G4VLR8_SCHMA Loading...

Iron-sulfur clusters transporter ABCB7, mitochondrial

AlphaFold DB , UniProt , Accession G4VLR8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 745 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	33.6	Very low	31.6	Very low	239 Å²	239	144.7 Å²	144.7	100%	1.177	85%	0.845	S	S	*	*				0	123.6	0	-84.8	173.3	156.6	0	0	108.3
2	I	34.9	Very low	31.1	Very low	166 Å²	166	143.6 Å²	143.6	85%	0.851	84%	0.841	S	S	*	*			trans	67.6	76.7	174.4	-39.8	177.4	0	0	0	114.9
3	S	28.5	Very low	31	Very low	123 Å²	123	144.9 Å²	144.9	86%	0.86	83%	0.834	S	S	*	*				60.2	114	74.7	169.6	0	0	0	0	115.3
4	G	36.4	Very low	30.7	Very low	74 Å²	74	148.4 Å²	148.4	76%	0.763	83%	0.834	S	S	*	*			trans	155.9	74.5	157.2	0	0	0	0	0	116.7
5	T	29.4	Very low	30.4	Very low	137 Å²	137	145.3 Å²	145.3	84%	0.84	83%	0.825	S	S	*	*			trans	-82.5	156	154	36.6	0	0	0	0	110.4
6	P	39.1	Very low	30.1	Very low	126 Å²	126	145.2 Å²	145.2	82%	0.818	82%	0.819	S	S	*	*				-135.6	151.8	113.3	33	-19.5	0	0	0	114.7
7	K	28.7	Very low	30	Very low	193 Å²	193	146.1 Å²	146.1	84%	0.839	81%	0.812	S	S	*	*			trans	-58.2	140.2	172.4	-69.5	168.4	172.3	174.6	0	111.8
8	I	33.4	Very low	29.6	Very low	173 Å²	173	151.4 Å²	151.4	89%	0.887	82%	0.818	S	S	*	*			trans	-132.2	129.6	145	-63.8	-177.5	0	0	0	108.6
9	L	28.6	Very low	29.5	Very low	147 Å²	147	148.1 Å²	148.1	77%	0.77	81%	0.808	S	S	*	*			trans	-63.9	153.4	-174.7	-90.2	84.7	0	0	0	114.9
10	A	26.4	Very low	29.2	Very low	80 Å²	80	148 Å²	148	66%	0.661	81%	0.812	S	S	*	*			trans	42.4	122.4	134.3	0	0	0	0	0	117.9
11	T	29.1	Very low	29.1	Very low	134 Å²	134	146.2 Å²	146.2	82%	0.822	81%	0.81	S	S	*	*				-167.9	145.1	69.2	7.4	0	0	0	0	110.5
12	T	25	Very low	28.7	Very low	131 Å²	131	143 Å²	143	80%	0.804	79%	0.79	S	S	*	*			trans	-54.5	121.8	175.7	35.9	0	0	0	0	114.6
13	H	30.1	Very low	28.3	Very low	161 Å²	161	140.4 Å²	140.4	75%	0.745	79%	0.786	S	S	*	*			trans	-122.7	91.6	150.7	-104.5	-80.7	0	0	0	108.9	C15	H13-C15 VanDerWaalsContact C-N 3.3Å; H13-C15 PolarHBondContact O-N 3.48Å
14	K	26.1	Very low	28.2	Very low	194 Å²	194	142.1 Å²	142.1	84%	0.843	78%	0.781	S	S	*	*			trans	-69.5	91.2	159.3	-95.9	179.2	174.6	175.1	0	107.2	I16	K14-I16 PolarHBondContact O-N 3.37Å
15	C	27.1	Very low	27.8	Very low	102 Å²	102	144.2 Å²	144.2	69%	0.689	77%	0.774	S	S	*	*			trans	-88.6	96.6	162.1	-134.4	0	0	0	0	107.5	H13 F17	H13-C15 VanDerWaalsContact C-N 3.3Å; H13-C15 PolarHBondContact O-N 3.48Å; C15-F17 VanDerWaalsContact C-N 3.31Å; C15-F17 PolarHBondContact O-N 3.05Å
16	I	25.2	Very low	27.6	Very low	143 Å²	143	146.4 Å²	146.4	73%	0.733	78%	0.779	S	S	*	*			trans	-70.5	91.3	168.4	-64.2	171.4	0	0	0	106.6	K14 R18	K14-I16 PolarHBondContact O-N 3.37Å; I16-R18 HydrophobicContact CG2-CB 4.3Å
17	F	27.6	Very low	27.1	Very low	161 Å²	161	144.6 Å²	144.6	71%	0.706	78%	0.775	S	S	*	*			trans	-98.5	85.5	158	-109.7	-85.5	0	0	0	107.6	C15 S19	C15-F17 VanDerWaalsContact C-N 3.31Å; C15-F17 PolarHBondContact O-N 3.05Å; F17-S19 PolarHBondContact O-N 3.35Å
18	R	22.9	Very low	26.9	Very low	241 Å²	241	141.3 Å²	141.3	91%	0.909	78%	0.777	S	S	*	*			trans	-85.2	90	164.5	-147.3	-179.7	-168.5	-173.3	2.6	105.9	I16	I16-R18 HydrophobicContact CG2-CB 4.3Å
19	S	27.7	Very low	26.6	Very low	89 Å²	89	142.2 Å²	142.2	62%	0.622	77%	0.774	S	S	*	*			trans	-122.2	99	164.8	69.4	0	0	0	0	109.3	F17 S21	F17-S19 PolarHBondContact O-N 3.35Å; S19-S21 PolarHBondContact O-N 3.4Å
20	T	24.2	Very low	26.4	Very low	145 Å²	145	140.2 Å²	140.2	89%	0.89	77%	0.773	S	S	*	*			trans	-41.3	113.1	150.1	28.2	0	0	0	0	111.4
21	S	27.8	Very low	26.6	Very low	111 Å²	111	141.4 Å²	141.4	78%	0.776	77%	0.771	S	S	*	*			trans	-156.4	91	152.5	179.7	0	0	0	0	109.6	S19	S19-S21 PolarHBondContact O-N 3.4Å
22	F	25.5	Very low	26.6	Very low	171 Å²	171	145.9 Å²	145.9	75%	0.75	78%	0.775	S	S	*	*			trans	-8.6	132.7	144.4	-124.9	-110.4	0	0	0	117	Q24	F22-Q24 HydrophobicContact CE1-CG 4.5Å
23	S	26.2	Very low	26.7	Very low	112 Å²	112	142.5 Å²	142.5	78%	0.783	77%	0.766	S	S	*	*			trans	167.6	79.7	140.5	-71.9	0	0	0	0	108.7
24	Q	26.6	Very low	26.5	Very low	160 Å²	160	141.1 Å²	141.1	75%	0.748	77%	0.769	S	S	*	*				41.8	96.7	106	-75.2	-172.4	-18	0	0	114.2	F22	F22-Q24 HydrophobicContact CE1-CG 4.5Å
25	L	26.4	Very low	26.5	Very low	117 Å²	117	139.5 Å²	139.5	61%	0.613	77%	0.768	S	S	*	*			trans	-178.4	42.6	146.1	-104.7	153	0	0	0	114.3	F417	L25-F417 HydrophobicContact CD2-CD1 4.13Å; L25-F417 HydrophobicContact CD2-CE1 3.55Å
26	L	26.6	Very low	26.6	Very low	183 Å²	183	139.4 Å²	139.4	96%	0.958	77%	0.768	S	S	*	*			trans	-151.4	76	163.9	-77.5	-179.3	0	0	0	109.7
27	A	27	Very low	26.6	Very low	88 Å²	88	137.2 Å²	137.2	73%	0.727	77%	0.766	S	S	*	*			trans	-154.1	86	161.6	0	0	0	0	0	109	K29	A27-K29 PolarHBondContact O-N 3.43Å
28	S	25.1	Very low	26.6	Very low	125 Å²	125	138.1 Å²	138.1	87%	0.874	77%	0.77	S	S	*	*			trans	-62.9	90	149.2	58.5	0	0	0	0	107.6
29	K	27.5	Very low	26.9	Very low	192 Å²	192	137.1 Å²	137.1	84%	0.835	77%	0.772	S	S	*	*			trans	-126.2	83.7	158.8	-84.4	-167.4	175	-172.9	0	107.9	A27	A27-K29 PolarHBondContact O-N 3.43Å
30	S	25.1	Very low	27.1	Very low	105 Å²	105	140.1 Å²	140.1	73%	0.734	78%	0.776	S	S	*	*			trans	-64.1	148.4	140.2	-179.4	0	0	0	0	107.5
31	V	29.1	Very low	27.4	Very low	104 Å²	104	141.9 Å²	141.9	63%	0.63	77%	0.768	S	S	*	*			trans	99.7	116.6	159.3	-172.2	0	0	0	0	118
32	Y	30	Very low	27.7	Very low	228 Å²	228	143.3 Å²	143.3	89%	0.894	77%	0.772	S	S	*	*			trans	63.2	131.8	169	-61	-64.2	0	0	0	117.4
33	G	27.6	Very low	28	Very low	60 Å²	60	141.3 Å²	141.3	62%	0.619	77%	0.769	S	S	*	*			cis	123.3	106.9	28.1	0	0	0	0	0	108.2
34	V	25.3	Very low	28.3	Very low	133 Å²	133	139.7 Å²	139.7	81%	0.806	77%	0.77	S	S	*	*			trans	70.2	135.4	144.5	-179	0	0	0	0	120.1
35	L	26	Very low	28.4	Very low	160 Å²	160	143.7 Å²	143.7	84%	0.838	78%	0.778	S	S	*	*			trans	97.5	122.6	150.3	-85.4	157.1	0	0	0	122.5
36	S	28.4	Very low	28.8	Very low	99 Å²	99	147.4 Å²	147.4	69%	0.692	79%	0.792	S	S	*	*			trans	88.3	100.1	140.2	-160.8	0	0	0	0	117.1
37	S	25.5	Very low	29	Very low	98 Å²	98	147.7 Å²	147.7	69%	0.685	79%	0.786	S	S	*	*				88.9	127.6	66.1	87.4	0	0	0	0	114.7
38	K	29.2	Very low	29	Very low	179 Å²	179	150 Å²	150	78%	0.778	79%	0.785	S	S	*	*			trans	125.1	95.3	152.7	-74.4	-177.2	174.4	-179.2	0	114.8
39	F	29.2	Very low	29.3	Very low	221 Å²	221	153.1 Å²	153.1	97%	0.969	79%	0.785	S	S	*	*			trans	-131.2	119.6	136.9	-106.1	-84.6	0	0	0	108.4
40	H	31.4	Very low	29.4	Very low	152 Å²	152	148.4 Å²	148.4	70%	0.704	78%	0.776	S	S	*	*			trans	-82.4	138.6	178.2	-106.3	-66.7	0	0	0	110.4
41	Y	29.5	Very low	29.7	Very low	181 Å²	181	155.2 Å²	155.2	71%	0.71	79%	0.786	S	S	*	*			trans	43.5	132.5	135.9	-91.7	-108.1	0	0	0	118.6
42	V	34.5	Very low	29.9	Very low	142 Å²	142	155.5 Å²	155.5	86%	0.861	79%	0.79	S	S	*	*				-150.4	143.1	74.4	166.9	0	0	0	0	112.4
43	N	31	Very low	30.1	Very low	128 Å²	128	152.8 Å²	152.8	68%	0.684	79%	0.791	S	S	*	*			trans	-54.2	147.4	-179.7	-79.1	-45.1	0	0	0	117.4
44	G	34	Very low	30.4	Very low	78 Å²	78	153.7 Å²	153.7	80%	0.804	80%	0.8	S	S	*	*			trans	-169.9	91	156.8	0	0	0	0	0	111.8
45	R	28.3	Very low	30.8	Very low	244 Å²	244	155.7 Å²	155.7	92%	0.921	81%	0.806	S	S	*	*			trans	-69.3	134.8	177.4	-71.3	174.5	176.6	172.1	-1.7	111.3
46	Q	34.1	Very low	30.9	Very low	196 Å²	196	155.9 Å²	155.9	92%	0.916	81%	0.806	S	S	*	*			trans	-157.8	152.8	133.6	-112	-176.5	6.4	0	0	113.2
47	K	31.7	Very low	30.8	Very low	188 Å²	188	159.9 Å²	159.9	82%	0.817	81%	0.814	S	S	*	*			trans	-81.8	135.9	-156.5	-73.3	167.9	168.9	177	0	113.1
48	I	27.7	Very low	30.9	Very low	138 Å²	138	165.2 Å²	165.2	71%	0.708	83%	0.825	S	S	*	*				48.4	112.1	110.8	-50.6	167.6	0	0	0	115.4
49	H	30.2	Very low	30.8	Very low	189 Å²	189	167.9 Å²	167.9	88%	0.875	83%	0.83	S	S	*	*				-157.4	119.4	123.5	-112	-69.2	0	0	0	111.8
50	S	30.6	Very low	31	Very low	94 Å²	94	162.7 Å²	162.7	66%	0.657	82%	0.819	S	S	*	*			trans	-84.8	144.8	172.2	45.5	0	0	0	0	111.5
51	R	30.3	Very low	30.8	Very low	248 Å²	248	162.7 Å²	162.7	94%	0.936	83%	0.83	S	S	*	*			trans	-149.9	120.5	148.1	-84.9	-165.2	174.4	-179.6	-1.3	109.4
52	P	33.3	Very low	30.8	Very low	109 Å²	109	157.8 Å²	157.8	71%	0.708	83%	0.834	S	S	*	*			trans	-101.6	149.7	160.7	35.7	-25.9	0	0	0	110.4
53	N	34.8	Very low	30.4	Very low	171 Å²	171	157.5 Å²	157.5	91%	0.914	83%	0.832	S	S	*	*			trans	149.3	127.7	148.3	-79.1	-14.7	0	0	0	110.6
54	G	33.9	Very low	30.4	Very low	80 Å²	80	159 Å²	159	83%	0.825	84%	0.839	S	S	*	*			trans	164.2	89.6	169.2	0	0	0	0	0	112.3
55	L	33.1	Very low	29.9	Very low	175 Å²	175	162.4 Å²	162.4	92%	0.916	84%	0.84	S	S	*	*			trans	-51.9	147.7	177.9	-105	86	0	0	0	114.3
56	L	27.8	Very low	30.1	Very low	163 Å²	163	157.7 Å²	157.7	85%	0.853	83%	0.832	S	S	*	*			trans	-48.5	131.5	163.3	-78.2	140.8	0	0	0	113.7
57	H	26.6	Very low	29.7	Very low	184 Å²	184	159.5 Å²	159.5	85%	0.852	83%	0.83	S	S	*	*			trans	-168	127.8	139	-106.4	-75.6	0	0	0	107.7
58	F	28.5	Very low	29.4	Very low	209 Å²	209	158.1 Å²	158.1	92%	0.917	83%	0.831	S	S	*	*			trans	-176.4	128.9	134.9	-110	-79.7	0	0	0	111
59	R	26.2	Very low	29.4	Very low	235 Å²	235	160.8 Å²	160.8	89%	0.887	84%	0.84	S	S	*	*			trans	-83.9	160.3	167	-96.5	-176.5	167.4	-177.1	-2.9	110.1
60	P	33	Very low	29.2	Very low	112 Å²	112	160.3 Å²	160.3	73%	0.727	84%	0.838	S	S	*	*			trans	-96.3	154.5	-162.2	37.5	-33	0	0	0	114
61	T	27.2	Very low	29	Very low	152 Å²	152	161.3 Å²	161.3	93%	0.933	85%	0.845	S	S	*	*			trans	166.2	135.5	137.9	30.5	0	0	0	0	109.3
62	G	30	Very low	28.9	Very low	78 Å²	78	158.5 Å²	158.5	80%	0.804	84%	0.842	S	S	*	*			trans	166.8	98.4	175.3	0	0	0	0	0	113
63	V	27.1	Very low	28.5	Very low	136 Å²	136	157 Å²	157	82%	0.824	85%	0.846	S	S	*	*			trans	-71.7	130.8	169.9	179	0	0	0	0	108.5
64	L	30.5	Very low	28.2	Very low	159 Å²	159	153.4 Å²	153.4	83%	0.832	84%	0.835	S	S	*	*			trans	-148.8	123.4	162	-137.8	93.2	0	0	0	111.6	L66	L64-L66 HydrophobicContact CD2-CD1 4.11Å
65	N	23.6	Very low	28	Very low	151 Å²	151	154.9 Å²	154.9	81%	0.807	82%	0.823	S	S	*	*			trans	-69.6	136.8	166.4	-79.6	-41.4	0	0	0	110.1
66	L	31.5	Very low	28	Very low	145 Å²	145	152.4 Å²	152.4	76%	0.759	81%	0.811	S	S	*	*			trans	-160.3	122.7	149.6	-110.4	133.7	0	0	0	114.3	L64	L64-L66 HydrophobicContact CD2-CD1 4.11Å
67	R	26.8	Very low	28.1	Very low	234 Å²	234	151 Å²	151	88%	0.883	80%	0.804	S	S	*	*			trans	19.5	133.1	151.5	-72.5	175.3	172.9	166.7	-1.5	121.6
68	L	24.7	Very low	28.3	Very low	159 Å²	159	148 Å²	148	83%	0.832	80%	0.799	S	S	*	*			trans	-44.9	124.8	161	-73.1	142.1	0	0	0	113.8
69	Q	28.2	Very low	28.3	Very low	193 Å²	193	142 Å²	142	90%	0.902	78%	0.783	S	S	*	*			trans	-121.6	123.4	148.7	-94.9	-179.4	-23.1	0	0	108	S71	Q69-S71 PolarHBondContact O-N 3.39Å
70	H	25.3	Very low	28.8	Very low	179 Å²	179	133.4 Å²	133.4	83%	0.829	75%	0.754	S	S	*	*			trans	-69.2	114.3	172.1	-82.7	-83.2	0	0	0	109.5
71	S	27.2	Very low	28.6	Very low	116 Å²	116	132 Å²	132	81%	0.811	75%	0.745	S	S	*	*			trans	-123.4	116.2	161.2	-173.5	0	0	0	0	108.3	Q69	Q69-S71 PolarHBondContact O-N 3.39Å
72	H	27.5	Very low	29	Very low	189 Å²	189	126.8 Å²	126.8	88%	0.875	72%	0.717	S	S	*	*			trans	-61.2	141	165.3	-82.1	-85.5	0	0	0	109.5
73	G	26.1	Very low	29.6	Very low	76 Å²	76	126.9 Å²	126.9	78%	0.784	70%	0.699	S	S	*	*			trans	109.5	77.1	165.7	0	0	0	0	0	115.7
74	S	28.1	Very low	30.1	Very low	97 Å²	97	126.8 Å²	126.8	68%	0.678	69%	0.69	S	S	*	*			trans	-133.5	97.1	146.8	72.6	0	0	0	0	108.4
75	L	30.1	Very low	30.3	Very low	111 Å²	111	127.5 Å²	127.5	58%	0.581	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.9	142.3	156.7	-79.8	114.8	0	0	0	107.8
76	D	32	Very low	31.1	Very low	123 Å²	123	128.9 Å²	128.9	66%	0.658	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	88.5	12.5	170.1	-59.3	-14	0	0	0	121.5
77	N	29.3	Very low	31.7	Very low	132 Å²	132	124.2 Å²	124.2	71%	0.706	67%	0.67	S	S	*	*			trans	-124.7	32.7	173.8	-117.6	8.7	0	0	0	116.6	S79	N77-S79 VanDerWaalsContact C-N 3.34Å
78	V	31	Very low	33	Very low	123 Å²	123	119 Å²	119	75%	0.745	66%	0.659	S	S	*	*			trans	-98.8	63.9	160.8	-167.6	0	0	0	0	109.1	N80	V78-N80 VanDerWaalsContact C-N 3.32Å; V78-N80 PolarHBondContact O-N 3.47Å; V78-N80 VanDerWaalsContact O-N 3.13Å
79	S	30	Very low	34.7	Very low	83 Å²	83	112.4 Å²	112.4	58%	0.58	62%	0.624	S	S	*	*			trans	-62.4	103.9	147.3	47.3	0	0	0	0	105.5	N77 P81	N77-S79 VanDerWaalsContact C-N 3.34Å; S79-P81 WeakPolarHBondContact O-CD 3.46Å; S79-P81 VanDerWaalsContact O-N 3.15Å
80	N	35.3	Very low	37	Very low	54 Å²	54	106.6 Å²	106.6	29%	0.289	60%	0.604	S	S	.	*			trans	-68.3	106.8	-178.3	-167	-10.2	0	0	0	108.3	V78 A82 L83 R214	V78-N80 VanDerWaalsContact C-N 3.32Å; V78-N80 PolarHBondContact O-N 3.47Å; V78-N80 VanDerWaalsContact O-N 3.13Å; N80-A82 PolarHBondContact O-N 3.32Å; N80-A82 WeakPolarHBondContact OD1-CB 3.47Å; N80-A82 PolarHBondContact OD1-N 3.44Å; N80-L83 PolarHBondContact O-N 3.45Å; N80-R214 PolarHBondContact ND2-NH1 3.48Å; N80-R214 VanDerWaalsContact ND2-NH1 3.17Å
81	P	30.2	Very low	39.6	Very low	81 Å²	81	102 Å²	102	53%	0.526	59%	0.586	S	S	.	*	H	α-helix	trans	-63.6	-14.5	-179.4	26.4	-32.5	0	0	0	111.8	S79 L83 E84 Q85	S79-P81 WeakPolarHBondContact O-CD 3.46Å; S79-P81 VanDerWaalsContact O-N 3.15Å; P81-L83 VanDerWaalsContact C-N 3.29Å; P81-L83 PolarHBondContact O-N 2.66Å; P81-E84 PolarHBondContact O-N 3.43Å; P81-E84 VanDerWaalsContact O-N 3.09Å; P81-Q85 PolarHBondContact O-N 3.07Å
82	A	35.6	Very low	42.1	Very low	43 Å²	43	104.1 Å²	104.1	36%	0.355	58%	0.576	S	S	.	*	H	α-helix	trans	-73.4	-14.8	174.5	0	0	0	0	0	114.4	N80	N80-A82 PolarHBondContact O-N 3.32Å; N80-A82 WeakPolarHBondContact OD1-CB 3.47Å; N80-A82 PolarHBondContact OD1-N 3.44Å
83	L	40.9	Very low	44.6	Very low	81 Å²	81	97.5 Å²	97.5	42%	0.424	55%	0.549	S	S	.	.	H	α-helix	trans	-85.7	-22.6	165.6	-79.8	165.3	0	0	0	111.8	N80 P81	N80-L83 PolarHBondContact O-N 3.45Å; P81-L83 VanDerWaalsContact C-N 3.29Å; P81-L83 PolarHBondContact O-N 2.66Å
84	E	37.6	Very low	47.3	Very low	133 Å²	133	93.9 Å²	93.9	62%	0.621	51%	0.512	S	S	*	.	H	α-helix	trans	-79.5	-19.1	178.8	-81	-176.2	143.2	0	0	113.8	P81	P81-E84 PolarHBondContact O-N 3.43Å; P81-E84 VanDerWaalsContact O-N 3.09Å
85	Q	35	Very low	49.8	Very low	174 Å²	174	91.3 Å²	91.3	81%	0.813	49%	0.49	S	S	*	.	S	Bend	trans	-109.6	-6	-171.3	-93.3	-179.8	-6.8	0	0	117.7	P81	P81-Q85 PolarHBondContact O-N 3.07Å
86	K	39.9	Very low	52.5	Low	180 Å²	180	93.8 Å²	93.8	78%	0.783	49%	0.492	S	S	*	.	S	Bend	trans	-130	1.3	-172.8	-124.7	176.9	-178.5	179.1	0	119.3
87	A	45.5	Very low	54.9	Low	48 Å²	48	92 Å²	92	40%	0.397	48%	0.476	S	S	.	.			trans	-165	63.6	165.8	0	0	0	0	0	111.1	L89	A87-L89 PolarHBondContact O-N 3.17Å
88	I	53.1	Low	57.4	Low	125 Å²	125	86 Å²	86	64%	0.641	44%	0.443	S	S	*	.			trans	-69.9	93.2	161.1	-57.3	176	0	0	0	105.1	S90	I88-S90 PolarHBondContact O-N 3.19Å; I88-S90 VanDerWaalsContact O-N 3.16Å
89	L	61.8	Low	59.8	Low	19 Å²	19	84.7 Å²	84.7	10%	0.099	43%	0.432	C	S	.	.			trans	-51.1	125.6	170.6	-75	167.4	0	0	0	107.5	A87 D91 T93 I94 F436 E440	A87-L89 PolarHBondContact O-N 3.17Å; L89-D91 PolarHBondContact O-N 3.31Å; L89-T93 HydrophobicContact CD2-CG2 4.32Å; L89-I94 HydrophobicContact CB-CD1 3.99Å; L89-I94 HydrophobicContact CB-CG1 3.74Å; L89-I94 HydrophobicContact CD1-CG1 4.48Å; L89-F436 HydrophobicContact CD1-CB 3.69Å; L89-E440 WeakPolarHBondContact CD2-OE1 3.48Å
90	S	75.5	Confident	62.3	Low	71 Å²	71	88.2 Å²	88.2	50%	0.497	44%	0.437	S	S	.	.			trans	-50.8	132.5	173.4	171.8	0	0	0	0	109.2	I88 W92 T93 I94	I88-S90 PolarHBondContact O-N 3.19Å; I88-S90 VanDerWaalsContact O-N 3.16Å; S90-W92 PolarHBondContact O-N 3.27Å; S90-T93 WeakPolarHBondContact O-CA 3.39Å; S90-T93 VanDerWaalsContact O-CB 3.27Å; S90-T93 WeakPolarHBondContact O-CB 3.05Å; S90-T93 PolarHBondContact O-N 2.71Å; S90-I94 PolarHBondContact O-N 3.1Å
91	D	79.6	Confident	64.4	Low	83 Å²	83	87.7 Å²	87.7	44%	0.444	43%	0.431	S	S	.	.	H	α-helix	trans	-49.4	-34.9	-178.8	-67.8	-15.5	0	0	0	111.7	L89 I94 I95 L429	L89-D91 PolarHBondContact O-N 3.31Å; D91-I94 WeakPolarHBondContact O-CB 3.23Å; D91-I94 PolarHBondContact O-N 3.27Å; D91-I95 WeakPolarHBondContact O-CG1 3.49Å; D91-I95 PolarHBondContact O-N 3.07Å; D91-L429 HydrophobicContact CB-CD1 4.06Å; D91-L429 HydrophobicContact CB-CD2 4.41Å
92	W	80.3	Confident	66.7	Low	161 Å²	161	84.5 Å²	84.5	61%	0.61	41%	0.41	S	S	*	.	H	α-helix	trans	-68.6	-37.6	177.1	-169.6	77.5	0	0	0	113.3	S90 I94 I95 R96	S90-W92 PolarHBondContact O-N 3.27Å; W92-I94 VanDerWaalsContact C-N 3.31Å; W92-I94 PolarHBondContact O-N 3.48Å; W92-I95 PolarHBondContact O-N 3.48Å; W92-R96 VanDerWaalsContact CH2-NH1 3.26Å; W92-R96 VanDerWaalsContact O-CB 3.29Å; W92-R96 WeakPolarHBondContact O-CB 3.44Å; W92-R96 PolarHBondContact O-N 3.18Å
93	T	80.4	Confident	69.1	Low	49 Å²	49	88.1 Å²	88.1	30%	0.301	42%	0.415	S	S	.	.	H	α-helix	trans	-63.1	-40.1	173.8	-54.7	0	0	0	0	110.8	L89 S90 R96 R97	L89-T93 HydrophobicContact CD2-CG2 4.32Å; S90-T93 WeakPolarHBondContact O-CA 3.39Å; S90-T93 VanDerWaalsContact O-CB 3.27Å; S90-T93 WeakPolarHBondContact O-CB 3.05Å; S90-T93 PolarHBondContact O-N 2.71Å; T93-R96 PolarHBondContact O-N 3.42Å; T93-R97 WeakPolarHBondContact O-CB 3.3Å; T93-R97 VanDerWaalsContact O-CG 3.31Å; T93-R97 WeakPolarHBondContact O-CG 3.45Å; T93-R97 PolarHBondContact O-N 2.6Å
94	I	82.1	Confident	71	Confident	0 Å²	0	84.7 Å²	84.7	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-63.1	-49.3	177.1	-62.4	175.9	0	0	0	110.4	L89 S90 D91 W92 R96 R97 L98 L429 M432 F436	L89-I94 HydrophobicContact CB-CD1 3.99Å; L89-I94 HydrophobicContact CB-CG1 3.74Å; L89-I94 HydrophobicContact CD1-CG1 4.48Å; S90-I94 PolarHBondContact O-N 3.1Å; D91-I94 WeakPolarHBondContact O-CB 3.23Å; D91-I94 PolarHBondContact O-N 3.27Å; W92-I94 VanDerWaalsContact C-N 3.31Å; W92-I94 PolarHBondContact O-N 3.48Å; I94-R96 PolarHBondContact O-N 3.45Å; I94-R97 PolarHBondContact O-N 3.21Å; I94-L98 PolarHBondContact O-N 3.1Å; I94-L429 HydrophobicContact CB-CD2 4.38Å; I94-L429 HydrophobicContact CG2-CD2 4.04Å; I94-M432 HydrophobicContact CG2-CB 3.99Å; I94-M432 HydrophobicContact CG2-CE 3.58Å; I94-M432 HydrophobicContact CG2-SD 4.32Å; I94-F436 HydrophobicContact CG2-CD2 4.06Å; I94-F436 HydrophobicContact CG2-CE2 3.95Å
95	I	81.7	Confident	73	Confident	44 Å²	44	86.4 Å²	86.4	23%	0.226	40%	0.403	C	S	.	.	H	α-helix	trans	-62.3	-42.4	177.5	-68	167.7	0	0	0	111	D91 W92 R97 L98 L99 M237 L429	D91-I95 WeakPolarHBondContact O-CG1 3.49Å; D91-I95 PolarHBondContact O-N 3.07Å; W92-I95 PolarHBondContact O-N 3.48Å; I95-R97 PolarHBondContact O-N 3.18Å; I95-L98 VanDerWaalsContact O-CB 3.32Å; I95-L98 WeakPolarHBondContact O-CB 3.22Å; I95-L98 PolarHBondContact O-N 2.94Å; I95-L99 HydrophobicContact CG2-CD1 4.19Å; I95-L99 HydrophobicContact CG2-CG 4.47Å; I95-L99 WeakPolarHBondContact O-CG 3.43Å; I95-L99 PolarHBondContact O-N 3.16Å; I95-M237 HydrophobicContact CD1-CE 4.23Å; I95-M237 HydrophobicContact CG1-CE 4.31Å; I95-M237 HydrophobicContact CG2-CE 3.95Å; I95-L429 HydrophobicContact CD1-CD2 4.39Å; I95-L429 HydrophobicContact CG1-CD2 4.1Å
96	R	85.3	Confident	75.2	Confident	162 Å²	162	85.1 Å²	85.1	61%	0.611	40%	0.402	S	S	*	.	H	α-helix	trans	-64.7	-39.8	178.3	-170.9	174.9	-177.1	172.3	1	112.2	W92 T93 I94 L99	W92-R96 VanDerWaalsContact CH2-NH1 3.26Å; W92-R96 VanDerWaalsContact O-CB 3.29Å; W92-R96 WeakPolarHBondContact O-CB 3.44Å; W92-R96 PolarHBondContact O-N 3.18Å; T93-R96 PolarHBondContact O-N 3.42Å; I94-R96 PolarHBondContact O-N 3.45Å; R96-L99 PolarHBondContact O-N 3.05Å
97	R	82	Confident	77.4	Confident	86 Å²	86	80.4 Å²	80.4	33%	0.325	38%	0.379	S	S	.	.	H	α-helix	trans	-62.3	-45.2	173.1	-75.8	179.4	-177.6	178.9	5.9	110.7	T93 I94 I95 L99 K100 Y101 F436 E440	T93-R97 WeakPolarHBondContact O-CB 3.3Å; T93-R97 VanDerWaalsContact O-CG 3.31Å; T93-R97 WeakPolarHBondContact O-CG 3.45Å; T93-R97 PolarHBondContact O-N 2.6Å; I94-R97 PolarHBondContact O-N 3.21Å; I95-R97 PolarHBondContact O-N 3.18Å; R97-L99 PolarHBondContact O-N 3.26Å; R97-K100 WeakPolarHBondContact O-CB 3.32Å; R97-K100 PolarHBondContact O-N 2.73Å; R97-Y101 WeakPolarHBondContact O-CD2 3.27Å; R97-F436 HydrophobicContact CB-CE2 4.4Å; R97-F436 HydrophobicContact CB-CZ 4.47Å; R97-E440 IonicContact CZ-OE1 2.64Å; R97-E440 IonicContact NH1-OE1 3.4Å; R97-E440 PolarHBondContact NH1-OE1 3.25Å; R97-E440 IonicContact NH2-OE1 2.75Å; R97-E440 PolarHBondContact NH2-OE1 3.42Å
98	L	82.9	Confident	79.4	Confident	5 Å²	5	82 Å²	82	3%	0.026	39%	0.385	C	S	.	.	H	α-helix	trans	-56.3	-47.6	175.4	-89.5	179.5	0	0	0	113.7	I94 I95 K100 Y101 V102 I230 I233 M432	I94-L98 PolarHBondContact O-N 3.1Å; I95-L98 VanDerWaalsContact O-CB 3.32Å; I95-L98 WeakPolarHBondContact O-CB 3.22Å; I95-L98 PolarHBondContact O-N 2.94Å; L98-K100 PolarHBondContact O-N 3.15Å; L98-K100 VanDerWaalsContact O-N 3.15Å; L98-Y101 WeakPolarHBondContact O-CA 3.35Å; L98-Y101 PolarHBondContact O-N 3.47Å; L98-V102 WeakPolarHBondContact O-CG2 3.5Å; L98-V102 PolarHBondContact O-N 3.25Å; L98-I230 HydrophobicContact CD2-CB 4.27Å; L98-I230 HydrophobicContact CD2-CD1 3.89Å; L98-I230 HydrophobicContact CD2-CG1 3.8Å; L98-I230 HydrophobicContact CD2-CG2 3.79Å; L98-I233 HydrophobicContact CD1-CB 4.39Å; L98-I233 HydrophobicContact CD1-CD1 4.32Å; L98-I233 HydrophobicContact CD1-CG2 3.99Å; L98-M432 HydrophobicContact CD1-CE 3.28Å; L98-M432 HydrophobicContact CD1-SD 3.73Å; L98-M432 HydrophobicContact CD2-CE 3.56Å; L98-M432 HydrophobicContact CG-CE 3.29Å; L98-M432 HydrophobicContact CG-SD 4.36Å
99	L	82	Confident	81.2	Confident	97 Å²	97	81.6 Å²	81.6	51%	0.508	38%	0.38	S	S	.	.	H	α-helix	trans	-57.4	-31.9	-178.4	-74.5	169.9	0	0	0	112.1	I95 R96 R97 Y101 V102 W103	I95-L99 HydrophobicContact CG2-CD1 4.19Å; I95-L99 HydrophobicContact CG2-CG 4.47Å; I95-L99 WeakPolarHBondContact O-CG 3.43Å; I95-L99 PolarHBondContact O-N 3.16Å; R96-L99 PolarHBondContact O-N 3.05Å; R97-L99 PolarHBondContact O-N 3.26Å; L99-Y101 VanDerWaalsContact C-N 3.31Å; L99-Y101 PolarHBondContact O-N 3.37Å; L99-V102 PolarHBondContact O-N 3.31Å; L99-W103 WeakPolarHBondContact O-CB 3.35Å; L99-W103 PolarHBondContact O-N 2.79Å
100	K	82.6	Confident	82.5	Confident	157 Å²	157	80.9 Å²	80.9	68%	0.683	38%	0.377	S	S	*	.	H	α-helix	trans	-64.4	-32.9	174.1	-168.8	-178.5	175.6	-174.4	0	112.9	R97 L98 W103	R97-K100 WeakPolarHBondContact O-CB 3.32Å; R97-K100 PolarHBondContact O-N 2.73Å; L98-K100 PolarHBondContact O-N 3.15Å; L98-K100 VanDerWaalsContact O-N 3.15Å; K100-W103 CarbonylContact O-C 3.55Å
101	Y	78.7	Confident	83.2	Confident	42 Å²	42	81.4 Å²	81.4	17%	0.165	37%	0.368	C	S	.	.	H	α-helix	trans	-84.5	-26.4	177.9	-65.2	-80.5	0	0	0	113.4	R97 L98 L99 S191 V195 Q198	R97-Y101 WeakPolarHBondContact O-CD2 3.27Å; L98-Y101 WeakPolarHBondContact O-CA 3.35Å; L98-Y101 PolarHBondContact O-N 3.47Å; L99-Y101 VanDerWaalsContact C-N 3.31Å; L99-Y101 PolarHBondContact O-N 3.37Å; Y101-S191 PolarHBondContact O-OG 2.89Å; Y101-V195 HydrophobicContact CD1-CG2 3.63Å; Y101-V195 HydrophobicContact CD2-CG2 3.81Å; Y101-V195 HydrophobicContact CE1-CG2 3.79Å; Y101-V195 HydrophobicContact CE2-CG2 4Å; Y101-V195 HydrophobicContact CG-CG2 3.63Å; Y101-Q198 PolarHBondContact OH-OE1 3.47Å
102	V	79.3	Confident	83.7	Confident	15 Å²	15	83.4 Å²	83.4	9%	0.091	38%	0.378	C	S	.	.	H	α-helix	trans	-76	-32.8	173.6	-178.9	0	0	0	0	110.9	L98 L99 P104 V114 L234	L98-V102 WeakPolarHBondContact O-CG2 3.5Å; L98-V102 PolarHBondContact O-N 3.25Å; L99-V102 PolarHBondContact O-N 3.31Å; V102-P104 WeakPolarHBondContact O-CD 3.28Å; V102-V114 HydrophobicContact CG1-CG2 4.05Å; V102-L234 HydrophobicContact CG2-CD1 3.86Å; V102-L234 HydrophobicContact CG2-CD2 3.2Å; V102-L234 HydrophobicContact CG2-CG 4.17Å
103	W	85.1	Confident	84.3	Confident	119 Å²	119	79.7 Å²	79.7	45%	0.451	36%	0.364	S	S	.	.	S	Bend	trans	-112.3	65.6	176.5	-162.6	-92	0	0	0	111.2	L99 K100 K105 R111 V114 V115	L99-W103 WeakPolarHBondContact O-CB 3.35Å; L99-W103 PolarHBondContact O-N 2.79Å; K100-W103 CarbonylContact O-C 3.55Å; W103-K105 PolarHBondContact O-N 3.44Å; W103-R111 HydrophobicContact CD2-CB 4.35Å; W103-R111 HydrophobicContact CD2-CG 3.75Å; W103-R111 HydrophobicContact CE3-CB 4.31Å; W103-R111 HydrophobicContact CE3-CG 4.11Å; W103-R111 HydrophobicContact CG-CG 4.1Å; W103-R111 HydrophobicContact CH2-CB 4.12Å; W103-R111 HydrophobicContact CZ2-CB 4.15Å; W103-R111 HydrophobicContact CZ2-CG 4.17Å; W103-R111 HydrophobicContact CZ3-CB 4.2Å; W103-R111 HydrophobicContact CZ3-CG 4.47Å; W103-R111 VanDerWaalsContact NE1-CD 3.27Å; W103-V114 HydrophobicContact CE3-CB 4.46Å; W103-V114 HydrophobicContact CE3-CG1 4.28Å; W103-V114 HydrophobicContact CZ3-CB 4.32Å; W103-V114 HydrophobicContact CZ3-CG1 4.2Å; W103-V115 HydrophobicContact CH2-CG2 3.63Å; W103-V115 HydrophobicContact CZ3-CG2 3.85Å
104	P	80.7	Confident	84.8	Confident	8 Å²	8	78.2 Å²	78.2	5%	0.052	36%	0.355	C	S	.	.			trans	-65.5	130	-178.6	28.3	-34.1	0	0	0	109.9	V102 D106 R107 I110 R111	V102-P104 WeakPolarHBondContact O-CD 3.28Å; P104-D106 VanDerWaalsContact C-N 3.26Å; P104-D106 PolarHBondContact O-N 2.94Å; P104-R107 HydrophobicContact CB-CB 4.37Å; P104-R107 HydrophobicContact CG-CB 3.98Å; P104-I110 HydrophobicContact CG-CB 3.91Å; P104-I110 HydrophobicContact CG-CD1 4.03Å; P104-I110 HydrophobicContact CG-CG2 3.93Å; P104-R111 WeakPolarHBondContact O-CD 3.38Å; P104-R111 PolarHBondContact O-NE 2.96Å
105	K	78.8	Confident	85.3	Confident	169 Å²	169	81.2 Å²	81.2	74%	0.735	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-39.2	177	-68.7	-172	176.3	-173	0	110.9	W103 R107 R111	W103-K105 PolarHBondContact O-N 3.44Å; K105-R107 VanDerWaalsContact C-N 3.35Å; K105-R107 PolarHBondContact O-N 2.95Å; K105-R111 PolarHBondContact O-NH2 2.79Å
106	D	82.7	Confident	85.8	Confident	148 Å²	148	80.8 Å²	80.8	79%	0.791	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-8.2	-170.1	-48.5	-43.3	0	0	0	114.1	P104	P104-D106 VanDerWaalsContact C-N 3.26Å; P104-D106 PolarHBondContact O-N 2.94Å
107	R	86.1	Confident	86.2	Confident	81 Å²	81	73 Å²	73	31%	0.306	35%	0.346	S	S	.	.			trans	-129	85.2	-175.9	-61.8	-172.1	71.1	-167	-2.4	112.2	P104 K105 E109 I110 S190	P104-R107 HydrophobicContact CB-CB 4.37Å; P104-R107 HydrophobicContact CG-CB 3.98Å; K105-R107 VanDerWaalsContact C-N 3.35Å; K105-R107 PolarHBondContact O-N 2.95Å; R107-E109 PolarHBondContact O-N 3.26Å; R107-I110 HydrophobicContact CB-CB 4.48Å; R107-I110 HydrophobicContact CB-CD1 4.04Å; R107-I110 HydrophobicContact CB-CG1 4.23Å; R107-I110 PolarHBondContact O-N 3.38Å; R107-I110 VanDerWaalsContact O-N 3.15Å; R107-S190 PolarHBondContact NH1-OG 3.49Å
108	P	87.8	Confident	86.6	Confident	80 Å²	80	72.1 Å²	72.1	52%	0.519	35%	0.347	S	S	.	.	H	α-helix	trans	-61.5	-30.7	-178.4	24.9	-33.8	0	0	0	113.1	I110 R111 L112	P108-I110 VanDerWaalsContact C-N 3.26Å; P108-I110 PolarHBondContact O-N 2.99Å; P108-R111 PolarHBondContact O-N 2.87Å; P108-L112 PolarHBondContact O-N 3.31Å
109	E	90	Very high	87.1	Confident	117 Å²	117	76.8 Å²	76.8	55%	0.547	37%	0.371	S	S	.	.	H	α-helix	trans	-56.6	-37.5	175.4	-65.3	-179.2	-168.5	0	0	113.4	R107 R113	R107-E109 PolarHBondContact O-N 3.26Å; E109-R113 WeakPolarHBondContact O-CG 3.39Å; E109-R113 PolarHBondContact O-N 3.01Å
110	I	88.7	Confident	87.7	Confident	5 Å²	5	73.6 Å²	73.6	3%	0.026	35%	0.354	C	S	.	.	H	α-helix	trans	-72.6	-43	179.7	-66.1	178.1	0	0	0	109.4	P104 R107 P108 L112 R113 V114 A187 S190	P104-I110 HydrophobicContact CG-CB 3.91Å; P104-I110 HydrophobicContact CG-CD1 4.03Å; P104-I110 HydrophobicContact CG-CG2 3.93Å; R107-I110 HydrophobicContact CB-CB 4.48Å; R107-I110 HydrophobicContact CB-CD1 4.04Å; R107-I110 HydrophobicContact CB-CG1 4.23Å; R107-I110 PolarHBondContact O-N 3.38Å; R107-I110 VanDerWaalsContact O-N 3.15Å; P108-I110 VanDerWaalsContact C-N 3.26Å; P108-I110 PolarHBondContact O-N 2.99Å; I110-L112 VanDerWaalsContact C-N 3.33Å; I110-L112 PolarHBondContact O-N 3.4Å; I110-R113 WeakPolarHBondContact O-CB 3.46Å; I110-R113 PolarHBondContact O-N 2.86Å; I110-R113 VanDerWaalsContact O-N 3.15Å; I110-V114 WeakPolarHBondContact O-CG2 3.41Å; I110-V114 PolarHBondContact O-N 3.22Å; I110-A187 HydrophobicContact CG2-CB 3.93Å; I110-S190 WeakPolarHBondContact CD1-OG 3.39Å
111	R	89.5	Confident	88.1	Confident	81 Å²	81	66.3 Å²	66.3	31%	0.306	32%	0.323	S	S	.	.	H	α-helix	trans	-59	-44.9	176.4	-66.1	-170.5	-86	151.9	-8.7	111.5	W103 P104 K105 P108 R113 V114 V115	W103-R111 HydrophobicContact CD2-CB 4.35Å; W103-R111 HydrophobicContact CD2-CG 3.75Å; W103-R111 HydrophobicContact CE3-CB 4.31Å; W103-R111 HydrophobicContact CE3-CG 4.11Å; W103-R111 HydrophobicContact CG-CG 4.1Å; W103-R111 HydrophobicContact CH2-CB 4.12Å; W103-R111 HydrophobicContact CZ2-CB 4.15Å; W103-R111 HydrophobicContact CZ2-CG 4.17Å; W103-R111 HydrophobicContact CZ3-CB 4.2Å; W103-R111 HydrophobicContact CZ3-CG 4.47Å; W103-R111 VanDerWaalsContact NE1-CD 3.27Å; P104-R111 WeakPolarHBondContact O-CD 3.38Å; P104-R111 PolarHBondContact O-NE 2.96Å; K105-R111 PolarHBondContact O-NH2 2.79Å; P108-R111 PolarHBondContact O-N 2.87Å; R111-R113 VanDerWaalsContact C-N 3.31Å; R111-R113 PolarHBondContact O-N 2.93Å; R111-V114 PolarHBondContact O-N 2.91Å; R111-V115 WeakPolarHBondContact O-CG2 3.33Å; R111-V115 PolarHBondContact O-N 3.29Å
112	L	92	Very high	88.8	Confident	126 Å²	126	67.5 Å²	67.5	66%	0.66	33%	0.332	S	S	*	.	H	α-helix	trans	-58.9	-41.8	176	-176.4	65.6	0	0	0	111.9	P108 I110 V115 A116	P108-L112 PolarHBondContact O-N 3.31Å; I110-L112 VanDerWaalsContact C-N 3.33Å; I110-L112 PolarHBondContact O-N 3.4Å; L112-V115 PolarHBondContact O-N 3.18Å; L112-A116 VanDerWaalsContact O-CB 3.29Å; L112-A116 WeakPolarHBondContact O-CB 2.9Å; L112-A116 PolarHBondContact O-N 3.05Å
113	R	92.1	Very high	89.4	Confident	82 Å²	82	69.6 Å²	69.6	31%	0.309	35%	0.347	S	S	.	.	H	α-helix	trans	-66.1	-39.2	176.8	-72.8	171.2	180	-109.3	-2.1	112.9	E109 I110 R111 A116 A117 V183 K186	E109-R113 WeakPolarHBondContact O-CG 3.39Å; E109-R113 PolarHBondContact O-N 3.01Å; I110-R113 WeakPolarHBondContact O-CB 3.46Å; I110-R113 PolarHBondContact O-N 2.86Å; I110-R113 VanDerWaalsContact O-N 3.15Å; R111-R113 VanDerWaalsContact C-N 3.31Å; R111-R113 PolarHBondContact O-N 2.93Å; R113-A116 PolarHBondContact O-N 2.75Å; R113-A117 WeakPolarHBondContact O-CB 3.44Å; R113-A117 PolarHBondContact O-N 2.82Å; R113-V183 HydrophobicContact CB-CG1 4.14Å; R113-V183 HydrophobicContact CG-CG1 4.4Å; R113-V183 WeakPolarHBondContact O-CG1 3.27Å; R113-K186 VanDerWaalsContact NH1-CB 3.31Å
114	V	90.3	Very high	89.8	Confident	19 Å²	19	64 Å²	64	12%	0.115	33%	0.326	C	S	.	.	H	α-helix	trans	-63.1	-46.2	175.4	174.6	0	0	0	0	110.2	V102 W103 I110 R111 A117 M118 F184 A187	V102-V114 HydrophobicContact CG1-CG2 4.05Å; W103-V114 HydrophobicContact CE3-CB 4.46Å; W103-V114 HydrophobicContact CE3-CG1 4.28Å; W103-V114 HydrophobicContact CZ3-CB 4.32Å; W103-V114 HydrophobicContact CZ3-CG1 4.2Å; I110-V114 WeakPolarHBondContact O-CG2 3.41Å; I110-V114 PolarHBondContact O-N 3.22Å; R111-V114 PolarHBondContact O-N 2.91Å; V114-A117 PolarHBondContact O-N 3.47Å; V114-M118 WeakPolarHBondContact O-CG 3.47Å; V114-M118 PolarHBondContact O-N 2.79Å; V114-F184 HydrophobicContact CG2-CE2 4.4Å; V114-A187 HydrophobicContact CG2-CB 3.88Å
115	V	92.4	Very high	90.3	Very high	63 Å²	63	64.4 Å²	64.4	38%	0.382	33%	0.327	S	S	.	.	H	α-helix	trans	-61.8	-47.3	176.1	175.2	0	0	0	0	111.1	W103 R111 L112 A117 M118 L119	W103-V115 HydrophobicContact CH2-CG2 3.63Å; W103-V115 HydrophobicContact CZ3-CG2 3.85Å; R111-V115 WeakPolarHBondContact O-CG2 3.33Å; R111-V115 PolarHBondContact O-N 3.29Å; L112-V115 PolarHBondContact O-N 3.18Å; V115-A117 VanDerWaalsContact C-N 3.32Å; V115-A117 PolarHBondContact O-N 3.19Å; V115-M118 PolarHBondContact O-N 2.91Å; V115-M118 VanDerWaalsContact O-N 3.14Å; V115-L119 HydrophobicContact CG1-CD1 4.14Å; V115-L119 HydrophobicContact CG1-CG 4.45Å; V115-L119 WeakPolarHBondContact O-CG 3.44Å; V115-L119 PolarHBondContact O-N 3Å
116	A	93.6	Very high	91	Very high	34 Å²	34	59.5 Å²	59.5	28%	0.281	31%	0.313	S	S	.	.	H	α-helix	trans	-59.7	-41.4	177.7	0	0	0	0	0	112.2	L112 R113 L119 L120 V183	L112-A116 VanDerWaalsContact O-CB 3.29Å; L112-A116 WeakPolarHBondContact O-CB 2.9Å; L112-A116 PolarHBondContact O-N 3.05Å; R113-A116 PolarHBondContact O-N 2.75Å; A116-L119 PolarHBondContact O-N 3.3Å; A116-L120 WeakPolarHBondContact O-CB 3.23Å; A116-L120 VanDerWaalsContact O-CG 3.28Å; A116-L120 WeakPolarHBondContact O-CG 3.41Å; A116-L120 PolarHBondContact O-N 3.06Å; A116-V183 HydrophobicContact CB-CG1 4.07Å
117	A	92.8	Very high	91.5	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-63.5	-41.6	174.7	0	0	0	0	0	112	R113 V114 V115 L120 L121 R180 V183 F184	R113-A117 WeakPolarHBondContact O-CB 3.44Å; R113-A117 PolarHBondContact O-N 2.82Å; V114-A117 PolarHBondContact O-N 3.47Å; V115-A117 VanDerWaalsContact C-N 3.32Å; V115-A117 PolarHBondContact O-N 3.19Å; A117-L120 PolarHBondContact O-N 2.76Å; A117-L121 WeakPolarHBondContact O-CB 3.28Å; A117-L121 PolarHBondContact O-N 3.04Å; A117-R180 HydrophobicContact CB-CG 4.17Å; A117-R180 WeakPolarHBondContact O-CG 3.34Å; A117-V183 HydrophobicContact CB-CG1 4.28Å; A117-F184 HydrophobicContact CB-CB 3.93Å; A117-F184 HydrophobicContact CB-CD2 4.23Å
118	M	91	Very high	91.8	Very high	66 Å²	66	51.5 Å²	51.5	33%	0.325	28%	0.277	S	S	.	.	H	α-helix	trans	-65.4	-37.5	176	-70	-60.7	-65.2	0	0	112.5	V114 V115 L121 L122	V114-M118 WeakPolarHBondContact O-CG 3.47Å; V114-M118 PolarHBondContact O-N 2.79Å; V115-M118 PolarHBondContact O-N 2.91Å; V115-M118 VanDerWaalsContact O-N 3.14Å; M118-L121 HydrophobicContact CE-CD1 4.48Å; M118-L121 WeakPolarHBondContact O-CB 3.1Å; M118-L121 PolarHBondContact O-N 3.24Å; M118-L121 HydrophobicContact SD-CD1 4.09Å; M118-L122 WeakPolarHBondContact O-CG 3.4Å; M118-L122 PolarHBondContact O-N 2.88Å; M118-L122 VanDerWaalsContact O-N 3.1Å
119	L	93.3	Very high	91.9	Very high	103 Å²	103	48.1 Å²	48.1	54%	0.539	26%	0.255	S	S	.	.	H	α-helix	trans	-65.8	-45.7	174	-70.7	173	0	0	0	111.5	V115 A116 L121 L122 S123	V115-L119 HydrophobicContact CG1-CD1 4.14Å; V115-L119 HydrophobicContact CG1-CG 4.45Å; V115-L119 WeakPolarHBondContact O-CG 3.44Å; V115-L119 PolarHBondContact O-N 3Å; A116-L119 PolarHBondContact O-N 3.3Å; L119-L121 VanDerWaalsContact C-N 3.28Å; L119-L121 PolarHBondContact O-N 2.91Å; L119-L122 PolarHBondContact O-N 2.89Å; L119-S123 WeakPolarHBondContact O-CB 3.42Å; L119-S123 PolarHBondContact O-N 2.94Å; L119-S123 PolarHBondContact O-OG 2.91Å; L119-S123 VanDerWaalsContact O-OG 3.11Å
120	L	94.2	Very high	92.1	Very high	31 Å²	31	46.4 Å²	46.4	16%	0.162	25%	0.249	C	C	.	.	H	α-helix	trans	-61.2	-36.9	176.2	-72.3	168.9	0	0	0	112.5	A116 A117 S124 L176 L179 R180 V183	A116-L120 WeakPolarHBondContact O-CB 3.23Å; A116-L120 VanDerWaalsContact O-CG 3.28Å; A116-L120 WeakPolarHBondContact O-CG 3.41Å; A116-L120 PolarHBondContact O-N 3.06Å; A117-L120 PolarHBondContact O-N 2.76Å; L120-S124 VanDerWaalsContact O-CB 3.26Å; L120-S124 WeakPolarHBondContact O-CB 3.5Å; L120-S124 PolarHBondContact O-N 2.71Å; L120-L176 HydrophobicContact CD2-CD2 3.76Å; L120-L179 HydrophobicContact CD1-CB 4.32Å; L120-L179 HydrophobicContact CD1-CD2 4.07Å; L120-L179 HydrophobicContact CD1-CG 3.81Å; L120-L179 HydrophobicContact CD2-CD2 3.87Å; L120-L179 HydrophobicContact CD2-CG 4.42Å; L120-R180 HydrophobicContact CB-CB 3.85Å; L120-V183 HydrophobicContact CD1-CB 4.44Å; L120-V183 HydrophobicContact CD1-CG2 3.98Å
121	L	91.7	Very high	92.3	Very high	3 Å²	3	46.3 Å²	46.3	2%	0.016	25%	0.249	C	C	.	.	H	α-helix	trans	-59.4	-52.5	173.6	-179.3	166	0	0	0	111.3	A117 M118 L119 S124 K125 R180 V238 P243	A117-L121 WeakPolarHBondContact O-CB 3.28Å; A117-L121 PolarHBondContact O-N 3.04Å; M118-L121 HydrophobicContact CE-CD1 4.48Å; M118-L121 WeakPolarHBondContact O-CB 3.1Å; M118-L121 PolarHBondContact O-N 3.24Å; M118-L121 HydrophobicContact SD-CD1 4.09Å; L119-L121 VanDerWaalsContact C-N 3.28Å; L119-L121 PolarHBondContact O-N 2.91Å; L121-S124 PolarHBondContact O-N 3.16Å; L121-K125 HydrophobicContact CD2-CG 4.49Å; L121-K125 PolarHBondContact O-N 2.95Å; L121-R180 HydrophobicContact CB-CG 4.4Å; L121-V238 HydrophobicContact CD1-CG1 4.28Å; L121-V238 WeakPolarHBondContact CD1-O 3.46Å; L121-P243 HydrophobicContact CD1-CG 3.7Å; L121-P243 HydrophobicContact CD2-CB 4.33Å; L121-P243 HydrophobicContact CD2-CG 4.15Å; L121-P243 HydrophobicContact CG-CB 4.44Å; L121-P243 HydrophobicContact CG-CG 3.88Å
122	L	92.1	Very high	92.5	Very high	67 Å²	67	42.7 Å²	42.7	35%	0.351	24%	0.236	S	C	.	.	H	α-helix	trans	-62.3	-47.8	-179.8	-70	171.3	0	0	0	110.5	M118 L119 S124 K125 C126 F246	M118-L122 WeakPolarHBondContact O-CG 3.4Å; M118-L122 PolarHBondContact O-N 2.88Å; M118-L122 VanDerWaalsContact O-N 3.1Å; L119-L122 PolarHBondContact O-N 2.89Å; L122-S124 PolarHBondContact O-N 2.69Å; L122-K125 PolarHBondContact O-N 3.39Å; L122-C126 PolarHBondContact O-N 2.96Å; L122-C126 PolarHBondContact O-SG 3.41Å; L122-F246 HydrophobicContact CD2-CD1 4.46Å; L122-F246 HydrophobicContact CD2-CD2 4.11Å; L122-F246 HydrophobicContact CD2-CE1 4.26Å; L122-F246 HydrophobicContact CD2-CE2 3.9Å; L122-F246 HydrophobicContact CD2-CG 4.38Å; L122-F246 HydrophobicContact CD2-CZ 3.98Å
123	S	93.6	Very high	92.5	Very high	60 Å²	60	39.2 Å²	39.2	42%	0.42	22%	0.216	S	C	.	.	H	α-helix	trans	-58	-45.8	176.7	-61.8	0	0	0	0	112	L119 K125 C126 V127	L119-S123 WeakPolarHBondContact O-CB 3.42Å; L119-S123 PolarHBondContact O-N 2.94Å; L119-S123 PolarHBondContact O-OG 2.91Å; L119-S123 VanDerWaalsContact O-OG 3.11Å; S123-K125 PolarHBondContact O-N 3.3Å; S123-C126 PolarHBondContact O-N 3.36Å; S123-V127 VanDerWaalsContact O-CG2 3.29Å; S123-V127 WeakPolarHBondContact O-CG2 3.2Å; S123-V127 PolarHBondContact O-N 2.71Å
124	S	93.3	Very high	92.5	Very high	0 Å²	0	36 Å²	36	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60.4	-45.7	177.2	178.5	0	0	0	0	112.2	L120 L121 L122 V127 N128 A173 N177	L120-S124 VanDerWaalsContact O-CB 3.26Å; L120-S124 WeakPolarHBondContact O-CB 3.5Å; L120-S124 PolarHBondContact O-N 2.71Å; L121-S124 PolarHBondContact O-N 3.16Å; L122-S124 PolarHBondContact O-N 2.69Å; S124-V127 PolarHBondContact O-N 3.3Å; S124-N128 WeakPolarHBondContact O-CB 3.29Å; S124-N128 PolarHBondContact O-N 2.94Å; S124-A173 PolarHBondContact OG-O 2.69Å; S124-N177 WeakPolarHBondContact CB-OD1 3.46Å; S124-N177 PolarHBondContact OG-ND2 3.03Å; S124-N177 PolarHBondContact OG-OD1 3.46Å
125	K	91.1	Very high	92.7	Very high	18 Å²	18	39 Å²	39	8%	0.078	22%	0.217	C	C	.	.	H	α-helix	trans	-67	-39.8	179.8	-73.9	-61.6	-174.1	-179.8	0	112.6	L121 L122 S123 N128 V129 P243 F246 E247	L121-K125 HydrophobicContact CD2-CG 4.49Å; L121-K125 PolarHBondContact O-N 2.95Å; L122-K125 PolarHBondContact O-N 3.39Å; S123-K125 PolarHBondContact O-N 3.3Å; K125-N128 PolarHBondContact O-N 3.15Å; K125-V129 WeakPolarHBondContact O-CG2 3.17Å; K125-V129 PolarHBondContact O-N 3.33Å; K125-P243 HydrophobicContact CD-CB 4.38Å; K125-P243 HydrophobicContact CG-CB 4.28Å; K125-F246 HydrophobicContact CB-CD1 3.88Å; K125-F246 HydrophobicContact CB-CE1 3.9Å; K125-F246 HydrophobicContact CG-CD1 4.38Å; K125-E247 HydrophobicContact CD-CB 4.48Å; K125-E247 IonicContact NZ-OE1 3.66Å; K125-E247 PolarHBondContact NZ-OE1 3.43Å; K125-E247 IonicContact NZ-OE2 2.78Å; K125-E247 PolarHBondContact NZ-OE2 3.09Å
126	C	92	Very high	92.7	Very high	65 Å²	65	37.3 Å²	37.3	44%	0.439	20%	0.204	S	C	.	.	H	α-helix	trans	-58.9	-47.5	172.2	-68.8	0	0	0	0	111.4	L122 S123 N128 V129 L130	L122-C126 PolarHBondContact O-N 2.96Å; L122-C126 PolarHBondContact O-SG 3.41Å; S123-C126 PolarHBondContact O-N 3.36Å; C126-N128 VanDerWaalsContact C-N 3.32Å; C126-N128 PolarHBondContact O-N 2.95Å; C126-V129 PolarHBondContact O-N 2.86Å; C126-L130 WeakPolarHBondContact O-CG 3.28Å; C126-L130 PolarHBondContact O-N 3.41Å
127	V	93.6	Very high	92.4	Very high	28 Å²	28	38.9 Å²	38.9	17%	0.17	21%	0.207	C	C	.	.	H	α-helix	trans	-62.5	-40.2	176.3	179	0	0	0	0	111.1	S123 S124 V129 L130 V131 F169 T172 A173 L176	S123-V127 VanDerWaalsContact O-CG2 3.29Å; S123-V127 WeakPolarHBondContact O-CG2 3.2Å; S123-V127 PolarHBondContact O-N 2.71Å; S124-V127 PolarHBondContact O-N 3.3Å; V127-V129 PolarHBondContact O-N 2.92Å; V127-L130 WeakPolarHBondContact O-CB 3.45Å; V127-L130 PolarHBondContact O-N 2.8Å; V127-V131 PolarHBondContact O-N 3.43Å; V127-F169 HydrophobicContact CG1-CB 4.26Å; V127-F169 HydrophobicContact CG1-CD1 3.92Å; V127-F169 HydrophobicContact CG1-CG 4.42Å; V127-F169 VanDerWaalsContact CG1-O 3.23Å; V127-F169 WeakPolarHBondContact CG1-O 3.39Å; V127-T172 HydrophobicContact CG1-CG2 4.45Å; V127-A173 HydrophobicContact CB-CB 4.12Å; V127-A173 HydrophobicContact CG1-CB 3.87Å; V127-L176 HydrophobicContact CG2-CD1 4.29Å
128	N	91.9	Very high	92.2	Very high	33 Å²	33	39 Å²	39	18%	0.176	21%	0.208	C	C	.	.	H	α-helix	trans	-63	-41.4	179.3	-164.9	53.4	0	0	0	112.7	S124 K125 C126 L130 V131 P132 A173 E247 Q410	S124-N128 WeakPolarHBondContact O-CB 3.29Å; S124-N128 PolarHBondContact O-N 2.94Å; K125-N128 PolarHBondContact O-N 3.15Å; C126-N128 VanDerWaalsContact C-N 3.32Å; C126-N128 PolarHBondContact O-N 2.95Å; N128-L130 VanDerWaalsContact C-N 3.25Å; N128-L130 PolarHBondContact O-N 2.71Å; N128-V131 WeakPolarHBondContact O-CB 3.18Å; N128-V131 PolarHBondContact O-N 3.45Å; N128-P132 WeakPolarHBondContact O-CD 3.38Å; N128-A173 HydrophobicContact CB-CB 4.16Å; N128-E247 PolarHBondContact ND2-OE1 3.35Å; N128-Q410 PolarHBondContact O-NE2 3.47Å; N128-Q410 VanDerWaalsContact O-NE2 3.13Å; N128-Q410 PolarHBondContact O-OE1 3.25Å
129	V	91.9	Very high	92.2	Very high	9 Å²	9	37 Å²	37	6%	0.055	20%	0.2	C	C	.	.	H	α-helix	trans	-66.4	-27.5	176.7	169.8	0	0	0	0	111.8	K125 C126 V127 P132 F133 V250 I254 L407	K125-V129 WeakPolarHBondContact O-CG2 3.17Å; K125-V129 PolarHBondContact O-N 3.33Å; C126-V129 PolarHBondContact O-N 2.86Å; V127-V129 PolarHBondContact O-N 2.92Å; V129-P132 WeakPolarHBondContact O-CD 3.37Å; V129-F133 WeakPolarHBondContact O-CD2 3.49Å; V129-V250 HydrophobicContact CB-CG1 4.45Å; V129-V250 HydrophobicContact CG1-CG1 3.85Å; V129-V250 HydrophobicContact CG2-CG1 3.98Å; V129-I254 HydrophobicContact CG1-CD1 3.39Å; V129-L407 HydrophobicContact CG1-CD2 4.22Å
130	L	92.6	Very high	92	Very high	81 Å²	81	32.8 Å²	32.8	42%	0.424	18%	0.178	S	C	.	.	H	α-helix	trans	-76	-21.8	175.6	-67.6	173.1	0	0	0	113.3	C126 V127 N128 F133 V134 F169	C126-L130 WeakPolarHBondContact O-CG 3.28Å; C126-L130 PolarHBondContact O-N 3.41Å; V127-L130 WeakPolarHBondContact O-CB 3.45Å; V127-L130 PolarHBondContact O-N 2.8Å; N128-L130 VanDerWaalsContact C-N 3.25Å; N128-L130 PolarHBondContact O-N 2.71Å; L130-F133 WeakPolarHBondContact O-CB 3.41Å; L130-F133 PolarHBondContact O-N 3.2Å; L130-V134 PolarHBondContact O-N 2.83Å; L130-F169 HydrophobicContact CB-CD1 4.1Å; L130-F169 HydrophobicContact CB-CE1 4.15Å; L130-F169 HydrophobicContact CD1-CE1 4.02Å
131	V	94	Very high	91.5	Very high	4 Å²	4	31.3 Å²	31.3	2%	0.024	17%	0.17	C	C	.	.	H	α-helix	trans	-56.5	-47.3	-177.1	169.6	0	0	0	0	112.6	V127 N128 F133 V134 F135 Y166 F169 R170	V127-V131 PolarHBondContact O-N 3.43Å; N128-V131 WeakPolarHBondContact O-CB 3.18Å; N128-V131 PolarHBondContact O-N 3.45Å; V131-F133 VanDerWaalsContact C-N 3.3Å; V131-F133 PolarHBondContact O-N 3.05Å; V131-V134 PolarHBondContact O-N 3.18Å; V131-F135 PolarHBondContact O-N 3.19Å; V131-F135 VanDerWaalsContact O-N 3.16Å; V131-Y166 HydrophobicContact CG1-CD2 3.63Å; V131-Y166 HydrophobicContact CG1-CE2 3.22Å; V131-F169 HydrophobicContact CG2-CB 3.89Å; V131-R170 HydrophobicContact CG2-CB 4.28Å
132	P	92.9	Very high	91.2	Very high	5 Å²	5	36.5 Å²	36.5	3%	0.032	20%	0.197	C	C	.	.	H	α-helix	trans	-63.6	-30.1	174.6	-27.3	39.3	0	0	0	114.2	N128 V129 F135 K136 L403 L407	N128-P132 WeakPolarHBondContact O-CD 3.38Å; V129-P132 WeakPolarHBondContact O-CD 3.37Å; P132-F135 PolarHBondContact O-N 2.96Å; P132-K136 PolarHBondContact O-N 3.32Å; P132-L403 HydrophobicContact CB-CD1 3.6Å; P132-L407 HydrophobicContact CB-CD2 4.26Å; P132-L407 HydrophobicContact CB-CG 4.15Å; P132-L407 HydrophobicContact CG-CD2 4.03Å; P132-L407 HydrophobicContact CG-CG 4.28Å
133	F	92.7	Very high	90.7	Very high	53 Å²	53	36.4 Å²	36.4	23%	0.232	20%	0.202	C	C	.	.	H	α-helix	trans	-67.6	-43.7	175.6	-76.5	-96.1	0	0	0	111.4	V129 L130 V131 F135 K136 I137 I254 K258 L403 L407	V129-F133 WeakPolarHBondContact O-CD2 3.49Å; L130-F133 WeakPolarHBondContact O-CB 3.41Å; L130-F133 PolarHBondContact O-N 3.2Å; V131-F133 VanDerWaalsContact C-N 3.3Å; V131-F133 PolarHBondContact O-N 3.05Å; F133-F135 PolarHBondContact O-N 3.14Å; F133-K136 WeakPolarHBondContact O-CB 3.34Å; F133-K136 PolarHBondContact O-N 3.09Å; F133-I137 WeakPolarHBondContact O-CG1 3.42Å; F133-I137 PolarHBondContact O-N 3.3Å; F133-I137 VanDerWaalsContact O-N 3.09Å; F133-I254 HydrophobicContact CE2-CD1 4.16Å; F133-I254 HydrophobicContact CE2-CG2 4.34Å; F133-I254 HydrophobicContact CZ-CD1 4.39Å; F133-I254 HydrophobicContact CZ-CG2 3.81Å; F133-K258 HydrophobicContact CE1-CD 4.11Å; F133-K258 HydrophobicContact CZ-CD 4.38Å; F133-L403 HydrophobicContact CD1-CD1 4.25Å; F133-L403 HydrophobicContact CD1-CD2 3.84Å; F133-L403 HydrophobicContact CD2-CD1 3.74Å; F133-L403 HydrophobicContact CE1-CD1 4.4Å; F133-L403 HydrophobicContact CE1-CD2 3.69Å; F133-L403 HydrophobicContact CE2-CD1 3.9Å; F133-L403 HydrophobicContact CG-CD1 3.92Å; F133-L403 HydrophobicContact CG-CD2 4.34Å; F133-L403 HydrophobicContact CZ-CD1 4.24Å; F133-L403 HydrophobicContact CZ-CD2 4.07Å; F133-L407 HydrophobicContact CE2-CD2 4.47Å
134	V	92.3	Very high	89.8	Confident	15 Å²	15	36.5 Å²	36.5	9%	0.091	21%	0.213	C	C	.	.	H	α-helix	trans	-60.1	-40.4	175.3	-178.1	0	0	0	0	110.1	L130 V131 I137 A138 I162 S165 F169	L130-V134 PolarHBondContact O-N 2.83Å; V131-V134 PolarHBondContact O-N 3.18Å; V134-I137 PolarHBondContact O-N 3.22Å; V134-A138 PolarHBondContact O-N 2.83Å; V134-I162 HydrophobicContact CG1-CG2 3.6Å; V134-I162 WeakPolarHBondContact CG1-O 3.42Å; V134-I162 WeakPolarHBondContact O-CG2 3.47Å; V134-S165 VanDerWaalsContact CG1-OG 3.28Å; V134-S165 WeakPolarHBondContact CG1-OG 3.15Å; V134-F169 HydrophobicContact CG2-CD1 4.46Å; V134-F169 HydrophobicContact CG2-CD2 4.49Å; V134-F169 HydrophobicContact CG2-CG 4.4Å
135	F	93.3	Very high	88.7	Confident	81 Å²	81	40.8 Å²	40.8	36%	0.355	23%	0.233	S	C	.	.	H	α-helix	trans	-67.8	-39.4	177.4	-167.9	-159.1	0	0	0	112.8	V131 P132 F133 I137 A138 V139 L163 Y166 V402	V131-F135 PolarHBondContact O-N 3.19Å; V131-F135 VanDerWaalsContact O-N 3.16Å; P132-F135 PolarHBondContact O-N 2.96Å; F133-F135 PolarHBondContact O-N 3.14Å; F135-I137 VanDerWaalsContact C-N 3.33Å; F135-I137 PolarHBondContact O-N 3.22Å; F135-A138 PolarHBondContact O-N 2.7Å; F135-V139 HydrophobicContact CD2-CG2 4.22Å; F135-V139 HydrophobicContact CE2-CG2 4.02Å; F135-V139 WeakPolarHBondContact O-CG2 3.34Å; F135-V139 PolarHBondContact O-N 2.75Å; F135-L163 HydrophobicContact CD2-CD2 4.14Å; F135-L163 HydrophobicContact CE2-CD2 4.26Å; F135-Y166 HydrophobicContact CB-CD2 3.9Å; F135-Y166 HydrophobicContact CB-CE2 4.08Å; F135-Y166 HydrophobicContact CG-CE2 4.44Å; F135-V402 HydrophobicContact CB-CG1 4.44Å; F135-V402 HydrophobicContact CD1-CG1 3.23Å; F135-V402 HydrophobicContact CD2-CG1 4.45Å; F135-V402 HydrophobicContact CE1-CG1 3.41Å; F135-V402 VanDerWaalsContact CE1-CG1 3.41Å; F135-V402 HydrophobicContact CG-CG1 3.81Å; F135-V402 HydrophobicContact CZ-CG1 4.1Å
136	K	92.2	Very high	87.3	Confident	27 Å²	27	42.5 Å²	42.5	12%	0.117	25%	0.245	C	C	.	.	H	α-helix	trans	-52.4	-50.7	171	162.3	174.6	179.9	174.1	0	111.3	P132 F133 A138 V139 D140 T397 G399 D400 L403	P132-K136 PolarHBondContact O-N 3.32Å; F133-K136 WeakPolarHBondContact O-CB 3.34Å; F133-K136 PolarHBondContact O-N 3.09Å; K136-A138 VanDerWaalsContact C-N 3.29Å; K136-A138 PolarHBondContact O-N 2.85Å; K136-V139 WeakPolarHBondContact O-CB 3.42Å; K136-V139 PolarHBondContact O-N 3.38Å; K136-D140 WeakPolarHBondContact CE-OD2 3.42Å; K136-D140 VanDerWaalsContact CG-OD2 3.28Å; K136-D140 WeakPolarHBondContact CG-OD2 3.14Å; K136-D140 IonicContact NZ-OD2 2.81Å; K136-D140 VanDerWaalsContact O-CG 3.28Å; K136-D140 PolarHBondContact O-N 3.43Å; K136-T397 VanDerWaalsContact CE-OG1 3.23Å; K136-T397 WeakPolarHBondContact CE-OG1 3.37Å; K136-T397 PolarHBondContact NZ-OG1 3.18Å; K136-G399 WeakPolarHBondContact CB-O 3.23Å; K136-D400 WeakPolarHBondContact CD-OD1 3.44Å; K136-D400 WeakPolarHBondContact CE-OD1 3.34Å; K136-D400 IonicContact NZ-OD1 3.99Å; K136-D400 PolarHBondContact NZ-OD1 2.85Å; K136-D400 IonicContact NZ-OD2 2.95Å; K136-D400 PolarHBondContact NZ-OD2 3.03Å; K136-L403 HydrophobicContact CB-CB 4.1Å; K136-L403 HydrophobicContact CD-CB 4.24Å; K136-L403 HydrophobicContact CD-CD2 3.79Å
137	I	89	Confident	86	Confident	67 Å²	67	41.7 Å²	41.7	34%	0.344	24%	0.239	S	C	.	.	H	α-helix	trans	-62.3	-38.4	-176.4	-59.6	165.6	0	0	0	110.9	F133 V134 F135 V139 D140 C141 P147 I162	F133-I137 WeakPolarHBondContact O-CG1 3.42Å; F133-I137 PolarHBondContact O-N 3.3Å; F133-I137 VanDerWaalsContact O-N 3.09Å; V134-I137 PolarHBondContact O-N 3.22Å; F135-I137 VanDerWaalsContact C-N 3.33Å; F135-I137 PolarHBondContact O-N 3.22Å; I137-V139 VanDerWaalsContact C-N 3.3Å; I137-V139 PolarHBondContact O-N 3.47Å; I137-D140 PolarHBondContact O-N 2.92Å; I137-C141 PolarHBondContact O-N 2.77Å; I137-C141 PolarHBondContact O-SG 3.16Å; I137-P147 HydrophobicContact CG2-CG 3.78Å; I137-I162 HydrophobicContact CB-CD1 4.47Å; I137-I162 HydrophobicContact CB-CG2 4.35Å; I137-I162 HydrophobicContact CG2-CD1 3.63Å
138	A	88.7	Confident	84.3	Confident	2 Å²	2	48.5 Å²	48.5	2%	0.017	27%	0.273	C	S	.	.	H	α-helix	trans	-61.6	-39	175.5	0	0	0	0	0	112.3	V134 F135 K136 L142 I162 L163	V134-A138 PolarHBondContact O-N 2.83Å; F135-A138 PolarHBondContact O-N 2.7Å; K136-A138 VanDerWaalsContact C-N 3.29Å; K136-A138 PolarHBondContact O-N 2.85Å; A138-L142 WeakPolarHBondContact O-CG 3.28Å; A138-L142 PolarHBondContact O-N 2.79Å; A138-I162 HydrophobicContact CB-CB 4.16Å; A138-I162 HydrophobicContact CB-CG2 3.78Å; A138-L163 HydrophobicContact CB-CD2 3.9Å; A138-L163 HydrophobicContact CB-CG 3.99Å
139	V	90.3	Very high	82.9	Confident	26 Å²	26	54.9 Å²	54.9	16%	0.158	31%	0.307	C	S	.	.	H	α-helix	trans	-70.8	-40.6	177.6	175	0	0	0	0	111.1	F135 K136 I137 L142 S143 V402	F135-V139 HydrophobicContact CD2-CG2 4.22Å; F135-V139 HydrophobicContact CE2-CG2 4.02Å; F135-V139 WeakPolarHBondContact O-CG2 3.34Å; F135-V139 PolarHBondContact O-N 2.75Å; K136-V139 WeakPolarHBondContact O-CB 3.42Å; K136-V139 PolarHBondContact O-N 3.38Å; I137-V139 VanDerWaalsContact C-N 3.3Å; I137-V139 PolarHBondContact O-N 3.47Å; V139-L142 PolarHBondContact O-N 2.78Å; V139-S143 WeakPolarHBondContact O-CB 3.24Å; V139-S143 PolarHBondContact O-N 2.86Å; V139-S143 PolarHBondContact O-OG 3.01Å; V139-V402 HydrophobicContact CG1-CG2 4.44Å; V139-V402 HydrophobicContact CG2-CG1 4.46Å; V139-V402 HydrophobicContact CG2-CG2 4.13Å
140	D	88	Confident	81.5	Confident	14 Å²	14	56.8 Å²	56.8	8%	0.075	32%	0.316	C	S	.	.	H	α-helix	trans	-62	-43.6	176.3	-64.1	-20	0	0	0	110.8	K136 I137 L142 S143 G144 E145 T397 G399	K136-D140 WeakPolarHBondContact CE-OD2 3.42Å; K136-D140 VanDerWaalsContact CG-OD2 3.28Å; K136-D140 WeakPolarHBondContact CG-OD2 3.14Å; K136-D140 IonicContact NZ-OD2 2.81Å; K136-D140 VanDerWaalsContact O-CG 3.28Å; K136-D140 PolarHBondContact O-N 3.43Å; I137-D140 PolarHBondContact O-N 2.92Å; D140-L142 VanDerWaalsContact C-N 3.32Å; D140-L142 PolarHBondContact O-N 2.8Å; D140-S143 PolarHBondContact O-N 2.76Å; D140-S143 VanDerWaalsContact O-N 3.11Å; D140-G144 PolarHBondContact O-N 2.73Å; D140-E145 HydrophobicContact CB-CB 4.34Å; D140-E145 CarbonylContact O-C 3.52Å; D140-E145 PolarHBondContact O-N 2.87Å; D140-T397 VanDerWaalsContact CG-OG1 3.26Å; D140-T397 WeakPolarHBondContact OD1-CB 3.5Å; D140-T397 PolarHBondContact OD1-OG1 2.82Å; D140-T397 PolarHBondContact OD2-OG1 3.25Å; D140-G399 VanDerWaalsContact OD1-CA 3.23Å; D140-G399 WeakPolarHBondContact OD1-CA 3.33Å; D140-G399 PolarHBondContact OD1-N 3.41Å; D140-G399 VanDerWaalsContact OD1-N 3.12Å
141	C	84.9	Confident	80	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-57.5	-41.3	173.6	-72.9	0	0	0	0	112.9	I137 S143 T146 P147 A159 I162	I137-C141 PolarHBondContact O-N 2.77Å; I137-C141 PolarHBondContact O-SG 3.16Å; C141-S143 VanDerWaalsContact C-N 3.33Å; C141-T146 HydrophobicContact CB-CG2 4.21Å; C141-P147 WeakPolarHBondContact SG-CD 3.34Å; C141-A159 HydrophobicContact CB-CB 4.37Å; C141-I162 VanDerWaalsContact SG-CD1 3.54Å
142	L	84.1	Confident	78.8	Confident	112 Å²	112	63.4 Å²	63.4	59%	0.586	36%	0.363	S	S	*	.	H	α-helix	trans	-76.1	-21.5	178.8	-69.7	173.3	0	0	0	113.2	A138 V139 D140 G144 A159	A138-L142 WeakPolarHBondContact O-CG 3.28Å; A138-L142 PolarHBondContact O-N 2.79Å; V139-L142 PolarHBondContact O-N 2.78Å; D140-L142 VanDerWaalsContact C-N 3.32Å; D140-L142 PolarHBondContact O-N 2.8Å; L142-G144 VanDerWaalsContact C-N 3.33Å; L142-A159 HydrophobicContact CD1-CB 4.19Å; L142-A159 HydrophobicContact CD2-CB 3.73Å; L142-A159 HydrophobicContact CG-CB 3.7Å
143	S	83.5	Confident	77.8	Confident	65 Å²	65	66 Å²	66	46%	0.455	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	2.3	179.6	-52.6	0	0	0	0	113.1	V139 D140 C141	V139-S143 WeakPolarHBondContact O-CB 3.24Å; V139-S143 PolarHBondContact O-N 2.86Å; V139-S143 PolarHBondContact O-OG 3.01Å; D140-S143 PolarHBondContact O-N 2.76Å; D140-S143 VanDerWaalsContact O-N 3.11Å; C141-S143 VanDerWaalsContact C-N 3.33Å
144	G	74.5	Confident	77.1	Confident	62 Å²	62	66.1 Å²	66.1	64%	0.639	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.6	3.4	179	0	0	0	0	0	114.9	D140 L142 T146	D140-G144 PolarHBondContact O-N 2.73Å; L142-G144 VanDerWaalsContact C-N 3.33Å; G144-T146 PolarHBondContact O-N 3.21Å
145	E	68.9	Low	76.3	Confident	90 Å²	90	68.6 Å²	68.6	42%	0.421	40%	0.402	S	S	.	.			trans	-101.3	61	177.1	-64.7	-171.3	160.9	0	0	110.4	D140 P147 T397	D140-E145 HydrophobicContact CB-CB 4.34Å; D140-E145 CarbonylContact O-C 3.52Å; D140-E145 PolarHBondContact O-N 2.87Å; E145-P147 WeakPolarHBondContact O-CD 3.43Å; E145-T397 WeakPolarHBondContact OE2-CB 3.47Å; E145-T397 WeakPolarHBondContact OE2-CG2 3.46Å
146	T	62.5	Low	75.8	Confident	54 Å²	54	68.1 Å²	68.1	33%	0.331	41%	0.409	S	S	.	.			trans	-65.7	127.8	178.6	34.6	0	0	0	0	110.8	C141 G144 L148 P155	C141-T146 HydrophobicContact CB-CG2 4.21Å; G144-T146 PolarHBondContact O-N 3.21Å; T146-L148 PolarHBondContact O-N 2.95Å; T146-P155 HydrophobicContact CG2-CB 4.46Å; T146-P155 HydrophobicContact CG2-CG 4.47Å
147	P	64	Low	75.4	Confident	48 Å²	48	70.1 Å²	70.1	31%	0.312	42%	0.423	S	S	.	.			trans	-55.4	140.3	170.5	-22.6	31.7	0	0	0	110.3	I137 C141 E145 L149 L150	I137-P147 HydrophobicContact CG2-CG 3.78Å; C141-P147 WeakPolarHBondContact SG-CD 3.34Å; E145-P147 WeakPolarHBondContact O-CD 3.43Å; P147-L149 PolarHBondContact O-N 2.96Å; P147-L150 PolarHBondContact O-N 3.4Å
148	L	58.8	Low	75.2	Confident	170 Å²	170	67 Å²	67	89%	0.89	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-47.8	-32.1	-179.9	-102.7	141.8	0	0	0	113.8	T146 L150 G151	T146-L148 PolarHBondContact O-N 2.95Å; L148-L150 VanDerWaalsContact C-N 3.26Å; L148-L150 PolarHBondContact O-N 3.29Å; L148-G151 PolarHBondContact O-N 2.94Å
149	L	60.9	Low	75	Confident	168 Å²	168	67 Å²	67	88%	0.88	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-70.2	-16	179.4	-64.9	175.5	0	0	0	114.7	P147	P147-L149 PolarHBondContact O-N 2.96Å
150	L	63.1	Low	74.9	Confident	49 Å²	49	69.6 Å²	69.6	26%	0.257	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-117.4	10.7	-178.6	-63.8	173.2	0	0	0	112.1	P147 L148 D152 T153 A158 I162	P147-L150 PolarHBondContact O-N 3.4Å; L148-L150 VanDerWaalsContact C-N 3.26Å; L148-L150 PolarHBondContact O-N 3.29Å; L150-D152 PolarHBondContact O-N 2.97Å; L150-T153 PolarHBondContact O-N 3.1Å; L150-T153 VanDerWaalsContact O-N 3.09Å; L150-T153 PolarHBondContact O-OG1 2.76Å; L150-A158 HydrophobicContact CB-CB 4.17Å; L150-A158 HydrophobicContact CD1-CB 4.06Å; L150-I162 HydrophobicContact CD1-CD1 3.67Å; L150-I162 HydrophobicContact CD1-CG1 4.3Å
151	G	61.3	Low	74.9	Confident	46 Å²	46	72.9 Å²	72.9	47%	0.474	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-29.6	-173.5	0	0	0	0	0	114.5	L148	L148-G151 PolarHBondContact O-N 2.94Å
152	D	68.6	Low	75.1	Confident	178 Å²	178	73.6 Å²	73.6	95%	0.952	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-11.7	-178.9	-63.4	-19.1	0	0	0	113.4	L150	L150-D152 PolarHBondContact O-N 2.97Å
153	T	71.3	Confident	75.5	Confident	58 Å²	58	71.9 Å²	71.9	36%	0.356	44%	0.439	S	S	.	.	S	Bend	trans	-93.1	143.3	178	19.6	0	0	0	0	110.9	L150 V157	L150-T153 PolarHBondContact O-N 3.1Å; L150-T153 VanDerWaalsContact O-N 3.09Å; L150-T153 PolarHBondContact O-OG1 2.76Å; T153-V157 HydrophobicContact CG2-CG1 4.21Å
154	S	78.7	Confident	76	Confident	57 Å²	57	74.4 Å²	74.4	40%	0.399	45%	0.446	S	S	.	.			trans	-57.5	137.6	172.2	68.2	0	0	0	0	109.8	S156 V157 A158	S154-S156 PolarHBondContact O-N 3.21Å; S154-S156 PolarHBondContact OG-OG 3.08Å; S154-V157 PolarHBondContact O-N 3.05Å; S154-V157 WeakPolarHBondContact OG-CG2 3.17Å; S154-A158 PolarHBondContact O-N 2.71Å
155	P	76.3	Confident	76.8	Confident	67 Å²	67	73.2 Å²	73.2	44%	0.435	43%	0.428	S	S	.	.	H	α-helix	trans	-53.3	-32.2	-175.2	-30.8	35.2	0	0	0	114.2	T146 A159	T146-P155 HydrophobicContact CG2-CB 4.46Å; T146-P155 HydrophobicContact CG2-CG 4.47Å; P155-A159 VanDerWaalsContact O-CB 3.25Å; P155-A159 WeakPolarHBondContact O-CB 3.43Å; P155-A159 PolarHBondContact O-N 2.75Å
156	S	81.7	Confident	77.9	Confident	70 Å²	70	71.7 Å²	71.7	49%	0.49	42%	0.419	S	S	.	.	H	α-helix	trans	-67.6	-41.2	176.4	57.9	0	0	0	0	113.2	S154 T160	S154-S156 PolarHBondContact O-N 3.21Å; S154-S156 PolarHBondContact OG-OG 3.08Å; S156-T160 WeakPolarHBondContact O-CB 3.44Å; S156-T160 PolarHBondContact O-N 2.96Å; S156-T160 PolarHBondContact O-OG1 2.93Å
157	V	84.9	Confident	79.4	Confident	70 Å²	70	70.8 Å²	70.8	42%	0.424	42%	0.42	S	S	.	.	H	α-helix	trans	-70.7	-42	177.6	173.2	0	0	0	0	110.4	T153 S154 T160 T161	T153-V157 HydrophobicContact CG2-CG1 4.21Å; S154-V157 PolarHBondContact O-N 3.05Å; S154-V157 WeakPolarHBondContact OG-CG2 3.17Å; V157-T160 PolarHBondContact O-N 3.39Å; V157-T161 WeakPolarHBondContact O-CB 3.22Å; V157-T161 PolarHBondContact O-N 3.45Å; V157-T161 PolarHBondContact O-OG1 3.11Å
158	A	83.6	Confident	80.9	Confident	1 Å²	1	73.8 Å²	73.8	1%	0.008	43%	0.433	C	S	.	.	H	α-helix	trans	-57.3	-52.6	173.3	0	0	0	0	0	111	L150 S154 T160 T161 I162	L150-A158 HydrophobicContact CB-CB 4.17Å; L150-A158 HydrophobicContact CD1-CB 4.06Å; S154-A158 PolarHBondContact O-N 2.71Å; A158-T160 PolarHBondContact O-N 3.47Å; A158-T161 PolarHBondContact O-N 2.79Å; A158-I162 WeakPolarHBondContact O-CD1 3.34Å; A158-I162 VanDerWaalsContact O-CG1 3.29Å; A158-I162 WeakPolarHBondContact O-CG1 3.44Å; A158-I162 PolarHBondContact O-N 2.84Å
159	A	84.6	Confident	82.6	Confident	3 Å²	3	69 Å²	69	3%	0.025	41%	0.405	C	S	.	.	H	α-helix	trans	-60.3	-43.2	178.4	0	0	0	0	0	112.4	C141 L142 P155 T161 I162 L163	C141-A159 HydrophobicContact CB-CB 4.37Å; L142-A159 HydrophobicContact CD1-CB 4.19Å; L142-A159 HydrophobicContact CD2-CB 3.73Å; L142-A159 HydrophobicContact CG-CB 3.7Å; P155-A159 VanDerWaalsContact O-CB 3.25Å; P155-A159 WeakPolarHBondContact O-CB 3.43Å; P155-A159 PolarHBondContact O-N 2.75Å; A159-T161 PolarHBondContact O-N 3.13Å; A159-I162 PolarHBondContact O-N 2.87Å; A159-L163 WeakPolarHBondContact O-CB 3.36Å; A159-L163 VanDerWaalsContact O-CG 3.27Å; A159-L163 WeakPolarHBondContact O-CG 3.48Å; A159-L163 PolarHBondContact O-N 3.4Å
160	T	87.7	Confident	84.2	Confident	80 Å²	80	68.1 Å²	68.1	49%	0.491	39%	0.39	S	S	.	.	H	α-helix	trans	-61.4	-43.5	178.1	-57.2	0	0	0	0	111.6	S156 V157 A158 I162 L163 I164	S156-T160 WeakPolarHBondContact O-CB 3.44Å; S156-T160 PolarHBondContact O-N 2.96Å; S156-T160 PolarHBondContact O-OG1 2.93Å; V157-T160 PolarHBondContact O-N 3.39Å; A158-T160 PolarHBondContact O-N 3.47Å; T160-I162 VanDerWaalsContact C-N 3.35Å; T160-I162 PolarHBondContact O-N 3.32Å; T160-L163 PolarHBondContact O-N 3.35Å; T160-I164 HydrophobicContact CG2-CD1 4.32Å; T160-I164 WeakPolarHBondContact O-CG1 3.46Å; T160-I164 PolarHBondContact O-N 3.13Å
161	T	88.6	Confident	85.7	Confident	82 Å²	82	68.7 Å²	68.7	50%	0.503	40%	0.402	S	S	.	.	H	α-helix	trans	-62.7	-42.3	177.9	-55.3	0	0	0	0	111.5	V157 A158 A159 I164 S165	V157-T161 WeakPolarHBondContact O-CB 3.22Å; V157-T161 PolarHBondContact O-N 3.45Å; V157-T161 PolarHBondContact O-OG1 3.11Å; A158-T161 PolarHBondContact O-N 2.79Å; A159-T161 PolarHBondContact O-N 3.13Å; T161-I164 PolarHBondContact O-N 2.94Å; T161-S165 PolarHBondContact O-N 3.31Å; T161-S165 VanDerWaalsContact O-N 3.07Å
162	I	90.1	Very high	87.4	Confident	16 Å²	16	69.4 Å²	69.4	8%	0.082	40%	0.397	C	S	.	.	H	α-helix	trans	-68.7	-35.4	176.9	-62.7	159.2	0	0	0	111.4	V134 I137 A138 C141 L150 A158 A159 T160 S165 Y166	V134-I162 HydrophobicContact CG1-CG2 3.6Å; V134-I162 WeakPolarHBondContact CG1-O 3.42Å; V134-I162 WeakPolarHBondContact O-CG2 3.47Å; I137-I162 HydrophobicContact CB-CD1 4.47Å; I137-I162 HydrophobicContact CB-CG2 4.35Å; I137-I162 HydrophobicContact CG2-CD1 3.63Å; A138-I162 HydrophobicContact CB-CB 4.16Å; A138-I162 HydrophobicContact CB-CG2 3.78Å; C141-I162 VanDerWaalsContact SG-CD1 3.54Å; L150-I162 HydrophobicContact CD1-CD1 3.67Å; L150-I162 HydrophobicContact CD1-CG1 4.3Å; A158-I162 WeakPolarHBondContact O-CD1 3.34Å; A158-I162 VanDerWaalsContact O-CG1 3.29Å; A158-I162 WeakPolarHBondContact O-CG1 3.44Å; A158-I162 PolarHBondContact O-N 2.84Å; A159-I162 PolarHBondContact O-N 2.87Å; T160-I162 VanDerWaalsContact C-N 3.35Å; T160-I162 PolarHBondContact O-N 3.32Å; I162-S165 PolarHBondContact O-N 2.9Å; I162-S165 PolarHBondContact O-OG 3.14Å; I162-Y166 PolarHBondContact O-N 2.93Å
163	L	91.4	Very high	88.5	Confident	75 Å²	75	61 Å²	61	39%	0.393	35%	0.352	S	S	.	.	H	α-helix	trans	-69.6	-33.2	176	-72.2	171.7	0	0	0	112.4	F135 A138 A159 T160 Y166 G167	F135-L163 HydrophobicContact CD2-CD2 4.14Å; F135-L163 HydrophobicContact CE2-CD2 4.26Å; A138-L163 HydrophobicContact CB-CD2 3.9Å; A138-L163 HydrophobicContact CB-CG 3.99Å; A159-L163 WeakPolarHBondContact O-CB 3.36Å; A159-L163 VanDerWaalsContact O-CG 3.27Å; A159-L163 WeakPolarHBondContact O-CG 3.48Å; A159-L163 PolarHBondContact O-N 3.4Å; T160-L163 PolarHBondContact O-N 3.35Å; L163-Y166 WeakPolarHBondContact O-CB 3.25Å; L163-Y166 PolarHBondContact O-N 3.03Å; L163-G167 PolarHBondContact O-N 2.83Å
164	I	93.4	Very high	89.5	Confident	118 Å²	118	61.3 Å²	61.3	61%	0.605	36%	0.357	S	S	*	.	H	α-helix	trans	-64.2	-44.5	170.1	-67.2	166.5	0	0	0	110	T160 T161 Y166 G167 L168	T160-I164 HydrophobicContact CG2-CD1 4.32Å; T160-I164 WeakPolarHBondContact O-CG1 3.46Å; T160-I164 PolarHBondContact O-N 3.13Å; T161-I164 PolarHBondContact O-N 2.94Å; I164-Y166 VanDerWaalsContact C-N 3.33Å; I164-Y166 PolarHBondContact O-N 3.04Å; I164-G167 PolarHBondContact O-N 2.68Å; I164-G167 VanDerWaalsContact O-N 3.17Å; I164-L168 PolarHBondContact O-N 2.94Å
165	S	91.5	Very high	90.3	Very high	37 Å²	37	60.6 Å²	60.6	26%	0.259	36%	0.358	S	S	.	.	H	α-helix	trans	-64.9	-36.8	177.2	76.8	0	0	0	0	111.8	V134 T161 I162 G167 L168 F169	V134-S165 VanDerWaalsContact CG1-OG 3.28Å; V134-S165 WeakPolarHBondContact CG1-OG 3.15Å; T161-S165 PolarHBondContact O-N 3.31Å; T161-S165 VanDerWaalsContact O-N 3.07Å; I162-S165 PolarHBondContact O-N 2.9Å; I162-S165 PolarHBondContact O-OG 3.14Å; S165-G167 VanDerWaalsContact C-N 3.31Å; S165-G167 PolarHBondContact O-N 3.3Å; S165-L168 WeakPolarHBondContact O-CB 3.24Å; S165-L168 PolarHBondContact O-N 3.38Å; S165-L168 VanDerWaalsContact O-N 3.09Å; S165-F169 VanDerWaalsContact O-CD2 3.23Å; S165-F169 WeakPolarHBondContact O-CD2 3.42Å; S165-F169 PolarHBondContact O-N 2.84Å
166	Y	92.7	Very high	91.2	Very high	59 Å²	59	59.2 Å²	59.2	23%	0.231	35%	0.347	C	S	.	.	H	α-helix	trans	-53.5	-47.6	170.9	165.3	-88.4	0	0	0	111.6	V131 F135 I162 L163 I164 L168 F169 R170	V131-Y166 HydrophobicContact CG1-CD2 3.63Å; V131-Y166 HydrophobicContact CG1-CE2 3.22Å; F135-Y166 HydrophobicContact CB-CD2 3.9Å; F135-Y166 HydrophobicContact CB-CE2 4.08Å; F135-Y166 HydrophobicContact CG-CE2 4.44Å; I162-Y166 PolarHBondContact O-N 2.93Å; L163-Y166 WeakPolarHBondContact O-CB 3.25Å; L163-Y166 PolarHBondContact O-N 3.03Å; I164-Y166 VanDerWaalsContact C-N 3.33Å; I164-Y166 PolarHBondContact O-N 3.04Å; Y166-L168 PolarHBondContact O-N 3.46Å; Y166-F169 PolarHBondContact O-N 3.02Å; Y166-R170 WeakPolarHBondContact O-CB 3.29Å; Y166-R170 PolarHBondContact O-N 2.89Å; Y166-R170 PolarHBondContact OH-NH1 3.13Å
167	G	94.6	Very high	91.7	Very high	35 Å²	35	57.4 Å²	57.4	36%	0.361	33%	0.332	S	S	.	.	H	α-helix	trans	-60.3	-43.2	175.7	0	0	0	0	0	112.6	L163 I164 S165 R170 A171	L163-G167 PolarHBondContact O-N 2.83Å; I164-G167 PolarHBondContact O-N 2.68Å; I164-G167 VanDerWaalsContact O-N 3.17Å; S165-G167 VanDerWaalsContact C-N 3.31Å; S165-G167 PolarHBondContact O-N 3.3Å; G167-R170 PolarHBondContact O-N 3.33Å; G167-A171 WeakPolarHBondContact O-CB 2.97Å; G167-A171 PolarHBondContact O-N 2.83Å
168	L	95.5	Very high	92.1	Very high	110 Å²	110	59.9 Å²	59.9	58%	0.576	34%	0.339	S	S	*	.	H	α-helix	trans	-65.2	-44.4	178.1	-176.9	63.6	0	0	0	112.7	I164 S165 Y166 A171 T172	I164-L168 PolarHBondContact O-N 2.94Å; S165-L168 WeakPolarHBondContact O-CB 3.24Å; S165-L168 PolarHBondContact O-N 3.38Å; S165-L168 VanDerWaalsContact O-N 3.09Å; Y166-L168 PolarHBondContact O-N 3.46Å; L168-A171 PolarHBondContact O-N 3.08Å; L168-T172 VanDerWaalsContact O-CB 3.29Å; L168-T172 WeakPolarHBondContact O-CB 3.42Å; L168-T172 PolarHBondContact O-N 3.26Å; L168-T172 PolarHBondContact O-OG1 3.19Å
169	F	94.5	Very high	92.6	Very high	69 Å²	69	64.1 Å²	64.1	30%	0.303	36%	0.361	S	S	.	.	H	α-helix	trans	-62.4	-44.9	176.5	-88	-110.9	0	0	0	110.7	V127 L130 V131 V134 S165 Y166 A171 T172 A173	V127-F169 HydrophobicContact CG1-CB 4.26Å; V127-F169 HydrophobicContact CG1-CD1 3.92Å; V127-F169 HydrophobicContact CG1-CG 4.42Å; V127-F169 VanDerWaalsContact CG1-O 3.23Å; V127-F169 WeakPolarHBondContact CG1-O 3.39Å; L130-F169 HydrophobicContact CB-CD1 4.1Å; L130-F169 HydrophobicContact CB-CE1 4.15Å; L130-F169 HydrophobicContact CD1-CE1 4.02Å; V131-F169 HydrophobicContact CG2-CB 3.89Å; V134-F169 HydrophobicContact CG2-CD1 4.46Å; V134-F169 HydrophobicContact CG2-CD2 4.49Å; V134-F169 HydrophobicContact CG2-CG 4.4Å; S165-F169 VanDerWaalsContact O-CD2 3.23Å; S165-F169 WeakPolarHBondContact O-CD2 3.42Å; S165-F169 PolarHBondContact O-N 2.84Å; Y166-F169 PolarHBondContact O-N 3.02Å; F169-A171 PolarHBondContact O-N 3.32Å; F169-T172 PolarHBondContact O-N 2.97Å; F169-A173 WeakPolarHBondContact O-CB 3.37Å; F169-A173 PolarHBondContact O-N 2.91Å
170	R	93.2	Very high	93	Very high	150 Å²	150	64.7 Å²	64.7	57%	0.566	36%	0.362	S	S	*	.	H	α-helix	trans	-62.3	-44.1	176.9	-171.2	177.2	177.6	165.5	-2.8	111.9	V131 Y166 G167 S174	V131-R170 HydrophobicContact CG2-CB 4.28Å; Y166-R170 WeakPolarHBondContact O-CB 3.29Å; Y166-R170 PolarHBondContact O-N 2.89Å; Y166-R170 PolarHBondContact OH-NH1 3.13Å; G167-R170 PolarHBondContact O-N 3.33Å; R170-S174 PolarHBondContact O-N 3.22Å; R170-S174 VanDerWaalsContact O-N 3.11Å
171	A	95.7	Very high	93.2	Very high	61 Å²	61	63 Å²	63	50%	0.504	35%	0.352	S	S	.	.	H	α-helix	trans	-63.7	-41.7	175.8	0	0	0	0	0	111.9	G167 L168 F169 S174 G175	G167-A171 WeakPolarHBondContact O-CB 2.97Å; G167-A171 PolarHBondContact O-N 2.83Å; L168-A171 PolarHBondContact O-N 3.08Å; F169-A171 PolarHBondContact O-N 3.32Å; A171-S174 PolarHBondContact O-N 2.57Å; A171-G175 PolarHBondContact O-N 2.98Å
172	T	96	Very high	93.4	Very high	61 Å²	61	62.2 Å²	62.2	37%	0.374	35%	0.354	S	S	.	.	H	α-helix	trans	-65	-46	178.4	-58.2	0	0	0	0	111.5	V127 L168 F169 S174 G175 L176	V127-T172 HydrophobicContact CG1-CG2 4.45Å; L168-T172 VanDerWaalsContact O-CB 3.29Å; L168-T172 WeakPolarHBondContact O-CB 3.42Å; L168-T172 PolarHBondContact O-N 3.26Å; L168-T172 PolarHBondContact O-OG1 3.19Å; F169-T172 PolarHBondContact O-N 2.97Å; T172-S174 VanDerWaalsContact C-N 3.31Å; T172-S174 PolarHBondContact O-N 3.19Å; T172-G175 PolarHBondContact O-N 3.48Å; T172-L176 HydrophobicContact CG2-CD1 4.13Å; T172-L176 HydrophobicContact CG2-CG 4.43Å; T172-L176 WeakPolarHBondContact O-CG 3.02Å; T172-L176 PolarHBondContact O-N 3.32Å
173	A	92.5	Very high	93.6	Very high	1 Å²	1	63 Å²	63	1%	0.008	36%	0.359	C	S	.	.	H	α-helix	trans	-57.6	-45.1	175.1	0	0	0	0	0	111.2	S124 V127 N128 F169 N177	S124-A173 PolarHBondContact OG-O 2.69Å; V127-A173 HydrophobicContact CB-CB 4.12Å; V127-A173 HydrophobicContact CG1-CB 3.87Å; N128-A173 HydrophobicContact CB-CB 4.16Å; F169-A173 WeakPolarHBondContact O-CB 3.37Å; F169-A173 PolarHBondContact O-N 2.91Å; A173-N177 PolarHBondContact O-N 3.35Å; A173-N177 VanDerWaalsContact O-N 3.08Å; A173-N177 PolarHBondContact O-ND2 2.82Å
174	S	92.7	Very high	93.6	Very high	66 Å²	66	59.7 Å²	59.7	46%	0.462	34%	0.342	S	S	.	.	H	α-helix	trans	-62.6	-46.2	175.8	-164.7	0	0	0	0	112.2	R170 A171 T172 L176 N177 E178	R170-S174 PolarHBondContact O-N 3.22Å; R170-S174 VanDerWaalsContact O-N 3.11Å; A171-S174 PolarHBondContact O-N 2.57Å; T172-S174 VanDerWaalsContact C-N 3.31Å; T172-S174 PolarHBondContact O-N 3.19Å; S174-L176 PolarHBondContact O-N 2.81Å; S174-N177 WeakPolarHBondContact O-CB 3.45Å; S174-N177 PolarHBondContact O-N 3.16Å; S174-E178 PolarHBondContact O-N 2.96Å
175	G	95.9	Very high	93.5	Very high	41 Å²	41	55.9 Å²	55.9	42%	0.423	33%	0.328	S	S	.	.	H	α-helix	trans	-61.9	-41.6	179.2	0	0	0	0	0	113	A171 T172 N177 E178 L179	A171-G175 PolarHBondContact O-N 2.98Å; T172-G175 PolarHBondContact O-N 3.48Å; G175-N177 VanDerWaalsContact C-N 3.34Å; G175-E178 PolarHBondContact O-N 3.26Å; G175-L179 WeakPolarHBondContact O-CB 2.99Å; G175-L179 PolarHBondContact O-N 2.73Å
176	L	95.1	Very high	93.5	Very high	38 Å²	38	58.9 Å²	58.9	20%	0.199	34%	0.336	C	S	.	.	H	α-helix	trans	-64.7	-37.4	174.6	-68.9	173	0	0	0	112.2	L120 V127 T172 S174 L179 R180	L120-L176 HydrophobicContact CD2-CD2 3.76Å; V127-L176 HydrophobicContact CG2-CD1 4.29Å; T172-L176 HydrophobicContact CG2-CD1 4.13Å; T172-L176 HydrophobicContact CG2-CG 4.43Å; T172-L176 WeakPolarHBondContact O-CG 3.02Å; T172-L176 PolarHBondContact O-N 3.32Å; S174-L176 PolarHBondContact O-N 2.81Å; L176-L179 PolarHBondContact O-N 3.38Å; L176-R180 WeakPolarHBondContact O-CB 3.48Å; L176-R180 PolarHBondContact O-N 2.48Å
177	N	90.9	Very high	93.3	Very high	32 Å²	32	56.1 Å²	56.1	17%	0.171	33%	0.326	C	S	.	.	H	α-helix	trans	-64.1	-43.5	175	-88.2	-34.1	0	0	0	112.2	S124 A173 S174 G175 R180 T181	S124-N177 WeakPolarHBondContact CB-OD1 3.46Å; S124-N177 PolarHBondContact OG-ND2 3.03Å; S124-N177 PolarHBondContact OG-OD1 3.46Å; A173-N177 PolarHBondContact O-N 3.35Å; A173-N177 VanDerWaalsContact O-N 3.08Å; A173-N177 PolarHBondContact O-ND2 2.82Å; S174-N177 WeakPolarHBondContact O-CB 3.45Å; S174-N177 PolarHBondContact O-N 3.16Å; G175-N177 VanDerWaalsContact C-N 3.34Å; N177-R180 WeakPolarHBondContact O-CB 3.26Å; N177-R180 PolarHBondContact O-N 2.95Å; N177-T181 PolarHBondContact O-N 3.37Å; N177-T181 VanDerWaalsContact O-N 3.14Å; N177-T181 PolarHBondContact O-OG1 2.99Å; N177-T181 VanDerWaalsContact O-OG1 3.08Å
178	E	93.1	Very high	93	Very high	122 Å²	122	54.6 Å²	54.6	57%	0.57	31%	0.31	S	S	*	.	H	α-helix	trans	-69	-39.5	176.9	-67	-52.2	142.4	0	0	111.9	S174 G175 R180 T181 A182	S174-E178 PolarHBondContact O-N 2.96Å; G175-E178 PolarHBondContact O-N 3.26Å; E178-R180 PolarHBondContact O-N 3.13Å; E178-T181 WeakPolarHBondContact O-CB 3.45Å; E178-T181 PolarHBondContact O-N 2.92Å; E178-T181 VanDerWaalsContact O-N 3.13Å; E178-A182 PolarHBondContact O-N 3.15Å
179	L	95	Very high	92.8	Very high	90 Å²	90	54.6 Å²	54.6	47%	0.471	31%	0.31	S	S	.	.	H	α-helix	trans	-63.3	-41.9	175.7	-173.2	61.9	0	0	0	111.5	L120 G175 L176 T181 A182 V183	L120-L179 HydrophobicContact CD1-CB 4.32Å; L120-L179 HydrophobicContact CD1-CD2 4.07Å; L120-L179 HydrophobicContact CD1-CG 3.81Å; L120-L179 HydrophobicContact CD2-CD2 3.87Å; L120-L179 HydrophobicContact CD2-CG 4.42Å; G175-L179 WeakPolarHBondContact O-CB 2.99Å; G175-L179 PolarHBondContact O-N 2.73Å; L176-L179 PolarHBondContact O-N 3.38Å; L179-T181 VanDerWaalsContact C-N 3.29Å; L179-T181 PolarHBondContact O-N 3.34Å; L179-A182 PolarHBondContact O-N 3.05Å; L179-V183 HydrophobicContact CD1-CG2 4.42Å; L179-V183 HydrophobicContact CG-CG2 4.43Å; L179-V183 WeakPolarHBondContact O-CB 3.28Å; L179-V183 VanDerWaalsContact O-CG2 3.27Å; L179-V183 WeakPolarHBondContact O-CG2 3.34Å; L179-V183 PolarHBondContact O-N 2.88Å
180	R	93.1	Very high	92.5	Very high	16 Å²	16	51.9 Å²	51.9	6%	0.06	30%	0.299	C	S	.	.	H	α-helix	trans	-53.6	-48.6	170.8	170.3	-163.2	71.6	167.2	-1.2	110.7	A117 L120 L121 L176 N177 E178 A182 V183 F184 V238 F239	A117-R180 HydrophobicContact CB-CG 4.17Å; A117-R180 WeakPolarHBondContact O-CG 3.34Å; L120-R180 HydrophobicContact CB-CB 3.85Å; L121-R180 HydrophobicContact CB-CG 4.4Å; L176-R180 WeakPolarHBondContact O-CB 3.48Å; L176-R180 PolarHBondContact O-N 2.48Å; N177-R180 WeakPolarHBondContact O-CB 3.26Å; N177-R180 PolarHBondContact O-N 2.95Å; E178-R180 PolarHBondContact O-N 3.13Å; R180-A182 PolarHBondContact O-N 3.34Å; R180-V183 PolarHBondContact O-N 3.49Å; R180-F184 WeakPolarHBondContact O-CB 3.46Å; R180-F184 PolarHBondContact O-N 3.07Å; R180-V238 PolarHBondContact NH1-O 3.29Å; R180-V238 VanDerWaalsContact NH1-O 3.09Å; R180-F239 HydrophobicContact CG-CE1 4.25Å
181	T	91.8	Very high	92.2	Very high	45 Å²	45	44.8 Å²	44.8	28%	0.276	27%	0.273	S	S	.	.	H	α-helix	trans	-58.7	-47.8	179.8	-59.2	0	0	0	0	111.1	N177 E178 L179 V183 F184 A185 F239	N177-T181 PolarHBondContact O-N 3.37Å; N177-T181 VanDerWaalsContact O-N 3.14Å; N177-T181 PolarHBondContact O-OG1 2.99Å; N177-T181 VanDerWaalsContact O-OG1 3.08Å; E178-T181 WeakPolarHBondContact O-CB 3.45Å; E178-T181 PolarHBondContact O-N 2.92Å; E178-T181 VanDerWaalsContact O-N 3.13Å; L179-T181 VanDerWaalsContact C-N 3.29Å; L179-T181 PolarHBondContact O-N 3.34Å; T181-V183 PolarHBondContact O-N 3.3Å; T181-F184 PolarHBondContact O-N 3.14Å; T181-A185 WeakPolarHBondContact O-CB 3.5Å; T181-A185 PolarHBondContact O-N 3.27Å; T181-F239 HydrophobicContact CG2-CE2 3.93Å; T181-F239 HydrophobicContact CG2-CZ 3.95Å
182	A	93.4	Very high	91.9	Very high	65 Å²	65	43.2 Å²	43.2	54%	0.537	26%	0.256	S	S	.	.	H	α-helix	trans	-62.7	-42.4	178.5	0	0	0	0	0	112.9	E178 L179 R180	E178-A182 PolarHBondContact O-N 3.15Å; L179-A182 PolarHBondContact O-N 3.05Å; R180-A182 PolarHBondContact O-N 3.34Å
183	V	93.4	Very high	91.7	Very high	33 Å²	33	47.9 Å²	47.9	20%	0.2	27%	0.267	C	S	.	.	H	α-helix	trans	-65.8	-43.6	178.3	172	0	0	0	0	111	R113 A116 A117 L120 L179 R180 T181	R113-V183 HydrophobicContact CB-CG1 4.14Å; R113-V183 HydrophobicContact CG-CG1 4.4Å; R113-V183 WeakPolarHBondContact O-CG1 3.27Å; A116-V183 HydrophobicContact CB-CG1 4.07Å; A117-V183 HydrophobicContact CB-CG1 4.28Å; L120-V183 HydrophobicContact CD1-CB 4.44Å; L120-V183 HydrophobicContact CD1-CG2 3.98Å; L179-V183 HydrophobicContact CD1-CG2 4.42Å; L179-V183 HydrophobicContact CG-CG2 4.43Å; L179-V183 WeakPolarHBondContact O-CB 3.28Å; L179-V183 VanDerWaalsContact O-CG2 3.27Å; L179-V183 WeakPolarHBondContact O-CG2 3.34Å; L179-V183 PolarHBondContact O-N 2.88Å; R180-V183 PolarHBondContact O-N 3.49Å; T181-V183 PolarHBondContact O-N 3.3Å
184	F	92.5	Very high	91.5	Very high	4 Å²	4	51.6 Å²	51.6	2%	0.018	28%	0.284	C	S	.	.	H	α-helix	trans	-71.6	-29.8	-178.5	-171.3	-109.4	0	0	0	113.4	V114 A117 R180 T181 K186 A187 A188 L234 V238 F239	V114-F184 HydrophobicContact CG2-CE2 4.4Å; A117-F184 HydrophobicContact CB-CB 3.93Å; A117-F184 HydrophobicContact CB-CD2 4.23Å; R180-F184 WeakPolarHBondContact O-CB 3.46Å; R180-F184 PolarHBondContact O-N 3.07Å; T181-F184 PolarHBondContact O-N 3.14Å; F184-K186 VanDerWaalsContact C-N 3.3Å; F184-K186 PolarHBondContact O-N 2.99Å; F184-A187 HydrophobicContact CD2-CB 4.39Å; F184-A187 WeakPolarHBondContact O-CA 3.33Å; F184-A187 WeakPolarHBondContact O-CB 3.4Å; F184-A187 PolarHBondContact O-N 3.12Å; F184-A188 HydrophobicContact CD1-CB 4.22Å; F184-A188 HydrophobicContact CE1-CB 3.87Å; F184-A188 HydrophobicContact CZ-CB 4.41Å; F184-A188 PolarHBondContact O-N 2.93Å; F184-L234 HydrophobicContact CE1-CB 4.13Å; F184-L234 HydrophobicContact CZ-CB 4.11Å; F184-V238 HydrophobicContact CD1-CB 4.47Å; F184-V238 HydrophobicContact CD1-CG1 4.48Å; F184-V238 HydrophobicContact CD1-CG2 4.5Å; F184-V238 HydrophobicContact CD2-CG1 4.38Å; F184-V238 HydrophobicContact CD2-CG2 4.28Å; F184-V238 HydrophobicContact CE1-CB 4.23Å; F184-V238 HydrophobicContact CE1-CG2 3.93Å; F184-V238 HydrophobicContact CE2-CG2 3.71Å; F184-V238 HydrophobicContact CG-CG1 4.33Å; F184-V238 HydrophobicContact CZ-CB 4.3Å; F184-V238 HydrophobicContact CZ-CG2 3.51Å; F184-F239 HydrophobicContact CB-CE1 4.2Å; F184-F239 HydrophobicContact CB-CZ 4.15Å; F184-F239 HydrophobicContact CD1-CE1 4.01Å; F184-F239 AromaticContact CD1-CZ 3.72Å; F184-F239 HydrophobicContact CD1-CZ 3.72Å; F184-F239 HydrophobicContact CG-CE1 4.34Å; F184-F239 HydrophobicContact CG-CZ 4.31Å
185	A	91.4	Very high	91.3	Very high	39 Å²	39	48.5 Å²	48.5	32%	0.322	26%	0.262	S	S	.	.	H	α-helix	trans	-53.5	-42	-176.7	0	0	0	0	0	113.5	T181 A187 A188 L189	T181-A185 WeakPolarHBondContact O-CB 3.5Å; T181-A185 PolarHBondContact O-N 3.27Å; A185-A187 VanDerWaalsContact C-N 3.33Å; A185-A187 PolarHBondContact O-N 3.04Å; A185-A188 PolarHBondContact O-N 2.85Å; A185-L189 WeakPolarHBondContact O-CB 3.3Å; A185-L189 WeakPolarHBondContact O-CG 3.47Å; A185-L189 PolarHBondContact O-N 3.33Å
186	K	90	Very high	91	Very high	99 Å²	99	47.4 Å²	47.4	43%	0.43	25%	0.251	S	S	.	.	H	α-helix	trans	-66.1	-35.4	177.6	-164.4	-176	-173.4	-176.2	0	112.1	R113 F184 S190	R113-K186 VanDerWaalsContact NH1-CB 3.31Å; F184-K186 VanDerWaalsContact C-N 3.3Å; F184-K186 PolarHBondContact O-N 2.99Å; K186-S190 WeakPolarHBondContact O-CB 3.46Å; K186-S190 PolarHBondContact O-N 3.39Å; K186-S190 VanDerWaalsContact O-N 3.12Å
187	A	88.4	Confident	90.8	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.008	26%	0.258	C	S	.	.	H	α-helix	trans	-66.5	-52.1	176.7	0	0	0	0	0	110.2	I110 V114 F184 A185 S190 S191	I110-A187 HydrophobicContact CG2-CB 3.93Å; V114-A187 HydrophobicContact CG2-CB 3.88Å; F184-A187 HydrophobicContact CD2-CB 4.39Å; F184-A187 WeakPolarHBondContact O-CA 3.33Å; F184-A187 WeakPolarHBondContact O-CB 3.4Å; F184-A187 PolarHBondContact O-N 3.12Å; A185-A187 VanDerWaalsContact C-N 3.33Å; A185-A187 PolarHBondContact O-N 3.04Å; A187-S190 PolarHBondContact O-N 3.44Å; A187-S191 PolarHBondContact O-N 3.33Å; A187-S191 VanDerWaalsContact O-N 3.12Å; A187-S191 PolarHBondContact O-OG 3.26Å; A187-S191 VanDerWaalsContact O-OG 3.13Å
188	A	89.2	Confident	90.8	Very high	3 Å²	3	50.7 Å²	50.7	3%	0.025	27%	0.268	C	S	.	.	H	α-helix	trans	-59.2	-51.1	179.5	0	0	0	0	0	112.9	F184 A185 S190 S191 I192 L234	F184-A188 HydrophobicContact CD1-CB 4.22Å; F184-A188 HydrophobicContact CE1-CB 3.87Å; F184-A188 HydrophobicContact CZ-CB 4.41Å; F184-A188 PolarHBondContact O-N 2.93Å; A185-A188 PolarHBondContact O-N 2.85Å; A188-S190 VanDerWaalsContact C-N 3.34Å; A188-S190 PolarHBondContact O-N 2.87Å; A188-S191 PolarHBondContact O-N 2.79Å; A188-I192 WeakPolarHBondContact O-CG1 3.4Å; A188-I192 PolarHBondContact O-N 2.88Å; A188-L234 HydrophobicContact CB-CD1 4.29Å
189	L	90.3	Very high	90.7	Very high	110 Å²	110	44.9 Å²	44.9	58%	0.576	24%	0.24	S	C	*	.	H	α-helix	trans	-66.6	-33.3	-178.7	-67.7	174.8	0	0	0	112.9	A185 I192 R193	A185-L189 WeakPolarHBondContact O-CB 3.3Å; A185-L189 WeakPolarHBondContact O-CG 3.47Å; A185-L189 PolarHBondContact O-N 3.33Å; L189-I192 HydrophobicContact CD2-CD1 4.25Å; L189-R193 WeakPolarHBondContact O-CB 3.36Å; L189-R193 PolarHBondContact O-N 3.12Å
190	S	88.7	Confident	90.5	Very high	12 Å²	12	46 Å²	46	8%	0.084	24%	0.242	C	C	.	.	H	α-helix	trans	-66.2	-42.1	174.4	-174.1	0	0	0	0	111.6	R107 I110 K186 A187 A188 R193 E194	R107-S190 PolarHBondContact NH1-OG 3.49Å; I110-S190 WeakPolarHBondContact CD1-OG 3.39Å; K186-S190 WeakPolarHBondContact O-CB 3.46Å; K186-S190 PolarHBondContact O-N 3.39Å; K186-S190 VanDerWaalsContact O-N 3.12Å; A187-S190 PolarHBondContact O-N 3.44Å; A188-S190 VanDerWaalsContact C-N 3.34Å; A188-S190 PolarHBondContact O-N 2.87Å; S190-R193 PolarHBondContact O-N 3.43Å; S190-E194 WeakPolarHBondContact O-CB 3.27Å; S190-E194 PolarHBondContact O-N 3.3Å
191	S	87.6	Confident	90.5	Very high	2 Å²	2	53 Å²	53	1%	0.014	27%	0.268	C	S	.	.	H	α-helix	trans	-63.8	-41.3	177.3	-57.8	0	0	0	0	111.5	Y101 A187 A188 E194 V195	Y101-S191 PolarHBondContact O-OG 2.89Å; A187-S191 PolarHBondContact O-N 3.33Å; A187-S191 VanDerWaalsContact O-N 3.12Å; A187-S191 PolarHBondContact O-OG 3.26Å; A187-S191 VanDerWaalsContact O-OG 3.13Å; A188-S191 PolarHBondContact O-N 2.79Å; S191-E194 PolarHBondContact O-N 3.31Å; S191-V195 WeakPolarHBondContact O-CG2 3.45Å; S191-V195 PolarHBondContact O-N 2.67Å
192	I	89.7	Confident	90.4	Very high	28 Å²	28	52.7 Å²	52.7	14%	0.144	26%	0.264	C	S	.	.	H	α-helix	trans	-60.5	-47.4	175.7	-66.8	160.2	0	0	0	111	A188 L189 E194 G196 A227 I230 N231	A188-I192 WeakPolarHBondContact O-CG1 3.4Å; A188-I192 PolarHBondContact O-N 2.88Å; L189-I192 HydrophobicContact CD2-CD1 4.25Å; I192-E194 VanDerWaalsContact C-N 3.34Å; I192-E194 PolarHBondContact O-N 2.86Å; I192-G196 PolarHBondContact O-N 3.41Å; I192-A227 HydrophobicContact CG2-CB 3.83Å; I192-I230 HydrophobicContact CG1-CB 4.22Å; I192-I230 HydrophobicContact CG1-CG2 3.7Å; I192-N231 HydrophobicContact CD1-CB 3.52Å
193	R	90.2	Very high	90.2	Very high	159 Å²	159	50.6 Å²	50.6	60%	0.6	24%	0.243	S	C	*	.	H	α-helix	trans	-58.6	-46.1	178.3	-177.8	-174.7	69.4	172.2	5.8	111.6	L189 S190 G196 V197	L189-R193 WeakPolarHBondContact O-CB 3.36Å; L189-R193 PolarHBondContact O-N 3.12Å; S190-R193 PolarHBondContact O-N 3.43Å; R193-G196 PolarHBondContact O-N 3.31Å; R193-V197 HydrophobicContact CG-CG2 4.47Å; R193-V197 WeakPolarHBondContact O-CB 3.44Å; R193-V197 VanDerWaalsContact O-CG2 3.25Å; R193-V197 WeakPolarHBondContact O-CG2 3.36Å; R193-V197 PolarHBondContact O-N 3.29Å
194	E	89	Confident	90	Very high	79 Å²	79	55 Å²	55	37%	0.369	26%	0.261	S	S	.	.	H	α-helix	trans	-64.7	-47.2	-177.2	-174.1	165.6	-174	0	0	112.1	S190 S191 I192 V197 Q198	S190-E194 WeakPolarHBondContact O-CB 3.27Å; S190-E194 PolarHBondContact O-N 3.3Å; S191-E194 PolarHBondContact O-N 3.31Å; I192-E194 VanDerWaalsContact C-N 3.34Å; I192-E194 PolarHBondContact O-N 2.86Å; E194-V197 PolarHBondContact O-N 3.38Å; E194-Q198 WeakPolarHBondContact O-CB 3.11Å; E194-Q198 PolarHBondContact O-N 3.12Å
195	V	88.7	Confident	89.8	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.006	29%	0.287	C	S	.	.	H	α-helix	trans	-63.9	-45.3	176.1	177.3	0	0	0	0	111	Y101 S191 V197 Q198 V199 I230 M435 F436	Y101-V195 HydrophobicContact CD1-CG2 3.63Å; Y101-V195 HydrophobicContact CD2-CG2 3.81Å; Y101-V195 HydrophobicContact CE1-CG2 3.79Å; Y101-V195 HydrophobicContact CE2-CG2 4Å; Y101-V195 HydrophobicContact CG-CG2 3.63Å; S191-V195 WeakPolarHBondContact O-CG2 3.45Å; S191-V195 PolarHBondContact O-N 2.67Å; V195-V197 PolarHBondContact O-N 3.41Å; V195-Q198 PolarHBondContact O-N 3.43Å; V195-V199 HydrophobicContact CG1-CG2 4.27Å; V195-V199 WeakPolarHBondContact O-CG2 3.37Å; V195-V199 PolarHBondContact O-N 2.97Å; V195-I230 HydrophobicContact CB-CD1 3.95Å; V195-I230 HydrophobicContact CG1-CD1 3.73Å; V195-I230 HydrophobicContact CG2-CD1 4.06Å; V195-M435 HydrophobicContact CG1-CE 3.56Å; V195-M435 HydrophobicContact CG1-SD 4.37Å; V195-F436 HydrophobicContact CG1-CE1 3.94Å
196	G	90	Very high	89.7	Confident	18 Å²	18	58.5 Å²	58.5	19%	0.186	28%	0.275	C	S	.	.	H	α-helix	trans	-59.1	-44.9	179.1	0	0	0	0	0	112.7	I192 R193 V199 F200	I192-G196 PolarHBondContact O-N 3.41Å; R193-G196 PolarHBondContact O-N 3.31Å; G196-V199 PolarHBondContact O-N 2.8Å; G196-F200 WeakPolarHBondContact O-CB 3.35Å; G196-F200 PolarHBondContact O-N 3.17Å
197	V	90.9	Very high	89.5	Confident	57 Å²	57	54.7 Å²	54.7	35%	0.345	26%	0.259	S	S	.	.	H	α-helix	trans	-66.9	-37.8	176.5	172.4	0	0	0	0	111.6	R193 E194 V195 F200 R201	R193-V197 HydrophobicContact CG-CG2 4.47Å; R193-V197 WeakPolarHBondContact O-CB 3.44Å; R193-V197 VanDerWaalsContact O-CG2 3.25Å; R193-V197 WeakPolarHBondContact O-CG2 3.36Å; R193-V197 PolarHBondContact O-N 3.29Å; E194-V197 PolarHBondContact O-N 3.38Å; V195-V197 PolarHBondContact O-N 3.41Å; V197-F200 PolarHBondContact O-N 2.96Å; V197-R201 WeakPolarHBondContact O-CG 3.25Å; V197-R201 PolarHBondContact O-N 3.36Å
198	Q	90.8	Very high	89.3	Confident	81 Å²	81	56.6 Å²	56.6	38%	0.379	27%	0.269	S	S	.	.	H	α-helix	trans	-63.8	-46.3	177.1	-173.9	175.6	25.9	0	0	111.9	Y101 E194 V195 F200 R201 H202 L439	Y101-Q198 PolarHBondContact OH-OE1 3.47Å; E194-Q198 WeakPolarHBondContact O-CB 3.11Å; E194-Q198 PolarHBondContact O-N 3.12Å; V195-Q198 PolarHBondContact O-N 3.43Å; Q198-F200 VanDerWaalsContact C-N 3.33Å; Q198-F200 PolarHBondContact O-N 2.81Å; Q198-R201 PolarHBondContact O-N 2.84Å; Q198-H202 WeakPolarHBondContact O-CB 3.5Å; Q198-H202 PolarHBondContact O-N 3.29Å; Q198-L439 HydrophobicContact CG-CD2 4.39Å
199	V	91.1	Very high	88.7	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61.2	-44.2	175.4	177.1	0	0	0	0	110.6	V195 G196 R201 H202 M203 I223 M435 L438 L439	V195-V199 HydrophobicContact CG1-CG2 4.27Å; V195-V199 WeakPolarHBondContact O-CG2 3.37Å; V195-V199 PolarHBondContact O-N 2.97Å; G196-V199 PolarHBondContact O-N 2.8Å; V199-R201 PolarHBondContact O-N 3.47Å; V199-H202 PolarHBondContact O-N 2.75Å; V199-M203 HydrophobicContact CG1-CG 4.48Å; V199-M203 HydrophobicContact CG1-SD 4.2Å; V199-M203 WeakPolarHBondContact O-CG 3.37Å; V199-M203 PolarHBondContact O-N 3.39Å; V199-I223 HydrophobicContact CG1-CD1 4.37Å; V199-I223 HydrophobicContact CG1-CG1 3.92Å; V199-M435 HydrophobicContact CG1-CG 4.24Å; V199-M435 HydrophobicContact CG2-CG 3.85Å; V199-M435 HydrophobicContact CG2-SD 4.23Å; V199-L438 HydrophobicContact CG1-CB 4.42Å; V199-L438 HydrophobicContact CG1-CD1 4.12Å; V199-L439 HydrophobicContact CB-CD2 4.29Å; V199-L439 HydrophobicContact CG2-CD1 4.01Å; V199-L439 HydrophobicContact CG2-CD2 3.86Å; V199-L439 HydrophobicContact CG2-CG 3.87Å
200	F	90.7	Very high	88.2	Confident	115 Å²	115	55.7 Å²	55.7	50%	0.504	27%	0.266	S	S	.	.	H	α-helix	trans	-59.6	-46.5	177.9	-176.1	-97.5	0	0	0	112.6	G196 V197 Q198 M203 H204	G196-F200 WeakPolarHBondContact O-CB 3.35Å; G196-F200 PolarHBondContact O-N 3.17Å; V197-F200 PolarHBondContact O-N 2.96Å; Q198-F200 VanDerWaalsContact C-N 3.33Å; Q198-F200 PolarHBondContact O-N 2.81Å; F200-M203 PolarHBondContact O-N 3.31Å; F200-H204 AromaticContact CD1-CD2 3.96Å; F200-H204 AromaticContact CE1-CD2 3.54Å; F200-H204 AromaticContact CE1-NE2 3.35Å; F200-H204 VanDerWaalsContact CE1-NE2 3.35Å; F200-H204 WeakPolarHBondContact CE1-NE2 3.42Å; F200-H204 AromaticContact CE2-NE2 3.89Å; F200-H204 AromaticContact CZ-CD2 3.81Å; F200-H204 AromaticContact CZ-NE2 3.17Å; F200-H204 WeakPolarHBondContact CZ-NE2 3.4Å; F200-H204 PolarHBondContact O-CD2 2.9Å; F200-H204 PolarHBondContact O-N 3.34Å
201	R	92.1	Very high	87.9	Confident	161 Å²	161	58 Å²	58	61%	0.608	28%	0.275	S	S	*	.	H	α-helix	trans	-61.5	-44.4	174.9	-73.2	-179.5	-171.3	131.5	-0.6	111.8	V197 Q198 V199 M203 H204 N205	V197-R201 WeakPolarHBondContact O-CG 3.25Å; V197-R201 PolarHBondContact O-N 3.36Å; Q198-R201 PolarHBondContact O-N 2.84Å; V199-R201 PolarHBondContact O-N 3.47Å; R201-M203 VanDerWaalsContact C-N 3.3Å; R201-M203 PolarHBondContact O-N 3.26Å; R201-H204 PolarHBondContact O-N 3.06Å; R201-N205 PolarHBondContact O-N 2.66Å
202	H	90.8	Very high	87.5	Confident	39 Å²	39	63.3 Å²	63.3	18%	0.181	30%	0.303	C	S	.	.	H	α-helix	trans	-61.5	-39.9	179	-171.6	70.7	0	0	0	111.9	Q198 V199 H204 N205 L206 L438 L439 L441	Q198-H202 WeakPolarHBondContact O-CB 3.5Å; Q198-H202 PolarHBondContact O-N 3.29Å; V199-H202 PolarHBondContact O-N 2.75Å; H202-H204 VanDerWaalsContact C-N 3.3Å; H202-H204 PolarHBondContact O-N 3.2Å; H202-N205 WeakPolarHBondContact O-CA 3.01Å; H202-N205 WeakPolarHBondContact O-CB 3.29Å; H202-N205 PolarHBondContact O-N 3.06Å; H202-L206 PolarHBondContact O-N 3.29Å; H202-L438 PolarHBondContact CD2-O 3.41Å; H202-L438 PolarHBondContact NE2-O 3.07Å; H202-L439 HydrophobicContact CB-CD2 3.68Å; H202-L441 PolarHBondContact CE1-O 3.21Å; H202-L441 VanDerWaalsContact CE1-O 3.24Å; H202-L441 PolarHBondContact NE2-O 3.35Å
203	M	88.9	Confident	86.5	Confident	21 Å²	21	65.1 Å²	65.1	10%	0.103	33%	0.329	C	S	.	.	H	α-helix	trans	-61.2	-36.3	176.1	-76.3	177.7	51.4	0	0	113.4	V199 F200 R201 N205 L206 H211 L219 I223 L438	V199-M203 HydrophobicContact CG1-CG 4.48Å; V199-M203 HydrophobicContact CG1-SD 4.2Å; V199-M203 WeakPolarHBondContact O-CG 3.37Å; V199-M203 PolarHBondContact O-N 3.39Å; F200-M203 PolarHBondContact O-N 3.31Å; R201-M203 VanDerWaalsContact C-N 3.3Å; R201-M203 PolarHBondContact O-N 3.26Å; M203-N205 PolarHBondContact O-N 2.93Å; M203-L206 PolarHBondContact O-N 2.98Å; M203-H211 PolarHBondContact O-CE1 2.92Å; M203-H211 PolarHBondContact O-NE2 2.75Å; M203-L219 HydrophobicContact CE-CB 3.65Å; M203-L219 HydrophobicContact CE-CD1 3.96Å; M203-L219 HydrophobicContact CE-CG 4.24Å; M203-I223 HydrophobicContact CE-CD1 4.12Å; M203-I223 HydrophobicContact SD-CD1 3.34Å; M203-I223 WeakPolarHBondContact SD-CD1 3.45Å; M203-I223 HydrophobicContact SD-CG1 3.91Å; M203-L438 HydrophobicContact SD-CD1 4.16Å
204	H	89.3	Confident	85.5	Confident	125 Å²	125	61.1 Å²	61.1	58%	0.579	31%	0.314	S	S	*	.	H	α-helix	trans	-66.9	-23.5	173.7	-82.5	-65.4	0	0	0	113.4	F200 R201 H202	F200-H204 AromaticContact CD1-CD2 3.96Å; F200-H204 AromaticContact CE1-CD2 3.54Å; F200-H204 AromaticContact CE1-NE2 3.35Å; F200-H204 VanDerWaalsContact CE1-NE2 3.35Å; F200-H204 WeakPolarHBondContact CE1-NE2 3.42Å; F200-H204 AromaticContact CE2-NE2 3.89Å; F200-H204 AromaticContact CZ-CD2 3.81Å; F200-H204 AromaticContact CZ-NE2 3.17Å; F200-H204 WeakPolarHBondContact CZ-NE2 3.4Å; F200-H204 PolarHBondContact O-CD2 2.9Å; F200-H204 PolarHBondContact O-N 3.34Å; R201-H204 PolarHBondContact O-N 3.06Å; H202-H204 VanDerWaalsContact C-N 3.3Å; H202-H204 PolarHBondContact O-N 3.2Å
205	N	89	Confident	84.4	Confident	106 Å²	106	65.4 Å²	65.4	57%	0.567	33%	0.326	S	S	*	.	H	α-helix	trans	-84.4	-11.1	176.5	-64.2	-22.1	0	0	0	113.1	R201 H202 M203 P443	R201-N205 PolarHBondContact O-N 2.66Å; H202-N205 WeakPolarHBondContact O-CA 3.01Å; H202-N205 WeakPolarHBondContact O-CB 3.29Å; H202-N205 PolarHBondContact O-N 3.06Å; M203-N205 PolarHBondContact O-N 2.93Å; N205-P443 HydrophobicContact CB-CG 4.38Å; N205-P443 VanDerWaalsContact O-CB 3.25Å; N205-P443 WeakPolarHBondContact O-CB 3.32Å; N205-P443 VanDerWaalsContact O-CG 3.25Å; N205-P443 WeakPolarHBondContact O-CG 3.32Å
206	L	88.1	Confident	83.7	Confident	11 Å²	11	70.7 Å²	70.7	6%	0.058	36%	0.359	C	S	.	.	S	Bend	trans	-72.9	153.2	175.8	-63.3	175.9	0	0	0	111.7	H202 M203 Y210 H211 L441 P443	H202-L206 PolarHBondContact O-N 3.29Å; M203-L206 PolarHBondContact O-N 2.98Å; L206-Y210 HydrophobicContact CB-CD1 4.04Å; L206-Y210 HydrophobicContact CB-CG 4.29Å; L206-Y210 HydrophobicContact CD1-CD1 3.6Å; L206-Y210 HydrophobicContact CD1-CE1 3.52Å; L206-Y210 HydrophobicContact CD1-CE2 4.49Å; L206-Y210 HydrophobicContact CD1-CG 4.15Å; L206-Y210 HydrophobicContact CG-CD1 4.45Å; L206-H211 PolarHBondContact O-NE2 2.95Å; L206-L441 HydrophobicContact CD1-CB 4.44Å; L206-L441 HydrophobicContact CD1-CD1 3.92Å; L206-L441 HydrophobicContact CD2-CB 3.7Å; L206-P443 HydrophobicContact CD2-CG 4.2Å
207	D	85.1	Confident	83	Confident	19 Å²	19	72.1 Å²	72.1	10%	0.102	37%	0.373	C	S	.	.			trans	-68.3	157.8	-172.8	-46.2	-68.5	0	0	0	113.6	S209 Y210 H211 T444 V445	D207-S209 PolarHBondContact O-N 3.03Å; D207-Y210 WeakPolarHBondContact O-CB 3.13Å; D207-Y210 PolarHBondContact O-N 3.47Å; D207-H211 PolarHBondContact O-CD2 3.03Å; D207-H211 VanDerWaalsContact O-CD2 3.27Å; D207-H211 PolarHBondContact O-N 2.82Å; D207-T444 VanDerWaalsContact CG-N 3.29Å; D207-T444 PolarHBondContact OD1-N 2.86Å; D207-T444 VanDerWaalsContact OD1-N 3.08Å; D207-T444 VanDerWaalsContact OD2-CB 3.26Å; D207-T444 WeakPolarHBondContact OD2-CB 3.41Å; D207-T444 PolarHBondContact OD2-N 2.98Å; D207-T444 PolarHBondContact OD2-OG1 3.17Å; D207-V445 WeakPolarHBondContact OD1-CB 3.37Å; D207-V445 PolarHBondContact OD1-N 2.86Å
208	L	84.5	Confident	82.2	Confident	41 Å²	41	72.3 Å²	72.3	22%	0.215	38%	0.381	C	S	.	.	H	α-helix	trans	-58.6	-36.7	175.1	-177	61.4	0	0	0	112.2	Y210 H211 L212 F522 F523	L208-Y210 PolarHBondContact O-N 3.44Å; L208-H211 PolarHBondContact O-N 3.34Å; L208-H211 VanDerWaalsContact O-N 3.14Å; L208-L212 HydrophobicContact CD1-CD1 4.27Å; L208-L212 HydrophobicContact CD1-CD2 4.43Å; L208-L212 HydrophobicContact CD1-CG 4.01Å; L208-L212 HydrophobicContact CD2-CD1 4.29Å; L208-L212 HydrophobicContact CG-CD1 3.83Å; L208-L212 HydrophobicContact CG-CG 4.05Å; L208-L212 WeakPolarHBondContact O-CG 3.41Å; L208-L212 PolarHBondContact O-N 3.41Å; L208-F522 HydrophobicContact CB-CB 4.17Å; L208-F522 HydrophobicContact CB-CD1 3.82Å; L208-F522 HydrophobicContact CB-CG 4.2Å; L208-F522 HydrophobicContact CD2-CB 3.98Å; L208-F522 HydrophobicContact CD2-CD1 4.08Å; L208-F522 HydrophobicContact CD2-CD2 4.11Å; L208-F522 HydrophobicContact CD2-CG 3.81Å; L208-F522 HydrophobicContact CG-CD1 4.47Å; L208-F523 HydrophobicContact CB-CZ 4.26Å; L208-F523 HydrophobicContact CD2-CE2 4.02Å; L208-F523 HydrophobicContact CD2-CZ 4.19Å; L208-F523 HydrophobicContact CG-CZ 4.37Å
209	S	77.8	Confident	81.8	Confident	59 Å²	59	69.1 Å²	69.1	41%	0.413	37%	0.367	S	S	.	.	H	α-helix	trans	-50.8	-44.6	171.1	-90.3	0	0	0	0	112.7	D207 G213 F523	D207-S209 PolarHBondContact O-N 3.03Å; S209-G213 PolarHBondContact O-N 3.13Å; S209-G213 VanDerWaalsContact O-N 3.13Å; S209-F523 VanDerWaalsContact OG-CE1 3.28Å; S209-F523 WeakPolarHBondContact OG-CE1 3.38Å
210	Y	79.9	Confident	81.5	Confident	36 Å²	36	71 Å²	71	14%	0.141	39%	0.386	C	S	.	.	H	α-helix	trans	-66.1	-42.3	-178.4	-178.9	-91.7	0	0	0	110.7	L206 D207 L208 R214 L219 L438 L441	L206-Y210 HydrophobicContact CB-CD1 4.04Å; L206-Y210 HydrophobicContact CB-CG 4.29Å; L206-Y210 HydrophobicContact CD1-CD1 3.6Å; L206-Y210 HydrophobicContact CD1-CE1 3.52Å; L206-Y210 HydrophobicContact CD1-CE2 4.49Å; L206-Y210 HydrophobicContact CD1-CG 4.15Å; L206-Y210 HydrophobicContact CG-CD1 4.45Å; D207-Y210 WeakPolarHBondContact O-CB 3.13Å; D207-Y210 PolarHBondContact O-N 3.47Å; L208-Y210 PolarHBondContact O-N 3.44Å; Y210-R214 HydrophobicContact CD1-CG 4.48Å; Y210-R214 HydrophobicContact CE1-CG 4.16Å; Y210-R214 HydrophobicContact CE2-CG 4.36Å; Y210-R214 WeakPolarHBondContact O-CB 3.43Å; Y210-R214 WeakPolarHBondContact O-CG 3.37Å; Y210-R214 PolarHBondContact O-N 2.88Å; Y210-L219 HydrophobicContact CE1-CD1 4.18Å; Y210-L219 HydrophobicContact CE1-CD2 4.01Å; Y210-L219 WeakPolarHBondContact OH-CD2 3.46Å; Y210-L438 WeakPolarHBondContact OH-CD2 3.43Å; Y210-L441 HydrophobicContact CD2-CD1 4.18Å; Y210-L441 HydrophobicContact CE1-CD1 4.4Å; Y210-L441 HydrophobicContact CE2-CD1 3.32Å; Y210-L441 VanDerWaalsContact CZ-CD1 3.45Å; Y210-L441 WeakPolarHBondContact OH-CD1 3.29Å
211	H	82.6	Confident	81.3	Confident	59 Å²	59	70.9 Å²	70.9	27%	0.273	39%	0.386	S	S	.	.	H	α-helix	trans	-70.7	-40.3	180	-70.2	-69.9	0	0	0	113	M203 L206 D207 L208 G213 R214	M203-H211 PolarHBondContact O-CE1 2.92Å; M203-H211 PolarHBondContact O-NE2 2.75Å; L206-H211 PolarHBondContact O-NE2 2.95Å; D207-H211 PolarHBondContact O-CD2 3.03Å; D207-H211 VanDerWaalsContact O-CD2 3.27Å; D207-H211 PolarHBondContact O-N 2.82Å; L208-H211 PolarHBondContact O-N 3.34Å; L208-H211 VanDerWaalsContact O-N 3.14Å; H211-G213 VanDerWaalsContact C-N 3.31Å; H211-G213 PolarHBondContact O-N 3.45Å; H211-R214 PolarHBondContact O-N 3.14Å; H211-R214 VanDerWaalsContact O-O 3.11Å
212	L	78.2	Confident	81	Confident	114 Å²	114	64 Å²	64	60%	0.597	36%	0.363	S	S	*	.	H	α-helix	trans	-66.9	-32.8	177.4	-69.1	175.7	0	0	0	112.4	L208 R214	L208-L212 HydrophobicContact CD1-CD1 4.27Å; L208-L212 HydrophobicContact CD1-CD2 4.43Å; L208-L212 HydrophobicContact CD1-CG 4.01Å; L208-L212 HydrophobicContact CD2-CD1 4.29Å; L208-L212 HydrophobicContact CG-CD1 3.83Å; L208-L212 HydrophobicContact CG-CG 4.05Å; L208-L212 WeakPolarHBondContact O-CG 3.41Å; L208-L212 PolarHBondContact O-N 3.41Å; L212-R214 VanDerWaalsContact C-N 3.31Å; L212-R214 PolarHBondContact O-N 3.14Å
213	G	68.8	Low	80.9	Confident	66 Å²	66	63.5 Å²	63.5	68%	0.68	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-3.7	178.3	0	0	0	0	0	114.9	S209 H211	S209-G213 PolarHBondContact O-N 3.13Å; S209-G213 VanDerWaalsContact O-N 3.13Å; H211-G213 VanDerWaalsContact C-N 3.31Å; H211-G213 PolarHBondContact O-N 3.45Å
214	R	69.7	Low	80.9	Confident	76 Å²	76	66.2 Å²	66.2	29%	0.287	38%	0.376	S	S	.	.	S	Bend	trans	-123.1	136.7	-173.3	-66	-69.4	-176.6	168.5	0.5	111	N80 Y210 H211 L212 T216 L219	N80-R214 PolarHBondContact ND2-NH1 3.48Å; N80-R214 VanDerWaalsContact ND2-NH1 3.17Å; Y210-R214 HydrophobicContact CD1-CG 4.48Å; Y210-R214 HydrophobicContact CE1-CG 4.16Å; Y210-R214 HydrophobicContact CE2-CG 4.36Å; Y210-R214 WeakPolarHBondContact O-CB 3.43Å; Y210-R214 WeakPolarHBondContact O-CG 3.37Å; Y210-R214 PolarHBondContact O-N 2.88Å; H211-R214 PolarHBondContact O-N 3.14Å; H211-R214 VanDerWaalsContact O-O 3.11Å; L212-R214 VanDerWaalsContact C-N 3.31Å; L212-R214 PolarHBondContact O-N 3.14Å; R214-T216 PolarHBondContact O-N 3.29Å; R214-L219 HydrophobicContact CB-CD1 3.99Å; R214-L219 HydrophobicContact CB-CG 4.35Å
215	R	65.4	Low	80.9	Confident	168 Å²	168	66 Å²	66	63%	0.634	37%	0.37	S	S	*	.			trans	-70	115.4	167	-64.7	-175.4	-177.8	-177.4	0.1	108.3	G217 A218	R215-G217 PolarHBondContact O-N 3.21Å; R215-G217 VanDerWaalsContact O-N 3.13Å; R215-A218 HydrophobicContact CB-CB 4.48Å; R215-A218 WeakPolarHBondContact O-CB 3.12Å; R215-A218 PolarHBondContact O-N 2.92Å
216	T	74	Confident	81	Confident	113 Å²	113	60.9 Å²	60.9	69%	0.693	34%	0.343	S	S	*	.	H	α-helix	trans	-50.4	-37.9	-179.3	50.9	0	0	0	0	113	R214 A218 L219 G220	R214-T216 PolarHBondContact O-N 3.29Å; T216-A218 VanDerWaalsContact C-N 3.3Å; T216-A218 PolarHBondContact O-N 2.95Å; T216-L219 PolarHBondContact O-N 3.26Å; T216-G220 PolarHBondContact O-N 3.16Å; T216-G220 VanDerWaalsContact O-N 3.07Å
217	G	75.3	Confident	81.1	Confident	47 Å²	47	61.3 Å²	61.3	49%	0.485	35%	0.348	S	S	.	.	H	α-helix	trans	-62.3	-30.3	175.7	0	0	0	0	0	114.7	R215 K221	R215-G217 PolarHBondContact O-N 3.21Å; R215-G217 VanDerWaalsContact O-N 3.13Å; G217-K221 WeakPolarHBondContact O-CG 3.37Å; G217-K221 PolarHBondContact O-N 3.04Å; G217-K221 VanDerWaalsContact O-N 3.07Å
218	A	75.2	Confident	81.4	Confident	62 Å²	62	66.7 Å²	66.7	51%	0.512	37%	0.367	S	S	.	.	H	α-helix	trans	-71.5	-38.4	175.9	0	0	0	0	0	111.5	R215 T216 K221 A222	R215-A218 HydrophobicContact CB-CB 4.48Å; R215-A218 WeakPolarHBondContact O-CB 3.12Å; R215-A218 PolarHBondContact O-N 2.92Å; T216-A218 VanDerWaalsContact C-N 3.3Å; T216-A218 PolarHBondContact O-N 2.95Å; A218-K221 PolarHBondContact O-N 2.87Å; A218-A222 WeakPolarHBondContact O-CB 3.28Å; A218-A222 PolarHBondContact O-N 3.08Å
219	L	82	Confident	81.7	Confident	13 Å²	13	64.8 Å²	64.8	7%	0.068	36%	0.357	C	S	.	.	H	α-helix	trans	-65.5	-45.3	175.8	-64	170.1	0	0	0	110.9	M203 Y210 R214 T216 K221 A222 I223 L438	M203-L219 HydrophobicContact CE-CB 3.65Å; M203-L219 HydrophobicContact CE-CD1 3.96Å; M203-L219 HydrophobicContact CE-CG 4.24Å; Y210-L219 HydrophobicContact CE1-CD1 4.18Å; Y210-L219 HydrophobicContact CE1-CD2 4.01Å; Y210-L219 WeakPolarHBondContact OH-CD2 3.46Å; R214-L219 HydrophobicContact CB-CD1 3.99Å; R214-L219 HydrophobicContact CB-CG 4.35Å; T216-L219 PolarHBondContact O-N 3.26Å; L219-K221 PolarHBondContact O-N 3.47Å; L219-A222 WeakPolarHBondContact O-CB 3.49Å; L219-A222 PolarHBondContact O-N 2.77Å; L219-A222 VanDerWaalsContact O-N 3.11Å; L219-I223 WeakPolarHBondContact O-CG1 3.46Å; L219-I223 PolarHBondContact O-N 3.28Å; L219-I223 VanDerWaalsContact O-N 3.11Å; L219-L438 HydrophobicContact CD2-CD2 4.12Å
220	G	84.9	Confident	82.3	Confident	40 Å²	40	62 Å²	62	41%	0.412	34%	0.338	S	S	.	.	H	α-helix	trans	-57.6	-45.8	174.5	0	0	0	0	0	112.6	T216 A222 I223 D224	T216-G220 PolarHBondContact O-N 3.16Å; T216-G220 VanDerWaalsContact O-N 3.07Å; G220-A222 VanDerWaalsContact C-N 3.32Å; G220-A222 PolarHBondContact O-N 3.48Å; G220-I223 PolarHBondContact O-N 3.27Å; G220-D224 WeakPolarHBondContact O-CB 3.24Å; G220-D224 PolarHBondContact O-N 3.28Å; G220-D224 VanDerWaalsContact O-N 3.08Å
221	K	85.2	Confident	82.8	Confident	113 Å²	113	63.4 Å²	63.4	49%	0.491	35%	0.348	S	S	.	.	H	α-helix	trans	-61.8	-36.4	174.6	-76.7	-179.8	-177.1	178.9	0	112.5	G217 A218 L219 R225	G217-K221 WeakPolarHBondContact O-CG 3.37Å; G217-K221 PolarHBondContact O-N 3.04Å; G217-K221 VanDerWaalsContact O-N 3.07Å; A218-K221 PolarHBondContact O-N 2.87Å; L219-K221 PolarHBondContact O-N 3.47Å; K221-R225 VanDerWaalsContact O-CB 3.27Å; K221-R225 WeakPolarHBondContact O-CB 3.26Å; K221-R225 VanDerWaalsContact O-CG 3.23Å; K221-R225 WeakPolarHBondContact O-CG 3.39Å; K221-R225 PolarHBondContact O-N 2.77Å
222	A	85.7	Confident	83.2	Confident	15 Å²	15	62.6 Å²	62.6	12%	0.124	34%	0.344	C	S	.	.	H	α-helix	trans	-66.1	-44.1	179	0	0	0	0	0	112.2	A218 L219 G220 G226 T434 L438	A218-A222 WeakPolarHBondContact O-CB 3.28Å; A218-A222 PolarHBondContact O-N 3.08Å; L219-A222 WeakPolarHBondContact O-CB 3.49Å; L219-A222 PolarHBondContact O-N 2.77Å; L219-A222 VanDerWaalsContact O-N 3.11Å; G220-A222 VanDerWaalsContact C-N 3.32Å; G220-A222 PolarHBondContact O-N 3.48Å; A222-G226 PolarHBondContact O-N 2.69Å; A222-T434 HydrophobicContact CB-CG2 4.09Å; A222-L438 HydrophobicContact CB-CD1 4.38Å
223	I	88.5	Confident	83.8	Confident	29 Å²	29	57.3 Å²	57.3	15%	0.149	32%	0.316	C	S	.	.	H	α-helix	trans	-62.4	-48.4	175.4	-57.8	170.8	0	0	0	110.4	V199 M203 L219 G220 G226 A227	V199-I223 HydrophobicContact CG1-CD1 4.37Å; V199-I223 HydrophobicContact CG1-CG1 3.92Å; M203-I223 HydrophobicContact CE-CD1 4.12Å; M203-I223 HydrophobicContact SD-CD1 3.34Å; M203-I223 WeakPolarHBondContact SD-CD1 3.45Å; M203-I223 HydrophobicContact SD-CG1 3.91Å; L219-I223 WeakPolarHBondContact O-CG1 3.46Å; L219-I223 PolarHBondContact O-N 3.28Å; L219-I223 VanDerWaalsContact O-N 3.11Å; G220-I223 PolarHBondContact O-N 3.27Å; I223-G226 PolarHBondContact O-N 3.47Å; I223-A227 WeakPolarHBondContact O-CB 3.48Å; I223-A227 PolarHBondContact O-N 3.25Å
224	D	89.2	Confident	84.8	Confident	79 Å²	79	54.6 Å²	54.6	42%	0.422	29%	0.286	S	S	.	.	H	α-helix	trans	-65.9	-44.2	-176.8	170.3	60.5	0	0	0	112.7	G220 A227 R228	G220-D224 WeakPolarHBondContact O-CB 3.24Å; G220-D224 PolarHBondContact O-N 3.28Å; G220-D224 VanDerWaalsContact O-N 3.08Å; D224-A227 PolarHBondContact O-N 3.31Å; D224-R228 PolarHBondContact O-N 2.71Å; D224-R228 IonicContact OD1-CZ 3.94Å; D224-R228 IonicContact OD1-NH1 3.68Å; D224-R228 PolarHBondContact OD1-NH1 3.17Å; D224-R228 IonicContact OD2-CZ 2.67Å; D224-R228 IonicContact OD2-NH1 3.49Å; D224-R228 PolarHBondContact OD2-NH1 3.2Å; D224-R228 IonicContact OD2-NH2 3.47Å; D224-R228 PolarHBondContact OD2-NH2 3.15Å
225	R	89.9	Confident	85.6	Confident	119 Å²	119	52.9 Å²	52.9	45%	0.449	28%	0.284	S	S	.	.	H	α-helix	trans	-63.8	-44	172.4	-72.1	178.5	-167.7	174.4	2.3	111.8	K221 A227 R228 G229 D431	K221-R225 VanDerWaalsContact O-CB 3.27Å; K221-R225 WeakPolarHBondContact O-CB 3.26Å; K221-R225 VanDerWaalsContact O-CG 3.23Å; K221-R225 WeakPolarHBondContact O-CG 3.39Å; K221-R225 PolarHBondContact O-N 2.77Å; R225-A227 VanDerWaalsContact C-N 3.34Å; R225-A227 PolarHBondContact O-N 3.05Å; R225-R228 PolarHBondContact O-N 3.31Å; R225-G229 PolarHBondContact O-N 3.03Å; R225-D431 HydrophobicContact CB-CB 4.04Å
226	G	90.6	Very high	86.8	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-58	-45.8	175.7	0	0	0	0	0	111.9	A222 I223 R228 G229 I230	A222-G226 PolarHBondContact O-N 2.69Å; I223-G226 PolarHBondContact O-N 3.47Å; G226-R228 PolarHBondContact O-N 2.9Å; G226-G229 PolarHBondContact O-N 3.39Å; G226-G229 VanDerWaalsContact O-N 3.14Å; G226-I230 WeakPolarHBondContact O-CG1 3.47Å; G226-I230 PolarHBondContact O-N 3.22Å
227	A	91.1	Very high	87.4	Confident	20 Å²	20	41.3 Å²	41.3	17%	0.165	23%	0.23	C	C	.	.	H	α-helix	trans	-60.2	-43.1	175.9	0	0	0	0	0	113	I192 I223 D224 R225 I230 N231	I192-A227 HydrophobicContact CG2-CB 3.83Å; I223-A227 WeakPolarHBondContact O-CB 3.48Å; I223-A227 PolarHBondContact O-N 3.25Å; D224-A227 PolarHBondContact O-N 3.31Å; R225-A227 VanDerWaalsContact C-N 3.34Å; R225-A227 PolarHBondContact O-N 3.05Å; A227-I230 WeakPolarHBondContact O-CB 3.19Å; A227-I230 PolarHBondContact O-N 2.91Å; A227-N231 PolarHBondContact O-N 3.4Å
228	R	90.3	Very high	87.9	Confident	132 Å²	132	39.7 Å²	39.7	50%	0.498	21%	0.21	S	C	.	.	H	α-helix	trans	-63.7	-39.8	172.2	-78.8	-166.1	-67.2	-84.1	-9.2	112.5	D224 R225 G226 I230 N231 F232	D224-R228 PolarHBondContact O-N 2.71Å; D224-R228 IonicContact OD1-CZ 3.94Å; D224-R228 IonicContact OD1-NH1 3.68Å; D224-R228 PolarHBondContact OD1-NH1 3.17Å; D224-R228 IonicContact OD2-CZ 2.67Å; D224-R228 IonicContact OD2-NH1 3.49Å; D224-R228 PolarHBondContact OD2-NH1 3.2Å; D224-R228 IonicContact OD2-NH2 3.47Å; D224-R228 PolarHBondContact OD2-NH2 3.15Å; R225-R228 PolarHBondContact O-N 3.31Å; G226-R228 PolarHBondContact O-N 2.9Å; R228-I230 VanDerWaalsContact C-N 3.33Å; R228-I230 PolarHBondContact O-N 3.01Å; R228-N231 WeakPolarHBondContact O-CB 3.42Å; R228-N231 PolarHBondContact O-N 3.37Å; R228-F232 PolarHBondContact O-N 2.72Å
229	G	91	Very high	88.4	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-60.3	-43.1	175.7	0	0	0	0	0	112	R225 G226 F232 I233 S428	R225-G229 PolarHBondContact O-N 3.03Å; G226-G229 PolarHBondContact O-N 3.39Å; G226-G229 VanDerWaalsContact O-N 3.14Å; G229-F232 PolarHBondContact O-N 3.31Å; G229-I233 WeakPolarHBondContact O-CG1 3.45Å; G229-I233 PolarHBondContact O-N 3.47Å; G229-S428 VanDerWaalsContact CA-CB 3.5Å; G229-S428 WeakPolarHBondContact O-CB 3.4Å
230	I	90.9	Very high	88.6	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-56.4	-53.8	171.7	-66.2	-170.3	0	0	0	110.3	L98 I192 V195 G226 A227 R228 F232 I233 L234 M432 M435	L98-I230 HydrophobicContact CD2-CB 4.27Å; L98-I230 HydrophobicContact CD2-CD1 3.89Å; L98-I230 HydrophobicContact CD2-CG1 3.8Å; L98-I230 HydrophobicContact CD2-CG2 3.79Å; I192-I230 HydrophobicContact CG1-CB 4.22Å; I192-I230 HydrophobicContact CG1-CG2 3.7Å; V195-I230 HydrophobicContact CB-CD1 3.95Å; V195-I230 HydrophobicContact CG1-CD1 3.73Å; V195-I230 HydrophobicContact CG2-CD1 4.06Å; G226-I230 WeakPolarHBondContact O-CG1 3.47Å; G226-I230 PolarHBondContact O-N 3.22Å; A227-I230 WeakPolarHBondContact O-CB 3.19Å; A227-I230 PolarHBondContact O-N 2.91Å; R228-I230 VanDerWaalsContact C-N 3.33Å; R228-I230 PolarHBondContact O-N 3.01Å; I230-F232 VanDerWaalsContact C-N 3.28Å; I230-F232 PolarHBondContact O-N 2.95Å; I230-I233 PolarHBondContact O-N 3.35Å; I230-L234 HydrophobicContact CG2-CD1 3.86Å; I230-L234 HydrophobicContact CG2-CG 4.28Å; I230-L234 VanDerWaalsContact O-CG 3.3Å; I230-L234 WeakPolarHBondContact O-CG 3.18Å; I230-L234 PolarHBondContact O-N 2.83Å; I230-L234 VanDerWaalsContact O-N 3.07Å; I230-M432 HydrophobicContact CB-SD 4.36Å; I230-M432 HydrophobicContact CD1-CE 4.21Å; I230-M432 HydrophobicContact CG1-CE 3.58Å; I230-M432 HydrophobicContact CG1-CG 4.01Å; I230-M432 HydrophobicContact CG1-SD 3.65Å; I230-M435 HydrophobicContact CD1-CE 3.56Å; I230-M435 HydrophobicContact CG1-CE 4.14Å
231	N	91.1	Very high	88.8	Confident	65 Å²	65	41.4 Å²	41.4	35%	0.348	20%	0.199	S	C	.	.	H	α-helix	trans	-53.9	-49.5	-179.1	-169.1	49	0	0	0	111.1	I192 A227 R228 I233 L234 T235	I192-N231 HydrophobicContact CD1-CB 3.52Å; A227-N231 PolarHBondContact O-N 3.4Å; R228-N231 WeakPolarHBondContact O-CB 3.42Å; R228-N231 PolarHBondContact O-N 3.37Å; N231-I233 PolarHBondContact O-N 3.45Å; N231-L234 PolarHBondContact O-N 3.04Å; N231-T235 WeakPolarHBondContact O-CB 3.22Å; N231-T235 PolarHBondContact O-N 3.02Å; N231-T235 PolarHBondContact O-OG1 3.33Å
232	F	90.9	Very high	88.9	Confident	42 Å²	42	41.2 Å²	41.2	18%	0.184	20%	0.199	C	C	.	.	H	α-helix	trans	-61.4	-48	-178.1	-177.4	-93.8	0	0	0	112.3	R228 G229 I230 L234 T235 A236 E424 V425 S428	R228-F232 PolarHBondContact O-N 2.72Å; G229-F232 PolarHBondContact O-N 3.31Å; I230-F232 VanDerWaalsContact C-N 3.28Å; I230-F232 PolarHBondContact O-N 2.95Å; F232-L234 VanDerWaalsContact C-N 3.34Å; F232-L234 PolarHBondContact O-N 3.22Å; F232-T235 PolarHBondContact O-N 3.31Å; F232-A236 HydrophobicContact CD1-CB 4.36Å; F232-A236 HydrophobicContact CE1-CB 3.85Å; F232-A236 HydrophobicContact CZ-CB 3.98Å; F232-A236 WeakPolarHBondContact O-CB 3.49Å; F232-A236 PolarHBondContact O-N 2.89Å; F232-E424 HydrophobicContact CD1-CB 3.78Å; F232-E424 HydrophobicContact CD2-CB 4.2Å; F232-E424 VanDerWaalsContact CE1-C 3.43Å; F232-E424 HydrophobicContact CE1-CB 3.23Å; F232-E424 HydrophobicContact CE2-CB 3.71Å; F232-E424 HydrophobicContact CE2-CG 4.38Å; F232-E424 WeakPolarHBondContact CE2-OE2 3.36Å; F232-E424 HydrophobicContact CG-CB 4.24Å; F232-E424 HydrophobicContact CZ-CB 3.2Å; F232-E424 HydrophobicContact CZ-CG 4.22Å; F232-E424 VanDerWaalsContact CZ-OE2 3.26Å; F232-E424 WeakPolarHBondContact CZ-OE2 3.12Å; F232-V425 HydrophobicContact CD1-CG2 4.5Å; F232-V425 HydrophobicContact CE1-CB 4.48Å; F232-V425 HydrophobicContact CE1-CG2 3.79Å; F232-V425 VanDerWaalsContact CE1-N 3.35Å; F232-S428 WeakPolarHBondContact CD1-OG 3.48Å
233	I	90.6	Very high	89.1	Confident	3 Å²	3	40.5 Å²	40.5	2%	0.015	19%	0.193	C	C	.	.	H	α-helix	trans	-61	-44.7	-179.6	-70	179.5	0	0	0	111	L98 G229 I230 N231 A236 M237 L429 M432	L98-I233 HydrophobicContact CD1-CB 4.39Å; L98-I233 HydrophobicContact CD1-CD1 4.32Å; L98-I233 HydrophobicContact CD1-CG2 3.99Å; G229-I233 WeakPolarHBondContact O-CG1 3.45Å; G229-I233 PolarHBondContact O-N 3.47Å; I230-I233 PolarHBondContact O-N 3.35Å; N231-I233 PolarHBondContact O-N 3.45Å; I233-A236 PolarHBondContact O-N 3.15Å; I233-M237 HydrophobicContact CG2-CE 3.88Å; I233-M237 HydrophobicContact CG2-CG 4.45Å; I233-M237 HydrophobicContact CG2-SD 4.1Å; I233-M237 WeakPolarHBondContact O-CB 3.26Å; I233-M237 WeakPolarHBondContact O-CG 3.27Å; I233-M237 PolarHBondContact O-N 2.96Å; I233-L429 HydrophobicContact CD1-CD2 3.65Å; I233-L429 HydrophobicContact CD1-CG 3.9Å; I233-M432 HydrophobicContact CD1-SD 3.63Å
234	L	88.8	Confident	89.1	Confident	9 Å²	9	40.1 Å²	40.1	5%	0.047	19%	0.192	C	C	.	.	H	α-helix	trans	-62.5	-48.2	179.4	-65.3	-175.3	0	0	0	111.8	V102 F184 A188 I230 N231 F232 M237 V238	V102-L234 HydrophobicContact CG2-CD1 3.86Å; V102-L234 HydrophobicContact CG2-CD2 3.2Å; V102-L234 HydrophobicContact CG2-CG 4.17Å; F184-L234 HydrophobicContact CE1-CB 4.13Å; F184-L234 HydrophobicContact CZ-CB 4.11Å; A188-L234 HydrophobicContact CB-CD1 4.29Å; I230-L234 HydrophobicContact CG2-CD1 3.86Å; I230-L234 HydrophobicContact CG2-CG 4.28Å; I230-L234 VanDerWaalsContact O-CG 3.3Å; I230-L234 WeakPolarHBondContact O-CG 3.18Å; I230-L234 PolarHBondContact O-N 2.83Å; I230-L234 VanDerWaalsContact O-N 3.07Å; N231-L234 PolarHBondContact O-N 3.04Å; F232-L234 VanDerWaalsContact C-N 3.34Å; F232-L234 PolarHBondContact O-N 3.22Å; L234-M237 PolarHBondContact O-N 3.36Å; L234-V238 WeakPolarHBondContact O-CG2 3.45Å; L234-V238 PolarHBondContact O-N 2.97Å; L234-V238 VanDerWaalsContact O-N 3.13Å
235	T	87.5	Confident	89.2	Confident	40 Å²	40	41 Å²	41	25%	0.245	20%	0.2	C	C	.	.	H	α-helix	trans	-62.2	-44.7	176.1	-62.8	0	0	0	0	111.3	N231 F232 M237 V238 F239	N231-T235 WeakPolarHBondContact O-CB 3.22Å; N231-T235 PolarHBondContact O-N 3.02Å; N231-T235 PolarHBondContact O-OG1 3.33Å; F232-T235 PolarHBondContact O-N 3.31Å; T235-M237 PolarHBondContact O-N 3.39Å; T235-V238 PolarHBondContact O-N 3.33Å; T235-F239 HydrophobicContact CG2-CD2 3.3Å; T235-F239 HydrophobicContact CG2-CE2 3.69Å; T235-F239 HydrophobicContact CG2-CG 4.26Å; T235-F239 WeakPolarHBondContact O-CA 3.14Å; T235-F239 WeakPolarHBondContact O-CB 3.36Å; T235-F239 WeakPolarHBondContact O-CG 3.44Å; T235-F239 PolarHBondContact O-N 3.07Å
236	A	89.6	Confident	89.3	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-64	-41.4	-179.7	0	0	0	0	0	112	F232 I233 N240 L241 V421 V425	F232-A236 HydrophobicContact CD1-CB 4.36Å; F232-A236 HydrophobicContact CE1-CB 3.85Å; F232-A236 HydrophobicContact CZ-CB 3.98Å; F232-A236 WeakPolarHBondContact O-CB 3.49Å; F232-A236 PolarHBondContact O-N 2.89Å; I233-A236 PolarHBondContact O-N 3.15Å; A236-N240 WeakPolarHBondContact O-CB 3.39Å; A236-N240 PolarHBondContact O-N 3.06Å; A236-N240 VanDerWaalsContact O-N 3.09Å; A236-L241 PolarHBondContact O-N 3.07Å; A236-V421 HydrophobicContact CB-CG1 4.31Å; A236-V425 HydrophobicContact CB-CG2 4.36Å
237	M	87.3	Confident	89.3	Confident	37 Å²	37	38.6 Å²	38.6	18%	0.182	19%	0.193	C	C	.	.	I	π-helix	trans	-62.5	-51.7	176.1	-75.9	-177.2	173.6	0	0	111.7	I95 I233 L234 T235 L241 F242	I95-M237 HydrophobicContact CD1-CE 4.23Å; I95-M237 HydrophobicContact CG1-CE 4.31Å; I95-M237 HydrophobicContact CG2-CE 3.95Å; I233-M237 HydrophobicContact CG2-CE 3.88Å; I233-M237 HydrophobicContact CG2-CG 4.45Å; I233-M237 HydrophobicContact CG2-SD 4.1Å; I233-M237 WeakPolarHBondContact O-CB 3.26Å; I233-M237 WeakPolarHBondContact O-CG 3.27Å; I233-M237 PolarHBondContact O-N 2.96Å; L234-M237 PolarHBondContact O-N 3.36Å; T235-M237 PolarHBondContact O-N 3.39Å; M237-L241 HydrophobicContact CG-CD1 4.42Å; M237-F242 HydrophobicContact CB-CD2 4.25Å; M237-F242 HydrophobicContact CB-CE2 3.96Å; M237-F242 WeakPolarHBondContact O-CB 3.45Å; M237-F242 WeakPolarHBondContact O-CD2 3.34Å; M237-F242 WeakPolarHBondContact O-CG 2.91Å; M237-F242 PolarHBondContact O-N 3.34Å
238	V	85.2	Confident	89.4	Confident	13 Å²	13	38.9 Å²	38.9	8%	0.079	19%	0.193	C	C	.	.	I	π-helix	trans	-77.4	-34.6	-174	-178.1	0	0	0	0	112.5	L121 R180 F184 L234 T235 P243	L121-V238 HydrophobicContact CD1-CG1 4.28Å; L121-V238 WeakPolarHBondContact CD1-O 3.46Å; R180-V238 PolarHBondContact NH1-O 3.29Å; R180-V238 VanDerWaalsContact NH1-O 3.09Å; F184-V238 HydrophobicContact CD1-CB 4.47Å; F184-V238 HydrophobicContact CD1-CG1 4.48Å; F184-V238 HydrophobicContact CD1-CG2 4.5Å; F184-V238 HydrophobicContact CD2-CG1 4.38Å; F184-V238 HydrophobicContact CD2-CG2 4.28Å; F184-V238 HydrophobicContact CE1-CB 4.23Å; F184-V238 HydrophobicContact CE1-CG2 3.93Å; F184-V238 HydrophobicContact CE2-CG2 3.71Å; F184-V238 HydrophobicContact CG-CG1 4.33Å; F184-V238 HydrophobicContact CZ-CB 4.3Å; F184-V238 HydrophobicContact CZ-CG2 3.51Å; L234-V238 WeakPolarHBondContact O-CG2 3.45Å; L234-V238 PolarHBondContact O-N 2.97Å; L234-V238 VanDerWaalsContact O-N 3.13Å; T235-V238 PolarHBondContact O-N 3.33Å; V238-P243 WeakPolarHBondContact O-CD 3.49Å; V238-P243 WeakPolarHBondContact O-CG 3.32Å
239	F	85.6	Confident	89.5	Confident	35 Å²	35	35.4 Å²	35.4	15%	0.154	19%	0.192	C	C	.	.	I	π-helix	trans	-100	-25.1	-171	-56.2	-20.2	0	0	0	114.6	R180 T181 F184 T235	R180-F239 HydrophobicContact CG-CE1 4.25Å; T181-F239 HydrophobicContact CG2-CE2 3.93Å; T181-F239 HydrophobicContact CG2-CZ 3.95Å; F184-F239 HydrophobicContact CB-CE1 4.2Å; F184-F239 HydrophobicContact CB-CZ 4.15Å; F184-F239 HydrophobicContact CD1-CE1 4.01Å; F184-F239 AromaticContact CD1-CZ 3.72Å; F184-F239 HydrophobicContact CD1-CZ 3.72Å; F184-F239 HydrophobicContact CG-CE1 4.34Å; F184-F239 HydrophobicContact CG-CZ 4.31Å; T235-F239 HydrophobicContact CG2-CD2 3.3Å; T235-F239 HydrophobicContact CG2-CE2 3.69Å; T235-F239 HydrophobicContact CG2-CG 4.26Å; T235-F239 WeakPolarHBondContact O-CA 3.14Å; T235-F239 WeakPolarHBondContact O-CB 3.36Å; T235-F239 WeakPolarHBondContact O-CG 3.44Å; T235-F239 PolarHBondContact O-N 3.07Å
240	N	87.3	Confident	89.6	Confident	54 Å²	54	37.3 Å²	37.3	29%	0.289	20%	0.204	S	C	.	.	I	π-helix	trans	-120.7	-62.2	-175.8	-64.4	-31.2	0	0	0	112.2	A236 T244 V421	A236-N240 WeakPolarHBondContact O-CB 3.39Å; A236-N240 PolarHBondContact O-N 3.06Å; A236-N240 VanDerWaalsContact O-N 3.09Å; N240-T244 WeakPolarHBondContact O-CB 3.4Å; N240-T244 PolarHBondContact O-N 3.05Å; N240-T244 PolarHBondContact O-OG1 3.41Å; N240-V421 HydrophobicContact CB-CG2 4.46Å
241	L	88.1	Confident	89.7	Confident	61 Å²	61	37.3 Å²	37.3	32%	0.319	20%	0.204	S	C	.	.	I	π-helix	trans	-64.6	-58.1	-169.4	-65.5	172.8	0	0	0	112.5	A236 M237 T244 T245 V421	A236-L241 PolarHBondContact O-N 3.07Å; M237-L241 HydrophobicContact CG-CD1 4.42Å; L241-T244 PolarHBondContact O-N 3.42Å; L241-T245 WeakPolarHBondContact O-CB 3.38Å; L241-T245 PolarHBondContact O-N 3.01Å; L241-T245 PolarHBondContact O-OG1 3.46Å; L241-V421 HydrophobicContact CD2-CG1 4.12Å; L241-V421 HydrophobicContact CG-CG1 4.36Å
242	F	88.1	Confident	89.7	Confident	109 Å²	109	35.5 Å²	35.5	48%	0.478	20%	0.195	S	C	.	.	H	α-helix	trans	-63.6	-46.6	-179.6	-65.6	-46.7	0	0	0	113.3	M237 T244 T245 F246	M237-F242 HydrophobicContact CB-CD2 4.25Å; M237-F242 HydrophobicContact CB-CE2 3.96Å; M237-F242 WeakPolarHBondContact O-CB 3.45Å; M237-F242 WeakPolarHBondContact O-CD2 3.34Å; M237-F242 WeakPolarHBondContact O-CG 2.91Å; M237-F242 PolarHBondContact O-N 3.34Å; F242-T244 VanDerWaalsContact C-N 3.32Å; F242-T244 PolarHBondContact O-N 3.03Å; F242-T245 PolarHBondContact O-N 3.17Å; F242-F246 WeakPolarHBondContact O-CB 3.45Å; F242-F246 PolarHBondContact O-N 3.29Å
243	P	88.8	Confident	89.7	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.006	21%	0.205	C	C	.	.	H	α-helix	trans	-60.8	-38.9	177.2	-20.8	29.6	0	0	0	113.4	L121 K125 V238 E247	L121-P243 HydrophobicContact CD1-CG 3.7Å; L121-P243 HydrophobicContact CD2-CB 4.33Å; L121-P243 HydrophobicContact CD2-CG 4.15Å; L121-P243 HydrophobicContact CG-CB 4.44Å; L121-P243 HydrophobicContact CG-CG 3.88Å; K125-P243 HydrophobicContact CD-CB 4.38Å; K125-P243 HydrophobicContact CG-CB 4.28Å; V238-P243 WeakPolarHBondContact O-CD 3.49Å; V238-P243 WeakPolarHBondContact O-CG 3.32Å; P243-E247 VanDerWaalsContact O-CB 3.25Å; P243-E247 WeakPolarHBondContact O-CB 3.29Å; P243-E247 PolarHBondContact O-N 3.37Å
244	T	90.4	Very high	89.7	Confident	20 Å²	20	36.7 Å²	36.7	12%	0.123	21%	0.212	C	C	.	.	H	α-helix	trans	-71.1	-44	-179.5	-54.5	0	0	0	0	110.9	N240 L241 F242 F246 E247 V248 P414 L415	N240-T244 WeakPolarHBondContact O-CB 3.4Å; N240-T244 PolarHBondContact O-N 3.05Å; N240-T244 PolarHBondContact O-OG1 3.41Å; L241-T244 PolarHBondContact O-N 3.42Å; F242-T244 VanDerWaalsContact C-N 3.32Å; F242-T244 PolarHBondContact O-N 3.03Å; T244-F246 VanDerWaalsContact C-N 3.29Å; T244-F246 PolarHBondContact O-N 3.38Å; T244-E247 PolarHBondContact O-N 3.3Å; T244-V248 HydrophobicContact CG2-CG2 4.31Å; T244-V248 WeakPolarHBondContact O-CB 3.37Å; T244-V248 VanDerWaalsContact O-CG2 3.29Å; T244-V248 WeakPolarHBondContact O-CG2 3.44Å; T244-V248 PolarHBondContact O-N 3.09Å; T244-P414 HydrophobicContact CG2-CB 4.09Å; T244-P414 VanDerWaalsContact OG1-CB 3.28Å; T244-P414 WeakPolarHBondContact OG1-CB 3.41Å; T244-L415 HydrophobicContact CG2-CD2 4.03Å; T244-L415 HydrophobicContact CG2-CG 4.41Å
245	T	90.8	Very high	89.8	Confident	98 Å²	98	36.3 Å²	36.3	60%	0.601	21%	0.21	S	C	*	.	H	α-helix	trans	-59.9	-42.6	175.3	-58.6	0	0	0	0	111.2	L241 F242 A249	L241-T245 WeakPolarHBondContact O-CB 3.38Å; L241-T245 PolarHBondContact O-N 3.01Å; L241-T245 PolarHBondContact O-OG1 3.46Å; F242-T245 PolarHBondContact O-N 3.17Å; T245-A249 WeakPolarHBondContact O-CB 3.47Å; T245-A249 PolarHBondContact O-N 3.31Å
246	F	91.3	Very high	89.9	Confident	67 Å²	67	40.2 Å²	40.2	29%	0.294	22%	0.221	S	C	.	.	H	α-helix	trans	-62.9	-47.4	175.3	178.9	-100.1	0	0	0	111.9	L122 K125 F242 T244 V248 A249 V250	L122-F246 HydrophobicContact CD2-CD1 4.46Å; L122-F246 HydrophobicContact CD2-CD2 4.11Å; L122-F246 HydrophobicContact CD2-CE1 4.26Å; L122-F246 HydrophobicContact CD2-CE2 3.9Å; L122-F246 HydrophobicContact CD2-CG 4.38Å; L122-F246 HydrophobicContact CD2-CZ 3.98Å; K125-F246 HydrophobicContact CB-CD1 3.88Å; K125-F246 HydrophobicContact CB-CE1 3.9Å; K125-F246 HydrophobicContact CG-CD1 4.38Å; F242-F246 WeakPolarHBondContact O-CB 3.45Å; F242-F246 PolarHBondContact O-N 3.29Å; T244-F246 VanDerWaalsContact C-N 3.29Å; T244-F246 PolarHBondContact O-N 3.38Å; F246-V248 PolarHBondContact O-N 2.93Å; F246-A249 PolarHBondContact O-N 3.43Å; F246-V250 HydrophobicContact CD1-CG2 4.2Å; F246-V250 HydrophobicContact CD2-CG2 4.37Å; F246-V250 HydrophobicContact CE1-CG2 3.8Å; F246-V250 HydrophobicContact CE2-CG2 3.97Å; F246-V250 HydrophobicContact CG-CG2 4.48Å; F246-V250 HydrophobicContact CZ-CG2 3.68Å; F246-V250 WeakPolarHBondContact O-CG2 3.5Å; F246-V250 PolarHBondContact O-N 3.29Å
247	E	91.5	Very high	89.7	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.009	24%	0.242	C	C	.	.	H	α-helix	trans	-64.3	-41.2	-179.6	-164.8	170.9	-148	0	0	112.1	K125 N128 P243 T244 V250 V251 L411	K125-E247 HydrophobicContact CD-CB 4.48Å; K125-E247 IonicContact NZ-OE1 3.66Å; K125-E247 PolarHBondContact NZ-OE1 3.43Å; K125-E247 IonicContact NZ-OE2 2.78Å; K125-E247 PolarHBondContact NZ-OE2 3.09Å; N128-E247 PolarHBondContact ND2-OE1 3.35Å; P243-E247 VanDerWaalsContact O-CB 3.25Å; P243-E247 WeakPolarHBondContact O-CB 3.29Å; P243-E247 PolarHBondContact O-N 3.37Å; T244-E247 PolarHBondContact O-N 3.3Å; E247-V250 PolarHBondContact O-N 2.98Å; E247-V251 HydrophobicContact CG-CG2 4.37Å; E247-V251 WeakPolarHBondContact O-CB 3.41Å; E247-V251 VanDerWaalsContact O-CG2 3.25Å; E247-V251 WeakPolarHBondContact O-CG2 3.49Å; E247-V251 PolarHBondContact O-N 3.47Å; E247-L411 HydrophobicContact CB-CD2 4.1Å; E247-L411 HydrophobicContact CG-CD2 3.7Å
248	V	92.3	Very high	89.6	Confident	25 Å²	25	46.7 Å²	46.7	15%	0.152	25%	0.246	C	C	.	.	H	α-helix	trans	-60.2	-46.4	173.3	169.3	0	0	0	0	110.8	T244 F246 T252 I271 L411	T244-V248 HydrophobicContact CG2-CG2 4.31Å; T244-V248 WeakPolarHBondContact O-CB 3.37Å; T244-V248 VanDerWaalsContact O-CG2 3.29Å; T244-V248 WeakPolarHBondContact O-CG2 3.44Å; T244-V248 PolarHBondContact O-N 3.09Å; F246-V248 PolarHBondContact O-N 2.93Å; V248-T252 HydrophobicContact CG1-CG2 4.3Å; V248-T252 WeakPolarHBondContact O-CB 3.45Å; V248-T252 VanDerWaalsContact O-CG2 3.31Å; V248-T252 WeakPolarHBondContact O-CG2 3.5Å; V248-T252 PolarHBondContact O-N 3.29Å; V248-T252 PolarHBondContact O-OG1 3.45Å; V248-I271 HydrophobicContact CG1-CD1 4Å; V248-I271 HydrophobicContact CG2-CD1 4.39Å; V248-L411 HydrophobicContact CG2-CD1 4.48Å; V248-L411 HydrophobicContact CG2-CD2 3.86Å
249	A	92.9	Very high	89.5	Confident	59 Å²	59	46.1 Å²	46.1	49%	0.488	24%	0.242	S	C	.	.	H	α-helix	trans	-62.4	-43.9	178.6	0	0	0	0	0	112	T245 F246 T252 G253	T245-A249 WeakPolarHBondContact O-CB 3.47Å; T245-A249 PolarHBondContact O-N 3.31Å; F246-A249 PolarHBondContact O-N 3.43Å; A249-T252 PolarHBondContact O-OG1 3.47Å; A249-G253 PolarHBondContact O-N 3.18Å
250	V	92.5	Very high	89.4	Confident	42 Å²	42	44.6 Å²	44.6	26%	0.255	24%	0.236	S	C	.	.	H	α-helix	trans	-66.5	-48.4	178.2	172.2	0	0	0	0	111.3	V129 F246 E247 G253 I254	V129-V250 HydrophobicContact CB-CG1 4.45Å; V129-V250 HydrophobicContact CG1-CG1 3.85Å; V129-V250 HydrophobicContact CG2-CG1 3.98Å; F246-V250 HydrophobicContact CD1-CG2 4.2Å; F246-V250 HydrophobicContact CD2-CG2 4.37Å; F246-V250 HydrophobicContact CE1-CG2 3.8Å; F246-V250 HydrophobicContact CE2-CG2 3.97Å; F246-V250 HydrophobicContact CG-CG2 4.48Å; F246-V250 HydrophobicContact CZ-CG2 3.68Å; F246-V250 WeakPolarHBondContact O-CG2 3.5Å; F246-V250 PolarHBondContact O-N 3.29Å; E247-V250 PolarHBondContact O-N 2.98Å; V250-G253 PolarHBondContact O-N 3.35Å; V250-I254 HydrophobicContact CG1-CD1 3.71Å; V250-I254 HydrophobicContact CG1-CG1 4.44Å; V250-I254 VanDerWaalsContact O-CG1 3.25Å; V250-I254 WeakPolarHBondContact O-CG1 3.26Å; V250-I254 PolarHBondContact O-N 2.93Å
251	V	92.6	Very high	89.4	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.8	-45.8	-178.9	170.3	0	0	0	0	111.3	E247 G253 I254 L255 L407 L411	E247-V251 HydrophobicContact CG-CG2 4.37Å; E247-V251 WeakPolarHBondContact O-CB 3.41Å; E247-V251 VanDerWaalsContact O-CG2 3.25Å; E247-V251 WeakPolarHBondContact O-CG2 3.49Å; E247-V251 PolarHBondContact O-N 3.47Å; V251-G253 VanDerWaalsContact C-N 3.33Å; V251-G253 PolarHBondContact O-N 3.43Å; V251-I254 PolarHBondContact O-N 3.2Å; V251-L255 HydrophobicContact CG1-CD1 4.27Å; V251-L255 HydrophobicContact CG1-CG 4.44Å; V251-L255 WeakPolarHBondContact O-CG 3.5Å; V251-L255 PolarHBondContact O-N 3.31Å; V251-L407 HydrophobicContact CG1-CB 3.97Å; V251-L407 HydrophobicContact CG2-CB 4.47Å; V251-L407 HydrophobicContact CG2-CD2 4.25Å; V251-L411 HydrophobicContact CB-CD1 3.93Å; V251-L411 HydrophobicContact CB-CD2 4.38Å; V251-L411 HydrophobicContact CB-CG 4.36Å; V251-L411 HydrophobicContact CG1-CD1 3.67Å; V251-L411 HydrophobicContact CG1-CG 4.31Å; V251-L411 HydrophobicContact CG2-CD1 4.35Å; V251-L411 HydrophobicContact CG2-CD2 4.1Å; V251-L411 HydrophobicContact CG2-CG 4.23Å
252	T	91.2	Very high	89.4	Confident	28 Å²	28	44.7 Å²	44.7	17%	0.172	25%	0.246	C	C	.	.	H	α-helix	trans	-64.6	-37.6	177.2	52.9	0	0	0	0	111.9	V248 A249 L255 Y256 L268 I271	V248-T252 HydrophobicContact CG1-CG2 4.3Å; V248-T252 WeakPolarHBondContact O-CB 3.45Å; V248-T252 VanDerWaalsContact O-CG2 3.31Å; V248-T252 WeakPolarHBondContact O-CG2 3.5Å; V248-T252 PolarHBondContact O-N 3.29Å; V248-T252 PolarHBondContact O-OG1 3.45Å; A249-T252 PolarHBondContact O-OG1 3.47Å; T252-L255 PolarHBondContact O-N 3.11Å; T252-Y256 WeakPolarHBondContact O-CB 3.47Å; T252-Y256 PolarHBondContact O-N 3.33Å; T252-L268 HydrophobicContact CG2-CD1 4.47Å; T252-I271 HydrophobicContact CG2-CD1 4.41Å
253	G	91.8	Very high	89.4	Confident	38 Å²	38	39.5 Å²	39.5	39%	0.392	22%	0.223	S	C	.	.	H	α-helix	trans	-62.5	-42.7	172	0	0	0	0	0	113.3	A249 V250 V251 Y256 Y257	A249-G253 PolarHBondContact O-N 3.18Å; V250-G253 PolarHBondContact O-N 3.35Å; V251-G253 VanDerWaalsContact C-N 3.33Å; V251-G253 PolarHBondContact O-N 3.43Å; G253-Y256 PolarHBondContact O-N 2.98Å; G253-Y257 WeakPolarHBondContact O-CB 3.49Å; G253-Y257 PolarHBondContact O-N 3.49Å
254	I	90.6	Very high	89.5	Confident	32 Å²	32	40 Å²	40	16%	0.164	23%	0.227	C	C	.	.	H	α-helix	trans	-62.9	-43.9	174.7	-70.8	164.8	0	0	0	110.8	V129 F133 V250 V251 Y256 Y257 K258 L407	V129-I254 HydrophobicContact CG1-CD1 3.39Å; F133-I254 HydrophobicContact CE2-CD1 4.16Å; F133-I254 HydrophobicContact CE2-CG2 4.34Å; F133-I254 HydrophobicContact CZ-CD1 4.39Å; F133-I254 HydrophobicContact CZ-CG2 3.81Å; V250-I254 HydrophobicContact CG1-CD1 3.71Å; V250-I254 HydrophobicContact CG1-CG1 4.44Å; V250-I254 VanDerWaalsContact O-CG1 3.25Å; V250-I254 WeakPolarHBondContact O-CG1 3.26Å; V250-I254 PolarHBondContact O-N 2.93Å; V251-I254 PolarHBondContact O-N 3.2Å; I254-Y256 VanDerWaalsContact C-N 3.34Å; I254-Y257 PolarHBondContact O-N 3.29Å; I254-K258 HydrophobicContact CG2-CD 4.36Å; I254-K258 WeakPolarHBondContact O-CB 3.33Å; I254-K258 PolarHBondContact O-N 3.24Å; I254-L407 HydrophobicContact CG2-CD1 3.9Å
255	L	90.2	Very high	89.6	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-63.6	-42	178.9	-69.7	178.1	0	0	0	111.7	V251 T252 Y259 G260 A267 V404 L408	V251-L255 HydrophobicContact CG1-CD1 4.27Å; V251-L255 HydrophobicContact CG1-CG 4.44Å; V251-L255 WeakPolarHBondContact O-CG 3.5Å; V251-L255 PolarHBondContact O-N 3.31Å; T252-L255 PolarHBondContact O-N 3.11Å; L255-Y259 HydrophobicContact CD2-CD2 3.52Å; L255-Y259 HydrophobicContact CD2-CE2 3.79Å; L255-Y259 PolarHBondContact O-N 3.38Å; L255-G260 PolarHBondContact O-N 3.36Å; L255-A267 HydrophobicContact CD1-CB 3.56Å; L255-V404 HydrophobicContact CD2-CG1 4.47Å; L255-V404 HydrophobicContact CD2-CG2 3.97Å; L255-L408 HydrophobicContact CD1-CD2 3.94Å
256	Y	90	Very high	89.7	Confident	122 Å²	122	40.4 Å²	40.4	48%	0.478	23%	0.227	S	C	.	.	H	α-helix	trans	-61.6	-47.2	176.7	177	-95.1	0	0	0	111.4	T252 G253 I254 G260 V261	T252-Y256 WeakPolarHBondContact O-CB 3.47Å; T252-Y256 PolarHBondContact O-N 3.33Å; G253-Y256 PolarHBondContact O-N 2.98Å; I254-Y256 VanDerWaalsContact C-N 3.34Å; Y256-G260 WeakPolarHBondContact O-CA 3.31Å; Y256-G260 PolarHBondContact O-N 3.26Å; Y256-V261 HydrophobicContact CD2-CG2 4.33Å; Y256-V261 HydrophobicContact CE2-CG2 3.8Å
257	Y	86.4	Confident	89.7	Confident	116 Å²	116	37.3 Å²	37.3	46%	0.455	21%	0.214	S	C	.	.	H	α-helix	trans	-70.6	-37.4	-177.5	-174.7	-95.4	0	0	0	113.4	G253 I254 T379 V383	G253-Y257 WeakPolarHBondContact O-CB 3.49Å; G253-Y257 PolarHBondContact O-N 3.49Å; I254-Y257 PolarHBondContact O-N 3.29Å; Y257-T379 WeakPolarHBondContact O-CG2 3.47Å; Y257-V383 HydrophobicContact CE1-CG2 4.4Å; Y257-V383 HydrophobicContact CE2-CG2 4.43Å
258	K	83.4	Confident	89.8	Confident	58 Å²	58	41.9 Å²	41.9	25%	0.252	24%	0.238	S	C	.	.	H	α-helix	trans	-94	-35.6	-174.5	-73.2	-162.4	70.9	-156.8	0	115.4	F133 I254 D400	F133-K258 HydrophobicContact CE1-CD 4.11Å; F133-K258 HydrophobicContact CZ-CD 4.38Å; I254-K258 HydrophobicContact CG2-CD 4.36Å; I254-K258 WeakPolarHBondContact O-CB 3.33Å; I254-K258 PolarHBondContact O-N 3.24Å; K258-D400 IonicContact NZ-OD1 2.79Å; K258-D400 PolarHBondContact NZ-OD1 3.36Å
259	Y	83.8	Confident	90	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.008	26%	0.256	C	S	.	.	H	α-helix	trans	-120.3	0.2	-170.5	-51.8	-67.4	0	0	0	113.1	L255 V366 Q369 L396 D400 L403 V404	L255-Y259 HydrophobicContact CD2-CD2 3.52Å; L255-Y259 HydrophobicContact CD2-CE2 3.79Å; L255-Y259 PolarHBondContact O-N 3.38Å; Y259-V366 HydrophobicContact CD1-CG1 4.29Å; Y259-V366 HydrophobicContact CD1-CG2 4.15Å; Y259-V366 HydrophobicContact CE1-CG1 4.28Å; Y259-V366 HydrophobicContact CG-CG2 4.26Å; Y259-Q369 PolarHBondContact O-NE2 2.81Å; Y259-Q369 VanDerWaalsContact O-NE2 3.08Å; Y259-L396 HydrophobicContact CD1-CD1 4.05Å; Y259-L396 HydrophobicContact CD1-CD2 4Å; Y259-L396 HydrophobicContact CE1-CD1 4.46Å; Y259-L396 HydrophobicContact CE1-CD2 3.89Å; Y259-D400 HydrophobicContact CE1-CB 3.78Å; Y259-D400 PolarHBondContact OH-OD1 3.24Å; Y259-L403 WeakPolarHBondContact OH-CD2 3.44Å; Y259-L403 WeakPolarHBondContact OH-CG 3.39Å; Y259-V404 HydrophobicContact CD1-CG2 4.49Å; Y259-V404 HydrophobicContact CD2-CG2 3.75Å; Y259-V404 HydrophobicContact CE1-CG2 4.09Å; Y259-V404 HydrophobicContact CE2-CG2 3.27Å; Y259-V404 HydrophobicContact CG-CG2 4.34Å; Y259-V404 VanDerWaalsContact CZ-CG2 3.46Å
260	G	82.7	Confident	90	Very high	2 Å²	2	42.1 Å²	42.1	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	85.7	-173	175.9	0	0	0	0	0	115	L255 Y256 A262 S264 T379	L255-G260 PolarHBondContact O-N 3.36Å; Y256-G260 WeakPolarHBondContact O-CA 3.31Å; Y256-G260 PolarHBondContact O-N 3.26Å; G260-A262 VanDerWaalsContact C-N 3.34Å; G260-A262 PolarHBondContact O-N 2.79Å; G260-S264 PolarHBondContact O-N 3.15Å; G260-S264 PolarHBondContact O-OG 3.06Å; G260-T379 WeakPolarHBondContact CA-OG1 3.27Å
261	V	87.9	Confident	90.1	Very high	71 Å²	71	41 Å²	41	43%	0.43	23%	0.229	S	C	.	.	H	α-helix	trans	-67	-35.9	-174.1	179.2	0	0	0	0	111.5	Y256 S264 T265	Y256-V261 HydrophobicContact CD2-CG2 4.33Å; Y256-V261 HydrophobicContact CE2-CG2 3.8Å; V261-S264 WeakPolarHBondContact CA-OG 3.13Å; V261-S264 PolarHBondContact O-OG 3.04Å; V261-T265 VanDerWaalsContact O-CB 3.24Å; V261-T265 WeakPolarHBondContact O-CB 3.06Å; V261-T265 PolarHBondContact O-N 3.16Å; V261-T265 PolarHBondContact O-OG1 3.26Å
262	A	88.1	Confident	90.1	Very high	47 Å²	47	43.8 Å²	43.8	39%	0.388	25%	0.252	S	S	.	.	H	α-helix	trans	-61.4	-53.7	-176.3	0	0	0	0	0	112	G260 S264 T265 I266	G260-A262 VanDerWaalsContact C-N 3.34Å; G260-A262 PolarHBondContact O-N 2.79Å; A262-S264 PolarHBondContact O-N 2.76Å; A262-T265 PolarHBondContact O-N 3.29Å; A262-I266 WeakPolarHBondContact O-CD1 3.22Å; A262-I266 VanDerWaalsContact O-CG1 3.25Å; A262-I266 WeakPolarHBondContact O-CG1 3.11Å; A262-I266 PolarHBondContact O-N 3Å
263	A	87.8	Confident	90.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64.3	-42.1	-178.7	0	0	0	0	0	112.3	A267 T362	A263-A267 WeakPolarHBondContact O-CB 3.26Å; A263-A267 PolarHBondContact O-N 3.13Å; A263-T362 HydrophobicContact CB-CG2 3.94Å
264	S	91.5	Very high	90.4	Very high	12 Å²	12	42.9 Å²	42.9	8%	0.084	24%	0.243	C	C	.	.	H	α-helix	trans	-67.3	-38.7	178.8	54	0	0	0	0	112.8	G260 V261 A262 A267 L268	G260-S264 PolarHBondContact O-N 3.15Å; G260-S264 PolarHBondContact O-OG 3.06Å; V261-S264 WeakPolarHBondContact CA-OG 3.13Å; V261-S264 PolarHBondContact O-OG 3.04Å; A262-S264 PolarHBondContact O-N 2.76Å; S264-A267 PolarHBondContact O-N 3.33Å; S264-L268 WeakPolarHBondContact O-CB 3.36Å; S264-L268 PolarHBondContact O-N 2.88Å
265	T	92.7	Very high	90.5	Very high	79 Å²	79	43.1 Å²	43.1	49%	0.485	25%	0.246	S	C	.	.	H	α-helix	trans	-68.4	-41	177.3	-56	0	0	0	0	111.7	V261 A262 L268 S269	V261-T265 VanDerWaalsContact O-CB 3.24Å; V261-T265 WeakPolarHBondContact O-CB 3.06Å; V261-T265 PolarHBondContact O-N 3.16Å; V261-T265 PolarHBondContact O-OG1 3.26Å; A262-T265 PolarHBondContact O-N 3.29Å; T265-L268 PolarHBondContact O-N 3.13Å; T265-S269 VanDerWaalsContact O-CB 3.24Å; T265-S269 WeakPolarHBondContact O-CB 3.38Å; T265-S269 PolarHBondContact O-N 3.23Å
266	I	93.2	Very high	90.7	Very high	46 Å²	46	46 Å²	46	24%	0.236	27%	0.271	C	S	.	.	H	α-helix	trans	-60.9	-46.7	174.3	-66.6	165.2	0	0	0	110.1	A262 S269 C270 A361 T362 T365	A262-I266 WeakPolarHBondContact O-CD1 3.22Å; A262-I266 VanDerWaalsContact O-CG1 3.25Å; A262-I266 WeakPolarHBondContact O-CG1 3.11Å; A262-I266 PolarHBondContact O-N 3Å; I266-S269 PolarHBondContact O-N 2.86Å; I266-C270 WeakPolarHBondContact O-CB 3.48Å; I266-C270 PolarHBondContact O-N 2.71Å; I266-A361 HydrophobicContact CG2-CB 3.83Å; I266-T362 WeakPolarHBondContact CG2-OG1 3.47Å; I266-T365 HydrophobicContact CD1-CG2 3.56Å
267	A	91.8	Very high	90.9	Very high	2 Å²	2	43 Å²	43	2%	0.017	26%	0.26	C	S	.	.	H	α-helix	trans	-61.2	-46.4	177.7	0	0	0	0	0	112.3	L255 A263 S264 C270 I271 L408	L255-A267 HydrophobicContact CD1-CB 3.56Å; A263-A267 WeakPolarHBondContact O-CB 3.26Å; A263-A267 PolarHBondContact O-N 3.13Å; S264-A267 PolarHBondContact O-N 3.33Å; A267-C270 WeakPolarHBondContact O-CB 3.36Å; A267-C270 PolarHBondContact O-N 3.22Å; A267-I271 WeakPolarHBondContact O-CG1 3.45Å; A267-I271 PolarHBondContact O-N 2.99Å; A267-L408 HydrophobicContact CB-CD2 3.81Å
268	L	93.5	Very high	91.2	Very high	98 Å²	98	37.5 Å²	37.5	51%	0.513	24%	0.238	S	C	.	.	H	α-helix	trans	-65.3	-40.7	178.9	-171.2	65.9	0	0	0	111.8	T252 S264 T265 I271 A272	T252-L268 HydrophobicContact CG2-CD1 4.47Å; S264-L268 WeakPolarHBondContact O-CB 3.36Å; S264-L268 PolarHBondContact O-N 2.88Å; T265-L268 PolarHBondContact O-N 3.13Å; L268-I271 PolarHBondContact O-N 3.33Å; L268-A272 WeakPolarHBondContact O-CB 3.33Å; L268-A272 PolarHBondContact O-N 3.21Å
269	S	94.8	Very high	91.5	Very high	76 Å²	76	38.3 Å²	38.3	53%	0.531	24%	0.242	S	C	.	.	H	α-helix	trans	-63.9	-39.7	174.4	-175.3	0	0	0	0	111.9	T265 I266 A272 A273	T265-S269 VanDerWaalsContact O-CB 3.24Å; T265-S269 WeakPolarHBondContact O-CB 3.38Å; T265-S269 PolarHBondContact O-N 3.23Å; I266-S269 PolarHBondContact O-N 2.86Å; S269-A272 PolarHBondContact O-N 3.12Å; S269-A273 VanDerWaalsContact O-CB 3.28Å; S269-A273 WeakPolarHBondContact O-CB 3.12Å; S269-A273 PolarHBondContact O-N 2.98Å
270	C	94.6	Very high	92	Very high	14 Å²	14	41.2 Å²	41.2	10%	0.095	27%	0.267	C	S	.	.	H	α-helix	trans	-61.1	-47.8	174.4	179.3	0	0	0	0	111.1	I266 A267 A272 A273 Y274	I266-C270 WeakPolarHBondContact O-CB 3.48Å; I266-C270 PolarHBondContact O-N 2.71Å; A267-C270 WeakPolarHBondContact O-CB 3.36Å; A267-C270 PolarHBondContact O-N 3.22Å; C270-A272 PolarHBondContact O-N 3.07Å; C270-A273 PolarHBondContact O-N 3.34Å; C270-Y274 VanDerWaalsContact O-CB 3.23Å; C270-Y274 WeakPolarHBondContact O-CB 3.46Å; C270-Y274 PolarHBondContact O-N 2.73Å
271	I	93.1	Very high	92.4	Very high	19 Å²	19	42 Å²	42	10%	0.097	27%	0.271	C	S	.	.	H	α-helix	trans	-62.7	-44.1	177.5	-64.9	165.6	0	0	0	110.7	V248 T252 A267 L268 Y274 T275 L411 L415	V248-I271 HydrophobicContact CG1-CD1 4Å; V248-I271 HydrophobicContact CG2-CD1 4.39Å; T252-I271 HydrophobicContact CG2-CD1 4.41Å; A267-I271 WeakPolarHBondContact O-CG1 3.45Å; A267-I271 PolarHBondContact O-N 2.99Å; L268-I271 PolarHBondContact O-N 3.33Å; I271-Y274 WeakPolarHBondContact O-CB 3.46Å; I271-Y274 PolarHBondContact O-N 2.97Å; I271-T275 WeakPolarHBondContact O-CB 3.19Å; I271-T275 PolarHBondContact O-N 3.22Å; I271-T275 PolarHBondContact O-OG1 2.87Å; I271-T275 VanDerWaalsContact O-OG1 3.1Å; I271-L411 HydrophobicContact CD1-CD1 3.91Å; I271-L415 HydrophobicContact CG1-CD1 4.47Å; I271-L415 HydrophobicContact CG2-CD1 4.44Å
272	A	93.9	Very high	92.5	Very high	58 Å²	58	39 Å²	39	48%	0.479	25%	0.252	S	S	.	.	H	α-helix	trans	-62.1	-46	177.7	0	0	0	0	0	112.1	L268 S269 C270 T275 A276	L268-A272 WeakPolarHBondContact O-CB 3.33Å; L268-A272 PolarHBondContact O-N 3.21Å; S269-A272 PolarHBondContact O-N 3.12Å; C270-A272 PolarHBondContact O-N 3.07Å; A272-T275 PolarHBondContact O-N 3.33Å; A272-A276 WeakPolarHBondContact O-CB 3.45Å; A272-A276 PolarHBondContact O-N 3.07Å
273	A	95.4	Very high	92.5	Very high	45 Å²	45	46.5 Å²	46.5	37%	0.372	27%	0.271	S	S	.	.	H	α-helix	trans	-62	-43.4	175.3	0	0	0	0	0	111.5	S269 C270 A276 F277 I354	S269-A273 VanDerWaalsContact O-CB 3.28Å; S269-A273 WeakPolarHBondContact O-CB 3.12Å; S269-A273 PolarHBondContact O-N 2.98Å; C270-A273 PolarHBondContact O-N 3.34Å; A273-A276 PolarHBondContact O-N 2.78Å; A273-F277 WeakPolarHBondContact O-CB 3.36Å; A273-F277 PolarHBondContact O-N 3.42Å; A273-I354 HydrophobicContact CB-CG2 4.1Å
274	Y	93.9	Very high	92.7	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.008	29%	0.294	C	S	.	.	H	α-helix	trans	-59.3	-48.7	176.1	-177.1	-77.3	0	0	0	111.3	C270 I271 T278 Q351 L415 N416	C270-Y274 VanDerWaalsContact O-CB 3.23Å; C270-Y274 WeakPolarHBondContact O-CB 3.46Å; C270-Y274 PolarHBondContact O-N 2.73Å; I271-Y274 WeakPolarHBondContact O-CB 3.46Å; I271-Y274 PolarHBondContact O-N 2.97Å; Y274-T278 WeakPolarHBondContact CE1-OG1 3.49Å; Y274-T278 WeakPolarHBondContact O-CB 3.47Å; Y274-T278 PolarHBondContact O-N 2.81Å; Y274-T278 PolarHBondContact O-OG1 3.48Å; Y274-Q351 HydrophobicContact CD2-CB 4.26Å; Y274-Q351 HydrophobicContact CD2-CG 4.24Å; Y274-Q351 HydrophobicContact CE1-CG 4.36Å; Y274-Q351 HydrophobicContact CE2-CB 3.53Å; Y274-Q351 HydrophobicContact CE2-CG 3.61Å; Y274-Q351 PolarHBondContact OH-NE2 3.27Å; Y274-Q351 VanDerWaalsContact OH-NE2 3.12Å; Y274-L415 HydrophobicContact CD1-CB 4.27Å; Y274-L415 HydrophobicContact CE1-CB 3.69Å; Y274-L415 WeakPolarHBondContact CE1-O 3.43Å; Y274-L415 VanDerWaalsContact OH-C 3.25Å; Y274-L415 PolarHBondContact OH-O 2.97Å; Y274-N416 WeakPolarHBondContact OH-CA 3.36Å; Y274-N416 PolarHBondContact OH-N 3.35Å; Y274-N416 PolarHBondContact OH-OD1 2.97Å
275	T	91.8	Very high	92.8	Very high	37 Å²	37	54.1 Å²	54.1	23%	0.227	30%	0.298	C	S	.	.	H	α-helix	trans	-64.3	-46.4	179.3	-63.1	0	0	0	0	111.5	I271 A272 T278 F279 L418	I271-T275 WeakPolarHBondContact O-CB 3.19Å; I271-T275 PolarHBondContact O-N 3.22Å; I271-T275 PolarHBondContact O-OG1 2.87Å; I271-T275 VanDerWaalsContact O-OG1 3.1Å; A272-T275 PolarHBondContact O-N 3.33Å; T275-T278 PolarHBondContact O-N 2.84Å; T275-F279 HydrophobicContact CG2-CD2 3.82Å; T275-F279 HydrophobicContact CG2-CE2 3.43Å; T275-F279 VanDerWaalsContact CG2-CE2 3.43Å; T275-F279 HydrophobicContact CG2-CZ 3.93Å; T275-F279 WeakPolarHBondContact O-CG 3.5Å; T275-F279 PolarHBondContact O-N 3.45Å; T275-L418 HydrophobicContact CG2-CD2 4.06Å
276	A	94.1	Very high	92.5	Very high	61 Å²	61	52.5 Å²	52.5	50%	0.504	29%	0.288	S	S	.	.	H	α-helix	trans	-61.9	-47.5	178.8	0	0	0	0	0	111.9	A272 A273 F279 A280	A272-A276 WeakPolarHBondContact O-CB 3.45Å; A272-A276 PolarHBondContact O-N 3.07Å; A273-A276 PolarHBondContact O-N 2.78Å; A276-F279 PolarHBondContact O-N 2.91Å; A276-A280 WeakPolarHBondContact O-CB 3.33Å; A276-A280 PolarHBondContact O-N 3.34Å
277	F	95	Very high	92.4	Very high	58 Å²	58	56 Å²	56	25%	0.254	30%	0.304	S	S	.	.	H	α-helix	trans	-59.9	-48.7	175.6	176	-100.2	0	0	0	111.5	A273 F279 A280 V281 L347 Q351 I354	A273-F277 WeakPolarHBondContact O-CB 3.36Å; A273-F277 PolarHBondContact O-N 3.42Å; F277-F279 VanDerWaalsContact C-N 3.33Å; F277-F279 PolarHBondContact O-N 2.94Å; F277-A280 PolarHBondContact O-N 3.36Å; F277-V281 HydrophobicContact CD1-CG2 4.47Å; F277-V281 HydrophobicContact CD2-CG2 3.97Å; F277-V281 HydrophobicContact CE1-CG2 4.11Å; F277-V281 HydrophobicContact CE2-CG2 3.56Å; F277-V281 HydrophobicContact CG-CG2 4.4Å; F277-V281 HydrophobicContact CZ-CG2 3.64Å; F277-V281 WeakPolarHBondContact O-CB 3.25Å; F277-V281 WeakPolarHBondContact O-CG2 3.43Å; F277-V281 PolarHBondContact O-N 3.12Å; F277-L347 HydrophobicContact CD1-CD1 4.39Å; F277-L347 HydrophobicContact CE1-CD1 4.04Å; F277-Q351 HydrophobicContact CD1-CG 4.3Å; F277-Q351 HydrophobicContact CE1-CG 4.36Å; F277-I354 HydrophobicContact CB-CD1 3.53Å; F277-I354 HydrophobicContact CD1-CD1 3.8Å; F277-I354 HydrophobicContact CD2-CD1 4.2Å; F277-I354 HydrophobicContact CG-CD1 3.57Å
278	T	92.9	Very high	92.4	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-57.6	-46.2	180	-61.9	0	0	0	0	111	Y274 T275 T282 L347 Q351	Y274-T278 WeakPolarHBondContact CE1-OG1 3.49Å; Y274-T278 WeakPolarHBondContact O-CB 3.47Å; Y274-T278 PolarHBondContact O-N 2.81Å; Y274-T278 PolarHBondContact O-OG1 3.48Å; T275-T278 PolarHBondContact O-N 2.84Å; T278-T282 WeakPolarHBondContact O-CB 3.25Å; T278-T282 PolarHBondContact O-N 3.02Å; T278-T282 PolarHBondContact O-OG1 2.77Å; T278-L347 HydrophobicContact CG2-CD1 4.42Å; T278-Q351 PolarHBondContact OG1-NE2 3.47Å
279	F	89.9	Confident	92.2	Very high	75 Å²	75	57.4 Å²	57.4	33%	0.329	30%	0.302	S	S	.	.	H	α-helix	trans	-68.7	-42	179	-69.7	-21.5	0	0	0	113.2	T275 A276 F277 T282 R283 L418 Y422	T275-F279 HydrophobicContact CG2-CD2 3.82Å; T275-F279 HydrophobicContact CG2-CE2 3.43Å; T275-F279 VanDerWaalsContact CG2-CE2 3.43Å; T275-F279 HydrophobicContact CG2-CZ 3.93Å; T275-F279 WeakPolarHBondContact O-CG 3.5Å; T275-F279 PolarHBondContact O-N 3.45Å; A276-F279 PolarHBondContact O-N 2.91Å; F277-F279 VanDerWaalsContact C-N 3.33Å; F277-F279 PolarHBondContact O-N 2.94Å; F279-T282 PolarHBondContact O-N 3Å; F279-R283 WeakPolarHBondContact O-CB 3.25Å; F279-R283 PolarHBondContact O-N 2.98Å; F279-L418 HydrophobicContact CE1-CD2 4.19Å; F279-L418 HydrophobicContact CE1-CG 3.99Å; F279-L418 HydrophobicContact CZ-CD2 4.2Å; F279-L418 HydrophobicContact CZ-CG 4.28Å; F279-Y422 HydrophobicContact CD1-CD2 4.48Å; F279-Y422 HydrophobicContact CD1-CG 4.21Å; F279-Y422 HydrophobicContact CE1-CD2 4.04Å; F279-Y422 AromaticContact CE1-CG 3.93Å; F279-Y422 HydrophobicContact CE1-CG 3.93Å; F279-Y422 HydrophobicContact CZ-CD2 4.39Å
280	A	92.7	Very high	91.9	Very high	64 Å²	64	57 Å²	57	53%	0.529	30%	0.297	S	S	.	.	H	α-helix	trans	-60.9	-50.7	177.9	0	0	0	0	0	111.7	A276 F277 R283 W284	A276-A280 WeakPolarHBondContact O-CB 3.33Å; A276-A280 PolarHBondContact O-N 3.34Å; F277-A280 PolarHBondContact O-N 3.36Å; A280-R283 PolarHBondContact O-N 3.43Å; A280-W284 PolarHBondContact O-N 2.88Å; A280-W284 VanDerWaalsContact O-N 3.12Å
281	V	92.2	Very high	91.8	Very high	18 Å²	18	60.6 Å²	60.6	11%	0.109	31%	0.312	C	S	.	.	H	α-helix	trans	-68.2	-38.4	179.6	176.9	0	0	0	0	111.2	F277 R283 W284 R285 L347	F277-V281 HydrophobicContact CD1-CG2 4.47Å; F277-V281 HydrophobicContact CD2-CG2 3.97Å; F277-V281 HydrophobicContact CE1-CG2 4.11Å; F277-V281 HydrophobicContact CE2-CG2 3.56Å; F277-V281 HydrophobicContact CG-CG2 4.4Å; F277-V281 HydrophobicContact CZ-CG2 3.64Å; F277-V281 WeakPolarHBondContact O-CB 3.25Å; F277-V281 WeakPolarHBondContact O-CG2 3.43Å; F277-V281 PolarHBondContact O-N 3.12Å; V281-R283 PolarHBondContact O-N 3.43Å; V281-W284 HydrophobicContact CG1-CE3 4.38Å; V281-W284 PolarHBondContact O-N 3.21Å; V281-R285 WeakPolarHBondContact O-CG 3.48Å; V281-R285 PolarHBondContact O-N 3.27Å; V281-L347 HydrophobicContact CB-CD1 4.01Å; V281-L347 HydrophobicContact CG1-CB 3.88Å; V281-L347 HydrophobicContact CG1-CD1 3.97Å; V281-L347 HydrophobicContact CG1-CG 4.45Å
282	T	90	Very high	91.8	Very high	7 Å²	7	61.1 Å²	61.1	4%	0.043	31%	0.314	C	S	.	.	H	α-helix	trans	-61.9	-42.6	175.8	-63.3	0	0	0	0	111.5	T278 F279 R285 T286 Y422	T278-T282 WeakPolarHBondContact O-CB 3.25Å; T278-T282 PolarHBondContact O-N 3.02Å; T278-T282 PolarHBondContact O-OG1 2.77Å; F279-T282 PolarHBondContact O-N 3Å; T282-R285 WeakPolarHBondContact O-CG 3.42Å; T282-T286 WeakPolarHBondContact O-CB 3.3Å; T282-T286 PolarHBondContact O-N 3.27Å; T282-T286 VanDerWaalsContact O-N 3.09Å; T282-T286 PolarHBondContact O-OG1 2.86Å; T282-Y422 HydrophobicContact CG2-CD1 4.49Å
283	R	88	Confident	91.6	Very high	205 Å²	205	62.2 Å²	62.2	77%	0.774	31%	0.312	S	S	*	.	H	α-helix	trans	-62.2	-44.7	176.7	-176.2	178	177	-180	-1.1	111.4	F279 A280 V281	F279-R283 WeakPolarHBondContact O-CB 3.25Å; F279-R283 PolarHBondContact O-N 2.98Å; A280-R283 PolarHBondContact O-N 3.43Å; V281-R283 PolarHBondContact O-N 3.43Å
284	W	91.9	Very high	91.4	Very high	129 Å²	129	66.3 Å²	66.3	49%	0.489	32%	0.322	S	S	.	.	H	α-helix	trans	-62.4	-53.8	177.4	172.6	65.1	0	0	0	112	A280 V281 T286 Q287 F288	A280-W284 PolarHBondContact O-N 2.88Å; A280-W284 VanDerWaalsContact O-N 3.12Å; V281-W284 HydrophobicContact CG1-CE3 4.38Å; V281-W284 PolarHBondContact O-N 3.21Å; W284-T286 PolarHBondContact O-N 3.06Å; W284-Q287 PolarHBondContact O-N 3.16Å; W284-F288 AromaticContact CD2-CE2 3.96Å; W284-F288 HydrophobicContact CD2-CE2 3.96Å; W284-F288 HydrophobicContact CD2-CZ 4.4Å; W284-F288 AromaticContact CE2-CE2 3.57Å; W284-F288 AromaticContact CE2-CZ 3.61Å; W284-F288 HydrophobicContact CE3-CE2 4.19Å; W284-F288 AromaticContact CH2-CE2 3.78Å; W284-F288 HydrophobicContact CH2-CE2 3.78Å; W284-F288 HydrophobicContact CH2-CZ 4.25Å; W284-F288 AromaticContact CZ2-CE2 3.49Å; W284-F288 HydrophobicContact CZ2-CE2 3.49Å; W284-F288 VanDerWaalsContact CZ2-CE2 3.49Å; W284-F288 AromaticContact CZ2-CZ 3.54Å; W284-F288 HydrophobicContact CZ2-CZ 3.54Å; W284-F288 HydrophobicContact CZ3-CE2 4.11Å; W284-F288 AromaticContact NE1-CZ 3.77Å
285	R	92.9	Very high	91.4	Very high	43 Å²	43	66.6 Å²	66.6	16%	0.162	32%	0.324	C	S	.	.	H	α-helix	trans	-68	-20.1	-176.4	75	-175.7	-62.8	-139.9	-10.2	114.7	V281 T282 Q287 F288 R289 T340	V281-R285 WeakPolarHBondContact O-CG 3.48Å; V281-R285 PolarHBondContact O-N 3.27Å; T282-R285 WeakPolarHBondContact O-CG 3.42Å; R285-Q287 PolarHBondContact O-N 3.35Å; R285-F288 HydrophobicContact CB-CD2 4.26Å; R285-F288 PolarHBondContact O-N 3.36Å; R285-F288 VanDerWaalsContact O-N 3.12Å; R285-R289 PolarHBondContact O-N 3.24Å; R285-T340 PolarHBondContact NH2-O 3.4Å
286	T	87.1	Confident	91.5	Very high	45 Å²	45	68.4 Å²	68.4	28%	0.276	33%	0.332	S	S	.	.	H	α-helix	trans	-57.6	-31.9	177.1	-65.2	0	0	0	0	111.2	T282 W284 R289 V290	T282-T286 WeakPolarHBondContact O-CB 3.3Å; T282-T286 PolarHBondContact O-N 3.27Å; T282-T286 VanDerWaalsContact O-N 3.09Å; T282-T286 PolarHBondContact O-OG1 2.86Å; W284-T286 PolarHBondContact O-N 3.06Å; T286-R289 PolarHBondContact O-N 2.97Å; T286-V290 WeakPolarHBondContact O-CG2 3.49Å; T286-V290 PolarHBondContact O-N 2.91Å
287	Q	90.9	Very high	91.4	Very high	121 Å²	121	67.3 Å²	67.3	57%	0.565	33%	0.327	S	S	*	.	H	α-helix	trans	-64.6	-40.3	177.1	-62.2	179.9	-14.5	0	0	112.7	W284 R285 R289 V290 Q291	W284-Q287 PolarHBondContact O-N 3.16Å; R285-Q287 PolarHBondContact O-N 3.35Å; Q287-R289 VanDerWaalsContact C-N 3.34Å; Q287-V290 PolarHBondContact O-N 3.41Å; Q287-Q291 WeakPolarHBondContact O-CG 3.42Å; Q287-Q291 PolarHBondContact O-N 2.73Å; Q287-Q291 VanDerWaalsContact O-N 3.08Å
288	F	91.6	Very high	91.4	Very high	33 Å²	33	71.4 Å²	71.4	15%	0.145	34%	0.341	C	S	.	.	H	α-helix	trans	-64.2	-41.4	176.2	-54.5	-44	0	0	0	111.2	W284 R285 V290 Q291 M292 R339 T340	W284-F288 AromaticContact CD2-CE2 3.96Å; W284-F288 HydrophobicContact CD2-CE2 3.96Å; W284-F288 HydrophobicContact CD2-CZ 4.4Å; W284-F288 AromaticContact CE2-CE2 3.57Å; W284-F288 AromaticContact CE2-CZ 3.61Å; W284-F288 HydrophobicContact CE3-CE2 4.19Å; W284-F288 AromaticContact CH2-CE2 3.78Å; W284-F288 HydrophobicContact CH2-CE2 3.78Å; W284-F288 HydrophobicContact CH2-CZ 4.25Å; W284-F288 AromaticContact CZ2-CE2 3.49Å; W284-F288 HydrophobicContact CZ2-CE2 3.49Å; W284-F288 VanDerWaalsContact CZ2-CE2 3.49Å; W284-F288 AromaticContact CZ2-CZ 3.54Å; W284-F288 HydrophobicContact CZ2-CZ 3.54Å; W284-F288 HydrophobicContact CZ3-CE2 4.11Å; W284-F288 AromaticContact NE1-CZ 3.77Å; R285-F288 HydrophobicContact CB-CD2 4.26Å; R285-F288 PolarHBondContact O-N 3.36Å; R285-F288 VanDerWaalsContact O-N 3.12Å; F288-V290 VanDerWaalsContact C-N 3.31Å; F288-V290 PolarHBondContact O-N 3.43Å; F288-Q291 PolarHBondContact O-N 3.16Å; F288-M292 PolarHBondContact O-N 3.2Å; F288-R339 HydrophobicContact CB-CB 4.39Å; F288-R339 HydrophobicContact CD1-CB 4.43Å; F288-R339 HydrophobicContact CG-CB 4.28Å; F288-T340 PolarHBondContact O-OG1 3.3Å
289	R	89.1	Confident	91.5	Very high	95 Å²	95	71.4 Å²	71.4	36%	0.358	34%	0.341	S	S	.	.	H	α-helix	trans	-62.7	-37.8	175.3	-171.7	173.9	-179.6	175.8	-1.5	112.4	R285 T286 Q287 M292 N293 T340	R285-R289 PolarHBondContact O-N 3.24Å; T286-R289 PolarHBondContact O-N 2.97Å; Q287-R289 VanDerWaalsContact C-N 3.34Å; R289-M292 HydrophobicContact CG-CE 4.27Å; R289-M292 PolarHBondContact O-N 2.73Å; R289-N293 PolarHBondContact O-N 3.13Å; R289-N293 PolarHBondContact O-OD1 3.03Å; R289-T340 HydrophobicContact CB-CG2 4.31Å
290	V	89.2	Confident	91.7	Very high	68 Å²	68	70.1 Å²	70.1	41%	0.412	34%	0.344	S	S	.	.	H	α-helix	trans	-64.2	-41	175.2	170.3	0	0	0	0	111.1	T286 Q287 F288 K294	T286-V290 WeakPolarHBondContact O-CG2 3.49Å; T286-V290 PolarHBondContact O-N 2.91Å; Q287-V290 PolarHBondContact O-N 3.41Å; F288-V290 VanDerWaalsContact C-N 3.31Å; F288-V290 PolarHBondContact O-N 3.43Å; V290-K294 HydrophobicContact CG1-CD 4.39Å; V290-K294 WeakPolarHBondContact O-CG 3.39Å; V290-K294 PolarHBondContact O-N 3.31Å; V290-K294 VanDerWaalsContact O-N 3.08Å
291	Q	91.9	Very high	91.6	Very high	90 Å²	90	69.1 Å²	69.1	42%	0.421	33%	0.333	S	S	.	.	H	α-helix	trans	-64.3	-44.4	175.5	-67.6	171.3	30.4	0	0	111.4	Q287 F288 K294 A295 A336	Q287-Q291 WeakPolarHBondContact O-CG 3.42Å; Q287-Q291 PolarHBondContact O-N 2.73Å; Q287-Q291 VanDerWaalsContact O-N 3.08Å; F288-Q291 PolarHBondContact O-N 3.16Å; Q291-K294 PolarHBondContact O-N 2.74Å; Q291-A295 PolarHBondContact O-N 3.12Å; Q291-A336 HydrophobicContact CB-CB 4.41Å
292	M	93.5	Very high	91.8	Very high	30 Å²	30	70.4 Å²	70.4	15%	0.148	34%	0.338	C	S	.	.	H	α-helix	trans	-58.2	-49.2	176.2	-175	-165.4	79.9	0	0	111.7	F288 R289 K294 A295 D296 Y333 A336 T340	F288-M292 PolarHBondContact O-N 3.2Å; R289-M292 HydrophobicContact CG-CE 4.27Å; R289-M292 PolarHBondContact O-N 2.73Å; M292-K294 VanDerWaalsContact C-N 3.29Å; M292-K294 PolarHBondContact O-N 3.25Å; M292-A295 PolarHBondContact O-N 3.22Å; M292-D296 WeakPolarHBondContact O-CB 3.24Å; M292-D296 PolarHBondContact O-N 3.15Å; M292-Y333 HydrophobicContact CG-CD2 3.94Å; M292-Y333 HydrophobicContact CG-CE2 3.67Å; M292-Y333 HydrophobicContact SD-CE2 4.41Å; M292-A336 HydrophobicContact CB-CB 3.91Å; M292-T340 HydrophobicContact SD-CG2 4.13Å
293	N	89.7	Confident	92	Very high	80 Å²	80	71.5 Å²	71.5	43%	0.428	35%	0.347	S	S	.	.	H	α-helix	trans	-62.9	-34	177.7	-72.7	-0.8	0	0	0	112.7	R289 G297	R289-N293 PolarHBondContact O-N 3.13Å; R289-N293 PolarHBondContact O-OD1 3.03Å; N293-G297 PolarHBondContact O-N 3.24Å
294	K	92.2	Very high	92.4	Very high	132 Å²	132	65.4 Å²	65.4	57%	0.574	33%	0.333	S	S	*	.	H	α-helix	trans	-68.2	-41.5	175.6	-76.9	177.6	179.6	-175.8	0	111.7	V290 Q291 M292 R298	V290-K294 HydrophobicContact CG1-CD 4.39Å; V290-K294 WeakPolarHBondContact O-CG 3.39Å; V290-K294 PolarHBondContact O-N 3.31Å; V290-K294 VanDerWaalsContact O-N 3.08Å; Q291-K294 PolarHBondContact O-N 2.74Å; M292-K294 VanDerWaalsContact C-N 3.29Å; M292-K294 PolarHBondContact O-N 3.25Å; K294-R298 WeakPolarHBondContact O-CG 3.42Å; K294-R298 PolarHBondContact O-N 3.35Å; K294-R298 VanDerWaalsContact O-N 3.16Å
295	A	92.7	Very high	92.4	Very high	7 Å²	7	63 Å²	63	6%	0.058	33%	0.33	C	S	.	.	H	α-helix	trans	-66.4	-45.4	176.6	0	0	0	0	0	111.3	Q291 M292 G297 R298 A299 Q332	Q291-A295 PolarHBondContact O-N 3.12Å; M292-A295 PolarHBondContact O-N 3.22Å; A295-G297 PolarHBondContact O-N 2.77Å; A295-R298 PolarHBondContact O-N 2.97Å; A295-A299 PolarHBondContact O-N 3.31Å; A295-Q332 HydrophobicContact CB-CB 4.31Å
296	D	94.9	Very high	92.6	Very high	75 Å²	75	62.2 Å²	62.2	40%	0.401	33%	0.331	S	S	.	.	H	α-helix	trans	-56.8	-48.4	174.8	-175.6	44.3	0	0	0	111.8	M292 R298 A299 A300 Y333	M292-D296 WeakPolarHBondContact O-CB 3.24Å; M292-D296 PolarHBondContact O-N 3.15Å; D296-R298 VanDerWaalsContact C-N 3.34Å; D296-R298 PolarHBondContact O-N 3.01Å; D296-A299 PolarHBondContact O-N 2.95Å; D296-A300 WeakPolarHBondContact O-CB 3.37Å; D296-A300 PolarHBondContact O-N 3.16Å; D296-Y333 HydrophobicContact CB-CD2 3.74Å; D296-Y333 HydrophobicContact CB-CE2 3.91Å
297	G	91.3	Very high	93	Very high	38 Å²	38	66.2 Å²	66.2	39%	0.392	35%	0.35	S	S	.	.	H	α-helix	trans	-60.1	-39.3	177.4	0	0	0	0	0	113.6	N293 A295 S301	N293-G297 PolarHBondContact O-N 3.24Å; A295-G297 PolarHBondContact O-N 2.77Å; G297-S301 WeakPolarHBondContact O-CB 3.06Å; G297-S301 PolarHBondContact O-N 3.48Å
298	R	94	Very high	93.2	Very high	145 Å²	145	66.5 Å²	66.5	55%	0.547	35%	0.354	S	S	.	.	H	α-helix	trans	-67.7	-45.3	175.9	-72.1	174.4	-175	173.2	-1.7	111.9	K294 A295 D296 A300 S301 Q302 L329	K294-R298 WeakPolarHBondContact O-CG 3.42Å; K294-R298 PolarHBondContact O-N 3.35Å; K294-R298 VanDerWaalsContact O-N 3.16Å; A295-R298 PolarHBondContact O-N 2.97Å; D296-R298 VanDerWaalsContact C-N 3.34Å; D296-R298 PolarHBondContact O-N 3.01Å; R298-A300 VanDerWaalsContact C-N 3.34Å; R298-A300 PolarHBondContact O-N 3.42Å; R298-S301 PolarHBondContact O-N 3.28Å; R298-Q302 PolarHBondContact O-N 2.87Å; R298-L329 HydrophobicContact CB-CD2 4.19Å
299	A	95	Very high	93.4	Very high	0 Å²	0	68 Å²	68	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-60.4	-45	177	0	0	0	0	0	111	A295 D296 S301 Q302 A303 Y326 L329	A295-A299 PolarHBondContact O-N 3.31Å; D296-A299 PolarHBondContact O-N 2.95Å; A299-S301 PolarHBondContact O-N 3.38Å; A299-Q302 PolarHBondContact O-N 3.11Å; A299-A303 PolarHBondContact O-N 2.79Å; A299-Y326 HydrophobicContact CB-CE2 4.07Å; A299-Y326 WeakPolarHBondContact O-CE2 3.27Å; A299-L329 HydrophobicContact CB-CB 4.03Å
300	A	94.1	Very high	93.7	Very high	47 Å²	47	69.9 Å²	69.9	39%	0.388	37%	0.371	S	S	.	.	H	α-helix	trans	-63.3	-40.3	176.7	0	0	0	0	0	112.8	D296 R298 A303 T304	D296-A300 WeakPolarHBondContact O-CB 3.37Å; D296-A300 PolarHBondContact O-N 3.16Å; R298-A300 VanDerWaalsContact C-N 3.34Å; R298-A300 PolarHBondContact O-N 3.42Å; A300-A303 PolarHBondContact O-N 2.97Å; A300-T304 WeakPolarHBondContact O-CB 3.4Å; A300-T304 PolarHBondContact O-N 3.44Å; A300-T304 PolarHBondContact O-OG1 2.92Å
301	S	92.5	Very high	94.1	Very high	43 Å²	43	72.4 Å²	72.4	30%	0.301	38%	0.379	S	S	.	.	H	α-helix	trans	-63.5	-45	175.4	-172.2	0	0	0	0	111.6	G297 R298 A299 T304 D305	G297-S301 WeakPolarHBondContact O-CB 3.06Å; G297-S301 PolarHBondContact O-N 3.48Å; R298-S301 PolarHBondContact O-N 3.28Å; A299-S301 PolarHBondContact O-N 3.38Å; S301-T304 PolarHBondContact O-N 3.46Å; S301-D305 WeakPolarHBondContact O-CB 3.43Å; S301-D305 PolarHBondContact O-N 2.96Å
302	Q	94.7	Very high	94.3	Very high	46 Å²	46	71.5 Å²	71.5	22%	0.215	38%	0.379	C	S	.	.	H	α-helix	trans	-60.7	-46.7	177.4	-176.1	63.5	33.9	0	0	111.2	R298 A299 T304 D305 S306 E322 L329	R298-Q302 PolarHBondContact O-N 2.87Å; A299-Q302 PolarHBondContact O-N 3.11Å; Q302-T304 VanDerWaalsContact C-N 3.3Å; Q302-T304 PolarHBondContact O-N 3.15Å; Q302-D305 PolarHBondContact O-N 3.35Å; Q302-S306 WeakPolarHBondContact O-CB 3.41Å; Q302-S306 PolarHBondContact O-N 2.95Å; Q302-E322 PolarHBondContact NE2-OE2 3.08Å; Q302-L329 HydrophobicContact CB-CD1 3.62Å; Q302-L329 HydrophobicContact CG-CD1 4.03Å
303	A	95.8	Very high	94.5	Very high	29 Å²	29	70.9 Å²	70.9	24%	0.24	38%	0.377	C	S	.	.	H	α-helix	trans	-60.8	-41	177.9	0	0	0	0	0	111.9	A299 A300 L307 Y326	A299-A303 PolarHBondContact O-N 2.79Å; A300-A303 PolarHBondContact O-N 2.97Å; A303-L307 WeakPolarHBondContact O-CB 3.32Å; A303-L307 VanDerWaalsContact O-CG 3.23Å; A303-L307 WeakPolarHBondContact O-CG 3.44Å; A303-L307 PolarHBondContact O-N 3.34Å; A303-L307 VanDerWaalsContact O-N 3.1Å; A303-Y326 HydrophobicContact CB-CD2 4.19Å; A303-Y326 HydrophobicContact CB-CE2 3.78Å
304	T	94.6	Very high	94.9	Very high	77 Å²	77	71.1 Å²	71.1	47%	0.472	38%	0.375	S	S	.	.	H	α-helix	trans	-66.1	-44.8	178.3	-57	0	0	0	0	111.4	A300 S301 Q302 L307 I308	A300-T304 WeakPolarHBondContact O-CB 3.4Å; A300-T304 PolarHBondContact O-N 3.44Å; A300-T304 PolarHBondContact O-OG1 2.92Å; S301-T304 PolarHBondContact O-N 3.46Å; Q302-T304 VanDerWaalsContact C-N 3.3Å; Q302-T304 PolarHBondContact O-N 3.15Å; T304-L307 PolarHBondContact O-N 3.29Å; T304-I308 HydrophobicContact CG2-CD1 3.74Å; T304-I308 HydrophobicContact CG2-CG1 4.32Å; T304-I308 WeakPolarHBondContact O-CB 3.16Å; T304-I308 WeakPolarHBondContact O-CG1 3.44Å; T304-I308 PolarHBondContact O-N 3.45Å
305	D	93.9	Very high	95.1	Very high	79 Å²	79	72.4 Å²	72.4	42%	0.422	38%	0.377	S	S	.	.	H	α-helix	trans	-64.8	-42.1	-179.3	-161.9	46.6	0	0	0	111.6	S301 Q302 L307 I308 N309	S301-D305 WeakPolarHBondContact O-CB 3.43Å; S301-D305 PolarHBondContact O-N 2.96Å; Q302-D305 PolarHBondContact O-N 3.35Å; D305-L307 PolarHBondContact O-N 3.1Å; D305-I308 PolarHBondContact O-N 3.35Å; D305-N309 VanDerWaalsContact O-CB 3.31Å; D305-N309 WeakPolarHBondContact O-CB 3.5Å; D305-N309 PolarHBondContact O-N 3.46Å; D305-N309 PolarHBondContact O-ND2 3.32Å; D305-N309 PolarHBondContact OD1-ND2 2.93Å; D305-N309 VanDerWaalsContact OD1-ND2 3.16Å
306	S	95.1	Very high	95.4	Very high	27 Å²	27	78.8 Å²	78.8	19%	0.189	40%	0.404	C	S	.	.	H	α-helix	trans	-60.1	-42.7	174.2	-171.8	0	0	0	0	112.3	Q302 N309 Y310	Q302-S306 WeakPolarHBondContact O-CB 3.41Å; Q302-S306 PolarHBondContact O-N 2.95Å; S306-N309 CarbonylContact O-C 3.58Å; S306-N309 VanDerWaalsContact O-C 3.31Å; S306-N309 PolarHBondContact O-N 3.49Å; S306-Y310 PolarHBondContact O-N 2.89Å; S306-Y310 VanDerWaalsContact O-N 3.1Å
307	L	96.1	Very high	95.5	Very high	129 Å²	129	81.4 Å²	81.4	68%	0.675	42%	0.418	S	S	*	.	H	α-helix	trans	-74.2	-36.1	179.9	-70.4	173.8	0	0	0	113.6	A303 T304 D305 N309 Y310	A303-L307 WeakPolarHBondContact O-CB 3.32Å; A303-L307 VanDerWaalsContact O-CG 3.23Å; A303-L307 WeakPolarHBondContact O-CG 3.44Å; A303-L307 PolarHBondContact O-N 3.34Å; A303-L307 VanDerWaalsContact O-N 3.1Å; T304-L307 PolarHBondContact O-N 3.29Å; D305-L307 PolarHBondContact O-N 3.1Å; L307-N309 VanDerWaalsContact C-N 3.29Å; L307-Y310 WeakPolarHBondContact O-CB 3.43Å; L307-Y310 PolarHBondContact O-N 3.39Å
308	I	94.6	Very high	95.8	Very high	126 Å²	126	82.7 Å²	82.7	65%	0.646	42%	0.416	S	S	*	.	H	α-helix	trans	-64.6	-41.2	173.2	-72.3	172.7	0	0	0	109.6	T304 D305 Y310	T304-I308 HydrophobicContact CG2-CD1 3.74Å; T304-I308 HydrophobicContact CG2-CG1 4.32Å; T304-I308 WeakPolarHBondContact O-CB 3.16Å; T304-I308 WeakPolarHBondContact O-CG1 3.44Å; T304-I308 PolarHBondContact O-N 3.45Å; D305-I308 PolarHBondContact O-N 3.35Å; I308-Y310 PolarHBondContact O-N 3.28Å
309	N	96.3	Very high	95.9	Very high	64 Å²	64	79.3 Å²	79.3	34%	0.342	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	26.9	178.9	-61.2	-46.3	0	0	0	112.4	D305 S306 L307 E311 T312 V313	D305-N309 VanDerWaalsContact O-CB 3.31Å; D305-N309 WeakPolarHBondContact O-CB 3.5Å; D305-N309 PolarHBondContact O-N 3.46Å; D305-N309 PolarHBondContact O-ND2 3.32Å; D305-N309 PolarHBondContact OD1-ND2 2.93Å; D305-N309 VanDerWaalsContact OD1-ND2 3.16Å; S306-N309 CarbonylContact O-C 3.58Å; S306-N309 VanDerWaalsContact O-C 3.31Å; S306-N309 PolarHBondContact O-N 3.49Å; L307-N309 VanDerWaalsContact C-N 3.29Å; N309-E311 PolarHBondContact O-N 3.16Å; N309-E311 VanDerWaalsContact O-N 3.15Å; N309-T312 WeakPolarHBondContact O-CA 3.34Å; N309-T312 WeakPolarHBondContact O-CB 3.42Å; N309-T312 PolarHBondContact O-N 3.36Å; N309-V313 PolarHBondContact O-N 2.98Å
310	Y	95.9	Very high	96.1	Very high	135 Å²	135	85.9 Å²	85.9	53%	0.529	44%	0.437	S	S	.	.	H	α-helix	trans	-49.5	-44.8	-177.7	170.6	-94.7	0	0	0	112.5	S306 L307 I308 T312 V313 K314	S306-Y310 PolarHBondContact O-N 2.89Å; S306-Y310 VanDerWaalsContact O-N 3.1Å; L307-Y310 WeakPolarHBondContact O-CB 3.43Å; L307-Y310 PolarHBondContact O-N 3.39Å; I308-Y310 PolarHBondContact O-N 3.28Å; Y310-T312 VanDerWaalsContact C-N 3.34Å; Y310-T312 PolarHBondContact O-N 3.22Å; Y310-V313 PolarHBondContact O-N 3.36Å; Y310-K314 HydrophobicContact CD1-CG 4.36Å; Y310-K314 HydrophobicContact CD2-CG 4.33Å; Y310-K314 HydrophobicContact CE1-CG 3.92Å; Y310-K314 HydrophobicContact CE2-CD 4.37Å; Y310-K314 HydrophobicContact CE2-CG 3.88Å; Y310-K314 WeakPolarHBondContact O-CB 3.46Å; Y310-K314 WeakPolarHBondContact O-CG 3.47Å; Y310-K314 PolarHBondContact O-N 3.09Å; Y310-K314 WeakPolarHBondContact OH-CE 3.45Å
311	E	96.8	Very high	96.2	Very high	122 Å²	122	90.8 Å²	90.8	57%	0.57	45%	0.445	S	S	*	.	H	α-helix	trans	-61.4	-42.8	177.2	-69.7	-170.4	-166.8	0	0	111.9	N309 K314 Y315	N309-E311 PolarHBondContact O-N 3.16Å; N309-E311 VanDerWaalsContact O-N 3.15Å; E311-K314 PolarHBondContact O-N 3.16Å; E311-Y315 HydrophobicContact CB-CD2 4.25Å; E311-Y315 HydrophobicContact CB-CE2 3.7Å; E311-Y315 WeakPolarHBondContact O-CB 3.37Å; E311-Y315 WeakPolarHBondContact O-CD2 3.4Å; E311-Y315 PolarHBondContact O-N 3.06Å; E311-Y315 PolarHBondContact OE2-OH 3.42Å; E311-Y315 VanDerWaalsContact OE2-OH 3.11Å
312	T	97.7	Very high	96.4	Very high	70 Å²	70	90.5 Å²	90.5	43%	0.429	44%	0.439	S	S	.	.	H	α-helix	trans	-64.9	-46.9	178	-57.4	0	0	0	0	110.7	N309 Y310 K314 Y315 F316	N309-T312 WeakPolarHBondContact O-CA 3.34Å; N309-T312 WeakPolarHBondContact O-CB 3.42Å; N309-T312 PolarHBondContact O-N 3.36Å; Y310-T312 VanDerWaalsContact C-N 3.34Å; Y310-T312 PolarHBondContact O-N 3.22Å; T312-K314 PolarHBondContact O-N 3.36Å; T312-Y315 PolarHBondContact O-N 3.04Å; T312-F316 HydrophobicContact CG2-CD2 3.86Å; T312-F316 HydrophobicContact CG2-CE2 4Å; T312-F316 VanDerWaalsContact O-CD2 3.24Å; T312-F316 WeakPolarHBondContact O-CD2 3.38Å; T312-F316 PolarHBondContact O-N 2.97Å; T312-F316 VanDerWaalsContact O-N 3.16Å
313	V	97.5	Very high	96.5	Very high	17 Å²	17	90.5 Å²	90.5	10%	0.103	45%	0.447	C	S	.	.	H	α-helix	trans	-56.8	-42.3	177.2	177.7	0	0	0	0	110.5	N309 Y310 N317 N318 E319 E322	N309-V313 PolarHBondContact O-N 2.98Å; Y310-V313 PolarHBondContact O-N 3.36Å; V313-N317 PolarHBondContact O-N 3.28Å; V313-N317 VanDerWaalsContact O-N 3.12Å; V313-N318 PolarHBondContact O-N 3.07Å; V313-N318 VanDerWaalsContact O-N 3.13Å; V313-E319 HydrophobicContact CG1-CG 4.18Å; V313-E322 HydrophobicContact CG1-CG 4.01Å; V313-E322 HydrophobicContact CG2-CG 4.02Å
314	K	97.3	Very high	96.6	Very high	85 Å²	85	94 Å²	94	37%	0.37	46%	0.458	S	S	.	.	H	α-helix	trans	-70.5	-42.2	177.3	-72.6	-68.7	176.1	-173.7	0	113.7	Y310 E311 T312 F316 N317 E319	Y310-K314 HydrophobicContact CD1-CG 4.36Å; Y310-K314 HydrophobicContact CD2-CG 4.33Å; Y310-K314 HydrophobicContact CE1-CG 3.92Å; Y310-K314 HydrophobicContact CE2-CD 4.37Å; Y310-K314 HydrophobicContact CE2-CG 3.88Å; Y310-K314 WeakPolarHBondContact O-CB 3.46Å; Y310-K314 WeakPolarHBondContact O-CG 3.47Å; Y310-K314 PolarHBondContact O-N 3.09Å; Y310-K314 WeakPolarHBondContact OH-CE 3.45Å; E311-K314 PolarHBondContact O-N 3.16Å; T312-K314 PolarHBondContact O-N 3.36Å; K314-F316 PolarHBondContact O-N 3.21Å; K314-N317 PolarHBondContact O-N 2.9Å; K314-E319 WeakPolarHBondContact CD-OE1 3.36Å; K314-E319 WeakPolarHBondContact CE-OE1 3.17Å; K314-E319 IonicContact NZ-OE1 3.1Å; K314-E319 PolarHBondContact NZ-OE1 2.83Å
315	Y	97.5	Very high	96.7	Very high	159 Å²	159	93.2 Å²	93.2	62%	0.624	45%	0.451	S	S	*	.	H	α-helix	trans	-60.9	-27.1	177.9	-68.9	-37.4	0	0	0	112.6	E311 T312	E311-Y315 HydrophobicContact CB-CD2 4.25Å; E311-Y315 HydrophobicContact CB-CE2 3.7Å; E311-Y315 WeakPolarHBondContact O-CB 3.37Å; E311-Y315 WeakPolarHBondContact O-CD2 3.4Å; E311-Y315 PolarHBondContact O-N 3.06Å; E311-Y315 PolarHBondContact OE2-OH 3.42Å; E311-Y315 VanDerWaalsContact OE2-OH 3.11Å; T312-Y315 PolarHBondContact O-N 3.04Å
316	F	97.8	Very high	96.8	Very high	141 Å²	141	93.7 Å²	93.7	62%	0.618	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	11.4	-178.7	-64	-76.5	0	0	0	114.3	T312 K314 N318	T312-F316 HydrophobicContact CG2-CD2 3.86Å; T312-F316 HydrophobicContact CG2-CE2 4Å; T312-F316 VanDerWaalsContact O-CD2 3.24Å; T312-F316 WeakPolarHBondContact O-CD2 3.38Å; T312-F316 PolarHBondContact O-N 2.97Å; T312-F316 VanDerWaalsContact O-N 3.16Å; K314-F316 PolarHBondContact O-N 3.21Å; F316-N318 WeakPolarHBondContact CB-ND2 3.34Å; F316-N318 PolarHBondContact O-N 2.84Å; F316-N318 VanDerWaalsContact O-N 3.15Å; F316-N318 PolarHBondContact O-ND2 3.08Å
317	N	97	Very high	97	Very high	130 Å²	130	97.5 Å²	97.5	70%	0.695	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	36.7	176	-60.2	88.7	0	0	0	114.6	V313 K314 E319	V313-N317 PolarHBondContact O-N 3.28Å; V313-N317 VanDerWaalsContact O-N 3.12Å; K314-N317 PolarHBondContact O-N 2.9Å; N317-E319 VanDerWaalsContact CA-OE2 3.27Å; N317-E319 WeakPolarHBondContact CA-OE2 3.44Å
318	N	97.3	Very high	97	Very high	66 Å²	66	97.2 Å²	97.2	35%	0.353	46%	0.459	S	S	.	.			trans	-100.4	22.5	-172.3	-80.7	-48.3	0	0	0	113.6	V313 F316 E320 R321 E322	V313-N318 PolarHBondContact O-N 3.07Å; V313-N318 VanDerWaalsContact O-N 3.13Å; F316-N318 WeakPolarHBondContact CB-ND2 3.34Å; F316-N318 PolarHBondContact O-N 2.84Å; F316-N318 VanDerWaalsContact O-N 3.15Å; F316-N318 PolarHBondContact O-ND2 3.08Å; N318-E320 PolarHBondContact O-N 3.46Å; N318-R321 HydrophobicContact CB-CB 4.33Å; N318-R321 PolarHBondContact O-N 2.88Å; N318-E322 WeakPolarHBondContact O-CG 3.35Å; N318-E322 PolarHBondContact O-N 3.41Å
319	E	97.4	Very high	97.1	Very high	73 Å²	73	92.7 Å²	92.7	34%	0.341	44%	0.436	S	S	.	.	H	α-helix	trans	-58.1	-45.2	-177.7	-60.6	96.3	135.6	0	0	112.7	V313 K314 N317 E322 A323	V313-E319 HydrophobicContact CG1-CG 4.18Å; K314-E319 WeakPolarHBondContact CD-OE1 3.36Å; K314-E319 WeakPolarHBondContact CE-OE1 3.17Å; K314-E319 IonicContact NZ-OE1 3.1Å; K314-E319 PolarHBondContact NZ-OE1 2.83Å; N317-E319 VanDerWaalsContact CA-OE2 3.27Å; N317-E319 WeakPolarHBondContact CA-OE2 3.44Å; E319-E322 PolarHBondContact O-N 3.44Å; E319-A323 WeakPolarHBondContact O-CB 3.17Å; E319-A323 PolarHBondContact O-N 3.41Å
320	E	97.6	Very high	97.2	Very high	138 Å²	138	92.2 Å²	92.2	65%	0.645	43%	0.432	S	S	*	.	H	α-helix	trans	-68.6	-37.8	-179.3	-163.4	62.6	-157.9	0	0	111.5	N318 E322 A323 E324	N318-E320 PolarHBondContact O-N 3.46Å; E320-E322 PolarHBondContact O-N 3.43Å; E320-A323 WeakPolarHBondContact O-CB 3.48Å; E320-A323 PolarHBondContact O-N 3.05Å; E320-E324 WeakPolarHBondContact O-CG 3.4Å; E320-E324 PolarHBondContact O-N 2.94Å
321	R	96.5	Very high	97.3	Very high	151 Å²	151	88.1 Å²	88.1	57%	0.57	43%	0.426	S	S	*	.	H	α-helix	trans	-61.1	-45.4	174.2	177.1	-172	171.9	95.7	1.1	111.2	N318 A323 E324 L325	N318-R321 HydrophobicContact CB-CB 4.33Å; N318-R321 PolarHBondContact O-N 2.88Å; R321-A323 VanDerWaalsContact C-N 3.32Å; R321-E324 PolarHBondContact O-N 2.96Å; R321-L325 HydrophobicContact CG-CD1 4.33Å; R321-L325 WeakPolarHBondContact O-CG 3.45Å; R321-L325 PolarHBondContact O-N 3.11Å
322	E	96.8	Very high	97.3	Very high	37 Å²	37	86.5 Å²	86.5	17%	0.173	42%	0.418	C	S	.	.	H	α-helix	trans	-64.3	-38.5	176.5	-72	-59.6	134.6	0	0	111.5	Q302 V313 N318 E319 E320 L325 Y326	Q302-E322 PolarHBondContact NE2-OE2 3.08Å; V313-E322 HydrophobicContact CG1-CG 4.01Å; V313-E322 HydrophobicContact CG2-CG 4.02Å; N318-E322 WeakPolarHBondContact O-CG 3.35Å; N318-E322 PolarHBondContact O-N 3.41Å; E319-E322 PolarHBondContact O-N 3.44Å; E320-E322 PolarHBondContact O-N 3.43Å; E322-L325 PolarHBondContact O-N 3.19Å; E322-Y326 WeakPolarHBondContact O-CB 2.99Å; E322-Y326 PolarHBondContact O-N 2.88Å
323	A	97.3	Very high	97.2	Very high	46 Å²	46	86.5 Å²	86.5	38%	0.38	41%	0.411	S	S	.	.	H	α-helix	trans	-64	-44.7	174.3	0	0	0	0	0	112.3	E319 E320 R321 L325 Y326 D327	E319-A323 WeakPolarHBondContact O-CB 3.17Å; E319-A323 PolarHBondContact O-N 3.41Å; E320-A323 WeakPolarHBondContact O-CB 3.48Å; E320-A323 PolarHBondContact O-N 3.05Å; R321-A323 VanDerWaalsContact C-N 3.32Å; A323-L325 PolarHBondContact O-N 2.89Å; A323-Y326 PolarHBondContact O-N 3.37Å; A323-D327 WeakPolarHBondContact O-CB 3.45Å; A323-D327 PolarHBondContact O-N 3.11Å
324	E	97.8	Very high	97.2	Very high	102 Å²	102	91.9 Å²	91.9	48%	0.477	44%	0.435	S	S	.	.	H	α-helix	trans	-63.1	-39.7	175.8	-75	-179.6	-172.2	0	0	112.7	E320 R321 Y326 D327 K328	E320-E324 WeakPolarHBondContact O-CG 3.4Å; E320-E324 PolarHBondContact O-N 2.94Å; R321-E324 PolarHBondContact O-N 2.96Å; E324-Y326 VanDerWaalsContact C-N 3.35Å; E324-D327 PolarHBondContact O-N 3.46Å; E324-K328 WeakPolarHBondContact O-CG 3.27Å; E324-K328 PolarHBondContact O-N 3.43Å
325	L	96.3	Very high	97.2	Very high	60 Å²	60	92.9 Å²	92.9	31%	0.314	44%	0.441	S	S	.	.	H	α-helix	trans	-64	-43.5	175	-75.2	171.2	0	0	0	110.9	R321 E322 A323 L329	R321-L325 HydrophobicContact CG-CD1 4.33Å; R321-L325 WeakPolarHBondContact O-CG 3.45Å; R321-L325 PolarHBondContact O-N 3.11Å; E322-L325 PolarHBondContact O-N 3.19Å; A323-L325 PolarHBondContact O-N 2.89Å; L325-L329 WeakPolarHBondContact O-CG 3.32Å; L325-L329 PolarHBondContact O-N 3.41Å
326	Y	97.2	Very high	97.1	Very high	89 Å²	89	85.7 Å²	85.7	35%	0.349	41%	0.414	S	S	.	.	H	α-helix	trans	-64.4	-43.1	175.8	-176.2	-109.7	0	0	0	112.1	A299 A303 E322 A323 E324 K328 L329 Q330	A299-Y326 HydrophobicContact CB-CE2 4.07Å; A299-Y326 WeakPolarHBondContact O-CE2 3.27Å; A303-Y326 HydrophobicContact CB-CD2 4.19Å; A303-Y326 HydrophobicContact CB-CE2 3.78Å; E322-Y326 WeakPolarHBondContact O-CB 2.99Å; E322-Y326 PolarHBondContact O-N 2.88Å; A323-Y326 PolarHBondContact O-N 3.37Å; E324-Y326 VanDerWaalsContact C-N 3.35Å; Y326-K328 PolarHBondContact O-N 3.48Å; Y326-L329 WeakPolarHBondContact O-CB 3.39Å; Y326-L329 PolarHBondContact O-N 2.83Å; Y326-L329 VanDerWaalsContact O-N 3.12Å; Y326-Q330 HydrophobicContact CD1-CG 4.03Å; Y326-Q330 HydrophobicContact CE1-CG 3.69Å; Y326-Q330 HydrophobicContact CE2-CG 4.29Å; Y326-Q330 HydrophobicContact CG-CG 4.49Å; Y326-Q330 WeakPolarHBondContact O-CG 3.45Å; Y326-Q330 PolarHBondContact O-N 3.39Å; Y326-Q330 PolarHBondContact OH-NE2 3.42Å
327	D	98.1	Very high	97	Very high	108 Å²	108	80.4 Å²	80.4	58%	0.578	40%	0.395	S	S	*	.	H	α-helix	trans	-59	-45.4	177.2	-177	67.3	0	0	0	111.9	A323 E324 L329 Q330 A331	A323-D327 WeakPolarHBondContact O-CB 3.45Å; A323-D327 PolarHBondContact O-N 3.11Å; E324-D327 PolarHBondContact O-N 3.46Å; D327-L329 VanDerWaalsContact C-N 3.27Å; D327-L329 PolarHBondContact O-N 2.93Å; D327-Q330 CarbonylContact O-C 3.59Å; D327-Q330 PolarHBondContact O-N 3.32Å; D327-Q330 VanDerWaalsContact O-N 3.08Å; D327-A331 PolarHBondContact O-N 2.91Å
328	K	97.4	Very high	97	Very high	123 Å²	123	78 Å²	78	54%	0.535	38%	0.384	S	S	.	.	H	α-helix	trans	-57.7	-38.3	174.5	-74.5	169.4	-175.2	164.5	0	112.9	E324 Y326 Q332	E324-K328 WeakPolarHBondContact O-CG 3.27Å; E324-K328 PolarHBondContact O-N 3.43Å; Y326-K328 PolarHBondContact O-N 3.48Å; K328-Q332 WeakPolarHBondContact O-CG 3.41Å; K328-Q332 PolarHBondContact O-N 2.88Å
329	L	96.6	Very high	97	Very high	31 Å²	31	79.9 Å²	79.9	16%	0.162	39%	0.387	C	S	.	.	H	α-helix	trans	-73.4	-37.1	176.6	-66.2	173.4	0	0	0	111.5	R298 A299 Q302 L325 Y326 D327 Q332 Y333	R298-L329 HydrophobicContact CB-CD2 4.19Å; A299-L329 HydrophobicContact CB-CB 4.03Å; Q302-L329 HydrophobicContact CB-CD1 3.62Å; Q302-L329 HydrophobicContact CG-CD1 4.03Å; L325-L329 WeakPolarHBondContact O-CG 3.32Å; L325-L329 PolarHBondContact O-N 3.41Å; Y326-L329 WeakPolarHBondContact O-CB 3.39Å; Y326-L329 PolarHBondContact O-N 2.83Å; Y326-L329 VanDerWaalsContact O-N 3.12Å; D327-L329 VanDerWaalsContact C-N 3.27Å; D327-L329 PolarHBondContact O-N 2.93Å; L329-Q332 PolarHBondContact O-N 3.31Å; L329-Y333 PolarHBondContact O-N 3.47Å; L329-Y333 VanDerWaalsContact O-N 3.1Å
330	Q	97.6	Very high	96.8	Very high	53 Å²	53	77.1 Å²	77.1	25%	0.248	38%	0.375	C	S	.	.	H	α-helix	trans	-65.8	-38.4	174.7	-75.6	-64.5	-7.5	0	0	112.4	Y326 D327 Q332 Y333 E334	Y326-Q330 HydrophobicContact CD1-CG 4.03Å; Y326-Q330 HydrophobicContact CE1-CG 3.69Å; Y326-Q330 HydrophobicContact CE2-CG 4.29Å; Y326-Q330 HydrophobicContact CG-CG 4.49Å; Y326-Q330 WeakPolarHBondContact O-CG 3.45Å; Y326-Q330 PolarHBondContact O-N 3.39Å; Y326-Q330 PolarHBondContact OH-NE2 3.42Å; D327-Q330 CarbonylContact O-C 3.59Å; D327-Q330 PolarHBondContact O-N 3.32Å; D327-Q330 VanDerWaalsContact O-N 3.08Å; Q330-Q332 VanDerWaalsContact C-N 3.32Å; Q330-Q332 PolarHBondContact O-N 3.02Å; Q330-Y333 CarbonylContact O-C 3.36Å; Q330-Y333 WeakPolarHBondContact O-CB 3.33Å; Q330-Y333 PolarHBondContact O-N 3.45Å; Q330-Y333 VanDerWaalsContact O-N 3.12Å; Q330-E334 WeakPolarHBondContact O-CB 3.4Å; Q330-E334 PolarHBondContact O-N 3.11Å
331	A	97.9	Very high	96.7	Very high	49 Å²	49	74.6 Å²	74.6	41%	0.405	37%	0.369	S	S	.	.	H	α-helix	trans	-61.2	-39	174.2	0	0	0	0	0	112.3	D327 E334 E335	D327-A331 PolarHBondContact O-N 2.91Å; A331-E334 PolarHBondContact O-N 3.11Å; A331-E335 PolarHBondContact O-N 3.25Å
332	Q	96	Very high	96.7	Very high	89 Å²	89	71.1 Å²	71.1	42%	0.416	37%	0.365	S	S	.	.	H	α-helix	trans	-65.5	-39.3	173.4	-68.1	175.5	21.1	0	0	112.1	A295 K328 L329 Q330 A336	A295-Q332 HydrophobicContact CB-CB 4.31Å; K328-Q332 WeakPolarHBondContact O-CG 3.41Å; K328-Q332 PolarHBondContact O-N 2.88Å; L329-Q332 PolarHBondContact O-N 3.31Å; Q330-Q332 VanDerWaalsContact C-N 3.32Å; Q330-Q332 PolarHBondContact O-N 3.02Å; Q332-A336 WeakPolarHBondContact O-CB 3.44Å; Q332-A336 PolarHBondContact O-N 3.07Å
333	Y	96.2	Very high	96.6	Very high	70 Å²	70	69.5 Å²	69.5	28%	0.275	36%	0.357	S	S	.	.	H	α-helix	trans	-64.2	-44.6	174.4	166.7	-101.1	0	0	0	111.2	M292 D296 L329 Q330 A336 S337	M292-Y333 HydrophobicContact CG-CD2 3.94Å; M292-Y333 HydrophobicContact CG-CE2 3.67Å; M292-Y333 HydrophobicContact SD-CE2 4.41Å; D296-Y333 HydrophobicContact CB-CD2 3.74Å; D296-Y333 HydrophobicContact CB-CE2 3.91Å; L329-Y333 PolarHBondContact O-N 3.47Å; L329-Y333 VanDerWaalsContact O-N 3.1Å; Q330-Y333 CarbonylContact O-C 3.36Å; Q330-Y333 WeakPolarHBondContact O-CB 3.33Å; Q330-Y333 PolarHBondContact O-N 3.45Å; Q330-Y333 VanDerWaalsContact O-N 3.12Å; Y333-A336 PolarHBondContact O-N 3.08Å; Y333-S337 WeakPolarHBondContact O-CB 3.32Å; Y333-S337 PolarHBondContact O-N 3.37Å
334	E	97.4	Very high	96.4	Very high	130 Å²	130	70.6 Å²	70.6	61%	0.607	36%	0.357	S	S	*	.	H	α-helix	trans	-56.9	-52.8	177.3	-174.2	-176.6	162.3	0	0	111	Q330 A331 A336 S337 V338	Q330-E334 WeakPolarHBondContact O-CB 3.4Å; Q330-E334 PolarHBondContact O-N 3.11Å; A331-E334 PolarHBondContact O-N 3.11Å; E334-A336 VanDerWaalsContact C-N 3.32Å; E334-A336 PolarHBondContact O-N 3.42Å; E334-S337 WeakPolarHBondContact O-CB 3.31Å; E334-S337 PolarHBondContact O-N 2.84Å; E334-S337 VanDerWaalsContact O-N 3.11Å; E334-V338 WeakPolarHBondContact O-CG2 3.49Å; E334-V338 PolarHBondContact O-N 2.92Å
335	E	96.9	Very high	96.3	Very high	106 Å²	106	68.6 Å²	68.6	50%	0.495	36%	0.357	S	S	.	.	H	α-helix	trans	-57.6	-44.7	179.5	-170.8	-173.7	174.1	0	0	111.9	A331 R339	A331-E335 PolarHBondContact O-N 3.25Å; E335-R339 WeakPolarHBondContact O-CG 3.41Å; E335-R339 PolarHBondContact O-N 2.94Å; E335-R339 IonicContact OE1-CZ 3.82Å; E335-R339 IonicContact OE1-NE 2.65Å; E335-R339 IonicContact OE1-NH2 2.96Å; E335-R339 PolarHBondContact OE1-NH2 3.21Å
336	A	95.3	Very high	96.2	Very high	8 Å²	8	69.5 Å²	69.5	7%	0.066	37%	0.365	C	S	.	.	H	α-helix	trans	-68.9	-34.1	178.4	0	0	0	0	0	112.9	Q291 M292 Q332 Y333 E334 T340	Q291-A336 HydrophobicContact CB-CB 4.41Å; M292-A336 HydrophobicContact CB-CB 3.91Å; Q332-A336 WeakPolarHBondContact O-CB 3.44Å; Q332-A336 PolarHBondContact O-N 3.07Å; Y333-A336 PolarHBondContact O-N 3.08Å; E334-A336 VanDerWaalsContact C-N 3.32Å; E334-A336 PolarHBondContact O-N 3.42Å; A336-T340 WeakPolarHBondContact O-CB 3.44Å; A336-T340 PolarHBondContact O-N 3.19Å; A336-T340 PolarHBondContact O-OG1 3.12Å
337	S	96.4	Very high	96	Very high	29 Å²	29	65.7 Å²	65.7	20%	0.203	35%	0.35	C	S	.	.	H	α-helix	trans	-69.2	-41.7	176.3	-175.3	0	0	0	0	111.7	Y333 E334 R339 T340 T341	Y333-S337 WeakPolarHBondContact O-CB 3.32Å; Y333-S337 PolarHBondContact O-N 3.37Å; E334-S337 WeakPolarHBondContact O-CB 3.31Å; E334-S337 PolarHBondContact O-N 2.84Å; E334-S337 VanDerWaalsContact O-N 3.11Å; S337-R339 PolarHBondContact O-N 2.95Å; S337-T340 PolarHBondContact O-N 2.79Å; S337-T340 VanDerWaalsContact O-N 3.17Å; S337-T341 WeakPolarHBondContact O-CB 3.32Å; S337-T341 PolarHBondContact O-N 3.26Å; S337-T341 PolarHBondContact O-OG1 2.97Å
338	V	97.6	Very high	95.8	Very high	79 Å²	79	64.5 Å²	64.5	48%	0.479	34%	0.344	S	S	.	.	H	α-helix	trans	-58.3	-49.2	173.5	170.8	0	0	0	0	110.2	E334 T340 T341 T342	E334-V338 WeakPolarHBondContact O-CG2 3.49Å; E334-V338 PolarHBondContact O-N 2.92Å; V338-T340 VanDerWaalsContact C-N 3.3Å; V338-T340 PolarHBondContact O-N 3.5Å; V338-T341 PolarHBondContact O-N 3.4Å; V338-T342 HydrophobicContact CG1-CG2 4.21Å; V338-T342 WeakPolarHBondContact O-CG2 3.47Å; V338-T342 PolarHBondContact O-N 3.48Å; V338-T342 PolarHBondContact O-OG1 3.49Å
339	R	96.3	Very high	95.7	Very high	106 Å²	106	66 Å²	66	40%	0.4	35%	0.351	S	S	.	.	H	α-helix	trans	-60.3	-37.5	176	-67.4	176.4	-173.3	-171.3	0.4	112.9	F288 E335 S337 T342 S343	F288-R339 HydrophobicContact CB-CB 4.39Å; F288-R339 HydrophobicContact CD1-CB 4.43Å; F288-R339 HydrophobicContact CG-CB 4.28Å; E335-R339 WeakPolarHBondContact O-CG 3.41Å; E335-R339 PolarHBondContact O-N 2.94Å; E335-R339 IonicContact OE1-CZ 3.82Å; E335-R339 IonicContact OE1-NE 2.65Å; E335-R339 IonicContact OE1-NH2 2.96Å; E335-R339 PolarHBondContact OE1-NH2 3.21Å; S337-R339 PolarHBondContact O-N 2.95Å; R339-T342 WeakPolarHBondContact CA-OG1 3.35Å; R339-T342 PolarHBondContact O-OG1 3.17Å; R339-S343 VanDerWaalsContact O-CB 3.31Å; R339-S343 WeakPolarHBondContact O-CB 3.42Å; R339-S343 PolarHBondContact O-N 3.34Å; R339-S343 VanDerWaalsContact O-N 3.09Å; R339-S343 PolarHBondContact O-OG 2.63Å
340	T	94.1	Very high	95.7	Very high	15 Å²	15	65 Å²	65	9%	0.092	35%	0.349	C	S	.	.	H	α-helix	trans	-68.2	-37	178	-61.5	0	0	0	0	112.1	R285 F288 R289 M292 A336 S337 V338 S343 L344	R285-T340 PolarHBondContact NH2-O 3.4Å; F288-T340 PolarHBondContact O-OG1 3.3Å; R289-T340 HydrophobicContact CB-CG2 4.31Å; M292-T340 HydrophobicContact SD-CG2 4.13Å; A336-T340 WeakPolarHBondContact O-CB 3.44Å; A336-T340 PolarHBondContact O-N 3.19Å; A336-T340 PolarHBondContact O-OG1 3.12Å; S337-T340 PolarHBondContact O-N 2.79Å; S337-T340 VanDerWaalsContact O-N 3.17Å; V338-T340 VanDerWaalsContact C-N 3.3Å; V338-T340 PolarHBondContact O-N 3.5Å; T340-S343 PolarHBondContact O-OG 3.18Å; T340-L344 PolarHBondContact O-N 2.93Å
341	T	95	Very high	95.5	Very high	85 Å²	85	62.8 Å²	62.8	52%	0.521	34%	0.338	S	S	.	.	H	α-helix	trans	-77.3	-44.7	179.6	-57.3	0	0	0	0	111.7	S337 V338 S343 L344 A345	S337-T341 WeakPolarHBondContact O-CB 3.32Å; S337-T341 PolarHBondContact O-N 3.26Å; S337-T341 PolarHBondContact O-OG1 2.97Å; V338-T341 PolarHBondContact O-N 3.4Å; T341-S343 VanDerWaalsContact C-N 3.34Å; T341-S343 PolarHBondContact O-N 3.49Å; T341-L344 VanDerWaalsContact O-CB 3.23Å; T341-L344 WeakPolarHBondContact O-CB 3.32Å; T341-L344 PolarHBondContact O-N 3.02Å; T341-A345 PolarHBondContact O-N 3.11Å; T341-A345 VanDerWaalsContact O-N 3.15Å
342	T	96.6	Very high	95.3	Very high	79 Å²	79	63 Å²	63	49%	0.485	34%	0.34	S	S	.	.	H	α-helix	trans	-64.6	-38.4	177.2	54.5	0	0	0	0	111.8	V338 R339 L344 A345 V346	V338-T342 HydrophobicContact CG1-CG2 4.21Å; V338-T342 WeakPolarHBondContact O-CG2 3.47Å; V338-T342 PolarHBondContact O-N 3.48Å; V338-T342 PolarHBondContact O-OG1 3.49Å; R339-T342 WeakPolarHBondContact CA-OG1 3.35Å; R339-T342 PolarHBondContact O-OG1 3.17Å; T342-L344 VanDerWaalsContact C-N 3.28Å; T342-L344 PolarHBondContact O-N 2.73Å; T342-A345 WeakPolarHBondContact O-CB 3.35Å; T342-A345 PolarHBondContact O-N 3.01Å; T342-A345 VanDerWaalsContact O-N 3.12Å; T342-V346 PolarHBondContact O-N 3.27Å
343	S	95	Very high	95.3	Very high	2 Å²	2	60.6 Å²	60.6	1%	0.014	34%	0.336	C	S	.	.	H	α-helix	trans	-65.4	-26.2	172.3	61.7	0	0	0	0	113.9	R339 T340 T341 L347	R339-S343 VanDerWaalsContact O-CB 3.31Å; R339-S343 WeakPolarHBondContact O-CB 3.42Å; R339-S343 PolarHBondContact O-N 3.34Å; R339-S343 VanDerWaalsContact O-N 3.09Å; R339-S343 PolarHBondContact O-OG 2.63Å; T340-S343 PolarHBondContact O-OG 3.18Å; T341-S343 VanDerWaalsContact C-N 3.34Å; T341-S343 PolarHBondContact O-N 3.49Å; S343-L347 PolarHBondContact O-N 2.8Å; S343-L347 VanDerWaalsContact O-N 3.17Å
344	L	93.4	Very high	95.3	Very high	70 Å²	70	59.3 Å²	59.3	37%	0.366	33%	0.333	S	S	.	.	H	α-helix	trans	-66.3	-44.3	169.3	-173.9	56.1	0	0	0	110.9	T340 T341 T342 V346 L347 N348	T340-L344 PolarHBondContact O-N 2.93Å; T341-L344 VanDerWaalsContact O-CB 3.23Å; T341-L344 WeakPolarHBondContact O-CB 3.32Å; T341-L344 PolarHBondContact O-N 3.02Å; T342-L344 VanDerWaalsContact C-N 3.28Å; T342-L344 PolarHBondContact O-N 2.73Å; L344-V346 VanDerWaalsContact C-N 3.33Å; L344-V346 PolarHBondContact O-N 2.98Å; L344-L347 WeakPolarHBondContact O-CB 3.42Å; L344-L347 PolarHBondContact O-N 2.93Å; L344-N348 PolarHBondContact O-N 3.27Å
345	A	94.6	Very high	95.1	Very high	59 Å²	59	54.2 Å²	54.2	49%	0.488	31%	0.309	S	S	.	.	H	α-helix	trans	-61.7	-42.6	-179.9	0	0	0	0	0	111.2	T341 T342 L347 N348 F349	T341-A345 PolarHBondContact O-N 3.11Å; T341-A345 VanDerWaalsContact O-N 3.15Å; T342-A345 WeakPolarHBondContact O-CB 3.35Å; T342-A345 PolarHBondContact O-N 3.01Å; T342-A345 VanDerWaalsContact O-N 3.12Å; A345-L347 PolarHBondContact O-N 2.86Å; A345-N348 PolarHBondContact O-N 3.38Å; A345-F349 VanDerWaalsContact O-CB 3.3Å; A345-F349 WeakPolarHBondContact O-CB 3.4Å; A345-F349 PolarHBondContact O-N 2.68Å
346	V	94.4	Very high	95	Very high	79 Å²	79	52.7 Å²	52.7	48%	0.479	31%	0.31	S	S	.	.	H	α-helix	trans	-60.3	-44.1	173.9	175.1	0	0	0	0	111.6	T342 L344 G350	T342-V346 PolarHBondContact O-N 3.27Å; L344-V346 VanDerWaalsContact C-N 3.33Å; L344-V346 PolarHBondContact O-N 2.98Å; V346-G350 PolarHBondContact O-N 3.43Å
347	L	93.8	Very high	95	Very high	9 Å²	9	57.2 Å²	57.2	5%	0.047	34%	0.336	C	S	.	.	H	α-helix	trans	-60	-52.6	175.7	174.7	65.1	0	0	0	111.3	F277 T278 V281 S343 L344 A345 F349 G350 Q351	F277-L347 HydrophobicContact CD1-CD1 4.39Å; F277-L347 HydrophobicContact CE1-CD1 4.04Å; T278-L347 HydrophobicContact CG2-CD1 4.42Å; V281-L347 HydrophobicContact CB-CD1 4.01Å; V281-L347 HydrophobicContact CG1-CB 3.88Å; V281-L347 HydrophobicContact CG1-CD1 3.97Å; V281-L347 HydrophobicContact CG1-CG 4.45Å; S343-L347 PolarHBondContact O-N 2.8Å; S343-L347 VanDerWaalsContact O-N 3.17Å; L344-L347 WeakPolarHBondContact O-CB 3.42Å; L344-L347 PolarHBondContact O-N 2.93Å; A345-L347 PolarHBondContact O-N 2.86Å; L347-F349 VanDerWaalsContact C-N 3.33Å; L347-F349 PolarHBondContact O-N 3.49Å; L347-G350 PolarHBondContact O-N 3.46Å; L347-Q351 HydrophobicContact CD1-CG 4.07Å; L347-Q351 HydrophobicContact CG-CG 4.47Å; L347-Q351 WeakPolarHBondContact O-CB 3.39Å; L347-Q351 VanDerWaalsContact O-CG 3.32Å; L347-Q351 WeakPolarHBondContact O-CG 3.37Å; L347-Q351 PolarHBondContact O-N 2.84Å
348	N	93.4	Very high	94.9	Very high	83 Å²	83	56.2 Å²	56.2	44%	0.444	33%	0.331	S	S	.	.	H	α-helix	trans	-61.9	-42	-177.7	-69.7	-7.2	0	0	0	111.5	L344 A345 A352	L344-N348 PolarHBondContact O-N 3.27Å; A345-N348 PolarHBondContact O-N 3.38Å; N348-A352 WeakPolarHBondContact O-CB 3.28Å; N348-A352 PolarHBondContact O-N 3.23Å
349	F	95.7	Very high	94.7	Very high	155 Å²	155	53.6 Å²	53.6	68%	0.68	31%	0.314	S	S	*	.	H	α-helix	trans	-63.3	-48.5	176.4	175.9	-100.2	0	0	0	111.6	A345 L347 Q351 A352 A353	A345-F349 VanDerWaalsContact O-CB 3.3Å; A345-F349 WeakPolarHBondContact O-CB 3.4Å; A345-F349 PolarHBondContact O-N 2.68Å; L347-F349 VanDerWaalsContact C-N 3.33Å; L347-F349 PolarHBondContact O-N 3.49Å; F349-Q351 VanDerWaalsContact C-N 3.34Å; F349-Q351 PolarHBondContact O-N 2.81Å; F349-A352 PolarHBondContact O-N 2.93Å; F349-A353 WeakPolarHBondContact O-CB 3.49Å; F349-A353 PolarHBondContact O-N 3.27Å
350	G	95.4	Very high	94.7	Very high	11 Å²	11	50.4 Å²	50.4	11%	0.113	31%	0.31	C	S	.	.	H	α-helix	trans	-63.9	-38.5	178.8	0	0	0	0	0	112.8	V346 L347 A353 I354	V346-G350 PolarHBondContact O-N 3.43Å; L347-G350 PolarHBondContact O-N 3.46Å; G350-A353 PolarHBondContact O-N 3.05Å; G350-I354 VanDerWaalsContact O-CG1 3.25Å; G350-I354 WeakPolarHBondContact O-CG1 3.44Å; G350-I354 PolarHBondContact O-N 3.47Å
351	Q	94.2	Very high	94.7	Very high	5 Å²	5	51.3 Å²	51.3	2%	0.023	32%	0.319	C	S	.	.	H	α-helix	trans	-61.3	-47.3	172.9	-79.4	-179.4	-30.2	0	0	112	Y274 F277 T278 L347 F349 F355	Y274-Q351 HydrophobicContact CD2-CB 4.26Å; Y274-Q351 HydrophobicContact CD2-CG 4.24Å; Y274-Q351 HydrophobicContact CE1-CG 4.36Å; Y274-Q351 HydrophobicContact CE2-CB 3.53Å; Y274-Q351 HydrophobicContact CE2-CG 3.61Å; Y274-Q351 PolarHBondContact OH-NE2 3.27Å; Y274-Q351 VanDerWaalsContact OH-NE2 3.12Å; F277-Q351 HydrophobicContact CD1-CG 4.3Å; F277-Q351 HydrophobicContact CE1-CG 4.36Å; T278-Q351 PolarHBondContact OG1-NE2 3.47Å; L347-Q351 HydrophobicContact CD1-CG 4.07Å; L347-Q351 HydrophobicContact CG-CG 4.47Å; L347-Q351 WeakPolarHBondContact O-CB 3.39Å; L347-Q351 VanDerWaalsContact O-CG 3.32Å; L347-Q351 WeakPolarHBondContact O-CG 3.37Å; L347-Q351 PolarHBondContact O-N 2.84Å; F349-Q351 VanDerWaalsContact C-N 3.34Å; F349-Q351 PolarHBondContact O-N 2.81Å; Q351-F355 VanDerWaalsContact O-CB 3.31Å; Q351-F355 WeakPolarHBondContact O-CB 3.44Å; Q351-F355 PolarHBondContact O-N 2.87Å
352	A	94.2	Very high	94.5	Very high	53 Å²	53	47.3 Å²	47.3	44%	0.438	29%	0.294	S	S	.	.	H	α-helix	trans	-62.2	-44.1	176.3	0	0	0	0	0	111.5	N348 F349 F355 S356	N348-A352 WeakPolarHBondContact O-CB 3.28Å; N348-A352 PolarHBondContact O-N 3.23Å; F349-A352 PolarHBondContact O-N 2.93Å; A352-F355 PolarHBondContact O-N 3.42Å; A352-S356 VanDerWaalsContact O-CB 3.28Å; A352-S356 WeakPolarHBondContact O-CB 3.41Å; A352-S356 PolarHBondContact O-N 2.82Å; A352-S356 PolarHBondContact O-OG 3.08Å
353	A	96.1	Very high	94.3	Very high	40 Å²	40	46.4 Å²	46.4	33%	0.331	29%	0.286	S	S	.	.	H	α-helix	trans	-62.1	-48.8	179.2	0	0	0	0	0	112.5	F349 G350 F355 S356 V357	F349-A353 WeakPolarHBondContact O-CB 3.49Å; F349-A353 PolarHBondContact O-N 3.27Å; G350-A353 PolarHBondContact O-N 3.05Å; A353-F355 VanDerWaalsContact C-N 3.31Å; A353-F355 PolarHBondContact O-N 3.12Å; A353-S356 PolarHBondContact O-N 3.31Å; A353-V357 VanDerWaalsContact O-CG2 3.3Å; A353-V357 WeakPolarHBondContact O-CG2 3.37Å; A353-V357 PolarHBondContact O-N 3.47Å
354	I	95.7	Very high	94.2	Very high	42 Å²	42	51.1 Å²	51.1	22%	0.215	31%	0.31	C	S	.	.	H	α-helix	trans	-58	-47.4	176.8	-68.6	165.5	0	0	0	110.1	A273 F277 G350 V357 G358	A273-I354 HydrophobicContact CB-CG2 4.1Å; F277-I354 HydrophobicContact CB-CD1 3.53Å; F277-I354 HydrophobicContact CD1-CD1 3.8Å; F277-I354 HydrophobicContact CD2-CD1 4.2Å; F277-I354 HydrophobicContact CG-CD1 3.57Å; G350-I354 VanDerWaalsContact O-CG1 3.25Å; G350-I354 WeakPolarHBondContact O-CG1 3.44Å; G350-I354 PolarHBondContact O-N 3.47Å; I354-V357 PolarHBondContact O-N 3.1Å; I354-G358 PolarHBondContact O-N 3.1Å
355	F	93.8	Very high	94	Very high	24 Å²	24	49.3 Å²	49.3	11%	0.105	30%	0.302	C	S	.	.	H	α-helix	trans	-66.6	-43.4	-177.7	-165	-93.6	0	0	0	112.1	Q351 A352 A353 G358 L359 L408	Q351-F355 VanDerWaalsContact O-CB 3.31Å; Q351-F355 WeakPolarHBondContact O-CB 3.44Å; Q351-F355 PolarHBondContact O-N 2.87Å; A352-F355 PolarHBondContact O-N 3.42Å; A353-F355 VanDerWaalsContact C-N 3.31Å; A353-F355 PolarHBondContact O-N 3.12Å; F355-G358 PolarHBondContact O-N 3.12Å; F355-L359 HydrophobicContact CE1-CB 4.46Å; F355-L359 HydrophobicContact CE1-CD2 4.33Å; F355-L359 WeakPolarHBondContact O-CB 3.36Å; F355-L359 PolarHBondContact O-N 2.97Å; F355-L408 HydrophobicContact CZ-CB 4.07Å; F355-L408 WeakPolarHBondContact CZ-O 3.5Å
356	S	94.1	Very high	93.7	Very high	73 Å²	73	46.5 Å²	46.5	51%	0.51	28%	0.278	S	S	.	.	H	α-helix	trans	-62.1	-41.2	176.2	-69.7	0	0	0	0	112.5	A352 A353 A360	A352-S356 VanDerWaalsContact O-CB 3.28Å; A352-S356 WeakPolarHBondContact O-CB 3.41Å; A352-S356 PolarHBondContact O-N 2.82Å; A352-S356 PolarHBondContact O-OG 3.08Å; A353-S356 PolarHBondContact O-N 3.31Å; S356-A360 VanDerWaalsContact O-CB 3.24Å; S356-A360 WeakPolarHBondContact O-CB 3.38Å; S356-A360 PolarHBondContact O-N 3.4Å
357	V	95.8	Very high	93.5	Very high	104 Å²	104	44.4 Å²	44.4	63%	0.63	27%	0.269	S	S	*	.	H	α-helix	trans	-64.8	-47.8	175.7	170.5	0	0	0	0	110.7	A353 I354 L359 A360 A361	A353-V357 VanDerWaalsContact O-CG2 3.3Å; A353-V357 WeakPolarHBondContact O-CG2 3.37Å; A353-V357 PolarHBondContact O-N 3.47Å; I354-V357 PolarHBondContact O-N 3.1Å; V357-L359 PolarHBondContact O-N 3.3Å; V357-A360 PolarHBondContact O-N 3.27Å; V357-A361 WeakPolarHBondContact O-CB 3.39Å; V357-A361 PolarHBondContact O-N 2.64Å
358	G	94.6	Very high	93.2	Very high	8 Å²	8	48.8 Å²	48.8	8%	0.082	29%	0.292	C	S	.	.	H	α-helix	trans	-62.9	-42.5	178.1	0	0	0	0	0	112.7	I354 F355 A361 T362	I354-G358 PolarHBondContact O-N 3.1Å; F355-G358 PolarHBondContact O-N 3.12Å; G358-A361 PolarHBondContact O-N 3Å; G358-T362 PolarHBondContact O-N 3.22Å; G358-T362 PolarHBondContact O-OG1 3.19Å
359	L	93.3	Very high	92.7	Very high	23 Å²	23	45.9 Å²	45.9	12%	0.12	28%	0.276	C	S	.	.	H	α-helix	trans	-61.9	-48.5	175.8	-177.6	65.7	0	0	0	111.6	F355 V357 T362 M363 L408	F355-L359 HydrophobicContact CE1-CB 4.46Å; F355-L359 HydrophobicContact CE1-CD2 4.33Å; F355-L359 WeakPolarHBondContact O-CB 3.36Å; F355-L359 PolarHBondContact O-N 2.97Å; V357-L359 PolarHBondContact O-N 3.3Å; L359-T362 PolarHBondContact O-N 2.99Å; L359-M363 HydrophobicContact CG-CE 4.13Å; L359-M363 HydrophobicContact CG-SD 4.35Å; L359-M363 WeakPolarHBondContact O-CB 3.48Å; L359-M363 VanDerWaalsContact O-CG 3.29Å; L359-M363 WeakPolarHBondContact O-CG 3.43Å; L359-M363 PolarHBondContact O-N 3.35Å; L359-L408 HydrophobicContact CD1-CB 3.85Å; L359-L408 HydrophobicContact CD1-CD1 3.79Å; L359-L408 HydrophobicContact CD1-CG 4.46Å
360	A	94.6	Very high	92.2	Very high	39 Å²	39	40.2 Å²	40.2	32%	0.322	25%	0.254	S	S	.	.	H	α-helix	trans	-61.7	-44.7	177.6	0	0	0	0	0	111.8	S356 V357 T362 M363 I364	S356-A360 VanDerWaalsContact O-CB 3.24Å; S356-A360 WeakPolarHBondContact O-CB 3.38Å; S356-A360 PolarHBondContact O-N 3.4Å; V357-A360 PolarHBondContact O-N 3.27Å; A360-T362 PolarHBondContact O-N 3.35Å; A360-M363 PolarHBondContact O-N 2.97Å; A360-I364 WeakPolarHBondContact O-CB 3.47Å; A360-I364 VanDerWaalsContact O-CG1 3.23Å; A360-I364 WeakPolarHBondContact O-CG1 3.48Å; A360-I364 PolarHBondContact O-N 3.45Å
361	A	94.8	Very high	91.6	Very high	35 Å²	35	43.9 Å²	43.9	29%	0.289	28%	0.284	S	S	.	.	H	α-helix	trans	-59.3	-48.3	176.9	0	0	0	0	0	111.5	I266 V357 G358 M363 I364 T365	I266-A361 HydrophobicContact CG2-CB 3.83Å; V357-A361 WeakPolarHBondContact O-CB 3.39Å; V357-A361 PolarHBondContact O-N 2.64Å; G358-A361 PolarHBondContact O-N 3Å; A361-M363 PolarHBondContact O-N 3.49Å; A361-I364 PolarHBondContact O-N 3.48Å; A361-T365 WeakPolarHBondContact O-CG2 3.49Å; A361-T365 PolarHBondContact O-N 2.98Å
362	T	91.7	Very high	90.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-63.6	-43.2	177.2	-49.5	0	0	0	0	111.5	A263 I266 G358 L359 A360 I364 T365 V366 V404 L408	A263-T362 HydrophobicContact CB-CG2 3.94Å; I266-T362 WeakPolarHBondContact CG2-OG1 3.47Å; G358-T362 PolarHBondContact O-N 3.22Å; G358-T362 PolarHBondContact O-OG1 3.19Å; L359-T362 PolarHBondContact O-N 2.99Å; A360-T362 PolarHBondContact O-N 3.35Å; T362-I364 PolarHBondContact O-N 2.99Å; T362-T365 WeakPolarHBondContact CA-OG1 3.49Å; T362-T365 PolarHBondContact O-N 3.17Å; T362-T365 PolarHBondContact O-OG1 3.39Å; T362-V366 VanDerWaalsContact O-CG2 3.3Å; T362-V366 WeakPolarHBondContact O-CG2 3.37Å; T362-V366 PolarHBondContact O-N 2.91Å; T362-V404 HydrophobicContact CG2-CG1 3.58Å; T362-L408 HydrophobicContact CG2-CD1 4.07Å
363	M	91.5	Very high	89.5	Confident	61 Å²	61	46.3 Å²	46.3	30%	0.3	31%	0.305	S	S	.	.	H	α-helix	trans	-62.5	-39.5	176.7	-72.7	-171.4	-50.6	0	0	112.5	L359 A360 A361 V366 A367 N405	L359-M363 HydrophobicContact CG-CE 4.13Å; L359-M363 HydrophobicContact CG-SD 4.35Å; L359-M363 WeakPolarHBondContact O-CB 3.48Å; L359-M363 VanDerWaalsContact O-CG 3.29Å; L359-M363 WeakPolarHBondContact O-CG 3.43Å; L359-M363 PolarHBondContact O-N 3.35Å; A360-M363 PolarHBondContact O-N 2.97Å; A361-M363 PolarHBondContact O-N 3.49Å; M363-V366 PolarHBondContact O-N 2.91Å; M363-A367 WeakPolarHBondContact O-CB 3.46Å; M363-A367 PolarHBondContact O-N 3.2Å; M363-N405 HydrophobicContact SD-CB 4.18Å
364	I	92.6	Very high	87.6	Confident	101 Å²	101	50.4 Å²	50.4	52%	0.518	32%	0.32	S	S	.	.	H	α-helix	trans	-63.2	-43.2	175	-70	163.8	0	0	0	110.4	A360 A361 T362 V366 A367 N368	A360-I364 WeakPolarHBondContact O-CB 3.47Å; A360-I364 VanDerWaalsContact O-CG1 3.23Å; A360-I364 WeakPolarHBondContact O-CG1 3.48Å; A360-I364 PolarHBondContact O-N 3.45Å; A361-I364 PolarHBondContact O-N 3.48Å; T362-I364 PolarHBondContact O-N 2.99Å; I364-V366 VanDerWaalsContact C-N 3.33Å; I364-V366 PolarHBondContact O-N 3.12Å; I364-A367 PolarHBondContact O-N 2.89Å; I364-N368 WeakPolarHBondContact O-CB 3.4Å; I364-N368 VanDerWaalsContact O-CG 3.24Å; I364-N368 PolarHBondContact O-N 2.82Å; I364-N368 PolarHBondContact O-ND2 2.91Å
365	T	89.3	Confident	86	Confident	32 Å²	32	49.9 Å²	49.9	20%	0.196	32%	0.319	C	S	.	.	H	α-helix	trans	-60.9	-43	176.9	57.5	0	0	0	0	112.3	I266 A361 T362 N368 Q369	I266-T365 HydrophobicContact CD1-CG2 3.56Å; A361-T365 WeakPolarHBondContact O-CG2 3.49Å; A361-T365 PolarHBondContact O-N 2.98Å; T362-T365 WeakPolarHBondContact CA-OG1 3.49Å; T362-T365 PolarHBondContact O-N 3.17Å; T362-T365 PolarHBondContact O-OG1 3.39Å; T365-N368 PolarHBondContact O-N 3.08Å; T365-Q369 WeakPolarHBondContact O-CG 3.46Å; T365-Q369 PolarHBondContact O-N 3.44Å; T365-Q369 VanDerWaalsContact O-N 3.11Å
366	V	88.6	Confident	84.4	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-70.8	-40.1	179	176.4	0	0	0	0	110.7	Y259 T362 M363 I364 N368 Q369 V370 L396 D400 L401 V404	Y259-V366 HydrophobicContact CD1-CG1 4.29Å; Y259-V366 HydrophobicContact CD1-CG2 4.15Å; Y259-V366 HydrophobicContact CE1-CG1 4.28Å; Y259-V366 HydrophobicContact CG-CG2 4.26Å; T362-V366 VanDerWaalsContact O-CG2 3.3Å; T362-V366 WeakPolarHBondContact O-CG2 3.37Å; T362-V366 PolarHBondContact O-N 2.91Å; M363-V366 PolarHBondContact O-N 2.91Å; I364-V366 VanDerWaalsContact C-N 3.33Å; I364-V366 PolarHBondContact O-N 3.12Å; V366-N368 VanDerWaalsContact C-N 3.31Å; V366-N368 PolarHBondContact O-N 2.95Å; V366-Q369 PolarHBondContact O-N 2.73Å; V366-Q369 VanDerWaalsContact O-N 3.16Å; V366-V370 HydrophobicContact CG1-CG2 4.37Å; V366-V370 VanDerWaalsContact O-CG2 3.28Å; V366-V370 WeakPolarHBondContact O-CG2 3.44Å; V366-V370 PolarHBondContact O-N 3.25Å; V366-L396 HydrophobicContact CG1-CD1 4.47Å; V366-D400 HydrophobicContact CG1-CB 4.3Å; V366-L401 HydrophobicContact CB-CD2 4.07Å; V366-L401 HydrophobicContact CG1-CD2 3.87Å; V366-V404 HydrophobicContact CG2-CG1 4.48Å; V366-V404 HydrophobicContact CG2-CG2 3.98Å
367	A	89.6	Confident	82.5	Confident	34 Å²	34	51.8 Å²	51.8	28%	0.281	33%	0.33	S	S	.	.	H	α-helix	trans	-61.3	-40.2	176.1	0	0	0	0	0	111.7	M363 I364 V370 A371 L401	M363-A367 WeakPolarHBondContact O-CB 3.46Å; M363-A367 PolarHBondContact O-N 3.2Å; I364-A367 PolarHBondContact O-N 2.89Å; A367-V370 PolarHBondContact O-N 3.08Å; A367-A371 VanDerWaalsContact O-CB 3.31Å; A367-A371 WeakPolarHBondContact O-CB 3.33Å; A367-A371 PolarHBondContact O-N 3.21Å; A367-L401 HydrophobicContact CB-CD2 3.96Å
368	N	87.6	Confident	80.9	Confident	101 Å²	101	50.2 Å²	50.2	54%	0.54	32%	0.321	S	S	.	.	H	α-helix	trans	-66.8	-36.7	174.8	-70.1	-17.8	0	0	0	112.1	I364 T365 V366 S372	I364-N368 WeakPolarHBondContact O-CB 3.4Å; I364-N368 VanDerWaalsContact O-CG 3.24Å; I364-N368 PolarHBondContact O-N 2.82Å; I364-N368 PolarHBondContact O-ND2 2.91Å; T365-N368 PolarHBondContact O-N 3.08Å; V366-N368 VanDerWaalsContact C-N 3.31Å; V366-N368 PolarHBondContact O-N 2.95Å; N368-S372 VanDerWaalsContact O-CB 3.3Å; N368-S372 WeakPolarHBondContact O-CB 3.32Å; N368-S372 PolarHBondContact O-N 3.41Å; N368-S372 PolarHBondContact O-OG 3.5Å
369	Q	83.8	Confident	79.2	Confident	23 Å²	23	50.6 Å²	50.6	11%	0.107	32%	0.321	C	S	.	.	H	α-helix	trans	-68.3	-38.5	173.8	-69.3	174.7	9.7	0	0	112	Y259 T365 V366 S372 G373 L396	Y259-Q369 PolarHBondContact O-NE2 2.81Å; Y259-Q369 VanDerWaalsContact O-NE2 3.08Å; T365-Q369 WeakPolarHBondContact O-CG 3.46Å; T365-Q369 PolarHBondContact O-N 3.44Å; T365-Q369 VanDerWaalsContact O-N 3.11Å; V366-Q369 PolarHBondContact O-N 2.73Å; V366-Q369 VanDerWaalsContact O-N 3.16Å; Q369-S372 PolarHBondContact O-OG 3.19Å; Q369-G373 PolarHBondContact O-N 2.95Å; Q369-L396 HydrophobicContact CB-CD1 3.49Å; Q369-L396 VanDerWaalsContact CB-CD1 3.49Å; Q369-L396 HydrophobicContact CG-CD1 4.45Å; Q369-L396 VanDerWaalsContact OE1-CD1 3.25Å
370	V	84	Confident	77.5	Confident	36 Å²	36	50.6 Å²	50.6	22%	0.218	33%	0.325	C	S	.	.	H	α-helix	trans	-63.4	-48.5	172.8	173.2	0	0	0	0	110.5	V366 A367 G373 L396	V366-V370 HydrophobicContact CG1-CG2 4.37Å; V366-V370 VanDerWaalsContact O-CG2 3.28Å; V366-V370 WeakPolarHBondContact O-CG2 3.44Å; V366-V370 PolarHBondContact O-N 3.25Å; A367-V370 PolarHBondContact O-N 3.08Å; V370-G373 PolarHBondContact O-N 3.26Å; V370-L396 HydrophobicContact CB-CB 4.42Å; V370-L396 HydrophobicContact CG2-CB 3.48Å; V370-L396 VanDerWaalsContact CG2-CB 3.48Å; V370-L396 HydrophobicContact CG2-CD1 4.44Å
371	A	83.4	Confident	75.9	Confident	88 Å²	88	51.1 Å²	51.1	73%	0.727	33%	0.329	S	S	*	.	H	α-helix	trans	-68.8	-34.6	-176.8	0	0	0	0	0	113.7	A367 G373	A367-A371 VanDerWaalsContact O-CB 3.31Å; A367-A371 WeakPolarHBondContact O-CB 3.33Å; A367-A371 PolarHBondContact O-N 3.21Å; A371-G373 VanDerWaalsContact C-N 3.27Å
372	S	77	Confident	74.3	Confident	67 Å²	67	54.5 Å²	54.5	47%	0.469	34%	0.339	S	S	.	.	H	α-helix	trans	-77.8	-12.2	177	55.7	0	0	0	0	113.2	N368 Q369 L374	N368-S372 VanDerWaalsContact O-CB 3.3Å; N368-S372 WeakPolarHBondContact O-CB 3.32Å; N368-S372 PolarHBondContact O-N 3.41Å; N368-S372 PolarHBondContact O-OG 3.5Å; Q369-S372 PolarHBondContact O-OG 3.19Å; S372-L374 PolarHBondContact O-N 3.21Å
373	G	67	Low	72.6	Confident	42 Å²	42	55.2 Å²	55.2	43%	0.433	34%	0.343	S	S	.	.			trans	63	2.5	-173.8	0	0	0	0	0	113.9	Q369 V370 A371	Q369-G373 PolarHBondContact O-N 2.95Å; V370-G373 PolarHBondContact O-N 3.26Å; A371-G373 VanDerWaalsContact C-N 3.27Å
374	L	57	Low	71.2	Confident	126 Å²	126	56.5 Å²	56.5	66%	0.66	35%	0.35	S	S	*	.			trans	-102.5	109.7	-176.5	-73.3	158	0	0	0	107.8	S372	S372-L374 PolarHBondContact O-N 3.21Å
375	T	61.4	Low	69.7	Low	31 Å²	31	59.5 Å²	59.5	19%	0.19	36%	0.362	C	S	.	.			trans	-64.1	141.4	160.6	41	0	0	0	0	108.3	P377 L396	T375-P377 WeakPolarHBondContact O-CD 3.48Å; T375-L396 HydrophobicContact CG2-CD2 4.46Å; T375-L396 HydrophobicContact CG2-CG 4.18Å
376	D	60.3	Low	68.3	Low	41 Å²	41	61.7 Å²	61.7	22%	0.219	38%	0.383	C	S	.	.			trans	-48.3	118.2	178.5	174.6	14.7	0	0	0	109.2	T378 T379 A380	D376-T378 PolarHBondContact O-N 3.03Å; D376-T378 VanDerWaalsContact O-N 3.07Å; D376-T378 PolarHBondContact OD1-OG1 3.23Å; D376-T378 PolarHBondContact OD2-OG1 3.31Å; D376-T379 WeakPolarHBondContact CB-OG1 3.4Å; D376-T379 WeakPolarHBondContact O-CA 3.39Å; D376-T379 VanDerWaalsContact O-CB 3.32Å; D376-T379 WeakPolarHBondContact O-CB 3.19Å; D376-T379 PolarHBondContact O-N 3.06Å; D376-T379 PolarHBondContact O-OG1 3.21Å; D376-T379 PolarHBondContact OD2-OG1 2.9Å; D376-A380 PolarHBondContact O-N 2.95Å
377	P	55.3	Low	66.9	Low	96 Å²	96	63.8 Å²	63.8	62%	0.623	40%	0.396	S	S	*	.	H	α-helix	trans	-59.7	-26.9	-164.9	16.3	-29.6	0	0	0	113.4	T375 T379 A381	T375-P377 WeakPolarHBondContact O-CD 3.48Å; P377-T379 VanDerWaalsContact C-N 3.33Å; P377-A381 VanDerWaalsContact O-CB 3.22Å; P377-A381 WeakPolarHBondContact O-CB 3.2Å; P377-A381 PolarHBondContact O-N 2.98Å
378	T	61.1	Low	65	Low	71 Å²	71	65.2 Å²	65.2	44%	0.436	42%	0.415	S	S	.	.	H	α-helix	trans	-66.7	-36.9	172.2	51.1	0	0	0	0	112.1	D376 H382	D376-T378 PolarHBondContact O-N 3.03Å; D376-T378 VanDerWaalsContact O-N 3.07Å; D376-T378 PolarHBondContact OD1-OG1 3.23Å; D376-T378 PolarHBondContact OD2-OG1 3.31Å; T378-H382 WeakPolarHBondContact O-CB 3.2Å; T378-H382 PolarHBondContact O-CD2 3.21Å; T378-H382 PolarHBondContact O-N 3.47Å
379	T	59.1	Low	63.5	Low	15 Å²	15	64.3 Å²	64.3	9%	0.092	41%	0.409	C	S	.	.	H	α-helix	trans	-76.8	-41.4	-180	-27.3	0	0	0	0	110.6	Y257 G260 D376 P377 H382 V383	Y257-T379 WeakPolarHBondContact O-CG2 3.47Å; G260-T379 WeakPolarHBondContact CA-OG1 3.27Å; D376-T379 WeakPolarHBondContact CB-OG1 3.4Å; D376-T379 WeakPolarHBondContact O-CA 3.39Å; D376-T379 VanDerWaalsContact O-CB 3.32Å; D376-T379 WeakPolarHBondContact O-CB 3.19Å; D376-T379 PolarHBondContact O-N 3.06Å; D376-T379 PolarHBondContact O-OG1 3.21Å; D376-T379 PolarHBondContact OD2-OG1 2.9Å; P377-T379 VanDerWaalsContact C-N 3.33Å; T379-H382 PolarHBondContact O-N 2.94Å; T379-V383 WeakPolarHBondContact O-CB 3.31Å; T379-V383 WeakPolarHBondContact O-CG2 3.29Å; T379-V383 PolarHBondContact O-N 2.65Å
380	A	58.6	Low	61.7	Low	24 Å²	24	67.6 Å²	67.6	20%	0.198	44%	0.435	C	S	.	.	H	α-helix	trans	-60.9	-44.4	173.5	0	0	0	0	0	111.4	D376 L384	D376-A380 PolarHBondContact O-N 2.95Å; A380-L384 WeakPolarHBondContact O-CB 3.41Å; A380-L384 PolarHBondContact O-N 3.24Å
381	A	59.2	Low	59.8	Low	49 Å²	49	69.3 Å²	69.3	41%	0.405	45%	0.448	S	S	.	.	H	α-helix	trans	-63.7	-47.2	176.6	0	0	0	0	0	112	P377 V383 L384 E385	P377-A381 VanDerWaalsContact O-CB 3.22Å; P377-A381 WeakPolarHBondContact O-CB 3.2Å; P377-A381 PolarHBondContact O-N 2.98Å; A381-V383 PolarHBondContact O-N 2.87Å; A381-L384 PolarHBondContact O-N 2.92Å; A381-E385 VanDerWaalsContact O-CB 3.25Å; A381-E385 WeakPolarHBondContact O-CB 3.42Å; A381-E385 PolarHBondContact O-N 2.75Å
382	H	62.1	Low	58	Low	107 Å²	107	70 Å²	70	50%	0.495	44%	0.439	S	S	.	.	H	α-helix	trans	-66.3	-38.3	178.8	-70.3	-179.9	0	0	0	113	T378 T379 A386	T378-H382 WeakPolarHBondContact O-CB 3.2Å; T378-H382 PolarHBondContact O-CD2 3.21Å; T378-H382 PolarHBondContact O-N 3.47Å; T379-H382 PolarHBondContact O-N 2.94Å; H382-A386 WeakPolarHBondContact O-CB 3.4Å; H382-A386 PolarHBondContact O-N 3.49Å
383	V	57.1	Low	56.7	Low	15 Å²	15	68.5 Å²	68.5	9%	0.091	43%	0.431	C	S	.	.	H	α-helix	trans	-68.8	-41	176.7	171.3	0	0	0	0	110.3	Y257 T379 A381 T387 L392	Y257-V383 HydrophobicContact CE1-CG2 4.4Å; Y257-V383 HydrophobicContact CE2-CG2 4.43Å; T379-V383 WeakPolarHBondContact O-CB 3.31Å; T379-V383 WeakPolarHBondContact O-CG2 3.29Å; T379-V383 PolarHBondContact O-N 2.65Å; A381-V383 PolarHBondContact O-N 2.87Å; V383-T387 HydrophobicContact CG1-CG2 4.47Å; V383-T387 WeakPolarHBondContact O-CB 3.45Å; V383-T387 PolarHBondContact O-N 2.94Å; V383-T387 PolarHBondContact O-OG1 3.07Å; V383-L392 HydrophobicContact CG1-CB 3.85Å
384	L	60.2	Low	56.3	Low	87 Å²	87	73.9 Å²	73.9	46%	0.455	44%	0.442	S	S	.	.	H	α-helix	trans	-65	-41.1	177.1	-166.9	75.6	0	0	0	111.4	A380 A381 G388	A380-L384 WeakPolarHBondContact O-CB 3.41Å; A380-L384 PolarHBondContact O-N 3.24Å; A381-L384 PolarHBondContact O-N 2.92Å; L384-G388 VanDerWaalsContact O-CA 3.29Å; L384-G388 WeakPolarHBondContact O-CA 3.34Å; L384-G388 PolarHBondContact O-N 3.37Å
385	E	61.9	Low	56.6	Low	164 Å²	164	70.6 Å²	70.6	77%	0.766	43%	0.43	S	S	*	.	H	α-helix	trans	-71.6	-41.1	178	-169.2	174.7	-170.7	0	0	112.3	A381	A381-E385 VanDerWaalsContact O-CB 3.25Å; A381-E385 WeakPolarHBondContact O-CB 3.42Å; A381-E385 PolarHBondContact O-N 2.75Å
386	A	60.8	Low	57.4	Low	78 Å²	78	69.9 Å²	69.9	65%	0.645	43%	0.425	S	S	*	.	H	α-helix	trans	-76.8	-29.1	-178.6	0	0	0	0	0	113.5	H382	H382-A386 WeakPolarHBondContact O-CB 3.4Å; H382-A386 PolarHBondContact O-N 3.49Å
387	T	58.1	Low	58.6	Low	44 Å²	44	68.7 Å²	68.7	27%	0.27	42%	0.419	S	S	.	.	H	α-helix	trans	-113.8	-22.2	-172.5	70.1	0	0	0	0	114.3	V383 I389 L392	V383-T387 HydrophobicContact CG1-CG2 4.47Å; V383-T387 WeakPolarHBondContact O-CB 3.45Å; V383-T387 PolarHBondContact O-N 2.94Å; V383-T387 PolarHBondContact O-OG1 3.07Å; T387-I389 WeakPolarHBondContact O-CG1 3.36Å; T387-I389 PolarHBondContact O-N 3.44Å; T387-I389 VanDerWaalsContact O-N 3.12Å; T387-I389 PolarHBondContact OG1-N 3.46Å; T387-L392 HydrophobicContact CG2-CD1 3.95Å
388	G	50.9	Low	60.1	Low	65 Å²	65	68 Å²	68	67%	0.67	41%	0.412	S	S	*	.			trans	64.4	6.4	-174.1	0	0	0	0	0	114.4	L384	L384-G388 VanDerWaalsContact O-CA 3.29Å; L384-G388 WeakPolarHBondContact O-CA 3.34Å; L384-G388 PolarHBondContact O-N 3.37Å
389	I	54.5	Low	61.4	Low	82 Å²	82	64.6 Å²	64.6	42%	0.421	39%	0.392	S	S	.	.			trans	-111.4	99.8	-171.2	-65.1	160.2	0	0	0	108.7	T387 S391 L392	T387-I389 WeakPolarHBondContact O-CG1 3.36Å; T387-I389 PolarHBondContact O-N 3.44Å; T387-I389 VanDerWaalsContact O-N 3.12Å; T387-I389 PolarHBondContact OG1-N 3.46Å; I389-S391 WeakPolarHBondContact CG2-OG 3.38Å; I389-S391 PolarHBondContact O-N 3.4Å; I389-S391 VanDerWaalsContact O-N 3.13Å; I389-L392 HydrophobicContact CB-CD1 4.08Å; I389-L392 HydrophobicContact CB-CG 4.42Å; I389-L392 HydrophobicContact CD1-CD1 4.37Å; I389-L392 HydrophobicContact CG2-CD1 4.21Å; I389-L392 HydrophobicContact CG2-CG 4.08Å; I389-L392 PolarHBondContact O-N 3.2Å; I389-L392 VanDerWaalsContact O-N 3.08Å
390	S	45.8	Very low	62.9	Low	92 Å²	92	64 Å²	64	64%	0.643	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-58.8	-24	177.6	58.4	0	0	0	0	113.5	L392 A393	S390-L392 PolarHBondContact O-N 3.42Å; S390-A393 WeakPolarHBondContact O-CB 3.48Å; S390-A393 PolarHBondContact O-N 3.13Å; S390-A393 VanDerWaalsContact O-N 3.11Å
391	S	45.5	Very low	64.5	Low	72 Å²	72	65.1 Å²	65.1	50%	0.503	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-70.9	-16.8	177.8	68.7	0	0	0	0	113.9	I389 A393 K394	I389-S391 WeakPolarHBondContact CG2-OG 3.38Å; I389-S391 PolarHBondContact O-N 3.4Å; I389-S391 VanDerWaalsContact O-N 3.13Å; S391-A393 VanDerWaalsContact C-N 3.35Å; S391-K394 WeakPolarHBondContact O-CB 3.47Å; S391-K394 WeakPolarHBondContact O-CG 3.45Å
392	L	45.9	Very low	66.1	Low	101 Å²	101	64.4 Å²	64.4	53%	0.529	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-81.1	-16.1	171.4	-74.3	168.3	0	0	0	112.6	V383 T387 I389 S390 K394	V383-L392 HydrophobicContact CG1-CB 3.85Å; T387-L392 HydrophobicContact CG2-CD1 3.95Å; I389-L392 HydrophobicContact CB-CD1 4.08Å; I389-L392 HydrophobicContact CB-CG 4.42Å; I389-L392 HydrophobicContact CD1-CD1 4.37Å; I389-L392 HydrophobicContact CG2-CD1 4.21Å; I389-L392 HydrophobicContact CG2-CG 4.08Å; I389-L392 PolarHBondContact O-N 3.2Å; I389-L392 VanDerWaalsContact O-N 3.08Å; S390-L392 PolarHBondContact O-N 3.42Å; L392-K394 PolarHBondContact O-N 3.01Å
393	A	49.3	Very low	67.6	Low	36 Å²	36	59.3 Å²	59.3	30%	0.298	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-81.5	10.1	171.4	0	0	0	0	0	112.9	S390 S391	S390-A393 WeakPolarHBondContact O-CB 3.48Å; S390-A393 PolarHBondContact O-N 3.13Å; S390-A393 VanDerWaalsContact O-N 3.11Å; S391-A393 VanDerWaalsContact C-N 3.35Å
394	K	57.4	Low	69.3	Low	156 Å²	156	58.6 Å²	58.6	68%	0.678	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-54	144.9	176.2	-94.1	-177.4	175.1	-174.8	0	111.4	S391 L392	S391-K394 WeakPolarHBondContact O-CB 3.47Å; S391-K394 WeakPolarHBondContact O-CG 3.45Å; L392-K394 PolarHBondContact O-N 3.01Å
395	S	63.3	Low	70.9	Confident	57 Å²	57	57.4 Å²	57.4	40%	0.399	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-47.5	138.1	174.2	48.7	0	0	0	0	110.9
396	L	78.8	Confident	72.4	Confident	16 Å²	16	50.5 Å²	50.5	8%	0.084	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-58.1	145.1	171.4	-63.2	177.6	0	0	0	109.9	Y259 V366 Q369 V370 T375 D400	Y259-L396 HydrophobicContact CD1-CD1 4.05Å; Y259-L396 HydrophobicContact CD1-CD2 4Å; Y259-L396 HydrophobicContact CE1-CD1 4.46Å; Y259-L396 HydrophobicContact CE1-CD2 3.89Å; V366-L396 HydrophobicContact CG1-CD1 4.47Å; Q369-L396 HydrophobicContact CB-CD1 3.49Å; Q369-L396 VanDerWaalsContact CB-CD1 3.49Å; Q369-L396 HydrophobicContact CG-CD1 4.45Å; Q369-L396 VanDerWaalsContact OE1-CD1 3.25Å; V370-L396 HydrophobicContact CB-CB 4.42Å; V370-L396 HydrophobicContact CG2-CB 3.48Å; V370-L396 VanDerWaalsContact CG2-CB 3.48Å; V370-L396 HydrophobicContact CG2-CD1 4.44Å; T375-L396 HydrophobicContact CG2-CD2 4.46Å; T375-L396 HydrophobicContact CG2-CG 4.18Å; L396-D400 WeakPolarHBondContact CA-OD2 3.44Å
397	T	85.6	Confident	73.9	Confident	15 Å²	15	46.8 Å²	46.8	9%	0.092	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-102.8	166.3	-172.8	75.2	0	0	0	0	110.5	K136 D140 E145 G399 D400	K136-T397 VanDerWaalsContact CE-OG1 3.23Å; K136-T397 WeakPolarHBondContact CE-OG1 3.37Å; K136-T397 PolarHBondContact NZ-OG1 3.18Å; D140-T397 VanDerWaalsContact CG-OG1 3.26Å; D140-T397 WeakPolarHBondContact OD1-CB 3.5Å; D140-T397 PolarHBondContact OD1-OG1 2.82Å; D140-T397 PolarHBondContact OD2-OG1 3.25Å; E145-T397 WeakPolarHBondContact OE2-CB 3.47Å; E145-T397 WeakPolarHBondContact OE2-CG2 3.46Å; T397-G399 PolarHBondContact O-N 3.49Å; T397-G399 PolarHBondContact OG1-N 2.85Å; T397-D400 PolarHBondContact N-OD2 3.07Å; T397-D400 WeakPolarHBondContact O-CB 3.5Å; T397-D400 PolarHBondContact O-N 3.26Å; T397-D400 PolarHBondContact OG1-N 3.45Å
398	V	87.9	Confident	75.6	Confident	81 Å²	81	45.1 Å²	45.1	49%	0.491	28%	0.279	S	S	.	.	H	α-helix	trans	-60.4	-31.6	171.8	-179.3	0	0	0	0	110.9	D400 L401	V398-D400 PolarHBondContact O-N 3.42Å; V398-L401 WeakPolarHBondContact O-CB 3.45Å; V398-L401 PolarHBondContact O-N 3.46Å
399	G	88.4	Confident	77.5	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-65.4	-19.2	173.9	0	0	0	0	0	114.4	K136 D140 T397 L401 V402 L403	K136-G399 WeakPolarHBondContact CB-O 3.23Å; D140-G399 VanDerWaalsContact OD1-CA 3.23Å; D140-G399 WeakPolarHBondContact OD1-CA 3.33Å; D140-G399 PolarHBondContact OD1-N 3.41Å; D140-G399 VanDerWaalsContact OD1-N 3.12Å; T397-G399 PolarHBondContact O-N 3.49Å; T397-G399 PolarHBondContact OG1-N 2.85Å; G399-L401 VanDerWaalsContact C-N 3.3Å; G399-L401 PolarHBondContact O-N 2.9Å; G399-V402 WeakPolarHBondContact O-CB 3.42Å; G399-V402 PolarHBondContact O-N 2.89Å; G399-L403 PolarHBondContact O-N 3.42Å
400	D	90.3	Very high	79.2	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.011	26%	0.256	C	S	.	.	H	α-helix	trans	-67	-29.8	173.3	-79	-55.6	0	0	0	112.9	K136 K258 Y259 V366 L396 T397 V398 V402 L403 V404	K136-D400 WeakPolarHBondContact CD-OD1 3.44Å; K136-D400 WeakPolarHBondContact CE-OD1 3.34Å; K136-D400 IonicContact NZ-OD1 3.99Å; K136-D400 PolarHBondContact NZ-OD1 2.85Å; K136-D400 IonicContact NZ-OD2 2.95Å; K136-D400 PolarHBondContact NZ-OD2 3.03Å; K258-D400 IonicContact NZ-OD1 2.79Å; K258-D400 PolarHBondContact NZ-OD1 3.36Å; Y259-D400 HydrophobicContact CE1-CB 3.78Å; Y259-D400 PolarHBondContact OH-OD1 3.24Å; V366-D400 HydrophobicContact CG1-CB 4.3Å; L396-D400 WeakPolarHBondContact CA-OD2 3.44Å; T397-D400 PolarHBondContact N-OD2 3.07Å; T397-D400 WeakPolarHBondContact O-CB 3.5Å; T397-D400 PolarHBondContact O-N 3.26Å; T397-D400 PolarHBondContact OG1-N 3.45Å; V398-D400 PolarHBondContact O-N 3.42Å; D400-V402 VanDerWaalsContact C-N 3.3Å; D400-V402 PolarHBondContact O-N 2.91Å; D400-L403 PolarHBondContact O-N 3.48Å; D400-V404 WeakPolarHBondContact O-CG2 3.46Å; D400-V404 PolarHBondContact O-N 2.97Å
401	L	91.6	Very high	81.3	Confident	49 Å²	49	40.4 Å²	40.4	26%	0.257	23%	0.226	S	C	.	.	H	α-helix	trans	-63.1	-40.8	171.8	-65.6	172.9	0	0	0	111	V366 A367 V398 G399 N405	V366-L401 HydrophobicContact CB-CD2 4.07Å; V366-L401 HydrophobicContact CG1-CD2 3.87Å; A367-L401 HydrophobicContact CB-CD2 3.96Å; V398-L401 WeakPolarHBondContact O-CB 3.45Å; V398-L401 PolarHBondContact O-N 3.46Å; G399-L401 VanDerWaalsContact C-N 3.3Å; G399-L401 PolarHBondContact O-N 2.9Å; L401-N405 VanDerWaalsContact O-CB 3.29Å; L401-N405 WeakPolarHBondContact O-CB 3.45Å; L401-N405 PolarHBondContact O-N 2.89Å
402	V	92.8	Very high	83.4	Confident	34 Å²	34	37.4 Å²	37.4	21%	0.206	21%	0.205	C	C	.	.	H	α-helix	trans	-68.3	-38.9	177.1	178.5	0	0	0	0	111.1	F135 V139 G399 D400 G406	F135-V402 HydrophobicContact CB-CG1 4.44Å; F135-V402 HydrophobicContact CD1-CG1 3.23Å; F135-V402 HydrophobicContact CD2-CG1 4.45Å; F135-V402 HydrophobicContact CE1-CG1 3.41Å; F135-V402 VanDerWaalsContact CE1-CG1 3.41Å; F135-V402 HydrophobicContact CG-CG1 3.81Å; F135-V402 HydrophobicContact CZ-CG1 4.1Å; V139-V402 HydrophobicContact CG1-CG2 4.44Å; V139-V402 HydrophobicContact CG2-CG1 4.46Å; V139-V402 HydrophobicContact CG2-CG2 4.13Å; G399-V402 WeakPolarHBondContact O-CB 3.42Å; G399-V402 PolarHBondContact O-N 2.89Å; D400-V402 VanDerWaalsContact C-N 3.3Å; D400-V402 PolarHBondContact O-N 2.91Å; V402-G406 PolarHBondContact O-N 3.03Å
403	L	93.6	Very high	85.4	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.2	-51.5	175.5	179.5	50.1	0	0	0	111.5	P132 F133 K136 Y259 G399 D400 N405 G406 L407	P132-L403 HydrophobicContact CB-CD1 3.6Å; F133-L403 HydrophobicContact CD1-CD1 4.25Å; F133-L403 HydrophobicContact CD1-CD2 3.84Å; F133-L403 HydrophobicContact CD2-CD1 3.74Å; F133-L403 HydrophobicContact CE1-CD1 4.4Å; F133-L403 HydrophobicContact CE1-CD2 3.69Å; F133-L403 HydrophobicContact CE2-CD1 3.9Å; F133-L403 HydrophobicContact CG-CD1 3.92Å; F133-L403 HydrophobicContact CG-CD2 4.34Å; F133-L403 HydrophobicContact CZ-CD1 4.24Å; F133-L403 HydrophobicContact CZ-CD2 4.07Å; K136-L403 HydrophobicContact CB-CB 4.1Å; K136-L403 HydrophobicContact CD-CB 4.24Å; K136-L403 HydrophobicContact CD-CD2 3.79Å; Y259-L403 WeakPolarHBondContact OH-CD2 3.44Å; Y259-L403 WeakPolarHBondContact OH-CG 3.39Å; G399-L403 PolarHBondContact O-N 3.42Å; D400-L403 PolarHBondContact O-N 3.48Å; L403-N405 PolarHBondContact O-N 3.48Å; L403-G406 PolarHBondContact O-N 3.42Å; L403-L407 HydrophobicContact CD1-CD1 3.62Å; L403-L407 HydrophobicContact CD1-CD2 4.43Å; L403-L407 HydrophobicContact CD1-CG 3.81Å; L403-L407 HydrophobicContact CG-CD1 3.94Å; L403-L407 HydrophobicContact CG-CG 4.5Å; L403-L407 WeakPolarHBondContact O-CB 3.29Å; L403-L407 WeakPolarHBondContact O-CG 3.33Å; L403-L407 PolarHBondContact O-N 2.95Å
404	V	92.8	Very high	87.2	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63.6	-43.9	-179.7	170.2	0	0	0	0	111.2	L255 Y259 T362 V366 D400 G406 L408	L255-V404 HydrophobicContact CD2-CG1 4.47Å; L255-V404 HydrophobicContact CD2-CG2 3.97Å; Y259-V404 HydrophobicContact CD1-CG2 4.49Å; Y259-V404 HydrophobicContact CD2-CG2 3.75Å; Y259-V404 HydrophobicContact CE1-CG2 4.09Å; Y259-V404 HydrophobicContact CE2-CG2 3.27Å; Y259-V404 HydrophobicContact CG-CG2 4.34Å; Y259-V404 VanDerWaalsContact CZ-CG2 3.46Å; T362-V404 HydrophobicContact CG2-CG1 3.58Å; V366-V404 HydrophobicContact CG2-CG1 4.48Å; V366-V404 HydrophobicContact CG2-CG2 3.98Å; D400-V404 WeakPolarHBondContact O-CG2 3.46Å; D400-V404 PolarHBondContact O-N 2.97Å; V404-G406 PolarHBondContact O-N 3.47Å; V404-L408 HydrophobicContact CG1-CD1 3.93Å; V404-L408 HydrophobicContact CG1-CG 4.49Å; V404-L408 WeakPolarHBondContact O-CB 3.3Å; V404-L408 WeakPolarHBondContact O-CG 3.4Å; V404-L408 PolarHBondContact O-N 3.32Å
405	N	93.9	Very high	88.7	Confident	62 Å²	62	29.3 Å²	29.3	33%	0.332	17%	0.165	S	C	.	.	H	α-helix	trans	-59.4	-47.3	174.6	178.7	51.8	0	0	0	111.7	M363 L401 L403 F409	M363-N405 HydrophobicContact SD-CB 4.18Å; L401-N405 VanDerWaalsContact O-CB 3.29Å; L401-N405 WeakPolarHBondContact O-CB 3.45Å; L401-N405 PolarHBondContact O-N 2.89Å; L403-N405 PolarHBondContact O-N 3.48Å; N405-F409 WeakPolarHBondContact O-CB 3.39Å; N405-F409 PolarHBondContact O-N 3.06Å
406	G	93	Very high	89.9	Confident	19 Å²	19	30.4 Å²	30.4	20%	0.196	17%	0.166	C	C	.	.	H	α-helix	trans	-62.2	-47.2	179.6	0	0	0	0	0	113.3	V402 L403 V404 Q410	V402-G406 PolarHBondContact O-N 3.03Å; L403-G406 PolarHBondContact O-N 3.42Å; V404-G406 PolarHBondContact O-N 3.47Å; G406-Q410 VanDerWaalsContact O-CG 3.27Å; G406-Q410 WeakPolarHBondContact O-CG 3.33Å; G406-Q410 PolarHBondContact O-N 2.95Å; G406-Q410 VanDerWaalsContact O-N 3.08Å
407	L	93.3	Very high	90.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-64.5	-46.7	-179.9	-71.3	171.9	0	0	0	111.9	V129 P132 F133 V251 I254 L403	V129-L407 HydrophobicContact CG1-CD2 4.22Å; P132-L407 HydrophobicContact CB-CD2 4.26Å; P132-L407 HydrophobicContact CB-CG 4.15Å; P132-L407 HydrophobicContact CG-CD2 4.03Å; P132-L407 HydrophobicContact CG-CG 4.28Å; F133-L407 HydrophobicContact CE2-CD2 4.47Å; V251-L407 HydrophobicContact CG1-CB 3.97Å; V251-L407 HydrophobicContact CG2-CB 4.47Å; V251-L407 HydrophobicContact CG2-CD2 4.25Å; I254-L407 HydrophobicContact CG2-CD1 3.9Å; L403-L407 HydrophobicContact CD1-CD1 3.62Å; L403-L407 HydrophobicContact CD1-CD2 4.43Å; L403-L407 HydrophobicContact CD1-CG 3.81Å; L403-L407 HydrophobicContact CG-CD1 3.94Å; L403-L407 HydrophobicContact CG-CG 4.5Å; L403-L407 WeakPolarHBondContact O-CB 3.29Å; L403-L407 WeakPolarHBondContact O-CG 3.33Å; L403-L407 PolarHBondContact O-N 2.95Å
408	L	92.4	Very high	90.1	Very high	9 Å²	9	34.4 Å²	34.4	5%	0.047	18%	0.183	C	C	.	.	H	α-helix	trans	-65.4	-48.4	177.6	-71.1	178.3	0	0	0	110.4	L255 A267 F355 L359 T362 V404 Q410 L411 S412	L255-L408 HydrophobicContact CD1-CD2 3.94Å; A267-L408 HydrophobicContact CB-CD2 3.81Å; F355-L408 HydrophobicContact CZ-CB 4.07Å; F355-L408 WeakPolarHBondContact CZ-O 3.5Å; L359-L408 HydrophobicContact CD1-CB 3.85Å; L359-L408 HydrophobicContact CD1-CD1 3.79Å; L359-L408 HydrophobicContact CD1-CG 4.46Å; T362-L408 HydrophobicContact CG2-CD1 4.07Å; V404-L408 HydrophobicContact CG1-CD1 3.93Å; V404-L408 HydrophobicContact CG1-CG 4.49Å; V404-L408 WeakPolarHBondContact O-CB 3.3Å; V404-L408 WeakPolarHBondContact O-CG 3.4Å; V404-L408 PolarHBondContact O-N 3.32Å; L408-Q410 VanDerWaalsContact C-N 3.25Å; L408-Q410 PolarHBondContact O-N 3.24Å; L408-L411 WeakPolarHBondContact O-CB 3.32Å; L408-L411 PolarHBondContact O-N 3.15Å; L408-S412 PolarHBondContact O-N 3.44Å
409	F	91.2	Very high	89.8	Confident	112 Å²	112	30.9 Å²	30.9	49%	0.491	16%	0.163	S	C	.	.	H	α-helix	trans	-58	-37.6	-177.8	-175	-95.8	0	0	0	112.5	N405 L411 S412 I413	N405-F409 WeakPolarHBondContact O-CB 3.39Å; N405-F409 PolarHBondContact O-N 3.06Å; F409-L411 VanDerWaalsContact C-N 3.28Å; F409-L411 PolarHBondContact O-N 3.46Å; F409-S412 WeakPolarHBondContact O-CB 3.46Å; F409-S412 PolarHBondContact O-N 2.87Å; F409-S412 VanDerWaalsContact O-N 3.09Å; F409-S412 PolarHBondContact O-OG 2.8Å; F409-I413 HydrophobicContact CE1-CD1 4.14Å
410	Q	90.5	Very high	89.7	Confident	25 Å²	25	33.2 Å²	33.2	12%	0.117	18%	0.178	C	C	.	.	H	α-helix	trans	-58.8	-37.7	174	-76.9	176.9	-5.5	0	0	112.8	N128 G406 L408 S412 I413 P414	N128-Q410 PolarHBondContact O-NE2 3.47Å; N128-Q410 VanDerWaalsContact O-NE2 3.13Å; N128-Q410 PolarHBondContact O-OE1 3.25Å; G406-Q410 VanDerWaalsContact O-CG 3.27Å; G406-Q410 WeakPolarHBondContact O-CG 3.33Å; G406-Q410 PolarHBondContact O-N 2.95Å; G406-Q410 VanDerWaalsContact O-N 3.08Å; L408-Q410 VanDerWaalsContact C-N 3.25Å; L408-Q410 PolarHBondContact O-N 3.24Å; Q410-S412 VanDerWaalsContact C-N 3.28Å; Q410-S412 PolarHBondContact O-N 3.03Å; Q410-I413 PolarHBondContact O-N 2.86Å; Q410-P414 WeakPolarHBondContact O-CD 3.21Å
411	L	90.5	Very high	89.6	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-66.2	-29.9	175.9	-63.9	179.5	0	0	0	112.8	E247 V248 V251 I271 L408 F409 I413 P414 L415	E247-L411 HydrophobicContact CB-CD2 4.1Å; E247-L411 HydrophobicContact CG-CD2 3.7Å; V248-L411 HydrophobicContact CG2-CD1 4.48Å; V248-L411 HydrophobicContact CG2-CD2 3.86Å; V251-L411 HydrophobicContact CB-CD1 3.93Å; V251-L411 HydrophobicContact CB-CD2 4.38Å; V251-L411 HydrophobicContact CB-CG 4.36Å; V251-L411 HydrophobicContact CG1-CD1 3.67Å; V251-L411 HydrophobicContact CG1-CG 4.31Å; V251-L411 HydrophobicContact CG2-CD1 4.35Å; V251-L411 HydrophobicContact CG2-CD2 4.1Å; V251-L411 HydrophobicContact CG2-CG 4.23Å; I271-L411 HydrophobicContact CD1-CD1 3.91Å; L408-L411 WeakPolarHBondContact O-CB 3.32Å; L408-L411 PolarHBondContact O-N 3.15Å; F409-L411 VanDerWaalsContact C-N 3.28Å; F409-L411 PolarHBondContact O-N 3.46Å; L411-I413 VanDerWaalsContact C-N 3.27Å; L411-I413 PolarHBondContact O-N 3.18Å; L411-P414 WeakPolarHBondContact O-CD 3.36Å; L411-L415 HydrophobicContact CB-CD1 4.42Å; L411-L415 WeakPolarHBondContact O-CB 3.34Å; L411-L415 WeakPolarHBondContact O-CD1 3.13Å; L411-L415 WeakPolarHBondContact O-CG 3.28Å; L411-L415 PolarHBondContact O-N 3.49Å
412	S	89	Confident	89.1	Confident	9 Å²	9	36.5 Å²	36.5	6%	0.063	19%	0.188	C	C	.	.	H	α-helix	trans	-64	-32.6	-180	77.4	0	0	0	0	112.6	L408 F409 Q410 L415 N416	L408-S412 PolarHBondContact O-N 3.44Å; F409-S412 WeakPolarHBondContact O-CB 3.46Å; F409-S412 PolarHBondContact O-N 2.87Å; F409-S412 VanDerWaalsContact O-N 3.09Å; F409-S412 PolarHBondContact O-OG 2.8Å; Q410-S412 VanDerWaalsContact C-N 3.28Å; Q410-S412 PolarHBondContact O-N 3.03Å; S412-L415 PolarHBondContact O-N 3.38Å; S412-N416 PolarHBondContact O-N 3.48Å; S412-N416 PolarHBondContact O-ND2 2.81Å; S412-N416 PolarHBondContact O-OD1 2.86Å
413	I	87.9	Confident	88.6	Confident	87 Å²	87	37.6 Å²	37.6	45%	0.446	19%	0.189	S	C	.	.	H	α-helix	trans	-66.8	-53.5	-172.9	-59.8	169.2	0	0	0	111.4	F409 Q410 L411 L415 F417	F409-I413 HydrophobicContact CE1-CD1 4.14Å; Q410-I413 PolarHBondContact O-N 2.86Å; L411-I413 VanDerWaalsContact C-N 3.27Å; L411-I413 PolarHBondContact O-N 3.18Å; I413-L415 VanDerWaalsContact C-N 3.34Å; I413-F417 WeakPolarHBondContact O-CD2 3.23Å; I413-F417 WeakPolarHBondContact O-CE2 3.27Å
414	P	87.2	Confident	88.4	Confident	27 Å²	27	40.1 Å²	40.1	18%	0.175	20%	0.201	C	C	.	.	H	α-helix	trans	-66.2	-35.3	175.7	-20.7	33.1	0	0	0	113.1	T244 Q410 L411 N416 F417	T244-P414 HydrophobicContact CG2-CB 4.09Å; T244-P414 VanDerWaalsContact OG1-CB 3.28Å; T244-P414 WeakPolarHBondContact OG1-CB 3.41Å; Q410-P414 WeakPolarHBondContact O-CD 3.21Å; L411-P414 WeakPolarHBondContact O-CD 3.36Å; P414-N416 VanDerWaalsContact C-N 3.29Å; P414-N416 PolarHBondContact O-N 3.11Å; P414-F417 PolarHBondContact O-N 3.04Å
415	L	89.1	Confident	88.1	Confident	9 Å²	9	41.8 Å²	41.8	5%	0.047	21%	0.211	C	C	.	.	H	α-helix	trans	-65.7	-29.5	-178.4	-72.1	175.9	0	0	0	112.8	T244 I271 Y274 L411 S412 I413 F417 L418	T244-L415 HydrophobicContact CG2-CD2 4.03Å; T244-L415 HydrophobicContact CG2-CG 4.41Å; I271-L415 HydrophobicContact CG1-CD1 4.47Å; I271-L415 HydrophobicContact CG2-CD1 4.44Å; Y274-L415 HydrophobicContact CD1-CB 4.27Å; Y274-L415 HydrophobicContact CE1-CB 3.69Å; Y274-L415 WeakPolarHBondContact CE1-O 3.43Å; Y274-L415 VanDerWaalsContact OH-C 3.25Å; Y274-L415 PolarHBondContact OH-O 2.97Å; L411-L415 HydrophobicContact CB-CD1 4.42Å; L411-L415 WeakPolarHBondContact O-CB 3.34Å; L411-L415 WeakPolarHBondContact O-CD1 3.13Å; L411-L415 WeakPolarHBondContact O-CG 3.28Å; L411-L415 PolarHBondContact O-N 3.49Å; S412-L415 PolarHBondContact O-N 3.38Å; I413-L415 VanDerWaalsContact C-N 3.34Å; L415-F417 PolarHBondContact O-N 3.32Å; L415-F417 VanDerWaalsContact O-N 3.13Å; L415-L418 HydrophobicContact CD2-CD2 4.33Å; L415-L418 WeakPolarHBondContact O-CB 3.4Å; L415-L418 PolarHBondContact O-N 2.86Å
416	N	87.5	Confident	87.7	Confident	80 Å²	80	46 Å²	46	43%	0.428	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-27.8	174.2	-71.9	-23.5	0	0	0	113.3	Y274 S412 P414	Y274-N416 WeakPolarHBondContact OH-CA 3.36Å; Y274-N416 PolarHBondContact OH-N 3.35Å; Y274-N416 PolarHBondContact OH-OD1 2.97Å; S412-N416 PolarHBondContact O-N 3.48Å; S412-N416 PolarHBondContact O-ND2 2.81Å; S412-N416 PolarHBondContact O-OD1 2.86Å; P414-N416 VanDerWaalsContact C-N 3.29Å; P414-N416 PolarHBondContact O-N 3.11Å
417	F	85.2	Confident	87.3	Confident	84 Å²	84	49.3 Å²	49.3	37%	0.368	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-6	178.2	-59.4	-75.4	0	0	0	113.5	L25 I413 P414 L415 G419 T420 V421	L25-F417 HydrophobicContact CD2-CD1 4.13Å; L25-F417 HydrophobicContact CD2-CE1 3.55Å; I413-F417 WeakPolarHBondContact O-CD2 3.23Å; I413-F417 WeakPolarHBondContact O-CE2 3.27Å; P414-F417 PolarHBondContact O-N 3.04Å; L415-F417 PolarHBondContact O-N 3.32Å; L415-F417 VanDerWaalsContact O-N 3.13Å; F417-G419 VanDerWaalsContact C-N 3.32Å; F417-G419 PolarHBondContact O-N 2.99Å; F417-T420 PolarHBondContact O-N 3.01Å; F417-T420 VanDerWaalsContact O-N 3.08Å; F417-V421 HydrophobicContact CB-CG2 4.32Å; F417-V421 WeakPolarHBondContact O-CG2 3.17Å; F417-V421 PolarHBondContact O-N 3.33Å
418	L	84.3	Confident	87.2	Confident	31 Å²	31	49.7 Å²	49.7	16%	0.162	24%	0.235	C	C	.	.	H	α-helix	trans	-58.9	-39.7	-170.1	-172.1	65.3	0	0	0	113.1	T275 F279 L415 V421 Y422	T275-L418 HydrophobicContact CG2-CD2 4.06Å; F279-L418 HydrophobicContact CE1-CD2 4.19Å; F279-L418 HydrophobicContact CE1-CG 3.99Å; F279-L418 HydrophobicContact CZ-CD2 4.2Å; F279-L418 HydrophobicContact CZ-CG 4.28Å; L415-L418 HydrophobicContact CD2-CD2 4.33Å; L415-L418 WeakPolarHBondContact O-CB 3.4Å; L415-L418 PolarHBondContact O-N 2.86Å; L418-V421 PolarHBondContact O-N 3.28Å; L418-Y422 VanDerWaalsContact O-CB 3.32Å; L418-Y422 WeakPolarHBondContact O-CB 3.39Å; L418-Y422 PolarHBondContact O-N 3.33Å
419	G	82	Confident	87	Confident	7 Å²	7	49.8 Å²	49.8	7%	0.072	24%	0.236	C	C	.	.	H	α-helix	trans	-64.8	-41.8	177.2	0	0	0	0	0	112.9	F417 R423	F417-G419 VanDerWaalsContact C-N 3.32Å; F417-G419 PolarHBondContact O-N 2.99Å; G419-R423 PolarHBondContact O-N 3.09Å
420	T	85.9	Confident	86.7	Confident	50 Å²	50	47.9 Å²	47.9	31%	0.307	23%	0.23	S	C	.	.	H	α-helix	trans	-66.8	-46.5	175.1	-64.1	0	0	0	0	110.9	F417 Y422 R423 E424	F417-T420 PolarHBondContact O-N 3.01Å; F417-T420 VanDerWaalsContact O-N 3.08Å; T420-Y422 PolarHBondContact O-N 2.9Å; T420-R423 PolarHBondContact O-N 2.95Å; T420-E424 HydrophobicContact CG2-CG 4.34Å; T420-E424 WeakPolarHBondContact CG2-OE1 3.25Å; T420-E424 WeakPolarHBondContact O-CB 3.43Å; T420-E424 WeakPolarHBondContact O-CG 3.38Å; T420-E424 PolarHBondContact O-N 3.36Å
421	V	86.9	Confident	86.6	Confident	9 Å²	9	48 Å²	48	6%	0.055	23%	0.231	C	C	.	.	H	α-helix	trans	-59	-48	178.2	172.5	0	0	0	0	110.8	A236 N240 L241 F417 L418 R423 E424 V425	A236-V421 HydrophobicContact CB-CG1 4.31Å; N240-V421 HydrophobicContact CB-CG2 4.46Å; L241-V421 HydrophobicContact CD2-CG1 4.12Å; L241-V421 HydrophobicContact CG-CG1 4.36Å; F417-V421 HydrophobicContact CB-CG2 4.32Å; F417-V421 WeakPolarHBondContact O-CG2 3.17Å; F417-V421 PolarHBondContact O-N 3.33Å; L418-V421 PolarHBondContact O-N 3.28Å; V421-R423 PolarHBondContact O-N 3.12Å; V421-E424 PolarHBondContact O-N 3.32Å; V421-V425 HydrophobicContact CG1-CG2 4.11Å; V421-V425 WeakPolarHBondContact O-CB 3.36Å; V421-V425 VanDerWaalsContact O-CG2 3.28Å; V421-V425 WeakPolarHBondContact O-CG2 3.32Å; V421-V425 PolarHBondContact O-N 2.92Å
422	Y	82.5	Confident	86.6	Confident	110 Å²	110	47.9 Å²	47.9	43%	0.431	23%	0.231	S	C	.	.	H	α-helix	trans	-56	-50.2	177.9	172.1	-100.7	0	0	0	112.2	F279 T282 L418 T420 E424 V425 R426	F279-Y422 HydrophobicContact CD1-CD2 4.48Å; F279-Y422 HydrophobicContact CD1-CG 4.21Å; F279-Y422 HydrophobicContact CE1-CD2 4.04Å; F279-Y422 AromaticContact CE1-CG 3.93Å; F279-Y422 HydrophobicContact CE1-CG 3.93Å; F279-Y422 HydrophobicContact CZ-CD2 4.39Å; T282-Y422 HydrophobicContact CG2-CD1 4.49Å; L418-Y422 VanDerWaalsContact O-CB 3.32Å; L418-Y422 WeakPolarHBondContact O-CB 3.39Å; L418-Y422 PolarHBondContact O-N 3.33Å; T420-Y422 PolarHBondContact O-N 2.9Å; Y422-E424 PolarHBondContact O-N 3.48Å; Y422-V425 PolarHBondContact O-N 2.67Å; Y422-R426 PolarHBondContact O-N 3.45Å
423	R	82.2	Confident	86.5	Confident	57 Å²	57	48.5 Å²	48.5	22%	0.215	24%	0.235	C	C	.	.	H	α-helix	trans	-63.1	-42.4	179.7	-178.9	-167.6	56.3	71.8	1.1	111.8	G419 T420 V421 R426 Q427	G419-R423 PolarHBondContact O-N 3.09Å; T420-R423 PolarHBondContact O-N 2.95Å; V421-R423 PolarHBondContact O-N 3.12Å; R423-R426 PolarHBondContact O-N 2.96Å; R423-Q427 PolarHBondContact O-N 3.46Å
424	E	88.1	Confident	86.4	Confident	54 Å²	54	47 Å²	47	25%	0.252	23%	0.229	S	C	.	.	H	α-helix	trans	-73.1	-34.8	-178.8	-73.5	176.9	-179.4	0	0	112.4	F232 T420 V421 Y422 Q427 S428	F232-E424 HydrophobicContact CD1-CB 3.78Å; F232-E424 HydrophobicContact CD2-CB 4.2Å; F232-E424 VanDerWaalsContact CE1-C 3.43Å; F232-E424 HydrophobicContact CE1-CB 3.23Å; F232-E424 HydrophobicContact CE2-CB 3.71Å; F232-E424 HydrophobicContact CE2-CG 4.38Å; F232-E424 WeakPolarHBondContact CE2-OE2 3.36Å; F232-E424 HydrophobicContact CG-CB 4.24Å; F232-E424 HydrophobicContact CZ-CB 3.2Å; F232-E424 HydrophobicContact CZ-CG 4.22Å; F232-E424 VanDerWaalsContact CZ-OE2 3.26Å; F232-E424 WeakPolarHBondContact CZ-OE2 3.12Å; T420-E424 HydrophobicContact CG2-CG 4.34Å; T420-E424 WeakPolarHBondContact CG2-OE1 3.25Å; T420-E424 WeakPolarHBondContact O-CB 3.43Å; T420-E424 WeakPolarHBondContact O-CG 3.38Å; T420-E424 PolarHBondContact O-N 3.36Å; V421-E424 PolarHBondContact O-N 3.32Å; Y422-E424 PolarHBondContact O-N 3.48Å; E424-Q427 PolarHBondContact O-N 2.8Å; E424-S428 WeakPolarHBondContact O-CB 3.43Å; E424-S428 PolarHBondContact O-N 3.41Å; E424-S428 PolarHBondContact O-OG 2.67Å
425	V	87.7	Confident	86.5	Confident	34 Å²	34	45.7 Å²	45.7	21%	0.206	22%	0.221	C	C	.	.	H	α-helix	trans	-60.4	-49.4	169.9	168.7	0	0	0	0	109.1	F232 A236 V421 Y422 Q427 S428 L429	F232-V425 HydrophobicContact CD1-CG2 4.5Å; F232-V425 HydrophobicContact CE1-CB 4.48Å; F232-V425 HydrophobicContact CE1-CG2 3.79Å; F232-V425 VanDerWaalsContact CE1-N 3.35Å; A236-V425 HydrophobicContact CB-CG2 4.36Å; V421-V425 HydrophobicContact CG1-CG2 4.11Å; V421-V425 WeakPolarHBondContact O-CB 3.36Å; V421-V425 VanDerWaalsContact O-CG2 3.28Å; V421-V425 WeakPolarHBondContact O-CG2 3.32Å; V421-V425 PolarHBondContact O-N 2.92Å; Y422-V425 PolarHBondContact O-N 2.67Å; V425-Q427 PolarHBondContact O-N 3.47Å; V425-S428 PolarHBondContact O-N 3.31Å; V425-L429 HydrophobicContact CG1-CD1 3.85Å; V425-L429 HydrophobicContact CG1-CG 4.37Å; V425-L429 VanDerWaalsContact O-CG 3.28Å; V425-L429 WeakPolarHBondContact O-CG 3.49Å; V425-L429 PolarHBondContact O-N 2.89Å
426	R	84.6	Confident	86.4	Confident	151 Å²	151	45.3 Å²	45.3	57%	0.57	22%	0.219	S	C	*	.	H	α-helix	trans	-58.8	-47.6	178.6	-169.1	-173.4	-174	-119.2	0.7	112.1	Y422 R423 L429 I430	Y422-R426 PolarHBondContact O-N 3.45Å; R423-R426 PolarHBondContact O-N 2.96Å; R426-L429 PolarHBondContact O-N 2.97Å; R426-I430 HydrophobicContact CG-CD1 4.45Å; R426-I430 WeakPolarHBondContact O-CG1 3.44Å; R426-I430 PolarHBondContact O-N 3.42Å
427	Q	86.2	Confident	86.3	Confident	88 Å²	88	42.1 Å²	42.1	41%	0.411	21%	0.205	S	C	.	.	H	α-helix	trans	-64	-42.7	178	-176.1	59.9	49	0	0	111.7	R423 E424 V425 L429 I430 D431	R423-Q427 PolarHBondContact O-N 3.46Å; E424-Q427 PolarHBondContact O-N 2.8Å; V425-Q427 PolarHBondContact O-N 3.47Å; Q427-L429 VanDerWaalsContact C-N 3.3Å; Q427-L429 PolarHBondContact O-N 3.28Å; Q427-I430 WeakPolarHBondContact O-CB 3.2Å; Q427-I430 PolarHBondContact O-N 2.9Å; Q427-I430 VanDerWaalsContact O-N 3.13Å; Q427-D431 PolarHBondContact NE2-OD1 2.9Å; Q427-D431 PolarHBondContact O-N 3.07Å
428	S	90.6	Very high	86.4	Confident	8 Å²	8	38.5 Å²	38.5	6%	0.056	19%	0.189	C	C	.	.	H	α-helix	trans	-62	-39.4	178.8	-62.5	0	0	0	0	111.6	G229 F232 E424 V425 I430 D431 M432	G229-S428 VanDerWaalsContact CA-CB 3.5Å; G229-S428 WeakPolarHBondContact O-CB 3.4Å; F232-S428 WeakPolarHBondContact CD1-OG 3.48Å; E424-S428 WeakPolarHBondContact O-CB 3.43Å; E424-S428 PolarHBondContact O-N 3.41Å; E424-S428 PolarHBondContact O-OG 2.67Å; V425-S428 PolarHBondContact O-N 3.31Å; S428-I430 VanDerWaalsContact C-N 3.34Å; S428-I430 PolarHBondContact O-N 3.22Å; S428-D431 PolarHBondContact O-N 3.32Å; S428-M432 WeakPolarHBondContact O-CB 3.46Å; S428-M432 WeakPolarHBondContact O-CG 3.47Å; S428-M432 PolarHBondContact O-N 3.21Å
429	L	88.8	Confident	86.5	Confident	12 Å²	12	38.9 Å²	38.9	6%	0.063	19%	0.192	C	C	.	.	H	α-helix	trans	-62.4	-39.5	174.4	-71.3	167.8	0	0	0	111.9	D91 I94 I95 I233 V425 R426 Q427 S433	D91-L429 HydrophobicContact CB-CD1 4.06Å; D91-L429 HydrophobicContact CB-CD2 4.41Å; I94-L429 HydrophobicContact CB-CD2 4.38Å; I94-L429 HydrophobicContact CG2-CD2 4.04Å; I95-L429 HydrophobicContact CD1-CD2 4.39Å; I95-L429 HydrophobicContact CG1-CD2 4.1Å; I233-L429 HydrophobicContact CD1-CD2 3.65Å; I233-L429 HydrophobicContact CD1-CG 3.9Å; V425-L429 HydrophobicContact CG1-CD1 3.85Å; V425-L429 HydrophobicContact CG1-CG 4.37Å; V425-L429 VanDerWaalsContact O-CG 3.28Å; V425-L429 WeakPolarHBondContact O-CG 3.49Å; V425-L429 PolarHBondContact O-N 2.89Å; R426-L429 PolarHBondContact O-N 2.97Å; Q427-L429 VanDerWaalsContact C-N 3.3Å; Q427-L429 PolarHBondContact O-N 3.28Å; L429-S433 WeakPolarHBondContact O-CB 3.48Å; L429-S433 PolarHBondContact O-N 3.14Å
430	I	85	Confident	86.7	Confident	71 Å²	71	41.8 Å²	41.8	36%	0.364	20%	0.203	S	C	.	.	H	α-helix	trans	-68.1	-44.9	175.5	-63.9	164.6	0	0	0	111.7	R426 Q427 S428 M432 S433 T434	R426-I430 HydrophobicContact CG-CD1 4.45Å; R426-I430 WeakPolarHBondContact O-CG1 3.44Å; R426-I430 PolarHBondContact O-N 3.42Å; Q427-I430 WeakPolarHBondContact O-CB 3.2Å; Q427-I430 PolarHBondContact O-N 2.9Å; Q427-I430 VanDerWaalsContact O-N 3.13Å; S428-I430 VanDerWaalsContact C-N 3.34Å; S428-I430 PolarHBondContact O-N 3.22Å; I430-M432 VanDerWaalsContact C-N 3.27Å; I430-M432 PolarHBondContact O-N 3.49Å; I430-S433 PolarHBondContact O-N 3.48Å; I430-S433 PolarHBondContact O-OG 3.5Å; I430-T434 PolarHBondContact O-N 3.3Å; I430-T434 PolarHBondContact O-OG1 2.98Å
431	D	88.2	Confident	86.7	Confident	28 Å²	28	42 Å²	42	15%	0.15	20%	0.202	C	C	.	.	H	α-helix	trans	-64.2	-38.9	179	-70.6	-22.2	0	0	0	110.7	R225 Q427 S428 T434 M435	R225-D431 HydrophobicContact CB-CB 4.04Å; Q427-D431 PolarHBondContact NE2-OD1 2.9Å; Q427-D431 PolarHBondContact O-N 3.07Å; S428-D431 PolarHBondContact O-N 3.32Å; D431-T434 WeakPolarHBondContact O-CB 3.07Å; D431-T434 PolarHBondContact O-N 3.39Å; D431-M435 PolarHBondContact O-N 3.07Å; D431-M435 VanDerWaalsContact O-N 3.11Å
432	M	90	Very high	86.7	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-70.3	-37.5	174.9	-76.7	-173.3	61.6	0	0	113.8	I94 L98 I230 I233 S428 I430 T434 M435 F436	I94-M432 HydrophobicContact CG2-CB 3.99Å; I94-M432 HydrophobicContact CG2-CE 3.58Å; I94-M432 HydrophobicContact CG2-SD 4.32Å; L98-M432 HydrophobicContact CD1-CE 3.28Å; L98-M432 HydrophobicContact CD1-SD 3.73Å; L98-M432 HydrophobicContact CD2-CE 3.56Å; L98-M432 HydrophobicContact CG-CE 3.29Å; L98-M432 HydrophobicContact CG-SD 4.36Å; I230-M432 HydrophobicContact CB-SD 4.36Å; I230-M432 HydrophobicContact CD1-CE 4.21Å; I230-M432 HydrophobicContact CG1-CE 3.58Å; I230-M432 HydrophobicContact CG1-CG 4.01Å; I230-M432 HydrophobicContact CG1-SD 3.65Å; I233-M432 HydrophobicContact CD1-SD 3.63Å; S428-M432 WeakPolarHBondContact O-CB 3.46Å; S428-M432 WeakPolarHBondContact O-CG 3.47Å; S428-M432 PolarHBondContact O-N 3.21Å; I430-M432 VanDerWaalsContact C-N 3.27Å; I430-M432 PolarHBondContact O-N 3.49Å; M432-T434 VanDerWaalsContact C-N 3.26Å; M432-T434 PolarHBondContact O-N 3.37Å; M432-M435 PolarHBondContact O-N 3.44Å; M432-F436 HydrophobicContact CE-CD2 4.13Å; M432-F436 HydrophobicContact CE-CE2 3.3Å; M432-F436 HydrophobicContact CE-CZ 3.86Å; M432-F436 WeakPolarHBondContact O-CB 3.32Å; M432-F436 PolarHBondContact O-N 3.07Å
433	S	87.3	Confident	86.9	Confident	21 Å²	21	42.2 Å²	42.2	15%	0.147	22%	0.215	C	C	.	.	H	α-helix	trans	-62.9	-38.4	175.3	74.4	0	0	0	0	110.4	L429 I430 G437	L429-S433 WeakPolarHBondContact O-CB 3.48Å; L429-S433 PolarHBondContact O-N 3.14Å; I430-S433 PolarHBondContact O-N 3.48Å; I430-S433 PolarHBondContact O-OG 3.5Å; S433-G437 WeakPolarHBondContact O-CA 3.43Å; S433-G437 PolarHBondContact O-N 3.05Å
434	T	85.2	Confident	87	Confident	55 Å²	55	45 Å²	45	34%	0.337	24%	0.239	S	C	.	.	H	α-helix	trans	-61.8	-47.8	173.4	-54.6	0	0	0	0	111.3	A222 I430 D431 M432 G437 L438	A222-T434 HydrophobicContact CB-CG2 4.09Å; I430-T434 PolarHBondContact O-N 3.3Å; I430-T434 PolarHBondContact O-OG1 2.98Å; D431-T434 WeakPolarHBondContact O-CB 3.07Å; D431-T434 PolarHBondContact O-N 3.39Å; M432-T434 VanDerWaalsContact C-N 3.26Å; M432-T434 PolarHBondContact O-N 3.37Å; T434-G437 PolarHBondContact O-N 3.06Å; T434-L438 PolarHBondContact O-N 3.39Å
435	M	88.3	Confident	87	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-66.8	-44.7	179.6	-176.1	-177.3	67.8	0	0	112.6	V195 V199 I230 D431 M432 G437 L438	V195-M435 HydrophobicContact CG1-CE 3.56Å; V195-M435 HydrophobicContact CG1-SD 4.37Å; V199-M435 HydrophobicContact CG1-CG 4.24Å; V199-M435 HydrophobicContact CG2-CG 3.85Å; V199-M435 HydrophobicContact CG2-SD 4.23Å; I230-M435 HydrophobicContact CD1-CE 3.56Å; I230-M435 HydrophobicContact CG1-CE 4.14Å; D431-M435 PolarHBondContact O-N 3.07Å; D431-M435 VanDerWaalsContact O-N 3.11Å; M432-M435 PolarHBondContact O-N 3.44Å; M435-G437 VanDerWaalsContact C-N 3.32Å; M435-L438 VanDerWaalsContact O-CB 3.27Å; M435-L438 WeakPolarHBondContact O-CB 3.32Å; M435-L438 PolarHBondContact O-N 3.12Å; M435-L438 VanDerWaalsContact O-N 3.16Å
436	F	88	Confident	87	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.009	25%	0.25	C	S	.	.	H	α-helix	trans	-70.6	-29.8	176.8	-74.1	-39	0	0	0	112.5	L89 I94 R97 V195 M432 L438 L439 E440	L89-F436 HydrophobicContact CD1-CB 3.69Å; I94-F436 HydrophobicContact CG2-CD2 4.06Å; I94-F436 HydrophobicContact CG2-CE2 3.95Å; R97-F436 HydrophobicContact CB-CE2 4.4Å; R97-F436 HydrophobicContact CB-CZ 4.47Å; V195-F436 HydrophobicContact CG1-CE1 3.94Å; M432-F436 HydrophobicContact CE-CD2 4.13Å; M432-F436 HydrophobicContact CE-CE2 3.3Å; M432-F436 HydrophobicContact CE-CZ 3.86Å; M432-F436 WeakPolarHBondContact O-CB 3.32Å; M432-F436 PolarHBondContact O-N 3.07Å; F436-L438 PolarHBondContact O-N 2.98Å; F436-L439 HydrophobicContact CD1-CD1 3.91Å; F436-L439 HydrophobicContact CE1-CD1 4.4Å; F436-L439 WeakPolarHBondContact O-CB 3.38Å; F436-L439 PolarHBondContact O-N 3.36Å; F436-E440 PolarHBondContact O-N 3.36Å
437	G	86.2	Confident	87.4	Confident	13 Å²	13	43.9 Å²	43.9	13%	0.134	24%	0.236	C	C	.	.	H	α-helix	trans	-58.2	-30.1	169.5	0	0	0	0	0	112.2	S433 T434 M435 E440 L441	S433-G437 WeakPolarHBondContact O-CA 3.43Å; S433-G437 PolarHBondContact O-N 3.05Å; T434-G437 PolarHBondContact O-N 3.06Å; M435-G437 VanDerWaalsContact C-N 3.32Å; G437-E440 PolarHBondContact O-N 3.24Å; G437-L441 PolarHBondContact O-N 3.4Å
438	L	86.7	Confident	87.6	Confident	7 Å²	7	44.5 Å²	44.5	4%	0.037	24%	0.242	C	C	.	.	H	α-helix	trans	-65.2	-37.3	171.9	-59.1	176.3	0	0	0	112.3	V199 H202 M203 Y210 L219 A222 T434 M435 F436 E440 L441	V199-L438 HydrophobicContact CG1-CB 4.42Å; V199-L438 HydrophobicContact CG1-CD1 4.12Å; H202-L438 PolarHBondContact CD2-O 3.41Å; H202-L438 PolarHBondContact NE2-O 3.07Å; M203-L438 HydrophobicContact SD-CD1 4.16Å; Y210-L438 WeakPolarHBondContact OH-CD2 3.43Å; L219-L438 HydrophobicContact CD2-CD2 4.12Å; A222-L438 HydrophobicContact CB-CD1 4.38Å; T434-L438 PolarHBondContact O-N 3.39Å; M435-L438 VanDerWaalsContact O-CB 3.27Å; M435-L438 WeakPolarHBondContact O-CB 3.32Å; M435-L438 PolarHBondContact O-N 3.12Å; M435-L438 VanDerWaalsContact O-N 3.16Å; F436-L438 PolarHBondContact O-N 2.98Å; L438-E440 PolarHBondContact O-N 2.8Å; L438-L441 HydrophobicContact CD2-CD1 4.09Å; L438-L441 WeakPolarHBondContact O-CB 3.28Å; L438-L441 PolarHBondContact O-N 2.96Å
439	L	87	Confident	87.5	Confident	40 Å²	40	49.8 Å²	49.8	21%	0.209	28%	0.276	C	S	.	.	H	α-helix	trans	-70.2	-21.5	176.6	-66.2	-179.6	0	0	0	112.9	Q198 V199 H202 F436	Q198-L439 HydrophobicContact CG-CD2 4.39Å; V199-L439 HydrophobicContact CB-CD2 4.29Å; V199-L439 HydrophobicContact CG2-CD1 4.01Å; V199-L439 HydrophobicContact CG2-CD2 3.86Å; V199-L439 HydrophobicContact CG2-CG 3.87Å; H202-L439 HydrophobicContact CB-CD2 3.68Å; F436-L439 HydrophobicContact CD1-CD1 3.91Å; F436-L439 HydrophobicContact CE1-CD1 4.4Å; F436-L439 WeakPolarHBondContact O-CB 3.38Å; F436-L439 PolarHBondContact O-N 3.36Å
440	E	86.3	Confident	87.6	Confident	68 Å²	68	57.2 Å²	57.2	32%	0.318	32%	0.315	S	S	.	.	H	α-helix	trans	-84.4	-13.2	177.9	-66.8	-175.5	168	0	0	113	L89 R97 F436 G437 L438 V442	L89-E440 WeakPolarHBondContact CD2-OE1 3.48Å; R97-E440 IonicContact CZ-OE1 2.64Å; R97-E440 IonicContact NH1-OE1 3.4Å; R97-E440 PolarHBondContact NH1-OE1 3.25Å; R97-E440 IonicContact NH2-OE1 2.75Å; R97-E440 PolarHBondContact NH2-OE1 3.42Å; F436-E440 PolarHBondContact O-N 3.36Å; G437-E440 PolarHBondContact O-N 3.24Å; L438-E440 PolarHBondContact O-N 2.8Å; E440-V442 PolarHBondContact O-N 2.98Å
441	L	86	Confident	87.9	Confident	54 Å²	54	54.5 Å²	54.5	28%	0.283	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-65.4	123.1	172.7	-63.1	172.7	0	0	0	109.6	H202 L206 Y210 G437 L438	H202-L441 PolarHBondContact CE1-O 3.21Å; H202-L441 VanDerWaalsContact CE1-O 3.24Å; H202-L441 PolarHBondContact NE2-O 3.35Å; L206-L441 HydrophobicContact CD1-CB 4.44Å; L206-L441 HydrophobicContact CD1-CD1 3.92Å; L206-L441 HydrophobicContact CD2-CB 3.7Å; Y210-L441 HydrophobicContact CD2-CD1 4.18Å; Y210-L441 HydrophobicContact CE1-CD1 4.4Å; Y210-L441 HydrophobicContact CE2-CD1 3.32Å; Y210-L441 VanDerWaalsContact CZ-CD1 3.45Å; Y210-L441 WeakPolarHBondContact OH-CD1 3.29Å; G437-L441 PolarHBondContact O-N 3.4Å; L438-L441 HydrophobicContact CD2-CD1 4.09Å; L438-L441 WeakPolarHBondContact O-CB 3.28Å; L438-L441 PolarHBondContact O-N 2.96Å
442	V	85.7	Confident	88.2	Confident	101 Å²	101	56.9 Å²	56.9	61%	0.612	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-91.9	123.5	176.1	-177.2	0	0	0	0	108.4	E440 T444	E440-V442 PolarHBondContact O-N 2.98Å; V442-T444 PolarHBondContact O-N 2.9Å
443	P	86.2	Confident	88.5	Confident	23 Å²	23	61 Å²	61	15%	0.149	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-59	134.3	170.6	-21.2	30.9	0	0	0	111.3	N205 L206	N205-P443 HydrophobicContact CB-CG 4.38Å; N205-P443 VanDerWaalsContact O-CB 3.25Å; N205-P443 WeakPolarHBondContact O-CB 3.32Å; N205-P443 VanDerWaalsContact O-CG 3.25Å; N205-P443 WeakPolarHBondContact O-CG 3.32Å; L206-P443 HydrophobicContact CD2-CG 4.2Å
444	T	84	Confident	88.7	Confident	116 Å²	116	60.7 Å²	60.7	71%	0.712	34%	0.339	S	S	*	.	S	Bend	trans	-71.3	-42	177.2	-35.9	0	0	0	0	110.1	D207 V442	D207-T444 VanDerWaalsContact CG-N 3.29Å; D207-T444 PolarHBondContact OD1-N 2.86Å; D207-T444 VanDerWaalsContact OD1-N 3.08Å; D207-T444 VanDerWaalsContact OD2-CB 3.26Å; D207-T444 WeakPolarHBondContact OD2-CB 3.41Å; D207-T444 PolarHBondContact OD2-N 2.98Å; D207-T444 PolarHBondContact OD2-OG1 3.17Å; V442-T444 PolarHBondContact O-N 2.9Å
445	V	88.3	Confident	88.9	Confident	14 Å²	14	65 Å²	65	9%	0.085	36%	0.356	C	S	.	.	S	Bend	trans	-97.6	111.8	177.1	-177.4	0	0	0	0	109.4	D207 R521 L542	D207-V445 WeakPolarHBondContact OD1-CB 3.37Å; D207-V445 PolarHBondContact OD1-N 2.86Å; V445-R521 HydrophobicContact CG1-CG 3.9Å; V445-L542 HydrophobicContact CG1-CD2 4.31Å
446	R	89.4	Confident	89.1	Confident	162 Å²	162	66.4 Å²	66.4	61%	0.611	36%	0.362	S	S	*	.			trans	-141.2	153.4	175.4	61.8	-174.8	-179	179.5	0.3	110.9	R521	R446-R521 PolarHBondContact O-NH2 2.94Å; R446-R521 VanDerWaalsContact O-NH2 3.17Å
447	S	91.1	Very high	89.2	Confident	39 Å²	39	70.2 Å²	70.2	27%	0.273	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-60.5	141.4	165.6	-56	0	0	0	0	109.3	L542	S447-L542 WeakPolarHBondContact OG-CB 3.35Å; S447-L542 PolarHBondContact OG-N 3.14Å
448	L	90.5	Very high	89.5	Confident	101 Å²	101	75.7 Å²	75.7	53%	0.529	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-62.9	150.7	168.7	-64.3	171.7	0	0	0	109.6	N450 A451	L448-N450 PolarHBondContact O-N 3.09Å; L448-A451 HydrophobicContact CB-CB 4.28Å; L448-A451 WeakPolarHBondContact O-CB 3.15Å; L448-A451 PolarHBondContact O-N 3.44Å
449	P	88.7	Confident	89.7	Confident	118 Å²	118	79.8 Å²	79.8	77%	0.766	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	126.8	169.8	-23.1	33.4	0	0	0	109.9	A451	P449-A451 VanDerWaalsContact C-N 3.31Å; P449-A451 PolarHBondContact O-N 3.27Å
450	N	90.6	Very high	90.1	Very high	168 Å²	168	80.7 Å²	80.7	90%	0.898	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	26.7	-176.2	-51.4	-35.3	0	0	0	115.7	L448	L448-N450 PolarHBondContact O-N 3.09Å
451	A	92.4	Very high	90.5	Very high	15 Å²	15	77.5 Å²	77.5	12%	0.124	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-57.5	129.4	174.6	0	0	0	0	0	111.5	L448 P449	L448-A451 HydrophobicContact CB-CB 4.28Å; L448-A451 WeakPolarHBondContact O-CB 3.15Å; L448-A451 PolarHBondContact O-N 3.44Å; P449-A451 VanDerWaalsContact C-N 3.31Å; P449-A451 PolarHBondContact O-N 3.27Å
452	P	94.7	Very high	91	Very high	78 Å²	78	75.6 Å²	75.6	51%	0.506	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-64.7	151.4	178.5	27.2	-35.3	0	0	0	111.4	S539 V540 N541	P452-S539 WeakPolarHBondContact CD-O 3.29Å; P452-V540 CarbonylContact O-C 3.4Å; P452-V540 WeakPolarHBondContact O-CA 3.44Å; P452-N541 PolarHBondContact O-N 2.97Å
453	N	95.3	Very high	91.6	Very high	87 Å²	87	70.9 Å²	70.9	47%	0.465	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-69.9	141.2	169.1	-72.3	-25.5	0	0	0	109.7	H455 N541 S544	N453-H455 PolarHBondContact O-CD2 3.06Å; N453-H455 VanDerWaalsContact O-CD2 3.26Å; N453-N541 WeakPolarHBondContact OD1-CB 3.15Å; N453-S544 WeakPolarHBondContact CA-OG 3.38Å
454	I	93.1	Very high	92.1	Very high	13 Å²	13	71.4 Å²	71.4	7%	0.067	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-74.1	129	172.2	-155.3	170.7	0	0	0	109	I456 V532 V540 S544 L545 A548	I454-I456 HydrophobicContact CD1-CD1 3.35Å; I454-I456 HydrophobicContact CD1-CG1 4.27Å; I454-I456 HydrophobicContact CG1-CD1 3.56Å; I454-I456 HydrophobicContact CG1-CG1 3.93Å; I454-V532 HydrophobicContact CD1-CB 4.08Å; I454-V532 HydrophobicContact CD1-CG1 3.96Å; I454-V540 HydrophobicContact CB-CB 4.28Å; I454-V540 HydrophobicContact CB-CG1 4.22Å; I454-V540 HydrophobicContact CD1-CG1 4.4Å; I454-V540 HydrophobicContact CD1-CG2 4.34Å; I454-V540 HydrophobicContact CG1-CG1 4.22Å; I454-S544 WeakPolarHBondContact CG2-O 3.33Å; I454-S544 PolarHBondContact N-OG 3.21Å; I454-L545 HydrophobicContact CD1-CD1 3.97Å; I454-A548 HydrophobicContact CG2-CB 4.3Å
455	H	89	Confident	92.8	Very high	147 Å²	147	66 Å²	66	68%	0.681	35%	0.349	S	S	*	.			trans	-110.7	93.7	177	-69.9	-77.3	0	0	0	109.1	N453 N460	N453-H455 PolarHBondContact O-CD2 3.06Å; N453-H455 VanDerWaalsContact O-CD2 3.26Å; H455-N460 PolarHBondContact O-ND2 3.02Å
456	I	91.1	Very high	93.2	Very high	28 Å²	28	70.6 Å²	70.6	14%	0.144	36%	0.364	C	S	.	.			trans	-126.8	135.3	-178.7	-69.7	172.1	0	0	0	110.5	I454 N460 V532 P629	I454-I456 HydrophobicContact CD1-CD1 3.35Å; I454-I456 HydrophobicContact CD1-CG1 4.27Å; I454-I456 HydrophobicContact CG1-CD1 3.56Å; I454-I456 HydrophobicContact CG1-CG1 3.93Å; I456-N460 WeakPolarHBondContact CA-OD1 3.42Å; I456-N460 WeakPolarHBondContact CG2-OD1 3.49Å; I456-V532 HydrophobicContact CD1-CB 4.32Å; I456-V532 HydrophobicContact CD1-CG1 3.42Å; I456-V532 VanDerWaalsContact CD1-CG1 3.42Å; I456-P629 HydrophobicContact CG2-CB 4.25Å; I456-P629 HydrophobicContact CG2-CG 3.84Å
457	D	91.1	Very high	93.4	Very high	83 Å²	83	67 Å²	67	44%	0.444	36%	0.357	S	S	.	.			trans	-123.7	-172.9	169	63.8	36.3	0	0	0	109.6	S459 N460 S461	D457-S459 PolarHBondContact O-N 3Å; D457-S459 WeakPolarHBondContact OD1-CA 3.38Å; D457-S459 VanDerWaalsContact OD1-CB 3.29Å; D457-S459 WeakPolarHBondContact OD1-CB 3.39Å; D457-S459 PolarHBondContact OD1-N 3.35Å; D457-S459 PolarHBondContact OD1-OG 3.28Å; D457-N460 PolarHBondContact N-OD1 3.12Å; D457-N460 PolarHBondContact O-N 3.37Å; D457-N460 PolarHBondContact O-OD1 3.36Å; D457-N460 PolarHBondContact OD1-N 3.17Å; D457-N460 PolarHBondContact OD1-OD1 3.47Å; D457-S461 WeakPolarHBondContact O-CB 3.42Å; D457-S461 PolarHBondContact O-N 3.06Å; D457-S461 PolarHBondContact O-OG 3.37Å
458	R	92	Very high	93.7	Very high	128 Å²	128	65.1 Å²	65.1	48%	0.483	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-61.7	-31.1	-179.6	-68.2	-174.7	-172	173.6	6.4	112.9	S461 P498 P657 G658	R458-S461 PolarHBondContact O-OG 2.63Å; R458-P498 WeakPolarHBondContact O-CB 3.34Å; R458-P657 PolarHBondContact NH1-O 2.93Å; R458-G658 WeakPolarHBondContact CB-O 3.25Å
459	S	91.8	Very high	93.8	Very high	92 Å²	92	63.8 Å²	63.8	64%	0.643	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-76	-24.8	-175.1	75.3	0	0	0	0	114.3	D457 P498	D457-S459 PolarHBondContact O-N 3Å; D457-S459 WeakPolarHBondContact OD1-CA 3.38Å; D457-S459 VanDerWaalsContact OD1-CB 3.29Å; D457-S459 WeakPolarHBondContact OD1-CB 3.39Å; D457-S459 PolarHBondContact OD1-N 3.35Å; D457-S459 PolarHBondContact OD1-OG 3.28Å; S459-P498 WeakPolarHBondContact O-CB 3.47Å; S459-P498 WeakPolarHBondContact O-CG 3.15Å
460	N	94.4	Very high	94	Very high	60 Å²	60	58.4 Å²	58.4	32%	0.321	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-123.1	19.7	-177.6	69.3	1.8	0	0	0	113.4	H455 I456 D457 S462 G533	H455-N460 PolarHBondContact O-ND2 3.02Å; I456-N460 WeakPolarHBondContact CA-OD1 3.42Å; I456-N460 WeakPolarHBondContact CG2-OD1 3.49Å; D457-N460 PolarHBondContact N-OD1 3.12Å; D457-N460 PolarHBondContact O-N 3.37Å; D457-N460 PolarHBondContact O-OD1 3.36Å; D457-N460 PolarHBondContact OD1-N 3.17Å; D457-N460 PolarHBondContact OD1-OD1 3.47Å; N460-S462 PolarHBondContact O-N 2.88Å; N460-G533 WeakPolarHBondContact O-CA 3.16Å
461	S	95.2	Very high	94	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.257	C	S	.	.			trans	-80	37.9	-175.1	55	0	0	0	0	115.6	D457 R458 T660	D457-S461 WeakPolarHBondContact O-CB 3.42Å; D457-S461 PolarHBondContact O-N 3.06Å; D457-S461 PolarHBondContact O-OG 3.37Å; R458-S461 PolarHBondContact O-OG 2.63Å; S461-T660 WeakPolarHBondContact O-CB 3.34Å; S461-T660 WeakPolarHBondContact O-CG2 3.48Å; S461-T660 PolarHBondContact O-OG1 3.29Å; S461-T660 VanDerWaalsContact O-OG1 3.13Å; S461-T660 PolarHBondContact OG-OG1 3.29Å
462	S	96.8	Very high	93.6	Very high	14 Å²	14	53.4 Å²	53.4	10%	0.098	27%	0.265	C	S	.	.			trans	-66.8	148.5	177.9	57.4	0	0	0	0	112.5	N460 V496 V532 G533	N460-S462 PolarHBondContact O-N 2.88Å; S462-V496 VanDerWaalsContact CA-O 3.24Å; S462-V496 WeakPolarHBondContact CA-O 3.09Å; S462-V496 WeakPolarHBondContact CB-O 3.37Å; S462-V532 CarbonylContact O-C 3.51Å; S462-V532 WeakPolarHBondContact O-CA 3.33Å; S462-G533 PolarHBondContact O-N 2.98Å
463	V	97.4	Very high	92.7	Very high	3 Å²	3	55.4 Å²	55.4	2%	0.018	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	123.7	171.8	-179.9	0	0	0	0	108.8	F465 K495 V496 V519 L531 I630	V463-F465 HydrophobicContact CG1-CE2 4.29Å; V463-K495 CarbonylContact O-C 3.55Å; V463-K495 WeakPolarHBondContact O-CA 3.2Å; V463-V496 HydrophobicContact CB-CB 4.21Å; V463-V496 HydrophobicContact CB-CG2 4.4Å; V463-V496 PolarHBondContact N-O 3.27Å; V463-V496 PolarHBondContact O-N 3.38Å; V463-V519 HydrophobicContact CG1-CG1 4.24Å; V463-V519 HydrophobicContact CG1-CG2 3.83Å; V463-L531 WeakPolarHBondContact CA-O 3.3Å; V463-I630 HydrophobicContact CG2-CD1 3.89Å; V463-I630 HydrophobicContact CG2-CG1 4.47Å; V463-I630 HydrophobicContact CG2-CG2 4.13Å
464	E	97.6	Very high	91.4	Very high	33 Å²	33	55.1 Å²	55.1	15%	0.154	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	132.9	-173.3	-168.2	179.4	172.2	0	0	111.6	R466 F494 K495 V530 L531	E464-R466 HydrophobicContact CG-CG 3.97Å; E464-R466 WeakPolarHBondContact OE1-CG 3.49Å; E464-R466 IonicContact OE1-CZ 2.79Å; E464-R466 IonicContact OE1-NE 3.41Å; E464-R466 PolarHBondContact OE1-NE 2.89Å; E464-R466 IonicContact OE1-NH2 3.48Å; E464-R466 PolarHBondContact OE1-NH2 3.24Å; E464-R466 IonicContact OE2-CZ 2.69Å; E464-R466 IonicContact OE2-NE 2.71Å; E464-R466 PolarHBondContact OE2-NE 3.08Å; E464-R466 IonicContact OE2-NH2 3.4Å; E464-R466 PolarHBondContact OE2-NH2 2.87Å; E464-F494 WeakPolarHBondContact CA-O 3.2Å; E464-K495 HydrophobicContact CB-CB 4.5Å; E464-K495 HydrophobicContact CB-CG 4.11Å; E464-K495 HydrophobicContact CG-CB 4.02Å; E464-K495 HydrophobicContact CG-CD 4.33Å; E464-K495 HydrophobicContact CG-CG 3.98Å; E464-V530 CarbonylContact O-C 3.6Å; E464-V530 WeakPolarHBondContact O-CA 3.49Å; E464-L531 HydrophobicContact CB-CB 4.23Å; E464-L531 HydrophobicContact CB-CD1 4.07Å; E464-L531 HydrophobicContact CG-CD1 4.23Å; E464-L531 PolarHBondContact N-O 2.89Å; E464-L531 PolarHBondContact O-N 2.69Å
465	F	97.7	Very high	89.9	Confident	2 Å²	2	59 Å²	59	1%	0.009	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	122.9	168.3	-79.2	-118.7	0	0	0	107.3	V463 V468 L492 S493 F494 I515 L518 V519 V530	V463-F465 HydrophobicContact CG1-CE2 4.29Å; F465-V468 HydrophobicContact CB-CG2 3.99Å; F465-V468 HydrophobicContact CD1-CB 3.96Å; F465-V468 HydrophobicContact CD1-CG1 4.15Å; F465-V468 HydrophobicContact CD1-CG2 3.59Å; F465-V468 HydrophobicContact CE1-CG1 4.47Å; F465-V468 HydrophobicContact CE1-CG2 4.42Å; F465-V468 HydrophobicContact CG-CG2 4.12Å; F465-L492 HydrophobicContact CD1-CD2 4Å; F465-L492 HydrophobicContact CD1-CG 4.42Å; F465-L492 HydrophobicContact CE1-CD2 4.41Å; F465-S493 CarbonylContact O-C 2.89Å; F465-S493 WeakPolarHBondContact O-CA 3.4Å; F465-F494 HydrophobicContact CB-CD1 3.9Å; F465-F494 HydrophobicContact CB-CE1 3.79Å; F465-F494 HydrophobicContact CB-CG 4.49Å; F465-F494 HydrophobicContact CB-CZ 4.31Å; F465-F494 AromaticContact CD1-CE1 3.99Å; F465-F494 HydrophobicContact CD1-CE1 3.99Å; F465-F494 HydrophobicContact CD1-CZ 4.38Å; F465-F494 HydrophobicContact CD2-CD1 4.42Å; F465-F494 AromaticContact CD2-CE1 3.62Å; F465-F494 HydrophobicContact CD2-CE1 3.62Å; F465-F494 AromaticContact CD2-CE2 3.88Å; F465-F494 HydrophobicContact CD2-CE2 3.88Å; F465-F494 AromaticContact CD2-CZ 3.29Å; F465-F494 HydrophobicContact CD2-CZ 3.29Å; F465-F494 HydrophobicContact CE2-CE1 4.21Å; F465-F494 HydrophobicContact CE2-CE2 4.35Å; F465-F494 AromaticContact CE2-CZ 3.63Å; F465-F494 HydrophobicContact CE2-CZ 3.63Å; F465-F494 HydrophobicContact CG-CD1 4.17Å; F465-F494 AromaticContact CG-CE1 3.52Å; F465-F494 HydrophobicContact CG-CE1 3.52Å; F465-F494 AromaticContact CG-CZ 3.75Å; F465-F494 HydrophobicContact CG-CZ 3.75Å; F465-F494 HydrophobicContact CZ-CZ 4.34Å; F465-F494 PolarHBondContact N-O 3.15Å; F465-F494 PolarHBondContact O-N 2.98Å; F465-I515 HydrophobicContact CE1-CG2 4.32Å; F465-I515 HydrophobicContact CE2-CG2 3.9Å; F465-I515 HydrophobicContact CZ-CB 4.36Å; F465-I515 HydrophobicContact CZ-CG2 3.6Å; F465-L518 HydrophobicContact CE1-CB 4.16Å; F465-L518 HydrophobicContact CE1-CD1 4.01Å; F465-L518 HydrophobicContact CZ-CB 4.14Å; F465-V519 HydrophobicContact CE2-CG2 3.44Å; F465-V519 VanDerWaalsContact CE2-CG2 3.44Å; F465-V519 HydrophobicContact CZ-CG2 3.66Å; F465-V530 HydrophobicContact CD1-CG2 3.97Å; F465-V530 HydrophobicContact CD2-CG1 4.32Å; F465-V530 HydrophobicContact CE1-CG2 3.75Å; F465-V530 HydrophobicContact CE2-CG1 3.9Å; F465-V530 HydrophobicContact CE2-CG2 4.37Å; F465-V530 HydrophobicContact CG-CG2 4.34Å; F465-V530 HydrophobicContact CZ-CG1 4.07Å; F465-V530 HydrophobicContact CZ-CG2 3.95Å
466	R	96.6	Very high	88.3	Confident	111 Å²	111	55.1 Å²	55.1	42%	0.419	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	110.9	176.6	-64.9	-174.3	-172.5	154.5	10.3	110.1	E464 V468 G528 S529 L531	E464-R466 HydrophobicContact CG-CG 3.97Å; E464-R466 WeakPolarHBondContact OE1-CG 3.49Å; E464-R466 IonicContact OE1-CZ 2.79Å; E464-R466 IonicContact OE1-NE 3.41Å; E464-R466 PolarHBondContact OE1-NE 2.89Å; E464-R466 IonicContact OE1-NH2 3.48Å; E464-R466 PolarHBondContact OE1-NH2 3.24Å; E464-R466 IonicContact OE2-CZ 2.69Å; E464-R466 IonicContact OE2-NE 2.71Å; E464-R466 PolarHBondContact OE2-NE 3.08Å; E464-R466 IonicContact OE2-NH2 3.4Å; E464-R466 PolarHBondContact OE2-NH2 2.87Å; R466-V468 PolarHBondContact O-N 3.44Å; R466-V468 VanDerWaalsContact O-N 3.16Å; R466-G528 CarbonylContact O-C 3.56Å; R466-G528 WeakPolarHBondContact O-CA 3.23Å; R466-S529 PolarHBondContact N-O 3.46Å; R466-S529 PolarHBondContact O-N 2.96Å; R466-L531 HydrophobicContact CB-CD1 4.33Å; R466-L531 HydrophobicContact CG-CD1 3.63Å
467	D	95.2	Very high	86.6	Confident	87 Å²	87	60.2 Å²	60.2	47%	0.465	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	46.8	43.9	177.2	-167.8	42.1	0	0	0	113.2	K469 G491 S493 G528	D467-K469 PolarHBondContact O-N 2.86Å; D467-G491 WeakPolarHBondContact OD1-CA 3.41Å; D467-S493 WeakPolarHBondContact CA-OG 3.36Å; D467-S493 PolarHBondContact N-OG 3.17Å; D467-G528 VanDerWaalsContact O-CA 3.29Å; D467-G528 WeakPolarHBondContact O-CA 3.17Å
468	V	95.9	Very high	84.7	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	122.3	-171.3	167.7	0	0	0	0	110.5	F465 R466 F470 Y489 G491 L492 L518 V525 S529 V530	F465-V468 HydrophobicContact CB-CG2 3.99Å; F465-V468 HydrophobicContact CD1-CB 3.96Å; F465-V468 HydrophobicContact CD1-CG1 4.15Å; F465-V468 HydrophobicContact CD1-CG2 3.59Å; F465-V468 HydrophobicContact CE1-CG1 4.47Å; F465-V468 HydrophobicContact CE1-CG2 4.42Å; F465-V468 HydrophobicContact CG-CG2 4.12Å; R466-V468 PolarHBondContact O-N 3.44Å; R466-V468 VanDerWaalsContact O-N 3.16Å; V468-F470 HydrophobicContact CG1-CB 4.47Å; V468-Y489 HydrophobicContact CG1-CD2 4.32Å; V468-Y489 WeakPolarHBondContact O-CB 3.5Å; V468-G491 PolarHBondContact O-N 3.13Å; V468-L492 HydrophobicContact CB-CB 4.28Å; V468-L492 WeakPolarHBondContact CB-O 3.49Å; V468-L492 PolarHBondContact N-O 2.92Å; V468-L492 PolarHBondContact O-N 3.12Å; V468-L518 HydrophobicContact CG1-CD1 4.1Å; V468-V525 HydrophobicContact CG1-CB 4.33Å; V468-V525 HydrophobicContact CG1-CG1 3.61Å; V468-V525 HydrophobicContact CG2-CG1 4.29Å; V468-S529 WeakPolarHBondContact CG2-O 3.49Å; V468-V530 HydrophobicContact CG2-CG2 3.88Å
469	K	93.8	Very high	82.9	Confident	73 Å²	73	62 Å²	62	32%	0.317	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	125.3	171	-53.5	-167.9	177	-143.4	0	109.5	D467 F487 Y489 D490 S526 G527	D467-K469 PolarHBondContact O-N 2.86Å; K469-F487 HydrophobicContact CB-CD1 4.44Å; K469-F487 HydrophobicContact CB-CE1 4.2Å; K469-Y489 CarbonylContact C-O 3.6Å; K469-Y489 VanDerWaalsContact CA-O 3.28Å; K469-Y489 WeakPolarHBondContact CA-O 3.36Å; K469-D490 WeakPolarHBondContact CD-OD1 3.31Å; K469-D490 WeakPolarHBondContact CE-OD1 3.42Å; K469-D490 IonicContact NZ-OD1 3.4Å; K469-D490 PolarHBondContact NZ-OD1 3.01Å; K469-S526 WeakPolarHBondContact O-CA 3.25Å; K469-S526 WeakPolarHBondContact O-CB 3.32Å; K469-S526 PolarHBondContact O-N 2.86Å; K469-G527 PolarHBondContact N-O 3.47Å; K469-G527 PolarHBondContact O-N 3.02Å; K469-G527 VanDerWaalsContact O-N 3.16Å
470	F	93.3	Very high	81.1	Confident	5 Å²	5	61.9 Å²	61.9	2%	0.022	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	138.4	-176.5	-178	-101	0	0	0	112.7	V468 Y472 L488 Y489 T514 L518 F523	V468-F470 HydrophobicContact CG1-CB 4.47Å; F470-Y472 HydrophobicContact CE1-CD1 4.02Å; F470-Y472 AromaticContact CE1-CD2 4Å; F470-Y472 HydrophobicContact CE1-CD2 4Å; F470-Y472 AromaticContact CE1-CE1 3.82Å; F470-Y472 HydrophobicContact CE1-CE1 3.82Å; F470-Y472 AromaticContact CE1-CE2 3.83Å; F470-Y472 HydrophobicContact CE1-CE2 3.83Å; F470-Y472 HydrophobicContact CE1-CG 4.1Å; F470-Y472 AromaticContact CE1-CZ 3.72Å; F470-Y472 AromaticContact CZ-CD1 3.88Å; F470-Y472 HydrophobicContact CZ-CD1 3.88Å; F470-Y472 AromaticContact CZ-CE1 3.74Å; F470-Y472 HydrophobicContact CZ-CE1 3.74Å; F470-Y472 HydrophobicContact CZ-CG 4.34Å; F470-L488 HydrophobicContact CD1-CD2 4.36Å; F470-L488 PolarHBondContact O-N 2.93Å; F470-Y489 HydrophobicContact CB-CD2 3.96Å; F470-Y489 PolarHBondContact N-O 3.41Å; F470-Y489 PolarHBondContact O-N 2.95Å; F470-T514 HydrophobicContact CD1-CG2 3.54Å; F470-T514 HydrophobicContact CE1-CG2 3.37Å; F470-T514 HydrophobicContact CG-CG2 4.5Å; F470-T514 HydrophobicContact CZ-CG2 4.22Å; F470-L518 HydrophobicContact CB-CD1 4.27Å; F470-L518 HydrophobicContact CD2-CD2 3.73Å; F470-L518 HydrophobicContact CE2-CD2 3.88Å; F470-L518 HydrophobicContact CG-CD1 4.17Å; F470-L518 HydrophobicContact CG-CD2 4.2Å; F470-L518 HydrophobicContact CZ-CD2 4.46Å; F470-F523 HydrophobicContact CE2-CB 3.61Å; F470-F523 HydrophobicContact CE2-CG 4.18Å; F470-F523 HydrophobicContact CZ-CB 3.89Å; F470-F523 HydrophobicContact CZ-CD1 4.38Å; F470-F523 HydrophobicContact CZ-CD2 4.37Å; F470-F523 AromaticContact CZ-CG 3.96Å; F470-F523 HydrophobicContact CZ-CG 3.96Å
471	T	89	Confident	79.1	Confident	3 Å²	3	64.2 Å²	64.2	2%	0.018	33%	0.325	C	S	.	.			trans	-138.1	148.8	167.8	-177.6	0	0	0	0	109.8	Y473 P484 G485 K486 F487	T471-Y473 HydrophobicContact CG2-CE2 4.42Å; T471-P484 HydrophobicContact CG2-CB 3.74Å; T471-G485 VanDerWaalsContact OG1-C 3.25Å; T471-G485 WeakPolarHBondContact OG1-CA 3.49Å; T471-G485 PolarHBondContact OG1-N 2.97Å; T471-G485 PolarHBondContact OG1-O 3.09Å; T471-K486 PolarHBondContact OG1-O 3.13Å; T471-F487 HydrophobicContact CG2-CE1 4.46Å
472	Y	85.2	Confident	77.6	Confident	74 Å²	74	69.7 Å²	69.7	29%	0.29	35%	0.353	S	S	.	.			trans	-73.6	137.7	163.3	-71.5	-70.5	0	0	0	109.6	F470 G485 L488 T514 R517 F523	F470-Y472 HydrophobicContact CE1-CD1 4.02Å; F470-Y472 AromaticContact CE1-CD2 4Å; F470-Y472 HydrophobicContact CE1-CD2 4Å; F470-Y472 AromaticContact CE1-CE1 3.82Å; F470-Y472 HydrophobicContact CE1-CE1 3.82Å; F470-Y472 AromaticContact CE1-CE2 3.83Å; F470-Y472 HydrophobicContact CE1-CE2 3.83Å; F470-Y472 HydrophobicContact CE1-CG 4.1Å; F470-Y472 AromaticContact CE1-CZ 3.72Å; F470-Y472 AromaticContact CZ-CD1 3.88Å; F470-Y472 HydrophobicContact CZ-CD1 3.88Å; F470-Y472 AromaticContact CZ-CE1 3.74Å; F470-Y472 HydrophobicContact CZ-CE1 3.74Å; F470-Y472 HydrophobicContact CZ-CG 4.34Å; Y472-G485 PolarHBondContact O-N 3.39Å; Y472-G485 VanDerWaalsContact O-N 3.09Å; Y472-L488 HydrophobicContact CE2-CD2 4.14Å; Y472-T514 HydrophobicContact CE2-CG2 4.31Å; Y472-T514 WeakPolarHBondContact OH-CG2 3.44Å; Y472-T514 PolarHBondContact OH-OG1 3.2Å; Y472-T514 VanDerWaalsContact OH-OG1 3.11Å; Y472-R517 WeakPolarHBondContact OH-CD 3.49Å; Y472-R517 PolarHBondContact OH-NH1 2.92Å; Y472-F523 HydrophobicContact CD1-CE1 4.21Å; Y472-F523 HydrophobicContact CD1-CZ 4.32Å; Y472-F523 HydrophobicContact CE1-CD1 4.39Å; Y472-F523 HydrophobicContact CE1-CD2 4.17Å; Y472-F523 AromaticContact CE1-CE1 3.98Å; Y472-F523 HydrophobicContact CE1-CE1 3.98Å; Y472-F523 AromaticContact CE1-CE2 3.8Å; Y472-F523 HydrophobicContact CE1-CE2 3.8Å; Y472-F523 HydrophobicContact CE1-CG 4.48Å; Y472-F523 AromaticContact CE1-CZ 3.7Å; Y472-F523 HydrophobicContact CE1-CZ 3.7Å
473	Y	75.4	Confident	75.9	Confident	120 Å²	120	73.6 Å²	73.6	47%	0.471	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	123.2	169.1	-70	-91.6	0	0	0	108.1	T471 P484	T471-Y473 HydrophobicContact CG2-CE2 4.42Å; Y473-P484 HydrophobicContact CD1-CB 4.23Å; Y473-P484 HydrophobicContact CE1-CB 3.82Å; Y473-P484 HydrophobicContact CE1-CG 4.42Å
474	S	67	Low	74.4	Confident	82 Å²	82	77.2 Å²	77.2	57%	0.573	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.4	149.5	173.4	-171	0	0	0	0	109.6	K483	S474-K483 PolarHBondContact N-O 3.38Å; S474-K483 PolarHBondContact O-N 3.38Å; S474-K483 VanDerWaalsContact O-N 3.08Å
475	K	62.1	Low	73.2	Confident	95 Å²	95	77.5 Å²	77.5	41%	0.413	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	116.3	171.8	-158	176.5	-175.3	-178.9	0	107.5	S480 L482	K475-S480 VanDerWaalsContact CE-O 3.29Å; K475-S480 WeakPolarHBondContact CE-O 3.44Å; K475-L482 HydrophobicContact CB-CD2 4.13Å
476	D	56.3	Low	72.3	Confident	65 Å²	65	86.9 Å²	86.9	35%	0.348	45%	0.445	S	S	.	.			trans	-63	128	168.5	-173.7	-26.4	0	0	0	107.8	K478 D479	D476-K478 PolarHBondContact O-N 3.1Å; D476-K478 PolarHBondContact OD1-N 2.87Å; D476-D479 HydrophobicContact CB-CB 4.2Å; D476-D479 PolarHBondContact O-N 2.76Å
477	P	54.8	Low	71.7	Confident	135 Å²	135	86.4 Å²	86.4	88%	0.877	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-24.9	176.3	-26.4	33.3	0	0	0	114.1
478	K	51.6	Low	71.4	Confident	198 Å²	198	84.1 Å²	84.1	86%	0.861	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-11.1	-178.2	-63.6	-178.6	179.7	178.5	0	114.4	D476	D476-K478 PolarHBondContact O-N 3.1Å; D476-K478 PolarHBondContact OD1-N 2.87Å
479	D	53.3	Low	71.2	Confident	50 Å²	50	84.1 Å²	84.1	27%	0.267	43%	0.433	S	S	.	.			trans	-129.5	140.7	-173.8	-158.6	-21.3	0	0	0	111.4	D476 L481 K483	D476-D479 HydrophobicContact CB-CB 4.2Å; D476-D479 PolarHBondContact O-N 2.76Å; D479-L481 VanDerWaalsContact C-N 3.26Å; D479-L481 PolarHBondContact O-N 3.39Å; D479-L481 PolarHBondContact OD1-N 3.42Å; D479-K483 WeakPolarHBondContact OD2-CE 3.48Å; D479-K483 IonicContact OD2-NZ 3.3Å; D479-K483 PolarHBondContact OD2-NZ 2.99Å
480	S	53.6	Low	71	Confident	90 Å²	90	84.5 Å²	84.5	63%	0.629	44%	0.439	S	S	*	.	S	Bend	trans	-77	-15.6	-179.1	64.6	0	0	0	0	112.9	K475	K475-S480 VanDerWaalsContact CE-O 3.29Å; K475-S480 WeakPolarHBondContact CE-O 3.44Å
481	L	53.9	Low	70.9	Confident	109 Å²	109	85 Å²	85	57%	0.571	45%	0.445	S	S	*	.	S	Bend	trans	-91.3	142.5	-178.7	-62.2	172.2	0	0	0	112.1	D479	D479-L481 VanDerWaalsContact C-N 3.26Å; D479-L481 PolarHBondContact O-N 3.39Å; D479-L481 PolarHBondContact OD1-N 3.42Å
482	L	62.4	Low	71.2	Confident	115 Å²	115	84.9 Å²	84.9	60%	0.602	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.2	125	169.7	-72.8	166.1	0	0	0	108.7	K475	K475-L482 HydrophobicContact CB-CD2 4.13Å
483	K	61.3	Low	71.6	Confident	96 Å²	96	84 Å²	84	42%	0.417	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	139.9	174.6	-71.4	-179.3	-177.7	164.1	0	109.9	S474 D479 G485	S474-K483 PolarHBondContact N-O 3.38Å; S474-K483 PolarHBondContact O-N 3.38Å; S474-K483 VanDerWaalsContact O-N 3.08Å; D479-K483 WeakPolarHBondContact OD2-CE 3.48Å; D479-K483 IonicContact OD2-NZ 3.3Å; D479-K483 PolarHBondContact OD2-NZ 2.99Å; K483-G485 PolarHBondContact O-N 2.83Å
484	P	67	Low	72.6	Confident	78 Å²	78	78.6 Å²	78.6	51%	0.506	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	132.4	170.4	26.5	-31.5	0	0	0	109	T471 Y473	T471-P484 HydrophobicContact CG2-CB 3.74Å; Y473-P484 HydrophobicContact CD1-CB 4.23Å; Y473-P484 HydrophobicContact CE1-CB 3.82Å; Y473-P484 HydrophobicContact CE1-CG 4.42Å
485	G	71.1	Confident	74	Confident	39 Å²	39	78.4 Å²	78.4	40%	0.402	42%	0.417	S	S	.	.			trans	-72.8	-169.5	167.7	0	0	0	0	0	112.6	T471 Y472 K483 F487	T471-G485 VanDerWaalsContact OG1-C 3.25Å; T471-G485 WeakPolarHBondContact OG1-CA 3.49Å; T471-G485 PolarHBondContact OG1-N 2.97Å; T471-G485 PolarHBondContact OG1-O 3.09Å; Y472-G485 PolarHBondContact O-N 3.39Å; Y472-G485 VanDerWaalsContact O-N 3.09Å; K483-G485 PolarHBondContact O-N 2.83Å; G485-F487 PolarHBondContact O-N 3.49Å
486	K	80.4	Confident	75.7	Confident	200 Å²	200	74 Å²	74	87%	0.87	40%	0.398	S	S	*	.	S	Bend	trans	-61.2	133.2	167.2	-176.4	-179.3	177.9	-178.3	0	109	T471 L488	T471-K486 PolarHBondContact OG1-O 3.13Å; K486-L488 PolarHBondContact O-N 3.04Å
487	F	83.4	Confident	77.6	Confident	100 Å²	100	74.9 Å²	74.9	44%	0.439	40%	0.4	S	S	.	.			trans	-53.7	124.1	172.1	-78.7	-80.2	0	0	0	110.1	K469 T471 G485 D490	K469-F487 HydrophobicContact CB-CD1 4.44Å; K469-F487 HydrophobicContact CB-CE1 4.2Å; T471-F487 HydrophobicContact CG2-CE1 4.46Å; G485-F487 PolarHBondContact O-N 3.49Å; F487-D490 HydrophobicContact CB-CB 4.42Å
488	L	88.8	Confident	79.6	Confident	40 Å²	40	70.8 Å²	70.8	21%	0.209	37%	0.373	C	S	.	.	S	Bend	trans	-79.6	-39.4	171.6	-176.9	65.2	0	0	0	109.9	F470 Y472 K486 T514 G683	F470-L488 HydrophobicContact CD1-CD2 4.36Å; F470-L488 PolarHBondContact O-N 2.93Å; Y472-L488 HydrophobicContact CE2-CD2 4.14Å; K486-L488 PolarHBondContact O-N 3.04Å; L488-T514 HydrophobicContact CD2-CG2 3.89Å; L488-T514 VanDerWaalsContact CD2-OG1 3.24Å; L488-T514 WeakPolarHBondContact CD2-OG1 3.36Å; L488-G683 VanDerWaalsContact O-CA 3.23Å; L488-G683 WeakPolarHBondContact O-CA 3.44Å
489	Y	91.7	Very high	81.6	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	135	172.6	-54.4	-42.1	0	0	0	109.1	V468 K469 F470 L492 G511 T514 I515 L518 G683	V468-Y489 HydrophobicContact CG1-CD2 4.32Å; V468-Y489 WeakPolarHBondContact O-CB 3.5Å; K469-Y489 CarbonylContact C-O 3.6Å; K469-Y489 VanDerWaalsContact CA-O 3.28Å; K469-Y489 WeakPolarHBondContact CA-O 3.36Å; F470-Y489 HydrophobicContact CB-CD2 3.96Å; F470-Y489 PolarHBondContact N-O 3.41Å; F470-Y489 PolarHBondContact O-N 2.95Å; Y489-L492 HydrophobicContact CD1-CB 4.3Å; Y489-L492 HydrophobicContact CD1-CD2 3.87Å; Y489-L492 HydrophobicContact CD2-CD2 3.91Å; Y489-L492 HydrophobicContact CE1-CD2 3.88Å; Y489-L492 HydrophobicContact CE2-CD2 3.9Å; Y489-L492 HydrophobicContact CG-CB 4.08Å; Y489-L492 HydrophobicContact CG-CD2 3.9Å; Y489-G511 PolarHBondContact OH-O 3.46Å; Y489-T514 HydrophobicContact CE2-CG2 3.99Å; Y489-I515 HydrophobicContact CE2-CG1 4.35Å; Y489-I515 VanDerWaalsContact OH-CG1 3.28Å; Y489-I515 WeakPolarHBondContact OH-CG1 3.48Å; Y489-L518 HydrophobicContact CD2-CD1 4.08Å; Y489-L518 HydrophobicContact CE2-CD1 3.98Å; Y489-G683 WeakPolarHBondContact CD1-O 3.41Å
490	D	89.1	Confident	83.5	Confident	80 Å²	80	61.9 Å²	61.9	43%	0.428	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	62.2	173.4	-171.4	17.2	0	0	0	110	K469 F487 H684	K469-D490 WeakPolarHBondContact CD-OD1 3.31Å; K469-D490 WeakPolarHBondContact CE-OD1 3.42Å; K469-D490 IonicContact NZ-OD1 3.4Å; K469-D490 PolarHBondContact NZ-OD1 3.01Å; F487-D490 HydrophobicContact CB-CB 4.42Å; D490-H684 PolarHBondContact O-CE1 3.18Å
491	G	91.4	Very high	85.4	Confident	15 Å²	15	59.7 Å²	59.7	16%	0.155	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	112	34.1	-179.7	0	0	0	0	0	114.3	D467 V468 S493	D467-G491 WeakPolarHBondContact OD1-CA 3.41Å; V468-G491 PolarHBondContact O-N 3.13Å; G491-S493 PolarHBondContact O-N 3.37Å
492	L	94.8	Very high	87.4	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	121.8	176.2	177.6	65.8	0	0	0	110.2	F465 V468 Y489 F494 I515 L680 V685	F465-L492 HydrophobicContact CD1-CD2 4Å; F465-L492 HydrophobicContact CD1-CG 4.42Å; F465-L492 HydrophobicContact CE1-CD2 4.41Å; V468-L492 HydrophobicContact CB-CB 4.28Å; V468-L492 WeakPolarHBondContact CB-O 3.49Å; V468-L492 PolarHBondContact N-O 2.92Å; V468-L492 PolarHBondContact O-N 3.12Å; Y489-L492 HydrophobicContact CD1-CB 4.3Å; Y489-L492 HydrophobicContact CD1-CD2 3.87Å; Y489-L492 HydrophobicContact CD2-CD2 3.91Å; Y489-L492 HydrophobicContact CE1-CD2 3.88Å; Y489-L492 HydrophobicContact CE2-CD2 3.9Å; Y489-L492 HydrophobicContact CG-CB 4.08Å; Y489-L492 HydrophobicContact CG-CD2 3.9Å; L492-F494 HydrophobicContact CD1-CD1 4.18Å; L492-F494 HydrophobicContact CD1-CE1 4.38Å; L492-F494 HydrophobicContact CD2-CE1 4.03Å; L492-F494 HydrophobicContact CG-CD1 4.16Å; L492-F494 HydrophobicContact CG-CE1 4.11Å; L492-I515 HydrophobicContact CD2-CD1 4.17Å; L492-I515 HydrophobicContact CD2-CG1 4.37Å; L492-L680 HydrophobicContact CD1-CD2 3.67Å; L492-V685 HydrophobicContact CD1-CG2 3.82Å
493	S	95.3	Very high	88.9	Confident	55 Å²	55	49 Å²	49	39%	0.385	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	126.8	-179.8	-56.4	0	0	0	0	112.9	F465 D467 G491	F465-S493 CarbonylContact O-C 2.89Å; F465-S493 WeakPolarHBondContact O-CA 3.4Å; D467-S493 WeakPolarHBondContact CA-OG 3.36Å; D467-S493 PolarHBondContact N-OG 3.17Å; G491-S493 PolarHBondContact O-N 3.37Å
494	F	96.3	Very high	90.4	Very high	8 Å²	8	44.5 Å²	44.5	4%	0.035	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.6	162.5	172	65	-88.4	0	0	0	110.5	E464 F465 L492 V496 I504 I515 L678 V685	E464-F494 WeakPolarHBondContact CA-O 3.2Å; F465-F494 HydrophobicContact CB-CD1 3.9Å; F465-F494 HydrophobicContact CB-CE1 3.79Å; F465-F494 HydrophobicContact CB-CG 4.49Å; F465-F494 HydrophobicContact CB-CZ 4.31Å; F465-F494 AromaticContact CD1-CE1 3.99Å; F465-F494 HydrophobicContact CD1-CE1 3.99Å; F465-F494 HydrophobicContact CD1-CZ 4.38Å; F465-F494 HydrophobicContact CD2-CD1 4.42Å; F465-F494 AromaticContact CD2-CE1 3.62Å; F465-F494 HydrophobicContact CD2-CE1 3.62Å; F465-F494 AromaticContact CD2-CE2 3.88Å; F465-F494 HydrophobicContact CD2-CE2 3.88Å; F465-F494 AromaticContact CD2-CZ 3.29Å; F465-F494 HydrophobicContact CD2-CZ 3.29Å; F465-F494 HydrophobicContact CE2-CE1 4.21Å; F465-F494 HydrophobicContact CE2-CE2 4.35Å; F465-F494 AromaticContact CE2-CZ 3.63Å; F465-F494 HydrophobicContact CE2-CZ 3.63Å; F465-F494 HydrophobicContact CG-CD1 4.17Å; F465-F494 AromaticContact CG-CE1 3.52Å; F465-F494 HydrophobicContact CG-CE1 3.52Å; F465-F494 AromaticContact CG-CZ 3.75Å; F465-F494 HydrophobicContact CG-CZ 3.75Å; F465-F494 HydrophobicContact CZ-CZ 4.34Å; F465-F494 PolarHBondContact N-O 3.15Å; F465-F494 PolarHBondContact O-N 2.98Å; L492-F494 HydrophobicContact CD1-CD1 4.18Å; L492-F494 HydrophobicContact CD1-CE1 4.38Å; L492-F494 HydrophobicContact CD2-CE1 4.03Å; L492-F494 HydrophobicContact CG-CD1 4.16Å; L492-F494 HydrophobicContact CG-CE1 4.11Å; F494-V496 HydrophobicContact CD2-CG2 4.19Å; F494-V496 HydrophobicContact CE2-CG2 4.08Å; F494-I504 HydrophobicContact CE1-CD1 4.46Å; F494-I504 HydrophobicContact CE2-CD1 4.17Å; F494-I504 HydrophobicContact CZ-CD1 3.89Å; F494-I515 HydrophobicContact CE1-CD1 4.19Å; F494-I515 HydrophobicContact CZ-CD1 4.3Å; F494-I515 HydrophobicContact CZ-CG2 3.94Å; F494-L678 HydrophobicContact CB-CD1 3.64Å; F494-L678 HydrophobicContact CD1-CD1 4.32Å; F494-L678 HydrophobicContact CD2-CD1 3.52Å; F494-L678 HydrophobicContact CE2-CD1 4.24Å; F494-L678 HydrophobicContact CG-CD1 3.57Å; F494-V685 HydrophobicContact CB-CG2 4.32Å; F494-V685 HydrophobicContact CD1-CG2 4.27Å
495	K	96.4	Very high	91.6	Very high	78 Å²	78	40.8 Å²	40.8	34%	0.339	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	137.2	178	-170.8	176.9	176.7	-146.2	0	109.7	V463 E464 E497	V463-K495 CarbonylContact O-C 3.55Å; V463-K495 WeakPolarHBondContact O-CA 3.2Å; E464-K495 HydrophobicContact CB-CB 4.5Å; E464-K495 HydrophobicContact CB-CG 4.11Å; E464-K495 HydrophobicContact CG-CB 4.02Å; E464-K495 HydrophobicContact CG-CD 4.33Å; E464-K495 HydrophobicContact CG-CG 3.98Å; K495-E497 VanDerWaalsContact CD-OE1 3.28Å; K495-E497 WeakPolarHBondContact CD-OE1 3.26Å; K495-E497 WeakPolarHBondContact CE-OE1 2.85Å; K495-E497 WeakPolarHBondContact CE-OE2 3.46Å; K495-E497 IonicContact NZ-OE1 3.56Å; K495-E497 PolarHBondContact NZ-OE1 3.15Å; K495-E497 IonicContact NZ-OE2 2.71Å; K495-E497 PolarHBondContact NZ-OE2 3.43Å
496	V	96.8	Very high	92.4	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.006	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	116.7	171.6	-175	0	0	0	0	106.5	S462 V463 F494 Q500 V502 T660 L662	S462-V496 VanDerWaalsContact CA-O 3.24Å; S462-V496 WeakPolarHBondContact CA-O 3.09Å; S462-V496 WeakPolarHBondContact CB-O 3.37Å; V463-V496 HydrophobicContact CB-CB 4.21Å; V463-V496 HydrophobicContact CB-CG2 4.4Å; V463-V496 PolarHBondContact N-O 3.27Å; V463-V496 PolarHBondContact O-N 3.38Å; F494-V496 HydrophobicContact CD2-CG2 4.19Å; F494-V496 HydrophobicContact CE2-CG2 4.08Å; V496-Q500 HydrophobicContact CG1-CB 4.31Å; V496-V502 HydrophobicContact CB-CG2 4.2Å; V496-V502 HydrophobicContact CG1-CB 4.12Å; V496-V502 HydrophobicContact CG1-CG2 3.7Å; V496-V502 HydrophobicContact CG2-CB 3.97Å; V496-V502 HydrophobicContact CG2-CG1 4.26Å; V496-V502 HydrophobicContact CG2-CG2 3.99Å; V496-T660 HydrophobicContact CB-CG2 4.36Å; V496-T660 HydrophobicContact CG1-CG2 3.41Å; V496-T660 VanDerWaalsContact CG1-CG2 3.41Å; V496-L662 HydrophobicContact CG2-CD1 4.14Å
497	E	96.6	Very high	92.4	Very high	84 Å²	84	34.4 Å²	34.4	39%	0.393	19%	0.186	S	C	.	.			trans	-75.9	156.5	179.3	-63.5	-61.5	165.8	0	0	111.7	K495 G499 Q500	K495-E497 VanDerWaalsContact CD-OE1 3.28Å; K495-E497 WeakPolarHBondContact CD-OE1 3.26Å; K495-E497 WeakPolarHBondContact CE-OE1 2.85Å; K495-E497 WeakPolarHBondContact CE-OE2 3.46Å; K495-E497 IonicContact NZ-OE1 3.56Å; K495-E497 PolarHBondContact NZ-OE1 3.15Å; K495-E497 IonicContact NZ-OE2 2.71Å; K495-E497 PolarHBondContact NZ-OE2 3.43Å; E497-G499 PolarHBondContact O-N 3.26Å; E497-Q500 HydrophobicContact CB-CB 4.31Å; E497-Q500 WeakPolarHBondContact O-CB 3.33Å; E497-Q500 PolarHBondContact O-N 2.93Å
498	P	96	Very high	92.2	Very high	49 Å²	49	34.3 Å²	34.3	32%	0.318	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	128.5	178.2	-23.9	34.7	0	0	0	112.3	R458 S459 Q500 T660	R458-P498 WeakPolarHBondContact O-CB 3.34Å; S459-P498 WeakPolarHBondContact O-CB 3.47Å; S459-P498 WeakPolarHBondContact O-CG 3.15Å; P498-Q500 PolarHBondContact O-N 3.15Å; P498-T660 WeakPolarHBondContact CA-OG1 3.41Å
499	G	93.3	Very high	91.6	Very high	29 Å²	29	35.8 Å²	35.8	30%	0.299	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.8	-6.5	-177.9	0	0	0	0	0	115.2	E497 T660	E497-G499 PolarHBondContact O-N 3.26Å; G499-T660 PolarHBondContact N-OG1 3Å
500	Q	94.1	Very high	91.1	Very high	32 Å²	32	36.4 Å²	36.4	15%	0.15	23%	0.226	C	C	.	.			trans	-75.2	142.6	-179.5	-163.2	-173.2	-0.6	0	0	111.3	V496 E497 P498 V502 S661 D675 E676	V496-Q500 HydrophobicContact CG1-CB 4.31Å; E497-Q500 HydrophobicContact CB-CB 4.31Å; E497-Q500 WeakPolarHBondContact O-CB 3.33Å; E497-Q500 PolarHBondContact O-N 2.93Å; P498-Q500 PolarHBondContact O-N 3.15Å; Q500-V502 HydrophobicContact CB-CG2 4.4Å; Q500-V502 VanDerWaalsContact CD-CG2 3.42Å; Q500-V502 HydrophobicContact CG-CG2 3.77Å; Q500-S661 PolarHBondContact O-N 2.91Å; Q500-D675 HydrophobicContact CG-CB 3.87Å; Q500-E676 PolarHBondContact NE2-OE2 3.02Å
501	R	93.1	Very high	90.9	Very high	45 Å²	45	33.1 Å²	33.1	17%	0.17	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	99.5	171.8	-60.1	175.4	64.9	-160.4	-5	109.5	S661 D673 D675 E676	R501-S661 WeakPolarHBondContact CA-O 3.3Å; R501-D673 IonicContact CZ-OD2 2.84Å; R501-D673 IonicContact NH1-OD2 3.47Å; R501-D673 PolarHBondContact NH1-OD2 3.32Å; R501-D673 IonicContact NH2-OD1 2.81Å; R501-D673 IonicContact NH2-OD2 2.73Å; R501-D673 PolarHBondContact NH2-OD2 3.32Å; R501-D675 WeakPolarHBondContact CB-OD2 3.35Å; R501-D675 PolarHBondContact N-OD2 2.95Å; R501-D675 PolarHBondContact O-N 2.78Å; R501-E676 PolarHBondContact O-N 2.79Å
502	V	95.2	Very high	90.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	123.9	-179.1	177.2	0	0	0	0	110.3	V496 Q500 S661 L662 I663 E676 L678	V496-V502 HydrophobicContact CB-CG2 4.2Å; V496-V502 HydrophobicContact CG1-CB 4.12Å; V496-V502 HydrophobicContact CG1-CG2 3.7Å; V496-V502 HydrophobicContact CG2-CB 3.97Å; V496-V502 HydrophobicContact CG2-CG1 4.26Å; V496-V502 HydrophobicContact CG2-CG2 3.99Å; Q500-V502 HydrophobicContact CB-CG2 4.4Å; Q500-V502 VanDerWaalsContact CD-CG2 3.42Å; Q500-V502 HydrophobicContact CG-CG2 3.77Å; V502-S661 PolarHBondContact N-O 3.06Å; V502-L662 HydrophobicContact CB-CD1 4.49Å; V502-L662 HydrophobicContact CG1-CD1 4.48Å; V502-L662 WeakPolarHBondContact O-CA 3.28Å; V502-I663 PolarHBondContact O-N 3.39Å; V502-E676 CarbonylContact C-O 3.56Å; V502-E676 WeakPolarHBondContact CA-O 3.37Å; V502-E676 HydrophobicContact CG2-CB 4.29Å; V502-L678 HydrophobicContact CG1-CD1 3.67Å; V502-L678 HydrophobicContact CG1-CG 3.74Å
503	A	94	Very high	90.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	142	174.2	0	0	0	0	0	111.6	I663 I671 A674 E676 I677 L678	A503-I663 CarbonylContact C-O 3.58Å; A503-I663 VanDerWaalsContact CA-O 3.22Å; A503-I663 WeakPolarHBondContact CA-O 3.38Å; A503-I663 HydrophobicContact CB-CB 4.4Å; A503-I671 HydrophobicContact CB-CB 3.63Å; A503-I671 HydrophobicContact CB-CD1 3.73Å; A503-I671 HydrophobicContact CB-CG1 4.31Å; A503-I671 HydrophobicContact CB-CG2 3.61Å; A503-A674 HydrophobicContact CB-CB 3.75Å; A503-E676 PolarHBondContact N-O 3.09Å; A503-I677 HydrophobicContact CB-CG1 4.25Å; A503-I677 CarbonylContact O-C 3.31Å; A503-I677 WeakPolarHBondContact O-CA 3.4Å; A503-L678 PolarHBondContact O-N 3.11Å
504	I	93.8	Very high	90.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	122.6	175.3	-61.1	-169.9	0	0	0	108.9	F494 I515 L662 I663 I664 A665 L678 L680	F494-I504 HydrophobicContact CE1-CD1 4.46Å; F494-I504 HydrophobicContact CE2-CD1 4.17Å; F494-I504 HydrophobicContact CZ-CD1 3.89Å; I504-I515 HydrophobicContact CD1-CD1 3.53Å; I504-I515 HydrophobicContact CD1-CG2 4.17Å; I504-I515 HydrophobicContact CG2-CD1 4.13Å; I504-L662 HydrophobicContact CD1-CD1 3.61Å; I504-L662 HydrophobicContact CD1-CD2 4.47Å; I504-L662 HydrophobicContact CD1-CG 4.32Å; I504-L662 HydrophobicContact CG1-CD1 3.88Å; I504-I663 PolarHBondContact N-O 2.95Å; I504-I664 HydrophobicContact CB-CG1 4.29Å; I504-A665 PolarHBondContact O-N 2.88Å; I504-L678 WeakPolarHBondContact CA-O 3.37Å; I504-L678 HydrophobicContact CG1-CB 4.38Å; I504-L678 HydrophobicContact CG1-CD1 4.41Å; I504-L680 HydrophobicContact CG2-CD1 3.31Å; I504-L680 HydrophobicContact CG2-CG 3.75Å
505	V	92	Very high	90.1	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.006	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	162.4	-177.7	-61.2	0	0	0	0	111.3	L668 I671 I677 L678 V679 L680 Y702	V505-L668 HydrophobicContact CB-CD2 3.81Å; V505-L668 HydrophobicContact CG1-CD2 3.54Å; V505-L668 HydrophobicContact CG2-CD2 4.12Å; V505-I671 HydrophobicContact CG1-CD1 3.35Å; V505-I677 HydrophobicContact CG1-CG2 4.5Å; V505-I677 HydrophobicContact CG2-CG2 3.77Å; V505-L678 PolarHBondContact N-O 3.36Å; V505-V679 HydrophobicContact CG2-CB 4.35Å; V505-V679 HydrophobicContact CG2-CG1 4.4Å; V505-V679 HydrophobicContact CG2-CG2 3.95Å; V505-V679 CarbonylContact O-C 3.59Å; V505-L680 PolarHBondContact O-N 3.12Å; V505-Y702 HydrophobicContact CG2-CD2 3.98Å; V505-Y702 HydrophobicContact CG2-CE2 4.2Å
506	G	87.5	Confident	89.9	Confident	14 Å²	14	27.9 Å²	27.9	14%	0.144	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.6	173.7	179.4	0	0	0	0	0	111	K512 L680	G506-K512 PolarHBondContact O-NZ 3.43Å; G506-L680 WeakPolarHBondContact CA-O 3.37Å
507	E	81.9	Confident	89.8	Confident	90 Å²	90	31.7 Å²	31.7	42%	0.421	20%	0.196	S	C	.	.			trans	-59.6	161.7	179.9	-61.7	-178.7	139.8	0	0	112.6	G509 T510 K512 Y701	E507-G509 PolarHBondContact O-N 3.47Å; E507-T510 HydrophobicContact CB-CG2 3.95Å; E507-T510 WeakPolarHBondContact O-CG2 3.33Å; E507-T510 PolarHBondContact O-N 3.37Å; E507-T510 PolarHBondContact O-OG1 2.89Å; E507-K512 PolarHBondContact O-NZ 3.49Å; E507-Y701 HydrophobicContact CG-CE1 4.26Å; E507-Y701 WeakPolarHBondContact CG-OH 3.45Å; E507-Y701 PolarHBondContact OE1-OH 3.21Å
508	S	78.1	Confident	89.7	Confident	98 Å²	98	27.8 Å²	27.8	69%	0.685	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	133.7	168.1	-64.7	0	0	0	0	110
509	G	76.5	Confident	89.7	Confident	72 Å²	72	25.5 Å²	25.5	74%	0.742	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.3	-1.9	179.9	0	0	0	0	0	116.2	E507 G511	E507-G509 PolarHBondContact O-N 3.47Å; G509-G511 PolarHBondContact O-N 3.44Å
510	T	81.4	Confident	89.8	Confident	12 Å²	12	26 Å²	26	7%	0.074	16%	0.156	C	C	.	.	S	Bend	trans	-71.4	-5.2	174.1	56.2	0	0	0	0	114.3	E507	E507-T510 HydrophobicContact CB-CG2 3.95Å; E507-T510 WeakPolarHBondContact O-CG2 3.33Å; E507-T510 PolarHBondContact O-N 3.37Å; E507-T510 PolarHBondContact O-OG1 2.89Å
511	G	83.7	Confident	89.8	Confident	11 Å²	11	24.8 Å²	24.8	11%	0.113	15%	0.15	C	C	.	.			trans	100.5	2.8	173.4	0	0	0	0	0	115.9	Y489 G509 S513 T514	Y489-G511 PolarHBondContact OH-O 3.46Å; G509-G511 PolarHBondContact O-N 3.44Å; G511-S513 PolarHBondContact O-N 2.88Å; G511-S513 VanDerWaalsContact O-N 3.1Å; G511-T514 VanDerWaalsContact O-CA 3.28Å; G511-T514 WeakPolarHBondContact O-CA 3.13Å; G511-T514 WeakPolarHBondContact O-CB 3.44Å; G511-T514 PolarHBondContact O-N 2.97Å; G511-T514 PolarHBondContact O-OG1 3.24Å; G511-T514 VanDerWaalsContact O-OG1 3.05Å
512	K	88.5	Confident	89.8	Confident	8 Å²	8	25.7 Å²	25.7	4%	0.035	16%	0.156	C	C	.	.	H	α-helix	trans	-37.6	-56.2	-175.1	-53.9	-175	-68.4	-85.6	0	115.2	G506 E507 T514 I515 I664 L680	G506-K512 PolarHBondContact O-NZ 3.43Å; E507-K512 PolarHBondContact O-NZ 3.49Å; K512-T514 PolarHBondContact O-N 3.31Å; K512-T514 VanDerWaalsContact O-N 3.13Å; K512-I515 VanDerWaalsContact O-CB 3.26Å; K512-I515 WeakPolarHBondContact O-CB 3.45Å; K512-I515 WeakPolarHBondContact O-CG1 3.18Å; K512-I515 PolarHBondContact O-N 2.94Å; K512-I664 HydrophobicContact CB-CG2 3.6Å; K512-I664 HydrophobicContact CD-CG2 4.12Å; K512-I664 HydrophobicContact CG-CG2 4.45Å; K512-I664 WeakPolarHBondContact O-CD1 3.42Å; K512-L680 HydrophobicContact CG-CD1 4.32Å
513	S	87.3	Confident	89.7	Confident	25 Å²	25	26.7 Å²	26.7	18%	0.175	16%	0.16	C	C	.	.	H	α-helix	trans	-63.3	-20.6	179.1	-47.1	0	0	0	0	114.3	G511 I515 V516 R517 D634	G511-S513 PolarHBondContact O-N 2.88Å; G511-S513 VanDerWaalsContact O-N 3.1Å; S513-I515 VanDerWaalsContact C-N 3.26Å; S513-I515 PolarHBondContact O-N 3.13Å; S513-V516 PolarHBondContact O-N 3.37Å; S513-R517 WeakPolarHBondContact O-CG 3.43Å; S513-R517 PolarHBondContact O-N 3.41Å; S513-D634 PolarHBondContact OG-OD1 3.11Å
514	T	91.4	Very high	89.6	Confident	7 Å²	7	29.2 Å²	29.2	4%	0.043	17%	0.173	C	C	.	.	H	α-helix	trans	-65	-30.1	171.5	-49	0	0	0	0	111.9	F470 Y472 L488 Y489 G511 K512 V516 R517 L518	F470-T514 HydrophobicContact CD1-CG2 3.54Å; F470-T514 HydrophobicContact CE1-CG2 3.37Å; F470-T514 HydrophobicContact CG-CG2 4.5Å; F470-T514 HydrophobicContact CZ-CG2 4.22Å; Y472-T514 HydrophobicContact CE2-CG2 4.31Å; Y472-T514 WeakPolarHBondContact OH-CG2 3.44Å; Y472-T514 PolarHBondContact OH-OG1 3.2Å; Y472-T514 VanDerWaalsContact OH-OG1 3.11Å; L488-T514 HydrophobicContact CD2-CG2 3.89Å; L488-T514 VanDerWaalsContact CD2-OG1 3.24Å; L488-T514 WeakPolarHBondContact CD2-OG1 3.36Å; Y489-T514 HydrophobicContact CE2-CG2 3.99Å; G511-T514 VanDerWaalsContact O-CA 3.28Å; G511-T514 WeakPolarHBondContact O-CA 3.13Å; G511-T514 WeakPolarHBondContact O-CB 3.44Å; G511-T514 PolarHBondContact O-N 2.97Å; G511-T514 PolarHBondContact O-OG1 3.24Å; G511-T514 VanDerWaalsContact O-OG1 3.05Å; K512-T514 PolarHBondContact O-N 3.31Å; K512-T514 VanDerWaalsContact O-N 3.13Å; T514-V516 VanDerWaalsContact C-N 3.34Å; T514-V516 PolarHBondContact O-N 2.87Å; T514-R517 CarbonylContact O-C 3.57Å; T514-R517 PolarHBondContact O-N 3.12Å; T514-R517 VanDerWaalsContact O-N 3.14Å; T514-L518 HydrophobicContact CG2-CD1 4.13Å; T514-L518 HydrophobicContact CG2-CG 4.18Å; T514-L518 WeakPolarHBondContact O-CG 3.49Å; T514-L518 PolarHBondContact O-N 2.81Å
515	I	93.8	Very high	89.6	Confident	0 Å²	0	30 Å²	30	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.1	-47.6	175.9	-62.2	-174.9	0	0	0	109.8	F465 Y489 L492 F494 I504 K512 S513 R517 L518 V519 L662 L680	F465-I515 HydrophobicContact CE1-CG2 4.32Å; F465-I515 HydrophobicContact CE2-CG2 3.9Å; F465-I515 HydrophobicContact CZ-CB 4.36Å; F465-I515 HydrophobicContact CZ-CG2 3.6Å; Y489-I515 HydrophobicContact CE2-CG1 4.35Å; Y489-I515 VanDerWaalsContact OH-CG1 3.28Å; Y489-I515 WeakPolarHBondContact OH-CG1 3.48Å; L492-I515 HydrophobicContact CD2-CD1 4.17Å; L492-I515 HydrophobicContact CD2-CG1 4.37Å; F494-I515 HydrophobicContact CE1-CD1 4.19Å; F494-I515 HydrophobicContact CZ-CD1 4.3Å; F494-I515 HydrophobicContact CZ-CG2 3.94Å; I504-I515 HydrophobicContact CD1-CD1 3.53Å; I504-I515 HydrophobicContact CD1-CG2 4.17Å; I504-I515 HydrophobicContact CG2-CD1 4.13Å; K512-I515 VanDerWaalsContact O-CB 3.26Å; K512-I515 WeakPolarHBondContact O-CB 3.45Å; K512-I515 WeakPolarHBondContact O-CG1 3.18Å; K512-I515 PolarHBondContact O-N 2.94Å; S513-I515 VanDerWaalsContact C-N 3.26Å; S513-I515 PolarHBondContact O-N 3.13Å; I515-R517 VanDerWaalsContact C-N 3.28Å; I515-R517 PolarHBondContact O-N 3.18Å; I515-L518 PolarHBondContact O-N 3.06Å; I515-L518 VanDerWaalsContact O-N 3.13Å; I515-V519 HydrophobicContact CG2-CG2 4.42Å; I515-V519 WeakPolarHBondContact O-CG2 3.23Å; I515-V519 PolarHBondContact O-N 3.49Å; I515-L662 HydrophobicContact CG2-CD2 3.84Å; I515-L680 HydrophobicContact CD1-CD1 3.64Å
516	V	93.5	Very high	89.5	Confident	7 Å²	7	32.7 Å²	32.7	4%	0.042	20%	0.197	C	C	.	.	H	α-helix	trans	-56.7	-45.7	174.6	-170.6	0	0	0	0	110.8	S513 T514 L518 V519 Y520 V551 I632 D634 I664	S513-V516 PolarHBondContact O-N 3.37Å; T514-V516 VanDerWaalsContact C-N 3.34Å; T514-V516 PolarHBondContact O-N 2.87Å; V516-L518 VanDerWaalsContact C-N 3.26Å; V516-L518 PolarHBondContact O-N 3.32Å; V516-V519 PolarHBondContact O-N 2.88Å; V516-Y520 VanDerWaalsContact O-CB 3.24Å; V516-Y520 WeakPolarHBondContact O-CB 3.3Å; V516-Y520 PolarHBondContact O-N 3.28Å; V516-V551 HydrophobicContact CG1-CG1 3.95Å; V516-V551 HydrophobicContact CG1-CG2 4.34Å; V516-I632 HydrophobicContact CB-CG2 4.31Å; V516-I632 HydrophobicContact CG1-CD1 4.32Å; V516-I632 HydrophobicContact CG1-CG2 3.93Å; V516-I632 HydrophobicContact CG2-CG2 3.65Å; V516-D634 HydrophobicContact CG2-CB 4.04Å; V516-I664 HydrophobicContact CG2-CD1 3.17Å
517	R	93.4	Very high	89.7	Confident	81 Å²	81	33 Å²	33	31%	0.306	20%	0.2	S	C	.	.	H	α-helix	trans	-64.5	-29.9	-179.1	-65.7	165.1	174.9	178.9	2.6	112.7	Y472 S513 T514 I515 R521 F522 F523	Y472-R517 WeakPolarHBondContact OH-CD 3.49Å; Y472-R517 PolarHBondContact OH-NH1 2.92Å; S513-R517 WeakPolarHBondContact O-CG 3.43Å; S513-R517 PolarHBondContact O-N 3.41Å; T514-R517 CarbonylContact O-C 3.57Å; T514-R517 PolarHBondContact O-N 3.12Å; T514-R517 VanDerWaalsContact O-N 3.14Å; I515-R517 VanDerWaalsContact C-N 3.28Å; I515-R517 PolarHBondContact O-N 3.18Å; R517-R521 PolarHBondContact O-N 2.87Å; R517-F522 HydrophobicContact CB-CB 4.27Å; R517-F522 HydrophobicContact CB-CD2 4.48Å; R517-F522 HydrophobicContact CG-CD2 4.38Å; R517-F522 PolarHBondContact O-N 3.42Å; R517-F523 HydrophobicContact CB-CD2 3.89Å; R517-F523 HydrophobicContact CB-CE2 4.02Å; R517-F523 HydrophobicContact CG-CE2 4.3Å
518	L	95.4	Very high	90.3	Very high	3 Å²	3	30.1 Å²	30.1	2%	0.016	19%	0.194	C	C	.	.	H	α-helix	trans	-80.9	-43.7	176.4	-68.7	174.8	0	0	0	112	F465 V468 F470 Y489 T514 I515 V516 Y520 R521 F523 V525 V530	F465-L518 HydrophobicContact CE1-CB 4.16Å; F465-L518 HydrophobicContact CE1-CD1 4.01Å; F465-L518 HydrophobicContact CZ-CB 4.14Å; V468-L518 HydrophobicContact CG1-CD1 4.1Å; F470-L518 HydrophobicContact CB-CD1 4.27Å; F470-L518 HydrophobicContact CD2-CD2 3.73Å; F470-L518 HydrophobicContact CE2-CD2 3.88Å; F470-L518 HydrophobicContact CG-CD1 4.17Å; F470-L518 HydrophobicContact CG-CD2 4.2Å; F470-L518 HydrophobicContact CZ-CD2 4.46Å; Y489-L518 HydrophobicContact CD2-CD1 4.08Å; Y489-L518 HydrophobicContact CE2-CD1 3.98Å; T514-L518 HydrophobicContact CG2-CD1 4.13Å; T514-L518 HydrophobicContact CG2-CG 4.18Å; T514-L518 WeakPolarHBondContact O-CG 3.49Å; T514-L518 PolarHBondContact O-N 2.81Å; I515-L518 PolarHBondContact O-N 3.06Å; I515-L518 VanDerWaalsContact O-N 3.13Å; V516-L518 VanDerWaalsContact C-N 3.26Å; V516-L518 PolarHBondContact O-N 3.32Å; L518-Y520 VanDerWaalsContact C-N 3.34Å; L518-Y520 PolarHBondContact O-N 2.83Å; L518-R521 WeakPolarHBondContact O-CA 3.09Å; L518-R521 PolarHBondContact O-N 3.39Å; L518-F523 HydrophobicContact CD2-CB 4.15Å; L518-V525 HydrophobicContact CD1-CG1 4.27Å; L518-V525 HydrophobicContact CD2-CG1 3.94Å; L518-V530 HydrophobicContact CB-CG2 4.31Å
519	V	95.7	Very high	91.2	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.7	-43	175.3	178.6	0	0	0	0	111.2	V463 F465 I515 V516 R521 V530 V532 I549 I632	V463-V519 HydrophobicContact CG1-CG1 4.24Å; V463-V519 HydrophobicContact CG1-CG2 3.83Å; F465-V519 HydrophobicContact CE2-CG2 3.44Å; F465-V519 VanDerWaalsContact CE2-CG2 3.44Å; F465-V519 HydrophobicContact CZ-CG2 3.66Å; I515-V519 HydrophobicContact CG2-CG2 4.42Å; I515-V519 WeakPolarHBondContact O-CG2 3.23Å; I515-V519 PolarHBondContact O-N 3.49Å; V516-V519 PolarHBondContact O-N 2.88Å; V519-R521 PolarHBondContact O-N 2.98Å; V519-V530 HydrophobicContact CG2-CG1 4.25Å; V519-V532 HydrophobicContact CG1-CG2 4.19Å; V519-I549 HydrophobicContact CG1-CD1 3.88Å; V519-I632 HydrophobicContact CB-CD1 4.19Å; V519-I632 HydrophobicContact CG1-CD1 3.92Å
520	Y	94.9	Very high	92.2	Very high	39 Å²	39	23 Å²	23	15%	0.153	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-1.6	177.1	-150.1	-103.3	0	0	0	113.7	V516 L518 F522 R546 I549 V551	V516-Y520 VanDerWaalsContact O-CB 3.24Å; V516-Y520 WeakPolarHBondContact O-CB 3.3Å; V516-Y520 PolarHBondContact O-N 3.28Å; L518-Y520 VanDerWaalsContact C-N 3.34Å; L518-Y520 PolarHBondContact O-N 2.83Å; Y520-F522 AromaticContact CD1-CD2 3.99Å; Y520-F522 HydrophobicContact CD1-CD2 3.99Å; Y520-F522 HydrophobicContact CD1-CE1 4.36Å; Y520-F522 AromaticContact CD1-CE2 3.46Å; Y520-F522 HydrophobicContact CD1-CE2 3.46Å; Y520-F522 VanDerWaalsContact CD1-CE2 3.46Å; Y520-F522 AromaticContact CD1-CZ 3.67Å; Y520-F522 HydrophobicContact CD1-CZ 3.67Å; Y520-F522 HydrophobicContact CE1-CE2 4.17Å; Y520-F522 AromaticContact CE1-CZ 3.98Å; Y520-F522 HydrophobicContact CE1-CZ 3.98Å; Y520-F522 HydrophobicContact CG-CE2 4.23Å; Y520-F522 PolarHBondContact O-N 3.45Å; Y520-R546 HydrophobicContact CD1-CG 4Å; Y520-R546 HydrophobicContact CD2-CG 4.46Å; Y520-R546 HydrophobicContact CE1-CB 4.17Å; Y520-R546 HydrophobicContact CE1-CG 3.56Å; Y520-R546 HydrophobicContact CE2-CB 4.13Å; Y520-R546 HydrophobicContact CE2-CG 4.06Å; Y520-R546 HydrophobicContact CG-CG 4.43Å; Y520-R546 PolarHBondContact O-NE 3.42Å; Y520-I549 HydrophobicContact CD2-CB 4.08Å; Y520-I549 HydrophobicContact CD2-CD1 4.33Å; Y520-I549 HydrophobicContact CD2-CG2 3.93Å; Y520-I549 HydrophobicContact CE2-CB 4.09Å; Y520-I549 HydrophobicContact CE2-CG2 4.22Å; Y520-V551 HydrophobicContact CD2-CG2 3.89Å; Y520-V551 HydrophobicContact CE2-CG2 4.05Å
521	R	94.9	Very high	93	Very high	7 Å²	7	22.9 Å²	22.9	3%	0.026	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	54	-178.8	-160.4	178.5	170.8	-151.2	-11.1	112.4	V445 R446 R517 L518 V519 F523 D524 V537 R538 L542 L545 R546	V445-R521 HydrophobicContact CG1-CG 3.9Å; R446-R521 PolarHBondContact O-NH2 2.94Å; R446-R521 VanDerWaalsContact O-NH2 3.17Å; R517-R521 PolarHBondContact O-N 2.87Å; L518-R521 WeakPolarHBondContact O-CA 3.09Å; L518-R521 PolarHBondContact O-N 3.39Å; V519-R521 PolarHBondContact O-N 2.98Å; R521-F523 VanDerWaalsContact C-N 3.33Å; R521-D524 WeakPolarHBondContact CG-OD1 3.45Å; R521-D524 IonicContact CZ-OD1 2.73Å; R521-D524 IonicContact NE-OD1 3.7Å; R521-D524 PolarHBondContact NE-OD1 3.47Å; R521-D524 IonicContact NE-OD2 3.2Å; R521-D524 IonicContact NH2-OD1 2.68Å; R521-D524 IonicContact NH2-OD2 2.74Å; R521-D524 PolarHBondContact NH2-OD2 3.41Å; R521-V537 WeakPolarHBondContact CD-O 3.46Å; R521-V537 HydrophobicContact CG-CG2 4.36Å; R521-V537 PolarHBondContact NH1-O 3.39Å; R521-R538 VanDerWaalsContact CZ-CA 3.46Å; R521-R538 PolarHBondContact NH1-O 2.8Å; R521-L542 HydrophobicContact CB-CD1 3.95Å; R521-L542 HydrophobicContact CG-CD1 4.28Å; R521-L545 HydrophobicContact CB-CD2 3.88Å; R521-R546 PolarHBondContact O-NH2 3.35Å
522	F	93.1	Very high	93.6	Very high	65 Å²	65	22.3 Å²	22.3	29%	0.285	13%	0.127	S	C	.	.	S	Bend	trans	-78.7	-23.7	161	-78.7	-58.3	0	0	0	111.9	L208 R517 Y520	L208-F522 HydrophobicContact CB-CB 4.17Å; L208-F522 HydrophobicContact CB-CD1 3.82Å; L208-F522 HydrophobicContact CB-CG 4.2Å; L208-F522 HydrophobicContact CD2-CB 3.98Å; L208-F522 HydrophobicContact CD2-CD1 4.08Å; L208-F522 HydrophobicContact CD2-CD2 4.11Å; L208-F522 HydrophobicContact CD2-CG 3.81Å; L208-F522 HydrophobicContact CG-CD1 4.47Å; R517-F522 HydrophobicContact CB-CB 4.27Å; R517-F522 HydrophobicContact CB-CD2 4.48Å; R517-F522 HydrophobicContact CG-CD2 4.38Å; R517-F522 PolarHBondContact O-N 3.42Å; Y520-F522 AromaticContact CD1-CD2 3.99Å; Y520-F522 HydrophobicContact CD1-CD2 3.99Å; Y520-F522 HydrophobicContact CD1-CE1 4.36Å; Y520-F522 AromaticContact CD1-CE2 3.46Å; Y520-F522 HydrophobicContact CD1-CE2 3.46Å; Y520-F522 VanDerWaalsContact CD1-CE2 3.46Å; Y520-F522 AromaticContact CD1-CZ 3.67Å; Y520-F522 HydrophobicContact CD1-CZ 3.67Å; Y520-F522 HydrophobicContact CE1-CE2 4.17Å; Y520-F522 AromaticContact CE1-CZ 3.98Å; Y520-F522 HydrophobicContact CE1-CZ 3.98Å; Y520-F522 HydrophobicContact CG-CE2 4.23Å; Y520-F522 PolarHBondContact O-N 3.45Å
523	F	92.2	Very high	93.9	Very high	21 Å²	21	22.8 Å²	22.8	9%	0.092	13%	0.134	C	C	.	.	S	Bend	trans	-137.4	149.1	172.3	-52.5	-89	0	0	0	108.9	L208 S209 F470 Y472 R517 L518 R521	L208-F523 HydrophobicContact CB-CZ 4.26Å; L208-F523 HydrophobicContact CD2-CE2 4.02Å; L208-F523 HydrophobicContact CD2-CZ 4.19Å; L208-F523 HydrophobicContact CG-CZ 4.37Å; S209-F523 VanDerWaalsContact OG-CE1 3.28Å; S209-F523 WeakPolarHBondContact OG-CE1 3.38Å; F470-F523 HydrophobicContact CE2-CB 3.61Å; F470-F523 HydrophobicContact CE2-CG 4.18Å; F470-F523 HydrophobicContact CZ-CB 3.89Å; F470-F523 HydrophobicContact CZ-CD1 4.38Å; F470-F523 HydrophobicContact CZ-CD2 4.37Å; F470-F523 AromaticContact CZ-CG 3.96Å; F470-F523 HydrophobicContact CZ-CG 3.96Å; Y472-F523 HydrophobicContact CD1-CE1 4.21Å; Y472-F523 HydrophobicContact CD1-CZ 4.32Å; Y472-F523 HydrophobicContact CE1-CD1 4.39Å; Y472-F523 HydrophobicContact CE1-CD2 4.17Å; Y472-F523 AromaticContact CE1-CE1 3.98Å; Y472-F523 HydrophobicContact CE1-CE1 3.98Å; Y472-F523 AromaticContact CE1-CE2 3.8Å; Y472-F523 HydrophobicContact CE1-CE2 3.8Å; Y472-F523 HydrophobicContact CE1-CG 4.48Å; Y472-F523 AromaticContact CE1-CZ 3.7Å; Y472-F523 HydrophobicContact CE1-CZ 3.7Å; R517-F523 HydrophobicContact CB-CD2 3.89Å; R517-F523 HydrophobicContact CB-CE2 4.02Å; R517-F523 HydrophobicContact CG-CE2 4.3Å; L518-F523 HydrophobicContact CD2-CB 4.15Å; R521-F523 VanDerWaalsContact C-N 3.33Å
524	D	92.3	Very high	94.2	Very high	52 Å²	52	23.9 Å²	23.9	28%	0.278	15%	0.149	S	C	.	.			trans	-89.3	151.1	167.2	-73.8	-28	0	0	0	109.8	R521	R521-D524 WeakPolarHBondContact CG-OD1 3.45Å; R521-D524 IonicContact CZ-OD1 2.73Å; R521-D524 IonicContact NE-OD1 3.7Å; R521-D524 PolarHBondContact NE-OD1 3.47Å; R521-D524 IonicContact NE-OD2 3.2Å; R521-D524 IonicContact NH2-OD1 2.68Å; R521-D524 IonicContact NH2-OD2 2.74Å; R521-D524 PolarHBondContact NH2-OD2 3.41Å
525	V	93.4	Very high	94.4	Very high	18 Å²	18	26.5 Å²	26.5	11%	0.109	16%	0.16	C	C	.	.			trans	-72.3	148.1	176.3	-62.1	0	0	0	0	111.1	V468 L518 G527 V530	V468-V525 HydrophobicContact CG1-CB 4.33Å; V468-V525 HydrophobicContact CG1-CG1 3.61Å; V468-V525 HydrophobicContact CG2-CG1 4.29Å; L518-V525 HydrophobicContact CD1-CG1 4.27Å; L518-V525 HydrophobicContact CD2-CG1 3.94Å; V525-G527 WeakPolarHBondContact CB-O 3.36Å; V525-G527 WeakPolarHBondContact CG2-O 3.47Å; V525-V530 HydrophobicContact CG1-CG2 3.88Å
526	S	90.4	Very high	94.5	Very high	56 Å²	56	28 Å²	28	39%	0.392	17%	0.168	S	C	.	.	S	Bend	trans	-78.8	-23.4	174.3	-54.9	0	0	0	0	112.4	K469	K469-S526 WeakPolarHBondContact O-CA 3.25Å; K469-S526 WeakPolarHBondContact O-CB 3.32Å; K469-S526 PolarHBondContact O-N 2.86Å
527	G	92.7	Very high	94.6	Very high	20 Å²	20	27.9 Å²	27.9	21%	0.206	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	162.6	175	0	0	0	0	0	110.6	K469 V525	K469-G527 PolarHBondContact N-O 3.47Å; K469-G527 PolarHBondContact O-N 3.02Å; K469-G527 VanDerWaalsContact O-N 3.16Å; V525-G527 WeakPolarHBondContact CB-O 3.36Å; V525-G527 WeakPolarHBondContact CG2-O 3.47Å
528	G	94.9	Very high	94.7	Very high	30 Å²	30	27.9 Å²	27.9	31%	0.309	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	74.7	-159.2	-173.4	0	0	0	0	0	113.4	R466 D467 R538	R466-G528 CarbonylContact O-C 3.56Å; R466-G528 WeakPolarHBondContact O-CA 3.23Å; D467-G528 VanDerWaalsContact O-CA 3.29Å; D467-G528 WeakPolarHBondContact O-CA 3.17Å; G528-R538 PolarHBondContact O-NH2 3.2Å
529	S	96.7	Very high	94.6	Very high	20 Å²	20	30.1 Å²	30.1	14%	0.14	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	149.2	177.5	53.9	0	0	0	0	112.7	R466 V468 D536	R466-S529 PolarHBondContact N-O 3.46Å; R466-S529 PolarHBondContact O-N 2.96Å; V468-S529 WeakPolarHBondContact CG2-O 3.49Å; S529-D536 VanDerWaalsContact CB-OD2 3.25Å; S529-D536 WeakPolarHBondContact CB-OD2 3.21Å
530	V	97.5	Very high	94.6	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.012	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	122.7	167.5	178.9	0	0	0	0	106.5	E464 F465 V468 L518 V519 V525 D536 V537	E464-V530 CarbonylContact O-C 3.6Å; E464-V530 WeakPolarHBondContact O-CA 3.49Å; F465-V530 HydrophobicContact CD1-CG2 3.97Å; F465-V530 HydrophobicContact CD2-CG1 4.32Å; F465-V530 HydrophobicContact CE1-CG2 3.75Å; F465-V530 HydrophobicContact CE2-CG1 3.9Å; F465-V530 HydrophobicContact CE2-CG2 4.37Å; F465-V530 HydrophobicContact CG-CG2 4.34Å; F465-V530 HydrophobicContact CZ-CG1 4.07Å; F465-V530 HydrophobicContact CZ-CG2 3.95Å; V468-V530 HydrophobicContact CG2-CG2 3.88Å; L518-V530 HydrophobicContact CB-CG2 4.31Å; V519-V530 HydrophobicContact CG2-CG1 4.25Å; V525-V530 HydrophobicContact CG1-CG2 3.88Å; V530-D536 WeakPolarHBondContact O-CA 3.48Å; V530-V537 HydrophobicContact CB-CG2 4.04Å; V530-V537 HydrophobicContact CG1-CG1 4.19Å; V530-V537 HydrophobicContact CG1-CG2 4.45Å; V530-V537 PolarHBondContact O-N 3.4Å
531	L	97.3	Very high	94.6	Very high	8 Å²	8	30.2 Å²	30.2	4%	0.042	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	141.4	-178.3	-49.2	95.3	0	0	0	110.4	V463 E464 R466 G534 Q535	V463-L531 WeakPolarHBondContact CA-O 3.3Å; E464-L531 HydrophobicContact CB-CB 4.23Å; E464-L531 HydrophobicContact CB-CD1 4.07Å; E464-L531 HydrophobicContact CG-CD1 4.23Å; E464-L531 PolarHBondContact N-O 2.89Å; E464-L531 PolarHBondContact O-N 2.69Å; R466-L531 HydrophobicContact CB-CD1 4.33Å; R466-L531 HydrophobicContact CG-CD1 3.63Å; L531-G534 WeakPolarHBondContact CD2-O 3.28Å; L531-Q535 CarbonylContact C-O 3.44Å; L531-Q535 VanDerWaalsContact CA-O 3.25Å; L531-Q535 WeakPolarHBondContact CA-O 3.38Å
532	V	97	Very high	94.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	120.4	174.1	177.1	0	0	0	0	106.6	I454 I456 S462 V519 G534 Q535 V537 L545 I630	I454-V532 HydrophobicContact CD1-CB 4.08Å; I454-V532 HydrophobicContact CD1-CG1 3.96Å; I456-V532 HydrophobicContact CD1-CB 4.32Å; I456-V532 HydrophobicContact CD1-CG1 3.42Å; I456-V532 VanDerWaalsContact CD1-CG1 3.42Å; S462-V532 CarbonylContact O-C 3.51Å; S462-V532 WeakPolarHBondContact O-CA 3.33Å; V519-V532 HydrophobicContact CG1-CG2 4.19Å; V532-G534 VanDerWaalsContact C-N 3.26Å; V532-G534 PolarHBondContact O-N 2.63Å; V532-Q535 PolarHBondContact N-O 3.41Å; V532-Q535 PolarHBondContact O-N 3.44Å; V532-Q535 VanDerWaalsContact O-N 3.08Å; V532-V537 HydrophobicContact CB-CG1 4.23Å; V532-V537 HydrophobicContact CG2-CG1 3.62Å; V532-L545 HydrophobicContact CB-CD1 4.17Å; V532-L545 HydrophobicContact CG1-CD1 4.26Å; V532-L545 HydrophobicContact CG2-CD1 4.19Å; V532-I630 HydrophobicContact CG1-CD1 3.45Å; V532-I630 VanDerWaalsContact CG1-CD1 3.45Å
533	G	94.3	Very high	94.6	Very high	18 Å²	18	35.2 Å²	35.2	19%	0.186	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	38	-170.1	0	0	0	0	0	114	N460 S462 Q535	N460-G533 WeakPolarHBondContact O-CA 3.16Å; S462-G533 PolarHBondContact O-N 2.98Å; G533-Q535 PolarHBondContact O-N 3.26Å
534	G	93.9	Very high	94.7	Very high	47 Å²	47	35.1 Å²	35.1	49%	0.485	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	1	-177.2	0	0	0	0	0	115.3	L531 V532	L531-G534 WeakPolarHBondContact CD2-O 3.28Å; V532-G534 VanDerWaalsContact C-N 3.26Å; V532-G534 PolarHBondContact O-N 2.63Å
535	Q	94.9	Very high	94.9	Very high	62 Å²	62	32.6 Å²	32.6	29%	0.29	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	129.4	179.9	-65	169	72.7	0	0	110.1	L531 V532 G533 V537 V540	L531-Q535 CarbonylContact C-O 3.44Å; L531-Q535 VanDerWaalsContact CA-O 3.25Å; L531-Q535 WeakPolarHBondContact CA-O 3.38Å; V532-Q535 PolarHBondContact N-O 3.41Å; V532-Q535 PolarHBondContact O-N 3.44Å; V532-Q535 VanDerWaalsContact O-N 3.08Å; G533-Q535 PolarHBondContact O-N 3.26Å; Q535-V537 PolarHBondContact O-N 2.96Å; Q535-V540 HydrophobicContact CB-CG1 4.02Å
536	D	95.9	Very high	95	Very high	31 Å²	31	35 Å²	35	17%	0.166	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	127.6	175.3	-173.2	-37.8	0	0	0	109.9	S529 V530 R538 S539	S529-D536 VanDerWaalsContact CB-OD2 3.25Å; S529-D536 WeakPolarHBondContact CB-OD2 3.21Å; V530-D536 WeakPolarHBondContact O-CA 3.48Å; D536-R538 PolarHBondContact O-N 3.09Å; D536-R538 VanDerWaalsContact OD1-CB 3.27Å; D536-R538 WeakPolarHBondContact OD1-CB 3.46Å; D536-R538 WeakPolarHBondContact OD1-CG 3.24Å; D536-R538 PolarHBondContact OD1-N 3.44Å; D536-R538 IonicContact OD1-NE 3.4Å; D536-R538 PolarHBondContact OD1-NE 2.94Å; D536-R538 IonicContact OD2-CZ 2.94Å; D536-R538 IonicContact OD2-NE 3.36Å; D536-R538 PolarHBondContact OD2-NE 2.85Å; D536-R538 IonicContact OD2-NH2 2.83Å; D536-R538 PolarHBondContact OD2-NH2 3Å; D536-S539 WeakPolarHBondContact O-CB 3.37Å; D536-S539 PolarHBondContact O-N 3.4Å; D536-S539 PolarHBondContact O-OG 2.93Å
537	V	96	Very high	95.2	Very high	6 Å²	6	38.8 Å²	38.8	4%	0.036	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-22.6	-178.6	-62.3	0	0	0	0	113.1	R521 V530 V532 Q535 S539 L545	R521-V537 WeakPolarHBondContact CD-O 3.46Å; R521-V537 HydrophobicContact CG-CG2 4.36Å; R521-V537 PolarHBondContact NH1-O 3.39Å; V530-V537 HydrophobicContact CB-CG2 4.04Å; V530-V537 HydrophobicContact CG1-CG1 4.19Å; V530-V537 HydrophobicContact CG1-CG2 4.45Å; V530-V537 PolarHBondContact O-N 3.4Å; V532-V537 HydrophobicContact CB-CG1 4.23Å; V532-V537 HydrophobicContact CG2-CG1 3.62Å; Q535-V537 PolarHBondContact O-N 2.96Å; V537-S539 VanDerWaalsContact C-N 3.33Å; V537-L545 HydrophobicContact CB-CD2 3.77Å; V537-L545 HydrophobicContact CG1-CD1 3.98Å; V537-L545 HydrophobicContact CG1-CD2 3.99Å
538	R	94.7	Very high	95.3	Very high	81 Å²	81	38.2 Å²	38.2	31%	0.306	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-26.5	176.1	-64.9	176.1	-66.4	-171	-2	113.6	R521 G528 D536	R521-R538 VanDerWaalsContact CZ-CA 3.46Å; R521-R538 PolarHBondContact NH1-O 2.8Å; G528-R538 PolarHBondContact O-NH2 3.2Å; D536-R538 PolarHBondContact O-N 3.09Å; D536-R538 VanDerWaalsContact OD1-CB 3.27Å; D536-R538 WeakPolarHBondContact OD1-CB 3.46Å; D536-R538 WeakPolarHBondContact OD1-CG 3.24Å; D536-R538 PolarHBondContact OD1-N 3.44Å; D536-R538 IonicContact OD1-NE 3.4Å; D536-R538 PolarHBondContact OD1-NE 2.94Å; D536-R538 IonicContact OD2-CZ 2.94Å; D536-R538 IonicContact OD2-NE 3.36Å; D536-R538 PolarHBondContact OD2-NE 2.85Å; D536-R538 IonicContact OD2-NH2 2.83Å; D536-R538 PolarHBondContact OD2-NH2 3Å
539	S	93.9	Very high	95.4	Very high	50 Å²	50	36.8 Å²	36.8	35%	0.35	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-17	-172.5	73	0	0	0	0	114.4	P452 D536 V537	P452-S539 WeakPolarHBondContact CD-O 3.29Å; D536-S539 WeakPolarHBondContact O-CB 3.37Å; D536-S539 PolarHBondContact O-N 3.4Å; D536-S539 PolarHBondContact O-OG 2.93Å; V537-S539 VanDerWaalsContact C-N 3.33Å
540	V	95.3	Very high	95.4	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.191	C	C	.	.	S	Bend	trans	-100.9	164.3	-174.9	-61.5	0	0	0	0	112.8	P452 I454 Q535 L542 L545	P452-V540 CarbonylContact O-C 3.4Å; P452-V540 WeakPolarHBondContact O-CA 3.44Å; I454-V540 HydrophobicContact CB-CB 4.28Å; I454-V540 HydrophobicContact CB-CG1 4.22Å; I454-V540 HydrophobicContact CD1-CG1 4.4Å; I454-V540 HydrophobicContact CD1-CG2 4.34Å; I454-V540 HydrophobicContact CG1-CG1 4.22Å; Q535-V540 HydrophobicContact CB-CG1 4.02Å; V540-L542 PolarHBondContact O-N 2.99Å; V540-L545 HydrophobicContact CG2-CB 4.14Å; V540-L545 HydrophobicContact CG2-CD2 4.47Å
541	N	94.9	Very high	95.2	Very high	40 Å²	40	38 Å²	38	21%	0.214	20%	0.204	C	C	.	.			trans	-65.3	123.2	171.8	-178.9	-63.3	0	0	0	110.9	P452 N453 E543 S544 L545	P452-N541 PolarHBondContact O-N 2.97Å; N453-N541 WeakPolarHBondContact OD1-CB 3.15Å; N541-E543 VanDerWaalsContact C-N 3.32Å; N541-E543 PolarHBondContact O-N 2.88Å; N541-E543 WeakPolarHBondContact OD1-CA 3.11Å; N541-E543 VanDerWaalsContact OD1-CB 3.3Å; N541-E543 WeakPolarHBondContact OD1-CB 3.49Å; N541-E543 PolarHBondContact OD1-N 3.46Å; N541-S544 PolarHBondContact O-N 3.41Å; N541-S544 PolarHBondContact O-OG 3.06Å; N541-S544 PolarHBondContact OD1-N 2.98Å; N541-L545 PolarHBondContact O-N 3.38Å
542	L	94	Very high	95	Very high	21 Å²	21	37.7 Å²	37.7	11%	0.11	20%	0.202	C	C	.	.	H	α-helix	trans	-60.2	-35.6	-176	-173.8	63.2	0	0	0	114.1	V445 S447 R521 V540 L545 R546	V445-L542 HydrophobicContact CG1-CD2 4.31Å; S447-L542 WeakPolarHBondContact OG-CB 3.35Å; S447-L542 PolarHBondContact OG-N 3.14Å; R521-L542 HydrophobicContact CB-CD1 3.95Å; R521-L542 HydrophobicContact CG-CD1 4.28Å; V540-L542 PolarHBondContact O-N 2.99Å; L542-L545 HydrophobicContact CD1-CD2 4.43Å; L542-R546 HydrophobicContact CD1-CG 4.47Å; L542-R546 WeakPolarHBondContact O-CB 3.48Å; L542-R546 VanDerWaalsContact O-CG 3.29Å; L542-R546 WeakPolarHBondContact O-CG 3.35Å; L542-R546 PolarHBondContact O-N 2.85Å
543	E	93.6	Very high	94.6	Very high	157 Å²	157	39.9 Å²	39.9	73%	0.734	22%	0.216	S	C	*	.	H	α-helix	trans	-67	-46.4	177.9	-173.3	178.6	175.1	0	0	110.5	N541 L545 R546 H547	N541-E543 VanDerWaalsContact C-N 3.32Å; N541-E543 PolarHBondContact O-N 2.88Å; N541-E543 WeakPolarHBondContact OD1-CA 3.11Å; N541-E543 VanDerWaalsContact OD1-CB 3.3Å; N541-E543 WeakPolarHBondContact OD1-CB 3.49Å; N541-E543 PolarHBondContact OD1-N 3.46Å; E543-L545 PolarHBondContact O-N 3.21Å; E543-R546 PolarHBondContact O-N 2.96Å; E543-H547 WeakPolarHBondContact O-CB 3.14Å; E543-H547 PolarHBondContact O-N 2.85Å
544	S	95.1	Very high	94.2	Very high	18 Å²	18	42.1 Å²	42.1	13%	0.126	22%	0.222	C	C	.	.	H	α-helix	trans	-62.1	-41.7	176.9	73.3	0	0	0	0	112.4	N453 I454 N541 H547 A548	N453-S544 WeakPolarHBondContact CA-OG 3.38Å; I454-S544 WeakPolarHBondContact CG2-O 3.33Å; I454-S544 PolarHBondContact N-OG 3.21Å; N541-S544 PolarHBondContact O-N 3.41Å; N541-S544 PolarHBondContact O-OG 3.06Å; N541-S544 PolarHBondContact OD1-N 2.98Å; S544-H547 WeakPolarHBondContact O-CB 3.48Å; S544-H547 PolarHBondContact O-N 3.03Å; S544-A548 PolarHBondContact O-N 3.36Å; S544-A548 VanDerWaalsContact O-N 3.15Å
545	L	96.5	Very high	93.7	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-57.7	-51.1	174.1	175.6	65.9	0	0	0	111.6	I454 R521 V532 V537 V540 N541 L542 E543 H547 A548 I549	I454-L545 HydrophobicContact CD1-CD1 3.97Å; R521-L545 HydrophobicContact CB-CD2 3.88Å; V532-L545 HydrophobicContact CB-CD1 4.17Å; V532-L545 HydrophobicContact CG1-CD1 4.26Å; V532-L545 HydrophobicContact CG2-CD1 4.19Å; V537-L545 HydrophobicContact CB-CD2 3.77Å; V537-L545 HydrophobicContact CG1-CD1 3.98Å; V537-L545 HydrophobicContact CG1-CD2 3.99Å; V540-L545 HydrophobicContact CG2-CB 4.14Å; V540-L545 HydrophobicContact CG2-CD2 4.47Å; N541-L545 PolarHBondContact O-N 3.38Å; L542-L545 HydrophobicContact CD1-CD2 4.43Å; E543-L545 PolarHBondContact O-N 3.21Å; L545-H547 VanDerWaalsContact C-N 3.28Å; L545-H547 PolarHBondContact O-N 2.81Å; L545-A548 PolarHBondContact O-N 3.27Å; L545-A548 VanDerWaalsContact O-N 3.17Å; L545-I549 HydrophobicContact CD1-CD1 3.89Å; L545-I549 HydrophobicContact CG-CD1 4.22Å
546	R	95.7	Very high	93.4	Very high	69 Å²	69	43.8 Å²	43.8	26%	0.26	22%	0.222	S	C	.	.	H	α-helix	trans	-69.3	-26.5	-178.5	-72.8	-179.1	180	168.3	3.9	112.7	Y520 R521 L542 E543 K626	Y520-R546 HydrophobicContact CD1-CG 4Å; Y520-R546 HydrophobicContact CD2-CG 4.46Å; Y520-R546 HydrophobicContact CE1-CB 4.17Å; Y520-R546 HydrophobicContact CE1-CG 3.56Å; Y520-R546 HydrophobicContact CE2-CB 4.13Å; Y520-R546 HydrophobicContact CE2-CG 4.06Å; Y520-R546 HydrophobicContact CG-CG 4.43Å; Y520-R546 PolarHBondContact O-NE 3.42Å; R521-R546 PolarHBondContact O-NH2 3.35Å; L542-R546 HydrophobicContact CD1-CG 4.47Å; L542-R546 WeakPolarHBondContact O-CB 3.48Å; L542-R546 VanDerWaalsContact O-CG 3.29Å; L542-R546 WeakPolarHBondContact O-CG 3.35Å; L542-R546 PolarHBondContact O-N 2.85Å; E543-R546 PolarHBondContact O-N 2.96Å; R546-K626 WeakPolarHBondContact O-CE 3.43Å; R546-K626 PolarHBondContact O-NZ 3.4Å
547	H	94.5	Very high	93.1	Very high	135 Å²	135	47.6 Å²	47.6	63%	0.625	25%	0.247	S	C	*	.	H	α-helix	trans	-67.5	-38.4	172.2	-171.6	-79.9	0	0	0	111.4	E543 S544 L545 I549 K626	E543-H547 WeakPolarHBondContact O-CB 3.14Å; E543-H547 PolarHBondContact O-N 2.85Å; S544-H547 WeakPolarHBondContact O-CB 3.48Å; S544-H547 PolarHBondContact O-N 3.03Å; L545-H547 VanDerWaalsContact C-N 3.28Å; L545-H547 PolarHBondContact O-N 2.81Å; H547-I549 PolarHBondContact O-N 2.95Å; H547-K626 WeakPolarHBondContact O-CE 3.33Å
548	A	95.5	Very high	93	Very high	7 Å²	7	48.3 Å²	48.3	6%	0.058	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-5.8	-179.3	0	0	0	0	0	115.2	I454 S544 L545 P629 I630	I454-A548 HydrophobicContact CG2-CB 4.3Å; S544-A548 PolarHBondContact O-N 3.36Å; S544-A548 VanDerWaalsContact O-N 3.15Å; L545-A548 PolarHBondContact O-N 3.27Å; L545-A548 VanDerWaalsContact O-N 3.17Å; A548-P629 HydrophobicContact CB-CG 4.35Å; A548-P629 VanDerWaalsContact O-CD 3.26Å; A548-P629 WeakPolarHBondContact O-CD 3.47Å; A548-P629 WeakPolarHBondContact O-CG 3.37Å; A548-I630 PolarHBondContact O-N 2.85Å
549	I	96.5	Very high	93	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	122.1	-176.6	-57.8	158.1	0	0	0	110.5	V519 Y520 L545 H547 V551 K626 I630 I632	V519-I549 HydrophobicContact CG1-CD1 3.88Å; Y520-I549 HydrophobicContact CD2-CB 4.08Å; Y520-I549 HydrophobicContact CD2-CD1 4.33Å; Y520-I549 HydrophobicContact CD2-CG2 3.93Å; Y520-I549 HydrophobicContact CE2-CB 4.09Å; Y520-I549 HydrophobicContact CE2-CG2 4.22Å; L545-I549 HydrophobicContact CD1-CD1 3.89Å; L545-I549 HydrophobicContact CG-CD1 4.22Å; H547-I549 PolarHBondContact O-N 2.95Å; I549-V551 HydrophobicContact CG2-CG2 4.03Å; I549-K626 WeakPolarHBondContact O-CE 3.49Å; I549-K626 PolarHBondContact O-NZ 2.99Å; I549-I630 WeakPolarHBondContact CA-O 3.22Å; I549-I630 HydrophobicContact CG1-CB 4.26Å; I549-I630 HydrophobicContact CG1-CD1 4.32Å; I549-I630 HydrophobicContact CG1-CG2 4.44Å; I549-I630 HydrophobicContact CG2-CG2 4.42Å; I549-I632 HydrophobicContact CG2-CD1 3.66Å; I549-I632 HydrophobicContact CG2-CG1 3.99Å
550	A	95.5	Very high	92.9	Very high	2 Å²	2	51.3 Å²	51.3	2%	0.017	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	140.1	166.6	0	0	0	0	0	110	A623 K626 A628 I630 L631 I632	A550-A623 HydrophobicContact CB-CB 4.15Å; A550-K626 HydrophobicContact CB-CB 4.49Å; A550-K626 HydrophobicContact CB-CD 4.12Å; A550-A628 HydrophobicContact CB-CB 3.7Å; A550-A628 VanDerWaalsContact N-CB 3.32Å; A550-I630 PolarHBondContact N-O 3.37Å; A550-L631 HydrophobicContact CB-CD1 3.68Å; A550-L631 WeakPolarHBondContact O-CA 3.29Å; A550-I632 PolarHBondContact O-N 3.49Å
551	V	94.2	Very high	92.9	Very high	46 Å²	46	53.4 Å²	53.4	28%	0.279	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	130	-179.8	-176.8	0	0	0	0	108.6	V516 Y520 I549 I632	V516-V551 HydrophobicContact CG1-CG1 3.95Å; V516-V551 HydrophobicContact CG1-CG2 4.34Å; Y520-V551 HydrophobicContact CD2-CG2 3.89Å; Y520-V551 HydrophobicContact CE2-CG2 4.05Å; I549-V551 HydrophobicContact CG2-CG2 4.03Å; V551-I632 WeakPolarHBondContact CA-O 3.45Å; V551-I632 HydrophobicContact CG2-CB 4.38Å
552	I	92.5	Very high	92.9	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	102.8	168	-59.5	163.4	0	0	0	106.3	Q616 A619 I620 A623 L631 I632 Y633 D634 A636 L652	I552-Q616 VanDerWaalsContact CG2-NE2 3.29Å; I552-A619 HydrophobicContact CG2-CB 4.16Å; I552-I620 HydrophobicContact CD1-CG1 4.03Å; I552-I620 HydrophobicContact CG2-CG1 4.23Å; I552-A623 HydrophobicContact CD1-CB 4.09Å; I552-A623 HydrophobicContact CG1-CB 3.69Å; I552-L631 HydrophobicContact CD1-CD1 4.01Å; I552-L631 HydrophobicContact CG1-CD1 4.22Å; I552-I632 PolarHBondContact N-O 3.41Å; I552-Y633 HydrophobicContact CD1-CD1 3.64Å; I552-Y633 HydrophobicContact CD1-CE1 3.55Å; I552-D634 PolarHBondContact O-N 3.43Å; I552-A636 HydrophobicContact CB-CB 4.13Å; I552-A636 HydrophobicContact CG2-CB 3.56Å; I552-L652 HydrophobicContact CD1-CD1 4.49Å
553	P	90.4	Very high	93	Very high	46 Å²	46	51.5 Å²	51.5	30%	0.299	26%	0.263	S	S	.	.			trans	-75.3	165.3	-174	32.5	-36.3	0	0	0	112.2	Q616 D634	P553-Q616 PolarHBondContact O-NE2 2.9Å; P553-D634 CarbonylContact C-O 3.53Å
554	Q	84.3	Confident	93.2	Very high	66 Å²	66	46 Å²	46	31%	0.308	24%	0.236	S	C	.	.	S	Bend	trans	-63	-53.7	173.3	179.8	172.1	18.1	0	0	111.1	D634 E635	Q554-D634 WeakPolarHBondContact CA-O 3.3Å; Q554-D634 WeakPolarHBondContact CB-O 3.42Å; Q554-D634 PolarHBondContact N-O 3.02Å; Q554-E635 HydrophobicContact CB-CB 4.16Å; Q554-E635 HydrophobicContact CG-CB 4.02Å; Q554-E635 PolarHBondContact NE2-OE2 3.35Å
555	D	83.9	Confident	93.3	Very high	130 Å²	130	48.6 Å²	48.6	70%	0.695	24%	0.244	S	C	*	.	S	Bend	trans	-104.2	104.7	177.6	-73.2	-41.8	0	0	0	110.5	V557	D555-V557 PolarHBondContact O-N 3.44Å
556	T	88.9	Confident	93.3	Very high	13 Å²	13	48.6 Å²	48.6	8%	0.08	24%	0.244	C	C	.	.			trans	-78.5	115	176.1	-61.7	0	0	0	0	111.4	L558 K615 Q616 A619	T556-L558 HydrophobicContact CG2-CD2 4.36Å; T556-K615 HydrophobicContact CG2-CB 4.35Å; T556-K615 VanDerWaalsContact CG2-O 3.26Å; T556-K615 WeakPolarHBondContact CG2-O 3.15Å; T556-Q616 PolarHBondContact OG1-OE1 3.24Å; T556-A619 HydrophobicContact CG2-CB 3.71Å; T556-A619 WeakPolarHBondContact OG1-CB 3.42Å
557	V	90	Very high	93.4	Very high	112 Å²	112	45.3 Å²	45.3	68%	0.679	23%	0.231	S	C	*	.			trans	-88.9	140.1	173.1	-171.5	0	0	0	0	110.5	D555 R622	D555-V557 PolarHBondContact O-N 3.44Å; V557-R622 PolarHBondContact O-NH1 3.06Å
558	L	93.5	Very high	93.6	Very high	21 Å²	21	40.8 Å²	40.8	11%	0.11	21%	0.21	C	C	.	.			trans	-109.6	136.7	175	-58.6	178.7	0	0	0	109.9	T556 N566 V603 L610 K615 I618	T556-L558 HydrophobicContact CG2-CD2 4.36Å; L558-N566 WeakPolarHBondContact CA-OD1 3.33Å; L558-N566 HydrophobicContact CD2-CB 4.45Å; L558-V603 HydrophobicContact CB-CG2 4.27Å; L558-V603 HydrophobicContact CD1-CB 4.05Å; L558-V603 HydrophobicContact CD1-CG2 3.99Å; L558-L610 HydrophobicContact CD1-CB 4.45Å; L558-L610 HydrophobicContact CD1-CD1 3.76Å; L558-L610 HydrophobicContact CD1-CG 4.21Å; L558-K615 HydrophobicContact CD1-CG 4.05Å; L558-K615 HydrophobicContact CG-CG 4.42Å; L558-I618 HydrophobicContact CD1-CD1 4.34Å; L558-I618 HydrophobicContact CD2-CB 4.35Å; L558-I618 HydrophobicContact CD2-CD1 3.99Å; L558-I618 HydrophobicContact CD2-CG2 3.83Å
559	F	93.8	Very high	93.6	Very high	83 Å²	83	45.5 Å²	45.5	36%	0.364	23%	0.228	S	C	.	.			trans	-66.2	147.5	167.5	-66.2	-77.3	0	0	0	109.4	N561 Y565 N566 Y569	F559-N561 HydrophobicContact CB-CB 4.43Å; F559-N561 PolarHBondContact O-N 3.2Å; F559-Y565 HydrophobicContact CB-CD1 4.31Å; F559-Y565 HydrophobicContact CB-CE1 4Å; F559-Y565 HydrophobicContact CD2-CE1 4.06Å; F559-Y565 HydrophobicContact CG-CE1 4.04Å; F559-N566 PolarHBondContact N-OD1 3.33Å; F559-N566 PolarHBondContact O-ND2 3.41Å; F559-N566 VanDerWaalsContact O-ND2 3.08Å; F559-Y569 AromaticContact CD2-CD2 3.95Å; F559-Y569 HydrophobicContact CD2-CD2 3.95Å; F559-Y569 HydrophobicContact CD2-CE2 4.13Å; F559-Y569 HydrophobicContact CD2-CG 4.18Å; F559-Y569 HydrophobicContact CE1-CE2 4.35Å; F559-Y569 AromaticContact CE2-CD1 3.62Å; F559-Y569 HydrophobicContact CE2-CD1 3.62Å; F559-Y569 AromaticContact CE2-CD2 3.49Å; F559-Y569 HydrophobicContact CE2-CD2 3.49Å; F559-Y569 VanDerWaalsContact CE2-CD2 3.49Å; F559-Y569 AromaticContact CE2-CE1 3.51Å; F559-Y569 HydrophobicContact CE2-CE1 3.51Å; F559-Y569 AromaticContact CE2-CE2 3.38Å; F559-Y569 HydrophobicContact CE2-CE2 3.38Å; F559-Y569 AromaticContact CE2-CG 3.61Å; F559-Y569 HydrophobicContact CE2-CG 3.61Å; F559-Y569 AromaticContact CE2-CZ 3.4Å; F559-Y569 HydrophobicContact CZ-CD1 4.29Å; F559-Y569 HydrophobicContact CZ-CD2 4.13Å; F559-Y569 AromaticContact CZ-CE1 3.7Å; F559-Y569 HydrophobicContact CZ-CE1 3.7Å; F559-Y569 AromaticContact CZ-CE2 3.52Å; F559-Y569 HydrophobicContact CZ-CE2 3.52Å; F559-Y569 HydrophobicContact CZ-CG 4.48Å; F559-Y569 AromaticContact CZ-CZ 3.27Å; F559-Y569 WeakPolarHBondContact CZ-OH 3.36Å
560	H	92.9	Very high	93.5	Very high	110 Å²	110	46.3 Å²	46.3	51%	0.509	24%	0.236	S	C	.	.	S	Bend	trans	-73.4	79	170.3	-171.3	54.4	0	0	0	110.3	V603	H560-V603 WeakPolarHBondContact CA-O 3.46Å; H560-V603 PolarHBondContact ND1-O 2.67Å
561	N	94.6	Very high	93.5	Very high	45 Å²	45	48.8 Å²	48.8	24%	0.241	25%	0.249	C	C	.	.	S	Bend	trans	-161	-176.2	-175.6	-150.1	-29.3	0	0	0	109.6	F559 Y565 N566 Q602 V603	F559-N561 HydrophobicContact CB-CB 4.43Å; F559-N561 PolarHBondContact O-N 3.2Å; N561-Y565 HydrophobicContact CB-CD1 3.54Å; N561-Y565 HydrophobicContact CB-CE1 4.21Å; N561-Y565 HydrophobicContact CB-CG 3.94Å; N561-Y565 WeakPolarHBondContact ND2-CD1 3.38Å; N561-Y565 VanDerWaalsContact ND2-CG 3.31Å; N561-N566 PolarHBondContact O-ND2 2.9Å; N561-Q602 VanDerWaalsContact CA-OE1 3.29Å; N561-V603 VanDerWaalsContact O-CG2 3.28Å; N561-V603 WeakPolarHBondContact O-CG2 3.24Å; N561-V603 PolarHBondContact O-N 2.87Å
562	T	95.6	Very high	93.6	Very high	20 Å²	20	51.6 Å²	51.6	12%	0.123	26%	0.262	C	S	.	.	B	Isolated β-bridge	trans	-63.3	158.5	178	65.9	0	0	0	0	112.7	F564 Y565 N566 T601 Q602	T562-F564 VanDerWaalsContact C-N 3.28Å; T562-F564 PolarHBondContact O-N 3.35Å; T562-Y565 PolarHBondContact O-N 3.44Å; T562-Y565 WeakPolarHBondContact OG1-CB 3.29Å; T562-Y565 PolarHBondContact OG1-N 3.09Å; T562-N566 PolarHBondContact O-N 3.41Å; T562-N566 PolarHBondContact O-ND2 3.06Å; T562-T601 CarbonylContact C-O 3.57Å; T562-T601 VanDerWaalsContact CA-O 3.32Å; T562-T601 WeakPolarHBondContact CA-O 3.4Å; T562-Q602 VanDerWaalsContact CG2-NE2 3.3Å
563	I	96.4	Very high	93.7	Very high	1 Å²	1	60.7 Å²	60.7	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-60.6	-41.4	170.5	-67.5	176.6	0	0	0	110.2	Y565 N566 L567 I592 M595 Y599 T601 V603	I563-Y565 PolarHBondContact O-N 3.35Å; I563-N566 PolarHBondContact O-N 3.06Å; I563-N566 VanDerWaalsContact O-N 3.11Å; I563-L567 HydrophobicContact CG2-CD1 3.88Å; I563-L567 HydrophobicContact CG2-CG 4.19Å; I563-L567 WeakPolarHBondContact O-CG 3.31Å; I563-L567 PolarHBondContact O-N 3.41Å; I563-I592 HydrophobicContact CD1-CG1 4.31Å; I563-I592 HydrophobicContact CG2-CD1 3.59Å; I563-I592 HydrophobicContact CG2-CG1 3.97Å; I563-M595 HydrophobicContact CD1-CE 3.91Å; I563-M595 HydrophobicContact CD1-SD 3.33Å; I563-M595 WeakPolarHBondContact CD1-SD 3.33Å; I563-Y599 PolarHBondContact N-O 3.4Å; I563-T601 HydrophobicContact CD1-CG2 4.37Å; I563-T601 PolarHBondContact N-O 2.95Å; I563-V603 HydrophobicContact CD1-CG1 4.04Å; I563-V603 HydrophobicContact CG1-CG1 3.6Å; I563-V603 HydrophobicContact CG1-CG2 4.26Å
564	F	97.6	Very high	94	Very high	41 Å²	41	58.7 Å²	58.7	18%	0.18	29%	0.289	C	S	.	.	H	α-helix	trans	-51.9	-53.2	175	-173	-91.8	0	0	0	111.7	T562 N566 L567 Q568 P576 V579 Y580 Y599	T562-F564 VanDerWaalsContact C-N 3.28Å; T562-F564 PolarHBondContact O-N 3.35Å; F564-N566 VanDerWaalsContact C-N 3.29Å; F564-N566 PolarHBondContact O-N 3.4Å; F564-L567 PolarHBondContact O-N 3.49Å; F564-Q568 HydrophobicContact CE1-CB 4.3Å; F564-Q568 HydrophobicContact CE1-CG 4.46Å; F564-Q568 WeakPolarHBondContact O-CB 3.41Å; F564-Q568 PolarHBondContact O-N 3.41Å; F564-P576 HydrophobicContact CE2-CB 4.2Å; F564-P576 HydrophobicContact CZ-CB 4.25Å; F564-P576 HydrophobicContact CZ-CG 4.36Å; F564-V579 HydrophobicContact CD2-CG1 4.02Å; F564-V579 HydrophobicContact CE2-CB 4.04Å; F564-V579 HydrophobicContact CE2-CG1 3.89Å; F564-V579 HydrophobicContact CE2-CG2 4.34Å; F564-V579 HydrophobicContact CZ-CB 4.44Å; F564-V579 HydrophobicContact CZ-CG2 4.24Å; F564-Y580 HydrophobicContact CD2-CE1 4.23Å; F564-Y580 HydrophobicContact CE2-CE1 4.22Å; F564-Y599 HydrophobicContact CD2-CD1 4.48Å; F564-Y599 PolarHBondContact N-O 2.99Å
565	Y	97.2	Very high	94.6	Very high	72 Å²	72	58.5 Å²	58.5	28%	0.282	29%	0.292	S	S	.	.	H	α-helix	trans	-59.3	-43.3	178.6	177.4	-91.1	0	0	0	111.4	F559 N561 T562 I563 L567 Q568 Y569	F559-Y565 HydrophobicContact CB-CD1 4.31Å; F559-Y565 HydrophobicContact CB-CE1 4Å; F559-Y565 HydrophobicContact CD2-CE1 4.06Å; F559-Y565 HydrophobicContact CG-CE1 4.04Å; N561-Y565 HydrophobicContact CB-CD1 3.54Å; N561-Y565 HydrophobicContact CB-CE1 4.21Å; N561-Y565 HydrophobicContact CB-CG 3.94Å; N561-Y565 WeakPolarHBondContact ND2-CD1 3.38Å; N561-Y565 VanDerWaalsContact ND2-CG 3.31Å; T562-Y565 PolarHBondContact O-N 3.44Å; T562-Y565 WeakPolarHBondContact OG1-CB 3.29Å; T562-Y565 PolarHBondContact OG1-N 3.09Å; I563-Y565 PolarHBondContact O-N 3.35Å; Y565-L567 VanDerWaalsContact C-N 3.33Å; Y565-L567 PolarHBondContact O-N 3.41Å; Y565-Q568 PolarHBondContact O-N 3.08Å; Y565-Y569 AromaticContact CE1-CD2 4Å; Y565-Y569 HydrophobicContact CE1-CD2 4Å; Y565-Y569 WeakPolarHBondContact O-CB 3.3Å; Y565-Y569 PolarHBondContact O-N 3.48Å
566	N	96.9	Very high	95.2	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.9	-36.4	179.4	-85.9	-83.2	0	0	0	112.4	L558 F559 N561 T562 I563 F564 Y569 V603 I618 R622	L558-N566 WeakPolarHBondContact CA-OD1 3.33Å; L558-N566 HydrophobicContact CD2-CB 4.45Å; F559-N566 PolarHBondContact N-OD1 3.33Å; F559-N566 PolarHBondContact O-ND2 3.41Å; F559-N566 VanDerWaalsContact O-ND2 3.08Å; N561-N566 PolarHBondContact O-ND2 2.9Å; T562-N566 PolarHBondContact O-N 3.41Å; T562-N566 PolarHBondContact O-ND2 3.06Å; I563-N566 PolarHBondContact O-N 3.06Å; I563-N566 VanDerWaalsContact O-N 3.11Å; F564-N566 VanDerWaalsContact C-N 3.29Å; F564-N566 PolarHBondContact O-N 3.4Å; N566-Y569 WeakPolarHBondContact O-CB 3.28Å; N566-V603 WeakPolarHBondContact ND2-CG2 3.32Å; N566-I618 HydrophobicContact CB-CG2 4.4Å; N566-R622 WeakPolarHBondContact O-CG 3.38Å; N566-R622 PolarHBondContact O-NE 2.99Å; N566-R622 PolarHBondContact O-NH2 2.95Å; N566-R622 PolarHBondContact OD1-NH2 3Å
567	L	97.5	Very high	95.6	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-70.5	-53.9	174	-66.6	167.4	0	0	0	110.7	I563 F564 Y565 Y569 G570 V579 A583 I588 I592 Y599 I618 A621 L625	I563-L567 HydrophobicContact CG2-CD1 3.88Å; I563-L567 HydrophobicContact CG2-CG 4.19Å; I563-L567 WeakPolarHBondContact O-CG 3.31Å; I563-L567 PolarHBondContact O-N 3.41Å; F564-L567 PolarHBondContact O-N 3.49Å; Y565-L567 VanDerWaalsContact C-N 3.33Å; Y565-L567 PolarHBondContact O-N 3.41Å; L567-Y569 PolarHBondContact O-N 2.67Å; L567-G570 PolarHBondContact O-N 3.13Å; L567-G570 VanDerWaalsContact O-N 3.12Å; L567-V579 HydrophobicContact CB-CG1 3.73Å; L567-V579 HydrophobicContact CD1-CG1 4.08Å; L567-A583 HydrophobicContact CD1-CB 4.1Å; L567-I588 HydrophobicContact CD2-CG2 4.4Å; L567-I592 HydrophobicContact CD1-CD1 4.01Å; L567-Y599 HydrophobicContact CD1-CD1 3.97Å; L567-Y599 HydrophobicContact CD1-CE1 3.71Å; L567-I618 HydrophobicContact CD2-CB 4.37Å; L567-I618 HydrophobicContact CD2-CG1 4.15Å; L567-I618 HydrophobicContact CD2-CG2 4.16Å; L567-A621 HydrophobicContact CD2-CB 3.39Å; L567-L625 WeakPolarHBondContact O-CD1 3.45Å
568	Q	97.5	Very high	95.9	Very high	40 Å²	40	57.9 Å²	57.9	19%	0.187	28%	0.282	C	S	.	.	H	α-helix	trans	-57.9	-21.4	-179.5	-162.7	-174.8	38.2	0	0	112.5	F564 Y565 G570 N571 L572 A574 V579	F564-Q568 HydrophobicContact CE1-CB 4.3Å; F564-Q568 HydrophobicContact CE1-CG 4.46Å; F564-Q568 WeakPolarHBondContact O-CB 3.41Å; F564-Q568 PolarHBondContact O-N 3.41Å; Y565-Q568 PolarHBondContact O-N 3.08Å; Q568-G570 PolarHBondContact O-N 3.4Å; Q568-N571 CarbonylContact O-C 3.57Å; Q568-N571 WeakPolarHBondContact O-CA 3.4Å; Q568-N571 PolarHBondContact O-N 3.35Å; Q568-L572 PolarHBondContact O-N 2.88Å; Q568-A574 PolarHBondContact NE2-O 3.49Å; Q568-A574 VanDerWaalsContact NE2-O 3.07Å; Q568-V579 HydrophobicContact CB-CG2 3.98Å; Q568-V579 HydrophobicContact CG-CG2 3.97Å
569	Y	96.8	Very high	96.1	Very high	106 Å²	106	56.9 Å²	56.9	42%	0.416	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-24.7	175.2	-158.2	-93.8	0	0	0	114.2	F559 Y565 N566 L567 N571 L572	F559-Y569 AromaticContact CD2-CD2 3.95Å; F559-Y569 HydrophobicContact CD2-CD2 3.95Å; F559-Y569 HydrophobicContact CD2-CE2 4.13Å; F559-Y569 HydrophobicContact CD2-CG 4.18Å; F559-Y569 HydrophobicContact CE1-CE2 4.35Å; F559-Y569 AromaticContact CE2-CD1 3.62Å; F559-Y569 HydrophobicContact CE2-CD1 3.62Å; F559-Y569 AromaticContact CE2-CD2 3.49Å; F559-Y569 HydrophobicContact CE2-CD2 3.49Å; F559-Y569 VanDerWaalsContact CE2-CD2 3.49Å; F559-Y569 AromaticContact CE2-CE1 3.51Å; F559-Y569 HydrophobicContact CE2-CE1 3.51Å; F559-Y569 AromaticContact CE2-CE2 3.38Å; F559-Y569 HydrophobicContact CE2-CE2 3.38Å; F559-Y569 AromaticContact CE2-CG 3.61Å; F559-Y569 HydrophobicContact CE2-CG 3.61Å; F559-Y569 AromaticContact CE2-CZ 3.4Å; F559-Y569 HydrophobicContact CZ-CD1 4.29Å; F559-Y569 HydrophobicContact CZ-CD2 4.13Å; F559-Y569 AromaticContact CZ-CE1 3.7Å; F559-Y569 HydrophobicContact CZ-CE1 3.7Å; F559-Y569 AromaticContact CZ-CE2 3.52Å; F559-Y569 HydrophobicContact CZ-CE2 3.52Å; F559-Y569 HydrophobicContact CZ-CG 4.48Å; F559-Y569 AromaticContact CZ-CZ 3.27Å; F559-Y569 WeakPolarHBondContact CZ-OH 3.36Å; Y565-Y569 AromaticContact CE1-CD2 4Å; Y565-Y569 HydrophobicContact CE1-CD2 4Å; Y565-Y569 WeakPolarHBondContact O-CB 3.3Å; Y565-Y569 PolarHBondContact O-N 3.48Å; N566-Y569 WeakPolarHBondContact O-CB 3.28Å; L567-Y569 PolarHBondContact O-N 2.67Å; Y569-N571 VanDerWaalsContact C-N 3.27Å; Y569-N571 PolarHBondContact O-N 3.14Å; Y569-L572 HydrophobicContact CD2-CD2 4.44Å
570	G	94.2	Very high	96.2	Very high	17 Å²	17	57.9 Å²	57.9	18%	0.175	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-35.3	172.2	0	0	0	0	0	113.5	L567 Q568 R622	L567-G570 PolarHBondContact O-N 3.13Å; L567-G570 VanDerWaalsContact O-N 3.12Å; Q568-G570 PolarHBondContact O-N 3.4Å; G570-R622 WeakPolarHBondContact CA-O 3.28Å
571	N	95.9	Very high	96.3	Very high	55 Å²	55	56.1 Å²	56.1	29%	0.294	27%	0.271	S	S	.	.			trans	-155.3	103.2	172.3	175.9	5.4	0	0	0	109.4	Q568 Y569 K573 A574 L625	Q568-N571 CarbonylContact O-C 3.57Å; Q568-N571 WeakPolarHBondContact O-CA 3.4Å; Q568-N571 PolarHBondContact O-N 3.35Å; Y569-N571 VanDerWaalsContact C-N 3.27Å; Y569-N571 PolarHBondContact O-N 3.14Å; N571-K573 PolarHBondContact O-N 3.49Å; N571-K573 WeakPolarHBondContact OD1-CB 3.33Å; N571-K573 PolarHBondContact OD1-N 3.48Å; N571-A574 HydrophobicContact CB-CB 4.25Å; N571-A574 WeakPolarHBondContact O-CB 3.42Å; N571-A574 PolarHBondContact O-N 3.47Å; N571-L625 HydrophobicContact CB-CB 4.32Å; N571-L625 WeakPolarHBondContact CB-O 3.39Å
572	L	94.7	Very high	96.2	Very high	104 Å²	104	54.2 Å²	54.2	55%	0.545	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-9.9	-177.2	-65.1	177	0	0	0	114.2	Q568 Y569	Q568-L572 PolarHBondContact O-N 2.88Å; Y569-L572 HydrophobicContact CD2-CD2 4.44Å
573	K	95.4	Very high	96.2	Very high	192 Å²	192	53.2 Å²	53.2	84%	0.835	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-3.8	174.8	-59.3	178.7	-179	175.8	0	112.9	N571	N571-K573 PolarHBondContact O-N 3.49Å; N571-K573 WeakPolarHBondContact OD1-CB 3.33Å; N571-K573 PolarHBondContact OD1-N 3.48Å
574	A	95.9	Very high	96	Very high	4 Å²	4	60.7 Å²	60.7	3%	0.033	28%	0.283	C	S	.	.			trans	-66.1	140	-178.7	0	0	0	0	0	111.4	Q568 N571 E578 V579 L625	Q568-A574 PolarHBondContact NE2-O 3.49Å; Q568-A574 VanDerWaalsContact NE2-O 3.07Å; N571-A574 HydrophobicContact CB-CB 4.25Å; N571-A574 WeakPolarHBondContact O-CB 3.42Å; N571-A574 PolarHBondContact O-N 3.47Å; A574-E578 WeakPolarHBondContact CA-OE2 3.43Å; A574-E578 HydrophobicContact CB-CB 4.2Å; A574-E578 WeakPolarHBondContact CB-OE2 3.32Å; A574-V579 HydrophobicContact CB-CG2 4.23Å; A574-L625 HydrophobicContact CB-CD2 3.88Å
575	T	97.1	Very high	95.6	Very high	63 Å²	63	61.5 Å²	61.5	39%	0.387	29%	0.289	S	S	.	.			trans	-71.3	157.9	176.3	81.8	0	0	0	0	110.4	E577 E578 V579	T575-E577 WeakPolarHBondContact CB-OE2 3.33Å; T575-E577 PolarHBondContact O-N 2.92Å; T575-E577 PolarHBondContact OG1-N 3.27Å; T575-E577 PolarHBondContact OG1-OE2 2.9Å; T575-E578 PolarHBondContact N-OE2 2.71Å; T575-E578 VanDerWaalsContact N-OE2 3.11Å; T575-E578 PolarHBondContact O-N 3.49Å; T575-E578 VanDerWaalsContact O-N 3.12Å; T575-E578 PolarHBondContact OG1-N 2.95Å; T575-V579 WeakPolarHBondContact O-CG2 3.33Å; T575-V579 PolarHBondContact O-N 2.92Å; T575-V579 VanDerWaalsContact O-N 3.08Å
576	P	96.9	Very high	95.2	Very high	57 Å²	57	58.2 Å²	58.2	37%	0.37	28%	0.277	S	S	.	.	H	α-helix	trans	-52.6	-37.3	175.2	-27	36.1	0	0	0	113.2	F564 V579 Y580	F564-P576 HydrophobicContact CE2-CB 4.2Å; F564-P576 HydrophobicContact CZ-CB 4.25Å; F564-P576 HydrophobicContact CZ-CG 4.36Å; P576-V579 WeakPolarHBondContact O-CB 3.44Å; P576-V579 PolarHBondContact O-N 3.04Å; P576-Y580 HydrophobicContact CB-CE2 4.14Å; P576-Y580 WeakPolarHBondContact O-CD2 3.05Å; P576-Y580 PolarHBondContact O-N 3.46Å
577	E	97.1	Very high	94.8	Very high	122 Å²	122	61.4 Å²	61.4	57%	0.57	29%	0.294	S	S	*	.	H	α-helix	trans	-65.3	-42.8	178.7	-58.1	70.4	-150.6	0	0	111.6	T575 V579 Y580 E581	T575-E577 WeakPolarHBondContact CB-OE2 3.33Å; T575-E577 PolarHBondContact O-N 2.92Å; T575-E577 PolarHBondContact OG1-N 3.27Å; T575-E577 PolarHBondContact OG1-OE2 2.9Å; E577-V579 VanDerWaalsContact C-N 3.27Å; E577-V579 PolarHBondContact O-N 2.98Å; E577-Y580 PolarHBondContact O-N 3.35Å; E577-E581 PolarHBondContact O-N 2.98Å
578	E	96.4	Very high	94.5	Very high	63 Å²	63	61.5 Å²	61.5	29%	0.294	29%	0.294	S	S	.	.	H	α-helix	trans	-62.1	-38.1	174	-68.4	-173.8	122.3	0	0	111.4	A574 T575 E581 A582 L625 K627	A574-E578 WeakPolarHBondContact CA-OE2 3.43Å; A574-E578 HydrophobicContact CB-CB 4.2Å; A574-E578 WeakPolarHBondContact CB-OE2 3.32Å; T575-E578 PolarHBondContact N-OE2 2.71Å; T575-E578 VanDerWaalsContact N-OE2 3.11Å; T575-E578 PolarHBondContact O-N 3.49Å; T575-E578 VanDerWaalsContact O-N 3.12Å; T575-E578 PolarHBondContact OG1-N 2.95Å; E578-E581 PolarHBondContact O-N 3.24Å; E578-A582 WeakPolarHBondContact O-CB 3.28Å; E578-A582 PolarHBondContact O-N 2.65Å; E578-L625 HydrophobicContact CB-CD2 4.1Å; E578-L625 WeakPolarHBondContact O-CD2 3.41Å; E578-K627 IonicContact OE1-NZ 3.96Å; E578-K627 PolarHBondContact OE1-NZ 2.99Å
579	V	97.2	Very high	94.3	Very high	0 Å²	0	60 Å²	60	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-65.5	-44	176.9	176.3	0	0	0	0	111.2	F564 L567 Q568 A574 T575 P576 E577 A582 A583 L625	F564-V579 HydrophobicContact CD2-CG1 4.02Å; F564-V579 HydrophobicContact CE2-CB 4.04Å; F564-V579 HydrophobicContact CE2-CG1 3.89Å; F564-V579 HydrophobicContact CE2-CG2 4.34Å; F564-V579 HydrophobicContact CZ-CB 4.44Å; F564-V579 HydrophobicContact CZ-CG2 4.24Å; L567-V579 HydrophobicContact CB-CG1 3.73Å; L567-V579 HydrophobicContact CD1-CG1 4.08Å; Q568-V579 HydrophobicContact CB-CG2 3.98Å; Q568-V579 HydrophobicContact CG-CG2 3.97Å; A574-V579 HydrophobicContact CB-CG2 4.23Å; T575-V579 WeakPolarHBondContact O-CG2 3.33Å; T575-V579 PolarHBondContact O-N 2.92Å; T575-V579 VanDerWaalsContact O-N 3.08Å; P576-V579 WeakPolarHBondContact O-CB 3.44Å; P576-V579 PolarHBondContact O-N 3.04Å; E577-V579 VanDerWaalsContact C-N 3.27Å; E577-V579 PolarHBondContact O-N 2.98Å; V579-A582 PolarHBondContact O-N 2.94Å; V579-A583 WeakPolarHBondContact O-CB 3.36Å; V579-A583 PolarHBondContact O-N 3.36Å; V579-L625 HydrophobicContact CG2-CD1 4.2Å; V579-L625 HydrophobicContact CG2-CD2 4.46Å
580	Y	97	Very high	94.1	Very high	103 Å²	103	59.2 Å²	59.2	40%	0.404	29%	0.292	S	S	.	.	H	α-helix	trans	-66	-39.9	176.7	-60.2	-32.8	0	0	0	112.2	F564 P576 E577 A583 R584 Y599	F564-Y580 HydrophobicContact CD2-CE1 4.23Å; F564-Y580 HydrophobicContact CE2-CE1 4.22Å; P576-Y580 HydrophobicContact CB-CE2 4.14Å; P576-Y580 WeakPolarHBondContact O-CD2 3.05Å; P576-Y580 PolarHBondContact O-N 3.46Å; E577-Y580 PolarHBondContact O-N 3.35Å; Y580-A583 WeakPolarHBondContact O-CB 3.25Å; Y580-A583 PolarHBondContact O-N 2.92Å; Y580-R584 PolarHBondContact O-N 3.38Å; Y580-Y599 HydrophobicContact CD1-CD1 4.18Å; Y580-Y599 HydrophobicContact CD1-CD2 4.22Å; Y580-Y599 AromaticContact CD1-CE1 3.68Å; Y580-Y599 HydrophobicContact CD1-CE1 3.68Å; Y580-Y599 AromaticContact CD1-CE2 3.73Å; Y580-Y599 HydrophobicContact CD1-CE2 3.73Å; Y580-Y599 HydrophobicContact CD1-CG 4.43Å; Y580-Y599 AromaticContact CD1-CZ 3.44Å; Y580-Y599 VanDerWaalsContact CD1-CZ 3.44Å; Y580-Y599 AromaticContact CE1-CD1 3.96Å; Y580-Y599 HydrophobicContact CE1-CD1 3.96Å; Y580-Y599 AromaticContact CE1-CD2 3.74Å; Y580-Y599 HydrophobicContact CE1-CD2 3.74Å; Y580-Y599 AromaticContact CE1-CE1 3.94Å; Y580-Y599 HydrophobicContact CE1-CE1 3.94Å; Y580-Y599 AromaticContact CE1-CE2 3.73Å; Y580-Y599 HydrophobicContact CE1-CE2 3.73Å; Y580-Y599 AromaticContact CE1-CG 3.86Å; Y580-Y599 HydrophobicContact CE1-CG 3.86Å; Y580-Y599 AromaticContact CE1-CZ 3.83Å
581	E	94.2	Very high	94	Very high	73 Å²	73	59.4 Å²	59.4	34%	0.341	29%	0.291	S	S	.	.	H	α-helix	trans	-65.9	-42.5	176.2	-176	58.8	-171.6	0	0	111.2	E577 E578 A583 R584 L585	E577-E581 PolarHBondContact O-N 2.98Å; E578-E581 PolarHBondContact O-N 3.24Å; E581-A583 VanDerWaalsContact C-N 3.26Å; E581-A583 PolarHBondContact O-N 2.84Å; E581-R584 WeakPolarHBondContact O-CB 3.48Å; E581-R584 PolarHBondContact O-N 2.91Å; E581-R584 VanDerWaalsContact O-N 3.07Å; E581-R584 IonicContact OE1-CZ 3.58Å; E581-R584 IonicContact OE1-NE 3.19Å; E581-R584 PolarHBondContact OE1-NE 3.25Å; E581-R584 IonicContact OE1-NH2 2.76Å; E581-R584 PolarHBondContact OE1-NH2 3.1Å; E581-R584 IonicContact OE2-CZ 3.21Å; E581-R584 IonicContact OE2-NE 2.75Å; E581-R584 PolarHBondContact OE2-NE 3.25Å; E581-R584 IonicContact OE2-NH2 3.19Å; E581-R584 PolarHBondContact OE2-NH2 3.37Å; E581-L585 HydrophobicContact CG-CD1 4.29Å; E581-L585 HydrophobicContact CG-CG 4.34Å; E581-L585 WeakPolarHBondContact O-CG 3.33Å; E581-L585 PolarHBondContact O-N 2.98Å
582	A	93.6	Very high	93.9	Very high	5 Å²	5	56.8 Å²	56.8	4%	0.041	28%	0.278	C	S	.	.	H	α-helix	trans	-60.7	-36.3	173.6	0	0	0	0	0	112.4	E578 V579 S586 A621 L624 L625	E578-A582 WeakPolarHBondContact O-CB 3.28Å; E578-A582 PolarHBondContact O-N 2.65Å; V579-A582 PolarHBondContact O-N 2.94Å; A582-S586 WeakPolarHBondContact O-CB 3.44Å; A582-S586 PolarHBondContact O-N 3.45Å; A582-S586 PolarHBondContact O-OG 3.39Å; A582-A621 HydrophobicContact CB-CB 4.3Å; A582-L624 HydrophobicContact CB-CB 4.5Å; A582-L625 HydrophobicContact CB-CD1 4.04Å; A582-L625 HydrophobicContact CB-CD2 3.84Å; A582-L625 HydrophobicContact CB-CG 3.58Å
583	A	94.7	Very high	93.8	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-67.2	-35.1	174	0	0	0	0	0	112.7	L567 V579 Y580 E581 S586 N587 I588 A589 I592 Y599	L567-A583 HydrophobicContact CD1-CB 4.1Å; V579-A583 WeakPolarHBondContact O-CB 3.36Å; V579-A583 PolarHBondContact O-N 3.36Å; Y580-A583 WeakPolarHBondContact O-CB 3.25Å; Y580-A583 PolarHBondContact O-N 2.92Å; E581-A583 VanDerWaalsContact C-N 3.26Å; E581-A583 PolarHBondContact O-N 2.84Å; A583-S586 WeakPolarHBondContact CA-OG 3.25Å; A583-S586 PolarHBondContact O-OG 3.34Å; A583-N587 PolarHBondContact O-N 3.11Å; A583-I588 HydrophobicContact CB-CG2 3.8Å; A583-I588 WeakPolarHBondContact O-CG2 3.43Å; A583-I588 PolarHBondContact O-N 3.36Å; A583-A589 HydrophobicContact CB-CB 4.34Å; A583-A589 PolarHBondContact O-N 2.94Å; A583-A589 VanDerWaalsContact O-N 3.12Å; A583-I592 HydrophobicContact CB-CD1 4.47Å; A583-Y599 HydrophobicContact CB-CE1 4.07Å; A583-Y599 WeakPolarHBondContact CB-OH 3.33Å
584	R	92.4	Very high	93.7	Very high	158 Å²	158	59.1 Å²	59.1	60%	0.596	28%	0.279	S	S	*	.	H	α-helix	trans	-69.1	-49.6	175.1	-167.2	178.9	74.6	132.8	7	111.3	Y580 E581 S586 N587	Y580-R584 PolarHBondContact O-N 3.38Å; E581-R584 WeakPolarHBondContact O-CB 3.48Å; E581-R584 PolarHBondContact O-N 2.91Å; E581-R584 VanDerWaalsContact O-N 3.07Å; E581-R584 IonicContact OE1-CZ 3.58Å; E581-R584 IonicContact OE1-NE 3.19Å; E581-R584 PolarHBondContact OE1-NE 3.25Å; E581-R584 IonicContact OE1-NH2 2.76Å; E581-R584 PolarHBondContact OE1-NH2 3.1Å; E581-R584 IonicContact OE2-CZ 3.21Å; E581-R584 IonicContact OE2-NE 2.75Å; E581-R584 PolarHBondContact OE2-NE 3.25Å; E581-R584 IonicContact OE2-NH2 3.19Å; E581-R584 PolarHBondContact OE2-NH2 3.37Å; R584-S586 VanDerWaalsContact C-N 3.3Å; R584-S586 PolarHBondContact O-N 2.92Å; R584-N587 PolarHBondContact O-N 2.91Å
585	L	89.2	Confident	93.6	Very high	58 Å²	58	60 Å²	60	30%	0.304	28%	0.283	S	S	.	.	H	α-helix	trans	-62	-36.4	179.7	-67.2	-177.6	0	0	0	112.5	E581 N587 L624 V655	E581-L585 HydrophobicContact CG-CD1 4.29Å; E581-L585 HydrophobicContact CG-CG 4.34Å; E581-L585 WeakPolarHBondContact O-CG 3.33Å; E581-L585 PolarHBondContact O-N 2.98Å; L585-N587 VanDerWaalsContact C-N 3.26Å; L585-N587 PolarHBondContact O-N 3.37Å; L585-L624 HydrophobicContact CB-CD1 3.75Å; L585-L624 HydrophobicContact CD1-CD1 4.38Å; L585-V655 HydrophobicContact CD1-CG1 4.45Å; L585-V655 HydrophobicContact CD2-CG1 4.03Å
586	S	88.7	Confident	93.3	Very high	3 Å²	3	62.8 Å²	62.8	2%	0.021	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	1.6	174.9	60.1	0	0	0	0	114.4	A582 A583 R584 I588 R617	A582-S586 WeakPolarHBondContact O-CB 3.44Å; A582-S586 PolarHBondContact O-N 3.45Å; A582-S586 PolarHBondContact O-OG 3.39Å; A583-S586 WeakPolarHBondContact CA-OG 3.25Å; A583-S586 PolarHBondContact O-OG 3.34Å; R584-S586 VanDerWaalsContact C-N 3.3Å; R584-S586 PolarHBondContact O-N 2.92Å; S586-I588 VanDerWaalsContact C-N 3.26Å; S586-I588 PolarHBondContact O-N 3.39Å; S586-I588 WeakPolarHBondContact OG-CG2 3.39Å; S586-R617 WeakPolarHBondContact CB-O 3.46Å; S586-R617 WeakPolarHBondContact O-CB 3.42Å; S586-R617 WeakPolarHBondContact O-CD 3.4Å; S586-R617 VanDerWaalsContact O-CG 3.22Å; S586-R617 WeakPolarHBondContact O-CG 3.25Å
587	N	88.1	Confident	93.2	Very high	67 Å²	67	66.5 Å²	66.5	36%	0.358	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	31.4	-179.9	-164	36.3	0	0	0	114.2	A583 R584 L585 R617	A583-N587 PolarHBondContact O-N 3.11Å; R584-N587 PolarHBondContact O-N 2.91Å; L585-N587 VanDerWaalsContact C-N 3.26Å; L585-N587 PolarHBondContact O-N 3.37Å; N587-R617 VanDerWaalsContact O-CD 3.31Å; N587-R617 WeakPolarHBondContact O-CD 3.47Å
588	I	91.4	Very high	93.1	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.005	30%	0.296	C	S	.	.			trans	-100	-21	175	-164.9	62.8	0	0	0	112.6	L567 A583 S586 N590 A591 I592 E614 R617 I618	L567-I588 HydrophobicContact CD2-CG2 4.4Å; A583-I588 HydrophobicContact CB-CG2 3.8Å; A583-I588 WeakPolarHBondContact O-CG2 3.43Å; A583-I588 PolarHBondContact O-N 3.36Å; S586-I588 VanDerWaalsContact C-N 3.26Å; S586-I588 PolarHBondContact O-N 3.39Å; S586-I588 WeakPolarHBondContact OG-CG2 3.39Å; I588-N590 PolarHBondContact O-N 2.9Å; I588-A591 HydrophobicContact CD1-CB 4.01Å; I588-A591 WeakPolarHBondContact O-CB 3.24Å; I588-A591 PolarHBondContact O-N 3.4Å; I588-I592 HydrophobicContact CB-CD1 4.4Å; I588-I592 HydrophobicContact CG1-CD1 3.96Å; I588-I592 HydrophobicContact CG1-CG1 4.03Å; I588-I592 HydrophobicContact CG2-CD1 3.82Å; I588-I592 WeakPolarHBondContact O-CG1 3.4Å; I588-I592 PolarHBondContact O-N 2.89Å; I588-E614 HydrophobicContact CD1-CB 3.79Å; I588-E614 HydrophobicContact CD1-CG 3.81Å; I588-R617 HydrophobicContact CB-CB 3.92Å; I588-R617 HydrophobicContact CD1-CB 4.11Å; I588-R617 HydrophobicContact CG1-CB 4.34Å; I588-I618 HydrophobicContact CG1-CG1 4.27Å
589	A	94	Very high	93.1	Very high	9 Å²	9	60.2 Å²	60.2	7%	0.074	29%	0.289	C	S	.	.	H	α-helix	trans	-49.6	-51.1	-177.4	0	0	0	0	0	113.3	A583 A591 I592 E593	A583-A589 HydrophobicContact CB-CB 4.34Å; A583-A589 PolarHBondContact O-N 2.94Å; A583-A589 VanDerWaalsContact O-N 3.12Å; A589-A591 VanDerWaalsContact C-N 3.25Å; A589-A591 PolarHBondContact O-N 2.91Å; A589-I592 WeakPolarHBondContact O-CB 3.27Å; A589-I592 PolarHBondContact O-N 2.83Å; A589-E593 WeakPolarHBondContact O-CG 3.48Å; A589-E593 PolarHBondContact O-N 2.96Å
590	N	91.7	Very high	93	Very high	90 Å²	90	65.6 Å²	65.6	48%	0.481	32%	0.318	S	S	.	.	H	α-helix	trans	-59.7	-32.7	179	-66.3	-19.7	0	0	0	113.5	I588 R594	I588-N590 PolarHBondContact O-N 2.9Å; N590-R594 VanDerWaalsContact O-CG 3.32Å; N590-R594 WeakPolarHBondContact O-CG 3.41Å
591	A	91.8	Very high	93	Very high	20 Å²	20	61.1 Å²	61.1	17%	0.165	30%	0.301	C	S	.	.	H	α-helix	trans	-73.8	-39	177	0	0	0	0	0	110.8	I588 A589 R594 M595	I588-A591 HydrophobicContact CD1-CB 4.01Å; I588-A591 WeakPolarHBondContact O-CB 3.24Å; I588-A591 PolarHBondContact O-N 3.4Å; A589-A591 VanDerWaalsContact C-N 3.25Å; A589-A591 PolarHBondContact O-N 2.91Å; A591-R594 PolarHBondContact O-N 3.49Å; A591-M595 WeakPolarHBondContact O-CG 3.44Å
592	I	95.1	Very high	93	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-64.6	-45.2	176.9	-62.4	168.7	0	0	0	110.3	I563 L567 A583 I588 A589 R594 M595 G598 Y599	I563-I592 HydrophobicContact CD1-CG1 4.31Å; I563-I592 HydrophobicContact CG2-CD1 3.59Å; I563-I592 HydrophobicContact CG2-CG1 3.97Å; L567-I592 HydrophobicContact CD1-CD1 4.01Å; A583-I592 HydrophobicContact CB-CD1 4.47Å; I588-I592 HydrophobicContact CB-CD1 4.4Å; I588-I592 HydrophobicContact CG1-CD1 3.96Å; I588-I592 HydrophobicContact CG1-CG1 4.03Å; I588-I592 HydrophobicContact CG2-CD1 3.82Å; I588-I592 WeakPolarHBondContact O-CG1 3.4Å; I588-I592 PolarHBondContact O-N 2.89Å; A589-I592 WeakPolarHBondContact O-CB 3.27Å; A589-I592 PolarHBondContact O-N 2.83Å; I592-R594 PolarHBondContact O-N 2.65Å; I592-M595 VanDerWaalsContact O-CB 3.3Å; I592-M595 WeakPolarHBondContact O-CB 3.34Å; I592-M595 PolarHBondContact O-N 3.32Å; I592-G598 WeakPolarHBondContact O-CA 3.31Å; I592-Y599 HydrophobicContact CD1-CD1 4.17Å; I592-Y599 HydrophobicContact CD1-CE1 3.69Å; I592-Y599 HydrophobicContact CG2-CD1 3.99Å; I592-Y599 HydrophobicContact CG2-CD2 3.78Å; I592-Y599 HydrophobicContact CG2-CE1 4.15Å; I592-Y599 HydrophobicContact CG2-CE2 3.95Å; I592-Y599 HydrophobicContact CG2-CG 3.79Å
593	E	93	Very high	93	Very high	130 Å²	130	61.1 Å²	61.1	61%	0.607	30%	0.3	S	S	*	.	H	α-helix	trans	-62.3	-25.1	-179.7	-73	170.2	-170.1	0	0	113.7	A589 M595	A589-E593 WeakPolarHBondContact O-CG 3.48Å; A589-E593 PolarHBondContact O-N 2.96Å; E593-M595 VanDerWaalsContact C-N 3.3Å
594	R	93	Very high	92.7	Very high	214 Å²	214	61.7 Å²	61.7	81%	0.808	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-13.1	174.3	-69.1	171	-174	-177.6	1	113.3	N590 A591 I592	N590-R594 VanDerWaalsContact O-CG 3.32Å; N590-R594 WeakPolarHBondContact O-CG 3.41Å; A591-R594 PolarHBondContact O-N 3.49Å; I592-R594 PolarHBondContact O-N 2.65Å
595	M	93.9	Very high	92.1	Very high	23 Å²	23	63 Å²	63	11%	0.113	32%	0.319	C	S	.	.	S	Bend	trans	-79.7	143	179.5	-58.8	-178.9	-171.7	0	0	110.3	I563 A591 I592 E593 H597 G598 T601 L608 L610	I563-M595 HydrophobicContact CD1-CE 3.91Å; I563-M595 HydrophobicContact CD1-SD 3.33Å; I563-M595 WeakPolarHBondContact CD1-SD 3.33Å; A591-M595 WeakPolarHBondContact O-CG 3.44Å; I592-M595 VanDerWaalsContact O-CB 3.3Å; I592-M595 WeakPolarHBondContact O-CB 3.34Å; I592-M595 PolarHBondContact O-N 3.32Å; E593-M595 VanDerWaalsContact C-N 3.3Å; M595-H597 PolarHBondContact O-N 3.01Å; M595-G598 PolarHBondContact O-N 3.5Å; M595-T601 WeakPolarHBondContact CB-OG1 3.49Å; M595-T601 HydrophobicContact SD-CG2 3.88Å; M595-L608 HydrophobicContact CE-CD2 4.28Å; M595-L608 HydrophobicContact CG-CD2 4.5Å; M595-L608 HydrophobicContact SD-CD2 3.89Å; M595-L610 HydrophobicContact CE-CD2 3.47Å; M595-L610 VanDerWaalsContact CE-CD2 3.47Å; M595-L610 HydrophobicContact SD-CD2 4.43Å
596	P	90.7	Very high	91.3	Very high	121 Å²	121	69.8 Å²	69.8	79%	0.786	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-26.1	-177	-27.2	34.3	0	0	0	115.4
597	H	93.9	Very high	90.5	Very high	136 Å²	136	70.8 Å²	70.8	63%	0.63	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.7	11.9	-179.1	-57.8	-52.2	0	0	0	113.1	M595 Y599 D600	M595-H597 PolarHBondContact O-N 3.01Å; H597-Y599 PolarHBondContact O-N 3.47Å; H597-D600 HydrophobicContact CB-CB 4.47Å; H597-D600 WeakPolarHBondContact O-CB 3.39Å; H597-D600 PolarHBondContact O-N 3.49Å
598	G	95.4	Very high	90	Very high	18 Å²	18	71.7 Å²	71.7	19%	0.186	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	49.8	-128.2	-179.8	0	0	0	0	0	112.5	I592 M595 D600 T601	I592-G598 WeakPolarHBondContact O-CA 3.31Å; M595-G598 PolarHBondContact O-N 3.5Å; G598-D600 VanDerWaalsContact C-N 3.25Å; G598-D600 PolarHBondContact O-N 2.89Å; G598-T601 VanDerWaalsContact O-CB 3.29Å; G598-T601 WeakPolarHBondContact O-CB 3.34Å; G598-T601 PolarHBondContact O-N 2.95Å; G598-T601 PolarHBondContact O-OG1 3.24Å
599	Y	96.3	Very high	89.7	Confident	34 Å²	34	80.3 Å²	80.3	13%	0.133	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-66	-21.1	179.4	-74.3	-88.1	0	0	0	114.5	I563 F564 L567 Y580 A583 I592 H597 T601	I563-Y599 PolarHBondContact N-O 3.4Å; F564-Y599 HydrophobicContact CD2-CD1 4.48Å; F564-Y599 PolarHBondContact N-O 2.99Å; L567-Y599 HydrophobicContact CD1-CD1 3.97Å; L567-Y599 HydrophobicContact CD1-CE1 3.71Å; Y580-Y599 HydrophobicContact CD1-CD1 4.18Å; Y580-Y599 HydrophobicContact CD1-CD2 4.22Å; Y580-Y599 AromaticContact CD1-CE1 3.68Å; Y580-Y599 HydrophobicContact CD1-CE1 3.68Å; Y580-Y599 AromaticContact CD1-CE2 3.73Å; Y580-Y599 HydrophobicContact CD1-CE2 3.73Å; Y580-Y599 HydrophobicContact CD1-CG 4.43Å; Y580-Y599 AromaticContact CD1-CZ 3.44Å; Y580-Y599 VanDerWaalsContact CD1-CZ 3.44Å; Y580-Y599 AromaticContact CE1-CD1 3.96Å; Y580-Y599 HydrophobicContact CE1-CD1 3.96Å; Y580-Y599 AromaticContact CE1-CD2 3.74Å; Y580-Y599 HydrophobicContact CE1-CD2 3.74Å; Y580-Y599 AromaticContact CE1-CE1 3.94Å; Y580-Y599 HydrophobicContact CE1-CE1 3.94Å; Y580-Y599 AromaticContact CE1-CE2 3.73Å; Y580-Y599 HydrophobicContact CE1-CE2 3.73Å; Y580-Y599 AromaticContact CE1-CG 3.86Å; Y580-Y599 HydrophobicContact CE1-CG 3.86Å; Y580-Y599 AromaticContact CE1-CZ 3.83Å; A583-Y599 HydrophobicContact CB-CE1 4.07Å; A583-Y599 WeakPolarHBondContact CB-OH 3.33Å; I592-Y599 HydrophobicContact CD1-CD1 4.17Å; I592-Y599 HydrophobicContact CD1-CE1 3.69Å; I592-Y599 HydrophobicContact CG2-CD1 3.99Å; I592-Y599 HydrophobicContact CG2-CD2 3.78Å; I592-Y599 HydrophobicContact CG2-CE1 4.15Å; I592-Y599 HydrophobicContact CG2-CE2 3.95Å; I592-Y599 HydrophobicContact CG2-CG 3.79Å; H597-Y599 PolarHBondContact O-N 3.47Å; Y599-T601 VanDerWaalsContact C-N 3.27Å; Y599-T601 PolarHBondContact O-N 3.36Å
600	D	96	Very high	89.4	Confident	114 Å²	114	80.4 Å²	80.4	61%	0.61	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-83.7	-1.2	177.4	-66.9	-44.4	0	0	0	113.2	H597 G598 Q602	H597-D600 HydrophobicContact CB-CB 4.47Å; H597-D600 WeakPolarHBondContact O-CB 3.39Å; H597-D600 PolarHBondContact O-N 3.49Å; G598-D600 VanDerWaalsContact C-N 3.25Å; G598-D600 PolarHBondContact O-N 2.89Å; D600-Q602 PolarHBondContact O-N 3.08Å
601	T	95.6	Very high	89.2	Confident	9 Å²	9	78.9 Å²	78.9	6%	0.055	39%	0.389	C	S	.	.			trans	-57.7	124.5	176.4	-57.5	0	0	0	0	110.6	T562 I563 M595 G598 Y599 L608	T562-T601 CarbonylContact C-O 3.57Å; T562-T601 VanDerWaalsContact CA-O 3.32Å; T562-T601 WeakPolarHBondContact CA-O 3.4Å; I563-T601 HydrophobicContact CD1-CG2 4.37Å; I563-T601 PolarHBondContact N-O 2.95Å; M595-T601 WeakPolarHBondContact CB-OG1 3.49Å; M595-T601 HydrophobicContact SD-CG2 3.88Å; G598-T601 VanDerWaalsContact O-CB 3.29Å; G598-T601 WeakPolarHBondContact O-CB 3.34Å; G598-T601 PolarHBondContact O-N 2.95Å; G598-T601 PolarHBondContact O-OG1 3.24Å; Y599-T601 VanDerWaalsContact C-N 3.27Å; Y599-T601 PolarHBondContact O-N 3.36Å; T601-L608 HydrophobicContact CG2-CB 4.21Å; T601-L608 HydrophobicContact CG2-CD2 3.85Å
602	Q	94.6	Very high	88.9	Confident	77 Å²	77	79.6 Å²	79.6	36%	0.36	40%	0.398	S	S	.	.	B	Isolated β-bridge	trans	-77.4	126	178.5	-66.2	-69.9	-25.9	0	0	110.8	N561 T562 D600 L608	N561-Q602 VanDerWaalsContact CA-OE1 3.29Å; T562-Q602 VanDerWaalsContact CG2-NE2 3.3Å; D600-Q602 PolarHBondContact O-N 3.08Å; Q602-L608 PolarHBondContact O-N 2.9Å
603	V	93.4	Very high	88.4	Confident	0 Å²	0	79.9 Å²	79.9	0%	0	40%	0.402	C	S	.	.	B	Isolated β-bridge	trans	-119.9	-176.9	-179.7	-65.4	0	0	0	0	111.4	L558 H560 N561 I563 N566 L610	L558-V603 HydrophobicContact CB-CG2 4.27Å; L558-V603 HydrophobicContact CD1-CB 4.05Å; L558-V603 HydrophobicContact CD1-CG2 3.99Å; H560-V603 WeakPolarHBondContact CA-O 3.46Å; H560-V603 PolarHBondContact ND1-O 2.67Å; N561-V603 VanDerWaalsContact O-CG2 3.28Å; N561-V603 WeakPolarHBondContact O-CG2 3.24Å; N561-V603 PolarHBondContact O-N 2.87Å; I563-V603 HydrophobicContact CD1-CG1 4.04Å; I563-V603 HydrophobicContact CG1-CG1 3.6Å; I563-V603 HydrophobicContact CG1-CG2 4.26Å; N566-V603 WeakPolarHBondContact ND2-CG2 3.32Å; V603-L610 HydrophobicContact CG1-CD1 4.05Å; V603-L610 HydrophobicContact CG1-CD2 4.25Å; V603-L610 HydrophobicContact CG1-CG 3.99Å
604	G	88.9	Confident	88.3	Confident	13 Å²	13	75.7 Å²	75.7	13%	0.134	38%	0.382	C	S	.	.	S	Bend	trans	102.9	-170.8	-178.6	0	0	0	0	0	113.4	R606 G607	G604-R606 PolarHBondContact O-N 3.02Å; G604-R606 VanDerWaalsContact O-N 3.16Å; G604-G607 PolarHBondContact O-N 3.38Å; G604-G607 VanDerWaalsContact O-N 3.09Å
605	E	79.6	Confident	88.2	Confident	185 Å²	185	69.3 Å²	69.3	86%	0.864	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-34.5	-173.5	-69.3	-177.1	170.8	0	0	114.3
606	R	71.5	Confident	87.9	Confident	200 Å²	200	68.3 Å²	68.3	76%	0.755	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	7	179.6	-61.4	-176.9	-178.8	130.1	1.6	113.7	G604	G604-R606 PolarHBondContact O-N 3.02Å; G604-R606 VanDerWaalsContact O-N 3.16Å
607	G	72.8	Confident	87.8	Confident	24 Å²	24	64.3 Å²	64.3	25%	0.247	32%	0.324	C	S	.	.	S	Bend	trans	-106.1	-163.7	179.8	0	0	0	0	0	112.5	G604 K609	G604-G607 PolarHBondContact O-N 3.38Å; G604-G607 VanDerWaalsContact O-N 3.09Å; G607-K609 PolarHBondContact O-N 2.98Å
608	L	78.5	Confident	87.8	Confident	86 Å²	86	57.9 Å²	57.9	45%	0.45	29%	0.294	S	S	.	.	B	Isolated β-bridge	trans	-59.7	130.4	170.2	-177	70.3	0	0	0	109.6	M595 T601 Q602 L610	M595-L608 HydrophobicContact CE-CD2 4.28Å; M595-L608 HydrophobicContact CG-CD2 4.5Å; M595-L608 HydrophobicContact SD-CD2 3.89Å; T601-L608 HydrophobicContact CG2-CB 4.21Å; T601-L608 HydrophobicContact CG2-CD2 3.85Å; Q602-L608 PolarHBondContact O-N 2.9Å; L608-L610 HydrophobicContact CD2-CD2 4.08Å; L608-L610 HydrophobicContact CG-CD2 4.49Å; L608-L610 PolarHBondContact O-N 3.43Å
609	K	84.2	Confident	87.7	Confident	182 Å²	182	57.1 Å²	57.1	79%	0.791	29%	0.287	S	S	*	.			trans	-82	108.3	174.2	-68.6	-173.7	178.9	-179.7	0	109.2	G607	G607-K609 PolarHBondContact O-N 2.98Å
610	L	87.9	Confident	87.5	Confident	11 Å²	11	55.8 Å²	55.8	6%	0.058	28%	0.282	C	S	.	.			trans	-74.7	146.9	169.1	-59.4	-171.8	0	0	0	110.6	L558 M595 V603 L608 E614 K615 I618	L558-L610 HydrophobicContact CD1-CB 4.45Å; L558-L610 HydrophobicContact CD1-CD1 3.76Å; L558-L610 HydrophobicContact CD1-CG 4.21Å; M595-L610 HydrophobicContact CE-CD2 3.47Å; M595-L610 VanDerWaalsContact CE-CD2 3.47Å; M595-L610 HydrophobicContact SD-CD2 4.43Å; V603-L610 HydrophobicContact CG1-CD1 4.05Å; V603-L610 HydrophobicContact CG1-CD2 4.25Å; V603-L610 HydrophobicContact CG1-CG 3.99Å; L608-L610 HydrophobicContact CD2-CD2 4.08Å; L608-L610 HydrophobicContact CG-CD2 4.49Å; L608-L610 PolarHBondContact O-N 3.43Å; L610-E614 HydrophobicContact CB-CB 4.04Å; L610-K615 HydrophobicContact CB-CG 3.98Å; L610-K615 VanDerWaalsContact O-CE 3.32Å; L610-K615 WeakPolarHBondContact O-CE 3.18Å; L610-I618 HydrophobicContact CD1-CD1 3.31Å
611	S	87.8	Confident	87.4	Confident	59 Å²	59	50.3 Å²	50.3	41%	0.413	25%	0.253	S	S	.	.			trans	-61.9	158.7	172	65.3	0	0	0	0	111.3	G613 E614 K615	S611-G613 VanDerWaalsContact C-N 3.27Å; S611-G613 PolarHBondContact O-N 2.9Å; S611-E614 WeakPolarHBondContact CB-OE2 3.4Å; S611-E614 PolarHBondContact N-OE2 2.95Å; S611-E614 PolarHBondContact O-N 3.18Å; S611-E614 VanDerWaalsContact O-N 3.15Å; S611-E614 WeakPolarHBondContact OG-CB 3.45Å; S611-E614 WeakPolarHBondContact OG-CG 3.46Å; S611-E614 PolarHBondContact OG-N 3.46Å; S611-E614 PolarHBondContact OG-OE2 3.45Å; S611-K615 WeakPolarHBondContact O-CG 3.27Å; S611-K615 PolarHBondContact O-N 3.08Å
612	G	85.2	Confident	87.4	Confident	34 Å²	34	51.6 Å²	51.6	35%	0.351	26%	0.256	S	S	.	.	H	α-helix	trans	-53.9	-45	177.3	0	0	0	0	0	112.2	E614 K615 Q616 S639	G612-E614 PolarHBondContact O-N 3.01Å; G612-K615 PolarHBondContact O-N 2.69Å; G612-Q616 PolarHBondContact O-N 3.48Å; G612-S639 PolarHBondContact O-OG 3.13Å
613	G	85.2	Confident	87.3	Confident	8 Å²	8	48.4 Å²	48.4	8%	0.082	24%	0.243	C	C	.	.	H	α-helix	trans	-64.2	-37.1	177.2	0	0	0	0	0	114.8	S611 Q616 R617	S611-G613 VanDerWaalsContact C-N 3.27Å; S611-G613 PolarHBondContact O-N 2.9Å; G613-Q616 PolarHBondContact O-N 3.41Å; G613-R617 WeakPolarHBondContact O-CG 3.29Å; G613-R617 PolarHBondContact O-N 3.38Å
614	E	90	Very high	87.3	Confident	42 Å²	42	49.7 Å²	49.7	20%	0.196	25%	0.25	C	C	.	.	H	α-helix	trans	-68.7	-42.5	175.3	-73.1	164.1	150.8	0	0	112.2	I588 L610 S611 G612 Q616 R617 I618	I588-E614 HydrophobicContact CD1-CB 3.79Å; I588-E614 HydrophobicContact CD1-CG 3.81Å; L610-E614 HydrophobicContact CB-CB 4.04Å; S611-E614 WeakPolarHBondContact CB-OE2 3.4Å; S611-E614 PolarHBondContact N-OE2 2.95Å; S611-E614 PolarHBondContact O-N 3.18Å; S611-E614 VanDerWaalsContact O-N 3.15Å; S611-E614 WeakPolarHBondContact OG-CB 3.45Å; S611-E614 WeakPolarHBondContact OG-CG 3.46Å; S611-E614 PolarHBondContact OG-N 3.46Å; S611-E614 PolarHBondContact OG-OE2 3.45Å; G612-E614 PolarHBondContact O-N 3.01Å; E614-Q616 PolarHBondContact O-N 2.91Å; E614-R617 PolarHBondContact O-N 3.45Å; E614-I618 WeakPolarHBondContact O-CG1 3.43Å; E614-I618 PolarHBondContact O-N 3.08Å
615	K	90.5	Very high	87.6	Confident	79 Å²	79	49.3 Å²	49.3	34%	0.343	25%	0.245	S	C	.	.	H	α-helix	trans	-56.7	-42.2	173.5	-68.6	177.8	178.1	178.8	0	110.6	T556 L558 L610 S611 G612 I618 A619	T556-K615 HydrophobicContact CG2-CB 4.35Å; T556-K615 VanDerWaalsContact CG2-O 3.26Å; T556-K615 WeakPolarHBondContact CG2-O 3.15Å; L558-K615 HydrophobicContact CD1-CG 4.05Å; L558-K615 HydrophobicContact CG-CG 4.42Å; L610-K615 HydrophobicContact CB-CG 3.98Å; L610-K615 VanDerWaalsContact O-CE 3.32Å; L610-K615 WeakPolarHBondContact O-CE 3.18Å; S611-K615 WeakPolarHBondContact O-CG 3.27Å; S611-K615 PolarHBondContact O-N 3.08Å; G612-K615 PolarHBondContact O-N 2.69Å; K615-I618 WeakPolarHBondContact O-CB 3.09Å; K615-I618 PolarHBondContact O-N 2.94Å; K615-I618 VanDerWaalsContact O-N 3.15Å; K615-A619 PolarHBondContact O-N 3.34Å
616	Q	87.5	Confident	88.4	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.009	21%	0.214	C	C	.	.	H	α-helix	trans	-66	-41.9	-179.6	-155.5	59.3	14.6	0	0	113	I552 P553 T556 G612 G613 E614 I618 A619 I620 A636 L640	I552-Q616 VanDerWaalsContact CG2-NE2 3.29Å; P553-Q616 PolarHBondContact O-NE2 2.9Å; T556-Q616 PolarHBondContact OG1-OE1 3.24Å; G612-Q616 PolarHBondContact O-N 3.48Å; G613-Q616 PolarHBondContact O-N 3.41Å; E614-Q616 PolarHBondContact O-N 2.91Å; Q616-I618 PolarHBondContact O-N 3.26Å; Q616-A619 WeakPolarHBondContact O-CB 3.35Å; Q616-A619 PolarHBondContact O-N 3.48Å; Q616-I620 WeakPolarHBondContact O-CG1 3.26Å; Q616-I620 PolarHBondContact O-N 2.88Å; Q616-A636 WeakPolarHBondContact CG-O 3.32Å; Q616-A636 PolarHBondContact NE2-O 3.43Å; Q616-L640 HydrophobicContact CG-CD1 4.47Å
617	R	89.8	Confident	89.4	Confident	38 Å²	38	39.9 Å²	39.9	14%	0.143	21%	0.206	C	C	.	.	H	α-helix	trans	-60.7	-33.9	172.2	-69.6	-175	-80.3	-94.5	5.6	112.5	S586 N587 I588 G613 E614 I620 A621 I648	S586-R617 WeakPolarHBondContact CB-O 3.46Å; S586-R617 WeakPolarHBondContact O-CB 3.42Å; S586-R617 WeakPolarHBondContact O-CD 3.4Å; S586-R617 VanDerWaalsContact O-CG 3.22Å; S586-R617 WeakPolarHBondContact O-CG 3.25Å; N587-R617 VanDerWaalsContact O-CD 3.31Å; N587-R617 WeakPolarHBondContact O-CD 3.47Å; I588-R617 HydrophobicContact CB-CB 3.92Å; I588-R617 HydrophobicContact CD1-CB 4.11Å; I588-R617 HydrophobicContact CG1-CB 4.34Å; G613-R617 WeakPolarHBondContact O-CG 3.29Å; G613-R617 PolarHBondContact O-N 3.38Å; E614-R617 PolarHBondContact O-N 3.45Å; R617-I620 WeakPolarHBondContact O-CB 3.25Å; R617-I620 PolarHBondContact O-N 2.97Å; R617-A621 PolarHBondContact O-N 3.23Å; R617-I648 HydrophobicContact CG-CD1 4.11Å
618	I	93.8	Very high	90.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.6	-42.8	171.3	-67.5	171.4	0	0	0	111.4	L558 N566 L567 I588 L610 E614 K615 Q616 I620 A621 R622	L558-I618 HydrophobicContact CD1-CD1 4.34Å; L558-I618 HydrophobicContact CD2-CB 4.35Å; L558-I618 HydrophobicContact CD2-CD1 3.99Å; L558-I618 HydrophobicContact CD2-CG2 3.83Å; N566-I618 HydrophobicContact CB-CG2 4.4Å; L567-I618 HydrophobicContact CD2-CB 4.37Å; L567-I618 HydrophobicContact CD2-CG1 4.15Å; L567-I618 HydrophobicContact CD2-CG2 4.16Å; I588-I618 HydrophobicContact CG1-CG1 4.27Å; L610-I618 HydrophobicContact CD1-CD1 3.31Å; E614-I618 WeakPolarHBondContact O-CG1 3.43Å; E614-I618 PolarHBondContact O-N 3.08Å; K615-I618 WeakPolarHBondContact O-CB 3.09Å; K615-I618 PolarHBondContact O-N 2.94Å; K615-I618 VanDerWaalsContact O-N 3.15Å; Q616-I618 PolarHBondContact O-N 3.26Å; I618-I620 VanDerWaalsContact C-N 3.29Å; I618-I620 PolarHBondContact O-N 3.28Å; I618-A621 PolarHBondContact O-N 3.25Å; I618-R622 WeakPolarHBondContact O-CG 3.48Å; I618-R622 PolarHBondContact O-N 3.29Å
619	A	92.7	Very high	91.2	Very high	3 Å²	3	36 Å²	36	3%	0.025	18%	0.183	C	C	.	.	H	α-helix	trans	-61.9	-38.2	174.9	0	0	0	0	0	112.7	I552 T556 K615 Q616 R622 A623	I552-A619 HydrophobicContact CG2-CB 4.16Å; T556-A619 HydrophobicContact CG2-CB 3.71Å; T556-A619 WeakPolarHBondContact OG1-CB 3.42Å; K615-A619 PolarHBondContact O-N 3.34Å; Q616-A619 WeakPolarHBondContact O-CB 3.35Å; Q616-A619 PolarHBondContact O-N 3.48Å; A619-R622 WeakPolarHBondContact O-CB 3.34Å; A619-R622 PolarHBondContact O-N 2.85Å; A619-A623 PolarHBondContact O-N 3.32Å
620	I	91.1	Very high	91.8	Very high	5 Å²	5	27.3 Å²	27.3	3%	0.026	15%	0.145	C	C	.	.	H	α-helix	trans	-62.1	-47.9	174.5	-69.1	165.4	0	0	0	110.8	I552 Q616 R617 I618 R622 A623 L624 I648 L652	I552-I620 HydrophobicContact CD1-CG1 4.03Å; I552-I620 HydrophobicContact CG2-CG1 4.23Å; Q616-I620 WeakPolarHBondContact O-CG1 3.26Å; Q616-I620 PolarHBondContact O-N 2.88Å; R617-I620 WeakPolarHBondContact O-CB 3.25Å; R617-I620 PolarHBondContact O-N 2.97Å; I618-I620 VanDerWaalsContact C-N 3.29Å; I618-I620 PolarHBondContact O-N 3.28Å; I620-R622 VanDerWaalsContact C-N 3.28Å; I620-R622 PolarHBondContact O-N 3.4Å; I620-A623 WeakPolarHBondContact O-CB 3.37Å; I620-A623 PolarHBondContact O-N 2.88Å; I620-A623 VanDerWaalsContact O-N 3.09Å; I620-L624 HydrophobicContact CG2-CD1 4.3Å; I620-L624 WeakPolarHBondContact O-CG 3.34Å; I620-L624 PolarHBondContact O-N 3.02Å; I620-I648 HydrophobicContact CD1-CG2 3.33Å; I620-L652 HydrophobicContact CB-CD1 4.49Å; I620-L652 HydrophobicContact CD1-CD1 4.12Å; I620-L652 HydrophobicContact CG1-CD1 4.07Å; I620-L652 HydrophobicContact CG2-CD1 3.62Å; I620-L652 HydrophobicContact CG2-CD2 3.39Å; I620-L652 HydrophobicContact CG2-CG 3.96Å
621	A	94	Very high	92.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-58.6	-40.1	175.9	0	0	0	0	0	112.2	L567 A582 R617 I618 A623 L624 L625	L567-A621 HydrophobicContact CD2-CB 3.39Å; A582-A621 HydrophobicContact CB-CB 4.3Å; R617-A621 PolarHBondContact O-N 3.23Å; I618-A621 PolarHBondContact O-N 3.25Å; A621-A623 VanDerWaalsContact C-N 3.34Å; A621-A623 PolarHBondContact O-N 3.37Å; A621-L624 PolarHBondContact O-N 3.26Å; A621-L625 WeakPolarHBondContact O-CG 3.29Å; A621-L625 PolarHBondContact O-N 3.3Å
622	R	95.6	Very high	92.5	Very high	35 Å²	35	24.5 Å²	24.5	13%	0.132	13%	0.125	C	C	.	.	H	α-helix	trans	-60.6	-43.2	174	-70	170.2	179.4	167.4	-0.7	111.8	V557 N566 G570 I618 A619 I620 L625 K626	V557-R622 PolarHBondContact O-NH1 3.06Å; N566-R622 WeakPolarHBondContact O-CG 3.38Å; N566-R622 PolarHBondContact O-NE 2.99Å; N566-R622 PolarHBondContact O-NH2 2.95Å; N566-R622 PolarHBondContact OD1-NH2 3Å; G570-R622 WeakPolarHBondContact CA-O 3.28Å; I618-R622 WeakPolarHBondContact O-CG 3.48Å; I618-R622 PolarHBondContact O-N 3.29Å; A619-R622 WeakPolarHBondContact O-CB 3.34Å; A619-R622 PolarHBondContact O-N 2.85Å; I620-R622 VanDerWaalsContact C-N 3.28Å; I620-R622 PolarHBondContact O-N 3.4Å; R622-L625 PolarHBondContact O-N 3.4Å; R622-K626 WeakPolarHBondContact O-CB 3.38Å; R622-K626 PolarHBondContact O-N 3.44Å; R622-K626 VanDerWaalsContact O-N 3.11Å
623	A	93.6	Very high	92.8	Very high	11 Å²	11	23.2 Å²	23.2	9%	0.091	11%	0.11	C	C	.	.	H	α-helix	trans	-64.9	-41.9	178.2	0	0	0	0	0	111.8	A550 I552 A619 I620 A621 K626 K627 L631	A550-A623 HydrophobicContact CB-CB 4.15Å; I552-A623 HydrophobicContact CD1-CB 4.09Å; I552-A623 HydrophobicContact CG1-CB 3.69Å; A619-A623 PolarHBondContact O-N 3.32Å; I620-A623 WeakPolarHBondContact O-CB 3.37Å; I620-A623 PolarHBondContact O-N 2.88Å; I620-A623 VanDerWaalsContact O-N 3.09Å; A621-A623 VanDerWaalsContact C-N 3.34Å; A621-A623 PolarHBondContact O-N 3.37Å; A623-K626 WeakPolarHBondContact O-CB 3.23Å; A623-K626 PolarHBondContact O-N 2.79Å; A623-K627 PolarHBondContact O-N 3.37Å; A623-L631 HydrophobicContact CB-CD1 3.89Å
624	L	93.3	Very high	93.1	Very high	26 Å²	26	23.9 Å²	23.9	14%	0.136	11%	0.112	C	C	.	.	H	α-helix	trans	-61.5	-45.7	175.2	-71.3	175.8	0	0	0	112.2	A582 L585 I620 A621 K626 K627 L652 V655 T656	A582-L624 HydrophobicContact CB-CB 4.5Å; L585-L624 HydrophobicContact CB-CD1 3.75Å; L585-L624 HydrophobicContact CD1-CD1 4.38Å; I620-L624 HydrophobicContact CG2-CD1 4.3Å; I620-L624 WeakPolarHBondContact O-CG 3.34Å; I620-L624 PolarHBondContact O-N 3.02Å; A621-L624 PolarHBondContact O-N 3.26Å; L624-K626 PolarHBondContact O-N 3.37Å; L624-K627 VanDerWaalsContact O-CG 3.25Å; L624-K627 WeakPolarHBondContact O-CG 3.41Å; L624-K627 PolarHBondContact O-N 2.85Å; L624-L652 HydrophobicContact CD1-CD2 4Å; L624-L652 HydrophobicContact CD2-CD2 3.78Å; L624-L652 HydrophobicContact CG-CD2 4Å; L624-V655 HydrophobicContact CD2-CG2 3.93Å; L624-T656 HydrophobicContact CD2-CG2 3.9Å
625	L	95.5	Very high	92.8	Very high	5 Å²	5	23.1 Å²	23.1	3%	0.026	11%	0.108	C	C	.	.	H	α-helix	trans	-64.2	-30.1	178.3	-76.5	169.4	0	0	0	113	L567 N571 A574 E578 V579 A582 A621 R622 K627	L567-L625 WeakPolarHBondContact O-CD1 3.45Å; N571-L625 HydrophobicContact CB-CB 4.32Å; N571-L625 WeakPolarHBondContact CB-O 3.39Å; A574-L625 HydrophobicContact CB-CD2 3.88Å; E578-L625 HydrophobicContact CB-CD2 4.1Å; E578-L625 WeakPolarHBondContact O-CD2 3.41Å; V579-L625 HydrophobicContact CG2-CD1 4.2Å; V579-L625 HydrophobicContact CG2-CD2 4.46Å; A582-L625 HydrophobicContact CB-CD1 4.04Å; A582-L625 HydrophobicContact CB-CD2 3.84Å; A582-L625 HydrophobicContact CB-CG 3.58Å; A621-L625 WeakPolarHBondContact O-CG 3.29Å; A621-L625 PolarHBondContact O-N 3.3Å; R622-L625 PolarHBondContact O-N 3.4Å; L625-K627 VanDerWaalsContact C-N 3.3Å; L625-K627 PolarHBondContact O-N 3.31Å
626	K	95	Very high	91.8	Very high	49 Å²	49	19.6 Å²	19.6	21%	0.213	9%	0.094	C	C	.	.	H	α-helix	trans	-69.6	-26.5	177.5	-169.3	171.8	-179	179.6	0	112.9	R546 H547 I549 A550 R622 A623 L624 A628	R546-K626 WeakPolarHBondContact O-CE 3.43Å; R546-K626 PolarHBondContact O-NZ 3.4Å; H547-K626 WeakPolarHBondContact O-CE 3.33Å; I549-K626 WeakPolarHBondContact O-CE 3.49Å; I549-K626 PolarHBondContact O-NZ 2.99Å; A550-K626 HydrophobicContact CB-CB 4.49Å; A550-K626 HydrophobicContact CB-CD 4.12Å; R622-K626 WeakPolarHBondContact O-CB 3.38Å; R622-K626 PolarHBondContact O-N 3.44Å; R622-K626 VanDerWaalsContact O-N 3.11Å; A623-K626 WeakPolarHBondContact O-CB 3.23Å; A623-K626 PolarHBondContact O-N 2.79Å; L624-K626 PolarHBondContact O-N 3.37Å; K626-A628 HydrophobicContact CG-CB 4.46Å; K626-A628 PolarHBondContact O-N 3.5Å
627	K	92.6	Very high	90.9	Very high	138 Å²	138	20.1 Å²	20.1	60%	0.6	10%	0.097	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.7	38.2	176.8	-60.8	177.2	179.2	170.3	0	113.8	E578 A623 L624 L625	E578-K627 IonicContact OE1-NZ 3.96Å; E578-K627 PolarHBondContact OE1-NZ 2.99Å; A623-K627 PolarHBondContact O-N 3.37Å; L624-K627 VanDerWaalsContact O-CG 3.25Å; L624-K627 WeakPolarHBondContact O-CG 3.41Å; L624-K627 PolarHBondContact O-N 2.85Å; L625-K627 VanDerWaalsContact C-N 3.3Å; L625-K627 PolarHBondContact O-N 3.31Å
628	A	95.1	Very high	90	Very high	10 Å²	10	20.8 Å²	20.8	8%	0.083	11%	0.108	C	C	.	.			trans	-74.7	146.2	-178.8	0	0	0	0	0	112.3	A550 K626 I630	A550-A628 HydrophobicContact CB-CB 3.7Å; A550-A628 VanDerWaalsContact N-CB 3.32Å; K626-A628 HydrophobicContact CG-CB 4.46Å; K626-A628 PolarHBondContact O-N 3.5Å; A628-I630 VanDerWaalsContact C-N 3.26Å; A628-I630 PolarHBondContact O-N 3.26Å
629	P	95.7	Very high	88.9	Confident	18 Å²	18	23.8 Å²	23.8	12%	0.117	13%	0.128	C	C	.	.	S	Bend	trans	-71.4	-17.7	176.7	29.2	-36.8	0	0	0	114	I456 A548 V659 T660	I456-P629 HydrophobicContact CG2-CB 4.25Å; I456-P629 HydrophobicContact CG2-CG 3.84Å; A548-P629 HydrophobicContact CB-CG 4.35Å; A548-P629 VanDerWaalsContact O-CD 3.26Å; A548-P629 WeakPolarHBondContact O-CD 3.47Å; A548-P629 WeakPolarHBondContact O-CG 3.37Å; P629-V659 WeakPolarHBondContact O-CG1 3.29Å; P629-T660 PolarHBondContact O-N 3.2Å; P629-T660 VanDerWaalsContact O-N 3.12Å
630	I	96.6	Very high	88	Confident	1 Å²	1	24.1 Å²	24.1	1%	0.005	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	130	175.4	-58.9	166.7	0	0	0	108.9	V463 V532 A548 I549 A550 A628 I632 T660	V463-I630 HydrophobicContact CG2-CD1 3.89Å; V463-I630 HydrophobicContact CG2-CG1 4.47Å; V463-I630 HydrophobicContact CG2-CG2 4.13Å; V532-I630 HydrophobicContact CG1-CD1 3.45Å; V532-I630 VanDerWaalsContact CG1-CD1 3.45Å; A548-I630 PolarHBondContact O-N 2.85Å; I549-I630 WeakPolarHBondContact CA-O 3.22Å; I549-I630 HydrophobicContact CG1-CB 4.26Å; I549-I630 HydrophobicContact CG1-CD1 4.32Å; I549-I630 HydrophobicContact CG1-CG2 4.44Å; I549-I630 HydrophobicContact CG2-CG2 4.42Å; A550-I630 PolarHBondContact N-O 3.37Å; A628-I630 VanDerWaalsContact C-N 3.26Å; A628-I630 PolarHBondContact O-N 3.26Å; I630-I632 HydrophobicContact CG2-CG1 4.33Å; I630-T660 WeakPolarHBondContact CA-O 3.47Å
631	L	95.3	Very high	87.3	Confident	9 Å²	9	27.9 Å²	27.9	5%	0.047	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	126	177.6	-176.5	57.6	0	0	0	110.6	A550 I552 A623 Y633 V659 T660 S661 L662	A550-L631 HydrophobicContact CB-CD1 3.68Å; A550-L631 WeakPolarHBondContact O-CA 3.29Å; I552-L631 HydrophobicContact CD1-CD1 4.01Å; I552-L631 HydrophobicContact CG1-CD1 4.22Å; A623-L631 HydrophobicContact CB-CD1 3.89Å; L631-Y633 HydrophobicContact CB-CE2 4.41Å; L631-Y633 HydrophobicContact CD2-CE1 4.23Å; L631-Y633 HydrophobicContact CD2-CE2 3.79Å; L631-Y633 VanDerWaalsContact CD2-CZ 3.46Å; L631-Y633 WeakPolarHBondContact CD2-OH 3.35Å; L631-Y633 HydrophobicContact CG-CD2 4.33Å; L631-Y633 HydrophobicContact CG-CE2 3.7Å; L631-V659 HydrophobicContact CB-CG1 3.78Å; L631-T660 PolarHBondContact N-O 3.37Å; L631-S661 VanDerWaalsContact O-CA 3.3Å; L631-S661 WeakPolarHBondContact O-CA 3.31Å; L631-L662 PolarHBondContact O-N 3.37Å
632	I	94.7	Very high	86.1	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	127.5	179	-53.1	-180	0	0	0	109.5	V516 V519 I549 A550 V551 I552 I630 L662	V516-I632 HydrophobicContact CB-CG2 4.31Å; V516-I632 HydrophobicContact CG1-CD1 4.32Å; V516-I632 HydrophobicContact CG1-CG2 3.93Å; V516-I632 HydrophobicContact CG2-CG2 3.65Å; V519-I632 HydrophobicContact CB-CD1 4.19Å; V519-I632 HydrophobicContact CG1-CD1 3.92Å; I549-I632 HydrophobicContact CG2-CD1 3.66Å; I549-I632 HydrophobicContact CG2-CG1 3.99Å; A550-I632 PolarHBondContact O-N 3.49Å; V551-I632 WeakPolarHBondContact CA-O 3.45Å; V551-I632 HydrophobicContact CG2-CB 4.38Å; I552-I632 PolarHBondContact N-O 3.41Å; I630-I632 HydrophobicContact CG2-CG1 4.33Å; I632-L662 WeakPolarHBondContact CA-O 3.45Å; I632-L662 HydrophobicContact CG1-CB 4.26Å; I632-L662 HydrophobicContact CG2-CB 4.39Å; I632-L662 HydrophobicContact CG2-CD2 4.47Å
633	Y	91.6	Very high	85	Confident	7 Å²	7	34.8 Å²	34.8	3%	0.027	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	109.6	173.8	-54.8	-102.7	0	0	0	108.1	I552 L631 A636 L649 L652 L662 I663 I664	I552-Y633 HydrophobicContact CD1-CD1 3.64Å; I552-Y633 HydrophobicContact CD1-CE1 3.55Å; L631-Y633 HydrophobicContact CB-CE2 4.41Å; L631-Y633 HydrophobicContact CD2-CE1 4.23Å; L631-Y633 HydrophobicContact CD2-CE2 3.79Å; L631-Y633 VanDerWaalsContact CD2-CZ 3.46Å; L631-Y633 WeakPolarHBondContact CD2-OH 3.35Å; L631-Y633 HydrophobicContact CG-CD2 4.33Å; L631-Y633 HydrophobicContact CG-CE2 3.7Å; Y633-A636 HydrophobicContact CD1-CB 4.26Å; Y633-L649 HydrophobicContact CD1-CD2 3.68Å; Y633-L649 HydrophobicContact CE1-CD2 3.57Å; Y633-L652 HydrophobicContact CE1-CD1 3.98Å; Y633-L662 PolarHBondContact N-O 3.34Å; Y633-I663 HydrophobicContact CD2-CB 4.48Å; Y633-I663 HydrophobicContact CD2-CG1 3.69Å; Y633-I663 HydrophobicContact CE2-CG1 4.16Å; Y633-I663 HydrophobicContact CG-CG1 4.38Å; Y633-I664 WeakPolarHBondContact O-CB 3.23Å; Y633-I664 PolarHBondContact O-N 3.02Å
634	D	90.3	Very high	84.1	Confident	22 Å²	22	36.2 Å²	36.2	12%	0.118	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	90	179.5	-170.7	21.9	0	0	0	109.2	S513 V516 I552 P553 Q554 A636	S513-D634 PolarHBondContact OG-OD1 3.11Å; V516-D634 HydrophobicContact CG2-CB 4.04Å; I552-D634 PolarHBondContact O-N 3.43Å; P553-D634 CarbonylContact C-O 3.53Å; Q554-D634 WeakPolarHBondContact CA-O 3.3Å; Q554-D634 WeakPolarHBondContact CB-O 3.42Å; Q554-D634 PolarHBondContact N-O 3.02Å; D634-A636 PolarHBondContact O-N 2.95Å
635	E	83.9	Confident	83.1	Confident	26 Å²	26	35 Å²	35	12%	0.121	19%	0.193	C	C	.	.	S	Bend	trans	49.1	38.4	-176.8	-57.9	-169.4	-176	0	0	113.1	Q554 T637 S638 I664	Q554-E635 HydrophobicContact CB-CB 4.16Å; Q554-E635 HydrophobicContact CG-CB 4.02Å; Q554-E635 PolarHBondContact NE2-OE2 3.35Å; E635-T637 PolarHBondContact O-N 3.46Å; E635-S638 PolarHBondContact O-N 3.23Å; E635-S638 PolarHBondContact O-OG 2.93Å; E635-I664 WeakPolarHBondContact CA-O 3.34Å; E635-I664 HydrophobicContact CG-CG2 3.99Å; E635-I664 PolarHBondContact N-O 3.45Å
636	A	70.2	Confident	82	Confident	5 Å²	5	38.2 Å²	38.2	4%	0.041	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	11.6	-163.4	0	0	0	0	0	115.8	I552 Q616 Y633 D634	I552-A636 HydrophobicContact CB-CB 4.13Å; I552-A636 HydrophobicContact CG2-CB 3.56Å; Q616-A636 WeakPolarHBondContact CG-O 3.32Å; Q616-A636 PolarHBondContact NE2-O 3.43Å; Y633-A636 HydrophobicContact CD1-CB 4.26Å; D634-A636 PolarHBondContact O-N 2.95Å
637	T	68.7	Low	81.2	Confident	13 Å²	13	38.4 Å²	38.4	8%	0.08	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-153.5	4.8	-162.1	50.5	0	0	0	0	112.2	E635 S639 L640 E645 L649	E635-T637 PolarHBondContact O-N 3.46Å; T637-S639 PolarHBondContact O-N 2.88Å; T637-L640 HydrophobicContact CG2-CD1 4.4Å; T637-L640 PolarHBondContact O-N 3.22Å; T637-E645 WeakPolarHBondContact CB-OE1 3.45Å; T637-E645 WeakPolarHBondContact CB-OE2 3.33Å; T637-E645 HydrophobicContact CG2-CB 3.92Å; T637-E645 VanDerWaalsContact CG2-CD 3.44Å; T637-E645 HydrophobicContact CG2-CG 3.43Å; T637-E645 VanDerWaalsContact CG2-CG 3.43Å; T637-E645 VanDerWaalsContact CG2-OE1 3.32Å; T637-E645 WeakPolarHBondContact CG2-OE1 3.14Å; T637-E645 PolarHBondContact OG1-OE1 2.77Å; T637-E645 PolarHBondContact OG1-OE2 3.07Å; T637-L649 HydrophobicContact CG2-CD1 4.35Å; T637-L649 HydrophobicContact CG2-CG 4.45Å
638	S	70.9	Confident	80.4	Confident	53 Å²	53	32.4 Å²	32.4	37%	0.371	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-29.5	179.6	56.7	0	0	0	0	113.6	E635	E635-S638 PolarHBondContact O-N 3.23Å; E635-S638 PolarHBondContact O-OG 2.93Å
639	S	71.6	Confident	79.6	Confident	62 Å²	62	32.3 Å²	32.3	43%	0.434	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	1.7	177.2	69.1	0	0	0	0	115.3	G612 T637	G612-S639 PolarHBondContact O-OG 3.13Å; T637-S639 PolarHBondContact O-N 2.88Å
640	L	73.2	Confident	78.7	Confident	11 Å²	11	35.6 Å²	35.6	6%	0.058	20%	0.2	C	C	.	.	S	Bend	trans	-103.7	152.1	179.1	-69.3	171.3	0	0	0	110.4	Q616 T637 T644 E645 I648 R667	Q616-L640 HydrophobicContact CG-CD1 4.47Å; T637-L640 HydrophobicContact CG2-CD1 4.4Å; T637-L640 PolarHBondContact O-N 3.22Å; L640-T644 HydrophobicContact CD2-CG2 4.04Å; L640-E645 HydrophobicContact CB-CB 4.26Å; L640-I648 HydrophobicContact CD1-CD1 3.94Å; L640-R667 PolarHBondContact O-NH1 3.45Å; L640-R667 PolarHBondContact O-NH2 3.48Å
641	D	75.1	Confident	77.9	Confident	83 Å²	83	41.1 Å²	41.1	44%	0.444	22%	0.22	S	C	.	.			trans	-68.2	149.8	164.1	67.3	94.4	0	0	0	109.7	I643 T644 E645	D641-I643 PolarHBondContact O-N 3.34Å; D641-I643 VanDerWaalsContact O-N 3.16Å; D641-I643 PolarHBondContact OD1-N 3.11Å; D641-T644 PolarHBondContact O-N 2.73Å; D641-T644 PolarHBondContact OD1-N 3.35Å; D641-T644 PolarHBondContact OD1-OG1 3.24Å; D641-T644 VanDerWaalsContact OD1-OG1 3.06Å; D641-T644 WeakPolarHBondContact OD2-CB 3.48Å; D641-T644 PolarHBondContact OD2-OG1 3.48Å; D641-E645 WeakPolarHBondContact O-CB 3.42Å; D641-E645 PolarHBondContact O-N 3.4Å
642	S	69.6	Low	77.2	Confident	48 Å²	48	41 Å²	41	34%	0.336	22%	0.22	S	C	.	.	H	α-helix	trans	-61.6	-27.8	-170.7	-55.9	0	0	0	0	113.7	H646 R667	S642-H646 WeakPolarHBondContact O-CB 3.41Å; S642-H646 PolarHBondContact O-N 3.4Å; S642-R667 VanDerWaalsContact N-NH1 3.19Å; S642-R667 PolarHBondContact OG-NH1 2.83Å
643	I	73	Confident	76.6	Confident	133 Å²	133	42.1 Å²	42.1	68%	0.682	23%	0.23	S	C	*	.	H	α-helix	trans	-74.6	-48.7	-179.3	-60.1	173	0	0	0	109.8	D641 E645 H646 T647	D641-I643 PolarHBondContact O-N 3.34Å; D641-I643 VanDerWaalsContact O-N 3.16Å; D641-I643 PolarHBondContact OD1-N 3.11Å; I643-E645 VanDerWaalsContact C-N 3.28Å; I643-E645 PolarHBondContact O-N 2.88Å; I643-H646 PolarHBondContact O-N 2.93Å; I643-T647 WeakPolarHBondContact O-CB 3.38Å; I643-T647 PolarHBondContact O-N 3.24Å; I643-T647 PolarHBondContact O-OG1 2.84Å
644	T	74.3	Confident	76.2	Confident	41 Å²	41	47.6 Å²	47.6	25%	0.252	26%	0.255	S	S	.	.	H	α-helix	trans	-60.2	-41.9	175.3	-61.1	0	0	0	0	111	L640 D641 T647 I648	L640-T644 HydrophobicContact CD2-CG2 4.04Å; D641-T644 PolarHBondContact O-N 2.73Å; D641-T644 PolarHBondContact OD1-N 3.35Å; D641-T644 PolarHBondContact OD1-OG1 3.24Å; D641-T644 VanDerWaalsContact OD1-OG1 3.06Å; D641-T644 WeakPolarHBondContact OD2-CB 3.48Å; D641-T644 PolarHBondContact OD2-OG1 3.48Å; T644-T647 PolarHBondContact O-N 3.49Å; T644-I648 HydrophobicContact CG2-CD1 3.77Å; T644-I648 HydrophobicContact CG2-CG1 4.46Å; T644-I648 WeakPolarHBondContact O-CB 3.33Å; T644-I648 VanDerWaalsContact O-CG1 3.26Å; T644-I648 WeakPolarHBondContact O-CG1 3.48Å; T644-I648 PolarHBondContact O-N 3.18Å
645	E	72.1	Confident	75.9	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-57.1	-54.7	174.6	156.1	166.8	-156.3	0	0	112.1	T637 L640 D641 I643 T647 I648 L649 R667 T670	T637-E645 WeakPolarHBondContact CB-OE1 3.45Å; T637-E645 WeakPolarHBondContact CB-OE2 3.33Å; T637-E645 HydrophobicContact CG2-CB 3.92Å; T637-E645 VanDerWaalsContact CG2-CD 3.44Å; T637-E645 HydrophobicContact CG2-CG 3.43Å; T637-E645 VanDerWaalsContact CG2-CG 3.43Å; T637-E645 VanDerWaalsContact CG2-OE1 3.32Å; T637-E645 WeakPolarHBondContact CG2-OE1 3.14Å; T637-E645 PolarHBondContact OG1-OE1 2.77Å; T637-E645 PolarHBondContact OG1-OE2 3.07Å; L640-E645 HydrophobicContact CB-CB 4.26Å; D641-E645 WeakPolarHBondContact O-CB 3.42Å; D641-E645 PolarHBondContact O-N 3.4Å; I643-E645 VanDerWaalsContact C-N 3.28Å; I643-E645 PolarHBondContact O-N 2.88Å; E645-T647 VanDerWaalsContact C-N 3.28Å; E645-T647 PolarHBondContact O-N 3.38Å; E645-I648 PolarHBondContact O-N 3.43Å; E645-I648 VanDerWaalsContact O-N 3.13Å; E645-L649 HydrophobicContact CG-CD1 4.03Å; E645-L649 PolarHBondContact O-N 2.97Å; E645-R667 IonicContact OE2-NH1 2.73Å; E645-T670 HydrophobicContact CG-CG2 3.63Å; E645-T670 WeakPolarHBondContact OE1-CB 3.48Å; E645-T670 WeakPolarHBondContact OE1-CG2 3.47Å; E645-T670 PolarHBondContact OE1-OG1 2.91Å; E645-T670 VanDerWaalsContact OE2-CG2 3.29Å; E645-T670 WeakPolarHBondContact OE2-CG2 3.5Å
646	H	72.6	Confident	76	Confident	72 Å²	72	49.2 Å²	49.2	33%	0.333	27%	0.267	S	S	.	.	H	α-helix	trans	-59.2	-43.5	-177.9	-178	65.3	0	0	0	111.2	S642 I643 I648 L649 Q650	S642-H646 WeakPolarHBondContact O-CB 3.41Å; S642-H646 PolarHBondContact O-N 3.4Å; I643-H646 PolarHBondContact O-N 2.93Å; H646-I648 VanDerWaalsContact C-N 3.32Å; H646-I648 PolarHBondContact O-N 2.96Å; H646-L649 PolarHBondContact O-N 2.92Å; H646-Q650 VanDerWaalsContact O-CB 3.32Å; H646-Q650 WeakPolarHBondContact O-CB 3.39Å; H646-Q650 PolarHBondContact O-N 2.87Å
647	T	77.4	Confident	76.8	Confident	53 Å²	53	52.8 Å²	52.8	33%	0.325	29%	0.291	S	S	.	.	H	α-helix	trans	-59.8	-41.5	177.5	-54.1	0	0	0	0	112	I643 T644 E645 R651	I643-T647 WeakPolarHBondContact O-CB 3.38Å; I643-T647 PolarHBondContact O-N 3.24Å; I643-T647 PolarHBondContact O-OG1 2.84Å; T644-T647 PolarHBondContact O-N 3.49Å; E645-T647 VanDerWaalsContact C-N 3.28Å; E645-T647 PolarHBondContact O-N 3.38Å; T647-R651 WeakPolarHBondContact O-CB 3.19Å; T647-R651 VanDerWaalsContact O-CG 3.27Å; T647-R651 WeakPolarHBondContact O-CG 3.22Å; T647-R651 PolarHBondContact O-N 3.19Å; T647-R651 VanDerWaalsContact O-N 3.14Å
648	I	77.2	Confident	77.8	Confident	11 Å²	11	54.1 Å²	54.1	6%	0.056	31%	0.306	C	S	.	.	H	α-helix	trans	-69.9	-45.8	179.8	-74.4	171.8	0	0	0	111	R617 I620 L640 T644 E645 H646 R651 L652	R617-I648 HydrophobicContact CG-CD1 4.11Å; I620-I648 HydrophobicContact CD1-CG2 3.33Å; L640-I648 HydrophobicContact CD1-CD1 3.94Å; T644-I648 HydrophobicContact CG2-CD1 3.77Å; T644-I648 HydrophobicContact CG2-CG1 4.46Å; T644-I648 WeakPolarHBondContact O-CB 3.33Å; T644-I648 VanDerWaalsContact O-CG1 3.26Å; T644-I648 WeakPolarHBondContact O-CG1 3.48Å; T644-I648 PolarHBondContact O-N 3.18Å; E645-I648 PolarHBondContact O-N 3.43Å; E645-I648 VanDerWaalsContact O-N 3.13Å; H646-I648 VanDerWaalsContact C-N 3.32Å; H646-I648 PolarHBondContact O-N 2.96Å; I648-R651 PolarHBondContact O-N 3.43Å; I648-L652 HydrophobicContact CG2-CD1 4.05Å; I648-L652 WeakPolarHBondContact O-CG 3.5Å; I648-L652 PolarHBondContact O-N 2.86Å
649	L	76.9	Confident	78.9	Confident	9 Å²	9	52 Å²	52	5%	0.047	29%	0.291	C	S	.	.	H	α-helix	trans	-65.2	-40.8	-179.7	-69.7	177.7	0	0	0	111.8	Y633 T637 E645 H646 L652 A653	Y633-L649 HydrophobicContact CD1-CD2 3.68Å; Y633-L649 HydrophobicContact CE1-CD2 3.57Å; T637-L649 HydrophobicContact CG2-CD1 4.35Å; T637-L649 HydrophobicContact CG2-CG 4.45Å; E645-L649 HydrophobicContact CG-CD1 4.03Å; E645-L649 PolarHBondContact O-N 2.97Å; H646-L649 PolarHBondContact O-N 2.92Å; L649-L652 PolarHBondContact O-N 3.36Å; L649-A653 PolarHBondContact O-N 2.95Å
650	Q	78.4	Confident	80.1	Confident	87 Å²	87	49.1 Å²	49.1	41%	0.407	27%	0.271	S	S	.	.	H	α-helix	trans	-60.6	-50	175.2	-173.7	-171.7	-21	0	0	111.1	H646 L652 A653 E654	H646-Q650 VanDerWaalsContact O-CB 3.32Å; H646-Q650 WeakPolarHBondContact O-CB 3.39Å; H646-Q650 PolarHBondContact O-N 2.87Å; Q650-L652 VanDerWaalsContact C-N 3.25Å; Q650-L652 PolarHBondContact O-N 2.86Å; Q650-A653 WeakPolarHBondContact O-CB 3.32Å; Q650-A653 PolarHBondContact O-N 2.91Å; Q650-A653 VanDerWaalsContact O-N 3.14Å; Q650-E654 PolarHBondContact NE2-OE1 3.37Å; Q650-E654 VanDerWaalsContact NE2-OE1 3.12Å; Q650-E654 WeakPolarHBondContact O-CG 3.36Å; Q650-E654 PolarHBondContact O-N 2.61Å
651	R	80.1	Confident	81.1	Confident	116 Å²	116	48.8 Å²	48.8	44%	0.438	27%	0.27	S	S	.	.	H	α-helix	trans	-60	-36.6	176.8	-75.1	179.3	-176.1	-170.1	2.5	112.5	T647 I648 E654 V655	T647-R651 WeakPolarHBondContact O-CB 3.19Å; T647-R651 VanDerWaalsContact O-CG 3.27Å; T647-R651 WeakPolarHBondContact O-CG 3.22Å; T647-R651 PolarHBondContact O-N 3.19Å; T647-R651 VanDerWaalsContact O-N 3.14Å; I648-R651 PolarHBondContact O-N 3.43Å; R651-E654 PolarHBondContact O-N 3.16Å; R651-V655 WeakPolarHBondContact O-CG2 3.16Å; R651-V655 PolarHBondContact O-N 2.85Å
652	L	80.4	Confident	82	Confident	6 Å²	6	45 Å²	45	3%	0.031	25%	0.25	C	C	.	.	H	α-helix	trans	-64.4	-45.3	175.9	-76.4	170	0	0	0	111.7	I552 I620 L624 Y633 I648 L649 Q650 E654 V655 T656	I552-L652 HydrophobicContact CD1-CD1 4.49Å; I620-L652 HydrophobicContact CB-CD1 4.49Å; I620-L652 HydrophobicContact CD1-CD1 4.12Å; I620-L652 HydrophobicContact CG1-CD1 4.07Å; I620-L652 HydrophobicContact CG2-CD1 3.62Å; I620-L652 HydrophobicContact CG2-CD2 3.39Å; I620-L652 HydrophobicContact CG2-CG 3.96Å; L624-L652 HydrophobicContact CD1-CD2 4Å; L624-L652 HydrophobicContact CD2-CD2 3.78Å; L624-L652 HydrophobicContact CG-CD2 4Å; Y633-L652 HydrophobicContact CE1-CD1 3.98Å; I648-L652 HydrophobicContact CG2-CD1 4.05Å; I648-L652 WeakPolarHBondContact O-CG 3.5Å; I648-L652 PolarHBondContact O-N 2.86Å; L649-L652 PolarHBondContact O-N 3.36Å; Q650-L652 VanDerWaalsContact C-N 3.25Å; Q650-L652 PolarHBondContact O-N 2.86Å; L652-E654 VanDerWaalsContact C-N 3.25Å; L652-E654 PolarHBondContact O-N 3.42Å; L652-V655 HydrophobicContact CD2-CG2 4.44Å; L652-V655 WeakPolarHBondContact O-CG2 3.21Å; L652-V655 PolarHBondContact O-N 3.23Å; L652-V655 VanDerWaalsContact O-N 3.16Å; L652-T656 PolarHBondContact O-N 2.71Å; L652-T656 PolarHBondContact O-OG1 2.96Å
653	A	80.9	Confident	83.1	Confident	26 Å²	26	43 Å²	43	22%	0.215	24%	0.235	C	C	.	.	H	α-helix	trans	-58.5	-38.9	176.6	0	0	0	0	0	112	L649 Q650 V655	L649-A653 PolarHBondContact O-N 2.95Å; Q650-A653 WeakPolarHBondContact O-CB 3.32Å; Q650-A653 PolarHBondContact O-N 2.91Å; Q650-A653 VanDerWaalsContact O-N 3.14Å; A653-V655 PolarHBondContact O-N 2.86Å
654	E	83.5	Confident	84	Confident	121 Å²	121	36.8 Å²	36.8	57%	0.565	20%	0.203	S	C	*	.	H	α-helix	trans	-64.2	-36.7	177	-69.5	168	-168.7	0	0	113	Q650 R651 L652	Q650-E654 PolarHBondContact NE2-OE1 3.37Å; Q650-E654 VanDerWaalsContact NE2-OE1 3.12Å; Q650-E654 WeakPolarHBondContact O-CG 3.36Å; Q650-E654 PolarHBondContact O-N 2.61Å; R651-E654 PolarHBondContact O-N 3.16Å; L652-E654 VanDerWaalsContact C-N 3.25Å; L652-E654 PolarHBondContact O-N 3.42Å
655	V	84.3	Confident	84.4	Confident	60 Å²	60	35 Å²	35	36%	0.364	19%	0.193	S	C	.	.	H	α-helix	trans	-92.1	-8.7	-177.4	-57.5	0	0	0	0	114.3	L585 L624 R651 L652 A653 P657	L585-V655 HydrophobicContact CD1-CG1 4.45Å; L585-V655 HydrophobicContact CD2-CG1 4.03Å; L624-V655 HydrophobicContact CD2-CG2 3.93Å; R651-V655 WeakPolarHBondContact O-CG2 3.16Å; R651-V655 PolarHBondContact O-N 2.85Å; L652-V655 HydrophobicContact CD2-CG2 4.44Å; L652-V655 WeakPolarHBondContact O-CG2 3.21Å; L652-V655 PolarHBondContact O-N 3.23Å; L652-V655 VanDerWaalsContact O-N 3.16Å; A653-V655 PolarHBondContact O-N 2.86Å; V655-P657 WeakPolarHBondContact O-CD 3.33Å
656	T	86	Confident	84.7	Confident	22 Å²	22	39.6 Å²	39.6	14%	0.135	21%	0.214	C	C	.	.	S	Bend	trans	-120.4	57.2	176.7	63	0	0	0	0	113.2	L624 L652 G658 V659	L624-T656 HydrophobicContact CD2-CG2 3.9Å; L652-T656 PolarHBondContact O-N 2.71Å; L652-T656 PolarHBondContact O-OG1 2.96Å; T656-G658 PolarHBondContact O-N 3.45Å; T656-V659 WeakPolarHBondContact O-CB 3.11Å; T656-V659 PolarHBondContact O-N 3.32Å
657	P	86.3	Confident	85.1	Confident	81 Å²	81	39.7 Å²	39.7	53%	0.526	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	134.1	-178.2	27.2	-34.9	0	0	0	111.9	R458 V655 V659	R458-P657 PolarHBondContact NH1-O 2.93Å; V655-P657 WeakPolarHBondContact O-CD 3.33Å; P657-V659 VanDerWaalsContact C-N 3.28Å; P657-V659 PolarHBondContact O-N 3.48Å
658	G	90.1	Very high	85.5	Confident	40 Å²	40	37.3 Å²	37.3	41%	0.412	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	12.1	180	0	0	0	0	0	115	R458 T656	R458-G658 WeakPolarHBondContact CB-O 3.25Å; T656-G658 PolarHBondContact O-N 3.45Å
659	V	94.3	Very high	85.7	Confident	9 Å²	9	38.8 Å²	38.8	6%	0.055	21%	0.208	C	C	.	.			trans	-84.7	123.6	173.1	173.5	0	0	0	0	109.5	P629 L631 T656 P657 S661	P629-V659 WeakPolarHBondContact O-CG1 3.29Å; L631-V659 HydrophobicContact CB-CG1 3.78Å; T656-V659 WeakPolarHBondContact O-CB 3.11Å; T656-V659 PolarHBondContact O-N 3.32Å; P657-V659 VanDerWaalsContact C-N 3.28Å; P657-V659 PolarHBondContact O-N 3.48Å; V659-S661 PolarHBondContact O-N 3.38Å; V659-S661 PolarHBondContact O-OG 3.16Å; V659-S661 VanDerWaalsContact O-OG 3.12Å
660	T	96.3	Very high	85.9	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.012	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	124.2	176.5	-58.8	0	0	0	0	109.8	S461 V496 P498 G499 P629 I630 L631	S461-T660 WeakPolarHBondContact O-CB 3.34Å; S461-T660 WeakPolarHBondContact O-CG2 3.48Å; S461-T660 PolarHBondContact O-OG1 3.29Å; S461-T660 VanDerWaalsContact O-OG1 3.13Å; S461-T660 PolarHBondContact OG-OG1 3.29Å; V496-T660 HydrophobicContact CB-CG2 4.36Å; V496-T660 HydrophobicContact CG1-CG2 3.41Å; V496-T660 VanDerWaalsContact CG1-CG2 3.41Å; P498-T660 WeakPolarHBondContact CA-OG1 3.41Å; G499-T660 PolarHBondContact N-OG1 3Å; P629-T660 PolarHBondContact O-N 3.2Å; P629-T660 VanDerWaalsContact O-N 3.12Å; I630-T660 WeakPolarHBondContact CA-O 3.47Å; L631-T660 PolarHBondContact N-O 3.37Å
661	S	94.4	Very high	86.3	Confident	4 Å²	4	34.3 Å²	34.3	3%	0.028	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	125.5	-170.1	-62.7	0	0	0	0	111.8	Q500 R501 V502 L631 V659	Q500-S661 PolarHBondContact O-N 2.91Å; R501-S661 WeakPolarHBondContact CA-O 3.3Å; V502-S661 PolarHBondContact N-O 3.06Å; L631-S661 VanDerWaalsContact O-CA 3.3Å; L631-S661 WeakPolarHBondContact O-CA 3.31Å; V659-S661 PolarHBondContact O-N 3.38Å; V659-S661 PolarHBondContact O-OG 3.16Å; V659-S661 VanDerWaalsContact O-OG 3.12Å
662	L	94.3	Very high	86.6	Confident	4 Å²	4	32.4 Å²	32.4	2%	0.021	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	113.3	173.2	-172.2	65.4	0	0	0	109.5	V496 V502 I504 I515 L631 I632 Y633	V496-L662 HydrophobicContact CG2-CD1 4.14Å; V502-L662 HydrophobicContact CB-CD1 4.49Å; V502-L662 HydrophobicContact CG1-CD1 4.48Å; V502-L662 WeakPolarHBondContact O-CA 3.28Å; I504-L662 HydrophobicContact CD1-CD1 3.61Å; I504-L662 HydrophobicContact CD1-CD2 4.47Å; I504-L662 HydrophobicContact CD1-CG 4.32Å; I504-L662 HydrophobicContact CG1-CD1 3.88Å; I515-L662 HydrophobicContact CG2-CD2 3.84Å; L631-L662 PolarHBondContact O-N 3.37Å; I632-L662 WeakPolarHBondContact CA-O 3.45Å; I632-L662 HydrophobicContact CG1-CB 4.26Å; I632-L662 HydrophobicContact CG2-CB 4.39Å; I632-L662 HydrophobicContact CG2-CD2 4.47Å; Y633-L662 PolarHBondContact N-O 3.34Å
663	I	92.7	Very high	86.9	Confident	6 Å²	6	34.7 Å²	34.7	3%	0.031	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	106.8	-171.7	-51.3	170.4	0	0	0	110	V502 A503 I504 Y633 I671	V502-I663 PolarHBondContact O-N 3.39Å; A503-I663 CarbonylContact C-O 3.58Å; A503-I663 VanDerWaalsContact CA-O 3.22Å; A503-I663 WeakPolarHBondContact CA-O 3.38Å; A503-I663 HydrophobicContact CB-CB 4.4Å; I504-I663 PolarHBondContact N-O 2.95Å; Y633-I663 HydrophobicContact CD2-CB 4.48Å; Y633-I663 HydrophobicContact CD2-CG1 3.69Å; Y633-I663 HydrophobicContact CE2-CG1 4.16Å; Y633-I663 HydrophobicContact CG-CG1 4.38Å; I663-I671 HydrophobicContact CB-CG2 4.4Å; I663-I671 HydrophobicContact CG2-CG2 3.73Å
664	I	91.3	Very high	87.4	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	110.9	170.2	-64.6	163	0	0	0	107.9	I504 K512 V516 Y633 E635	I504-I664 HydrophobicContact CB-CG1 4.29Å; K512-I664 HydrophobicContact CB-CG2 3.6Å; K512-I664 HydrophobicContact CD-CG2 4.12Å; K512-I664 HydrophobicContact CG-CG2 4.45Å; K512-I664 WeakPolarHBondContact O-CD1 3.42Å; V516-I664 HydrophobicContact CG2-CD1 3.17Å; Y633-I664 WeakPolarHBondContact O-CB 3.23Å; Y633-I664 PolarHBondContact O-N 3.02Å; E635-I664 WeakPolarHBondContact CA-O 3.34Å; E635-I664 HydrophobicContact CG-CG2 3.99Å; E635-I664 PolarHBondContact N-O 3.45Å
665	A	83.3	Confident	87.8	Confident	4 Å²	4	32.3 Å²	32.3	3%	0.033	19%	0.186	C	C	.	.			trans	-115.7	137.6	-177	0	0	0	0	0	111.6	I504 I671	I504-A665 PolarHBondContact O-N 2.88Å; A665-I671 HydrophobicContact CB-CG2 3.41Å; A665-I671 VanDerWaalsContact CB-CG2 3.41Å
666	H	78.8	Confident	88.4	Confident	97 Å²	97	31.1 Å²	31.1	45%	0.449	18%	0.176	S	C	.	.	S	Bend	trans	-85.7	-42.3	163.6	-175.7	-83.7	0	0	0	110.7	Q709	H666-Q709 PolarHBondContact O-NE2 3.41Å
667	R	80	Confident	88.9	Confident	74 Å²	74	30 Å²	30	28%	0.279	17%	0.169	S	C	.	.	S	Bend	trans	-88.9	118.9	178.4	-65.1	-176.6	-175.8	165.5	14.4	109.8	L640 S642 E645 S669 T670	L640-R667 PolarHBondContact O-NH1 3.45Å; L640-R667 PolarHBondContact O-NH2 3.48Å; S642-R667 VanDerWaalsContact N-NH1 3.19Å; S642-R667 PolarHBondContact OG-NH1 2.83Å; E645-R667 IonicContact OE2-NH1 2.73Å; R667-S669 PolarHBondContact O-N 3.29Å; R667-T670 HydrophobicContact CB-CG2 3.79Å; R667-T670 PolarHBondContact O-N 3.49Å; R667-T670 PolarHBondContact O-OG1 2.73Å
668	L	85.2	Confident	89.3	Confident	2 Å²	2	26.2 Å²	26.2	1%	0.01	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-68.7	-22.7	-177.7	-62.1	176.2	0	0	0	112.8	V505 T670 I671 Y702 L705 W706	V505-L668 HydrophobicContact CB-CD2 3.81Å; V505-L668 HydrophobicContact CG1-CD2 3.54Å; V505-L668 HydrophobicContact CG2-CD2 4.12Å; L668-T670 PolarHBondContact O-N 2.84Å; L668-I671 HydrophobicContact CD2-CD1 4.18Å; L668-I671 WeakPolarHBondContact O-CG1 3.29Å; L668-I671 PolarHBondContact O-N 3.38Å; L668-Y702 HydrophobicContact CD1-CE2 4.3Å; L668-Y702 HydrophobicContact CD2-CD2 4.29Å; L668-Y702 HydrophobicContact CD2-CE2 3.69Å; L668-Y702 HydrophobicContact CG-CE2 4.44Å; L668-L705 HydrophobicContact CD1-CB 3.72Å; L668-W706 HydrophobicContact CB-CE3 3.48Å; L668-W706 VanDerWaalsContact CB-CE3 3.48Å; L668-W706 HydrophobicContact CB-CZ3 3.71Å; L668-W706 HydrophobicContact CD1-CB 4.01Å; L668-W706 HydrophobicContact CD1-CE3 4.12Å; L668-W706 HydrophobicContact CG-CE3 4.46Å
669	S	82.3	Confident	89.5	Confident	42 Å²	42	24.3 Å²	24.3	29%	0.294	13%	0.125	S	C	.	.	G	3₁₀ helix	trans	-64.3	-10.5	179.4	58.3	0	0	0	0	114.1	R667 I672	R667-S669 PolarHBondContact O-N 3.29Å; S669-I672 WeakPolarHBondContact O-CD1 3.36Å
670	T	80.7	Confident	89.3	Confident	2 Å²	2	24 Å²	24	1%	0.012	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-106.6	-1.4	-167.5	75.9	0	0	0	0	111.7	E645 R667 L668	E645-T670 HydrophobicContact CG-CG2 3.63Å; E645-T670 WeakPolarHBondContact OE1-CB 3.48Å; E645-T670 WeakPolarHBondContact OE1-CG2 3.47Å; E645-T670 PolarHBondContact OE1-OG1 2.91Å; E645-T670 VanDerWaalsContact OE2-CG2 3.29Å; E645-T670 WeakPolarHBondContact OE2-CG2 3.5Å; R667-T670 HydrophobicContact CB-CG2 3.79Å; R667-T670 PolarHBondContact O-N 3.49Å; R667-T670 PolarHBondContact O-OG1 2.73Å; L668-T670 PolarHBondContact O-N 2.84Å
671	I	86.7	Confident	89	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.143	C	C	.	.	S	Bend	trans	-125.1	17.8	178.8	59.3	150.8	0	0	0	112.1	A503 V505 I663 A665 L668 D673 A674 I677 Y702	A503-I671 HydrophobicContact CB-CB 3.63Å; A503-I671 HydrophobicContact CB-CD1 3.73Å; A503-I671 HydrophobicContact CB-CG1 4.31Å; A503-I671 HydrophobicContact CB-CG2 3.61Å; V505-I671 HydrophobicContact CG1-CD1 3.35Å; I663-I671 HydrophobicContact CB-CG2 4.4Å; I663-I671 HydrophobicContact CG2-CG2 3.73Å; A665-I671 HydrophobicContact CB-CG2 3.41Å; A665-I671 VanDerWaalsContact CB-CG2 3.41Å; L668-I671 HydrophobicContact CD2-CD1 4.18Å; L668-I671 WeakPolarHBondContact O-CG1 3.29Å; L668-I671 PolarHBondContact O-N 3.38Å; I671-D673 PolarHBondContact O-N 2.99Å; I671-A674 HydrophobicContact CB-CB 4.42Å; I671-A674 WeakPolarHBondContact O-CB 3.41Å; I671-A674 PolarHBondContact O-N 2.95Å; I671-I677 HydrophobicContact CD1-CD1 3.9Å; I671-I677 HydrophobicContact CD1-CG1 4.12Å; I671-I677 HydrophobicContact CD1-CG2 3.95Å; I671-Y702 HydrophobicContact CD1-CE2 4.21Å
672	I	87.3	Confident	88.4	Confident	76 Å²	76	35.7 Å²	35.7	39%	0.39	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-34.5	180	-64.7	172.1	0	0	0	110.5	S669 W706	S669-I672 WeakPolarHBondContact O-CD1 3.36Å; I672-W706 HydrophobicContact CD1-CH2 3.89Å; I672-W706 HydrophobicContact CG1-CH2 4.1Å; I672-W706 HydrophobicContact CG1-CZ3 4.28Å
673	D	86.4	Confident	87.8	Confident	55 Å²	55	35.7 Å²	35.7	29%	0.294	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	14.2	-178.2	68.5	-39	0	0	0	113.6	R501 I671	R501-D673 IonicContact CZ-OD2 2.84Å; R501-D673 IonicContact NH1-OD2 3.47Å; R501-D673 PolarHBondContact NH1-OD2 3.32Å; R501-D673 IonicContact NH2-OD1 2.81Å; R501-D673 IonicContact NH2-OD2 2.73Å; R501-D673 PolarHBondContact NH2-OD2 3.32Å; I671-D673 PolarHBondContact O-N 2.99Å
674	A	90.8	Very high	87.6	Confident	8 Å²	8	39.3 Å²	39.3	7%	0.066	19%	0.194	C	C	.	.			trans	-71.9	139.4	172.9	0	0	0	0	0	110.8	A503 I671 E676 I677	A503-A674 HydrophobicContact CB-CB 3.75Å; I671-A674 HydrophobicContact CB-CB 4.42Å; I671-A674 WeakPolarHBondContact O-CB 3.41Å; I671-A674 PolarHBondContact O-N 2.95Å; A674-E676 PolarHBondContact O-N 3.46Å; A674-I677 HydrophobicContact CB-CG1 4.15Å
675	D	93.3	Very high	87.6	Confident	89 Å²	89	40.7 Å²	40.7	48%	0.476	20%	0.202	S	C	.	.	S	Bend	trans	-64.4	-34.2	177.8	-59.4	-46.7	0	0	0	111	Q500 R501	Q500-D675 HydrophobicContact CG-CB 3.87Å; R501-D675 WeakPolarHBondContact CB-OD2 3.35Å; R501-D675 PolarHBondContact N-OD2 2.95Å; R501-D675 PolarHBondContact O-N 2.78Å
676	E	95.9	Very high	88	Confident	34 Å²	34	43.3 Å²	43.3	16%	0.159	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	142.6	174.2	-173.7	177.5	-163.7	0	0	110.4	Q500 R501 V502 A503 A674 L678	Q500-E676 PolarHBondContact NE2-OE2 3.02Å; R501-E676 PolarHBondContact O-N 2.79Å; V502-E676 CarbonylContact C-O 3.56Å; V502-E676 WeakPolarHBondContact CA-O 3.37Å; V502-E676 HydrophobicContact CG2-CB 4.29Å; A503-E676 PolarHBondContact N-O 3.09Å; A674-E676 PolarHBondContact O-N 3.46Å; E676-L678 HydrophobicContact CG-CD2 4.16Å
677	I	96	Very high	88.8	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	125	175.9	-56.3	174.7	0	0	0	107.9	A503 V505 I671 A674 R688 G689 H691 L694 Y702	A503-I677 HydrophobicContact CB-CG1 4.25Å; A503-I677 CarbonylContact O-C 3.31Å; A503-I677 WeakPolarHBondContact O-CA 3.4Å; V505-I677 HydrophobicContact CG1-CG2 4.5Å; V505-I677 HydrophobicContact CG2-CG2 3.77Å; I671-I677 HydrophobicContact CD1-CD1 3.9Å; I671-I677 HydrophobicContact CD1-CG1 4.12Å; I671-I677 HydrophobicContact CD1-CG2 3.95Å; A674-I677 HydrophobicContact CB-CG1 4.15Å; I677-R688 VanDerWaalsContact O-CA 3.27Å; I677-R688 WeakPolarHBondContact O-CA 3.12Å; I677-G689 WeakPolarHBondContact CB-O 3.37Å; I677-G689 PolarHBondContact N-O 3.07Å; I677-G689 PolarHBondContact O-N 3.26Å; I677-H691 HydrophobicContact CD1-CB 3.95Å; I677-L694 HydrophobicContact CB-CD1 3.77Å; I677-L694 HydrophobicContact CD1-CD1 4.43Å; I677-L694 HydrophobicContact CG2-CD1 3.94Å; I677-Y702 HydrophobicContact CD1-CE2 3.89Å; I677-Y702 HydrophobicContact CG2-CD2 4.04Å; I677-Y702 HydrophobicContact CG2-CE2 3.76Å
678	L	95.1	Very high	89.5	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	119.8	173.9	-54	179.4	0	0	0	109.4	F494 V502 A503 I504 V505 E676 V685 R688	F494-L678 HydrophobicContact CB-CD1 3.64Å; F494-L678 HydrophobicContact CD1-CD1 4.32Å; F494-L678 HydrophobicContact CD2-CD1 3.52Å; F494-L678 HydrophobicContact CE2-CD1 4.24Å; F494-L678 HydrophobicContact CG-CD1 3.57Å; V502-L678 HydrophobicContact CG1-CD1 3.67Å; V502-L678 HydrophobicContact CG1-CG 3.74Å; A503-L678 PolarHBondContact O-N 3.11Å; I504-L678 WeakPolarHBondContact CA-O 3.37Å; I504-L678 HydrophobicContact CG1-CB 4.38Å; I504-L678 HydrophobicContact CG1-CD1 4.41Å; V505-L678 PolarHBondContact N-O 3.36Å; E676-L678 HydrophobicContact CG-CD2 4.16Å; L678-V685 HydrophobicContact CB-CG1 4.24Å; L678-V685 HydrophobicContact CD2-CG1 4.15Å; L678-R688 HydrophobicContact CD2-CB 3.78Å
679	V	93.9	Very high	89.9	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	116	178.5	-171.2	0	0	0	0	108.8	V505 V685 S686 E687 L694 Y701 Y702	V505-V679 HydrophobicContact CG2-CB 4.35Å; V505-V679 HydrophobicContact CG2-CG1 4.4Å; V505-V679 HydrophobicContact CG2-CG2 3.95Å; V505-V679 CarbonylContact O-C 3.59Å; V679-V685 CarbonylContact O-C 3.55Å; V679-V685 WeakPolarHBondContact O-CA 3.23Å; V679-S686 PolarHBondContact O-N 3.44Å; V679-S686 PolarHBondContact O-OG 3.32Å; V679-E687 HydrophobicContact CB-CB 3.92Å; V679-E687 HydrophobicContact CG2-CB 3.81Å; V679-E687 PolarHBondContact N-O 3.13Å; V679-L694 HydrophobicContact CG2-CD1 4.19Å; V679-Y701 HydrophobicContact CG1-CD1 3.75Å; V679-Y702 HydrophobicContact CG2-CD2 4.07Å; V679-Y702 HydrophobicContact CG2-CG 4.47Å
680	L	91.8	Very high	90.5	Very high	1 Å²	1	44 Å²	44	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	127.8	177.3	-66.2	179.2	0	0	0	111.4	L492 I504 V505 G506 K512 I515 H684 V685	L492-L680 HydrophobicContact CD1-CD2 3.67Å; I504-L680 HydrophobicContact CG2-CD1 3.31Å; I504-L680 HydrophobicContact CG2-CG 3.75Å; V505-L680 PolarHBondContact O-N 3.12Å; G506-L680 WeakPolarHBondContact CA-O 3.37Å; K512-L680 HydrophobicContact CG-CD1 4.32Å; I515-L680 HydrophobicContact CD1-CD1 3.64Å; L680-H684 WeakPolarHBondContact CA-O 3.47Å; L680-V685 HydrophobicContact CD2-CG2 3.78Å
681	R	88.2	Confident	91.1	Very high	119 Å²	119	45.4 Å²	45.4	45%	0.449	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	133.2	174	-166.3	175.9	-179.6	-169.1	-0.3	109.3	G683 H684	R681-G683 PolarHBondContact O-N 3.12Å; R681-H684 PolarHBondContact N-O 3.26Å; R681-H684 PolarHBondContact O-N 3.27Å; R681-H684 VanDerWaalsContact O-O 3.13Å
682	N	82.3	Confident	91.4	Very high	134 Å²	134	49.4 Å²	49.4	72%	0.717	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	31.9	179.1	-59.8	-28.9	0	0	0	114.7	H684	N682-H684 PolarHBondContact O-CD2 3.04Å; N682-H684 VanDerWaalsContact O-CD2 3.26Å
683	G	81.5	Confident	91.8	Very high	3 Å²	3	47.9 Å²	47.9	3%	0.031	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.7	5.6	179	0	0	0	0	0	115.8	L488 Y489 R681	L488-G683 VanDerWaalsContact O-CA 3.23Å; L488-G683 WeakPolarHBondContact O-CA 3.44Å; Y489-G683 WeakPolarHBondContact CD1-O 3.41Å; R681-G683 PolarHBondContact O-N 3.12Å
684	H	88.1	Confident	92.1	Very high	83 Å²	83	45.2 Å²	45.2	38%	0.384	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	160.1	177.8	-56.1	-91.6	0	0	0	111.5	D490 L680 R681 N682 S686	D490-H684 PolarHBondContact O-CE1 3.18Å; L680-H684 WeakPolarHBondContact CA-O 3.47Å; R681-H684 PolarHBondContact N-O 3.26Å; R681-H684 PolarHBondContact O-N 3.27Å; R681-H684 VanDerWaalsContact O-O 3.13Å; N682-H684 PolarHBondContact O-CD2 3.04Å; N682-H684 VanDerWaalsContact O-CD2 3.26Å; H684-S686 PolarHBondContact O-N 3.41Å
685	V	92.4	Very high	92.3	Very high	31 Å²	31	47 Å²	47	19%	0.188	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	107	167.8	179.7	0	0	0	0	108	L492 F494 L678 V679 L680 E687	L492-V685 HydrophobicContact CD1-CG2 3.82Å; F494-V685 HydrophobicContact CB-CG2 4.32Å; F494-V685 HydrophobicContact CD1-CG2 4.27Å; L678-V685 HydrophobicContact CB-CG1 4.24Å; L678-V685 HydrophobicContact CD2-CG1 4.15Å; V679-V685 CarbonylContact O-C 3.55Å; V679-V685 WeakPolarHBondContact O-CA 3.23Å; L680-V685 HydrophobicContact CD2-CG2 3.78Å; V685-E687 WeakPolarHBondContact CG1-O 3.38Å
686	S	92.1	Very high	92.2	Very high	58 Å²	58	46.6 Å²	46.6	41%	0.406	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-35.9	179.8	60.2	0	0	0	0	112.6	V679 H684	V679-S686 PolarHBondContact O-N 3.44Å; V679-S686 PolarHBondContact O-OG 3.32Å; H684-S686 PolarHBondContact O-N 3.41Å
687	E	93.9	Very high	92.1	Very high	32 Å²	32	48.6 Å²	48.6	15%	0.15	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	150.3	-178.9	-64.4	163.8	-151.2	0	0	110.2	V679 V685 L694 S700 Y701 Y702	V679-E687 HydrophobicContact CB-CB 3.92Å; V679-E687 HydrophobicContact CG2-CB 3.81Å; V679-E687 PolarHBondContact N-O 3.13Å; V685-E687 WeakPolarHBondContact CG1-O 3.38Å; E687-L694 HydrophobicContact CB-CD2 3.88Å; E687-S700 WeakPolarHBondContact OE2-CB 3.28Å; E687-S700 PolarHBondContact OE2-OG 3.34Å; E687-Y701 WeakPolarHBondContact OE1-CA 3.01Å; E687-Y701 WeakPolarHBondContact OE1-CB 3.27Å; E687-Y701 PolarHBondContact OE1-N 2.95Å; E687-Y701 PolarHBondContact OE2-N 3.11Å; E687-Y702 PolarHBondContact OE2-N 3.21Å
688	R	94.9	Very high	91.6	Very high	125 Å²	125	53.3 Å²	53.3	47%	0.472	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	143	173.2	61	176.2	61.4	-161.1	-0.7	111.4	I677 L678	I677-R688 VanDerWaalsContact O-CA 3.27Å; I677-R688 WeakPolarHBondContact O-CA 3.12Å; L678-R688 HydrophobicContact CD2-CB 3.78Å
689	G	94.1	Very high	91.3	Very high	17 Å²	17	60.3 Å²	60.3	18%	0.175	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.7	-175.5	176.4	0	0	0	0	0	112.5	I677	I677-G689 WeakPolarHBondContact CB-O 3.37Å; I677-G689 PolarHBondContact N-O 3.07Å; I677-G689 PolarHBondContact O-N 3.26Å
690	T	95.3	Very high	91.1	Very high	57 Å²	57	60.3 Å²	60.3	35%	0.35	33%	0.331	S	S	.	.			trans	-77	163.1	172.3	61.9	0	0	0	0	111	S692 S693 L694	T690-S692 VanDerWaalsContact C-N 3.29Å; T690-S692 PolarHBondContact O-N 3.23Å; T690-S692 PolarHBondContact OG1-OG 3.22Å; T690-S693 PolarHBondContact O-N 3.41Å; T690-S693 VanDerWaalsContact O-N 3.16Å; T690-S693 VanDerWaalsContact OG1-CB 3.32Å; T690-S693 WeakPolarHBondContact OG1-CB 3.23Å; T690-S693 PolarHBondContact OG1-N 2.81Å; T690-L694 WeakPolarHBondContact O-CG 3.47Å; T690-L694 PolarHBondContact O-N 2.84Å
691	H	93.5	Very high	91.1	Very high	30 Å²	30	60.8 Å²	60.8	14%	0.139	33%	0.333	C	S	.	.	H	α-helix	trans	-50.6	-47.5	174.8	176.6	71.8	0	0	0	112.7	I677 L695 Y702 W706	I677-H691 HydrophobicContact CD1-CB 3.95Å; H691-L695 WeakPolarHBondContact CE1-CD1 3.22Å; H691-L695 VanDerWaalsContact NE2-CD1 3.27Å; H691-L695 WeakPolarHBondContact NE2-CD1 3.23Å; H691-L695 WeakPolarHBondContact O-CB 2.85Å; H691-L695 WeakPolarHBondContact O-CG 3.11Å; H691-L695 PolarHBondContact O-N 3.27Å; H691-L695 VanDerWaalsContact O-N 3.07Å; H691-Y702 AromaticContact ND1-CE1 3.56Å; H691-Y702 AromaticContact ND1-CZ 3.64Å; H691-Y702 PolarHBondContact ND1-OH 2.9Å; H691-W706 AromaticContact CE1-CE3 3.68Å; H691-W706 AromaticContact CE1-CH2 3.56Å; H691-W706 AromaticContact CE1-CZ2 3.91Å; H691-W706 AromaticContact CE1-CZ3 3.42Å; H691-W706 VanDerWaalsContact CE1-CZ3 3.42Å; H691-W706 WeakPolarHBondContact CE1-CZ3 3.49Å
692	S	93.9	Very high	91.3	Very high	84 Å²	84	55.1 Å²	55.1	59%	0.587	31%	0.311	S	S	*	.	H	α-helix	trans	-65.8	-41.5	179.3	52.5	0	0	0	0	112.7	T690 S696	T690-S692 VanDerWaalsContact C-N 3.29Å; T690-S692 PolarHBondContact O-N 3.23Å; T690-S692 PolarHBondContact OG1-OG 3.22Å; S692-S696 WeakPolarHBondContact O-CB 2.91Å; S692-S696 PolarHBondContact O-N 3.35Å; S692-S696 VanDerWaalsContact O-N 3.1Å
693	S	94.7	Very high	91.8	Very high	44 Å²	44	53.2 Å²	53.2	31%	0.308	29%	0.294	S	S	.	.	H	α-helix	trans	-63.6	-47.7	178.1	-179.9	0	0	0	0	111.4	T690 L695 S696 Q697	T690-S693 PolarHBondContact O-N 3.41Å; T690-S693 VanDerWaalsContact O-N 3.16Å; T690-S693 VanDerWaalsContact OG1-CB 3.32Å; T690-S693 WeakPolarHBondContact OG1-CB 3.23Å; T690-S693 PolarHBondContact OG1-N 2.81Å; S693-L695 PolarHBondContact O-N 3.34Å; S693-S696 PolarHBondContact O-N 3.17Å; S693-S696 PolarHBondContact O-OG 3.45Å; S693-Q697 PolarHBondContact O-N 3.43Å
694	L	93.8	Very high	92.2	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66.4	-38.1	-179.7	-68.6	174.8	0	0	0	112.5	I677 V679 E687 T690 S696 Q697 S700 Y702	I677-L694 HydrophobicContact CB-CD1 3.77Å; I677-L694 HydrophobicContact CD1-CD1 4.43Å; I677-L694 HydrophobicContact CG2-CD1 3.94Å; V679-L694 HydrophobicContact CG2-CD1 4.19Å; E687-L694 HydrophobicContact CB-CD2 3.88Å; T690-L694 WeakPolarHBondContact O-CG 3.47Å; T690-L694 PolarHBondContact O-N 2.84Å; L694-S696 VanDerWaalsContact C-N 3.31Å; L694-S696 PolarHBondContact O-N 3.19Å; L694-Q697 PolarHBondContact O-N 3.09Å; L694-S700 VanDerWaalsContact O-CB 3.23Å; L694-S700 WeakPolarHBondContact O-CB 3.48Å; L694-S700 PolarHBondContact O-OG 3.08Å; L694-Y702 HydrophobicContact CB-CD1 3.61Å; L694-Y702 HydrophobicContact CB-CE1 4.32Å; L694-Y702 HydrophobicContact CB-CG 3.86Å; L694-Y702 HydrophobicContact CD1-CD1 4.27Å; L694-Y702 HydrophobicContact CD1-CD2 3.96Å; L694-Y702 HydrophobicContact CD1-CE2 4.45Å; L694-Y702 HydrophobicContact CD1-CG 3.86Å; L694-Y702 HydrophobicContact CG-CG 4.47Å
695	L	93.3	Very high	92.1	Very high	45 Å²	45	54.3 Å²	54.3	24%	0.236	30%	0.299	C	S	.	.	H	α-helix	trans	-68.2	-28.6	174.6	-74.8	-175.4	0	0	0	113.8	H691 S693 Q697 Y702 R703 W706	H691-L695 WeakPolarHBondContact CE1-CD1 3.22Å; H691-L695 VanDerWaalsContact NE2-CD1 3.27Å; H691-L695 WeakPolarHBondContact NE2-CD1 3.23Å; H691-L695 WeakPolarHBondContact O-CB 2.85Å; H691-L695 WeakPolarHBondContact O-CG 3.11Å; H691-L695 PolarHBondContact O-N 3.27Å; H691-L695 VanDerWaalsContact O-N 3.07Å; S693-L695 PolarHBondContact O-N 3.34Å; L695-Q697 VanDerWaalsContact C-N 3.27Å; L695-Q697 PolarHBondContact O-N 3.07Å; L695-Y702 HydrophobicContact CD2-CD1 4.14Å; L695-Y702 HydrophobicContact CD2-CE1 4.12Å; L695-Y702 HydrophobicContact CG-CD1 4.41Å; L695-Y702 HydrophobicContact CG-CE1 4.17Å; L695-R703 HydrophobicContact CD2-CB 4.24Å; L695-R703 HydrophobicContact CD2-CG 4.21Å; L695-W706 HydrophobicContact CD2-CB 3.92Å; L695-W706 HydrophobicContact CD2-CD2 4.41Å; L695-W706 HydrophobicContact CD2-CG 3.78Å
696	S	92.8	Very high	92	Very high	81 Å²	81	55.1 Å²	55.1	57%	0.566	30%	0.299	S	S	*	.	H	α-helix	trans	-71	-24.1	179.9	76.4	0	0	0	0	113.1	S692 S693 L694 P698	S692-S696 WeakPolarHBondContact O-CB 2.91Å; S692-S696 PolarHBondContact O-N 3.35Å; S692-S696 VanDerWaalsContact O-N 3.1Å; S693-S696 PolarHBondContact O-N 3.17Å; S693-S696 PolarHBondContact O-OG 3.45Å; L694-S696 VanDerWaalsContact C-N 3.31Å; L694-S696 PolarHBondContact O-N 3.19Å; S696-P698 WeakPolarHBondContact O-CD 3.28Å
697	Q	92.4	Very high	91.9	Very high	76 Å²	76	56.1 Å²	56.1	36%	0.355	30%	0.3	S	S	.	.	S	Bend	trans	-75.7	121.7	179.4	-67.7	173.4	17.6	0	0	110.1	S693 L694 L695 D699 S700 R703	S693-Q697 PolarHBondContact O-N 3.43Å; L694-Q697 PolarHBondContact O-N 3.09Å; L695-Q697 VanDerWaalsContact C-N 3.27Å; L695-Q697 PolarHBondContact O-N 3.07Å; Q697-D699 VanDerWaalsContact C-N 3.35Å; Q697-D699 PolarHBondContact O-N 3.03Å; Q697-S700 PolarHBondContact O-N 3.32Å; Q697-R703 WeakPolarHBondContact O-CD 3.25Å
698	P	85.9	Confident	91.4	Very high	99 Å²	99	57.4 Å²	57.4	64%	0.643	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-42.4	-176.7	-24.9	34.2	0	0	0	113.7	S696	S696-P698 WeakPolarHBondContact O-CD 3.28Å
699	D	88.3	Confident	90.9	Very high	147 Å²	147	55.3 Å²	55.3	79%	0.786	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	11.8	-173.4	-58.7	-41.6	0	0	0	113.4	Q697 Y701	Q697-D699 VanDerWaalsContact C-N 3.35Å; Q697-D699 PolarHBondContact O-N 3.03Å; D699-Y701 PolarHBondContact O-N 3.26Å
700	S	90.6	Very high	90.3	Very high	1 Å²	1	64.4 Å²	64.4	1%	0.007	33%	0.33	C	S	.	.			trans	-65.4	129.9	-179.6	163.7	0	0	0	0	111.7	E687 L694 Q697 Y702 R703 Q704	E687-S700 WeakPolarHBondContact OE2-CB 3.28Å; E687-S700 PolarHBondContact OE2-OG 3.34Å; L694-S700 VanDerWaalsContact O-CB 3.23Å; L694-S700 WeakPolarHBondContact O-CB 3.48Å; L694-S700 PolarHBondContact O-OG 3.08Å; Q697-S700 PolarHBondContact O-N 3.32Å; S700-Y702 VanDerWaalsContact C-N 3.28Å; S700-Y702 PolarHBondContact O-N 2.59Å; S700-Y702 VanDerWaalsContact OG-CB 3.3Å; S700-Y702 WeakPolarHBondContact OG-CB 3.34Å; S700-Y702 PolarHBondContact OG-N 2.77Å; S700-Y702 VanDerWaalsContact OG-N 3.1Å; S700-R703 WeakPolarHBondContact O-CB 3.41Å; S700-R703 PolarHBondContact O-N 3.35Å; S700-R703 PolarHBondContact OG-N 3.25Å; S700-Q704 PolarHBondContact O-N 2.86Å; S700-Q704 VanDerWaalsContact O-N 3.17Å
701	Y	90.8	Very high	89.3	Confident	10 Å²	10	64.9 Å²	64.9	4%	0.039	34%	0.336	C	S	.	.	H	α-helix	trans	-63	-36.1	171	-169.2	-115.5	0	0	0	111.7	E507 V679 E687 D699 R703 Q704 L705	E507-Y701 HydrophobicContact CG-CE1 4.26Å; E507-Y701 WeakPolarHBondContact CG-OH 3.45Å; E507-Y701 PolarHBondContact OE1-OH 3.21Å; V679-Y701 HydrophobicContact CG1-CD1 3.75Å; E687-Y701 WeakPolarHBondContact OE1-CA 3.01Å; E687-Y701 WeakPolarHBondContact OE1-CB 3.27Å; E687-Y701 PolarHBondContact OE1-N 2.95Å; E687-Y701 PolarHBondContact OE2-N 3.11Å; D699-Y701 PolarHBondContact O-N 3.26Å; Y701-R703 VanDerWaalsContact C-N 3.31Å; Y701-R703 PolarHBondContact O-N 3.34Å; Y701-Q704 WeakPolarHBondContact O-CB 3.44Å; Y701-Q704 PolarHBondContact O-N 3.25Å; Y701-L705 HydrophobicContact CD1-CD1 3.94Å; Y701-L705 HydrophobicContact CD1-CG 4.27Å; Y701-L705 HydrophobicContact CE1-CD1 3.6Å; Y701-L705 HydrophobicContact CE1-CD2 4.13Å; Y701-L705 HydrophobicContact CE1-CG 3.84Å; Y701-L705 WeakPolarHBondContact O-CG 3.37Å; Y701-L705 PolarHBondContact O-N 3.44Å
702	Y	93.1	Very high	87.8	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-56.8	-44.9	171.1	-176.3	-92.9	0	0	0	112	V505 L668 I671 I677 V679 E687 H691 L694 L695 S700 Q704 L705 W706	V505-Y702 HydrophobicContact CG2-CD2 3.98Å; V505-Y702 HydrophobicContact CG2-CE2 4.2Å; L668-Y702 HydrophobicContact CD1-CE2 4.3Å; L668-Y702 HydrophobicContact CD2-CD2 4.29Å; L668-Y702 HydrophobicContact CD2-CE2 3.69Å; L668-Y702 HydrophobicContact CG-CE2 4.44Å; I671-Y702 HydrophobicContact CD1-CE2 4.21Å; I677-Y702 HydrophobicContact CD1-CE2 3.89Å; I677-Y702 HydrophobicContact CG2-CD2 4.04Å; I677-Y702 HydrophobicContact CG2-CE2 3.76Å; V679-Y702 HydrophobicContact CG2-CD2 4.07Å; V679-Y702 HydrophobicContact CG2-CG 4.47Å; E687-Y702 PolarHBondContact OE2-N 3.21Å; H691-Y702 AromaticContact ND1-CE1 3.56Å; H691-Y702 AromaticContact ND1-CZ 3.64Å; H691-Y702 PolarHBondContact ND1-OH 2.9Å; L694-Y702 HydrophobicContact CB-CD1 3.61Å; L694-Y702 HydrophobicContact CB-CE1 4.32Å; L694-Y702 HydrophobicContact CB-CG 3.86Å; L694-Y702 HydrophobicContact CD1-CD1 4.27Å; L694-Y702 HydrophobicContact CD1-CD2 3.96Å; L694-Y702 HydrophobicContact CD1-CE2 4.45Å; L694-Y702 HydrophobicContact CD1-CG 3.86Å; L694-Y702 HydrophobicContact CG-CG 4.47Å; L695-Y702 HydrophobicContact CD2-CD1 4.14Å; L695-Y702 HydrophobicContact CD2-CE1 4.12Å; L695-Y702 HydrophobicContact CG-CD1 4.41Å; L695-Y702 HydrophobicContact CG-CE1 4.17Å; S700-Y702 VanDerWaalsContact C-N 3.28Å; S700-Y702 PolarHBondContact O-N 2.59Å; S700-Y702 VanDerWaalsContact OG-CB 3.3Å; S700-Y702 WeakPolarHBondContact OG-CB 3.34Å; S700-Y702 PolarHBondContact OG-N 2.77Å; S700-Y702 VanDerWaalsContact OG-N 3.1Å; Y702-Q704 VanDerWaalsContact C-N 3.32Å; Y702-Q704 PolarHBondContact O-N 3.28Å; Y702-L705 PolarHBondContact O-N 3.39Å; Y702-W706 WeakPolarHBondContact O-CB 3.47Å; Y702-W706 PolarHBondContact O-N 2.99Å
703	R	92.4	Very high	85.3	Confident	95 Å²	95	68.6 Å²	68.6	36%	0.358	37%	0.365	S	S	.	.	H	α-helix	trans	-61.8	-39.6	176.9	-176.7	-179.2	179.6	169.3	-3.9	112	L695 Q697 S700 Y701 W706 N707	L695-R703 HydrophobicContact CD2-CB 4.24Å; L695-R703 HydrophobicContact CD2-CG 4.21Å; Q697-R703 WeakPolarHBondContact O-CD 3.25Å; S700-R703 WeakPolarHBondContact O-CB 3.41Å; S700-R703 PolarHBondContact O-N 3.35Å; S700-R703 PolarHBondContact OG-N 3.25Å; Y701-R703 VanDerWaalsContact C-N 3.31Å; Y701-R703 PolarHBondContact O-N 3.34Å; R703-W706 PolarHBondContact O-N 2.98Å; R703-N707 WeakPolarHBondContact O-CB 3.41Å; R703-N707 VanDerWaalsContact O-CG 3.27Å; R703-N707 PolarHBondContact O-N 3.26Å; R703-N707 PolarHBondContact O-ND2 3.31Å
704	Q	89.6	Confident	82.7	Confident	93 Å²	93	73.9 Å²	73.9	44%	0.435	39%	0.389	S	S	.	.	H	α-helix	trans	-62.7	-49.3	175.1	-65.1	175.6	16.9	0	0	111.4	S700 Y701 Y702 W706 N707 Q708	S700-Q704 PolarHBondContact O-N 2.86Å; S700-Q704 VanDerWaalsContact O-N 3.17Å; Y701-Q704 WeakPolarHBondContact O-CB 3.44Å; Y701-Q704 PolarHBondContact O-N 3.25Å; Y702-Q704 VanDerWaalsContact C-N 3.32Å; Y702-Q704 PolarHBondContact O-N 3.28Å; Q704-W706 VanDerWaalsContact C-N 3.29Å; Q704-W706 PolarHBondContact O-N 3.04Å; Q704-N707 PolarHBondContact O-N 3.47Å; Q704-Q708 VanDerWaalsContact O-CG 3.28Å; Q704-Q708 WeakPolarHBondContact O-CG 3.29Å; Q704-Q708 PolarHBondContact O-N 3.46Å
705	L	87.4	Confident	80.1	Confident	15 Å²	15	77.6 Å²	77.6	8%	0.079	41%	0.413	C	S	.	.	H	α-helix	trans	-58.9	-40.9	175.9	-70.3	175.1	0	0	0	111.8	L668 Y701 Y702 Q708 Q709	L668-L705 HydrophobicContact CD1-CB 3.72Å; Y701-L705 HydrophobicContact CD1-CD1 3.94Å; Y701-L705 HydrophobicContact CD1-CG 4.27Å; Y701-L705 HydrophobicContact CE1-CD1 3.6Å; Y701-L705 HydrophobicContact CE1-CD2 4.13Å; Y701-L705 HydrophobicContact CE1-CG 3.84Å; Y701-L705 WeakPolarHBondContact O-CG 3.37Å; Y701-L705 PolarHBondContact O-N 3.44Å; Y702-L705 PolarHBondContact O-N 3.39Å; L705-Q708 PolarHBondContact O-N 2.72Å; L705-Q709 WeakPolarHBondContact O-CG 3.36Å; L705-Q709 PolarHBondContact O-N 3.39Å
706	W	89.6	Confident	77.4	Confident	49 Å²	49	81.8 Å²	81.8	19%	0.186	44%	0.441	C	S	.	.	H	α-helix	trans	-60.9	-48.2	176.9	-178.2	-94.5	0	0	0	112.1	L668 I672 H691 L695 Y702 R703 Q704 Q708 Q709 R710	L668-W706 HydrophobicContact CB-CE3 3.48Å; L668-W706 VanDerWaalsContact CB-CE3 3.48Å; L668-W706 HydrophobicContact CB-CZ3 3.71Å; L668-W706 HydrophobicContact CD1-CB 4.01Å; L668-W706 HydrophobicContact CD1-CE3 4.12Å; L668-W706 HydrophobicContact CG-CE3 4.46Å; I672-W706 HydrophobicContact CD1-CH2 3.89Å; I672-W706 HydrophobicContact CG1-CH2 4.1Å; I672-W706 HydrophobicContact CG1-CZ3 4.28Å; H691-W706 AromaticContact CE1-CE3 3.68Å; H691-W706 AromaticContact CE1-CH2 3.56Å; H691-W706 AromaticContact CE1-CZ2 3.91Å; H691-W706 AromaticContact CE1-CZ3 3.42Å; H691-W706 VanDerWaalsContact CE1-CZ3 3.42Å; H691-W706 WeakPolarHBondContact CE1-CZ3 3.49Å; L695-W706 HydrophobicContact CD2-CB 3.92Å; L695-W706 HydrophobicContact CD2-CD2 4.41Å; L695-W706 HydrophobicContact CD2-CG 3.78Å; Y702-W706 WeakPolarHBondContact O-CB 3.47Å; Y702-W706 PolarHBondContact O-N 2.99Å; R703-W706 PolarHBondContact O-N 2.98Å; Q704-W706 VanDerWaalsContact C-N 3.29Å; Q704-W706 PolarHBondContact O-N 3.04Å; W706-Q708 VanDerWaalsContact C-N 3.34Å; W706-Q708 PolarHBondContact O-N 3.31Å; W706-Q709 PolarHBondContact O-N 2.94Å; W706-R710 WeakPolarHBondContact O-CB 3.47Å; W706-R710 PolarHBondContact O-N 3.05Å
707	N	88.9	Confident	74.6	Confident	79 Å²	79	84.3 Å²	84.3	42%	0.422	45%	0.453	S	S	.	.	H	α-helix	trans	-65.3	-37.8	178.4	-69.9	-22.8	0	0	0	112.1	R703 Q704 R710 S711	R703-N707 WeakPolarHBondContact O-CB 3.41Å; R703-N707 VanDerWaalsContact O-CG 3.27Å; R703-N707 PolarHBondContact O-N 3.26Å; R703-N707 PolarHBondContact O-ND2 3.31Å; Q704-N707 PolarHBondContact O-N 3.47Å; N707-R710 PolarHBondContact O-N 2.95Å; N707-S711 WeakPolarHBondContact O-CB 3.17Å; N707-S711 PolarHBondContact O-N 2.95Å; N707-S711 PolarHBondContact O-OG 2.83Å
708	Q	84.7	Confident	71.8	Confident	59 Å²	59	88.2 Å²	88.2	28%	0.276	48%	0.475	S	S	.	.	H	α-helix	trans	-62.4	-47.4	174.8	-73.1	170.7	2.8	0	0	111.5	Q704 L705 W706 R710 S711 G712	Q704-Q708 VanDerWaalsContact O-CG 3.28Å; Q704-Q708 WeakPolarHBondContact O-CG 3.29Å; Q704-Q708 PolarHBondContact O-N 3.46Å; L705-Q708 PolarHBondContact O-N 2.72Å; W706-Q708 VanDerWaalsContact C-N 3.34Å; W706-Q708 PolarHBondContact O-N 3.31Å; Q708-R710 VanDerWaalsContact C-N 3.33Å; Q708-R710 PolarHBondContact O-N 3.03Å; Q708-S711 PolarHBondContact O-N 2.93Å; Q708-S711 PolarHBondContact O-OG 2.94Å; Q708-G712 PolarHBondContact O-N 3.46Å; Q708-G712 VanDerWaalsContact O-N 3.15Å
709	Q	83.6	Confident	69.2	Low	80 Å²	80	89.2 Å²	89.2	37%	0.374	48%	0.479	S	S	.	.	H	α-helix	trans	-66.7	-34.1	178.6	-71.3	-171.1	9.7	0	0	112.9	H666 L705 W706	H666-Q709 PolarHBondContact O-NE2 3.41Å; L705-Q709 WeakPolarHBondContact O-CG 3.36Å; L705-Q709 PolarHBondContact O-N 3.39Å; W706-Q709 PolarHBondContact O-N 2.94Å
710	R	82.4	Confident	66.5	Low	208 Å²	208	87.2 Å²	87.2	79%	0.785	48%	0.477	S	S	*	.	H	α-helix	trans	-72.1	-33.9	176.2	-176.6	177.4	160.1	174.9	-4.4	112.9	W706 N707 Q708	W706-R710 WeakPolarHBondContact O-CB 3.47Å; W706-R710 PolarHBondContact O-N 3.05Å; N707-R710 PolarHBondContact O-N 2.95Å; Q708-R710 VanDerWaalsContact C-N 3.33Å; Q708-R710 PolarHBondContact O-N 3.03Å
711	S	73.3	Confident	63.5	Low	67 Å²	67	93.5 Å²	93.5	47%	0.469	52%	0.515	S	S	.	.	H	α-helix	trans	-84.3	-14.6	-178.2	53.2	0	0	0	0	113.8	N707 Q708 I713	N707-S711 WeakPolarHBondContact O-CB 3.17Å; N707-S711 PolarHBondContact O-N 2.95Å; N707-S711 PolarHBondContact O-OG 2.83Å; Q708-S711 PolarHBondContact O-N 2.93Å; Q708-S711 PolarHBondContact O-OG 2.94Å; S711-I713 PolarHBondContact O-N 2.78Å
712	G	61.7	Low	60.8	Low	68 Å²	68	98.5 Å²	98.5	70%	0.701	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.7	10.5	-179.6	0	0	0	0	0	114.3	Q708	Q708-G712 PolarHBondContact O-N 3.46Å; Q708-G712 VanDerWaalsContact O-N 3.15Å
713	I	42.3	Very low	57.8	Low	124 Å²	124	105.4 Å²	105.4	64%	0.636	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-102.1	116.3	-176.4	-57.6	166.3	0	0	0	108.8	S711	S711-I713 PolarHBondContact O-N 2.78Å
714	L	39.9	Very low	55	Low	155 Å²	155	110.6 Å²	110.6	81%	0.812	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-65	144.7	175.6	-74.7	159.8	0	0	0	111.3	T716	L714-T716 PolarHBondContact O-N 3.47Å
715	P	39.5	Very low	52.3	Low	79 Å²	79	112.6 Å²	112.6	51%	0.513	62%	0.623	S	S	.	*	P	Polyproline II helix	trans	-71.3	125.4	-178.3	-4.6	19.4	0	0	0	111.5
716	T	35.6	Very low	49.7	Very low	133 Å²	133	118.7 Å²	118.7	82%	0.816	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-85.5	120.6	158.2	-0.6	0	0	0	0	107.5	L714 I718	L714-T716 PolarHBondContact O-N 3.47Å; T716-I718 PolarHBondContact O-N 3.19Å; T716-I718 VanDerWaalsContact O-N 3.07Å
717	T	34.2	Very low	46.9	Very low	134 Å²	134	122.9 Å²	122.9	82%	0.822	68%	0.682	S	S	*	*			trans	-56.7	108.7	-178.4	-45.6	0	0	0	0	111.1	T719	T717-T719 PolarHBondContact O-N 3.09Å
718	I	34.5	Very low	44.4	Very low	158 Å²	158	127 Å²	127	81%	0.81	70%	0.703	S	S	*	*			trans	-82.2	110.4	168.1	-60.8	175.6	0	0	0	107.5	T716 S720	T716-I718 PolarHBondContact O-N 3.19Å; T716-I718 VanDerWaalsContact O-N 3.07Å; I718-S720 PolarHBondContact O-N 2.86Å
719	T	30.8	Very low	41.9	Very low	120 Å²	120	131 Å²	131	74%	0.736	73%	0.727	S	S	*	*			trans	-70.3	112.4	169.4	-16.9	0	0	0	0	107.9	T717 T721	T717-T719 PolarHBondContact O-N 3.09Å; T719-T721 PolarHBondContact O-N 3.34Å
720	S	32.4	Very low	39.5	Very low	105 Å²	105	133.7 Å²	133.7	73%	0.734	74%	0.744	S	S	*	*			trans	-69.5	100	168.7	51.7	0	0	0	0	109	I718 T722	I718-S720 PolarHBondContact O-N 2.86Å; S720-T722 PolarHBondContact O-N 2.95Å
721	T	28	Very low	37.2	Very low	132 Å²	132	130.7 Å²	130.7	81%	0.81	74%	0.744	S	S	*	*			trans	-67.2	109.1	156.3	43.3	0	0	0	0	108.7	T719	T719-T721 PolarHBondContact O-N 3.34Å
722	T	32.5	Very low	35.2	Very low	115 Å²	115	132.8 Å²	132.8	71%	0.706	76%	0.757	S	S	*	*			trans	-124.5	112.1	156.8	45.8	0	0	0	0	107.9	S720 F724	S720-T722 PolarHBondContact O-N 2.95Å; T722-F724 PolarHBondContact O-N 3.38Å
723	N	30.1	Very low	33.9	Very low	146 Å²	146	138.3 Å²	138.3	78%	0.781	76%	0.764	S	S	*	*			trans	-46.8	129.3	168.4	-69.6	-28.4	0	0	0	111
724	F	33.6	Very low	33.3	Very low	203 Å²	203	141.6 Å²	141.6	89%	0.89	77%	0.774	S	S	*	*			trans	-128.5	103.5	150.6	-100.1	-81.1	0	0	0	107.3	T722	T722-F724 PolarHBondContact O-N 3.38Å
725	D	33.6	Very low	33	Very low	136 Å²	136	142.6 Å²	142.6	73%	0.727	78%	0.778	S	S	*	*			trans	-67.6	153.8	164.7	-79.1	-42.6	0	0	0	111.2
726	N	32.4	Very low	32.5	Very low	142 Å²	142	143.6 Å²	143.6	76%	0.759	79%	0.787	S	S	*	*			trans	85.9	117.2	153.5	-77.5	-22.4	0	0	0	121.8
727	N	31.8	Very low	32.4	Very low	138 Å²	138	142.3 Å²	142.3	74%	0.738	78%	0.783	S	S	*	*			trans	69.1	101.5	141.5	-80.8	-14.2	0	0	0	119.3
728	N	34.7	Very low	32.2	Very low	164 Å²	164	140.8 Å²	140.8	88%	0.877	78%	0.778	S	S	*	*				-164.8	133.4	108.4	-100.9	-23.4	0	0	0	113.1
729	N	32.9	Very low	32.2	Very low	144 Å²	144	141.1 Å²	141.1	77%	0.77	78%	0.782	S	S	*	*			trans	-62.4	138.5	171.2	-78.9	-31.6	0	0	0	112.4
730	N	33.5	Very low	32.2	Very low	136 Å²	136	140.2 Å²	140.2	73%	0.727	78%	0.78	S	S	*	*				150.6	132.9	118.4	-87	-14.1	0	0	0	113.4
731	D	33.9	Very low	32.3	Very low	146 Å²	146	143.6 Å²	143.6	78%	0.781	78%	0.784	S	S	*	*			trans	90.4	123.9	146.2	-59.1	-25.2	0	0	0	123.1
732	C	31.8	Very low	32.5	Very low	111 Å²	111	145.6 Å²	145.6	75%	0.75	79%	0.785	S	S	*	*			trans	101.9	91.1	144	-82.4	0	0	0	0	121.1
733	H	34.2	Very low	32.5	Very low	184 Å²	184	146.7 Å²	146.7	85%	0.852	79%	0.791	S	S	*	*				77.1	104.7	128.2	-78.2	-67.7	0	0	0	122.1
734	K	28.8	Very low	32.6	Very low	192 Å²	192	147.3 Å²	147.3	84%	0.835	80%	0.795	S	S	*	*			trans	-59.5	139.3	152.4	-70.5	172	171.8	175.9	0	112.7
735	I	34.6	Very low	32.8	Very low	176 Å²	176	148.1 Å²	148.1	90%	0.903	82%	0.816	S	S	*	*			trans	-143.7	122.6	134.5	-60.6	-174.3	0	0	0	108.2
736	S	28.4	Very low	32.7	Very low	101 Å²	101	148.7 Å²	148.7	71%	0.706	82%	0.821	S	S	*	*			trans	-137.3	134.3	176	59.1	0	0	0	0	108.9
737	S	33.1	Very low	32.8	Very low	105 Å²	105	149.1 Å²	149.1	73%	0.734	82%	0.824	S	S	*	*			trans	156.3	103.1	155.4	53.6	0	0	0	0	108.5
738	S	30.4	Very low	32.8	Very low	102 Å²	102	149.7 Å²	149.7	71%	0.713	83%	0.829	S	S	*	*				70.8	115.1	94.5	68.3	0	0	0	0	114.2
739	D	34.4	Very low	32.7	Very low	166 Å²	166	148.8 Å²	148.8	89%	0.888	83%	0.826	S	S	*	*				-171.1	144.2	125.8	-92.7	-17.6	0	0	0	113
740	S	30.3	Very low	32.7	Very low	101 Å²	101	149.1 Å²	149.1	71%	0.706	83%	0.829	S	S	*	*			trans	-102.2	178.6	-163.4	48	0	0	0	0	114.5
741	Q	35.2	Very low	32.6	Very low	175 Å²	175	150 Å²	150	82%	0.818	84%	0.836	S	S	*	*			trans	100.2	104.2	165	-59.8	179.3	-9.3	0	0	115.4
742	Q	31.6	Very low	32.6	Very low	175 Å²	175	150.3 Å²	150.3	82%	0.818	84%	0.84	S	S	*	*				68	110.2	80.4	-85.1	-170.9	-11.6	0	0	115
743	T	33.8	Very low	32.6	Very low	138 Å²	138	153.3 Å²	153.3	85%	0.847	85%	0.847	S	S	*	*				160.1	155.6	109.1	45.6	0	0	0	0	112.6
744	N	31.7	Very low	32.5	Very low	159 Å²	159	150.8 Å²	150.8	85%	0.85	85%	0.847	S	S	*	*			trans	-75.7	145.6	-164.1	-62.3	-38.2	0	0	0	116.3
745	T	37.6	Very low	32.8	Very low	219 Å²	219	147 Å²	147	100%	1.344	85%	0.848	S	S	*	*				-162.4	0	120.8	28.6	0	0	0	0	109.2

Retrieved 745 of 745 residues in 188.6 ms (Link to these results)

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