176.2	-58.9	100.2	0	0	0	113.9	Q348	Q348-H350 PolarHBondContact O-N 2.77Å
351	G	74.1	Confident	89.1	Confident	50 Å²	50	38.4 Å²	38.4	52%	0.515	20%	0.2	S	C	.	.			trans	79.8	171.7	-171.5	0	0	0	0	0	112.2	H349	H349-G351 VanDerWaalsContact C-N 3.29Å; H349-G351 PolarHBondContact O-N 3.17Å
352	Y	82.8	Confident	89.3	Confident	83 Å²	83	37.6 Å²	37.6	33%	0.325	20%	0.197	S	C	.	.			trans	-145.2	162.4	179.6	59.7	-89.4	0	0	0	109.8	R264 V346 C356	R264-Y352 WeakPolarHBondContact CD-OH 3.36Å; R264-Y352 HydrophobicContact CG-CE2 3.93Å; V346-Y352 HydrophobicContact CB-CD1 4.43Å; V346-Y352 HydrophobicContact CG1-CD1 4.49Å; V346-Y352 HydrophobicContact CG1-CE1 4.3Å; V346-Y352 HydrophobicContact CG2-CD1 4.23Å; V346-Y352 HydrophobicContact CG2-CD2 4.27Å; V346-Y352 HydrophobicContact CG2-CG 4.09Å; Y352-C356 HydrophobicContact CD2-CB 4.26Å
353	T	87.7	Confident	89.5	Confident	83 Å²	83	36.9 Å²	36.9	51%	0.509	19%	0.194	S	C	.	.			trans	-108.1	-177.9	-180	64.1	0	0	0	0	111	S355 C356	T353-S355 PolarHBondContact O-N 3.29Å; T353-S355 WeakPolarHBondContact OG1-CB 3.26Å; T353-S355 PolarHBondContact OG1-N 3.46Å; T353-S355 PolarHBondContact OG1-OG 3.25Å; T353-C356 PolarHBondContact O-N 3.14Å; T353-C356 PolarHBondContact O-SG 2.85Å
354	N	89.2	Confident	89.8	Confident	58 Å²	58	36.9 Å²	36.9	31%	0.31	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-13.6	173.6	69.7	-29.4	0	0	0	113.6	H257 I262 C356 D357	H257-N354 PolarHBondContact CE1-O 3.18Å; H257-N354 PolarHBondContact ND1-ND2 2.76Å; I262-N354 HydrophobicContact CD1-CB 4.06Å; I262-N354 HydrophobicContact CG1-CB 3.83Å; I262-N354 HydrophobicContact CG2-CB 4.37Å; N354-C356 PolarHBondContact O-N 2.95Å; N354-C356 VanDerWaalsContact O-N 3.13Å; N354-D357 PolarHBondContact O-N 2.99Å
355	S	93.1	Very high	90	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.021	19%	0.191	C	C	.	.	H	α-helix	trans	-59.2	-19.5	176.1	67.4	0	0	0	0	114.9	T353 D357 W358 W359 R420	T353-S355 PolarHBondContact O-N 3.29Å; T353-S355 WeakPolarHBondContact OG1-CB 3.26Å; T353-S355 PolarHBondContact OG1-N 3.46Å; T353-S355 PolarHBondContact OG1-OG 3.25Å; S355-D357 PolarHBondContact O-N 3.12Å; S355-W358 PolarHBondContact O-N 3.4Å; S355-W359 PolarHBondContact O-N 3.33Å; S355-R420 VanDerWaalsContact C-NH1 3.33Å; S355-R420 WeakPolarHBondContact O-CD 3.31Å; S355-R420 PolarHBondContact O-NH1 3.16Å
356	C	93.2	Very high	90.3	Very high	3 Å²	3	36 Å²	36	2%	0.02	19%	0.189	C	C	.	.	H	α-helix	trans	-63	-30.6	177.1	65.4	0	0	0	0	112.9	A343 V346 Y352 T353 N354 W358 W359 S360	A343-C356 HydrophobicContact CB-CB 3.94Å; V346-C356 HydrophobicContact CG2-CB 3.88Å; Y352-C356 HydrophobicContact CD2-CB 4.26Å; T353-C356 PolarHBondContact O-N 3.14Å; T353-C356 PolarHBondContact O-SG 2.85Å; N354-C356 PolarHBondContact O-N 2.95Å; N354-C356 VanDerWaalsContact O-N 3.13Å; C356-W358 VanDerWaalsContact C-N 3.3Å; C356-W358 PolarHBondContact O-N 2.76Å; C356-W359 WeakPolarHBondContact O-CB 3.07Å; C356-W359 PolarHBondContact O-N 3.43Å; C356-S360 PolarHBondContact O-N 3.4Å; C356-S360 PolarHBondContact O-OG 2.88Å
357	D	94.5	Very high	90.7	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-69.4	-32.4	179	-67	-18.7	0	0	0	110.8	I253 H257 I262 H263 R264 I266 N354 S355 S360 L361	I253-D357 HydrophobicContact CD1-CB 4.46Å; I253-D357 HydrophobicContact CG2-CB 3.9Å; H257-D357 IonicContact CD2-OD2 3.87Å; H257-D357 IonicContact CE1-OD2 3.48Å; H257-D357 IonicContact NE2-OD2 3.84Å; H257-D357 PolarHBondContact NE2-OD2 3.3Å; I262-D357 WeakPolarHBondContact CG2-OD2 3.34Å; H263-D357 WeakPolarHBondContact CB-OD2 3.49Å; H263-D357 PolarHBondContact N-OD2 3.09Å; R264-D357 WeakPolarHBondContact CA-OD1 3.43Å; R264-D357 PolarHBondContact N-OD1 3.23Å; I266-D357 HydrophobicContact CG1-CB 4.08Å; N354-D357 PolarHBondContact O-N 2.99Å; S355-D357 PolarHBondContact O-N 3.12Å; D357-S360 WeakPolarHBondContact O-CB 3.32Å; D357-S360 PolarHBondContact O-N 3.27Å; D357-L361 PolarHBondContact O-N 2.84Å
358	W	97	Very high	91.3	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.008	18%	0.178	C	C	.	.	H	α-helix	trans	-70.7	-34.9	176.5	-56.4	129.3	0	0	0	113	V250 I253 D254 S355 C356 S360 L361 G362 L413 S422 I427	V250-W358 HydrophobicContact CB-CZ3 4.3Å; V250-W358 HydrophobicContact CG1-CH2 4.21Å; V250-W358 HydrophobicContact CG1-CZ3 4.14Å; V250-W358 HydrophobicContact CG2-CZ3 4.16Å; I253-W358 HydrophobicContact CB-CH2 3.89Å; I253-W358 HydrophobicContact CB-CZ3 3.92Å; I253-W358 HydrophobicContact CD1-CE3 4.35Å; I253-W358 HydrophobicContact CD1-CZ3 4.21Å; I253-W358 HydrophobicContact CG2-CD2 4.35Å; I253-W358 HydrophobicContact CG2-CE3 4.14Å; I253-W358 HydrophobicContact CG2-CH2 3.58Å; I253-W358 HydrophobicContact CG2-CZ2 3.81Å; I253-W358 HydrophobicContact CG2-CZ3 3.76Å; D254-W358 HydrophobicContact CB-CH2 4.39Å; S355-W358 PolarHBondContact O-N 3.4Å; C356-W358 VanDerWaalsContact C-N 3.3Å; C356-W358 PolarHBondContact O-N 2.76Å; W358-S360 VanDerWaalsContact C-N 3.34Å; W358-L361 HydrophobicContact CE3-CD2 3.93Å; W358-L361 HydrophobicContact CZ3-CD2 4.11Å; W358-L361 WeakPolarHBondContact O-CB 3.47Å; W358-L361 PolarHBondContact O-N 3.27Å; W358-G362 PolarHBondContact O-N 3.32Å; W358-G362 VanDerWaalsContact O-N 3.11Å; W358-L413 HydrophobicContact CB-CD2 4.05Å; W358-S422 PolarHBondContact NE1-O 3.04Å; W358-S422 VanDerWaalsContact NE1-O 3.15Å; W358-I427 HydrophobicContact CD2-CD1 3.72Å; W358-I427 HydrophobicContact CE3-CD1 3.54Å; W358-I427 HydrophobicContact CG-CD1 4.39Å; W358-I427 HydrophobicContact CH2-CD1 3.99Å; W358-I427 HydrophobicContact CZ2-CD1 4.14Å; W358-I427 HydrophobicContact CZ3-CD1 3.68Å
359	W	97.4	Very high	92	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.1	-49.7	169.4	172.9	-82.6	0	0	0	110.7	I342 A343 P344 S355 C356 L361 G362 V363 F375 I387 W390 C414 C415	I342-W359 PolarHBondContact O-NE1 3.44Å; A343-W359 VanDerWaalsContact CA-CD1 3.42Å; A343-W359 HydrophobicContact CB-CB 3.65Å; A343-W359 HydrophobicContact CB-CD2 4.17Å; A343-W359 HydrophobicContact CB-CG 3.58Å; P344-W359 HydrophobicContact CG-CE3 4.42Å; P344-W359 HydrophobicContact CG-CH2 4.02Å; P344-W359 HydrophobicContact CG-CZ2 4.38Å; P344-W359 HydrophobicContact CG-CZ3 4.04Å; S355-W359 PolarHBondContact O-N 3.33Å; C356-W359 WeakPolarHBondContact O-CB 3.07Å; C356-W359 PolarHBondContact O-N 3.43Å; W359-L361 PolarHBondContact O-N 3.45Å; W359-G362 WeakPolarHBondContact O-CA 3.31Å; W359-G362 PolarHBondContact O-N 2.76Å; W359-V363 PolarHBondContact O-N 2.96Å; W359-F375 HydrophobicContact CH2-CE2 4.29Å; W359-F375 HydrophobicContact CH2-CZ 4.1Å; W359-F375 HydrophobicContact CZ2-CD2 4.42Å; W359-F375 AromaticContact CZ2-CE2 3.44Å; W359-F375 HydrophobicContact CZ2-CE2 3.44Å; W359-F375 VanDerWaalsContact CZ2-CE2 3.44Å; W359-F375 AromaticContact CZ2-CZ 3.71Å; W359-F375 HydrophobicContact CZ2-CZ 3.71Å; W359-I387 HydrophobicContact CZ2-CG2 4.42Å; W359-W390 HydrophobicContact CH2-CB 3.64Å; W359-W390 AromaticContact CH2-CD1 3.93Å; W359-W390 HydrophobicContact CH2-CD2 4.13Å; W359-W390 AromaticContact CH2-CG 3.62Å; W359-W390 HydrophobicContact CH2-CG 3.62Å; W359-W390 HydrophobicContact CZ2-CB 4.35Å; W359-W390 HydrophobicContact CZ3-CD2 4.33Å; W359-W390 HydrophobicContact CZ3-CG 4.23Å; W359-C414 HydrophobicContact CE3-CB 4.32Å; W359-C414 HydrophobicContact CH2-CB 4.43Å; W359-C414 HydrophobicContact CZ3-CB 4.19Å; W359-C415 WeakPolarHBondContact CZ3-O 3.35Å
360	S	96.8	Very high	93.2	Very high	5 Å²	5	23 Å²	23	4%	0.035	13%	0.127	C	C	.	.	H	α-helix	trans	-57.2	-41	-179.8	-50.2	0	0	0	0	111.1	I266 Y341 C356 D357 W358 G362 V363 I364	I266-S360 WeakPolarHBondContact O-CB 3.16Å; Y341-S360 WeakPolarHBondContact O-CA 3.41Å; Y341-S360 WeakPolarHBondContact O-CB 3.33Å; Y341-S360 PolarHBondContact O-OG 3.24Å; C356-S360 PolarHBondContact O-N 3.4Å; C356-S360 PolarHBondContact O-OG 2.88Å; D357-S360 WeakPolarHBondContact O-CB 3.32Å; D357-S360 PolarHBondContact O-N 3.27Å; W358-S360 VanDerWaalsContact C-N 3.34Å; S360-G362 PolarHBondContact O-N 3.12Å; S360-V363 WeakPolarHBondContact O-CB 3.42Å; S360-V363 PolarHBondContact O-N 3.35Å; S360-I364 WeakPolarHBondContact O-CG1 3.37Å; S360-I364 PolarHBondContact O-N 2.82Å
361	L	98	Very high	94	Very high	1 Å²	1	14.5 Å²	14.5	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-60.7	-41.8	173.6	-176.6	66.8	0	0	0	112.7	I246 T249 V250 I253 D357 W358 W359 V363 I364 M365	I246-L361 HydrophobicContact CD1-CD1 3.66Å; I246-L361 HydrophobicContact CD1-CG 4.36Å; I246-L361 HydrophobicContact CG2-CD1 4.24Å; I246-L361 HydrophobicContact CG2-CD2 4.24Å; I246-L361 HydrophobicContact CG2-CG 4.32Å; T249-L361 HydrophobicContact CG2-CD1 3.6Å; V250-L361 HydrophobicContact CG2-CD2 3.5Å; V250-L361 VanDerWaalsContact CG2-CD2 3.5Å; I253-L361 HydrophobicContact CD1-CB 4.33Å; D357-L361 PolarHBondContact O-N 2.84Å; W358-L361 HydrophobicContact CE3-CD2 3.93Å; W358-L361 HydrophobicContact CZ3-CD2 4.11Å; W358-L361 WeakPolarHBondContact O-CB 3.47Å; W358-L361 PolarHBondContact O-N 3.27Å; W359-L361 PolarHBondContact O-N 3.45Å; L361-V363 VanDerWaalsContact C-N 3.34Å; L361-V363 PolarHBondContact O-N 3.1Å; L361-I364 PolarHBondContact O-N 2.68Å; L361-M365 PolarHBondContact O-N 3.47Å
362	G	98.2	Very high	94.9	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-62.7	-39	175.4	0	0	0	0	0	113	W358 W359 S360 M365 Y366 C414	W358-G362 PolarHBondContact O-N 3.32Å; W358-G362 VanDerWaalsContact O-N 3.11Å; W359-G362 WeakPolarHBondContact O-CA 3.31Å; W359-G362 PolarHBondContact O-N 2.76Å; S360-G362 PolarHBondContact O-N 3.12Å; G362-M365 PolarHBondContact O-N 3.4Å; G362-Y366 PolarHBondContact O-N 3.5Å; G362-C414 VanDerWaalsContact C-SG 3.54Å
363	V	98.2	Very high	95.5	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-63.4	-43.9	173.7	177.8	0	0	0	0	110.8	D340 Y341 W359 S360 L361 Y366 E367 P373 P374 F375	D340-V363 WeakPolarHBondContact O-CG1 3.34Å; Y341-V363 HydrophobicContact CD1-CB 4.01Å; Y341-V363 HydrophobicContact CD1-CG1 3.39Å; Y341-V363 HydrophobicContact CE1-CG1 3.82Å; Y341-V363 HydrophobicContact CG-CG1 4.17Å; W359-V363 PolarHBondContact O-N 2.96Å; S360-V363 WeakPolarHBondContact O-CB 3.42Å; S360-V363 PolarHBondContact O-N 3.35Å; L361-V363 VanDerWaalsContact C-N 3.34Å; L361-V363 PolarHBondContact O-N 3.1Å; V363-Y366 PolarHBondContact O-N 3.1Å; V363-E367 PolarHBondContact O-N 2.85Å; V363-P373 HydrophobicContact CG1-CB 3.97Å; V363-P374 HydrophobicContact CG1-CG 4.43Å; V363-F375 HydrophobicContact CG2-CE2 4.11Å
364	I	98	Very high	95.9	Very high	0 Å²	0	4.7 Å²	4.7	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-62.6	-45.1	176.3	-67.8	171.8	0	0	0	110.9	I246 I266 P268 L271 Y341 S360 L361 Y366 E367 M368	I246-I364 HydrophobicContact CD1-CG2 4.34Å; I266-I364 HydrophobicContact CG2-CD1 3.59Å; P268-I364 HydrophobicContact CG-CG1 4.23Å; L271-I364 HydrophobicContact CD1-CD1 4.01Å; L271-I364 HydrophobicContact CD1-CG2 4.45Å; Y341-I364 HydrophobicContact CD1-CG1 3.92Å; Y341-I364 HydrophobicContact CE1-CG1 4.03Å; S360-I364 WeakPolarHBondContact O-CG1 3.37Å; S360-I364 PolarHBondContact O-N 2.82Å; L361-I364 PolarHBondContact O-N 2.68Å; I364-Y366 VanDerWaalsContact C-N 3.32Å; I364-Y366 PolarHBondContact O-N 3.15Å; I364-E367 PolarHBondContact O-N 3.25Å; I364-E367 VanDerWaalsContact O-N 3.11Å; I364-M368 HydrophobicContact CG2-CE 3.7Å; I364-M368 HydrophobicContact CG2-CG 4.35Å; I364-M368 HydrophobicContact CG2-SD 4.18Å; I364-M368 WeakPolarHBondContact O-CG 3.47Å; I364-M368 PolarHBondContact O-N 3.42Å
365	M	98.4	Very high	96.1	Very high	0 Å²	0	2 Å²	2	0%	0	1%	0.012	C	C	.	.	H	α-helix	trans	-59.9	-43.1	177.9	-176.7	178.3	172.3	0	0	111.6	T242 I246 L361 G362 E367 M368 L369 L409 I410 F432	T242-M365 HydrophobicContact CG2-CG 3.93Å; I246-M365 HydrophobicContact CD1-CB 3.71Å; I246-M365 HydrophobicContact CD1-CG 4.3Å; I246-M365 HydrophobicContact CG1-CB 4.05Å; I246-M365 HydrophobicContact CG1-CG 4.07Å; L361-M365 PolarHBondContact O-N 3.47Å; G362-M365 PolarHBondContact O-N 3.4Å; M365-E367 VanDerWaalsContact C-N 3.34Å; M365-M368 PolarHBondContact O-N 3.35Å; M365-L369 HydrophobicContact CE-CD1 3.98Å; M365-L369 HydrophobicContact CG-CD1 4.24Å; M365-L369 WeakPolarHBondContact O-CG 3.19Å; M365-L369 PolarHBondContact O-N 3.22Å; M365-L409 HydrophobicContact CE-CB 4.26Å; M365-L409 HydrophobicContact CE-CD2 3.9Å; M365-L409 HydrophobicContact CE-CG 4.33Å; M365-L409 HydrophobicContact SD-CB 4.27Å; M365-L409 HydrophobicContact SD-CD2 3.55Å; M365-L409 VanDerWaalsContact SD-CD2 3.55Å; M365-L409 HydrophobicContact SD-CG 3.81Å; M365-I410 HydrophobicContact CB-CG1 4.15Å; M365-I410 HydrophobicContact CE-CD1 4.45Å; M365-I410 HydrophobicContact CE-CG1 4.21Å; M365-I410 HydrophobicContact CG-CD1 4.11Å; M365-I410 HydrophobicContact CG-CG1 3.85Å; M365-I410 HydrophobicContact SD-CD1 4.45Å; M365-I410 HydrophobicContact SD-CG1 3.76Å; M365-F432 HydrophobicContact CE-CD1 4.01Å; M365-F432 HydrophobicContact CE-CD2 3.92Å; M365-F432 HydrophobicContact CE-CE1 3.69Å; M365-F432 HydrophobicContact CE-CE2 3.63Å; M365-F432 HydrophobicContact CE-CG 4.11Å; M365-F432 HydrophobicContact CE-CZ 3.51Å; M365-F432 HydrophobicContact SD-CE1 4.4Å
366	Y	98.2	Very high	96	Very high	2 Å²	2	2.7 Å²	2.7	1%	0.008	2%	0.016	C	C	.	.	H	α-helix	trans	-59.8	-46.5	173.6	-178.3	-74.3	0	0	0	110.8	G362 V363 I364 M368 L369 I370 Y372 P374 L394 F395 F396 I410	G362-Y366 PolarHBondContact O-N 3.5Å; V363-Y366 PolarHBondContact O-N 3.1Å; I364-Y366 VanDerWaalsContact C-N 3.32Å; I364-Y366 PolarHBondContact O-N 3.15Å; Y366-M368 VanDerWaalsContact C-N 3.35Å; Y366-M368 PolarHBondContact O-N 2.66Å; Y366-L369 PolarHBondContact O-N 3.37Å; Y366-I370 HydrophobicContact CD1-CB 3.95Å; Y366-I370 HydrophobicContact CD1-CG1 3.95Å; Y366-I370 HydrophobicContact CD2-CG1 4.12Å; Y366-I370 HydrophobicContact CE1-CB 3.58Å; Y366-I370 HydrophobicContact CE1-CG1 3.73Å; Y366-I370 HydrophobicContact CE1-CG2 3.68Å; Y366-I370 HydrophobicContact CE2-CG1 3.91Å; Y366-I370 HydrophobicContact CG-CG1 4.13Å; Y366-I370 VanDerWaalsContact O-CB 3.29Å; Y366-I370 WeakPolarHBondContact O-CB 3.27Å; Y366-I370 WeakPolarHBondContact O-CG1 3.44Å; Y366-I370 PolarHBondContact O-N 2.78Å; Y366-Y372 WeakPolarHBondContact CD1-O 3.37Å; Y366-Y372 HydrophobicContact CE1-CD2 4.36Å; Y366-Y372 HydrophobicContact CE1-CE2 4.27Å; Y366-Y372 WeakPolarHBondContact CE1-O 3.34Å; Y366-P374 HydrophobicContact CD1-CB 3.94Å; Y366-P374 VanDerWaalsContact CD1-CD 3.4Å; Y366-P374 HydrophobicContact CD1-CG 4.12Å; Y366-P374 HydrophobicContact CD2-CB 4.04Å; Y366-P374 HydrophobicContact CD2-CG 4.44Å; Y366-P374 HydrophobicContact CE1-CB 3.93Å; Y366-P374 HydrophobicContact CE2-CB 4.01Å; Y366-P374 HydrophobicContact CG-CB 4.02Å; Y366-P374 HydrophobicContact CG-CG 4.06Å; Y366-L394 HydrophobicContact CD2-CD1 4.2Å; Y366-L394 HydrophobicContact CE2-CD1 4.32Å; Y366-F395 PolarHBondContact OH-O 2.88Å; Y366-F396 HydrophobicContact CD2-CD1 4.16Å; Y366-F396 AromaticContact CD2-CE1 3.78Å; Y366-F396 HydrophobicContact CD2-CE1 3.78Å; Y366-F396 HydrophobicContact CD2-CZ 4.47Å; Y366-F396 AromaticContact CE2-CD1 3.87Å; Y366-F396 HydrophobicContact CE2-CD1 3.87Å; Y366-F396 AromaticContact CE2-CE1 3.94Å; Y366-F396 HydrophobicContact CE2-CE1 3.94Å; Y366-I410 HydrophobicContact CD2-CD1 4.43Å; Y366-I410 HydrophobicContact CD2-CG2 4.31Å
367	E	96.7	Very high	95.7	Very high	0 Å²	0	3.3 Å²	3.3	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-62.6	-39.3	179.4	-178.3	175.4	-162.7	0	0	112.8	L231 P268 W324 R328 Y341 V363 I364 M365 L369 G371 P373	L231-E367 HydrophobicContact CD1-CG 4.25Å; P268-E367 WeakPolarHBondContact CG-OE2 3.45Å; W324-E367 PolarHBondContact NE1-OE1 3Å; R328-E367 IonicContact CZ-OE1 3.74Å; R328-E367 IonicContact NE-OE1 2.7Å; R328-E367 PolarHBondContact NE-OE1 3.07Å; R328-E367 VanDerWaalsContact NH2-CG 3.32Å; R328-E367 IonicContact NH2-OE1 3.85Å; R328-E367 PolarHBondContact NH2-OE1 3.37Å; Y341-E367 VanDerWaalsContact CE1-OE2 3.26Å; Y341-E367 WeakPolarHBondContact CE1-OE2 3.36Å; Y341-E367 VanDerWaalsContact CZ-OE2 3.3Å; Y341-E367 PolarHBondContact OH-OE1 2.74Å; Y341-E367 PolarHBondContact OH-OE2 3.17Å; V363-E367 PolarHBondContact O-N 2.85Å; I364-E367 PolarHBondContact O-N 3.25Å; I364-E367 VanDerWaalsContact O-N 3.11Å; M365-E367 VanDerWaalsContact C-N 3.34Å; E367-L369 VanDerWaalsContact C-N 3.31Å; E367-L369 PolarHBondContact O-N 3.45Å; E367-G371 WeakPolarHBondContact O-CA 3.31Å; E367-G371 PolarHBondContact O-N 3.04Å; E367-P373 HydrophobicContact CB-CG 4.44Å; E367-P373 HydrophobicContact CG-CG 4.34Å
368	M	97.4	Very high	95.2	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-59.4	-41.9	175.7	-72.4	176.5	169.1	0	0	111.8	M227 L231 T236 L237 T242 I246 I364 M365 Y366	M227-M368 HydrophobicContact CE-CE 3.93Å; M227-M368 HydrophobicContact CG-CE 3.8Å; M227-M368 HydrophobicContact SD-CE 3.68Å; L231-M368 HydrophobicContact CD1-CG 4.39Å; L231-M368 HydrophobicContact CD2-CB 4.44Å; L231-M368 HydrophobicContact CD2-CG 4.05Å; T236-M368 CarbonylContact C-O 3.59Å; T236-M368 WeakPolarHBondContact CA-O 3.36Å; T236-M368 WeakPolarHBondContact CB-O 3.46Å; L237-M368 HydrophobicContact CB-CB 4.44Å; L237-M368 HydrophobicContact CD1-CB 4.33Å; L237-M368 HydrophobicContact CD1-CE 4.4Å; L237-M368 HydrophobicContact CD1-CG 4.01Å; L237-M368 HydrophobicContact CD1-SD 4.19Å; L237-M368 HydrophobicContact CG-CB 4.5Å; L237-M368 PolarHBondContact N-O 3.35Å; T242-M368 HydrophobicContact CG2-CB 4.03Å; T242-M368 HydrophobicContact CG2-SD 3.93Å; I246-M368 HydrophobicContact CD1-CE 4.47Å; I246-M368 HydrophobicContact CD1-SD 3.86Å; I246-M368 HydrophobicContact CG1-SD 4.09Å; I364-M368 HydrophobicContact CG2-CE 3.7Å; I364-M368 HydrophobicContact CG2-CG 4.35Å; I364-M368 HydrophobicContact CG2-SD 4.18Å; I364-M368 WeakPolarHBondContact O-CG 3.47Å; I364-M368 PolarHBondContact O-N 3.42Å; M365-M368 PolarHBondContact O-N 3.35Å; Y366-M368 VanDerWaalsContact C-N 3.35Å; Y366-M368 PolarHBondContact O-N 2.66Å
369	L	97	Very high	94.6	Very high	10 Å²	10	9.5 Å²	9.5	5%	0.052	7%	0.067	C	C	.	.	H	α-helix	trans	-86.1	-34.9	-174.6	-64.8	173.5	0	0	0	113.4	E239 T242 M365 Y366 E367 I402 I410	E239-L369 HydrophobicContact CG-CD2 3.99Å; T242-L369 HydrophobicContact CG2-CD1 4.39Å; T242-L369 HydrophobicContact CG2-CD2 4.08Å; T242-L369 HydrophobicContact CG2-CG 4.05Å; T242-L369 WeakPolarHBondContact OG1-CD2 2.94Å; M365-L369 HydrophobicContact CE-CD1 3.98Å; M365-L369 HydrophobicContact CG-CD1 4.24Å; M365-L369 WeakPolarHBondContact O-CG 3.19Å; M365-L369 PolarHBondContact O-N 3.22Å; Y366-L369 PolarHBondContact O-N 3.37Å; E367-L369 VanDerWaalsContact C-N 3.31Å; E367-L369 PolarHBondContact O-N 3.45Å; L369-I402 HydrophobicContact CB-CD1 4.4Å; L369-I402 HydrophobicContact CD1-CD1 3.8Å; L369-I402 HydrophobicContact CD1-CG1 4.14Å; L369-I410 HydrophobicContact CD1-CD1 4.2Å
370	I	95	Very high	94	Very high	3 Å²	3	10.7 Å²	10.7	2%	0.015	8%	0.075	C	C	.	.	H	α-helix	trans	-102.3	-24.9	-172.1	-54.2	-58.6	0	0	0	112.4	Y366 Y372 P397 M400 I402	Y366-I370 HydrophobicContact CD1-CB 3.95Å; Y366-I370 HydrophobicContact CD1-CG1 3.95Å; Y366-I370 HydrophobicContact CD2-CG1 4.12Å; Y366-I370 HydrophobicContact CE1-CB 3.58Å; Y366-I370 HydrophobicContact CE1-CG1 3.73Å; Y366-I370 HydrophobicContact CE1-CG2 3.68Å; Y366-I370 HydrophobicContact CE2-CG1 3.91Å; Y366-I370 HydrophobicContact CG-CG1 4.13Å; Y366-I370 VanDerWaalsContact O-CB 3.29Å; Y366-I370 WeakPolarHBondContact O-CB 3.27Å; Y366-I370 WeakPolarHBondContact O-CG1 3.44Å; Y366-I370 PolarHBondContact O-N 2.78Å; I370-Y372 HydrophobicContact CG2-CD1 4.11Å; I370-Y372 HydrophobicContact CG2-CE1 3.62Å; I370-Y372 HydrophobicContact CG2-CE2 4.35Å; I370-P397 HydrophobicContact CG2-CG 4.13Å; I370-M400 HydrophobicContact CD1-CB 3.85Å; I370-M400 HydrophobicContact CD1-CG 4.33Å; I370-M400 HydrophobicContact CG2-CG 4.41Å; I370-I402 HydrophobicContact CD1-CD1 4.38Å; I370-I402 HydrophobicContact CD1-CG2 4.49Å
371	G	93.2	Very high	93.5	Very high	1 Å²	1	13.4 Å²	13.4	1%	0.01	9%	0.087	C	C	.	.	S	Bend	trans	97.3	-4.2	177.8	0	0	0	0	0	115	D235 R328 E367	D235-G371 WeakPolarHBondContact O-CA 3.48Å; R328-G371 PolarHBondContact NH2-O 2.99Å; E367-G371 WeakPolarHBondContact O-CA 3.31Å; E367-G371 PolarHBondContact O-N 3.04Å
372	Y	93.2	Very high	93.1	Very high	1 Å²	1	17.3 Å²	17.3	0%	0.004	11%	0.105	C	C	.	.	S	Bend	trans	-151.7	153.1	174.4	57.2	-90.1	0	0	0	110.8	S317 R320 A321 Y366 I370 P397	S317-Y372 PolarHBondContact OG-OH 3.03Å; R320-Y372 HydrophobicContact CB-CD1 3.81Å; R320-Y372 HydrophobicContact CB-CD2 4.42Å; R320-Y372 HydrophobicContact CB-CE1 3.65Å; R320-Y372 HydrophobicContact CB-CE2 4.3Å; R320-Y372 HydrophobicContact CB-CG 4.2Å; A321-Y372 HydrophobicContact CB-CD1 4.17Å; Y366-Y372 WeakPolarHBondContact CD1-O 3.37Å; Y366-Y372 HydrophobicContact CE1-CD2 4.36Å; Y366-Y372 HydrophobicContact CE1-CE2 4.27Å; Y366-Y372 WeakPolarHBondContact CE1-O 3.34Å; I370-Y372 HydrophobicContact CG2-CD1 4.11Å; I370-Y372 HydrophobicContact CG2-CE1 3.62Å; I370-Y372 HydrophobicContact CG2-CE2 4.35Å; Y372-P397 VanDerWaalsContact OH-CG 3.32Å; Y372-P397 WeakPolarHBondContact OH-CG 3.16Å
373	P	95.1	Very high	92.7	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	11%	0.105	C	C	.	.			trans	-63.6	145	174.7	-23.9	32.8	0	0	0	112.2	W324 D340 Y341 V363 E367 F375 C376	W324-P373 HydrophobicContact CD2-CG 4.45Å; W324-P373 HydrophobicContact CH2-CG 3.87Å; W324-P373 VanDerWaalsContact CZ2-CD 3.47Å; W324-P373 HydrophobicContact CZ2-CG 3.36Å; D340-P373 HydrophobicContact CB-CB 4.12Å; D340-P373 HydrophobicContact CB-CG 4.3Å; Y341-P373 HydrophobicContact CE1-CG 4.25Å; V363-P373 HydrophobicContact CG1-CB 3.97Å; E367-P373 HydrophobicContact CB-CG 4.44Å; E367-P373 HydrophobicContact CG-CG 4.34Å; P373-F375 PolarHBondContact O-N 2.98Å; P373-F375 VanDerWaalsContact O-N 3.1Å; P373-C376 HydrophobicContact CB-CB 4.39Å; P373-C376 WeakPolarHBondContact O-CB 3.28Å; P373-C376 PolarHBondContact O-N 3.2Å; P373-C376 VanDerWaalsContact O-N 3.14Å
374	P	95.2	Very high	92.4	Very high	10 Å²	10	18.2 Å²	18.2	7%	0.065	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-31.6	-173.8	22.9	-32.6	0	0	0	113.5	V363 Y366 L394	V363-P374 HydrophobicContact CG1-CG 4.43Å; Y366-P374 HydrophobicContact CD1-CB 3.94Å; Y366-P374 VanDerWaalsContact CD1-CD 3.4Å; Y366-P374 HydrophobicContact CD1-CG 4.12Å; Y366-P374 HydrophobicContact CD2-CB 4.04Å; Y366-P374 HydrophobicContact CD2-CG 4.44Å; Y366-P374 HydrophobicContact CE1-CB 3.93Å; Y366-P374 HydrophobicContact CE2-CB 4.01Å; Y366-P374 HydrophobicContact CG-CB 4.02Å; Y366-P374 HydrophobicContact CG-CG 4.06Å; P374-L394 HydrophobicContact CB-CD1 3.61Å; P374-L394 HydrophobicContact CG-CD1 4.14Å
375	F	94.5	Very high	92	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	6.1	-174.4	-45.5	-60.1	0	0	0	113.7	W359 V363 P373 S377 T383 K386 I387 W390 A393 L394	W359-F375 HydrophobicContact CH2-CE2 4.29Å; W359-F375 HydrophobicContact CH2-CZ 4.1Å; W359-F375 HydrophobicContact CZ2-CD2 4.42Å; W359-F375 AromaticContact CZ2-CE2 3.44Å; W359-F375 HydrophobicContact CZ2-CE2 3.44Å; W359-F375 VanDerWaalsContact CZ2-CE2 3.44Å; W359-F375 AromaticContact CZ2-CZ 3.71Å; W359-F375 HydrophobicContact CZ2-CZ 3.71Å; V363-F375 HydrophobicContact CG2-CE2 4.11Å; P373-F375 PolarHBondContact O-N 2.98Å; P373-F375 VanDerWaalsContact O-N 3.1Å; F375-S377 PolarHBondContact O-N 2.98Å; F375-S377 PolarHBondContact O-OG 3.11Å; F375-T383 HydrophobicContact CB-CG2 4.29Å; F375-T383 WeakPolarHBondContact O-CG2 3.47Å; F375-T383 PolarHBondContact O-OG1 3.49Å; F375-K386 HydrophobicContact CB-CB 4.04Å; F375-K386 HydrophobicContact CD1-CB 4.21Å; F375-I387 HydrophobicContact CB-CG1 3.78Å; F375-I387 HydrophobicContact CD2-CG1 3.77Å; F375-I387 HydrophobicContact CG-CG1 3.8Å; F375-W390 HydrophobicContact CE1-CB 3.93Å; F375-W390 HydrophobicContact CZ-CB 3.98Å; F375-A393 HydrophobicContact CD1-CB 4.11Å; F375-A393 HydrophobicContact CE1-CB 4.3Å; F375-L394 HydrophobicContact CE1-CB 4.23Å; F375-L394 HydrophobicContact CZ-CD1 4.48Å
376	C	90.9	Very high	91.8	Very high	18 Å²	18	22.2 Å²	22.2	12%	0.122	13%	0.126	C	C	.	.			trans	-59.9	137	-175	83.3	0	0	0	0	111.8	W324 D340 P373 K386	W324-C376 HydrophobicContact CD2-CB 4.39Å; W324-C376 HydrophobicContact CE3-CB 3.68Å; W324-C376 HydrophobicContact CZ3-CB 3.75Å; D340-C376 WeakPolarHBondContact OD1-CA 3.48Å; D340-C376 PolarHBondContact OD1-N 2.83Å; P373-C376 HydrophobicContact CB-CB 4.39Å; P373-C376 WeakPolarHBondContact O-CB 3.28Å; P373-C376 PolarHBondContact O-N 3.2Å; P373-C376 VanDerWaalsContact O-N 3.14Å; C376-K386 PolarHBondContact O-NZ 3.12Å
377	S	87.3	Confident	91.6	Very high	17 Å²	17	22.1 Å²	22.1	12%	0.119	13%	0.126	C	C	.	.			trans	-144.2	177.1	-177.5	-54.8	0	0	0	0	110.7	K327 F375 E382 T383 K386	K327-S377 PolarHBondContact NZ-O 3.2Å; F375-S377 PolarHBondContact O-N 2.98Å; F375-S377 PolarHBondContact O-OG 3.11Å; S377-E382 VanDerWaalsContact CB-CB 3.41Å; S377-T383 PolarHBondContact N-OG1 3.27Å; S377-K386 WeakPolarHBondContact OG-CD 3.35Å; S377-K386 VanDerWaalsContact OG-CE 3.23Å; S377-K386 WeakPolarHBondContact OG-CE 3.46Å; S377-K386 PolarHBondContact OG-NZ 3.38Å
378	A	82.6	Confident	91.4	Very high	80 Å²	80	24.4 Å²	24.4	66%	0.661	14%	0.137	S	C	*	.	S	Bend	trans	-68.7	-45.6	177.8	0	0	0	0	0	110	K327 E382	K327-A378 PolarHBondContact NZ-O 2.99Å; A378-E382 PolarHBondContact N-OE2 3.34Å; A378-E382 VanDerWaalsContact N-OE2 3.17Å
379	T	84.9	Confident	91.2	Very high	52 Å²	52	27.2 Å²	27.2	32%	0.319	15%	0.152	S	C	.	.	S	Bend	trans	-109.7	150.8	-177.5	68.4	0	0	0	0	112.8	Q381 E382 T383	T379-Q381 PolarHBondContact O-N 2.97Å; T379-E382 PolarHBondContact N-OE2 3.31Å; T379-E382 PolarHBondContact O-N 3.38Å; T379-E382 VanDerWaalsContact OG1-CG 3.27Å; T379-E382 WeakPolarHBondContact OG1-CG 3.28Å; T379-E382 PolarHBondContact OG1-N 2.98Å; T379-E382 PolarHBondContact OG1-OE2 2.88Å; T379-T383 PolarHBondContact O-N 2.97Å; T379-T383 VanDerWaalsContact O-N 3.14Å; T379-T383 PolarHBondContact O-OG1 3.47Å
380	P	85.9	Confident	91.1	Very high	24 Å²	24	29 Å²	29	16%	0.156	16%	0.158	C	C	.	.	H	α-helix	trans	-57.4	-32.6	172.8	-25.7	35.1	0	0	0	113.6	A293 F298 V336 T383 Y384	A293-P380 HydrophobicContact CB-CB 3.99Å; A293-P380 HydrophobicContact CB-CG 4.49Å; F298-P380 HydrophobicContact CE1-CB 4.21Å; V336-P380 HydrophobicContact CG1-CG 4.39Å; P380-T383 PolarHBondContact O-N 3.44Å; P380-Y384 WeakPolarHBondContact O-CB 3.38Å; P380-Y384 PolarHBondContact O-N 3.03Å
381	Q	86.3	Confident	91	Very high	62 Å²	62	37 Å²	37	29%	0.29	19%	0.193	S	C	.	.	H	α-helix	trans	-66.4	-42	178.3	-67.2	82	-3.8	0	0	112.2	F298 L302 T379 Y384 K385	F298-Q381 HydrophobicContact CE1-CG 4.48Å; F298-Q381 VanDerWaalsContact CZ-NE2 3.33Å; L302-Q381 HydrophobicContact CD1-CB 4.34Å; L302-Q381 HydrophobicContact CD1-CG 3.76Å; L302-Q381 HydrophobicContact CD2-CB 3.97Å; L302-Q381 HydrophobicContact CD2-CG 4.26Å; T379-Q381 PolarHBondContact O-N 2.97Å; Q381-Y384 PolarHBondContact O-N 3.49Å; Q381-K385 WeakPolarHBondContact O-CG 3.43Å; Q381-K385 PolarHBondContact O-N 2.6Å
382	E	88.6	Confident	91	Very high	83 Å²	83	43.7 Å²	43.7	39%	0.388	22%	0.224	S	C	.	.	H	α-helix	trans	-65.6	-42.5	173.2	-73.6	165.1	177.9	0	0	111.6	S377 A378 T379 Y384 K385 K386	S377-E382 VanDerWaalsContact CB-CB 3.41Å; A378-E382 PolarHBondContact N-OE2 3.34Å; A378-E382 VanDerWaalsContact N-OE2 3.17Å; T379-E382 PolarHBondContact N-OE2 3.31Å; T379-E382 PolarHBondContact O-N 3.38Å; T379-E382 VanDerWaalsContact OG1-CG 3.27Å; T379-E382 WeakPolarHBondContact OG1-CG 3.28Å; T379-E382 PolarHBondContact OG1-N 2.98Å; T379-E382 PolarHBondContact OG1-OE2 2.88Å; E382-Y384 VanDerWaalsContact C-N 3.33Å; E382-Y384 PolarHBondContact O-N 2.98Å; E382-K385 PolarHBondContact O-N 3.27Å; E382-K386 PolarHBondContact O-N 3.27Å
383	T	90.9	Very high	91	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-57.8	-47.5	174.2	-62.8	0	0	0	0	110.3	P339 D340 F375 S377 T379 P380 K385 K386 I387	P339-T383 HydrophobicContact CG-CG2 3.72Å; D340-T383 HydrophobicContact CB-CG2 4.44Å; D340-T383 WeakPolarHBondContact OD1-CG2 3.15Å; F375-T383 HydrophobicContact CB-CG2 4.29Å; F375-T383 WeakPolarHBondContact O-CG2 3.47Å; F375-T383 PolarHBondContact O-OG1 3.49Å; S377-T383 PolarHBondContact N-OG1 3.27Å; T379-T383 PolarHBondContact O-N 2.97Å; T379-T383 VanDerWaalsContact O-N 3.14Å; T379-T383 PolarHBondContact O-OG1 3.47Å; P380-T383 PolarHBondContact O-N 3.44Å; T383-K385 PolarHBondContact O-N 3.29Å; T383-K386 PolarHBondContact O-N 2.93Å; T383-K386 VanDerWaalsContact O-N 3.15Å; T383-I387 HydrophobicContact CG2-CD1 3.84Å; T383-I387 HydrophobicContact CG2-CG1 4.41Å; T383-I387 WeakPolarHBondContact O-CG1 3.36Å; T383-I387 PolarHBondContact O-N 3.36Å
384	Y	90.5	Very high	91	Very high	20 Å²	20	45.6 Å²	45.6	8%	0.078	24%	0.236	C	C	.	.	H	α-helix	trans	-56.2	-46.9	175.2	169.8	-92.4	0	0	0	112.5	Y299 L302 F347 P380 Q381 E382 K386 I387 M388	Y299-Y384 AromaticContact CD1-CD1 3.81Å; Y299-Y384 HydrophobicContact CD1-CD1 3.81Å; Y299-Y384 AromaticContact CD1-CD2 3.76Å; Y299-Y384 HydrophobicContact CD1-CD2 3.76Å; Y299-Y384 HydrophobicContact CD1-CE1 4.46Å; Y299-Y384 HydrophobicContact CD1-CE2 4.39Å; Y299-Y384 AromaticContact CD1-CG 3.42Å; Y299-Y384 HydrophobicContact CD1-CG 3.42Å; Y299-Y384 VanDerWaalsContact CD1-CG 3.42Å; Y299-Y384 AromaticContact CD2-CD2 3.55Å; Y299-Y384 HydrophobicContact CD2-CD2 3.55Å; Y299-Y384 AromaticContact CD2-CE2 3.83Å; Y299-Y384 HydrophobicContact CD2-CE2 3.83Å; Y299-Y384 HydrophobicContact CD2-CG 4.13Å; Y299-Y384 HydrophobicContact CE1-CD1 4.48Å; Y299-Y384 HydrophobicContact CE1-CD2 4.08Å; Y299-Y384 AromaticContact CE1-CG 3.74Å; Y299-Y384 HydrophobicContact CE1-CG 3.74Å; Y299-Y384 AromaticContact CE2-CD2 3.88Å; Y299-Y384 HydrophobicContact CE2-CD2 3.88Å; Y299-Y384 HydrophobicContact CE2-CG 4.39Å; Y299-Y384 HydrophobicContact CG-CD1 4.02Å; Y299-Y384 AromaticContact CG-CD2 3.47Å; Y299-Y384 HydrophobicContact CG-CD2 3.47Å; Y299-Y384 VanDerWaalsContact CG-CD2 3.47Å; Y299-Y384 HydrophobicContact CG-CE1 4.27Å; Y299-Y384 AromaticContact CG-CE2 3.73Å; Y299-Y384 HydrophobicContact CG-CE2 3.73Å; Y299-Y384 AromaticContact CG-CG 3.63Å; Y299-Y384 HydrophobicContact CG-CG 3.63Å; L302-Y384 HydrophobicContact CB-CE1 4.43Å; F347-Y384 HydrophobicContact CB-CE2 4.01Å; F347-Y384 HydrophobicContact CD1-CD2 4.24Å; F347-Y384 HydrophobicContact CD1-CE2 4.03Å; F347-Y384 HydrophobicContact CD2-CD2 4.23Å; F347-Y384 HydrophobicContact CD2-CE2 4.14Å; F347-Y384 HydrophobicContact CE1-CD2 4.35Å; F347-Y384 HydrophobicContact CE2-CD2 4.32Å; F347-Y384 HydrophobicContact CG-CD2 4.18Å; F347-Y384 AromaticContact CG-CE2 3.79Å; F347-Y384 HydrophobicContact CG-CE2 3.79Å; F347-Y384 HydrophobicContact CZ-CD2 4.39Å; P380-Y384 WeakPolarHBondContact O-CB 3.38Å; P380-Y384 PolarHBondContact O-N 3.03Å; Q381-Y384 PolarHBondContact O-N 3.49Å; E382-Y384 VanDerWaalsContact C-N 3.33Å; E382-Y384 PolarHBondContact O-N 2.98Å; Y384-K386 VanDerWaalsContact C-N 3.3Å; Y384-K386 PolarHBondContact O-N 3.43Å; Y384-I387 PolarHBondContact O-N 2.88Å; Y384-M388 HydrophobicContact CD1-CG 4.4Å; Y384-M388 HydrophobicContact CD2-CE 4.05Å; Y384-M388 HydrophobicContact CD2-CG 4.45Å; Y384-M388 HydrophobicContact CE1-CG 3.94Å; Y384-M388 HydrophobicContact CE2-CE 3.35Å; Y384-M388 HydrophobicContact CE2-CG 4.02Å; Y384-M388 HydrophobicContact CE2-SD 4.46Å; Y384-M388 WeakPolarHBondContact O-CG 3.14Å; Y384-M388 PolarHBondContact O-N 3.14Å
385	K	91	Very high	90.9	Very high	34 Å²	34	49.6 Å²	49.6	15%	0.148	25%	0.252	C	S	.	.	H	α-helix	trans	-59.8	-39	176.8	-73.9	-174.5	-178.3	-172.2	0	112.4	A305 K306 P307 Q381 E382 T383 N389	A305-K385 WeakPolarHBondContact O-CE 3.15Å; K306-K385 PolarHBondContact O-NZ 3Å; P307-K385 HydrophobicContact CG-CB 4.46Å; Q381-K385 WeakPolarHBondContact O-CG 3.43Å; Q381-K385 PolarHBondContact O-N 2.6Å; E382-K385 PolarHBondContact O-N 3.27Å; T383-K385 PolarHBondContact O-N 3.29Å; K385-N389 PolarHBondContact O-N 3.1Å; K385-N389 VanDerWaalsContact O-N 3.15Å; K385-N389 PolarHBondContact O-ND2 2.85Å
386	K	93.4	Very high	90.9	Very high	49 Å²	49	50.4 Å²	50.4	21%	0.213	26%	0.256	C	S	.	.	H	α-helix	trans	-67.8	-41.3	175.6	-74.5	-176.7	-175.5	168.3	0	112.2	F375 C376 S377 E382 T383 Y384 N389 W390 A393	F375-K386 HydrophobicContact CB-CB 4.04Å; F375-K386 HydrophobicContact CD1-CB 4.21Å; C376-K386 PolarHBondContact O-NZ 3.12Å; S377-K386 WeakPolarHBondContact OG-CD 3.35Å; S377-K386 VanDerWaalsContact OG-CE 3.23Å; S377-K386 WeakPolarHBondContact OG-CE 3.46Å; S377-K386 PolarHBondContact OG-NZ 3.38Å; E382-K386 PolarHBondContact O-N 3.27Å; T383-K386 PolarHBondContact O-N 2.93Å; T383-K386 VanDerWaalsContact O-N 3.15Å; Y384-K386 VanDerWaalsContact C-N 3.3Å; Y384-K386 PolarHBondContact O-N 3.43Å; K386-N389 CarbonylContact O-C 3.52Å; K386-N389 PolarHBondContact O-N 2.98Å; K386-W390 WeakPolarHBondContact O-CA 3.42Å; K386-W390 PolarHBondContact O-N 2.79Å; K386-A393 HydrophobicContact CB-CB 3.85Å; K386-A393 HydrophobicContact CG-CB 4.14Å; K386-A393 VanDerWaalsContact O-CB 3.32Å; K386-A393 WeakPolarHBondContact O-CB 3.36Å
387	I	93.7	Very high	90.9	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-61.7	-45.1	176.4	-67.3	165.8	0	0	0	110.5	P339 P344 W359 F375 T383 Y384 N389 W390	P339-I387 HydrophobicContact CB-CD1 4Å; P339-I387 HydrophobicContact CG-CD1 4.07Å; P339-I387 WeakPolarHBondContact O-CD1 3.31Å; P344-I387 HydrophobicContact CB-CG2 4.11Å; W359-I387 HydrophobicContact CZ2-CG2 4.42Å; F375-I387 HydrophobicContact CB-CG1 3.78Å; F375-I387 HydrophobicContact CD2-CG1 3.77Å; F375-I387 HydrophobicContact CG-CG1 3.8Å; T383-I387 HydrophobicContact CG2-CD1 3.84Å; T383-I387 HydrophobicContact CG2-CG1 4.41Å; T383-I387 WeakPolarHBondContact O-CG1 3.36Å; T383-I387 PolarHBondContact O-N 3.36Å; Y384-I387 PolarHBondContact O-N 2.88Å; I387-N389 VanDerWaalsContact C-N 3.25Å; I387-N389 PolarHBondContact O-N 3.38Å; I387-W390 WeakPolarHBondContact O-CB 3.29Å; I387-W390 PolarHBondContact O-N 2.93Å
388	M	92.4	Very high	91	Very high	49 Å²	49	53.9 Å²	53.9	24%	0.241	28%	0.278	C	S	.	.	H	α-helix	trans	-64	-31.5	177.5	-70.1	-59.1	152.1	0	0	113	P344 F347 Y384	P344-M388 HydrophobicContact CB-SD 4.42Å; F347-M388 HydrophobicContact CB-CE 3.34Å; F347-M388 HydrophobicContact CD2-CE 3.34Å; F347-M388 HydrophobicContact CE2-CE 4.38Å; F347-M388 HydrophobicContact CG-CE 3.62Å; Y384-M388 HydrophobicContact CD1-CG 4.4Å; Y384-M388 HydrophobicContact CD2-CE 4.05Å; Y384-M388 HydrophobicContact CD2-CG 4.45Å; Y384-M388 HydrophobicContact CE1-CG 3.94Å; Y384-M388 HydrophobicContact CE2-CE 3.35Å; Y384-M388 HydrophobicContact CE2-CG 4.02Å; Y384-M388 HydrophobicContact CE2-SD 4.46Å; Y384-M388 WeakPolarHBondContact O-CG 3.14Å; Y384-M388 PolarHBondContact O-N 3.14Å
389	N	93.5	Very high	91.2	Very high	59 Å²	59	54.8 Å²	54.8	32%	0.316	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	35.8	177.6	-60.4	-62.7	0	0	0	112	P307 F310 K385 K386 I387 K391 E392 A393	P307-N389 WeakPolarHBondContact CG-ND2 3.42Å; F310-N389 HydrophobicContact CZ-CB 4.03Å; K385-N389 PolarHBondContact O-N 3.1Å; K385-N389 VanDerWaalsContact O-N 3.15Å; K385-N389 PolarHBondContact O-ND2 2.85Å; K386-N389 CarbonylContact O-C 3.52Å; K386-N389 PolarHBondContact O-N 2.98Å; I387-N389 VanDerWaalsContact C-N 3.25Å; I387-N389 PolarHBondContact O-N 3.38Å; N389-K391 PolarHBondContact O-N 2.77Å; N389-E392 PolarHBondContact O-N 2.68Å; N389-A393 WeakPolarHBondContact O-CB 3.4Å; N389-A393 PolarHBondContact O-N 2.95Å
390	W	94.7	Very high	91.4	Very high	48 Å²	48	54.3 Å²	54.3	18%	0.182	26%	0.263	C	S	.	.	H	α-helix	trans	-54.7	-30.2	-172.7	62.1	-94.2	0	0	0	114.2	W359 F375 K386 I387 E392 A393 L394 C414 C415 G416	W359-W390 HydrophobicContact CH2-CB 3.64Å; W359-W390 AromaticContact CH2-CD1 3.93Å; W359-W390 HydrophobicContact CH2-CD2 4.13Å; W359-W390 AromaticContact CH2-CG 3.62Å; W359-W390 HydrophobicContact CH2-CG 3.62Å; W359-W390 HydrophobicContact CZ2-CB 4.35Å; W359-W390 HydrophobicContact CZ3-CD2 4.33Å; W359-W390 HydrophobicContact CZ3-CG 4.23Å; F375-W390 HydrophobicContact CE1-CB 3.93Å; F375-W390 HydrophobicContact CZ-CB 3.98Å; K386-W390 WeakPolarHBondContact O-CA 3.42Å; K386-W390 PolarHBondContact O-N 2.79Å; I387-W390 WeakPolarHBondContact O-CB 3.29Å; I387-W390 PolarHBondContact O-N 2.93Å; W390-E392 PolarHBondContact O-N 2.69Å; W390-A393 PolarHBondContact O-N 3.11Å; W390-L394 WeakPolarHBondContact O-CB 3.48Å; W390-L394 PolarHBondContact O-N 2.6Å; W390-C414 VanDerWaalsContact CE3-O 3.31Å; W390-C414 WeakPolarHBondContact CZ3-O 3.4Å; W390-C415 HydrophobicContact CH2-CB 3.84Å; W390-C415 HydrophobicContact CZ3-CB 4.11Å; W390-G416 VanDerWaalsContact CZ2-N 3.26Å
391	K	93.9	Very high	91.6	Very high	169 Å²	169	58.6 Å²	58.6	74%	0.735	29%	0.291	S	S	*	.	H	α-helix	trans	-57.6	-35.4	177.2	-68.5	-177.4	179.1	180	0	112.6	N389	N389-K391 PolarHBondContact O-N 2.77Å
392	E	92	Very high	91.9	Very high	142 Å²	142	56.5 Å²	56.5	66%	0.664	28%	0.281	S	S	*	.	H	α-helix	trans	-97.4	-30.5	178.2	-63.8	178	-176.8	0	0	111.7	F310 N389 W390	F310-E392 WeakPolarHBondContact CE2-OE2 3.47Å; F310-E392 HydrophobicContact CZ-CB 4.31Å; N389-E392 PolarHBondContact O-N 2.68Å; W390-E392 PolarHBondContact O-N 2.69Å
393	A	93.3	Very high	92.3	Very high	13 Å²	13	54.3 Å²	54.3	11%	0.107	28%	0.275	C	S	.	.	H	α-helix	trans	-82.7	-25.7	-174.3	0	0	0	0	0	114.3	F310 F375 K386 N389 W390 F395	F310-A393 HydrophobicContact CE1-CB 4.17Å; F375-A393 HydrophobicContact CD1-CB 4.11Å; F375-A393 HydrophobicContact CE1-CB 4.3Å; K386-A393 HydrophobicContact CB-CB 3.85Å; K386-A393 HydrophobicContact CG-CB 4.14Å; K386-A393 VanDerWaalsContact O-CB 3.32Å; K386-A393 WeakPolarHBondContact O-CB 3.36Å; N389-A393 WeakPolarHBondContact O-CB 3.4Å; N389-A393 PolarHBondContact O-N 2.95Å; W390-A393 PolarHBondContact O-N 3.11Å; A393-F395 PolarHBondContact O-N 2.94Å; A393-F395 VanDerWaalsContact O-N 3.09Å
394	L	95.2	Very high	92.6	Very high	28 Å²	28	60.5 Å²	60.5	15%	0.147	31%	0.308	C	S	.	.			trans	-74.4	98.5	177.9	-178.5	62.8	0	0	0	109.9	Y366 P374 F375 W390 F396 I410 Q411 C414	Y366-L394 HydrophobicContact CD2-CD1 4.2Å; Y366-L394 HydrophobicContact CE2-CD1 4.32Å; P374-L394 HydrophobicContact CB-CD1 3.61Å; P374-L394 HydrophobicContact CG-CD1 4.14Å; F375-L394 HydrophobicContact CE1-CB 4.23Å; F375-L394 HydrophobicContact CZ-CD1 4.48Å; W390-L394 WeakPolarHBondContact O-CB 3.48Å; W390-L394 PolarHBondContact O-N 2.6Å; L394-F396 HydrophobicContact CG-CE2 4.39Å; L394-I410 HydrophobicContact CD1-CG2 4.46Å; L394-Q411 HydrophobicContact CD2-CG 4.33Å; L394-C414 HydrophobicContact CD2-CB 4Å
395	F	93.2	Very high	92.9	Very high	94 Å²	94	63.9 Å²	63.9	41%	0.412	32%	0.324	S	S	.	.			trans	-123	133	-175.8	173.3	-101.1	0	0	0	110.8	Y366 A393 P397 P398	Y366-F395 PolarHBondContact OH-O 2.88Å; A393-F395 PolarHBondContact O-N 2.94Å; A393-F395 VanDerWaalsContact O-N 3.09Å; F395-P397 HydrophobicContact CD1-CG 4.49Å; F395-P397 HydrophobicContact CE1-CB 4.33Å; F395-P397 HydrophobicContact CE1-CG 4.41Å; F395-P398 HydrophobicContact CZ-CG 4.37Å
396	F	94.1	Very high	93.2	Very high	18 Å²	18	62.2 Å²	62.2	8%	0.079	32%	0.317	C	S	.	.			trans	-99.1	116.2	174.2	-63.1	-86.7	0	0	0	109.9	Y366 L394 I402 R407 I410 Q411	Y366-F396 HydrophobicContact CD2-CD1 4.16Å; Y366-F396 AromaticContact CD2-CE1 3.78Å; Y366-F396 HydrophobicContact CD2-CE1 3.78Å; Y366-F396 HydrophobicContact CD2-CZ 4.47Å; Y366-F396 AromaticContact CE2-CD1 3.87Å; Y366-F396 HydrophobicContact CE2-CD1 3.87Å; Y366-F396 AromaticContact CE2-CE1 3.94Å; Y366-F396 HydrophobicContact CE2-CE1 3.94Å; L394-F396 HydrophobicContact CG-CE2 4.39Å; F396-I402 HydrophobicContact CD1-CD1 3.98Å; F396-I402 HydrophobicContact CE1-CD1 3.97Å; F396-R407 HydrophobicContact CD1-CG 4.11Å; F396-R407 HydrophobicContact CE1-CG 4.17Å; F396-R407 HydrophobicContact CG-CG 4.29Å; F396-R407 HydrophobicContact CZ-CB 4.36Å; F396-R407 HydrophobicContact CZ-CG 4.42Å; F396-I410 HydrophobicContact CE1-CB 4.34Å; F396-I410 HydrophobicContact CE1-CD1 3.94Å; F396-I410 HydrophobicContact CE1-CG2 4.14Å; F396-I410 HydrophobicContact CZ-CB 4.09Å; F396-I410 HydrophobicContact CZ-CG2 3.81Å; F396-Q411 HydrophobicContact CE2-CG 3.92Å; F396-Q411 HydrophobicContact CZ-CG 4.17Å
397	P	91.8	Very high	93.4	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.32	C	S	.	.			trans	-61.7	128.2	-178.8	-20.5	31.1	0	0	0	112.6	S317 I370 Y372 F395 E399 M400	S317-P397 WeakPolarHBondContact OG-CB 3.32Å; S317-P397 WeakPolarHBondContact OG-CG 3.41Å; I370-P397 HydrophobicContact CG2-CG 4.13Å; Y372-P397 VanDerWaalsContact OH-CG 3.32Å; Y372-P397 WeakPolarHBondContact OH-CG 3.16Å; F395-P397 HydrophobicContact CD1-CG 4.49Å; F395-P397 HydrophobicContact CE1-CB 4.33Å; F395-P397 HydrophobicContact CE1-CG 4.41Å; P397-E399 VanDerWaalsContact CB-CD 3.47Å; P397-E399 HydrophobicContact CB-CG 4.41Å; P397-E399 WeakPolarHBondContact CB-OE1 3.49Å; P397-E399 VanDerWaalsContact CB-OE2 3.32Å; P397-E399 WeakPolarHBondContact CB-OE2 3.47Å; P397-E399 PolarHBondContact O-N 2.92Å; P397-M400 HydrophobicContact CB-CB 4.47Å; P397-M400 HydrophobicContact CB-CG 4.05Å; P397-M400 HydrophobicContact CG-CG 4.33Å; P397-M400 PolarHBondContact O-N 3.42Å; P397-M400 VanDerWaalsContact O-N 3.14Å
398	P	89	Confident	93.5	Very high	107 Å²	107	67.1 Å²	67.1	70%	0.695	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-28.3	-178.8	-25.9	34	0	0	0	114.4	F395 M400	F395-P398 HydrophobicContact CZ-CG 4.37Å; P398-M400 VanDerWaalsContact C-N 3.33Å
399	E	87.6	Confident	93.8	Very high	100 Å²	100	64.8 Å²	64.8	47%	0.467	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-15.4	-179.5	68.9	-84.6	-160.7	0	0	114.1	S317 P397	S317-E399 WeakPolarHBondContact CB-OE1 3.32Å; S317-E399 PolarHBondContact N-OE1 3.34Å; S317-E399 VanDerWaalsContact N-OE1 3.14Å; S317-E399 PolarHBondContact OG-OE1 3.26Å; P397-E399 VanDerWaalsContact CB-CD 3.47Å; P397-E399 HydrophobicContact CB-CG 4.41Å; P397-E399 WeakPolarHBondContact CB-OE1 3.49Å; P397-E399 VanDerWaalsContact CB-OE2 3.32Å; P397-E399 WeakPolarHBondContact CB-OE2 3.47Å; P397-E399 PolarHBondContact O-N 2.92Å
400	M	88.8	Confident	94	Very high	42 Å²	42	62 Å²	62	21%	0.207	31%	0.314	C	S	.	.	S	Bend	trans	-93	126.5	-177.5	-67.5	-58.5	-64.9	0	0	111.2	T236 I370 P397 P398 I402	T236-M400 HydrophobicContact CG2-CE 4.36Å; I370-M400 HydrophobicContact CD1-CB 3.85Å; I370-M400 HydrophobicContact CD1-CG 4.33Å; I370-M400 HydrophobicContact CG2-CG 4.41Å; P397-M400 HydrophobicContact CB-CB 4.47Å; P397-M400 HydrophobicContact CB-CG 4.05Å; P397-M400 HydrophobicContact CG-CG 4.33Å; P397-M400 PolarHBondContact O-N 3.42Å; P397-M400 VanDerWaalsContact O-N 3.14Å; P398-M400 VanDerWaalsContact C-N 3.33Å; M400-I402 PolarHBondContact O-N 2.94Å
401	P	89.2	Confident	94.2	Very high	113 Å²	113	64.4 Å²	64.4	73%	0.734	33%	0.327	S	S	*	.			trans	-72.9	111	178.1	29.5	-33.1	0	0	0	110.1
402	I	93.5	Very high	94.3	Very high	18 Å²	18	57.9 Å²	57.9	9%	0.092	30%	0.303	C	S	.	.			trans	-144.3	128.9	176.4	-178.7	174.9	0	0	0	109.7	L369 I370 F396 M400 S406 R407 I410	L369-I402 HydrophobicContact CB-CD1 4.4Å; L369-I402 HydrophobicContact CD1-CD1 3.8Å; L369-I402 HydrophobicContact CD1-CG1 4.14Å; I370-I402 HydrophobicContact CD1-CD1 4.38Å; I370-I402 HydrophobicContact CD1-CG2 4.49Å; F396-I402 HydrophobicContact CD1-CD1 3.98Å; F396-I402 HydrophobicContact CE1-CD1 3.97Å; M400-I402 PolarHBondContact O-N 2.94Å; I402-S406 VanDerWaalsContact CG1-CB 3.49Å; I402-R407 HydrophobicContact CD1-CG 3.99Å; I402-R407 HydrophobicContact CG1-CG 4.03Å; I402-R407 HydrophobicContact CG2-CG 4.02Å; I402-I410 HydrophobicContact CD1-CD1 3.99Å
403	S	96.3	Very high	94.6	Very high	37 Å²	37	51.1 Å²	51.1	26%	0.259	27%	0.271	S	S	.	.			trans	-70.7	160	-177.1	74.5	0	0	0	0	112.4	E239 H405 S406 R407	E239-S403 VanDerWaalsContact CD-OG 3.25Å; E239-S403 VanDerWaalsContact OE1-CB 3.28Å; E239-S403 WeakPolarHBondContact OE1-CB 3.36Å; E239-S403 PolarHBondContact OE1-N 2.91Å; E239-S403 PolarHBondContact OE1-OG 2.84Å; E239-S403 WeakPolarHBondContact OE2-CB 3.46Å; E239-S403 PolarHBondContact OE2-OG 3.08Å; S403-H405 PolarHBondContact O-N 2.9Å; S403-S406 PolarHBondContact O-N 3.04Å; S403-S406 PolarHBondContact OG-N 2.83Å; S403-S406 PolarHBondContact OG-OG 2.97Å; S403-S406 VanDerWaalsContact OG-OG 3.11Å; S403-R407 WeakPolarHBondContact O-CG 3.47Å; S403-R407 PolarHBondContact O-N 2.87Å
404	N	96.7	Very high	94.8	Very high	130 Å²	130	50.5 Å²	50.5	70%	0.695	27%	0.266	S	S	*	.	H	α-helix	trans	-62.5	-34	175.9	-70.8	-24.7	0	0	0	112	N408	N404-N408 VanDerWaalsContact O-CB 3.23Å; N404-N408 WeakPolarHBondContact O-CB 3.43Å; N404-N408 PolarHBondContact O-N 2.69Å
405	H	97.3	Very high	94.8	Very high	91 Å²	91	49.9 Å²	49.9	42%	0.421	26%	0.264	S	S	.	.	H	α-helix	trans	-64.2	-45.2	175.9	-61.3	163.3	0	0	0	111.2	S403 N408 L409 F432	S403-H405 PolarHBondContact O-N 2.9Å; H405-N408 PolarHBondContact O-N 3.38Å; H405-L409 PolarHBondContact O-N 3.4Å; H405-F432 HydrophobicContact CB-CB 4.15Å; H405-F432 HydrophobicContact CB-CD2 4.48Å
406	S	97.6	Very high	94.8	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.5	-46.8	176.4	-62.2	0	0	0	0	112.4	E239 I402 S403 N408 L409 I410 F432	E239-S406 WeakPolarHBondContact OE1-CB 3.33Å; E239-S406 PolarHBondContact OE1-OG 3.27Å; E239-S406 PolarHBondContact OE2-OG 3.36Å; I402-S406 VanDerWaalsContact CG1-CB 3.49Å; S403-S406 PolarHBondContact O-N 3.04Å; S403-S406 PolarHBondContact OG-N 2.83Å; S403-S406 PolarHBondContact OG-OG 2.97Å; S403-S406 VanDerWaalsContact OG-OG 3.11Å; S406-N408 PolarHBondContact O-N 3.46Å; S406-L409 PolarHBondContact O-N 2.9Å; S406-I410 WeakPolarHBondContact O-CG1 3.41Å; S406-I410 PolarHBondContact O-N 2.94Å; S406-F432 WeakPolarHBondContact OG-CD2 3.34Å; S406-F432 VanDerWaalsContact OG-CE2 3.24Å; S406-F432 WeakPolarHBondContact OG-CE2 3.27Å
407	R	97.2	Very high	94.7	Very high	72 Å²	72	47.2 Å²	47.2	27%	0.272	27%	0.265	S	S	.	.	H	α-helix	trans	-59.2	-47.2	176.9	-69.8	-178.1	-168.9	-128.2	-10	111.4	F396 I402 S403 I410 Q411	F396-R407 HydrophobicContact CD1-CG 4.11Å; F396-R407 HydrophobicContact CE1-CG 4.17Å; F396-R407 HydrophobicContact CG-CG 4.29Å; F396-R407 HydrophobicContact CZ-CB 4.36Å; F396-R407 HydrophobicContact CZ-CG 4.42Å; I402-R407 HydrophobicContact CD1-CG 3.99Å; I402-R407 HydrophobicContact CG1-CG 4.03Å; I402-R407 HydrophobicContact CG2-CG 4.02Å; S403-R407 WeakPolarHBondContact O-CG 3.47Å; S403-R407 PolarHBondContact O-N 2.87Å; R407-I410 PolarHBondContact O-N 3.41Å; R407-Q411 WeakPolarHBondContact O-CB 3.49Å; R407-Q411 VanDerWaalsContact O-CG 3.29Å; R407-Q411 WeakPolarHBondContact O-CG 3.28Å; R407-Q411 PolarHBondContact O-N 3.16Å
408	N	97.2	Very high	94.7	Very high	79 Å²	79	56.2 Å²	56.2	42%	0.422	31%	0.307	S	S	.	.	H	α-helix	trans	-64.3	-41.2	-177.9	-176	-101.7	0	0	0	112.1	N404 H405 S406 Q411 S412	N404-N408 VanDerWaalsContact O-CB 3.23Å; N404-N408 WeakPolarHBondContact O-CB 3.43Å; N404-N408 PolarHBondContact O-N 2.69Å; H405-N408 PolarHBondContact O-N 3.38Å; S406-N408 PolarHBondContact O-N 3.46Å; N408-Q411 PolarHBondContact O-N 3.47Å; N408-S412 WeakPolarHBondContact O-CB 3.34Å; N408-S412 PolarHBondContact O-N 2.83Å; N408-S412 PolarHBondContact O-OG 3.47Å
409	L	98.1	Very high	94.8	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-63.1	-47.8	175.3	178.6	57.1	0	0	0	111.6	M365 H405 S406 Q411 S412 L413 L421 Q430 F432 F433	M365-L409 HydrophobicContact CE-CB 4.26Å; M365-L409 HydrophobicContact CE-CD2 3.9Å; M365-L409 HydrophobicContact CE-CG 4.33Å; M365-L409 HydrophobicContact SD-CB 4.27Å; M365-L409 HydrophobicContact SD-CD2 3.55Å; M365-L409 VanDerWaalsContact SD-CD2 3.55Å; M365-L409 HydrophobicContact SD-CG 3.81Å; H405-L409 PolarHBondContact O-N 3.4Å; S406-L409 PolarHBondContact O-N 2.9Å; L409-Q411 VanDerWaalsContact C-N 3.32Å; L409-Q411 PolarHBondContact O-N 3.08Å; L409-S412 PolarHBondContact O-N 2.97Å; L409-S412 VanDerWaalsContact O-N 3.1Å; L409-L413 HydrophobicContact CD1-CD1 3.91Å; L409-L413 HydrophobicContact CD1-CG 4.12Å; L409-L413 HydrophobicContact CG-CD1 4Å; L409-L413 WeakPolarHBondContact O-CG 3.41Å; L409-L413 PolarHBondContact O-N 2.78Å; L409-L421 HydrophobicContact CD1-CD1 4.07Å; L409-Q430 HydrophobicContact CD1-CB 4.24Å; L409-Q430 HydrophobicContact CD1-CG 3.92Å; L409-F432 HydrophobicContact CB-CB 4.36Å; L409-F432 HydrophobicContact CD2-CB 3.9Å; L409-F432 HydrophobicContact CD2-CD1 3.34Å; L409-F432 HydrophobicContact CD2-CE1 4.06Å; L409-F432 HydrophobicContact CD2-CG 3.8Å; L409-F433 HydrophobicContact CD1-CE2 4.27Å; L409-F433 HydrophobicContact CD2-CD2 4.44Å; L409-F433 HydrophobicContact CD2-CE1 4.47Å; L409-F433 HydrophobicContact CD2-CE2 3.55Å; L409-F433 HydrophobicContact CD2-CZ 3.57Å
410	I	98.1	Very high	95.2	Very high	0 Å²	0	52 Å²	52	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-58.6	-44.8	176.9	-69.4	165.3	0	0	0	110.7	M365 Y366 L369 L394 F396 I402 S406 R407 S412 L413 C414	M365-I410 HydrophobicContact CB-CG1 4.15Å; M365-I410 HydrophobicContact CE-CD1 4.45Å; M365-I410 HydrophobicContact CE-CG1 4.21Å; M365-I410 HydrophobicContact CG-CD1 4.11Å; M365-I410 HydrophobicContact CG-CG1 3.85Å; M365-I410 HydrophobicContact SD-CD1 4.45Å; M365-I410 HydrophobicContact SD-CG1 3.76Å; Y366-I410 HydrophobicContact CD2-CD1 4.43Å; Y366-I410 HydrophobicContact CD2-CG2 4.31Å; L369-I410 HydrophobicContact CD1-CD1 4.2Å; L394-I410 HydrophobicContact CD1-CG2 4.46Å; F396-I410 HydrophobicContact CE1-CB 4.34Å; F396-I410 HydrophobicContact CE1-CD1 3.94Å; F396-I410 HydrophobicContact CE1-CG2 4.14Å; F396-I410 HydrophobicContact CZ-CB 4.09Å; F396-I410 HydrophobicContact CZ-CG2 3.81Å; I402-I410 HydrophobicContact CD1-CD1 3.99Å; S406-I410 WeakPolarHBondContact O-CG1 3.41Å; S406-I410 PolarHBondContact O-N 2.94Å; R407-I410 PolarHBondContact O-N 3.41Å; I410-S412 VanDerWaalsContact C-N 3.27Å; I410-S412 PolarHBondContact O-N 3.27Å; I410-L413 PolarHBondContact O-N 3.1Å; I410-C414 VanDerWaalsContact O-CB 3.28Å; I410-C414 WeakPolarHBondContact O-CB 3.42Å; I410-C414 PolarHBondContact O-N 3.36Å
411	Q	97.3	Very high	95.4	Very high	99 Å²	99	51.2 Å²	51.2	46%	0.463	28%	0.282	S	S	.	.	H	α-helix	trans	-65.4	-29.9	178.2	-72.9	174	-41.7	0	0	112.8	L394 F396 R407 N408 L409 C415	L394-Q411 HydrophobicContact CD2-CG 4.33Å; F396-Q411 HydrophobicContact CE2-CG 3.92Å; F396-Q411 HydrophobicContact CZ-CG 4.17Å; R407-Q411 WeakPolarHBondContact O-CB 3.49Å; R407-Q411 VanDerWaalsContact O-CG 3.29Å; R407-Q411 WeakPolarHBondContact O-CG 3.28Å; R407-Q411 PolarHBondContact O-N 3.16Å; N408-Q411 PolarHBondContact O-N 3.47Å; L409-Q411 VanDerWaalsContact C-N 3.32Å; L409-Q411 PolarHBondContact O-N 3.08Å; Q411-C415 WeakPolarHBondContact O-CB 3.39Å
412	S	97.2	Very high	95.3	Very high	31 Å²	31	48.7 Å²	48.7	22%	0.217	27%	0.267	C	S	.	.	H	α-helix	trans	-79.9	-21.5	178	-56.3	0	0	0	0	113.3	N408 L409 I410 C415 L421	N408-S412 WeakPolarHBondContact O-CB 3.34Å; N408-S412 PolarHBondContact O-N 2.83Å; N408-S412 PolarHBondContact O-OG 3.47Å; L409-S412 PolarHBondContact O-N 2.97Å; L409-S412 VanDerWaalsContact O-N 3.1Å; I410-S412 VanDerWaalsContact C-N 3.27Å; I410-S412 PolarHBondContact O-N 3.27Å; S412-C415 PolarHBondContact O-SG 3.44Å; S412-C415 VanDerWaalsContact O-SG 3.39Å; S412-L421 VanDerWaalsContact CB-CD1 3.5Å; S412-L421 PolarHBondContact O-N 2.71Å
413	L	97.5	Very high	95.1	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-90.4	-42.7	173	-68.1	170.4	0	0	0	111.7	W358 L409 I410 C415 R420 L421	W358-L413 HydrophobicContact CB-CD2 4.05Å; L409-L413 HydrophobicContact CD1-CD1 3.91Å; L409-L413 HydrophobicContact CD1-CG 4.12Å; L409-L413 HydrophobicContact CG-CD1 4Å; L409-L413 WeakPolarHBondContact O-CG 3.41Å; L409-L413 PolarHBondContact O-N 2.78Å; I410-L413 PolarHBondContact O-N 3.1Å; L413-C415 VanDerWaalsContact C-N 3.3Å; L413-C415 PolarHBondContact O-N 3.19Å; L413-R420 WeakPolarHBondContact O-CD 3.39Å; L413-R420 VanDerWaalsContact O-CG 3.29Å; L413-R420 WeakPolarHBondContact O-CG 3.46Å; L413-R420 PolarHBondContact O-NE 2.88Å; L413-R420 VanDerWaalsContact O-NE 3.1Å; L413-L421 HydrophobicContact CD2-CB 4.24Å
414	C	97.1	Very high	94.9	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.261	C	S	.	.	S	Bend	trans	-91.2	55	179.7	-64.4	0	0	0	0	111.8	W359 G362 W390 L394 I410	W359-C414 HydrophobicContact CE3-CB 4.32Å; W359-C414 HydrophobicContact CH2-CB 4.43Å; W359-C414 HydrophobicContact CZ3-CB 4.19Å; G362-C414 VanDerWaalsContact C-SG 3.54Å; W390-C414 VanDerWaalsContact CE3-O 3.31Å; W390-C414 WeakPolarHBondContact CZ3-O 3.4Å; L394-C414 HydrophobicContact CD2-CB 4Å; I410-C414 VanDerWaalsContact O-CB 3.28Å; I410-C414 WeakPolarHBondContact O-CB 3.42Å; I410-C414 PolarHBondContact O-N 3.36Å
415	C	95.9	Very high	94.7	Very high	14 Å²	14	46.8 Å²	46.8	10%	0.095	25%	0.253	C	S	.	.	S	Bend	trans	-128.9	-175.1	174.6	69.4	0	0	0	0	112.4	W359 W390 Q411 S412 L413 R420	W359-C415 WeakPolarHBondContact CZ3-O 3.35Å; W390-C415 HydrophobicContact CH2-CB 3.84Å; W390-C415 HydrophobicContact CZ3-CB 4.11Å; Q411-C415 WeakPolarHBondContact O-CB 3.39Å; S412-C415 PolarHBondContact O-SG 3.44Å; S412-C415 VanDerWaalsContact O-SG 3.39Å; L413-C415 VanDerWaalsContact C-N 3.3Å; L413-C415 PolarHBondContact O-N 3.19Å; C415-R420 PolarHBondContact O-NE 3.3Å; C415-R420 PolarHBondContact O-NH2 3.01Å; C415-R420 WeakPolarHBondContact SG-CA 3.22Å
416	G	93.1	Very high	94.6	Very high	23 Å²	23	45.9 Å²	45.9	24%	0.237	25%	0.251	C	S	.	.			trans	-59.7	141.9	178.2	0	0	0	0	0	111.5	W390 E418 T419 R420	W390-G416 VanDerWaalsContact CZ2-N 3.26Å; G416-E418 PolarHBondContact O-N 2.82Å; G416-E418 VanDerWaalsContact O-N 3.12Å; G416-T419 PolarHBondContact O-N 3.49Å; G416-T419 PolarHBondContact O-OG1 3.37Å; G416-R420 PolarHBondContact O-N 2.97Å; G416-R420 VanDerWaalsContact O-N 3.1Å
417	A	92.6	Very high	94.5	Very high	34 Å²	34	45.9 Å²	45.9	28%	0.281	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-53.7	-36.6	-172.5	0	0	0	0	0	113.6	E345 T419 R420	E345-A417 HydrophobicContact CG-CB 4.24Å; A417-T419 VanDerWaalsContact C-N 3.32Å; A417-T419 PolarHBondContact O-N 2.85Å; A417-R420 PolarHBondContact O-N 3.45Å
418	E	90.8	Very high	94.4	Very high	189 Å²	189	47.1 Å²	47.1	88%	0.883	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-66.9	-27.4	-180	-54.4	-61.1	166.7	0	0	114.3	G416	G416-E418 PolarHBondContact O-N 2.82Å; G416-E418 VanDerWaalsContact O-N 3.12Å
419	T	92.9	Very high	94.3	Very high	109 Å²	109	50.4 Å²	50.4	67%	0.669	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-109.7	-0.4	-176.5	57.1	0	0	0	0	112.7	G416 A417	G416-T419 PolarHBondContact O-N 3.49Å; G416-T419 PolarHBondContact O-OG1 3.37Å; A417-T419 VanDerWaalsContact C-N 3.32Å; A417-T419 PolarHBondContact O-N 2.85Å
420	R	96	Very high	94.3	Very high	9 Å²	9	52 Å²	52	3%	0.034	27%	0.273	C	S	.	.	S	Bend	trans	-71.1	141.9	-175.7	-169	178.7	-58.6	141.5	4.2	110.2	E345 S355 L413 C415 G416 A417 S422	E345-R420 IonicContact OE1-CZ 3.38Å; E345-R420 IonicContact OE1-NH1 2.69Å; E345-R420 PolarHBondContact OE1-NH1 3.34Å; E345-R420 IonicContact OE1-NH2 3.97Å; E345-R420 PolarHBondContact OE1-NH2 2.86Å; E345-R420 IonicContact OE2-CZ 3.66Å; E345-R420 IonicContact OE2-NH1 2.6Å; E345-R420 IonicContact OE2-NH2 2.66Å; E345-R420 PolarHBondContact OE2-NH2 2.87Å; S355-R420 VanDerWaalsContact C-NH1 3.33Å; S355-R420 WeakPolarHBondContact O-CD 3.31Å; S355-R420 PolarHBondContact O-NH1 3.16Å; L413-R420 WeakPolarHBondContact O-CD 3.39Å; L413-R420 VanDerWaalsContact O-CG 3.29Å; L413-R420 WeakPolarHBondContact O-CG 3.46Å; L413-R420 PolarHBondContact O-NE 2.88Å; L413-R420 VanDerWaalsContact O-NE 3.1Å; C415-R420 PolarHBondContact O-NE 3.3Å; C415-R420 PolarHBondContact O-NH2 3.01Å; C415-R420 WeakPolarHBondContact SG-CA 3.22Å; G416-R420 PolarHBondContact O-N 2.97Å; G416-R420 VanDerWaalsContact O-N 3.1Å; A417-R420 PolarHBondContact O-N 3.45Å; R420-S422 PolarHBondContact O-N 2.98Å
421	L	93	Very high	94.2	Very high	25 Å²	25	55 Å²	55	13%	0.131	29%	0.293	C	S	.	.			trans	-58.4	110.4	166.7	-66.2	175.5	0	0	0	109	L409 S412 L413 D426 I427 Q430	L409-L421 HydrophobicContact CD1-CD1 4.07Å; S412-L421 VanDerWaalsContact CB-CD1 3.5Å; S412-L421 PolarHBondContact O-N 2.71Å; L413-L421 HydrophobicContact CD2-CB 4.24Å; L421-D426 HydrophobicContact CD2-CB 4.03Å; L421-I427 HydrophobicContact CB-CG1 3.84Å; L421-I427 HydrophobicContact CD1-CG1 4.47Å; L421-Q430 HydrophobicContact CD1-CG 3.81Å
422	S	85.4	Confident	94.3	Very high	61 Å²	61	50.7 Å²	50.7	43%	0.427	27%	0.273	S	S	.	.			trans	-121.9	-8.2	-173.2	65.4	0	0	0	0	114.5	W358 R420	W358-S422 PolarHBondContact NE1-O 3.04Å; W358-S422 VanDerWaalsContact NE1-O 3.15Å; R420-S422 PolarHBondContact O-N 2.98Å
423	S	89.4	Confident	94.3	Very high	29 Å²	29	49.5 Å²	49.5	20%	0.203	26%	0.264	C	S	.	.	S	Bend	trans	-106.6	143.6	175.5	77.7	0	0	0	0	110.2	E425 D426 I427	S423-E425 PolarHBondContact O-N 3.39Å; S423-D426 PolarHBondContact O-N 3.17Å; S423-D426 VanDerWaalsContact OG-CB 3.25Å; S423-D426 WeakPolarHBondContact OG-CB 3.14Å; S423-D426 PolarHBondContact OG-N 3.16Å; S423-D426 PolarHBondContact OG-OD2 3.38Å; S423-I427 VanDerWaalsContact O-CG1 3.27Å; S423-I427 WeakPolarHBondContact O-CG1 3.38Å; S423-I427 PolarHBondContact O-N 2.97Å; S423-I427 VanDerWaalsContact O-N 3.16Å
424	I	92.1	Very high	94.2	Very high	4 Å²	4	56.7 Å²	56.7	2%	0.021	30%	0.297	C	S	.	.	H	α-helix	trans	-63.4	-34.6	173.7	-175	167.3	0	0	0	110.7	V250 L251 D254 D426 I427 R428	V250-I424 HydrophobicContact CG1-CD1 4.17Å; V250-I424 HydrophobicContact CG1-CG1 3.98Å; L251-I424 HydrophobicContact CD2-CD1 4.06Å; D254-I424 HydrophobicContact CB-CB 4.35Å; D254-I424 HydrophobicContact CB-CD1 3.72Å; D254-I424 WeakPolarHBondContact OD2-CD1 3.29Å; I424-D426 VanDerWaalsContact C-N 3.31Å; I424-D426 PolarHBondContact O-N 3.39Å; I424-I427 PolarHBondContact O-N 2.91Å; I424-R428 HydrophobicContact CG1-CG 4Å; I424-R428 WeakPolarHBondContact O-CB 3.23Å; I424-R428 WeakPolarHBondContact O-CG 3.47Å; I424-R428 PolarHBondContact O-N 3.35Å
425	E	93.2	Very high	94	Very high	111 Å²	111	59.7 Å²	59.7	52%	0.519	32%	0.322	S	S	.	.	H	α-helix	trans	-60.1	-40.1	179.5	-66.5	72.9	-158.1	0	0	112	S423 K429	S423-E425 PolarHBondContact O-N 3.39Å; E425-K429 WeakPolarHBondContact O-CD 3.27Å; E425-K429 WeakPolarHBondContact O-CE 3.24Å; E425-K429 VanDerWaalsContact O-CG 3.27Å; E425-K429 WeakPolarHBondContact O-CG 3.46Å
426	D	94.6	Very high	94	Very high	72 Å²	72	60.1 Å²	60.1	39%	0.385	32%	0.324	S	S	.	.	H	α-helix	trans	-83.4	-29.7	-179	-60.3	-36	0	0	0	112.5	L421 S423 I424 K429 Q430	L421-D426 HydrophobicContact CD2-CB 4.03Å; S423-D426 PolarHBondContact O-N 3.17Å; S423-D426 VanDerWaalsContact OG-CB 3.25Å; S423-D426 WeakPolarHBondContact OG-CB 3.14Å; S423-D426 PolarHBondContact OG-N 3.16Å; S423-D426 PolarHBondContact OG-OD2 3.38Å; I424-D426 VanDerWaalsContact C-N 3.31Å; I424-D426 PolarHBondContact O-N 3.39Å; D426-K429 IonicContact OD1-NZ 3.63Å; D426-K429 PolarHBondContact OD1-NZ 3.38Å; D426-Q430 PolarHBondContact O-NE2 2.78Å
427	I	95.8	Very high	94.2	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-65.1	-45.7	171.7	-66.3	168.5	0	0	0	110.2	V250 W358 L421 S423 I424 K429 Q430 F433	V250-I427 HydrophobicContact CG1-CG2 4.02Å; V250-I427 HydrophobicContact CG2-CG2 3.77Å; W358-I427 HydrophobicContact CD2-CD1 3.72Å; W358-I427 HydrophobicContact CE3-CD1 3.54Å; W358-I427 HydrophobicContact CG-CD1 4.39Å; W358-I427 HydrophobicContact CH2-CD1 3.99Å; W358-I427 HydrophobicContact CZ2-CD1 4.14Å; W358-I427 HydrophobicContact CZ3-CD1 3.68Å; L421-I427 HydrophobicContact CB-CG1 3.84Å; L421-I427 HydrophobicContact CD1-CG1 4.47Å; S423-I427 VanDerWaalsContact O-CG1 3.27Å; S423-I427 WeakPolarHBondContact O-CG1 3.38Å; S423-I427 PolarHBondContact O-N 2.97Å; S423-I427 VanDerWaalsContact O-N 3.16Å; I424-I427 PolarHBondContact O-N 2.91Å; I427-K429 PolarHBondContact O-N 3.28Å; I427-Q430 WeakPolarHBondContact O-CB 3.21Å; I427-Q430 VanDerWaalsContact O-CG 3.28Å; I427-Q430 WeakPolarHBondContact O-CG 3.46Å; I427-Q430 PolarHBondContact O-N 3.49Å; I427-Q430 VanDerWaalsContact O-N 3.13Å; I427-F433 HydrophobicContact CG2-CE2 3.7Å; I427-F433 HydrophobicContact CG2-CZ 4.26Å; I427-F433 WeakPolarHBondContact O-CD2 3.25Å; I427-F433 WeakPolarHBondContact O-CE2 3.45Å
428	R	95.5	Very high	94.3	Very high	98 Å²	98	60.9 Å²	60.9	37%	0.37	32%	0.315	S	S	.	.	H	α-helix	trans	-61.7	-29.6	-179.3	-73.9	-177.9	173.6	-178.6	0.1	113.8	I424 Q430 W438	I424-R428 HydrophobicContact CG1-CG 4Å; I424-R428 WeakPolarHBondContact O-CB 3.23Å; I424-R428 WeakPolarHBondContact O-CG 3.47Å; I424-R428 PolarHBondContact O-N 3.35Å; R428-Q430 VanDerWaalsContact C-N 3.26Å; R428-Q430 PolarHBondContact O-N 2.9Å; R428-W438 HydrophobicContact CB-CZ2 4.17Å; R428-W438 HydrophobicContact CG-CD2 3.79Å; R428-W438 HydrophobicContact CG-CE3 4.17Å; R428-W438 HydrophobicContact CG-CG 4.31Å; R428-W438 HydrophobicContact CG-CH2 4.06Å; R428-W438 HydrophobicContact CG-CZ2 3.7Å; R428-W438 HydrophobicContact CG-CZ3 4.28Å
429	K	95.7	Very high	94.5	Very high	147 Å²	147	59.4 Å²	59.4	64%	0.639	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-10.7	179.2	-70.1	167.7	-163	159.5	0	113.6	E425 D426 I427	E425-K429 WeakPolarHBondContact O-CD 3.27Å; E425-K429 WeakPolarHBondContact O-CE 3.24Å; E425-K429 VanDerWaalsContact O-CG 3.27Å; E425-K429 WeakPolarHBondContact O-CG 3.46Å; D426-K429 IonicContact OD1-NZ 3.63Å; D426-K429 PolarHBondContact OD1-NZ 3.38Å; I427-K429 PolarHBondContact O-N 3.28Å
430	Q	97.2	Very high	94.6	Very high	34 Å²	34	58.2 Å²	58.2	16%	0.159	30%	0.295	C	S	.	.	S	Bend	trans	-64	134.9	-176.7	-64.5	-63.3	-41.1	0	0	110.5	L409 L421 D426 I427 R428 F432 F433	L409-Q430 HydrophobicContact CD1-CB 4.24Å; L409-Q430 HydrophobicContact CD1-CG 3.92Å; L421-Q430 HydrophobicContact CD1-CG 3.81Å; D426-Q430 PolarHBondContact O-NE2 2.78Å; I427-Q430 WeakPolarHBondContact O-CB 3.21Å; I427-Q430 VanDerWaalsContact O-CG 3.28Å; I427-Q430 WeakPolarHBondContact O-CG 3.46Å; I427-Q430 PolarHBondContact O-N 3.49Å; I427-Q430 VanDerWaalsContact O-N 3.13Å; R428-Q430 VanDerWaalsContact C-N 3.26Å; R428-Q430 PolarHBondContact O-N 2.9Å; Q430-F432 PolarHBondContact O-N 3.28Å; Q430-F433 HydrophobicContact CB-CD2 4.04Å; Q430-F433 HydrophobicContact CB-CE2 4.37Å; Q430-F433 PolarHBondContact O-N 3.33Å
431	P	97.2	Very high	94.6	Very high	64 Å²	64	58.3 Å²	58.3	42%	0.416	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-55	-26.1	-178	-28.6	35.3	0	0	0	114.3	F433 H434	P431-F433 PolarHBondContact O-N 3.15Å; P431-H434 WeakPolarHBondContact O-CB 3.49Å; P431-H434 PolarHBondContact O-N 3.38Å
432	F	97.8	Very high	94.6	Very high	9 Å²	9	59 Å²	59	4%	0.039	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-57.1	-28.1	174.4	-179.4	-103.7	0	0	0	113.1	T242 Q243 M365 H405 S406 L409 Q430	T242-F432 HydrophobicContact CG2-CZ 4.24Å; Q243-F432 HydrophobicContact CB-CE1 3.88Å; Q243-F432 HydrophobicContact CB-CZ 3.77Å; Q243-F432 HydrophobicContact CG-CE1 4.13Å; Q243-F432 HydrophobicContact CG-CZ 4.41Å; Q243-F432 PolarHBondContact NE2-O 3.01Å; M365-F432 HydrophobicContact CE-CD1 4.01Å; M365-F432 HydrophobicContact CE-CD2 3.92Å; M365-F432 HydrophobicContact CE-CE1 3.69Å; M365-F432 HydrophobicContact CE-CE2 3.63Å; M365-F432 HydrophobicContact CE-CG 4.11Å; M365-F432 HydrophobicContact CE-CZ 3.51Å; M365-F432 HydrophobicContact SD-CE1 4.4Å; H405-F432 HydrophobicContact CB-CB 4.15Å; H405-F432 HydrophobicContact CB-CD2 4.48Å; S406-F432 WeakPolarHBondContact OG-CD2 3.34Å; S406-F432 VanDerWaalsContact OG-CE2 3.24Å; S406-F432 WeakPolarHBondContact OG-CE2 3.27Å; L409-F432 HydrophobicContact CB-CB 4.36Å; L409-F432 HydrophobicContact CD2-CB 3.9Å; L409-F432 HydrophobicContact CD2-CD1 3.34Å; L409-F432 HydrophobicContact CD2-CE1 4.06Å; L409-F432 HydrophobicContact CD2-CG 3.8Å; Q430-F432 PolarHBondContact O-N 3.28Å
433	F	97.7	Very high	95	Very high	5 Å²	5	62.6 Å²	62.6	2%	0.022	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-100	17.7	-178.2	-59.4	-68.5	0	0	0	114.3	Q243 I246 A247 L409 I427 Q430 P431 A435 V436 W438	Q243-F433 HydrophobicContact CG-CD1 4.15Å; I246-F433 HydrophobicContact CB-CE1 4.38Å; I246-F433 HydrophobicContact CG2-CE1 3.9Å; I246-F433 HydrophobicContact CG2-CZ 3.69Å; A247-F433 HydrophobicContact CB-CD1 4.2Å; A247-F433 HydrophobicContact CB-CE1 4.12Å; L409-F433 HydrophobicContact CD1-CE2 4.27Å; L409-F433 HydrophobicContact CD2-CD2 4.44Å; L409-F433 HydrophobicContact CD2-CE1 4.47Å; L409-F433 HydrophobicContact CD2-CE2 3.55Å; L409-F433 HydrophobicContact CD2-CZ 3.57Å; I427-F433 HydrophobicContact CG2-CE2 3.7Å; I427-F433 HydrophobicContact CG2-CZ 4.26Å; I427-F433 WeakPolarHBondContact O-CD2 3.25Å; I427-F433 WeakPolarHBondContact O-CE2 3.45Å; Q430-F433 HydrophobicContact CB-CD2 4.04Å; Q430-F433 HydrophobicContact CB-CE2 4.37Å; Q430-F433 PolarHBondContact O-N 3.33Å; P431-F433 PolarHBondContact O-N 3.15Å; F433-A435 PolarHBondContact O-N 3.09Å; F433-V436 HydrophobicContact CB-CB 4.35Å; F433-V436 HydrophobicContact CB-CG2 4.04Å; F433-V436 HydrophobicContact CD1-CG2 3.96Å; F433-V436 HydrophobicContact CG-CG2 4.5Å; F433-V436 WeakPolarHBondContact O-CB 3.38Å; F433-V436 PolarHBondContact O-N 3.24Å; F433-W438 HydrophobicContact CB-CZ2 3.7Å; F433-W438 HydrophobicContact CD1-CH2 4.04Å; F433-W438 AromaticContact CD1-CZ2 3.84Å; F433-W438 HydrophobicContact CD1-CZ2 3.84Å; F433-W438 HydrophobicContact CD2-CH2 4.41Å; F433-W438 AromaticContact CD2-CZ2 3.99Å; F433-W438 HydrophobicContact CD2-CZ2 3.99Å; F433-W438 HydrophobicContact CE1-CH2 4.19Å; F433-W438 HydrophobicContact CE1-CZ2 4.42Å; F433-W438 HydrophobicContact CG-CH2 4.15Å; F433-W438 AromaticContact CG-CZ2 3.59Å; F433-W438 HydrophobicContact CG-CZ2 3.59Å; F433-W438 HydrophobicContact CZ-CH2 4.44Å
434	H	95.2	Very high	95.1	Very high	153 Å²	153	67.3 Å²	67.3	71%	0.708	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-22.3	-173	67.4	27.2	0	0	0	115.7	P431	P431-H434 WeakPolarHBondContact O-CB 3.49Å; P431-H434 PolarHBondContact O-N 3.38Å
435	A	94.1	Very high	95.2	Very high	62 Å²	62	72.9 Å²	72.9	51%	0.512	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	3.5	-172.5	0	0	0	0	0	112.2	F433	F433-A435 PolarHBondContact O-N 3.09Å
436	V	95.9	Very high	95.3	Very high	23 Å²	23	68.2 Å²	68.2	14%	0.139	34%	0.337	C	S	.	.			trans	-83.5	121.4	-177.2	178.4	0	0	0	0	109.8	Q243 A247 F433 W438 I441	Q243-V436 HydrophobicContact CG-CG2 3.56Å; A247-V436 HydrophobicContact CB-CG1 3.78Å; A247-V436 HydrophobicContact CB-CG2 4.11Å; F433-V436 HydrophobicContact CB-CB 4.35Å; F433-V436 HydrophobicContact CB-CG2 4.04Å; F433-V436 HydrophobicContact CD1-CG2 3.96Å; F433-V436 HydrophobicContact CG-CG2 4.5Å; F433-V436 WeakPolarHBondContact O-CB 3.38Å; F433-V436 PolarHBondContact O-N 3.24Å; V436-W438 HydrophobicContact CB-CZ2 4.36Å; V436-W438 HydrophobicContact CG1-CD2 3.69Å; V436-W438 HydrophobicContact CG1-CE3 4.13Å; V436-W438 HydrophobicContact CG1-CG 4.01Å; V436-W438 HydrophobicContact CG1-CZ2 4.09Å; V436-W438 PolarHBondContact O-N 3.26Å; V436-I441 HydrophobicContact CG1-CD1 4.16Å
437	D	95.6	Very high	95.3	Very high	37 Å²	37	66.5 Å²	66.5	20%	0.198	33%	0.333	C	S	.	.			trans	-84.1	98.8	163.2	-179.9	-11	0	0	0	108.7	E439 H440 I441 R444	D437-E439 PolarHBondContact O-N 2.85Å; D437-E439 PolarHBondContact OD1-N 3.46Å; D437-H440 IonicContact OD1-CG 3.51Å; D437-H440 PolarHBondContact OD1-N 3.22Å; D437-H440 IonicContact OD1-ND1 2.91Å; D437-H440 PolarHBondContact OD1-ND1 3.42Å; D437-H440 WeakPolarHBondContact OD2-CB 3.21Å; D437-H440 IonicContact OD2-CG 2.73Å; D437-H440 IonicContact OD2-ND1 3.42Å; D437-H440 PolarHBondContact OD2-ND1 2.97Å; D437-I441 VanDerWaalsContact O-CB 3.28Å; D437-I441 WeakPolarHBondContact O-CB 3.28Å; D437-I441 PolarHBondContact O-N 3.01Å; D437-R444 IonicContact OD2-CZ 3.9Å; D437-R444 IonicContact OD2-NE 3.53Å; D437-R444 IonicContact OD2-NH2 3.21Å; D437-R444 PolarHBondContact OD2-NH2 3.43Å
438	W	95.8	Very high	95.3	Very high	37 Å²	37	67.4 Å²	67.4	14%	0.14	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-17.4	-176.4	-66.4	96.8	0	0	0	114.4	A247 V250 L251 R428 F433 V436	A247-W438 HydrophobicContact CB-CE3 4.46Å; A247-W438 HydrophobicContact CB-CH2 3.76Å; A247-W438 HydrophobicContact CB-CZ2 4.43Å; A247-W438 HydrophobicContact CB-CZ3 3.77Å; A247-W438 WeakPolarHBondContact O-CZ3 3.27Å; V250-W438 HydrophobicContact CB-CH2 4.31Å; V250-W438 HydrophobicContact CB-CZ3 4.1Å; V250-W438 HydrophobicContact CG1-CH2 4.23Å; V250-W438 HydrophobicContact CG1-CZ3 4.04Å; L251-W438 HydrophobicContact CD1-CE3 4.21Å; L251-W438 HydrophobicContact CD2-CE3 3.91Å; L251-W438 HydrophobicContact CD2-CZ3 4.39Å; L251-W438 HydrophobicContact CG-CE3 3.96Å; L251-W438 HydrophobicContact CG-CZ3 4.17Å; R428-W438 HydrophobicContact CB-CZ2 4.17Å; R428-W438 HydrophobicContact CG-CD2 3.79Å; R428-W438 HydrophobicContact CG-CE3 4.17Å; R428-W438 HydrophobicContact CG-CG 4.31Å; R428-W438 HydrophobicContact CG-CH2 4.06Å; R428-W438 HydrophobicContact CG-CZ2 3.7Å; R428-W438 HydrophobicContact CG-CZ3 4.28Å; F433-W438 HydrophobicContact CB-CZ2 3.7Å; F433-W438 HydrophobicContact CD1-CH2 4.04Å; F433-W438 AromaticContact CD1-CZ2 3.84Å; F433-W438 HydrophobicContact CD1-CZ2 3.84Å; F433-W438 HydrophobicContact CD2-CH2 4.41Å; F433-W438 AromaticContact CD2-CZ2 3.99Å; F433-W438 HydrophobicContact CD2-CZ2 3.99Å; F433-W438 HydrophobicContact CE1-CH2 4.19Å; F433-W438 HydrophobicContact CE1-CZ2 4.42Å; F433-W438 HydrophobicContact CG-CH2 4.15Å; F433-W438 AromaticContact CG-CZ2 3.59Å; F433-W438 HydrophobicContact CG-CZ2 3.59Å; F433-W438 HydrophobicContact CZ-CH2 4.44Å; V436-W438 HydrophobicContact CB-CZ2 4.36Å; V436-W438 HydrophobicContact CG1-CD2 3.69Å; V436-W438 HydrophobicContact CG1-CE3 4.13Å; V436-W438 HydrophobicContact CG1-CG 4.01Å; V436-W438 HydrophobicContact CG1-CZ2 4.09Å; V436-W438 PolarHBondContact O-N 3.26Å
439	E	94	Very high	95.1	Very high	157 Å²	157	67 Å²	67	73%	0.734	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-43.5	180	-66.9	-177.3	171.7	0	0	110.4	D437	D437-E439 PolarHBondContact O-N 2.85Å; D437-E439 PolarHBondContact OD1-N 3.46Å
440	H	95.4	Very high	94.9	Very high	84 Å²	84	61.4 Å²	61.4	39%	0.389	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	10.3	-171.3	-46.6	93.1	0	0	0	115.2	D437 R442 E443 R444	D437-H440 IonicContact OD1-CG 3.51Å; D437-H440 PolarHBondContact OD1-N 3.22Å; D437-H440 IonicContact OD1-ND1 2.91Å; D437-H440 PolarHBondContact OD1-ND1 3.42Å; D437-H440 WeakPolarHBondContact OD2-CB 3.21Å; D437-H440 IonicContact OD2-CG 2.73Å; D437-H440 IonicContact OD2-ND1 3.42Å; D437-H440 PolarHBondContact OD2-ND1 2.97Å; H440-R442 PolarHBondContact O-N 2.95Å; H440-R442 VanDerWaalsContact O-N 3.09Å; H440-E443 WeakPolarHBondContact CA-OE2 3.4Å; H440-E443 VanDerWaalsContact CB-OE2 3.27Å; H440-E443 WeakPolarHBondContact CB-OE2 3.21Å; H440-E443 IonicContact CD2-OE2 3.21Å; H440-E443 PolarHBondContact CD2-OE2 2.85Å; H440-E443 VanDerWaalsContact CD2-OE2 3.27Å; H440-E443 IonicContact CG-OE2 2.63Å; H440-E443 PolarHBondContact O-N 2.92Å; H440-E443 VanDerWaalsContact O-N 3.08Å; H440-R444 WeakPolarHBondContact O-CG 3.46Å; H440-R444 PolarHBondContact O-N 3.48Å
441	I	96	Very high	94.6	Very high	12 Å²	12	66.2 Å²	66.2	6%	0.062	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-35.7	-177.2	-172.2	167.5	0	0	0	112.8	W201 F244 A247 E248 L251 V436 D437	W201-I441 HydrophobicContact CH2-CG2 4.1Å; F244-I441 HydrophobicContact CD2-CD1 4.1Å; F244-I441 HydrophobicContact CD2-CG1 3.98Å; F244-I441 HydrophobicContact CE2-CD1 4.26Å; F244-I441 HydrophobicContact CE2-CG1 3.72Å; A247-I441 HydrophobicContact CB-CD1 3.69Å; E248-I441 HydrophobicContact CG-CD1 3.62Å; E248-I441 HydrophobicContact CG-CG1 3.95Å; L251-I441 HydrophobicContact CD1-CG2 3.53Å; V436-I441 HydrophobicContact CG1-CD1 4.16Å; D437-I441 VanDerWaalsContact O-CB 3.28Å; D437-I441 WeakPolarHBondContact O-CB 3.28Å; D437-I441 PolarHBondContact O-N 3.01Å
442	R	94.2	Very high	94.2	Very high	39 Å²	39	66.1 Å²	66.1	15%	0.147	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-18.4	-176.3	-158.4	174.7	-172.1	77.5	-4.1	113.9	P200 W201 E248 H278 I279 H440	P200-R442 PolarHBondContact O-NH2 3.07Å; W201-R442 VanDerWaalsContact CE3-NH1 3.26Å; W201-R442 HydrophobicContact CH2-CB 4.14Å; W201-R442 HydrophobicContact CH2-CG 4.36Å; E248-R442 IonicContact OE1-NH1 2.75Å; H278-R442 HydrophobicContact CB-CG 4.43Å; H278-R442 PolarHBondContact CE1-O 3.28Å; H278-R442 PolarHBondContact NE2-O 3.09Å; I279-R442 PolarHBondContact O-NH1 3.06Å; I279-R442 PolarHBondContact O-NH2 3.28Å; H440-R442 PolarHBondContact O-N 2.95Å; H440-R442 VanDerWaalsContact O-N 3.09Å
443	E	92.5	Very high	93.8	Very high	137 Å²	137	77 Å²	77	64%	0.64	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-19.5	173.4	-63.9	102.8	-144.5	0	0	112.6	H440	H440-E443 WeakPolarHBondContact CA-OE2 3.4Å; H440-E443 VanDerWaalsContact CB-OE2 3.27Å; H440-E443 WeakPolarHBondContact CB-OE2 3.21Å; H440-E443 IonicContact CD2-OE2 3.21Å; H440-E443 PolarHBondContact CD2-OE2 2.85Å; H440-E443 VanDerWaalsContact CD2-OE2 3.27Å; H440-E443 IonicContact CG-OE2 2.63Å; H440-E443 PolarHBondContact O-N 2.92Å; H440-E443 VanDerWaalsContact O-N 3.08Å
444	R	91.3	Very high	93.5	Very high	128 Å²	128	79.2 Å²	79.2	48%	0.483	41%	0.405	S	S	.	.	S	Bend	trans	-80.3	154.8	177.7	-68	174.3	-178	-154.9	-0.3	111	H278 D437 H440 A446	H278-R444 PolarHBondContact CE1-O 3.47Å; H278-R444 PolarHBondContact NE2-O 2.84Å; D437-R444 IonicContact OD2-CZ 3.9Å; D437-R444 IonicContact OD2-NE 3.53Å; D437-R444 IonicContact OD2-NH2 3.21Å; D437-R444 PolarHBondContact OD2-NH2 3.43Å; H440-R444 WeakPolarHBondContact O-CG 3.46Å; H440-R444 PolarHBondContact O-N 3.48Å; R444-A446 PolarHBondContact O-N 3.25Å
445	P	94.2	Very high	93.1	Very high	121 Å²	121	76.6 Å²	76.6	79%	0.786	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-55.3	135.6	174	-24.5	34.2	0	0	0	111.9
446	A	94.9	Very high	92.9	Very high	13 Å²	13	77 Å²	77	11%	0.107	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-63.3	154.1	176.4	0	0	0	0	0	112.3	F244 K276 G277 R444 I448	F244-A446 HydrophobicContact CE1-CB 3.88Å; F244-A446 VanDerWaalsContact CZ-CA 3.49Å; F244-A446 HydrophobicContact CZ-CB 3.78Å; K276-A446 VanDerWaalsContact O-CB 3.3Å; K276-A446 WeakPolarHBondContact O-CB 3.43Å; G277-A446 WeakPolarHBondContact O-CB 3.28Å; R444-A446 PolarHBondContact O-N 3.25Å; A446-I448 PolarHBondContact O-N 3.11Å
447	A	95.8	Very high	92.6	Very high	35 Å²	35	76.6 Å²	76.6	29%	0.289	39%	0.386	S	S	.	.	S	Bend	trans	-63.4	-25.4	-178.5	0	0	0	0	0	113.9	Q241 F244	Q241-A447 HydrophobicContact CB-CB 4.45Å; Q241-A447 HydrophobicContact CG-CB 4.19Å; F244-A447 HydrophobicContact CB-CB 3.63Å; F244-A447 HydrophobicContact CD1-CB 3.66Å; F244-A447 HydrophobicContact CD2-CB 4.37Å; F244-A447 HydrophobicContact CE1-CB 4.46Å; F244-A447 HydrophobicContact CG-CB 3.62Å
448	I	95.2	Very high	92.5	Very high	20 Å²	20	75.8 Å²	75.8	10%	0.103	38%	0.382	C	S	.	.	S	Bend	trans	-131.3	114	170.8	-54.3	174.1	0	0	0	107.7	L230 L237 Q241 Y245 A446	L230-I448 HydrophobicContact CD1-CD1 4.33Å; L230-I448 HydrophobicContact CD2-CD1 4.17Å; L237-I448 HydrophobicContact CD2-CD1 3.88Å; Q241-I448 HydrophobicContact CG-CD1 4.32Å; Q241-I448 HydrophobicContact CG-CG1 4.12Å; Y245-I448 HydrophobicContact CE2-CD1 3.98Å; Y245-I448 HydrophobicContact CE2-CG1 4.26Å; Y245-I448 WeakPolarHBondContact OH-CB 3.5Å; A446-I448 PolarHBondContact O-N 3.11Å
449	P	91.1	Very high	92.3	Very high	91 Å²	91	77.2 Å²	77.2	59%	0.591	40%	0.397	S	S	*	.			trans	-68.8	141.6	177.3	28.1	-33.7	0	0	0	110.8
450	V	92.3	Very high	92.2	Very high	28 Å²	28	71 Å²	71	17%	0.17	37%	0.369	C	S	.	.			trans	-86.8	123.3	174.4	170.4	0	0	0	0	109.1	I452	V450-I452 HydrophobicContact CG1-CG2 3.62Å
451	N	90.4	Very high	91.9	Very high	135 Å²	135	68.3 Å²	68.3	72%	0.722	36%	0.357	S	S	*	.			trans	-95.4	109.3	175.4	-65.9	-39.4	0	0	0	109.3
452	I	89.3	Confident	91.3	Very high	62 Å²	62	69.8 Å²	69.8	32%	0.318	36%	0.364	S	S	.	.			trans	-124.7	142.4	178.1	51.8	166	0	0	0	110.4	P223 A275 V450 D457	P223-I452 HydrophobicContact CB-CD1 4.47Å; P223-I452 HydrophobicContact CB-CG2 3.86Å; P223-I452 HydrophobicContact CG-CD1 3.95Å; P223-I452 HydrophobicContact CG-CG2 4.3Å; A275-I452 HydrophobicContact CB-CD1 3.89Å; V450-I452 HydrophobicContact CG1-CG2 3.62Å; I452-D457 WeakPolarHBondContact CA-OD2 3.45Å; I452-D457 HydrophobicContact CB-CB 4.24Å; I452-D457 HydrophobicContact CG2-CB 4.34Å
453	R	89.9	Confident	90.8	Very high	238 Å²	238	75.4 Å²	75.4	90%	0.898	39%	0.392	S	S	*	.	S	Bend	trans	-93	-27.9	-178	-60.4	176.8	-177.3	176	1.5	112.7	D457	R453-D457 WeakPolarHBondContact CB-OD2 3.08Å; R453-D457 PolarHBondContact N-OD2 3.46Å
454	S	89.9	Confident	90.4	Very high	52 Å²	52	70.7 Å²	70.7	36%	0.364	37%	0.37	S	S	.	.	S	Bend	trans	-155.9	169.9	-176.8	58.5	0	0	0	0	110.9	D456 D457	S454-D456 WeakPolarHBondContact CB-OD1 3.28Å; S454-D456 PolarHBondContact O-N 3.42Å; S454-D456 PolarHBondContact OG-OD1 3.23Å; S454-D457 VanDerWaalsContact O-CB 3.28Å; S454-D457 WeakPolarHBondContact O-CB 3.09Å; S454-D457 PolarHBondContact O-N 3.4Å; S454-D457 PolarHBondContact OG-N 2.87Å
455	I	87.9	Confident	89.6	Confident	98 Å²	98	69.6 Å²	69.6	50%	0.503	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-18.6	-179.5	59.4	169.7	0	0	0	113.6	I167 F221 L505	I167-I455 HydrophobicContact CG1-CD1 4Å; I167-I455 HydrophobicContact CG1-CG1 4.26Å; F221-I455 WeakPolarHBondContact CD1-O 3.29Å; F221-I455 WeakPolarHBondContact CE1-O 3.43Å; I455-L505 HydrophobicContact CD1-CD2 4.44Å; I455-L505 HydrophobicContact CG2-CD2 4.38Å
456	D	88.3	Confident	88.7	Confident	70 Å²	70	71.9 Å²	71.9	37%	0.374	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	13.6	178.2	63	-22.5	0	0	0	112	L158 I167 S454 T458	L158-D456 HydrophobicContact CD2-CB 4.03Å; I167-D456 HydrophobicContact CD1-CB 4.31Å; I167-D456 HydrophobicContact CG1-CB 4.36Å; S454-D456 WeakPolarHBondContact CB-OD1 3.28Å; S454-D456 PolarHBondContact O-N 3.42Å; S454-D456 PolarHBondContact OG-OD1 3.23Å; D456-T458 PolarHBondContact O-N 2.86Å
457	D	91.6	Very high	87.9	Confident	15 Å²	15	72.8 Å²	72.8	8%	0.08	39%	0.392	C	S	.	.			trans	-63.6	121.7	179.4	-169.4	-19.8	0	0	0	110.8	F221 I452 R453 S454 S459	F221-D457 WeakPolarHBondContact CZ-O 3.44Å; I452-D457 WeakPolarHBondContact CA-OD2 3.45Å; I452-D457 HydrophobicContact CB-CB 4.24Å; I452-D457 HydrophobicContact CG2-CB 4.34Å; R453-D457 WeakPolarHBondContact CB-OD2 3.08Å; R453-D457 PolarHBondContact N-OD2 3.46Å; S454-D457 VanDerWaalsContact O-CB 3.28Å; S454-D457 WeakPolarHBondContact O-CB 3.09Å; S454-D457 PolarHBondContact O-N 3.4Å; S454-D457 PolarHBondContact OG-N 2.87Å; D457-S459 WeakPolarHBondContact OD1-CB 3.29Å; D457-S459 PolarHBondContact OD1-N 3.36Å; D457-S459 PolarHBondContact OD1-OG 3.05Å; D457-S459 PolarHBondContact OD2-OG 3.2Å
458	T	92.1	Very high	87.3	Confident	19 Å²	19	76.4 Å²	76.4	12%	0.117	41%	0.407	C	S	.	.			trans	-112.7	17.2	-179.7	52.9	0	0	0	0	113.2	K146 I148 L158 F221 D456 N460 F461	K146-T458 HydrophobicContact CD-CG2 4.13Å; K146-T458 VanDerWaalsContact CD-OG1 3.28Å; K146-T458 WeakPolarHBondContact CD-OG1 3.37Å; K146-T458 PolarHBondContact NZ-OG1 2.7Å; I148-T458 HydrophobicContact CG2-CG2 3.68Å; L158-T458 HydrophobicContact CD2-CG2 3.79Å; F221-T458 HydrophobicContact CZ-CG2 4.16Å; D456-T458 PolarHBondContact O-N 2.86Å; T458-N460 PolarHBondContact O-N 3.17Å; T458-F461 PolarHBondContact O-N 3.31Å; T458-F461 VanDerWaalsContact O-N 3.12Å
459	S	91.6	Very high	86.8	Confident	67 Å²	67	78.2 Å²	78.2	47%	0.469	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-13.1	179.5	60.6	0	0	0	0	114.5	K233 D457	K233-S459 PolarHBondContact NZ-O 3.35Å; D457-S459 WeakPolarHBondContact OD1-CB 3.29Å; D457-S459 PolarHBondContact OD1-N 3.36Å; D457-S459 PolarHBondContact OD1-OG 3.05Å; D457-S459 PolarHBondContact OD2-OG 3.2Å
460	N	91.7	Very high	86.4	Confident	27 Å²	27	76.9 Å²	76.9	14%	0.144	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	7.9	173.9	-64.7	-45.6	0	0	0	114.2	P223 T229 K233 T458	P223-N460 WeakPolarHBondContact O-CB 3.48Å; P223-N460 PolarHBondContact O-ND2 3.41Å; T229-N460 WeakPolarHBondContact CG2-O 3.42Å; K233-N460 PolarHBondContact NZ-OD1 3.18Å; T458-N460 PolarHBondContact O-N 3.17Å
461	F	89.9	Confident	86	Confident	28 Å²	28	77.7 Å²	77.7	12%	0.123	41%	0.409	C	S	.	.	S	Bend	trans	-116.9	156.4	178.7	-63	-94.1	0	0	0	111.2	I148 F221 L222 T458	I148-F461 HydrophobicContact CB-CD1 3.89Å; I148-F461 HydrophobicContact CB-CE1 4.26Å; I148-F461 HydrophobicContact CB-CG 4.15Å; I148-F461 HydrophobicContact CD1-CE1 4.31Å; I148-F461 HydrophobicContact CG2-CG 4.45Å; I148-F461 WeakPolarHBondContact O-CD1 3.44Å; F221-F461 HydrophobicContact CD2-CZ 4.4Å; F221-F461 HydrophobicContact CE2-CD2 4.45Å; F221-F461 HydrophobicContact CE2-CE1 4.5Å; F221-F461 AromaticContact CE2-CE2 3.49Å; F221-F461 HydrophobicContact CE2-CE2 3.49Å; F221-F461 VanDerWaalsContact CE2-CE2 3.49Å; F221-F461 AromaticContact CE2-CZ 3.5Å; F221-F461 HydrophobicContact CE2-CZ 3.5Å; F221-F461 VanDerWaalsContact CE2-CZ 3.5Å; F221-F461 AromaticContact CZ-CE2 3.64Å; F221-F461 HydrophobicContact CZ-CE2 3.64Å; F221-F461 HydrophobicContact CZ-CZ 4.13Å; L222-F461 VanDerWaalsContact O-CZ 3.27Å; L222-F461 WeakPolarHBondContact O-CZ 3.37Å; T458-F461 PolarHBondContact O-N 3.31Å; T458-F461 VanDerWaalsContact O-N 3.12Å
462	D	83	Confident	84.9	Confident	42 Å²	42	73.4 Å²	73.4	23%	0.225	39%	0.389	C	S	.	.			trans	-62.6	144.7	170.4	-84	-17.4	0	0	0	111.1	Y333 F464	Y333-D462 WeakPolarHBondContact OH-CB 3.32Å; Y333-D462 PolarHBondContact OH-OD2 2.9Å; D462-F464 HydrophobicContact CB-CE2 4.31Å; D462-F464 HydrophobicContact CB-CZ 4.26Å; D462-F464 WeakPolarHBondContact O-CD2 3.32Å; D462-F464 WeakPolarHBondContact O-CE2 3.48Å
463	E	83.9	Confident	83.5	Confident	157 Å²	157	77.9 Å²	77.9	73%	0.734	41%	0.413	S	S	*	.			trans	-88.5	133.7	176.3	-65.9	-170.8	167.8	0	0	111.7	P465	E463-P465 VanDerWaalsContact O-CD 3.26Å; E463-P465 WeakPolarHBondContact O-CD 3.21Å
464	F	83.9	Confident	81.9	Confident	39 Å²	39	70.2 Å²	70.2	17%	0.171	39%	0.393	C	S	.	.			trans	-114	81.5	175.1	-58.9	-82.8	0	0	0	109.7	I147 K150 Y333 D462 A467	I147-F464 HydrophobicContact CB-CB 4.46Å; I147-F464 HydrophobicContact CB-CD2 4.21Å; I147-F464 HydrophobicContact CG2-CD2 3.9Å; I147-F464 HydrophobicContact CG2-CE2 4.3Å; I147-F464 HydrophobicContact CG2-CG 4.26Å; I147-F464 WeakPolarHBondContact O-CD2 3.22Å; K150-F464 HydrophobicContact CB-CE1 4.1Å; K150-F464 HydrophobicContact CB-CZ 4.38Å; K150-F464 HydrophobicContact CD-CD1 3.82Å; K150-F464 HydrophobicContact CD-CE1 3.93Å; K150-F464 HydrophobicContact CG-CD1 4.11Å; K150-F464 HydrophobicContact CG-CE1 3.85Å; K150-F464 HydrophobicContact CG-CZ 4.24Å; Y333-F464 HydrophobicContact CD1-CE1 4.35Å; Y333-F464 AromaticContact CE1-CE1 3.48Å; Y333-F464 HydrophobicContact CE1-CE1 3.48Å; Y333-F464 VanDerWaalsContact CE1-CE1 3.48Å; Y333-F464 AromaticContact CE1-CZ 3.56Å; Y333-F464 HydrophobicContact CE1-CZ 3.56Å; Y333-F464 AromaticContact CZ-CE1 3.63Å; Y333-F464 AromaticContact CZ-CZ 3.71Å; Y333-F464 WeakPolarHBondContact OH-CE1 3.33Å; Y333-F464 WeakPolarHBondContact OH-CZ 3.43Å; D462-F464 HydrophobicContact CB-CE2 4.31Å; D462-F464 HydrophobicContact CB-CZ 4.26Å; D462-F464 WeakPolarHBondContact O-CD2 3.32Å; D462-F464 WeakPolarHBondContact O-CE2 3.48Å; F464-A467 HydrophobicContact CB-CB 4.38Å
465	P	75.5	Confident	80.1	Confident	104 Å²	104	72.9 Å²	72.9	68%	0.675	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	146.9	179.7	26.6	-34	0	0	0	110.8	E463 A467	E463-P465 VanDerWaalsContact O-CD 3.26Å; E463-P465 WeakPolarHBondContact O-CD 3.21Å; P465-A467 PolarHBondContact O-N 2.84Å
466	N	74.3	Confident	78.3	Confident	170 Å²	170	72.5 Å²	72.5	91%	0.909	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	22.7	177.5	-49.7	-38.5	0	0	0	115.5
467	A	78.4	Confident	76.6	Confident	31 Å²	31	73.8 Å²	73.8	26%	0.256	42%	0.418	S	S	.	.			trans	-71.8	130	174.1	0	0	0	0	0	111.4	I147 F464 P465 L469	I147-A467 HydrophobicContact CD1-CB 3.49Å; I147-A467 VanDerWaalsContact CD1-CB 3.49Å; I147-A467 HydrophobicContact CG1-CB 3.91Å; F464-A467 HydrophobicContact CB-CB 4.38Å; P465-A467 PolarHBondContact O-N 2.84Å; A467-L469 PolarHBondContact O-N 2.81Å
468	D	82.6	Confident	74.5	Confident	112 Å²	112	81 Å²	81	60%	0.599	45%	0.453	S	S	*	.			trans	-72.7	117.2	171.3	-176.2	11.3	0	0	0	110.1	R157 S470	R157-D468 PolarHBondContact NH2-O 3.43Å; D468-S470 VanDerWaalsContact C-N 3.34Å; D468-S470 WeakPolarHBondContact OD1-CB 3.33Å; D468-S470 PolarHBondContact OD1-N 3.33Å; D468-S470 PolarHBondContact OD1-OG 3.31Å; D468-S470 VanDerWaalsContact OD1-OG 3.05Å; D468-S470 PolarHBondContact OD2-OG 3.05Å
469	L	85.7	Confident	72.6	Confident	57 Å²	57	88.9 Å²	88.9	30%	0.298	49%	0.486	S	S	.	.			trans	-89.2	-2.2	177.6	-64.7	177.7	0	0	0	112.6	P144 L145 I147 R157 A467	P144-L469 HydrophobicContact CB-CB 4.48Å; P144-L469 HydrophobicContact CG-CB 4.5Å; P144-L469 VanDerWaalsContact CG-O 3.29Å; P144-L469 WeakPolarHBondContact CG-O 3.46Å; L145-L469 WeakPolarHBondContact O-CD1 3.34Å; I147-L469 HydrophobicContact CG1-CD2 3.72Å; R157-L469 PolarHBondContact NH1-O 3.37Å; A467-L469 PolarHBondContact O-N 2.81Å
470	S	83.2	Confident	71.1	Confident	63 Å²	63	85.9 Å²	85.9	44%	0.441	47%	0.465	S	S	.	.	S	Bend	trans	-58.4	146	175	79.6	0	0	0	0	110.6	R157 D468	R157-S470 PolarHBondContact NH1-O 3.14Å; R157-S470 PolarHBondContact NH2-O 2.9Å; D468-S470 VanDerWaalsContact C-N 3.34Å; D468-S470 WeakPolarHBondContact OD1-CB 3.33Å; D468-S470 PolarHBondContact OD1-N 3.33Å; D468-S470 PolarHBondContact OD1-OG 3.31Å; D468-S470 VanDerWaalsContact OD1-OG 3.05Å; D468-S470 PolarHBondContact OD2-OG 3.05Å
471	W	82.6	Confident	69.1	Low	45 Å²	45	88.7 Å²	88.7	17%	0.17	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-72.2	135	171.7	-67.2	125	0	0	0	108.6	V139 F142 P144 V159 M170 I172 Y216 N473	V139-W471 HydrophobicContact CB-CD2 3.77Å; V139-W471 HydrophobicContact CB-CE3 4.14Å; V139-W471 HydrophobicContact CB-CG 4.02Å; V139-W471 HydrophobicContact CB-CZ2 4.34Å; V139-W471 HydrophobicContact CG1-CD2 4.21Å; V139-W471 HydrophobicContact CG1-CE3 4.05Å; V139-W471 HydrophobicContact CG1-CZ3 4.3Å; V139-W471 HydrophobicContact CG2-CB 4.29Å; V139-W471 HydrophobicContact CG2-CD2 4.28Å; V139-W471 HydrophobicContact CG2-CG 3.99Å; V139-W471 PolarHBondContact O-NE1 2.94Å; F142-W471 HydrophobicContact CB-CZ2 4.24Å; F142-W471 PolarHBondContact O-NE1 3.29Å; P144-W471 HydrophobicContact CB-CH2 4.25Å; P144-W471 HydrophobicContact CB-CZ2 3.96Å; P144-W471 HydrophobicContact CG-CZ2 3.97Å; V159-W471 HydrophobicContact CG1-CH2 4.17Å; M170-W471 HydrophobicContact CE-CH2 4.08Å; M170-W471 HydrophobicContact SD-CH2 3.45Å; M170-W471 WeakPolarHBondContact SD-CH2 3Å; M170-W471 HydrophobicContact SD-CZ2 4.45Å; M170-W471 HydrophobicContact SD-CZ3 3.84Å; I172-W471 HydrophobicContact CD1-CZ3 3.74Å; Y216-W471 HydrophobicContact CE1-CZ3 4.4Å; W471-N473 PolarHBondContact O-N 3.23Å
472	P	67.9	Low	67.3	Low	46 Å²	46	94.5 Å²	94.5	30%	0.299	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-54.8	125.8	177.4	-22.9	31.9	0	0	0	110.4	V474	P472-V474 PolarHBondContact O-N 3.37Å
473	N	58.8	Low	66.1	Low	155 Å²	155	96.4 Å²	96.4	83%	0.829	51%	0.508	S	S	*	.			trans	-55.7	115.5	178.7	-89.1	-31.9	0	0	0	110.4	W471 T475	W471-N473 PolarHBondContact O-N 3.23Å; N473-T475 PolarHBondContact O-N 3.08Å
474	V	57.7	Low	65.1	Low	78 Å²	78	91.6 Å²	91.6	47%	0.473	49%	0.488	S	S	.	.			trans	-67.7	96.8	178.6	-175.6	0	0	0	0	108.2	S212 P472	S212-V474 WeakPolarHBondContact OG-CG1 3.42Å; P472-V474 PolarHBondContact O-N 3.37Å
475	T	52.1	Low	64.1	Low	107 Å²	107	92 Å²	92	66%	0.656	49%	0.491	S	S	*	.			trans	-81.9	133.7	176.1	38.7	0	0	0	0	110.6	S212 N473	S212-T475 PolarHBondContact OG-O 3.5Å; N473-T475 PolarHBondContact O-N 3.08Å
476	D	50.5	Low	63.5	Low	90 Å²	90	87.9 Å²	87.9	48%	0.481	47%	0.466	S	S	.	.			trans	11.4	109	177.5	-162.7	-11.1	0	0	0	118.3	M478 K479	D476-M478 PolarHBondContact O-N 2.79Å; D476-M478 WeakPolarHBondContact OD1-CB 3.3Å; D476-M478 PolarHBondContact OD1-N 3.48Å; D476-K479 PolarHBondContact O-N 2.94Å
477	P	51.6	Low	63.3	Low	97 Å²	97	79.9 Å²	79.9	63%	0.63	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-50.9	-26.9	175.1	-24.7	32.3	0	0	0	115	K479 S480	P477-K479 VanDerWaalsContact C-N 3.3Å; P477-K479 PolarHBondContact O-N 3.02Å; P477-S480 PolarHBondContact O-N 3.4Å
478	M	48.4	Very low	62.6	Low	167 Å²	167	80 Å²	80	82%	0.823	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-68.6	-23.5	-176.2	-73.9	-131.7	113.6	0	0	113.9	D476 S480	D476-M478 PolarHBondContact O-N 2.79Å; D476-M478 WeakPolarHBondContact OD1-CB 3.3Å; D476-M478 PolarHBondContact OD1-N 3.48Å; M478-S480 VanDerWaalsContact C-N 3.31Å; M478-S480 PolarHBondContact O-N 3.1Å
479	K	52.3	Low	61.8	Low	184 Å²	184	76.7 Å²	76.7	80%	0.8	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-83.5	1.1	-179.1	-73.8	-174.9	178.7	177.2	0	114.7	D476 P477	D476-K479 PolarHBondContact O-N 2.94Å; P477-K479 VanDerWaalsContact C-N 3.3Å; P477-K479 PolarHBondContact O-N 3.02Å
480	S	58.4	Low	61.2	Low	4 Å²	4	74.1 Å²	74.1	3%	0.028	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-116	17.6	-168.8	-158.3	0	0	0	0	114.7	S212 P477 M478 K483 N484	S212-S480 PolarHBondContact O-OG 3.06Å; P477-S480 PolarHBondContact O-N 3.4Å; M478-S480 VanDerWaalsContact C-N 3.31Å; M478-S480 PolarHBondContact O-N 3.1Å; S480-K483 PolarHBondContact O-N 2.92Å; S480-N484 WeakPolarHBondContact O-CB 3.37Å; S480-N484 PolarHBondContact O-N 2.93Å; S480-N484 PolarHBondContact O-ND2 3.04Å; S480-N484 VanDerWaalsContact O-ND2 3.14Å
481	Y	50.3	Low	60.9	Low	86 Å²	86	74.8 Å²	74.8	34%	0.337	39%	0.389	S	S	.	.	H	α-helix	trans	-60.6	-53.3	-174.7	-168.5	-100	0	0	0	113	K72 V75 K483 N484 L485	K72-Y481 HydrophobicContact CG-CE1 4.38Å; K72-Y481 WeakPolarHBondContact CG-OH 3.26Å; V75-Y481 WeakPolarHBondContact CG2-OH 3.44Å; Y481-K483 VanDerWaalsContact C-N 3.3Å; Y481-K483 PolarHBondContact O-N 3.04Å; Y481-N484 PolarHBondContact O-N 3.18Å; Y481-L485 HydrophobicContact CE1-CD1 4.48Å; Y481-L485 HydrophobicContact CE1-CD2 4.48Å; Y481-L485 PolarHBondContact O-N 3.48Å
482	Q	53.1	Low	60.5	Low	151 Å²	151	75.7 Å²	75.7	71%	0.706	39%	0.393	S	S	*	.	H	α-helix	trans	-63.7	-34.6	177.3	-85.2	176.8	-18.6	0	0	112.8	N484 L485	Q482-N484 VanDerWaalsContact C-N 3.34Å; Q482-N484 PolarHBondContact O-N 3.39Å; Q482-L485 HydrophobicContact CG-CD1 4.47Å; Q482-L485 WeakPolarHBondContact O-CB 3.5Å; Q482-L485 PolarHBondContact O-N 3.06Å
483	K	58	Low	60.8	Low	81 Å²	81	74.3 Å²	74.3	35%	0.352	38%	0.382	S	S	.	.	H	α-helix	trans	-66.8	-38.2	179.9	-58.2	-172.9	178.2	175.7	0	111.5	L179 S480 Y481 L485 F487	L179-K483 HydrophobicContact CD1-CB 3.77Å; L179-K483 HydrophobicContact CD1-CD 4.29Å; L179-K483 HydrophobicContact CD1-CG 3.59Å; S480-K483 PolarHBondContact O-N 2.92Å; Y481-K483 VanDerWaalsContact C-N 3.3Å; Y481-K483 PolarHBondContact O-N 3.04Å; K483-L485 VanDerWaalsContact C-N 3.32Å; K483-L485 PolarHBondContact O-N 2.96Å; K483-F487 WeakPolarHBondContact O-CD2 3.44Å
484	N	62.2	Low	61.5	Low	57 Å²	57	67.2 Å²	67.2	31%	0.305	35%	0.345	S	S	.	.	H	α-helix	trans	-69.5	-27.7	-179.3	-69.9	-27.1	0	0	0	113.3	K175 S480 Y481 Q482 A486 F487 I488	K175-N484 PolarHBondContact NZ-OD1 3.4Å; S480-N484 WeakPolarHBondContact O-CB 3.37Å; S480-N484 PolarHBondContact O-N 2.93Å; S480-N484 PolarHBondContact O-ND2 3.04Å; S480-N484 VanDerWaalsContact O-ND2 3.14Å; Y481-N484 PolarHBondContact O-N 3.18Å; Q482-N484 VanDerWaalsContact C-N 3.34Å; Q482-N484 PolarHBondContact O-N 3.39Å; N484-A486 VanDerWaalsContact C-N 3.35Å; N484-A486 PolarHBondContact O-N 3.46Å; N484-F487 CarbonylContact O-C 3.47Å; N484-F487 PolarHBondContact O-N 3.25Å; N484-I488 PolarHBondContact O-N 2.93Å; N484-I488 VanDerWaalsContact O-N 3.14Å
485	L	61.7	Low	61.8	Low	47 Å²	47	65.3 Å²	65.3	25%	0.246	33%	0.33	C	S	.	.	H	α-helix	trans	-57.4	-46.5	176.4	-64.7	173.8	0	0	0	112.6	V75 Y481 Q482 K483 F487 I488	V75-L485 HydrophobicContact CB-CD2 4.24Å; V75-L485 HydrophobicContact CG1-CD2 4.43Å; V75-L485 HydrophobicContact CG2-CD2 2.97Å; V75-L485 HydrophobicContact CG2-CG 4.43Å; Y481-L485 HydrophobicContact CE1-CD1 4.48Å; Y481-L485 HydrophobicContact CE1-CD2 4.48Å; Y481-L485 PolarHBondContact O-N 3.48Å; Q482-L485 HydrophobicContact CG-CD1 4.47Å; Q482-L485 WeakPolarHBondContact O-CB 3.5Å; Q482-L485 PolarHBondContact O-N 3.06Å; K483-L485 VanDerWaalsContact C-N 3.32Å; K483-L485 PolarHBondContact O-N 2.96Å; L485-F487 PolarHBondContact O-N 2.95Å; L485-I488 HydrophobicContact CD2-CD1 4.11Å; L485-I488 WeakPolarHBondContact O-CD1 3.27Å; L485-I488 VanDerWaalsContact O-CG1 3.25Å; L485-I488 WeakPolarHBondContact O-CG1 3.36Å; L485-I488 PolarHBondContact O-N 3.39Å
486	A	64	Low	62.2	Low	18 Å²	18	62.3 Å²	62.3	15%	0.149	31%	0.31	C	S	.	.	H	α-helix	trans	-62.7	-30.1	-178.2	0	0	0	0	0	112.2	L179 V184 R188 N484	L179-A486 HydrophobicContact CD2-CB 3.57Å; V184-A486 HydrophobicContact CG1-CB 3.92Å; V184-A486 WeakPolarHBondContact CG1-O 3.35Å; V184-A486 HydrophobicContact CG2-CB 3.81Å; R188-A486 PolarHBondContact NE-O 3.04Å; R188-A486 PolarHBondContact NH2-O 3.34Å; N484-A486 VanDerWaalsContact C-N 3.35Å; N484-A486 PolarHBondContact O-N 3.46Å
487	F	70.7	Confident	62.5	Low	2 Å²	2	58.2 Å²	58.2	1%	0.009	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	21.2	-176.6	-50.9	-67.2	0	0	0	112.7	K175 M178 L179 V184 V187 Q210 L215 K483 N484 L485 N489 Y490	K175-F487 HydrophobicContact CB-CD2 4.43Å; K175-F487 HydrophobicContact CB-CE2 3.81Å; K175-F487 HydrophobicContact CB-CZ 4.49Å; K175-F487 HydrophobicContact CD-CD2 3.92Å; K175-F487 HydrophobicContact CD-CE2 4.15Å; K175-F487 HydrophobicContact CG-CD2 3.88Å; K175-F487 HydrophobicContact CG-CE2 3.71Å; K175-F487 HydrophobicContact CG-CZ 4.45Å; M178-F487 HydrophobicContact CB-CE1 4.25Å; M178-F487 HydrophobicContact CB-CZ 3.79Å; L179-F487 HydrophobicContact CD1-CE2 4.2Å; L179-F487 HydrophobicContact CD2-CE2 4.33Å; L179-F487 HydrophobicContact CD2-CZ 4.38Å; L179-F487 HydrophobicContact CG-CE2 4.04Å; L179-F487 HydrophobicContact CG-CZ 4.13Å; V184-F487 HydrophobicContact CB-CE1 4.39Å; V184-F487 HydrophobicContact CG1-CD1 4.39Å; V184-F487 HydrophobicContact CG1-CE1 4.19Å; V184-F487 HydrophobicContact CG2-CE1 3.95Å; V184-F487 HydrophobicContact CG2-CZ 3.99Å; V187-F487 HydrophobicContact CG1-CD1 4.47Å; V187-F487 HydrophobicContact CG2-CE1 4.43Å; Q210-F487 PolarHBondContact NE2-O 3.1Å; L215-F487 HydrophobicContact CD1-CD1 3.58Å; L215-F487 HydrophobicContact CD1-CE1 3.6Å; L215-F487 HydrophobicContact CD1-CG 4.15Å; L215-F487 HydrophobicContact CD1-CZ 4.19Å; L215-F487 HydrophobicContact CD2-CB 3.88Å; L215-F487 HydrophobicContact CD2-CD1 3.99Å; L215-F487 HydrophobicContact CD2-CD2 4.17Å; L215-F487 HydrophobicContact CD2-CG 3.73Å; L215-F487 HydrophobicContact CG-CD1 4.36Å; L215-F487 HydrophobicContact CG-CG 4.47Å; K483-F487 WeakPolarHBondContact O-CD2 3.44Å; N484-F487 CarbonylContact O-C 3.47Å; N484-F487 PolarHBondContact O-N 3.25Å; L485-F487 PolarHBondContact O-N 2.95Å; F487-N489 PolarHBondContact O-N 3.01Å; F487-Y490 WeakPolarHBondContact O-CB 3.29Å; F487-Y490 PolarHBondContact O-N 3.39Å; F487-Y490 VanDerWaalsContact O-N 3.08Å
488	I	62.4	Low	62.5	Low	33 Å²	33	57 Å²	57	17%	0.169	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	137.6	165.9	-70.8	167.2	0	0	0	108.3	V75 V78 N484 L485 Y490	V75-I488 HydrophobicContact CG1-CD1 3.9Å; V78-I488 HydrophobicContact CG1-CG2 4.4Å; N484-I488 PolarHBondContact O-N 2.93Å; N484-I488 VanDerWaalsContact O-N 3.14Å; L485-I488 HydrophobicContact CD2-CD1 4.11Å; L485-I488 WeakPolarHBondContact O-CD1 3.27Å; L485-I488 VanDerWaalsContact O-CG1 3.25Å; L485-I488 WeakPolarHBondContact O-CG1 3.36Å; L485-I488 PolarHBondContact O-N 3.39Å; I488-Y490 PolarHBondContact O-N 2.75Å
489	N	66.6	Low	62.6	Low	42 Å²	42	50.2 Å²	50.2	23%	0.225	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.6	3.5	-178.1	-52.1	-22.7	0	0	0	115.7	Y82 R191 F487 T491	Y82-N489 HydrophobicContact CD1-CB 4.16Å; Y82-N489 WeakPolarHBondContact CD1-OD1 3.49Å; Y82-N489 HydrophobicContact CD2-CB 4.46Å; Y82-N489 VanDerWaalsContact CD2-ND2 3.32Å; Y82-N489 WeakPolarHBondContact CD2-ND2 3.29Å; Y82-N489 HydrophobicContact CE1-CB 3.65Å; Y82-N489 WeakPolarHBondContact CE1-OD1 3.45Å; Y82-N489 HydrophobicContact CE2-CB 4.03Å; Y82-N489 VanDerWaalsContact CG-CG 3.45Å; Y82-N489 VanDerWaalsContact CG-ND2 3.26Å; R191-N489 PolarHBondContact NH1-O 3.44Å; F487-N489 PolarHBondContact O-N 3.01Å; N489-T491 PolarHBondContact O-N 3.13Å; N489-T491 VanDerWaalsContact O-N 3.12Å
490	Y	73.3	Confident	62.4	Low	4 Å²	4	45.5 Å²	45.5	2%	0.016	22%	0.224	C	C	.	.			trans	-59.5	-26.7	-179	-174.6	-95.8	0	0	0	113.7	V187 S208 F209 Q210 L215 Y216 L217 F487 I488	V187-Y490 HydrophobicContact CG1-CD2 3.81Å; V187-Y490 HydrophobicContact CG1-CE2 3.42Å; V187-Y490 VanDerWaalsContact CG1-CE2 3.42Å; S208-Y490 WeakPolarHBondContact CB-O 3.37Å; S208-Y490 PolarHBondContact OG-O 3.4Å; F209-Y490 WeakPolarHBondContact O-CD1 3.43Å; F209-Y490 WeakPolarHBondContact O-CE1 3.21Å; Q210-Y490 HydrophobicContact CB-CD1 4.17Å; L215-Y490 HydrophobicContact CB-CD1 4.47Å; L215-Y490 HydrophobicContact CB-CE1 3.77Å; L215-Y490 HydrophobicContact CB-CE2 4.2Å; L215-Y490 WeakPolarHBondContact CB-OH 3.09Å; L215-Y490 HydrophobicContact CD1-CD2 4.37Å; L215-Y490 HydrophobicContact CD1-CE2 4.04Å; L215-Y490 HydrophobicContact CD2-CD1 3.94Å; L215-Y490 HydrophobicContact CD2-CD2 4.27Å; L215-Y490 HydrophobicContact CD2-CE1 4.09Å; L215-Y490 HydrophobicContact CD2-CE2 4.4Å; L215-Y490 HydrophobicContact CD2-CG 4.01Å; L215-Y490 HydrophobicContact CG-CE1 4.46Å; L215-Y490 HydrophobicContact CG-CE2 4.47Å; Y216-Y490 WeakPolarHBondContact O-CE1 3.28Å; Y216-Y490 PolarHBondContact O-OH 3.04Å; L217-Y490 HydrophobicContact CD2-CE1 4.48Å; L217-Y490 HydrophobicContact CD2-CE2 4.26Å; L217-Y490 WeakPolarHBondContact CD2-OH 3.39Å; L217-Y490 WeakPolarHBondContact CG-OH 3.35Å; F487-Y490 WeakPolarHBondContact O-CB 3.29Å; F487-Y490 PolarHBondContact O-N 3.39Å; F487-Y490 VanDerWaalsContact O-N 3.08Å; I488-Y490 PolarHBondContact O-N 2.75Å
491	T	75.7	Confident	61.9	Low	76 Å²	76	46.9 Å²	46.9	47%	0.466	23%	0.231	S	C	.	.			trans	-72.2	125.9	-176.7	-55.1	0	0	0	0	113.2	S208 N489	S208-T491 CarbonylContact O-C 3.46Å; S208-T491 WeakPolarHBondContact O-CA 3.38Å; N489-T491 PolarHBondContact O-N 3.13Å; N489-T491 VanDerWaalsContact O-N 3.12Å
492	Y	75.2	Confident	61.4	Low	65 Å²	65	47 Å²	47	26%	0.255	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	149.8	177.7	171.8	-101.3	0	0	0	111.6	V195 M205 Y207 S208 A494	V195-Y492 HydrophobicContact CB-CE2 4.26Å; V195-Y492 HydrophobicContact CG1-CD2 4.02Å; V195-Y492 HydrophobicContact CG1-CE2 3.51Å; V195-Y492 HydrophobicContact CG2-CD1 3.75Å; V195-Y492 HydrophobicContact CG2-CD2 3.67Å; V195-Y492 HydrophobicContact CG2-CE1 3.87Å; V195-Y492 HydrophobicContact CG2-CE2 3.83Å; V195-Y492 HydrophobicContact CG2-CG 3.62Å; M205-Y492 HydrophobicContact CE-CD1 3.5Å; M205-Y492 VanDerWaalsContact CE-CD1 3.5Å; M205-Y492 HydrophobicContact CE-CE1 3.9Å; M205-Y492 HydrophobicContact CE-CG 4.23Å; Y207-Y492 WeakPolarHBondContact CA-O 3.24Å; S208-Y492 PolarHBondContact N-O 3.06Å; S208-Y492 PolarHBondContact O-N 3.33Å; S208-Y492 VanDerWaalsContact OG-CB 3.24Å; S208-Y492 WeakPolarHBondContact OG-CB 3.43Å; S208-Y492 PolarHBondContact OG-N 3.37Å; S208-Y492 VanDerWaalsContact OG-N 3.08Å; Y492-A494 HydrophobicContact CE1-CB 3.83Å
493	K	74.8	Confident	60.8	Low	17 Å²	17	48.2 Å²	48.2	7%	0.074	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	116.8	173.2	-61.3	-172.2	175.9	-166.6	0	110.1	L132 A135 Y207	L132-K493 HydrophobicContact CG-CD 4.14Å; L132-K493 PolarHBondContact O-NZ 3.48Å; A135-K493 WeakPolarHBondContact O-CE 3.37Å; A135-K493 PolarHBondContact O-NZ 3.29Å; Y207-K493 HydrophobicContact CD1-CB 4.24Å; Y207-K493 HydrophobicContact CD1-CG 4.16Å
494	A	73.1	Confident	60.1	Low	6 Å²	6	48.5 Å²	48.5	5%	0.05	24%	0.24	C	C	.	.			trans	-71.2	143.3	178.1	0	0	0	0	0	111.8	F206 Y492	F206-A494 WeakPolarHBondContact O-CB 3.5Å; F206-A494 PolarHBondContact O-N 3.06Å; Y492-A494 HydrophobicContact CE1-CB 3.83Å
495	F	64.1	Low	59.1	Low	37 Å²	37	47.4 Å²	47.4	16%	0.162	23%	0.234	C	C	.	.	S	Bend	trans	-66.3	-46.1	172.2	-171.6	-99	0	0	0	111.2	F129 G497 W498 T499	F129-F495 HydrophobicContact CB-CD2 3.89Å; F129-F495 HydrophobicContact CB-CE2 3.72Å; F129-F495 AromaticContact CD1-CD2 3.57Å; F129-F495 HydrophobicContact CD1-CD2 3.57Å; F129-F495 AromaticContact CD1-CE2 3.93Å; F129-F495 HydrophobicContact CD1-CE2 3.93Å; F129-F495 HydrophobicContact CD2-CB 4.34Å; F129-F495 AromaticContact CD2-CD2 3.47Å; F129-F495 HydrophobicContact CD2-CD2 3.47Å; F129-F495 VanDerWaalsContact CD2-CD2 3.47Å; F129-F495 HydrophobicContact CD2-CE2 4.2Å; F129-F495 HydrophobicContact CD2-CG 4.3Å; F129-F495 AromaticContact CE1-CD2 3.77Å; F129-F495 HydrophobicContact CE1-CD2 3.77Å; F129-F495 VanDerWaalsContact CE2-CA 3.5Å; F129-F495 HydrophobicContact CE2-CB 3.83Å; F129-F495 AromaticContact CE2-CD2 3.71Å; F129-F495 HydrophobicContact CE2-CD2 3.71Å; F129-F495 HydrophobicContact CE2-CG 4.25Å; F129-F495 AromaticContact CG-CD2 3.37Å; F129-F495 HydrophobicContact CG-CD2 3.37Å; F129-F495 AromaticContact CG-CE2 3.71Å; F129-F495 HydrophobicContact CG-CE2 3.71Å; F129-F495 HydrophobicContact CZ-CB 3.97Å; F129-F495 AromaticContact CZ-CD2 3.8Å; F129-F495 HydrophobicContact CZ-CD2 3.8Å; F129-F495 HydrophobicContact CZ-CG 4.41Å; F495-G497 VanDerWaalsContact C-N 3.27Å; F495-G497 PolarHBondContact O-N 3.24Å; F495-W498 PolarHBondContact O-N 3.08Å; F495-W498 VanDerWaalsContact O-N 3.08Å; F495-T499 HydrophobicContact CD1-CG2 3.79Å; F495-T499 HydrophobicContact CE1-CG2 3.38Å; F495-T499 HydrophobicContact CZ-CG2 3.78Å; F495-T499 PolarHBondContact O-N 3.06Å; F495-T499 PolarHBondContact O-OG1 3.25Å
496	D	60.5	Low	58.1	Low	44 Å²	44	50.6 Å²	50.6	24%	0.235	25%	0.252	C	S	.	.	H	α-helix	trans	-63	-28.2	179.6	-79	13.6	0	0	0	115	K204 W498 T499 N500	K204-D496 IonicContact NZ-OD2 3.33Å; K204-D496 PolarHBondContact NZ-OD2 3.28Å; D496-W498 PolarHBondContact O-N 2.78Å; D496-T499 WeakPolarHBondContact CA-OG1 3.14Å; D496-T499 PolarHBondContact O-N 3.44Å; D496-N500 PolarHBondContact O-N 3.27Å; D496-N500 VanDerWaalsContact O-N 3.14Å; D496-N500 PolarHBondContact OD2-ND2 3.33Å
497	G	55.6	Low	57.2	Low	4 Å²	4	58.2 Å²	58.2	4%	0.041	28%	0.276	C	S	.	.	H	α-helix	trans	-58	-16.1	174.6	0	0	0	0	0	113.2	Y207 F495	Y207-G497 PolarHBondContact OH-O 2.91Å; F495-G497 VanDerWaalsContact C-N 3.27Å; F495-G497 PolarHBondContact O-N 3.24Å
498	W	52.7	Low	56	Low	72 Å²	72	63.1 Å²	63.1	27%	0.273	30%	0.299	S	S	.	.	H	α-helix	trans	-111.3	-36.4	174.4	-173.5	72.6	0	0	0	113	K125 E128 L132 F495 D496	K125-W498 HydrophobicContact CB-CH2 4.16Å; K125-W498 HydrophobicContact CB-CZ3 3.69Å; K125-W498 HydrophobicContact CG-CH2 3.87Å; K125-W498 HydrophobicContact CG-CZ3 3.67Å; E128-W498 HydrophobicContact CB-CH2 3.79Å; E128-W498 HydrophobicContact CB-CZ2 3.81Å; E128-W498 HydrophobicContact CB-CZ3 4.39Å; E128-W498 HydrophobicContact CG-CH2 4.4Å; E128-W498 HydrophobicContact CG-CZ2 4.34Å; E128-W498 WeakPolarHBondContact OE2-CH2 3.36Å; E128-W498 WeakPolarHBondContact OE2-CZ2 3.48Å; L132-W498 HydrophobicContact CD2-CB 4.49Å; F495-W498 PolarHBondContact O-N 3.08Å; F495-W498 VanDerWaalsContact O-N 3.08Å; D496-W498 PolarHBondContact O-N 2.78Å
499	T	49.7	Very low	55.3	Low	25 Å²	25	65.2 Å²	65.2	15%	0.153	31%	0.31	C	S	.	.	H	α-helix	trans	-89.8	-25.4	-171.8	55.4	0	0	0	0	117.2	K125 F495 D496	K125-T499 HydrophobicContact CD-CG2 4.38Å; F495-T499 HydrophobicContact CD1-CG2 3.79Å; F495-T499 HydrophobicContact CE1-CG2 3.38Å; F495-T499 HydrophobicContact CZ-CG2 3.78Å; F495-T499 PolarHBondContact O-N 3.06Å; F495-T499 PolarHBondContact O-OG1 3.25Å; D496-T499 WeakPolarHBondContact CA-OG1 3.14Å; D496-T499 PolarHBondContact O-N 3.44Å
500	N	47.8	Very low	54.2	Low	84 Å²	84	70.6 Å²	70.6	45%	0.449	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-17	-167.9	-87	-19.3	0	0	0	115.3	D496 I504	D496-N500 PolarHBondContact O-N 3.27Å; D496-N500 VanDerWaalsContact O-N 3.14Å; D496-N500 PolarHBondContact OD2-ND2 3.33Å; N500-I504 WeakPolarHBondContact O-CD1 3.14Å
501	N	47.8	Very low	52.9	Low	33 Å²	33	75.8 Å²	75.8	18%	0.176	35%	0.353	C	S	.	.	H	α-helix	trans	-103.3	-15.5	-175.2	-77.3	-11.5	0	0	0	115.6	Y166 R503	Y166-N501 HydrophobicContact CE2-CB 3.67Å; Y166-N501 PolarHBondContact OH-ND2 3.4Å; Y166-N501 VanDerWaalsContact OH-ND2 3.12Å; N501-R503 PolarHBondContact O-N 3.39Å
502	D	41.2	Very low	51.7	Low	89 Å²	89	78.1 Å²	78.1	48%	0.476	36%	0.359	S	S	.	.	H	α-helix	trans	-69.1	-8.5	173.2	-86.7	-2.9	0	0	0	113.7
503	R	39.9	Very low	50.5	Low	176 Å²	176	80 Å²	80	66%	0.664	37%	0.37	S	S	*	.	H	α-helix	trans	-117	-23.3	178.7	-73.1	-174.8	170.2	-169.8	-2.6	114.8	N501 R507	N501-R503 PolarHBondContact O-N 3.39Å; R503-R507 VanDerWaalsContact O-CB 3.27Å; R503-R507 WeakPolarHBondContact O-CB 3.28Å; R503-R507 WeakPolarHBondContact O-CG 3.39Å; R503-R507 PolarHBondContact O-N 3.21Å
504	I	43.5	Very low	49.6	Very low	87 Å²	87	84.9 Å²	84.9	45%	0.446	39%	0.391	S	S	.	.	H	α-helix	trans	-81.7	-41.4	-178.8	-62.1	176	0	0	0	110.2	N500 R507 Q508	N500-I504 WeakPolarHBondContact O-CD1 3.14Å; I504-R507 PolarHBondContact O-N 3.19Å; I504-Q508 HydrophobicContact CG2-CG 4.49Å; I504-Q508 WeakPolarHBondContact O-CB 3.4Å; I504-Q508 VanDerWaalsContact O-CG 3.28Å; I504-Q508 WeakPolarHBondContact O-CG 3.27Å; I504-Q508 PolarHBondContact O-N 3.4Å
505	L	42	Very low	48.9	Very low	34 Å²	34	88 Å²	88	18%	0.178	41%	0.412	C	S	.	.	H	α-helix	trans	-73.6	-36.2	173.3	-100.2	128	0	0	0	112.6	Y166 I455 R507 Q508 L509	Y166-L505 HydrophobicContact CD2-CD1 4.13Å; Y166-L505 HydrophobicContact CE2-CD1 3.12Å; Y166-L505 HydrophobicContact CE2-CG 4.38Å; Y166-L505 WeakPolarHBondContact OH-CD1 3.44Å; I455-L505 HydrophobicContact CD1-CD2 4.44Å; I455-L505 HydrophobicContact CG2-CD2 4.38Å; L505-R507 VanDerWaalsContact C-N 3.31Å; L505-R507 PolarHBondContact O-N 2.57Å; L505-Q508 PolarHBondContact O-N 3.21Å; L505-L509 HydrophobicContact CD2-CD1 4.18Å; L505-L509 WeakPolarHBondContact O-CB 3.38Å; L505-L509 WeakPolarHBondContact O-CD1 3.27Å; L505-L509 VanDerWaalsContact O-CG 3.31Å; L505-L509 WeakPolarHBondContact O-CG 3.39Å; L505-L509 PolarHBondContact O-N 2.85Å
506	D	40	Very low	48.5	Very low	115 Å²	115	92.2 Å²	92.2	62%	0.615	43%	0.432	S	S	*	.	H	α-helix	trans	-61.2	-40.6	169.9	-109.2	2.8	0	0	0	111.4	Y510	D506-Y510 WeakPolarHBondContact O-CB 3.18Å; D506-Y510 PolarHBondContact O-N 3.14Å
507	R	44	Very low	48.3	Very low	178 Å²	178	98.8 Å²	98.8	67%	0.672	45%	0.454	S	S	*	.	H	α-helix	trans	-68	-40.4	173.4	-89.2	-173	-175.9	-160	1.7	113.4	R503 I504 L505 Q511	R503-R507 VanDerWaalsContact O-CB 3.27Å; R503-R507 WeakPolarHBondContact O-CB 3.28Å; R503-R507 WeakPolarHBondContact O-CG 3.39Å; R503-R507 PolarHBondContact O-N 3.21Å; I504-R507 PolarHBondContact O-N 3.19Å; L505-R507 VanDerWaalsContact C-N 3.31Å; L505-R507 PolarHBondContact O-N 2.57Å; R507-Q511 VanDerWaalsContact O-CB 3.23Å; R507-Q511 WeakPolarHBondContact O-CB 3.44Å; R507-Q511 WeakPolarHBondContact O-CG 3.35Å; R507-Q511 PolarHBondContact O-N 2.89Å
508	Q	45.9	Very low	48.4	Very low	105 Å²	105	104.5 Å²	104.5	49%	0.491	48%	0.479	S	S	.	.	H	α-helix	trans	-73.6	-40.5	-178.5	-75.7	177.4	-3.9	0	0	111.9	I504 L505 Q511 Q512	I504-Q508 HydrophobicContact CG2-CG 4.49Å; I504-Q508 WeakPolarHBondContact O-CB 3.4Å; I504-Q508 VanDerWaalsContact O-CG 3.28Å; I504-Q508 WeakPolarHBondContact O-CG 3.27Å; I504-Q508 PolarHBondContact O-N 3.4Å; L505-Q508 PolarHBondContact O-N 3.21Å; Q508-Q511 PolarHBondContact O-N 3.29Å; Q508-Q512 WeakPolarHBondContact O-CB 3.04Å; Q508-Q512 WeakPolarHBondContact O-CG 3.43Å; Q508-Q512 PolarHBondContact O-N 3.21Å
509	L	47.1	Very low	48.5	Very low	77 Å²	77	107.8 Å²	107.8	40%	0.403	50%	0.498	S	S	.	.	H	α-helix	trans	-64.4	-43.2	170.9	-75.4	161.9	0	0	0	110.7	L505 Q511 Q512 Q513	L505-L509 HydrophobicContact CD2-CD1 4.18Å; L505-L509 WeakPolarHBondContact O-CB 3.38Å; L505-L509 WeakPolarHBondContact O-CD1 3.27Å; L505-L509 VanDerWaalsContact O-CG 3.31Å; L505-L509 WeakPolarHBondContact O-CG 3.39Å; L505-L509 PolarHBondContact O-N 2.85Å; L509-Q511 PolarHBondContact O-N 3.2Å; L509-Q512 PolarHBondContact O-N 2.96Å; L509-Q513 VanDerWaalsContact O-CB 3.27Å; L509-Q513 WeakPolarHBondContact O-CB 3.32Å; L509-Q513 VanDerWaalsContact O-CG 3.24Å; L509-Q513 WeakPolarHBondContact O-CG 2.99Å; L509-Q513 PolarHBondContact O-N 3.26Å
510	Y	43.5	Very low	48.9	Very low	155 Å²	155	111 Å²	111	61%	0.608	52%	0.517	S	S	*	.	H	α-helix	trans	-63.4	-40.1	174.6	-173.7	-98.3	0	0	0	112	D506 K514	D506-Y510 WeakPolarHBondContact O-CB 3.18Å; D506-Y510 PolarHBondContact O-N 3.14Å; Y510-K514 HydrophobicContact CE1-CD 4.49Å; Y510-K514 WeakPolarHBondContact O-CB 2.97Å; Y510-K514 PolarHBondContact O-N 3.48Å
511	Q	47.6	Very low	49.4	Very low	113 Å²	113	109.3 Å²	109.3	53%	0.528	52%	0.515	S	S	.	.	H	α-helix	trans	-69.5	-42.2	176.2	-76.9	172.2	9.4	0	0	112.4	R507 Q508 L509 K514 S515	R507-Q511 VanDerWaalsContact O-CB 3.23Å; R507-Q511 WeakPolarHBondContact O-CB 3.44Å; R507-Q511 WeakPolarHBondContact O-CG 3.35Å; R507-Q511 PolarHBondContact O-N 2.89Å; Q508-Q511 PolarHBondContact O-N 3.29Å; L509-Q511 PolarHBondContact O-N 3.2Å; Q511-K514 PolarHBondContact O-N 3.44Å; Q511-S515 WeakPolarHBondContact O-CB 3.41Å; Q511-S515 PolarHBondContact O-N 3.24Å; Q511-S515 PolarHBondContact O-OG 3.18Å; Q511-S515 VanDerWaalsContact O-OG 3.1Å
512	Q	49.6	Very low	49.8	Very low	125 Å²	125	113.3 Å²	113.3	58%	0.584	54%	0.536	S	S	*	.	H	α-helix	trans	-66.3	-42.8	175.5	-79.7	-176.7	0.9	0	0	112.1	Q508 L509 K514 S515 Q516	Q508-Q512 WeakPolarHBondContact O-CB 3.04Å; Q508-Q512 WeakPolarHBondContact O-CG 3.43Å; Q508-Q512 PolarHBondContact O-N 3.21Å; L509-Q512 PolarHBondContact O-N 2.96Å; Q512-K514 VanDerWaalsContact C-N 3.31Å; Q512-K514 PolarHBondContact O-N 3.17Å; Q512-S515 PolarHBondContact O-N 3.37Å; Q512-Q516 WeakPolarHBondContact O-CB 3.29Å; Q512-Q516 WeakPolarHBondContact O-CG 3.44Å; Q512-Q516 PolarHBondContact O-N 3.03Å
513	Q	50.4	Low	50.5	Low	103 Å²	103	113 Å²	113	48%	0.481	54%	0.541	S	S	.	.	H	α-helix	trans	-64.2	-35.7	174.6	-73.9	179	24.4	0	0	111.8	L509 R517	L509-Q513 VanDerWaalsContact O-CB 3.27Å; L509-Q513 WeakPolarHBondContact O-CB 3.32Å; L509-Q513 VanDerWaalsContact O-CG 3.24Å; L509-Q513 WeakPolarHBondContact O-CG 2.99Å; L509-Q513 PolarHBondContact O-N 3.26Å; Q513-R517 WeakPolarHBondContact O-CB 3.45Å; Q513-R517 VanDerWaalsContact O-CG 3.27Å; Q513-R517 WeakPolarHBondContact O-CG 3.47Å; Q513-R517 PolarHBondContact O-N 2.97Å
514	K	56.5	Low	51.1	Low	120 Å²	120	107.4 Å²	107.4	52%	0.522	53%	0.529	S	S	.	.	H	α-helix	trans	-67.9	-41	175.1	-162.6	176.3	-176.1	-178.1	0	111.8	Y510 Q511 Q512 H518	Y510-K514 HydrophobicContact CE1-CD 4.49Å; Y510-K514 WeakPolarHBondContact O-CB 2.97Å; Y510-K514 PolarHBondContact O-N 3.48Å; Q511-K514 PolarHBondContact O-N 3.44Å; Q512-K514 VanDerWaalsContact C-N 3.31Å; Q512-K514 PolarHBondContact O-N 3.17Å; K514-H518 PolarHBondContact O-N 3.12Å
515	S	57.2	Low	51.7	Low	71 Å²	71	112.3 Å²	112.3	50%	0.497	54%	0.542	S	S	.	.	H	α-helix	trans	-67.1	-42.1	175.6	-65.4	0	0	0	0	112.8	Q511 Q512 H518 Q519	Q511-S515 WeakPolarHBondContact O-CB 3.41Å; Q511-S515 PolarHBondContact O-N 3.24Å; Q511-S515 PolarHBondContact O-OG 3.18Å; Q511-S515 VanDerWaalsContact O-OG 3.1Å; Q512-S515 PolarHBondContact O-N 3.37Å; S515-H518 PolarHBondContact O-N 3.12Å; S515-Q519 PolarHBondContact O-N 2.93Å
516	Q	56.3	Low	52.2	Low	126 Å²	126	114.6 Å²	114.6	59%	0.589	56%	0.56	S	S	*	*	H	α-helix	trans	-64.5	-44.5	174.9	-76.3	179.8	5.4	0	0	111.6	Q512 H518 Q519 T520	Q512-Q516 WeakPolarHBondContact O-CB 3.29Å; Q512-Q516 WeakPolarHBondContact O-CG 3.44Å; Q512-Q516 PolarHBondContact O-N 3.03Å; Q516-H518 VanDerWaalsContact C-N 3.32Å; Q516-H518 PolarHBondContact O-N 2.98Å; Q516-Q519 PolarHBondContact O-N 2.9Å; Q516-T520 PolarHBondContact O-N 3.44Å; Q516-T520 PolarHBondContact O-OG1 3.24Å
517	R	55.7	Low	52.7	Low	182 Å²	182	111.8 Å²	111.8	69%	0.687	55%	0.55	S	S	*	.	H	α-helix	trans	-60.6	-38.6	176	-77.6	179.1	176.8	-170.1	1.1	112.7	Q513 T520 A521	Q513-R517 WeakPolarHBondContact O-CB 3.45Å; Q513-R517 VanDerWaalsContact O-CG 3.27Å; Q513-R517 WeakPolarHBondContact O-CG 3.47Å; Q513-R517 PolarHBondContact O-N 2.97Å; R517-T520 WeakPolarHBondContact CA-OG1 3.41Å; R517-T520 PolarHBondContact O-OG1 3.2Å; R517-A521 VanDerWaalsContact O-CB 3.29Å; R517-A521 WeakPolarHBondContact O-CB 3.41Å; R517-A521 PolarHBondContact O-N 2.68Å
518	H	57.9	Low	53.1	Low	124 Å²	124	109.4 Å²	109.4	57%	0.574	55%	0.548	S	S	*	.	H	α-helix	trans	-66.8	-40.9	173.9	-91.7	18.7	0	0	0	112.8	K514 S515 Q516 A521 L522	K514-H518 PolarHBondContact O-N 3.12Å; S515-H518 PolarHBondContact O-N 3.12Å; Q516-H518 VanDerWaalsContact C-N 3.32Å; Q516-H518 PolarHBondContact O-N 2.98Å; H518-A521 PolarHBondContact O-N 3.25Å; H518-L522 WeakPolarHBondContact O-CB 3.23Å; H518-L522 WeakPolarHBondContact O-CD1 3.47Å; H518-L522 VanDerWaalsContact O-CG 3.29Å; H518-L522 WeakPolarHBondContact O-CG 3.46Å; H518-L522 PolarHBondContact O-N 3.02Å
519	Q	55.2	Low	53.4	Low	141 Å²	141	108.7 Å²	108.7	66%	0.659	55%	0.55	S	S	*	*	H	α-helix	trans	-66.5	-42.3	176.3	-75.8	179.1	6	0	0	112.5	S515 Q516 A521 L522 S523	S515-Q519 PolarHBondContact O-N 2.93Å; Q516-Q519 PolarHBondContact O-N 2.9Å; Q519-A521 PolarHBondContact O-N 2.88Å; Q519-L522 PolarHBondContact O-N 3.44Å; Q519-S523 WeakPolarHBondContact O-CB 3.43Å; Q519-S523 PolarHBondContact O-N 2.95Å
520	T	57.5	Low	53.5	Low	92 Å²	92	108 Å²	108	56%	0.564	55%	0.552	S	S	*	*	H	α-helix	trans	-64.5	-37.4	174.4	39.1	0	0	0	0	112.5	Q516 R517 S523 S524	Q516-T520 PolarHBondContact O-N 3.44Å; Q516-T520 PolarHBondContact O-OG1 3.24Å; R517-T520 WeakPolarHBondContact CA-OG1 3.41Å; R517-T520 PolarHBondContact O-OG1 3.2Å; T520-S523 PolarHBondContact O-N 3Å; T520-S524 WeakPolarHBondContact O-CB 3.36Å; T520-S524 PolarHBondContact O-N 3.26Å; T520-S524 PolarHBondContact O-OG 3.37Å; T520-S524 VanDerWaalsContact O-OG 3.06Å
521	A	58.1	Low	53.7	Low	49 Å²	49	105.5 Å²	105.5	41%	0.405	55%	0.549	S	S	.	.	H	α-helix	trans	-70.4	-32	178	0	0	0	0	0	113.2	R517 H518 Q519 S524 R525	R517-A521 VanDerWaalsContact O-CB 3.29Å; R517-A521 WeakPolarHBondContact O-CB 3.41Å; R517-A521 PolarHBondContact O-N 2.68Å; H518-A521 PolarHBondContact O-N 3.25Å; Q519-A521 PolarHBondContact O-N 2.88Å; A521-S524 WeakPolarHBondContact CA-OG 3.42Å; A521-S524 PolarHBondContact O-OG 2.68Å; A521-S524 VanDerWaalsContact O-OG 3.12Å; A521-R525 WeakPolarHBondContact O-CB 3.4Å; A521-R525 PolarHBondContact O-N 2.76Å
522	L	57.4	Low	53.7	Low	118 Å²	118	106.4 Å²	106.4	62%	0.618	56%	0.557	S	S	*	*	H	α-helix	trans	-74.1	-39.6	174.3	-73.9	164.2	0	0	0	111.5	H518 Q519 R525 S526	H518-L522 WeakPolarHBondContact O-CB 3.23Å; H518-L522 WeakPolarHBondContact O-CD1 3.47Å; H518-L522 VanDerWaalsContact O-CG 3.29Å; H518-L522 WeakPolarHBondContact O-CG 3.46Å; H518-L522 PolarHBondContact O-N 3.02Å; Q519-L522 PolarHBondContact O-N 3.44Å; L522-R525 PolarHBondContact O-N 2.95Å; L522-S526 WeakPolarHBondContact O-CB 3.46Å; L522-S526 PolarHBondContact O-N 2.63Å
523	S	54.9	Low	53.7	Low	83 Å²	83	105 Å²	105	58%	0.58	56%	0.557	S	S	*	*	H	α-helix	trans	-64.6	-43.9	174.9	172.8	0	0	0	0	112.2	Q519 T520 R525 S526 S527	Q519-S523 WeakPolarHBondContact O-CB 3.43Å; Q519-S523 PolarHBondContact O-N 2.95Å; T520-S523 PolarHBondContact O-N 3Å; S523-R525 VanDerWaalsContact C-N 3.35Å; S523-R525 PolarHBondContact O-N 2.78Å; S523-S526 PolarHBondContact O-N 3.11Å; S523-S527 PolarHBondContact O-N 3.43Å
524	S	54	Low	53.3	Low	57 Å²	57	103 Å²	103	40%	0.399	56%	0.564	S	S	.	*	H	α-helix	trans	-69.7	-29.7	177.4	61.3	0	0	0	0	113.3	T520 A521 S527 M528	T520-S524 WeakPolarHBondContact O-CB 3.36Å; T520-S524 PolarHBondContact O-N 3.26Å; T520-S524 PolarHBondContact O-OG 3.37Å; T520-S524 VanDerWaalsContact O-OG 3.06Å; A521-S524 WeakPolarHBondContact CA-OG 3.42Å; A521-S524 PolarHBondContact O-OG 2.68Å; A521-S524 VanDerWaalsContact O-OG 3.12Å; S524-S527 PolarHBondContact O-OG 3.02Å; S524-S527 VanDerWaalsContact O-OG 3.12Å; S524-M528 WeakPolarHBondContact O-CG 3.35Å; S524-M528 PolarHBondContact O-N 2.86Å
525	R	54.3	Low	52.7	Low	191 Å²	191	104.1 Å²	104.1	72%	0.721	57%	0.574	S	S	*	*	H	α-helix	trans	-72.3	-38.8	170.9	-96.8	-179.7	158.5	-179.5	-5.6	111.8	A521 L522 S523 V529	A521-R525 WeakPolarHBondContact O-CB 3.4Å; A521-R525 PolarHBondContact O-N 2.76Å; L522-R525 PolarHBondContact O-N 2.95Å; S523-R525 VanDerWaalsContact C-N 3.35Å; S523-R525 PolarHBondContact O-N 2.78Å; R525-V529 WeakPolarHBondContact O-CB 3.2Å; R525-V529 WeakPolarHBondContact O-CG2 3.28Å; R525-V529 PolarHBondContact O-N 3.19Å
526	S	53.2	Low	52.1	Low	82 Å²	82	109.5 Å²	109.5	57%	0.573	59%	0.589	S	S	*	*	H	α-helix	trans	-67	-36.8	177.1	-165.6	0	0	0	0	112	L522 S523 S530	L522-S526 WeakPolarHBondContact O-CB 3.46Å; L522-S526 PolarHBondContact O-N 2.63Å; S523-S526 PolarHBondContact O-N 3.11Å; S526-S530 PolarHBondContact O-N 3.01Å; S526-S530 PolarHBondContact O-OG 3.08Å; S526-S530 VanDerWaalsContact O-OG 3.11Å
527	S	50.5	Low	51.5	Low	56 Å²	56	110.5 Å²	110.5	39%	0.392	60%	0.598	S	S	.	*	H	α-helix	trans	-71.2	-39.5	176.5	70.5	0	0	0	0	112.5	S523 S524 V529 S530 D531	S523-S527 PolarHBondContact O-N 3.43Å; S524-S527 PolarHBondContact O-OG 3.02Å; S524-S527 VanDerWaalsContact O-OG 3.12Å; S527-V529 PolarHBondContact O-N 3.42Å; S527-S530 WeakPolarHBondContact CA-OG 3.18Å; S527-S530 PolarHBondContact O-N 3.05Å; S527-S530 PolarHBondContact O-OG 3.47Å; S527-D531 WeakPolarHBondContact O-CB 3.46Å; S527-D531 VanDerWaalsContact O-CG 3.23Å; S527-D531 PolarHBondContact O-N 3.49Å
528	M	52	Low	50.8	Low	128 Å²	128	109.6 Å²	109.6	63%	0.631	61%	0.607	S	S	*	*	H	α-helix	trans	-66.2	-36	174.2	-79.1	-172.8	-176.7	0	0	112.6	S524 L532	S524-M528 WeakPolarHBondContact O-CG 3.35Å; S524-M528 PolarHBondContact O-N 2.86Å; M528-L532 WeakPolarHBondContact O-CB 3.48Å; M528-L532 WeakPolarHBondContact O-CD1 3.37Å; M528-L532 WeakPolarHBondContact O-CG 3.33Å; M528-L532 PolarHBondContact O-N 3.11Å
529	V	52.4	Low	49.9	Very low	89 Å²	89	109.4 Å²	109.4	54%	0.539	62%	0.619	S	S	.	*	H	α-helix	trans	-72.1	-37.1	177.8	175.2	0	0	0	0	110.9	R525 S527 L532 T533	R525-V529 WeakPolarHBondContact O-CB 3.2Å; R525-V529 WeakPolarHBondContact O-CG2 3.28Å; R525-V529 PolarHBondContact O-N 3.19Å; S527-V529 PolarHBondContact O-N 3.42Å; V529-L532 PolarHBondContact O-N 3.06Å; V529-T533 WeakPolarHBondContact O-CG2 3.36Å; V529-T533 PolarHBondContact O-N 3.49Å; V529-T533 VanDerWaalsContact O-N 3.08Å; V529-T533 PolarHBondContact O-OG1 3.03Å
530	S	48.9	Very low	49	Very low	62 Å²	62	108.1 Å²	108.1	43%	0.434	63%	0.626	S	S	.	*	H	α-helix	trans	-66.8	-37.9	173.6	53.1	0	0	0	0	112.9	S526 S527 T533 G534	S526-S530 PolarHBondContact O-N 3.01Å; S526-S530 PolarHBondContact O-OG 3.08Å; S526-S530 VanDerWaalsContact O-OG 3.11Å; S527-S530 WeakPolarHBondContact CA-OG 3.18Å; S527-S530 PolarHBondContact O-N 3.05Å; S527-S530 PolarHBondContact O-OG 3.47Å; S530-T533 WeakPolarHBondContact CA-OG1 3.45Å; S530-T533 PolarHBondContact O-N 3.09Å; S530-T533 PolarHBondContact O-OG1 3.41Å; S530-T533 VanDerWaalsContact O-OG1 3.09Å; S530-G534 PolarHBondContact O-N 2.99Å
531	D	48.7	Very low	48	Very low	104 Å²	104	114.4 Å²	114.4	56%	0.556	67%	0.665	S	S	*	*	H	α-helix	trans	-71	-33.4	177.8	-70	-19.3	0	0	0	112.2	S527 I535	S527-D531 WeakPolarHBondContact O-CB 3.46Å; S527-D531 VanDerWaalsContact O-CG 3.23Å; S527-D531 PolarHBondContact O-N 3.49Å; D531-I535 VanDerWaalsContact O-CD1 3.3Å; D531-I535 WeakPolarHBondContact O-CD1 3.31Å; D531-I535 VanDerWaalsContact O-CG1 3.31Å; D531-I535 WeakPolarHBondContact O-CG1 3.3Å
532	L	47.6	Very low	47.5	Very low	131 Å²	131	117.7 Å²	117.7	69%	0.686	68%	0.678	S	S	*	*	H	α-helix	trans	-75.8	-25.6	175.2	-77.7	161	0	0	0	113.4	M528 V529	M528-L532 WeakPolarHBondContact O-CB 3.48Å; M528-L532 WeakPolarHBondContact O-CD1 3.37Å; M528-L532 WeakPolarHBondContact O-CG 3.33Å; M528-L532 PolarHBondContact O-N 3.11Å; V529-L532 PolarHBondContact O-N 3.06Å
533	T	48.5	Very low	47	Very low	97 Å²	97	117.7 Å²	117.7	60%	0.595	68%	0.681	S	S	*	*	H	α-helix	trans	-87.3	-18.4	174.9	54.7	0	0	0	0	113.8	V529 S530	V529-T533 WeakPolarHBondContact O-CG2 3.36Å; V529-T533 PolarHBondContact O-N 3.49Å; V529-T533 VanDerWaalsContact O-N 3.08Å; V529-T533 PolarHBondContact O-OG1 3.03Å; S530-T533 WeakPolarHBondContact CA-OG1 3.45Å; S530-T533 PolarHBondContact O-N 3.09Å; S530-T533 PolarHBondContact O-OG1 3.41Å; S530-T533 VanDerWaalsContact O-OG1 3.09Å
534	G	41.8	Very low	46.5	Very low	61 Å²	61	119.6 Å²	119.6	63%	0.629	69%	0.686	S	S	*	*	H	α-helix	trans	-84.5	-15.2	179.2	0	0	0	0	0	115.4	S530	S530-G534 PolarHBondContact O-N 2.99Å
535	I	44.6	Very low	46.1	Very low	142 Å²	142	123.3 Å²	123.3	73%	0.728	70%	0.703	S	S	*	*	S	Bend	trans	-92.1	-5.1	-173.4	-66.4	170.8	0	0	0	113.1	D531	D531-I535 VanDerWaalsContact O-CD1 3.3Å; D531-I535 WeakPolarHBondContact O-CD1 3.31Å; D531-I535 VanDerWaalsContact O-CG1 3.31Å; D531-I535 WeakPolarHBondContact O-CG1 3.3Å
536	K	44.5	Very low	45.6	Very low	185 Å²	185	119.1 Å²	119.1	80%	0.804	70%	0.702	S	S	*	*	S	Bend	trans	-98.1	5.5	-174.7	-83.7	-171	175.2	-176.9	0	117.4
537	N	44.6	Very low	45.1	Very low	146 Å²	146	121.5 Å²	121.5	78%	0.781	71%	0.711	S	S	*	*	S	Bend	trans	-117.6	12.8	-174.5	-78.9	-7.2	0	0	0	116.3
538	N	40.1	Very low	44.7	Very low	163 Å²	163	126.2 Å²	126.2	87%	0.872	73%	0.734	S	S	*	*			trans	-134.3	74.5	178.2	-87	-16.3	0	0	0	112.2
539	S	39.6	Very low	44.1	Very low	120 Å²	120	126.1 Å²	126.1	84%	0.839	74%	0.742	S	S	*	*			trans	-170.9	108.5	151.5	55.6	0	0	0	0	110.3
540	S	36.7	Very low	43.4	Very low	115 Å²	115	129.2 Å²	129.2	80%	0.804	76%	0.759	S	S	*	*			trans	-74.9	129.6	174.2	39.6	0	0	0	0	113.6
541	T	35.3	Very low	42.9	Very low	224 Å²	224	135.3 Å²	135.3	100%	1.374	79%	0.788	S	S	*	*			trans	172.3	0	135.6	32.7	0	0	0	0	109.4

Retrieved 541 of 541 residues in 268.3 ms (Link to these results)

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