A0A5K4END4_SCHMA Loading...

Broad substrate specificity ATP-binding cassette transporter ABCG2

AlphaFold DB , UniProt , Accession A0A5K4END4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 966 aa.

						>A0A5K4END4_SCHMA|A0A5K4END4
MGTNNPMDISIIDKTHCDELNTLQINIEYEPNFDLDNIDKKRNKRDFQKFTGVLNVKCLNIEHINDLDKNNNSCCYTMRNHSFNPYDYPYEHHVHCVSQNNDDMDMYTTNNNNTTTNHSNNYNDDNVVDFGCKTSHIIDIIRPPQLPPRKYQRSTNLLIFNMIRSPSDTCLISRKHHNCLKQLINSNSPQPFDSSQITSPEDTQFSVSMPTHSSNISDFPDSKLFHNHTTDHTDLPVTTDGSFEAFKILNNPLDNNYTPTEDHKQYRSLHDTIQDGKFPYTKMNSQTIPDNASNNSIQPTNIEKNYNQVNSTMSKKQTLTNFDEFPPTPGGSFSQRGKISGAKLSFHHISYEVKIQKTLCSKPVIKTILDDVSGILRPGMNALMGPTGSGKSSLLDVLAGRKDPKFLSGKVLIDGRPQPKNFKCISGYVVQDDIVMGTLTVRENLSFSAALRMTMHYTTEERNQKVNDIIDELGLNAVADSKVGTELVRGVSGGERKRTSIGMELITEPPVLFLDEPTTGLDAYMAGQVVKTLKALAKRGRTIIFSIHQPKYSIYKLFDTLTLIYRGQIIYHGLAKKEPIRYFGRLGYVCENHNNPPDFFMDVIHGECLRQNGNTPDVQIVDHHDTQERMHLVGQQLIQDWQTSEMAQHVLEEVSSIANRLEKYENGSKKSKDKAVDISFAASYFRQLKKVCWRSILNLLRDPLASVIQTIVYLFFALSMGIVYFQMNDSLESGIQNRTGLFYFCTLQVIFVNLATIELFIKERVLFIHESSSGYYQVSVYFFSKVICDIIPTKVLPILLFMPICYWMAGLQKTFGAFMFFELILCLTTLAAAAIALFISASVTVFGLANAIISIIYVFMMAFSGFLINLKSMAVWLSWLRYFSIFRYSMGGLLAMEMKTLRFCPMNNSNTTINRQCQNGTTYLEDQEIPYITGWDLWYNVVGLMVIMIAFYILCYVRLRLLNKYK
					

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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	35.5	Very low	34.9	Very low	258 Å²	258	142.2 Å²	142.2	100%	1.271	80%	0.804	S	S	*	*				0	103.2	0	-67.8	177.8	174.5	0	0	107
2	G	39	Very low	34.8	Very low	71 Å²	71	141.9 Å²	141.9	73%	0.732	80%	0.796	S	S	*	*			cis	-179.3	136.4	-7.8	0	0	0	0	0	102.2
3	T	39	Very low	34.5	Very low	121 Å²	121	142.4 Å²	142.4	74%	0.742	80%	0.796	S	S	*	*			cis	-159.7	134.8	19.1	39.1	0	0	0	0	108.7
4	N	36.3	Very low	34.2	Very low	141 Å²	141	145.9 Å²	145.9	75%	0.754	80%	0.799	S	S	*	*				49.6	139.8	129.1	-50.3	-9.7	0	0	0	119.6
5	N	35.2	Very low	34	Very low	146 Å²	146	144.6 Å²	144.6	78%	0.781	80%	0.797	S	S	*	*			cis	-170.6	150.3	-0.6	-119.7	-0.5	0	0	0	106.3
6	P	42.3	Very low	34	Very low	113 Å²	113	146.4 Å²	146.4	73%	0.734	80%	0.797	S	S	*	*			trans	-91.8	160.3	166	35.7	-28.4	0	0	0	111.5
7	M	35.8	Very low	33.6	Very low	174 Å²	174	144.9 Å²	144.9	86%	0.857	80%	0.798	S	S	*	*			trans	-132.2	115.5	163.8	-94	-140.1	-72.9	0	0	111.1
8	D	29	Very low	33.3	Very low	156 Å²	156	144.9 Å²	144.9	83%	0.834	80%	0.797	S	S	*	*			trans	-69.9	136.8	153.3	-73.7	-50.9	0	0	0	110.1
9	I	33.3	Very low	33.3	Very low	149 Å²	149	146.7 Å²	146.7	76%	0.764	80%	0.799	S	S	*	*			trans	-139.7	104.5	148.6	-63.5	-174.7	0	0	0	108.2
10	S	26.6	Very low	33.2	Very low	90 Å²	90	147.4 Å²	147.4	63%	0.629	80%	0.801	S	S	*	*			trans	-72	175.1	156.6	52	0	0	0	0	111.5
11	I	31.8	Very low	33	Very low	145 Å²	145	148.2 Å²	148.2	74%	0.744	81%	0.805	S	S	*	*			trans	82.8	127	176.6	-32.6	152.9	0	0	0	108.5
12	I	33.6	Very low	32.8	Very low	139 Å²	139	140.7 Å²	140.7	71%	0.713	77%	0.774	S	S	*	*			cis	-162.3	144.2	45.2	-38.4	-135.5	0	0	0	109
13	D	30.9	Very low	32.3	Very low	148 Å²	148	145.2 Å²	145.2	79%	0.791	78%	0.78	S	S	*	*			trans	70.9	122	149.4	-82.1	-28	0	0	0	125.1
14	K	30.8	Very low	31.8	Very low	192 Å²	192	147 Å²	147	84%	0.835	78%	0.78	S	S	*	*			trans	-61.5	127	151.4	-70	168.8	171.1	175.2	0	109.6
15	T	31.6	Very low	31.6	Very low	126 Å²	126	146.8 Å²	146.8	77%	0.773	78%	0.778	S	S	*	*			trans	170	102.6	140.2	35.6	0	0	0	0	109.2
16	H	32.7	Very low	31.1	Very low	174 Å²	174	145.7 Å²	145.7	81%	0.806	77%	0.772	S	S	*	*			trans	173.9	87.2	141.7	-100.5	50.7	0	0	0	108.3
17	C	27.4	Very low	30.5	Very low	120 Å²	120	146.7 Å²	146.7	81%	0.811	77%	0.769	S	S	*	*			trans	-85	151.8	142.3	-88.1	0	0	0	0	106.8
18	D	28.9	Very low	30.1	Very low	146 Å²	146	146.9 Å²	146.9	78%	0.781	77%	0.768	S	S	*	*			trans	79.7	89.5	174.1	-56.1	-20.5	0	0	0	116.6
19	E	33.7	Very low	30.1	Very low	179 Å²	179	149.3 Å²	149.3	84%	0.836	77%	0.767	S	S	*	*			trans	179.1	109.4	138.7	-103.2	175.8	-174.6	0	0	109.6
20	L	31.1	Very low	29.9	Very low	160 Å²	160	149.6 Å²	149.6	84%	0.838	77%	0.765	S	S	*	*			trans	168.2	62.7	143	-88.7	161.6	0	0	0	108.9
21	N	28.6	Very low	30.2	Very low	165 Å²	165	151.3 Å²	151.3	88%	0.882	77%	0.774	S	S	*	*			trans	-109.5	67.2	158.9	-121.8	-6.8	0	0	0	106.4
22	T	32.1	Very low	30.2	Very low	100 Å²	100	150.3 Å²	150.3	61%	0.613	77%	0.77	S	S	*	*			trans	-171.3	84.5	174.2	15.5	0	0	0	0	109.7
23	L	28.2	Very low	30.1	Very low	166 Å²	166	153.5 Å²	153.5	87%	0.869	78%	0.779	S	S	*	*			trans	-112.2	72.8	144.9	-95.5	162.4	0	0	0	106.2	I25	L23-I25 VanDerWaalsContact C-N 3.33Å; L23-I25 PolarHBondContact O-N 3.01Å
24	Q	28.8	Very low	30.2	Very low	157 Å²	157	153.4 Å²	153.4	73%	0.734	78%	0.779	S	S	*	*			trans	-67	99	153.9	-104.3	-179.1	-50.6	0	0	106.1	N26	Q24-N26 VanDerWaalsContact C-N 3.31Å; Q24-N26 PolarHBondContact O-N 3.4Å; Q24-N26 VanDerWaalsContact O-N 3.15Å
25	I	31.1	Very low	30	Very low	138 Å²	138	152.1 Å²	152.1	71%	0.708	78%	0.78	S	S	*	*			trans	-74.7	99.2	158.1	-64.3	176.9	0	0	0	105.1	L23 I27	L23-I25 VanDerWaalsContact C-N 3.33Å; L23-I25 PolarHBondContact O-N 3.01Å; I25-I27 HydrophobicContact CG2-CG1 4.32Å; I25-I27 PolarHBondContact O-N 3.31Å; I25-I27 VanDerWaalsContact O-N 3.15Å
26	N	25.6	Very low	30	Very low	123 Å²	123	153.3 Å²	153.3	66%	0.658	78%	0.782	S	S	*	*			trans	-55.6	110.3	164.1	-74.2	-19	0	0	0	108.3	Q24	Q24-N26 VanDerWaalsContact C-N 3.31Å; Q24-N26 PolarHBondContact O-N 3.4Å; Q24-N26 VanDerWaalsContact O-N 3.15Å
27	I	29.5	Very low	30	Very low	133 Å²	133	151.5 Å²	151.5	68%	0.682	78%	0.778	S	S	*	*			trans	-109.8	92.6	149.3	-58.3	179.9	0	0	0	104.2	I25 Y29	I25-I27 HydrophobicContact CG2-CG1 4.32Å; I25-I27 PolarHBondContact O-N 3.31Å; I25-I27 VanDerWaalsContact O-N 3.15Å; I27-Y29 HydrophobicContact CG2-CD2 3.84Å; I27-Y29 HydrophobicContact CG2-CE2 4.11Å; I27-Y29 PolarHBondContact O-N 3.48Å
28	E	26.3	Very low	30.3	Very low	179 Å²	179	152.2 Å²	152.2	84%	0.836	77%	0.773	S	S	*	*			trans	-55.6	114.7	159.8	-88.8	167.3	140.5	0	0	108
29	Y	30	Very low	30.5	Very low	207 Å²	207	151.3 Å²	151.3	81%	0.812	77%	0.768	S	S	*	*			trans	-112.5	104	150.6	-101.5	-82.9	0	0	0	105.7	I27 P31	I27-Y29 HydrophobicContact CG2-CD2 3.84Å; I27-Y29 HydrophobicContact CG2-CE2 4.11Å; I27-Y29 PolarHBondContact O-N 3.48Å; Y29-P31 WeakPolarHBondContact O-CD 3.48Å
30	E	27.8	Very low	30.4	Very low	155 Å²	155	151.6 Å²	151.6	72%	0.724	77%	0.766	S	S	*	*			trans	-54.9	137.3	162.9	-81.1	-172.7	117.8	0	0	109.9	N32	E30-N32 PolarHBondContact OE1-ND2 3.36Å
31	P	33.5	Very low	30.5	Very low	125 Å²	125	153.6 Å²	153.6	81%	0.812	77%	0.768	S	S	*	*			trans	-116.8	89.6	151.6	33.4	-17.4	0	0	0	107.9	Y29	Y29-P31 WeakPolarHBondContact O-CD 3.48Å
32	N	31.4	Very low	30.6	Very low	124 Å²	124	155 Å²	155	66%	0.663	76%	0.761	S	S	*	*			trans	-109.2	110.1	161.3	-80.4	-36.9	0	0	0	106.6	E30	E30-N32 PolarHBondContact OE1-ND2 3.36Å
33	F	31.3	Very low	30.5	Very low	206 Å²	206	156.4 Å²	156.4	90%	0.904	77%	0.765	S	S	*	*			trans	-167.6	136.8	132.9	-118.8	-83.2	0	0	0	111.7
34	D	33.1	Very low	30.6	Very low	146 Å²	146	158.6 Å²	158.6	78%	0.781	77%	0.767	S	S	*	*			trans	-56.4	140.5	-163.8	-74.8	-56.7	0	0	0	117
35	L	27.6	Very low	30.7	Very low	165 Å²	165	162 Å²	162	86%	0.864	77%	0.774	S	S	*	*			trans	-82.4	110.3	152.1	-84.5	156.4	0	0	0	107.9
36	D	31.9	Very low	30.9	Very low	151 Å²	151	161.7 Å²	161.7	81%	0.807	77%	0.773	S	S	*	*			trans	-162.2	143.3	140.9	-105.7	-21.9	0	0	0	112.2
37	N	33.3	Very low	31.1	Very low	136 Å²	136	166.2 Å²	166.2	73%	0.727	79%	0.787	S	S	*	*			trans	88.8	104.4	164.4	-72.7	-36	0	0	0	121.6
38	I	33.1	Very low	31.1	Very low	136 Å²	136	169 Å²	169	70%	0.697	80%	0.798	S	S	*	*				103.2	106.8	121.3	-65	167.2	0	0	0	118.3
39	D	32.8	Very low	31.3	Very low	127 Å²	127	169.9 Å²	169.9	68%	0.679	80%	0.799	S	S	*	*			trans	81.9	100.5	140.3	-77.2	-29.7	0	0	0	124.2
40	K	31.9	Very low	31.3	Very low	185 Å²	185	169.1 Å²	169.1	80%	0.804	80%	0.8	S	S	*	*				38.9	99.2	116.5	-72.4	176.5	179.2	163.4	0	118.4
41	K	32.2	Very low	31.4	Very low	202 Å²	202	168.5 Å²	168.5	88%	0.878	81%	0.807	S	S	*	*				162	138.5	115.8	-90.5	168.3	178.8	173.7	0	111.1
42	R	30.4	Very low	31.1	Very low	195 Å²	195	166 Å²	166	74%	0.736	80%	0.804	S	S	*	*	S	Bend	trans	82	128.3	165.8	-83.1	174.7	162.6	162.8	-10.5	119.1	N250	R42-N250 PolarHBondContact NH1-ND2 2.97Å
43	N	31.7	Very low	31	Very low	128 Å²	128	165.4 Å²	165.4	68%	0.684	81%	0.805	S	S	*	*			trans	87.3	63.2	163.9	-68.8	5.2	0	0	0	119.7	R45	N43-R45 VanDerWaalsContact C-N 3.33Å; N43-R45 PolarHBondContact O-N 3.44Å; N43-R45 VanDerWaalsContact O-N 3.15Å
44	K	28.4	Very low	30.8	Very low	213 Å²	213	163.3 Å²	163.3	93%	0.926	80%	0.802	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	88.2	142.8	-90.2	-178.2	172	179.7	0	109.1
45	R	32.4	Very low	30.5	Very low	229 Å²	229	162.9 Å²	162.9	86%	0.864	80%	0.8	S	S	*	*	T	Hydrogen-bonded Turn	trans	-167.8	-2.6	157.5	-114	-179.9	-91.7	-167.3	-6	116.4	N43	N43-R45 VanDerWaalsContact C-N 3.33Å; N43-R45 PolarHBondContact O-N 3.44Å; N43-R45 VanDerWaalsContact O-N 3.15Å
46	D	34.4	Very low	30.6	Very low	131 Å²	131	160 Å²	160	70%	0.701	79%	0.788	S	S	*	*	S	Bend	trans	-114.4	6.9	-172.3	-67.8	-35.5	0	0	0	116.4
47	F	29.6	Very low	30.3	Very low	217 Å²	217	162.2 Å²	162.2	95%	0.952	79%	0.791	S	S	*	*	S	Bend	trans	-107.7	22.1	-176.1	-133.7	-94.6	0	0	0	115.7
48	Q	31	Very low	30.1	Very low	193 Å²	193	160.5 Å²	160.5	90%	0.902	79%	0.789	S	S	*	*	S	Bend	trans	-118.7	19.4	177.6	-117.7	179.3	5.5	0	0	114
49	K	30.4	Very low	29.7	Very low	196 Å²	196	161.6 Å²	161.6	85%	0.852	80%	0.795	S	S	*	*	S	Bend	trans	-123.5	11.3	-175.7	-91.2	-175.6	177	178.3	0	116.8
50	F	28.7	Very low	29.6	Very low	192 Å²	192	163.3 Å²	163.3	84%	0.842	80%	0.804	S	S	*	*	S	Bend	trans	-144	65	178.7	-102.7	-86.7	0	0	0	113
51	T	30.4	Very low	29.5	Very low	142 Å²	142	160.9 Å²	160.9	87%	0.871	80%	0.799	S	S	*	*			trans	-159.4	124.7	160.9	43.8	0	0	0	0	109.9
52	G	28	Very low	29.2	Very low	73 Å²	73	159.4 Å²	159.4	75%	0.753	80%	0.795	S	S	*	*			trans	91	121.4	173.5	0	0	0	0	0	113.2
53	V	28.7	Very low	29.4	Very low	111 Å²	111	158.3 Å²	158.3	67%	0.673	80%	0.798	S	S	*	*				-141.4	92.6	59.2	-177.2	0	0	0	0	110.9	N55	V53-N55 HydrophobicContact CG1-CB 3.77Å
54	L	26.5	Very low	29.4	Very low	162 Å²	162	157.6 Å²	157.6	85%	0.848	79%	0.792	S	S	*	*			trans	-95.2	81.6	146.4	-120.4	152.8	0	0	0	105	V56	L54-V56 HydrophobicContact CD2-CG2 4.04Å; L54-V56 PolarHBondContact O-N 3.32Å
55	N	27.8	Very low	29.5	Very low	137 Å²	137	153.6 Å²	153.6	73%	0.733	78%	0.781	S	S	*	*			trans	-92.5	86.3	168.8	-104.3	-22.5	0	0	0	108	V53 K57	V53-N55 HydrophobicContact CG1-CB 3.77Å; N55-K57 PolarHBondContact O-N 3.48Å
56	V	28.5	Very low	29.5	Very low	103 Å²	103	149.1 Å²	149.1	62%	0.624	77%	0.774	S	S	*	*			trans	-73.6	101	151.2	178.1	0	0	0	0	105.5	L54 C58	L54-V56 HydrophobicContact CD2-CG2 4.04Å; L54-V56 PolarHBondContact O-N 3.32Å; V56-C58 VanDerWaalsContact C-N 3.27Å; V56-C58 PolarHBondContact O-N 3.39Å; V56-C58 VanDerWaalsContact O-N 3.12Å
57	K	27	Very low	29.5	Very low	199 Å²	199	150 Å²	150	87%	0.865	78%	0.778	S	S	*	*			trans	-77.6	88.5	161.4	-103.3	-174.2	174.3	-173.9	0	106.9	N55	N55-K57 PolarHBondContact O-N 3.48Å
58	C	27.4	Very low	29.6	Very low	100 Å²	100	145.2 Å²	145.2	68%	0.676	76%	0.763	S	S	*	*			trans	-69.1	120.8	150.9	-75.3	0	0	0	0	106.7	V56 N60	V56-C58 VanDerWaalsContact C-N 3.27Å; V56-C58 PolarHBondContact O-N 3.39Å; V56-C58 VanDerWaalsContact O-N 3.12Å; C58-N60 PolarHBondContact O-N 3.28Å
59	L	25.8	Very low	29.8	Very low	159 Å²	159	143.9 Å²	143.9	83%	0.832	75%	0.754	S	S	*	*			trans	-59.9	123.1	154.9	-85	111.7	0	0	0	106.8
60	N	29.8	Very low	29.9	Very low	162 Å²	162	141.3 Å²	141.3	87%	0.866	75%	0.75	S	S	*	*			trans	-137.2	128.3	153.6	-100	-11.3	0	0	0	109	C58	C58-N60 PolarHBondContact O-N 3.28Å
61	I	30.6	Very low	30.1	Very low	135 Å²	135	138.7 Å²	138.7	69%	0.692	75%	0.745	S	S	*	*			trans	-83.9	139.4	178.8	-76	167.5	0	0	0	107.6
62	E	26.5	Very low	30	Very low	171 Å²	171	138.9 Å²	138.9	80%	0.799	74%	0.74	S	S	*	*			trans	50.7	122.3	154.8	-67.7	167.9	178.7	0	0	120.9
63	H	33	Very low	30	Very low	172 Å²	172	140.9 Å²	140.9	80%	0.796	74%	0.742	S	S	*	*			trans	-172.4	143.4	137.1	-112.8	-99.7	0	0	0	105.6
64	I	31.9	Very low	29.8	Very low	112 Å²	112	141.5 Å²	141.5	57%	0.574	75%	0.751	S	S	*	*			cis	-179.8	153.8	-16.8	-125.1	166.4	0	0	0	104.5
65	N	31.5	Very low	29.7	Very low	130 Å²	130	139.2 Å²	139.2	70%	0.695	75%	0.747	S	S	*	*			trans	73.2	133.2	163.3	-60.5	-8.3	0	0	0	116.8
66	D	33.2	Very low	29.6	Very low	134 Å²	134	143.2 Å²	143.2	72%	0.717	75%	0.753	S	S	*	*			cis	-164.5	154.1	42.2	-109	-33.5	0	0	0	112.7
67	L	32.7	Very low	29.4	Very low	149 Å²	149	144 Å²	144	78%	0.78	76%	0.758	S	S	*	*			trans	70.2	97.9	150	-63.8	157.5	0	0	0	118.6
68	D	33.4	Very low	29.5	Very low	118 Å²	118	143.5 Å²	143.5	63%	0.631	76%	0.761	S	S	*	*				92.6	127.8	70.7	-158.8	28.5	0	0	0	113.9
69	K	33.7	Very low	29.5	Very low	164 Å²	164	149.5 Å²	149.5	71%	0.713	77%	0.77	S	S	*	*			trans	76.2	101.3	162.8	-76.8	157.5	-174.1	135.7	0	123.3
70	N	33.8	Very low	29.6	Very low	143 Å²	143	148.3 Å²	148.3	77%	0.765	76%	0.764	S	S	*	*				53.6	118.4	113	-78.4	-10.7	0	0	0	122.5
71	N	32.3	Very low	29.6	Very low	137 Å²	137	149.8 Å²	149.8	73%	0.733	77%	0.766	S	S	*	*				63.1	113.6	129.9	-79.7	-11	0	0	0	121.6
72	N	28.8	Very low	29.4	Very low	146 Å²	146	148.4 Å²	148.4	78%	0.781	77%	0.768	S	S	*	*			trans	61.4	127.4	130.3	-71	-11.6	0	0	0	120.7
73	S	27.3	Very low	29.5	Very low	114 Å²	114	150.4 Å²	150.4	80%	0.797	77%	0.774	S	S	*	*			trans	103.4	136.3	144.6	77.5	0	0	0	0	118.4
74	C	25.3	Very low	29.3	Very low	125 Å²	125	148.7 Å²	148.7	85%	0.845	77%	0.771	S	S	*	*			trans	85.6	113.5	157.8	-76.1	0	0	0	0	120.2
75	C	22.5	Very low	29.1	Very low	114 Å²	114	148.6 Å²	148.6	77%	0.77	78%	0.777	S	S	*	*			trans	-30.5	142.1	150	-57.5	0	0	0	0	114.6
76	Y	27.2	Very low	29	Very low	220 Å²	220	151.9 Å²	151.9	86%	0.863	78%	0.782	S	S	*	*				177.5	125.5	113.8	-102.2	-80.9	0	0	0	110.1
77	T	24	Very low	28.8	Very low	119 Å²	119	153.5 Å²	153.5	73%	0.73	79%	0.79	S	S	*	*			trans	13.5	126.8	148.8	48.3	0	0	0	0	121.5
78	M	29.3	Very low	28.7	Very low	190 Å²	190	155.8 Å²	155.8	94%	0.936	79%	0.79	S	S	*	*				-167.7	97.1	129	-85.9	-123.1	-138.3	0	0	107.9
79	R	27	Very low	28.7	Very low	225 Å²	225	156.3 Å²	156.3	85%	0.849	80%	0.8	S	S	*	*				53.2	111.6	94.3	-106.3	-173.8	-163.1	162.9	5.9	116.2
80	N	27.9	Very low	28.6	Very low	135 Å²	135	157.4 Å²	157.4	72%	0.722	80%	0.801	S	S	*	*			trans	56.2	102.9	138.2	-63.4	-3.5	0	0	0	119.1
81	H	29	Very low	28.3	Very low	193 Å²	193	159.3 Å²	159.3	89%	0.894	81%	0.805	S	S	*	*				-141.7	122	117.7	-105.1	-77.1	0	0	0	109.8
82	S	27	Very low	28.2	Very low	105 Å²	105	159.9 Å²	159.9	73%	0.734	80%	0.803	S	S	*	*			trans	-63.9	132.3	178.8	13.9	0	0	0	0	112
83	F	29	Very low	28.1	Very low	214 Å²	214	161.2 Å²	161.2	94%	0.939	80%	0.804	S	S	*	*			trans	-133.2	125.8	152.4	-104	-86.2	0	0	0	109.9
84	N	27.9	Very low	28.2	Very low	136 Å²	136	162 Å²	162	73%	0.727	80%	0.804	S	S	*	*			trans	-70.2	143.3	-170.4	-143.6	3.7	0	0	0	111	Y86	N84-Y86 PolarHBondContact O-N 2.75Å
85	P	27.9	Very low	28.3	Very low	109 Å²	109	164.3 Å²	164.3	71%	0.708	80%	0.802	S	S	*	*	S	Bend	trans	-93.5	73.9	175	36.3	-29.3	0	0	0	110.4
86	Y	29.6	Very low	28.4	Very low	199 Å²	199	164.2 Å²	164.2	78%	0.78	80%	0.801	S	S	*	*			trans	-155.8	105.2	164.7	-76.7	-75.7	0	0	0	109	N84	N84-Y86 PolarHBondContact O-N 2.75Å
87	D	29.1	Very low	28.6	Very low	169 Å²	169	160.2 Å²	160.2	90%	0.904	80%	0.8	S	S	*	*			trans	-160.5	96.4	155.1	-100.1	-28.1	0	0	0	110
88	Y	31.1	Very low	28.8	Very low	196 Å²	196	159.1 Å²	159.1	77%	0.769	80%	0.797	S	S	*	*			trans	-97.3	126.4	158	-87.9	-88.1	0	0	0	107.2	Y90	Y88-Y90 PolarHBondContact O-N 2.83Å; Y88-Y90 VanDerWaalsContact O-N 3.1Å
89	P	34	Very low	28.8	Very low	130 Å²	130	158.5 Å²	158.5	84%	0.844	79%	0.792	S	S	*	*			trans	-80.1	95.1	165.3	30.3	-27	0	0	0	108.6
90	Y	31.4	Very low	28.9	Very low	186 Å²	186	154.9 Å²	154.9	73%	0.729	79%	0.789	S	S	*	*			trans	-82.1	107	158.3	-90.8	-85.9	0	0	0	108.7	Y88 H92	Y88-Y90 PolarHBondContact O-N 2.83Å; Y88-Y90 VanDerWaalsContact O-N 3.1Å; Y90-H92 VanDerWaalsContact C-N 3.34Å; Y90-H92 AromaticContact CD1-CD2 3.99Å; Y90-H92 PolarHBondContact O-N 3.15Å; Y90-H92 VanDerWaalsContact O-N 3.1Å
91	E	26.1	Very low	28.9	Very low	183 Å²	183	155.4 Å²	155.4	86%	0.855	79%	0.792	S	S	*	*			trans	-73.3	91.4	157.1	-83.9	-173	157	0	0	108.6
92	H	30	Very low	29.1	Very low	150 Å²	150	152.6 Å²	152.6	69%	0.694	78%	0.784	S	S	*	*			trans	-105	103.2	160.3	-103.4	-66	0	0	0	108.9	Y90 V94	Y90-H92 VanDerWaalsContact C-N 3.34Å; Y90-H92 AromaticContact CD1-CD2 3.99Å; Y90-H92 PolarHBondContact O-N 3.15Å; Y90-H92 VanDerWaalsContact O-N 3.1Å; H92-V94 PolarHBondContact O-N 2.68Å
93	H	26.7	Very low	29.4	Very low	173 Å²	173	154.3 Å²	154.3	80%	0.801	78%	0.784	S	S	*	*			trans	-69.8	105.6	156.7	-88.5	-76.9	0	0	0	108.7
94	V	30.3	Very low	29.6	Very low	130 Å²	130	151.2 Å²	151.2	79%	0.788	78%	0.775	S	S	*	*			trans	-136.9	125	151.2	-178.5	0	0	0	0	107.7	H92	H92-V94 PolarHBondContact O-N 2.68Å
95	H	28.4	Very low	29.7	Very low	174 Å²	174	151 Å²	151	81%	0.806	77%	0.774	S	S	*	*			trans	-63.1	145.9	177.8	-100.5	-98.4	0	0	0	113
96	C	24.4	Very low	29.7	Very low	112 Å²	112	153.8 Å²	153.8	76%	0.757	78%	0.779	S	S	*	*			trans	-43.2	160.2	170.1	-50.6	0	0	0	0	114.5
97	V	29.7	Very low	29.7	Very low	137 Å²	137	155.7 Å²	155.7	83%	0.83	79%	0.787	S	S	*	*				-175	142.8	71.9	160.7	0	0	0	0	111.9
98	S	29.7	Very low	29.8	Very low	96 Å²	96	152.8 Å²	152.8	67%	0.671	78%	0.775	S	S	*	*			trans	73.4	115.8	150.9	-171.7	0	0	0	0	120
99	Q	27.7	Very low	29.8	Very low	176 Å²	176	149.5 Å²	149.5	82%	0.822	78%	0.775	S	S	*	*			cis	101.5	135.5	49.1	-104.6	-174.5	-16.6	0	0	114.1
100	N	30.8	Very low	29.6	Very low	149 Å²	149	149.8 Å²	149.8	80%	0.797	77%	0.77	S	S	*	*			trans	110.8	96.9	167.8	-59.8	-7	0	0	0	113.5
101	N	27.8	Very low	29.8	Very low	146 Å²	146	149 Å²	149	78%	0.781	78%	0.778	S	S	*	*				74.4	139.1	63.1	-88.1	19.1	0	0	0	116.3
102	D	33.2	Very low	30.1	Very low	135 Å²	135	146.3 Å²	146.3	72%	0.722	77%	0.77	S	S	*	*			trans	87.9	131.1	165.6	-45.5	-25.3	0	0	0	115.1
103	D	33	Very low	30.3	Very low	140 Å²	140	146 Å²	146	75%	0.749	77%	0.773	S	S	*	*			cis	-167.4	148.8	10.7	-99.7	-33	0	0	0	112.2
104	M	32	Very low	30.6	Very low	150 Å²	150	144 Å²	144	74%	0.739	77%	0.774	S	S	*	*			trans	53.1	125.7	132.6	-58.7	-99	-92.3	0	0	125.8
105	D	31.4	Very low	30.4	Very low	131 Å²	131	144 Å²	144	70%	0.701	77%	0.774	S	S	*	*				83.5	107.6	127.5	-62.9	-14.5	0	0	0	126.4
106	M	26.4	Very low	30.6	Very low	167 Å²	167	142.7 Å²	142.7	82%	0.823	78%	0.778	S	S	*	*				17.7	132.8	126.7	-108.8	-168.3	-162.5	0	0	122.1
107	Y	30.8	Very low	30.7	Very low	240 Å²	240	144.8 Å²	144.8	94%	0.941	78%	0.782	S	S	*	*			trans	-159.1	126.4	130.4	-93.8	-73.7	0	0	0	112.3
108	T	29.9	Very low	30.9	Very low	108 Å²	108	147.4 Å²	147.4	66%	0.663	79%	0.785	S	S	*	*			trans	-93.4	148.8	168.5	44.3	0	0	0	0	111.5
109	T	32.9	Very low	30.8	Very low	126 Å²	126	147.3 Å²	147.3	77%	0.773	79%	0.785	S	S	*	*				164.9	134.9	120	36.9	0	0	0	0	115.6
110	N	29.7	Very low	30.9	Very low	136 Å²	136	146.6 Å²	146.6	73%	0.727	79%	0.786	S	S	*	*			trans	53.2	128.8	139.9	-69.4	-8.1	0	0	0	124
111	N	34.4	Very low	30.9	Very low	169 Å²	169	146.3 Å²	146.3	90%	0.904	79%	0.785	S	S	*	*			trans	-149.3	137.3	133.3	-104.3	-23.4	0	0	0	113
112	N	32.1	Very low	31.1	Very low	127 Å²	127	150.3 Å²	150.3	68%	0.679	79%	0.791	S	S	*	*			trans	-78.9	156.2	-175.8	-61.5	-43.7	0	0	0	113
113	N	34.4	Very low	30.9	Very low	143 Å²	143	150.7 Å²	150.7	77%	0.765	79%	0.793	S	S	*	*				168.2	135.6	113.5	-85.9	-19.5	0	0	0	115.9
114	T	32.9	Very low	30.9	Very low	133 Å²	133	151.6 Å²	151.6	82%	0.816	80%	0.797	S	S	*	*			trans	79.7	111.3	139.7	50.5	0	0	0	0	122.8
115	T	27.5	Very low	30.8	Very low	129 Å²	129	151.4 Å²	151.4	79%	0.791	80%	0.799	S	S	*	*			trans	-64.7	150.2	159.7	45.6	0	0	0	0	115.1
116	T	31.8	Very low	30.8	Very low	146 Å²	146	152.8 Å²	152.8	90%	0.896	81%	0.807	S	S	*	*				-172.3	133.7	128.5	33.6	0	0	0	0	112.3
117	N	27.2	Very low	31	Very low	157 Å²	157	151.4 Å²	151.4	84%	0.84	81%	0.807	S	S	*	*			trans	-73.3	148.8	174.6	-73	-33.8	0	0	0	113.1
118	H	32.9	Very low	30.8	Very low	191 Å²	191	145.3 Å²	145.3	88%	0.884	80%	0.795	S	S	*	*			trans	-153.6	121	142.2	-106.3	-63.2	0	0	0	111.6
119	S	27.1	Very low	30.6	Very low	95 Å²	95	147.7 Å²	147.7	66%	0.664	80%	0.804	S	S	*	*			trans	-72.3	144.6	166.6	48.7	0	0	0	0	111.9
120	N	31.1	Very low	30.3	Very low	160 Å²	160	150.6 Å²	150.6	86%	0.856	81%	0.806	S	S	*	*			trans	-167.8	137.6	136.2	-96.2	-18.6	0	0	0	113
121	N	29.9	Very low	30.1	Very low	143 Å²	143	148 Å²	148	77%	0.765	81%	0.811	S	S	*	*			trans	-56.1	146	179.5	-67.9	-35	0	0	0	114.6
122	Y	31.6	Very low	29.6	Very low	231 Å²	231	145.9 Å²	145.9	91%	0.906	81%	0.808	S	S	*	*			trans	-146.7	113.1	137.4	-109.2	-84.4	0	0	0	109
123	N	30.4	Very low	29.3	Very low	143 Å²	143	149 Å²	149	77%	0.765	82%	0.816	S	S	*	*			trans	-74.1	136.9	160.1	-77.5	-19.4	0	0	0	107.7
124	D	32.3	Very low	29.1	Very low	159 Å²	159	147.8 Å²	147.8	85%	0.85	81%	0.814	S	S	*	*			trans	-153.2	117.1	143.2	-99.7	-26.5	0	0	0	108.6
125	D	30.6	Very low	28.9	Very low	145 Å²	145	145.6 Å²	145.6	78%	0.775	80%	0.804	S	S	*	*			trans	-64	131.2	173.4	-66.5	-54.1	0	0	0	110.1
126	N	31.4	Very low	29	Very low	161 Å²	161	147.4 Å²	147.4	86%	0.861	80%	0.803	S	S	*	*			trans	-150.5	121.6	146.8	-92.8	-43.5	0	0	0	110.6
127	V	29.3	Very low	28.8	Very low	137 Å²	137	147.7 Å²	147.7	83%	0.83	80%	0.797	S	S	*	*			trans	-58	124.7	-175.3	174.6	0	0	0	0	111.2
128	V	28.2	Very low	29	Very low	113 Å²	113	147 Å²	147	69%	0.685	79%	0.792	S	S	*	*			trans	-102	114	167.4	-178.5	0	0	0	0	108.1	F130	V128-F130 HydrophobicContact CG1-CD2 3.36Å; V128-F130 HydrophobicContact CG1-CE2 3.77Å; V128-F130 HydrophobicContact CG1-CG 4.4Å
129	D	25.6	Very low	28.8	Very low	158 Å²	158	145 Å²	145	85%	0.845	79%	0.788	S	S	*	*			trans	-96.1	100.2	172.3	-144.8	0.8	0	0	0	108.2
130	F	26.1	Very low	28.9	Very low	186 Å²	186	148 Å²	148	82%	0.816	80%	0.795	S	S	*	*			trans	-101.2	100.7	174.2	-105.6	-73.5	0	0	0	109.9	V128 C132	V128-F130 HydrophobicContact CG1-CD2 3.36Å; V128-F130 HydrophobicContact CG1-CE2 3.77Å; V128-F130 HydrophobicContact CG1-CG 4.4Å; F130-C132 PolarHBondContact O-N 3.42Å
131	G	25.6	Very low	28.9	Very low	82 Å²	82	148.1 Å²	148.1	85%	0.845	79%	0.794	S	S	*	*			trans	-81.9	101.3	166.7	0	0	0	0	0	111.6
132	C	22.9	Very low	28.7	Very low	124 Å²	124	152.1 Å²	152.1	84%	0.838	80%	0.798	S	S	*	*			trans	-85.3	141.9	172	-155.8	0	0	0	0	111.3	F130	F130-C132 PolarHBondContact O-N 3.42Å
133	K	27	Very low	28.6	Very low	193 Å²	193	146.1 Å²	146.1	84%	0.839	79%	0.787	S	S	*	*			trans	174.5	130.7	156.8	-100.4	164	-174.6	-174.6	0	107.8
134	T	29.5	Very low	28.6	Very low	118 Å²	118	145.2 Å²	145.2	72%	0.724	79%	0.79	S	S	*	*			cis	-175.2	137.6	8.9	7.7	0	0	0	0	108
135	S	28.1	Very low	28.5	Very low	86 Å²	86	146.5 Å²	146.5	60%	0.601	79%	0.79	S	S	*	*			trans	47.6	141.8	138.3	69.7	0	0	0	0	120.9
136	H	30.5	Very low	28.5	Very low	168 Å²	168	146.3 Å²	146.3	78%	0.778	79%	0.788	S	S	*	*			cis	-158.8	135.4	36.2	-71.9	-93.4	0	0	0	107.7
137	I	28	Very low	28.5	Very low	152 Å²	152	143.2 Å²	143.2	78%	0.779	78%	0.777	S	S	*	*				47.1	133.5	69	-37.2	-174	0	0	0	116.4
138	I	30.8	Very low	28.6	Very low	141 Å²	141	142.5 Å²	142.5	72%	0.723	78%	0.775	S	S	*	*			trans	95.4	118.1	160	-50	-175.9	0	0	0	112.8
139	D	29.4	Very low	28.6	Very low	151 Å²	151	148.3 Å²	148.3	81%	0.807	79%	0.785	S	S	*	*			cis	-157.6	150.5	36.9	-114.4	-30.4	0	0	0	114.1
140	I	27.8	Very low	28.9	Very low	156 Å²	156	147.6 Å²	147.6	80%	0.8	77%	0.774	S	S	*	*			trans	-91.8	127.9	168.5	-69	165.9	0	0	0	107.7
141	I	31.6	Very low	29.1	Very low	163 Å²	163	148.5 Å²	148.5	84%	0.836	77%	0.774	S	S	*	*			trans	179.2	122.8	142.6	-86.8	148.6	0	0	0	107
142	R	27.1	Very low	29.2	Very low	228 Å²	228	152.2 Å²	152.2	86%	0.86	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-102.9	119.4	-170.8	-167.6	-170.3	-75	-171.6	-1.8	109.6
143	P	29.1	Very low	29.5	Very low	104 Å²	104	157.1 Å²	157.1	68%	0.675	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-95.9	162.6	158.3	26.1	-12	0	0	0	110.7
144	P	30.5	Very low	29.7	Very low	125 Å²	125	152.1 Å²	152.1	81%	0.812	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-65.6	149	-165.3	27.2	-34.3	0	0	0	113.2	L146	P144-L146 PolarHBondContact O-N 3.3Å
145	Q	29.8	Very low	29.7	Very low	185 Å²	185	151 Å²	151	86%	0.864	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-64.8	119.5	-166.4	-59.1	-152.1	5.9	0	0	114.1
146	L	29.9	Very low	29.7	Very low	141 Å²	141	151.7 Å²	151.7	74%	0.738	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-99	143.1	151.2	-86.1	135.2	0	0	0	107.9	P144	P144-L146 PolarHBondContact O-N 3.3Å
147	P	32.5	Very low	29.6	Very low	96 Å²	96	151.5 Å²	151.5	62%	0.623	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-65	155.2	-174.4	28	-33.7	0	0	0	111.7	R149	P147-R149 PolarHBondContact O-N 3.23Å; P147-R149 VanDerWaalsContact O-N 3.08Å
148	P	31	Very low	29.6	Very low	122 Å²	122	150.5 Å²	150.5	79%	0.792	75%	0.749	S	S	*	*			trans	-71.2	109.7	-169	29.2	-32.9	0	0	0	111.1	K150	P148-K150 PolarHBondContact O-N 3.04Å
149	R	28.6	Very low	29.5	Very low	236 Å²	236	150.2 Å²	150.2	89%	0.891	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-64.1	116	161.9	-84.1	-176.3	172.6	175.3	-0	109	P147 Y151	P147-R149 PolarHBondContact O-N 3.23Å; P147-R149 VanDerWaalsContact O-N 3.08Å; R149-Y151 PolarHBondContact O-N 2.93Å
150	K	31	Very low	29.5	Very low	142 Å²	142	151.7 Å²	151.7	62%	0.617	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-59.1	131.9	167.5	-89.1	-178.2	172.5	178.8	0	110.8	P148 K966	P148-K150 PolarHBondContact O-N 3.04Å; K150-K966 PolarHBondContact NZ-OXT 3.3Å
151	Y	30.4	Very low	29.5	Very low	206 Å²	206	152 Å²	152	81%	0.808	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-58.2	133.6	-177.5	-108.2	-111.7	0	0	0	115.2	R149	R149-Y151 PolarHBondContact O-N 2.93Å
152	Q	28.6	Very low	29.4	Very low	160 Å²	160	153.3 Å²	153.3	75%	0.748	76%	0.755	S	S	*	*			trans	37	106.7	132.2	-107.8	147.2	-28	0	0	119.4
153	R	28.4	Very low	29.6	Very low	226 Å²	226	150.5 Å²	150.5	85%	0.853	76%	0.755	S	S	*	*			trans	-128.8	122.8	139	-112.1	-176.4	-177.8	178.9	2.4	109.2
154	S	30.5	Very low	29.6	Very low	89 Å²	89	157.1 Å²	157.1	62%	0.622	77%	0.767	S	S	*	*			trans	-70.6	135.1	179.7	34	0	0	0	0	113
155	T	29.2	Very low	29.4	Very low	94 Å²	94	156.1 Å²	156.1	58%	0.577	76%	0.763	S	S	*	*			trans	-139.9	78.1	148.6	17.6	0	0	0	0	107.8
156	N	28.6	Very low	29.7	Very low	100 Å²	100	153 Å²	153	54%	0.535	76%	0.759	S	S	.	*			trans	-117.5	89.2	150.9	-86.6	-17.2	0	0	0	105.4
157	L	29.6	Very low	29.6	Very low	164 Å²	164	150.6 Å²	150.6	86%	0.859	75%	0.754	S	S	*	*			trans	-117.7	87.4	149.6	-146.4	92.5	0	0	0	104.8
158	L	27.8	Very low	29.5	Very low	131 Å²	131	152.8 Å²	152.8	69%	0.686	76%	0.76	S	S	*	*			trans	-65	132.3	162	-86.6	155.5	0	0	0	107.7
159	I	28.4	Very low	29.4	Very low	136 Å²	136	153 Å²	153	70%	0.697	76%	0.759	S	S	*	*	S	Bend	trans	67.6	125.1	145.6	-51.1	165.8	0	0	0	114.9
160	F	28.1	Very low	29.3	Very low	182 Å²	182	147 Å²	147	80%	0.798	75%	0.753	S	S	*	*	S	Bend	trans	85.2	82.6	-172.3	-72.3	-89.7	0	0	0	116.8
161	N	29.3	Very low	29.1	Very low	161 Å²	161	147.9 Å²	147.9	86%	0.861	76%	0.763	S	S	*	*			trans	161.8	43.9	140.5	-83.7	-28	0	0	0	113.5
162	M	29.2	Very low	29.2	Very low	191 Å²	191	145.1 Å²	145.1	94%	0.941	76%	0.761	S	S	*	*			trans	-112.4	52.1	170.8	-75.2	-154.7	-146	0	0	112.9
163	I	30.6	Very low	29.1	Very low	169 Å²	169	141.9 Å²	141.9	87%	0.867	76%	0.756	S	S	*	*			trans	-142.6	80	161.7	-53.3	178.5	0	0	0	108.3
164	R	29.9	Very low	29.2	Very low	244 Å²	244	141.4 Å²	141.4	92%	0.921	75%	0.754	S	S	*	*			trans	-163.9	111.4	152.9	-132.8	170.8	178.7	164.3	-0.7	109
165	S	26.5	Very low	29.2	Very low	103 Å²	103	144.3 Å²	144.3	72%	0.72	76%	0.755	S	S	*	*			trans	-63.3	163.3	162	72.5	0	0	0	0	109.3
166	P	35.2	Very low	29.2	Very low	120 Å²	120	147.3 Å²	147.3	78%	0.779	76%	0.763	S	S	*	*				-140.7	132.2	103.4	25.2	-5.7	0	0	0	113.1
167	S	27.3	Very low	29.4	Very low	91 Å²	91	150.9 Å²	150.9	64%	0.636	78%	0.776	S	S	*	*			trans	-52.9	129.1	139	42	0	0	0	0	109.1
168	D	31.7	Very low	29.4	Very low	142 Å²	142	150.4 Å²	150.4	76%	0.759	77%	0.774	S	S	*	*			trans	168.1	122.5	134.5	-85.3	-11.1	0	0	0	112.1
169	T	27.6	Very low	29.4	Very low	126 Å²	126	149.5 Å²	149.5	77%	0.773	78%	0.778	S	S	*	*			trans	44	127.7	141.1	18.4	0	0	0	0	120.5
170	C	27.9	Very low	29.4	Very low	111 Å²	111	149.9 Å²	149.9	75%	0.75	78%	0.78	S	S	*	*				177	129.7	79.5	-141.8	0	0	0	0	112.4
171	L	26	Very low	29.4	Very low	159 Å²	159	150.7 Å²	150.7	83%	0.832	78%	0.783	S	S	*	*			trans	-63.2	173.3	154.9	-90.3	115.9	0	0	0	110.7
172	I	32.3	Very low	29.4	Very low	149 Å²	149	151.4 Å²	151.4	76%	0.764	78%	0.782	S	S	*	*			trans	115.7	88.5	154.1	-55.5	161.6	0	0	0	114.9
173	S	27.6	Very low	29.5	Very low	92 Å²	92	150 Å²	150	64%	0.643	78%	0.777	S	S	*	*				23.1	127.8	114.4	-158.9	0	0	0	0	119.9
174	R	30.5	Very low	29.7	Very low	216 Å²	216	150.2 Å²	150.2	82%	0.815	78%	0.778	S	S	*	*			trans	77.2	115.6	144.2	-79.1	173.5	177.2	-177	1.1	120.5
175	K	28.9	Very low	29.7	Very low	149 Å²	149	146.3 Å²	146.3	65%	0.648	78%	0.775	S	S	*	*				77.4	134.2	124.9	-79.6	-173.7	175.9	-176	0	119.8
176	H	29.5	Very low	30	Very low	158 Å²	158	146 Å²	146	73%	0.731	77%	0.774	S	S	*	*			trans	76.2	102.3	153.1	-78.5	-77.6	0	0	0	118.6
177	H	33.5	Very low	29.9	Very low	174 Å²	174	147.6 Å²	147.6	81%	0.806	78%	0.776	S	S	*	*				-177.6	124	102.5	-106.2	68	0	0	0	112
178	N	28.8	Very low	30	Very low	155 Å²	155	148.5 Å²	148.5	83%	0.829	78%	0.782	S	S	*	*			trans	-76.3	147.8	142.1	-81.9	-24.2	0	0	0	106.8
179	C	28.2	Very low	30.1	Very low	112 Å²	112	147.2 Å²	147.2	76%	0.757	78%	0.781	S	S	*	*				149.8	144.3	127.3	-151.9	0	0	0	0	112
180	L	29.3	Very low	30.4	Very low	144 Å²	144	149.6 Å²	149.6	75%	0.754	78%	0.784	S	S	*	*			trans	70.1	111.4	172.8	-69.3	110.6	0	0	0	115.9
181	K	28.2	Very low	30.6	Very low	198 Å²	198	149.5 Å²	149.5	86%	0.861	78%	0.781	S	S	*	*			cis	53.6	85.5	34.6	-124.5	-167.3	-168.2	-173.3	0	112.4
182	Q	29.2	Very low	30.9	Very low	177 Å²	177	151.4 Å²	151.4	83%	0.827	78%	0.783	S	S	*	*			trans	161.6	151.4	135	-90.8	179.5	-5.7	0	0	110.2
183	L	30.5	Very low	30.6	Very low	161 Å²	161	152 Å²	152	84%	0.843	79%	0.788	S	S	*	*			trans	83.7	92.2	174.3	-51.8	166.8	0	0	0	115
184	I	34.7	Very low	30.9	Very low	173 Å²	173	152.1 Å²	152.1	89%	0.887	79%	0.789	S	S	*	*				-157.4	99.9	112.8	-82.2	141.3	0	0	0	105.4
185	N	30.1	Very low	31	Very low	162 Å²	162	146.5 Å²	146.5	87%	0.866	78%	0.783	S	S	*	*			trans	-135.9	104.9	164	-138.7	17.4	0	0	0	103.9
186	S	32.7	Very low	31.1	Very low	98 Å²	98	148 Å²	148	69%	0.685	79%	0.792	S	S	*	*			trans	174.7	133.1	152	40.3	0	0	0	0	110.3
187	N	33.9	Very low	31.4	Very low	153 Å²	153	148.1 Å²	148.1	82%	0.818	80%	0.796	S	S	*	*			trans	91.8	87.4	155.8	-54.4	-12.8	0	0	0	117.7
188	S	28.3	Very low	31.4	Very low	110 Å²	110	145.8 Å²	145.8	77%	0.769	79%	0.794	S	S	*	*			trans	-52.3	157.2	134	55.6	0	0	0	0	110.9
189	P	34.6	Very low	31.5	Very low	114 Å²	114	143.7 Å²	143.7	74%	0.74	79%	0.792	S	S	*	*				-147.5	147.1	78.9	35.6	-15.9	0	0	0	116.7
190	Q	32.5	Very low	32	Very low	177 Å²	177	143.9 Å²	143.9	83%	0.827	79%	0.792	S	S	*	*			trans	57.6	140.9	133.7	-66	-91.5	-29.8	0	0	122.3
191	P	32.4	Very low	32.3	Very low	108 Å²	108	146.3 Å²	146.3	70%	0.701	80%	0.799	S	S	*	*			trans	-90.3	156.8	-179.7	38.2	-32.5	0	0	0	112.6
192	F	32.1	Very low	32.4	Very low	199 Å²	199	143.8 Å²	143.8	87%	0.873	80%	0.795	S	S	*	*			trans	-121.5	115.1	168.9	-106.2	-86.3	0	0	0	110.4
193	D	27.2	Very low	32.6	Very low	162 Å²	162	142.4 Å²	142.4	87%	0.866	80%	0.799	S	S	*	*			trans	-81.4	139.8	152.5	-98.8	-36.7	0	0	0	109
194	S	33.3	Very low	32.5	Very low	94 Å²	94	143 Å²	143	66%	0.657	80%	0.797	S	S	*	*			trans	-170.1	94.1	157.8	12.5	0	0	0	0	106.4
195	S	32.5	Very low	32.2	Very low	99 Å²	99	144.3 Å²	144.3	69%	0.692	80%	0.797	S	S	*	*				59.1	114.3	83.2	76.3	0	0	0	0	115.2
196	Q	31.6	Very low	31.9	Very low	181 Å²	181	141.8 Å²	141.8	85%	0.846	79%	0.792	S	S	*	*			trans	71.1	106.1	144.4	-63.1	-179.2	-4.1	0	0	120.3
197	I	35.2	Very low	31.9	Very low	159 Å²	159	143.3 Å²	143.3	82%	0.815	80%	0.797	S	S	*	*			trans	-156.9	94.6	132.8	-57.7	-167.9	0	0	0	105.6
198	T	34.1	Very low	31.7	Very low	125 Å²	125	141.3 Å²	141.3	77%	0.767	80%	0.795	S	S	*	*				42.8	134.6	104.5	60.5	0	0	0	0	114.5
199	S	31.4	Very low	31.5	Very low	111 Å²	111	144.1 Å²	144.1	78%	0.776	80%	0.798	S	S	*	*			cis	-174.8	173.6	3.5	53.8	0	0	0	0	106.3
200	P	37.8	Very low	31.4	Very low	116 Å²	116	144.6 Å²	144.6	75%	0.753	80%	0.801	S	S	*	*			trans	-98	168.7	-156.8	39.5	-33.9	0	0	0	114.5
201	E	35.5	Very low	31.1	Very low	196 Å²	196	141.7 Å²	141.7	92%	0.916	80%	0.796	S	S	*	*			trans	-159.2	137.2	153.3	-114.2	168.9	-155.7	0	0	113.1
202	D	30.3	Very low	31.1	Very low	145 Å²	145	145.7 Å²	145.7	78%	0.775	81%	0.805	S	S	*	*			trans	-66.6	157.5	-177.2	-63.5	-67.9	0	0	0	114.4
203	T	33.8	Very low	30.8	Very low	147 Å²	147	141.3 Å²	141.3	90%	0.902	80%	0.799	S	S	*	*			trans	-162.6	103.6	135.6	14.9	0	0	0	0	110.6
204	Q	28.3	Very low	31.1	Very low	173 Å²	173	139.4 Å²	139.4	81%	0.808	80%	0.798	S	S	*	*			trans	-63.9	144.4	161	-67.6	171.9	-23.6	0	0	110.2
205	F	29.1	Very low	30.8	Very low	201 Å²	201	142.5 Å²	142.5	88%	0.882	81%	0.807	S	S	*	*			trans	-148.8	111.1	138.1	-107	-77.4	0	0	0	109.7	V207	F205-V207 HydrophobicContact CD1-CG2 4.08Å; F205-V207 HydrophobicContact CE1-CG2 4.45Å
206	S	24	Very low	30.8	Very low	110 Å²	110	145.3 Å²	145.3	77%	0.769	81%	0.813	S	S	*	*			trans	-111.2	131.7	163.4	54.5	0	0	0	0	105.9
207	V	31.1	Very low	30.8	Very low	129 Å²	129	140.7 Å²	140.7	78%	0.782	80%	0.801	S	S	*	*			trans	-137.3	130.6	164.4	-177	0	0	0	0	108.8	F205	F205-V207 HydrophobicContact CD1-CG2 4.08Å; F205-V207 HydrophobicContact CE1-CG2 4.45Å
208	S	31.1	Very low	30.8	Very low	111 Å²	111	139.5 Å²	139.5	78%	0.776	80%	0.796	S	S	*	*			trans	-81.9	163.3	-168.3	27.7	0	0	0	0	114.6
209	M	24	Very low	30.7	Very low	169 Å²	169	142.6 Å²	142.6	83%	0.833	80%	0.799	S	S	*	*			trans	-52.8	169.3	173.6	-60.3	-170.8	173.9	0	0	114.7
210	P	31.3	Very low	31	Very low	125 Å²	125	142.4 Å²	142.4	81%	0.812	80%	0.795	S	S	*	*				-143.1	152.3	95.5	33.8	-16.7	0	0	0	115.4
211	T	27.5	Very low	30.7	Very low	115 Å²	115	143.9 Å²	143.9	71%	0.706	80%	0.797	S	S	*	*			trans	-71.1	144.5	166.6	41.8	0	0	0	0	111.6
212	H	31.5	Very low	30.7	Very low	192 Å²	192	139.3 Å²	139.3	89%	0.889	79%	0.787	S	S	*	*			trans	-149.7	123.5	151.1	-107.7	-74.1	0	0	0	110.4
213	S	27.3	Very low	30.8	Very low	108 Å²	108	141.4 Å²	141.4	76%	0.755	79%	0.789	S	S	*	*			trans	-80.6	144.6	173.8	51.9	0	0	0	0	112.2
214	S	33.3	Very low	30.7	Very low	121 Å²	121	140.7 Å²	140.7	85%	0.846	78%	0.779	S	S	*	*			trans	-166	126.1	144	50.2	0	0	0	0	112
215	N	26.8	Very low	30.8	Very low	159 Å²	159	142.3 Å²	142.3	85%	0.85	78%	0.783	S	S	*	*			trans	-64.8	166.7	171.5	-66.5	-39.5	0	0	0	113.7
216	I	32.7	Very low	30.9	Very low	158 Å²	158	140.4 Å²	140.4	81%	0.81	78%	0.777	S	S	*	*			trans	155.3	98.7	147.1	-83	155.7	0	0	0	106
217	S	31.6	Very low	31.2	Very low	85 Å²	85	140.9 Å²	140.9	59%	0.594	77%	0.771	S	S	*	*				79.7	134.1	74.8	81.9	0	0	0	0	116
218	D	33.5	Very low	31.4	Very low	133 Å²	133	143.2 Å²	143.2	71%	0.711	77%	0.773	S	S	*	*			trans	89.6	104.4	155.3	-48	-44.5	0	0	0	118.9
219	F	33.6	Very low	31.4	Very low	190 Å²	190	142.7 Å²	142.7	83%	0.833	77%	0.765	S	S	*	*				69.4	159.6	77.6	-95.9	-59.6	0	0	0	115.7
220	P	38.1	Very low	31.9	Very low	108 Å²	108	140.9 Å²	140.9	70%	0.701	76%	0.764	S	S	*	*			cis	-131.2	178.8	-33.1	17.4	7	0	0	0	115.5
221	D	30.9	Very low	31.9	Very low	146 Å²	146	141.4 Å²	141.4	78%	0.781	76%	0.76	S	S	*	*			trans	-39.6	159.4	166.3	-56.4	-57.2	0	0	0	120.4
222	S	34.2	Very low	32.3	Very low	101 Å²	101	143.8 Å²	143.8	71%	0.706	76%	0.763	S	S	*	*				172.5	135.4	119.4	48.9	0	0	0	0	116.4
223	K	33.4	Very low	32.5	Very low	189 Å²	189	140.4 Å²	140.4	82%	0.822	76%	0.756	S	S	*	*			trans	69.8	147.9	137.5	-67.8	173.8	-179.4	177.5	0	117.9
224	L	31.4	Very low	32.7	Very low	132 Å²	132	142 Å²	142	69%	0.691	76%	0.755	S	S	*	*			cis	-172.4	149.1	9.7	-143.9	87.6	0	0	0	105.5
225	F	29.8	Very low	32.7	Very low	206 Å²	206	144.2 Å²	144.2	90%	0.904	76%	0.757	S	S	*	*				-179.5	129	126	-107.9	-77.6	0	0	0	111.3
226	H	32.4	Very low	33.1	Very low	162 Å²	162	141.7 Å²	141.7	75%	0.75	75%	0.749	S	S	*	*			trans	-127.4	155.7	-168	-124.8	-63.3	0	0	0	109.8
227	N	30.9	Very low	33.2	Very low	120 Å²	120	140 Å²	140	64%	0.642	75%	0.746	S	S	*	*			trans	87.9	122.6	144.5	-67	-15.2	0	0	0	122.6
228	H	35.1	Very low	33.3	Very low	177 Å²	177	141.4 Å²	141.4	82%	0.819	75%	0.752	S	S	*	*				177.5	105.1	114.4	-96.1	-65	0	0	0	109.2
229	T	31	Very low	33.4	Very low	100 Å²	100	140.4 Å²	140.4	61%	0.613	75%	0.75	S	S	*	*				51.4	115.2	87.9	63	0	0	0	0	116.5
230	T	33.8	Very low	33.4	Very low	132 Å²	132	138.9 Å²	138.9	81%	0.81	75%	0.751	S	S	*	*				160	128.6	104.6	44.8	0	0	0	0	114.3
231	D	30.9	Very low	33.1	Very low	135 Å²	135	137.1 Å²	137.1	72%	0.722	75%	0.752	S	S	*	*			trans	-5.3	152.6	154.3	-58.3	-46.4	0	0	0	125
232	H	37	Very low	33	Very low	166 Å²	166	135.7 Å²	135.7	77%	0.769	75%	0.754	S	S	*	*				126.6	134.6	126.8	-81.8	-56.2	0	0	0	119.5
233	T	35.1	Very low	32.7	Very low	120 Å²	120	141.3 Å²	141.3	74%	0.736	77%	0.766	S	S	*	*			trans	93.9	99.2	147.5	52.5	0	0	0	0	122.1
234	D	31.8	Very low	32.6	Very low	141 Å²	141	141.7 Å²	141.7	75%	0.754	77%	0.771	S	S	*	*				30.9	120.1	118.8	-55.3	-34.9	0	0	0	121
235	L	32.9	Very low	32.4	Very low	169 Å²	169	139.7 Å²	139.7	89%	0.885	77%	0.773	S	S	*	*				165.3	152.6	102.2	-101.2	122	0	0	0	111.9
236	P	36	Very low	32.4	Very low	105 Å²	105	140 Å²	140	68%	0.682	77%	0.774	S	S	*	*			trans	-105.3	178.8	-162.9	38.8	-26.2	0	0	0	113.3
237	V	34	Very low	32.2	Very low	122 Å²	122	140.6 Å²	140.6	74%	0.739	78%	0.775	S	S	*	*			trans	162.2	113.1	141.2	157.7	0	0	0	0	111.3
238	T	33.1	Very low	32.3	Very low	116 Å²	116	142.8 Å²	142.8	71%	0.712	79%	0.785	S	S	*	*			trans	44.3	141	137.9	76.6	0	0	0	0	120.6
239	T	35.4	Very low	32	Very low	112 Å²	112	139.8 Å²	139.8	69%	0.687	77%	0.774	S	S	*	*			cis	-168.1	144.6	46.3	23.3	0	0	0	0	111.8
240	D	33.3	Very low	32.1	Very low	158 Å²	158	139.7 Å²	139.7	85%	0.845	77%	0.77	S	S	*	*			trans	61	128	136.6	-56.6	-20.7	0	0	0	124.3
241	G	32.3	Very low	32	Very low	71 Å²	71	141.3 Å²	141.3	73%	0.732	77%	0.774	S	S	*	*			trans	157.5	64.6	148.2	0	0	0	0	0	119.4
242	S	28.8	Very low	32.1	Very low	116 Å²	116	139.7 Å²	139.7	81%	0.811	77%	0.77	S	S	*	*			trans	71.1	93.6	150.8	65.7	0	0	0	0	120.8
243	F	29.2	Very low	31.8	Very low	219 Å²	219	139 Å²	139	96%	0.961	77%	0.771	S	S	*	*			trans	-159.4	92.9	142.1	-119.5	-85.1	0	0	0	109
244	E	29.5	Very low	31.7	Very low	197 Å²	197	141.3 Å²	141.3	92%	0.921	78%	0.779	S	S	*	*			trans	-131.6	121.2	165.4	-96.4	-151.1	157.1	0	0	109.7
245	A	28.7	Very low	31.5	Very low	90 Å²	90	141 Å²	141	74%	0.744	78%	0.778	S	S	*	*			trans	176.3	78.1	134.5	0	0	0	0	0	109.9
246	F	28.8	Very low	31.3	Very low	212 Å²	212	140.1 Å²	140.1	93%	0.93	77%	0.774	S	S	*	*	S	Bend	trans	-167.4	123.4	147.7	-115	-78.5	0	0	0	110.5
247	K	29.3	Very low	31	Very low	174 Å²	174	145.5 Å²	145.5	76%	0.757	78%	0.782	S	S	*	*			trans	92.5	104.5	172.2	-73.3	-179.2	170.6	174	0	118.9
248	I	31.5	Very low	30.8	Very low	167 Å²	167	144.9 Å²	144.9	86%	0.856	78%	0.779	S	S	*	*				-144.5	101.1	127.6	-58.3	-175.5	0	0	0	104.4
249	L	30.6	Very low	30.6	Very low	114 Å²	114	145.5 Å²	145.5	60%	0.597	79%	0.785	S	S	*	*				55.4	102.6	67.7	-99.5	162.8	0	0	0	115
250	N	31.3	Very low	30.5	Very low	98 Å²	98	147 Å²	147	52%	0.524	79%	0.794	S	S	.	*			trans	47.7	115.9	148.8	-62.3	-31.4	0	0	0	119.5	R42	R42-N250 PolarHBondContact NH1-ND2 2.97Å
251	N	32.3	Very low	30.3	Very low	166 Å²	166	148 Å²	148	89%	0.888	79%	0.794	S	S	*	*			trans	-136.9	140.7	135.5	-107.4	-21	0	0	0	110.3
252	P	32.8	Very low	30.2	Very low	100 Å²	100	152.5 Å²	152.5	65%	0.649	80%	0.801	S	S	*	*			trans	-91.4	160.2	-179	38.4	-32.6	0	0	0	111.5
253	L	30.8	Very low	30.1	Very low	151 Å²	151	156.1 Å²	156.1	79%	0.791	81%	0.805	S	S	*	*			trans	66.6	106	161.4	-60.3	161.8	0	0	0	116.5
254	D	32.6	Very low	30.1	Very low	169 Å²	169	155.5 Å²	155.5	90%	0.904	80%	0.802	S	S	*	*				-156.2	134.4	117.1	-108.5	-23.5	0	0	0	112.1
255	N	28	Very low	30.1	Very low	135 Å²	135	154.7 Å²	154.7	72%	0.722	80%	0.798	S	S	*	*			trans	-78.4	160.2	-179.8	-81.5	-42.3	0	0	0	111.2
256	N	28.8	Very low	30.2	Very low	151 Å²	151	161.2 Å²	161.2	81%	0.807	81%	0.805	S	S	*	*			trans	92.3	97	166.5	-53.3	-28.3	0	0	0	115.6
257	Y	30.6	Very low	30.1	Very low	217 Å²	217	162.7 Å²	162.7	85%	0.851	80%	0.804	S	S	*	*				-166.9	109.3	116.1	-120.8	-99.5	0	0	0	111.3
258	T	29.7	Very low	30.1	Very low	109 Å²	109	159.9 Å²	159.9	67%	0.669	81%	0.807	S	S	*	*			trans	30.6	124.2	148	57.3	0	0	0	0	121.7
259	P	27.6	Very low	30	Very low	130 Å²	130	159.8 Å²	159.8	84%	0.844	81%	0.807	S	S	*	*			trans	-88.7	133.2	169.3	34.6	-27.6	0	0	0	111.4
260	T	33.6	Very low	30	Very low	142 Å²	142	162.8 Å²	162.8	87%	0.871	82%	0.818	S	S	*	*			trans	-104.4	137.9	162.3	44	0	0	0	0	110.5
261	E	29.3	Very low	29.9	Very low	180 Å²	180	165.5 Å²	165.5	84%	0.841	83%	0.832	S	S	*	*			trans	-59	135.2	-169.6	-54.7	-171.5	133.4	0	0	114.7
262	D	30.1	Very low	29.9	Very low	166 Å²	166	163.3 Å²	163.3	89%	0.888	83%	0.825	S	S	*	*			trans	-176.8	73.6	133.6	-93.3	-21.6	0	0	0	109.4
263	H	28.2	Very low	30	Very low	192 Å²	192	165.1 Å²	165.1	89%	0.889	83%	0.828	S	S	*	*			trans	-114.8	104.5	165.6	-100.4	-58	0	0	0	108
264	K	28.4	Very low	29.9	Very low	205 Å²	205	166.8 Å²	166.8	89%	0.891	83%	0.831	S	S	*	*			trans	-178.5	84.5	154.5	-103.7	164.6	-171.6	179.8	0	111.8
265	Q	28.7	Very low	29.9	Very low	180 Å²	180	166 Å²	166	84%	0.841	83%	0.827	S	S	*	*	S	Bend	trans	178.6	146.5	144.3	-104.4	163.7	-1.4	0	0	108.9
266	Y	30.5	Very low	29.9	Very low	228 Å²	228	162.9 Å²	162.9	89%	0.894	83%	0.827	S	S	*	*	S	Bend	trans	90.3	44.7	-174.6	-61.3	-84.4	0	0	0	117.3
267	R	27.2	Very low	29.9	Very low	243 Å²	243	164.9 Å²	164.9	92%	0.917	83%	0.829	S	S	*	*	S	Bend	trans	-132.5	143.5	136	-80	-173.5	-175.9	-174.6	1.5	106.7
268	S	29.1	Very low	29.9	Very low	115 Å²	115	163.5 Å²	163.5	80%	0.804	83%	0.828	S	S	*	*			trans	91.3	77.1	-170.6	-175.2	0	0	0	0	115.7
269	L	30.3	Very low	30	Very low	164 Å²	164	163 Å²	163	86%	0.859	83%	0.826	S	S	*	*			trans	-153.4	59.2	148.1	-146.7	89	0	0	0	109.4
270	H	30.6	Very low	29.9	Very low	178 Å²	178	168 Å²	168	82%	0.824	83%	0.829	S	S	*	*	S	Bend	trans	-127.1	-3	173.3	-121.5	-66.4	0	0	0	115.2
271	D	28.9	Very low	29.8	Very low	154 Å²	154	167.8 Å²	167.8	82%	0.824	83%	0.828	S	S	*	*	S	Bend	trans	-138.9	78.3	176.5	-70.2	-47.4	0	0	0	110.6
272	T	32.7	Very low	29.8	Very low	120 Å²	120	168 Å²	168	74%	0.736	83%	0.827	S	S	*	*			trans	-163.4	127.7	153.2	-9.1	0	0	0	0	110.6
273	I	34	Very low	29.7	Very low	139 Å²	139	169.5 Å²	169.5	71%	0.713	83%	0.831	S	S	*	*			trans	91.2	73.2	153.6	-49.2	167.1	0	0	0	114.9	D275	I273-D275 WeakPolarHBondContact CG2-O 3.38Å
274	Q	29	Very low	29.7	Very low	185 Å²	185	167.1 Å²	167.1	86%	0.864	82%	0.824	S	S	*	*				-48	149.7	122.8	-76.7	178.4	-35.1	0	0	109.8
275	D	32.1	Very low	29.7	Very low	152 Å²	152	162.8 Å²	162.8	81%	0.813	82%	0.82	S	S	*	*			trans	91	105.5	-168.4	-53.5	-26.2	0	0	0	111.8	I273	I273-D275 WeakPolarHBondContact CG2-O 3.38Å
276	G	27.8	Very low	29.8	Very low	71 Å²	71	162.7 Å²	162.7	73%	0.732	82%	0.819	S	S	*	*			cis	103.4	102	48	0	0	0	0	0	108.3
277	K	30.6	Very low	29.6	Very low	192 Å²	192	158.3 Å²	158.3	84%	0.835	82%	0.817	S	S	*	*			trans	97.5	109.7	162	-62.9	-175.1	174.6	172.3	0	120.5
278	F	28.8	Very low	29.8	Very low	189 Å²	189	154.5 Å²	154.5	83%	0.829	81%	0.813	S	S	*	*			trans	66	165.7	130.7	-76.1	-92	0	0	0	119.6
279	P	32.2	Very low	30.1	Very low	98 Å²	98	154.8 Å²	154.8	64%	0.636	81%	0.812	S	S	*	*				-139	178.9	-56.4	37	-18.5	0	0	0	114.7
280	Y	26.1	Very low	29.9	Very low	234 Å²	234	154.5 Å²	154.5	92%	0.918	81%	0.811	S	S	*	*			trans	-56.8	135.4	165.8	-74.6	-96.3	0	0	0	113.4
281	T	31.3	Very low	30.1	Very low	138 Å²	138	153.9 Å²	153.9	85%	0.847	81%	0.814	S	S	*	*			trans	-140.1	132.7	159.4	-2.1	0	0	0	0	112.6
282	K	29.5	Very low	30.3	Very low	186 Å²	186	150.6 Å²	150.6	81%	0.809	81%	0.808	S	S	*	*			trans	-56.3	136	174.1	-71.7	165.3	168.9	172.5	0	111.7	N284	K282-N284 PolarHBondContact O-N 3.01Å
283	M	27.1	Very low	30.4	Very low	197 Å²	197	149.8 Å²	149.8	97%	0.97	81%	0.808	S	S	*	*			trans	-76.8	99.7	153.1	-86.8	178.8	171.6	0	0	108.2
284	N	30	Very low	30.3	Very low	141 Å²	141	149.9 Å²	149.9	75%	0.754	81%	0.81	S	S	*	*			trans	-117.9	128.4	156.7	-97.8	1.4	0	0	0	107.6	K282	K282-N284 PolarHBondContact O-N 3.01Å
285	S	26.5	Very low	30.6	Very low	115 Å²	115	148.2 Å²	148.2	80%	0.804	81%	0.807	S	S	*	*			trans	-56.2	127.7	166.9	47.8	0	0	0	0	112.5
286	Q	30.6	Very low	30.5	Very low	177 Å²	177	145.7 Å²	145.7	83%	0.827	80%	0.801	S	S	*	*			trans	-161	100.7	158.1	-103.1	171.7	-3.9	0	0	106.7
287	T	28.3	Very low	30.8	Very low	137 Å²	137	149.8 Å²	149.8	84%	0.84	81%	0.805	S	S	*	*				54.5	104.9	105.7	51.3	0	0	0	0	114.5
288	I	31.3	Very low	30.9	Very low	162 Å²	162	149.1 Å²	149.1	83%	0.831	80%	0.804	S	S	*	*			trans	-123	140.3	161.7	-67.8	179.7	0	0	0	106.3
289	P	34.4	Very low	31.2	Very low	121 Å²	121	144.4 Å²	144.4	79%	0.786	79%	0.792	S	S	*	*			trans	-90.6	149.7	-149.3	34.8	-32.3	0	0	0	114.2
290	D	27	Very low	31.3	Very low	158 Å²	158	146.4 Å²	146.4	85%	0.845	80%	0.803	S	S	*	*			trans	-69.1	140.7	171.2	-67.7	-40.2	0	0	0	111.7
291	N	33.3	Very low	31.5	Very low	165 Å²	165	142.4 Å²	142.4	88%	0.882	80%	0.798	S	S	*	*			trans	-147.6	130.4	151.2	-114.4	-12.6	0	0	0	111.6
292	A	33.5	Very low	31.7	Very low	85 Å²	85	144.3 Å²	144.3	70%	0.702	80%	0.801	S	S	*	*			trans	78.8	101.1	152.2	0	0	0	0	0	120.3
293	S	34.4	Very low	31.7	Very low	104 Å²	104	142.4 Å²	142.4	73%	0.727	80%	0.795	S	S	*	*				112.8	107.6	113.8	72.5	0	0	0	0	119.1
294	N	32.3	Very low	31.9	Very low	141 Å²	141	139.9 Å²	139.9	75%	0.754	78%	0.779	S	S	*	*				88	127.8	125.4	-70.1	-8.8	0	0	0	121.8
295	N	34.8	Very low	31.8	Very low	149 Å²	149	139 Å²	139	80%	0.797	77%	0.774	S	S	*	*			trans	91.5	127.2	155.3	-56.5	-19.8	0	0	0	116.3
296	S	30.4	Very low	32	Very low	99 Å²	99	143.8 Å²	143.8	69%	0.692	78%	0.776	S	S	*	*			cis	177.8	161.8	-18.1	34.5	0	0	0	0	105.9
297	I	34.3	Very low	31.8	Very low	158 Å²	158	142.5 Å²	142.5	81%	0.81	77%	0.774	S	S	*	*			trans	97.3	74.7	162.3	-45.7	166.4	0	0	0	117.5
298	Q	32.4	Very low	31.8	Very low	178 Å²	178	144.6 Å²	144.6	83%	0.832	78%	0.775	S	S	*	*				17.7	167.7	115.2	-83.8	-157.4	2.3	0	0	122.4
299	P	35.2	Very low	31.8	Very low	89 Å²	89	144 Å²	144	58%	0.578	78%	0.778	S	S	*	*			cis	-147.2	178.9	-45.6	41	-21.5	0	0	0	113.6
300	T	34.6	Very low	31.3	Very low	140 Å²	140	144.8 Å²	144.8	86%	0.859	78%	0.776	S	S	*	*				173.8	129.7	122	33.7	0	0	0	0	113
301	N	29.6	Very low	31.3	Very low	151 Å²	151	142 Å²	142	81%	0.807	77%	0.769	S	S	*	*			trans	-86.9	163.3	179.8	-66.8	-45.4	0	0	0	111.9
302	I	36.5	Very low	31.1	Very low	178 Å²	178	140.6 Å²	140.6	91%	0.913	77%	0.766	S	S	*	*				-155	138.7	125.2	-91.3	145.5	0	0	0	108.6
303	E	28.8	Very low	30.8	Very low	146 Å²	146	145.3 Å²	145.3	68%	0.682	78%	0.776	S	S	*	*			trans	-114.9	169.1	-159.8	-149.4	-167.2	165	0	0	110
304	K	31.6	Very low	30.6	Very low	144 Å²	144	145.6 Å²	145.6	63%	0.626	78%	0.778	S	S	*	*			trans	100.9	120.3	143.4	-79.1	167.1	174.1	131.6	0	122.9
305	N	28.9	Very low	30.3	Very low	123 Å²	123	148.5 Å²	148.5	66%	0.658	78%	0.784	S	S	*	*			trans	79.1	133.9	135.3	-60.2	-20.7	0	0	0	118
306	Y	30.3	Very low	30.1	Very low	215 Å²	215	151.7 Å²	151.7	84%	0.843	79%	0.791	S	S	*	*				-173.9	147.5	56.8	-119	-79.6	0	0	0	110.2
307	N	26.2	Very low	30	Very low	149 Å²	149	155.9 Å²	155.9	80%	0.797	80%	0.799	S	S	*	*			trans	-85.3	163.9	168.1	-87.5	-34.6	0	0	0	111.8
308	Q	27.5	Very low	29.6	Very low	181 Å²	181	154.4 Å²	154.4	85%	0.846	80%	0.798	S	S	*	*			trans	73.9	112.2	165.4	-80.5	179.1	-21.4	0	0	118.2
309	V	31.3	Very low	29.3	Very low	150 Å²	150	150.9 Å²	150.9	91%	0.909	79%	0.785	S	S	*	*				-153.8	135.1	119.1	174.2	0	0	0	0	109.5
310	N	25.6	Very low	28.9	Very low	138 Å²	138	152.6 Å²	152.6	74%	0.738	79%	0.793	S	S	*	*			trans	-70.3	153.7	-178	-77.6	-40.7	0	0	0	115.3
311	S	27	Very low	28.5	Very low	98 Å²	98	152.4 Å²	152.4	69%	0.685	79%	0.787	S	S	*	*			trans	72.7	131.6	134	68.1	0	0	0	0	120.9
312	T	27.1	Very low	28.6	Very low	136 Å²	136	153.6 Å²	153.6	83%	0.834	79%	0.785	S	S	*	*			trans	107.1	131.9	150.4	67.2	0	0	0	0	118.1
313	M	28.4	Very low	28.1	Very low	184 Å²	184	152.4 Å²	152.4	91%	0.906	78%	0.781	S	S	*	*			trans	92.2	89.6	164.6	-65.2	-156.5	169	0	0	120.2
314	S	30.6	Very low	28	Very low	111 Å²	111	153 Å²	153	78%	0.776	78%	0.784	S	S	*	*				97.2	91.7	116.6	-127.8	0	0	0	0	120
315	K	26.2	Very low	27.9	Very low	202 Å²	202	155.1 Å²	155.1	88%	0.878	79%	0.793	S	S	*	*			trans	12.2	109.9	134.6	-74.1	175.1	174.4	172.9	0	117.5
316	K	30	Very low	27.9	Very low	216 Å²	216	154.7 Å²	154.7	94%	0.939	80%	0.797	S	S	*	*			trans	-162.9	94.8	130.4	-111	173.2	-177.5	178.8	0	110.1
317	Q	28.3	Very low	28	Very low	186 Å²	186	150.4 Å²	150.4	87%	0.869	80%	0.795	S	S	*	*			trans	-83.2	122.1	174.1	-95.6	171.9	-21.9	0	0	110.4
318	T	26.3	Very low	28.3	Very low	128 Å²	128	149.6 Å²	149.6	79%	0.785	80%	0.796	S	S	*	*			trans	56.9	80.6	132.9	4.3	0	0	0	0	118.4
319	L	25.6	Very low	28.5	Very low	104 Å²	104	147.3 Å²	147.3	55%	0.545	80%	0.797	S	S	.	*			trans	-148.4	150	152.2	-119.9	112.8	0	0	0	107.8
320	T	26.5	Very low	28.3	Very low	124 Å²	124	144 Å²	144	76%	0.761	79%	0.794	S	S	*	*			trans	80.8	106.5	179.8	78.4	0	0	0	0	115.4
321	N	26.6	Very low	28.3	Very low	136 Å²	136	140.9 Å²	140.9	73%	0.727	79%	0.794	S	S	*	*			trans	-175.3	83	146	-88.7	-7.5	0	0	0	108.4
322	F	31	Very low	28.3	Very low	177 Å²	177	142.1 Å²	142.1	78%	0.776	80%	0.802	S	S	*	*	S	Bend	trans	-130.8	38	160.3	-112.7	-75.8	0	0	0	107.7
323	D	25.5	Very low	28.3	Very low	152 Å²	152	144 Å²	144	81%	0.813	80%	0.799	S	S	*	*	S	Bend	trans	-160	78.6	177.5	-81.2	-44.3	0	0	0	107.8
324	E	27.2	Very low	28.4	Very low	159 Å²	159	140.5 Å²	140.5	74%	0.743	79%	0.793	S	S	*	*			trans	-171.2	149	153.5	-117.4	165.2	172.4	0	0	112.1
325	F	29.8	Very low	28.4	Very low	188 Å²	188	144.3 Å²	144.3	83%	0.825	80%	0.798	S	S	*	*			trans	97	95.1	176.9	-61.9	-76.3	0	0	0	118
326	P	28.9	Very low	29.3	Very low	114 Å²	114	141.3 Å²	141.3	74%	0.74	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-75.2	144.3	147	33.8	-27.9	0	0	0	108.8
327	P	33.2	Very low	30	Very low	125 Å²	125	134.2 Å²	134.2	81%	0.812	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-77.1	134.1	168.8	31.3	-28.4	0	0	0	109.2
328	T	31.7	Very low	31.3	Very low	132 Å²	132	135 Å²	135	81%	0.81	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-57.5	142.2	167.5	34.6	0	0	0	0	111.2	G330	T328-G330 PolarHBondContact O-N 2.95Å
329	P	31	Very low	33.1	Very low	134 Å²	134	130.8 Å²	130.8	87%	0.87	74%	0.743	S	S	*	*	S	Bend	trans	-83.3	113.8	178.1	31.8	-28.6	0	0	0	109.5
330	G	27.5	Very low	35	Very low	81 Å²	81	130.9 Å²	130.9	84%	0.835	75%	0.752	S	S	*	*			trans	151.2	85.6	172.7	0	0	0	0	0	113.2	T328	T328-G330 PolarHBondContact O-N 2.95Å
331	G	26.7	Very low	37.1	Very low	72 Å²	72	125.7 Å²	125.7	74%	0.742	72%	0.723	S	S	*	*	S	Bend	trans	168.9	125.1	173.3	0	0	0	0	0	111.4	F333	G331-F333 PolarHBondContact O-N 2.98Å
332	S	26.6	Very low	39.9	Very low	123 Å²	123	119.3 Å²	119.3	86%	0.86	69%	0.689	S	S	*	*			trans	-41.8	124.1	-175	38	0	0	0	0	115.6	S334	S332-S334 PolarHBondContact O-N 3.45Å; S332-S334 VanDerWaalsContact O-N 3.09Å
333	F	27.6	Very low	42.7	Very low	176 Å²	176	113.7 Å²	113.7	77%	0.772	66%	0.664	S	S	*	*			trans	-77.9	85.1	-176.6	-152.7	-97.5	0	0	0	111	G331	G331-F333 PolarHBondContact O-N 2.98Å
334	S	29.6	Very low	45.9	Very low	111 Å²	111	106.4 Å²	106.4	78%	0.776	63%	0.626	S	S	*	*			trans	-142	14.1	175	-157.6	0	0	0	0	115.4	S332	S332-S334 PolarHBondContact O-N 3.45Å; S332-S334 VanDerWaalsContact O-N 3.09Å
335	Q	31	Very low	49	Very low	190 Å²	190	98.9 Å²	98.9	89%	0.888	59%	0.591	S	S	*	*			trans	-132.9	90	166.8	-68.7	-169.8	8	0	0	109.6	G337	Q335-G337 PolarHBondContact O-N 3.03Å; Q335-G337 VanDerWaalsContact O-N 3.09Å
336	R	44.1	Very low	52	Low	140 Å²	140	90 Å²	90	53%	0.528	55%	0.551	S	S	.	*			trans	-59	113.7	171.3	-84.4	-179	174.6	169.3	-1.5	108.4	K338 D468	R336-K338 PolarHBondContact O-N 3.27Å; R336-D468 IonicContact NH2-OD1 3.7Å; R336-D468 PolarHBondContact NH2-OD1 2.84Å
337	G	46.1	Very low	55	Low	67 Å²	67	85 Å²	85	69%	0.691	52%	0.519	S	S	*	.			trans	-52.7	135.3	-178.7	0	0	0	0	0	112.4	Q335 I339	Q335-G337 PolarHBondContact O-N 3.03Å; Q335-G337 VanDerWaalsContact O-N 3.09Å; G337-I339 PolarHBondContact O-N 3.27Å
338	K	55	Low	57.8	Low	201 Å²	201	83.5 Å²	83.5	87%	0.874	50%	0.5	S	S	*	.			trans	-64.8	113.4	178.2	-164.4	176.1	-175.1	178.9	0	108.7	R336 S340	R336-K338 PolarHBondContact O-N 3.27Å; K338-S340 PolarHBondContact O-N 3.17Å
339	I	63.9	Low	60.7	Low	41 Å²	41	77.2 Å²	77.2	21%	0.21	46%	0.462	C	S	.	.			trans	-66.4	121	175.8	-59.4	172.4	0	0	0	107.2	G337 G341 R541	G337-I339 PolarHBondContact O-N 3.27Å; I339-G341 PolarHBondContact O-N 2.68Å; I339-R541 HydrophobicContact CD1-CG 4.43Å; I339-R541 HydrophobicContact CG2-CG 4.41Å
340	S	65.4	Low	63.6	Low	106 Å²	106	71.8 Å²	71.8	74%	0.741	43%	0.427	S	S	*	.			trans	-75.5	107.4	174.6	-170.1	0	0	0	0	108.8	K338	K338-S340 PolarHBondContact O-N 3.17Å
341	G	71.1	Confident	66.7	Low	14 Å²	14	68.8 Å²	68.8	14%	0.144	39%	0.39	C	S	.	.			trans	-62.6	152.7	172.4	0	0	0	0	0	112.4	I339 G540	I339-G341 PolarHBondContact O-N 2.68Å; G341-G540 WeakPolarHBondContact CA-O 3.45Å; G341-G540 PolarHBondContact N-O 2.97Å; G341-G540 VanDerWaalsContact N-O 3.07Å
342	A	84.8	Confident	69.8	Low	3 Å²	3	69.1 Å²	69.1	3%	0.025	37%	0.373	C	S	.	.			trans	-100.3	133	176.8	0	0	0	0	0	111.1	L344 I413 D414 P510 V511 T542	A342-L344 PolarHBondContact O-N 3.1Å; A342-I413 HydrophobicContact CB-CG2 3.76Å; A342-D414 WeakPolarHBondContact CA-OD1 3.35Å; A342-D414 WeakPolarHBondContact CA-OD2 3.19Å; A342-D414 WeakPolarHBondContact CB-OD2 3.47Å; A342-P510 HydrophobicContact CB-CB 4.12Å; A342-V511 HydrophobicContact CB-CG2 3.81Å; A342-T542 PolarHBondContact N-OG1 3.2Å; A342-T542 WeakPolarHBondContact O-CB 3.33Å; A342-T542 PolarHBondContact O-OG1 3.48Å
343	K	90.1	Very high	72.7	Confident	58 Å²	58	65 Å²	65	25%	0.252	34%	0.343	S	S	.	.			trans	-80.4	113.4	170.5	-174.2	-179.3	-175.7	179.3	0	108.6	I375 D414 E653 I657	K343-I375 HydrophobicContact CD-CG2 4.3Å; K343-I375 HydrophobicContact CG-CG2 4.05Å; K343-D414 PolarHBondContact N-OD1 3.43Å; K343-D414 PolarHBondContact O-N 2.95Å; K343-E653 IonicContact NZ-OE1 2.65Å; K343-E653 PolarHBondContact NZ-OE1 3.42Å; K343-I657 HydrophobicContact CD-CD1 4.39Å
344	L	92.2	Very high	75.4	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	132.6	175.7	-169.5	152.9	0	0	0	109.1	A342 F346 L376 L398 V411 V511 F513 I544	A342-L344 PolarHBondContact O-N 3.1Å; L344-F346 HydrophobicContact CD2-CD1 3.93Å; L344-L376 HydrophobicContact CB-CB 4.35Å; L344-L376 HydrophobicContact CD2-CD1 4.18Å; L344-L376 PolarHBondContact N-O 2.81Å; L344-L376 PolarHBondContact O-N 3.12Å; L344-L398 HydrophobicContact CD2-CD1 4.4Å; L344-L398 HydrophobicContact CD2-CD2 3.92Å; L344-V411 HydrophobicContact CD1-CG1 4.48Å; L344-V411 HydrophobicContact CD2-CG1 4.17Å; L344-V411 HydrophobicContact CG-CG1 4.31Å; L344-V511 HydrophobicContact CD1-CG1 4.47Å; L344-F513 HydrophobicContact CD1-CE1 4.21Å; L344-F513 HydrophobicContact CD1-CZ 3.81Å; L344-I544 HydrophobicContact CD1-CD1 4.16Å
345	S	92.9	Very high	77.8	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.007	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	138.3	172.9	57.5	0	0	0	0	109.8	H347 G374 L412	S345-H347 WeakPolarHBondContact CB-NE2 3.18Å; S345-H347 PolarHBondContact OG-NE2 3.14Å; S345-G374 WeakPolarHBondContact CA-O 3.39Å; S345-L412 PolarHBondContact N-O 3.46Å; S345-L412 PolarHBondContact O-N 3.27Å
346	F	93.7	Very high	79.8	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	135.8	178.2	53.4	-91.4	0	0	0	108.9	L344 I349 V372 S373 G374 L376 L398 V411 I569	L344-F346 HydrophobicContact CD2-CD1 3.93Å; F346-I349 HydrophobicContact CB-CG1 3.87Å; F346-V372 HydrophobicContact CD2-CG1 3.99Å; F346-V372 WeakPolarHBondContact CD2-O 3.48Å; F346-V372 HydrophobicContact CE2-CG1 3.53Å; F346-S373 VanDerWaalsContact O-CA 3.32Å; F346-S373 WeakPolarHBondContact O-CA 3.35Å; F346-G374 WeakPolarHBondContact CD1-O 3.43Å; F346-G374 VanDerWaalsContact CZ-CA 3.4Å; F346-G374 PolarHBondContact N-O 3.07Å; F346-G374 PolarHBondContact O-N 2.94Å; F346-L376 HydrophobicContact CE1-CD1 4.02Å; F346-L376 HydrophobicContact CE1-CD2 4.46Å; F346-L376 HydrophobicContact CE1-CG 3.98Å; F346-L398 HydrophobicContact CB-CD2 3.59Å; F346-L398 HydrophobicContact CD1-CD1 4.24Å; F346-L398 HydrophobicContact CD1-CD2 3.68Å; F346-L398 HydrophobicContact CE1-CD1 4.41Å; F346-L398 HydrophobicContact CG-CD2 3.77Å; F346-V411 HydrophobicContact CB-CG2 4.37Å; F346-I569 HydrophobicContact CE2-CD1 4.17Å; F346-I569 HydrophobicContact CZ-CD1 4.5Å
347	H	92	Very high	80.8	Confident	11 Å²	11	58.8 Å²	58.8	5%	0.051	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	116.2	-164.6	-55.8	-120.3	0	0	0	108.5	S345 I349 G409 K410 V654	S345-H347 WeakPolarHBondContact CB-NE2 3.18Å; S345-H347 PolarHBondContact OG-NE2 3.14Å; H347-I349 VanDerWaalsContact C-N 3.29Å; H347-I349 PolarHBondContact O-N 3.19Å; H347-G409 VanDerWaalsContact O-CA 3.28Å; H347-G409 WeakPolarHBondContact O-CA 3.47Å; H347-K410 HydrophobicContact CB-CB 4.45Å; H347-K410 PolarHBondContact CD2-O 3.34Å; H347-K410 PolarHBondContact N-O 3.08Å; H347-K410 PolarHBondContact O-N 3.15Å; H347-V654 HydrophobicContact CB-CG1 4.31Å; H347-V654 WeakPolarHBondContact CE1-CG1 3.47Å; H347-V654 PolarHBondContact CE1-O 2.82Å; H347-V654 WeakPolarHBondContact ND1-CG1 3.36Å
348	H	91.2	Very high	81.9	Confident	92 Å²	92	59.2 Å²	59.2	43%	0.426	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	48.9	48.1	174.2	-60.8	-69.1	0	0	0	113.5	S350 D371 V372 S373 G409	H348-S350 PolarHBondContact O-N 3.07Å; H348-D371 WeakPolarHBondContact CA-OD1 3.46Å; H348-D371 WeakPolarHBondContact CB-OD1 3.39Å; H348-D371 IonicContact CE1-OD1 3.79Å; H348-D371 IonicContact CE1-OD2 3.04Å; H348-D371 IonicContact CG-OD1 3.45Å; H348-D371 VanDerWaalsContact CG-OD1 3.23Å; H348-D371 IonicContact ND1-OD1 2.72Å; H348-D371 PolarHBondContact ND1-OD1 2.87Å; H348-D371 IonicContact ND1-OD2 3.86Å; H348-D371 PolarHBondContact ND1-OD2 3.01Å; H348-V372 PolarHBondContact N-O 3.07Å; H348-S373 PolarHBondContact N-OG 3.45Å; H348-G409 VanDerWaalsContact O-CA 3.26Å; H348-G409 WeakPolarHBondContact O-CA 3.35Å
349	I	92.4	Very high	82.5	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	117.4	-176.2	-63.9	-63.4	0	0	0	109.8	F346 H347 L369 D371 V372 V397 L407 S408 V411	F346-I349 HydrophobicContact CB-CG1 3.87Å; H347-I349 VanDerWaalsContact C-N 3.29Å; H347-I349 PolarHBondContact O-N 3.19Å; I349-L369 HydrophobicContact CG2-CD1 4.21Å; I349-D371 PolarHBondContact O-N 3.17Å; I349-V372 HydrophobicContact CB-CB 4.41Å; I349-V372 WeakPolarHBondContact CB-O 3.43Å; I349-V372 PolarHBondContact N-O 3.43Å; I349-V372 PolarHBondContact O-N 3.2Å; I349-V397 HydrophobicContact CG2-CG1 3.78Å; I349-L407 HydrophobicContact CG2-CD1 3.97Å; I349-S408 WeakPolarHBondContact CA-O 3.37Å; I349-V411 HydrophobicContact CD1-CG2 3.74Å; I349-V411 HydrophobicContact CG1-CG2 4.47Å
350	S	92.8	Very high	82.8	Confident	19 Å²	19	60.4 Å²	60.4	13%	0.133	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	141.7	167	-41.1	0	0	0	0	110.6	H348 L369 D371 S408	H348-S350 PolarHBondContact O-N 3.07Å; S350-L369 CarbonylContact C-O 3.56Å; S350-L369 VanDerWaalsContact CA-O 3.22Å; S350-L369 WeakPolarHBondContact CA-O 3.4Å; S350-L369 WeakPolarHBondContact CB-O 3.36Å; S350-D371 PolarHBondContact OG-N 3.22Å; S350-D371 VanDerWaalsContact OG-N 3.08Å; S350-S408 WeakPolarHBondContact CB-OG 3.5Å; S350-S408 PolarHBondContact N-O 3.28Å; S350-S408 VanDerWaalsContact N-O 3.16Å; S350-S408 PolarHBondContact N-OG 2.85Å; S350-S408 PolarHBondContact O-N 3.49Å; S350-S408 PolarHBondContact O-OG 3.3Å
351	Y	92.3	Very high	83.2	Confident	18 Å²	18	57.7 Å²	57.7	7%	0.071	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	124.7	-177.3	-179.1	-114.4	0	0	0	110.9	V353 I368 L369 V397 K402 F406 L407	Y351-V353 HydrophobicContact CD1-CG2 4.15Å; Y351-V353 HydrophobicContact CE1-CG2 3.35Å; Y351-I368 HydrophobicContact CD1-CB 4.12Å; Y351-I368 HydrophobicContact CD1-CD1 4.36Å; Y351-I368 HydrophobicContact CE1-CD1 4.23Å; Y351-I368 PolarHBondContact O-N 3.44Å; Y351-L369 PolarHBondContact N-O 3.18Å; Y351-L369 PolarHBondContact O-N 3.28Å; Y351-V397 HydrophobicContact CG-CG2 4.37Å; Y351-K402 HydrophobicContact CE1-CD 4.26Å; Y351-K402 HydrophobicContact CE1-CG 4.43Å; Y351-K402 HydrophobicContact CE2-CB 4.01Å; Y351-K402 HydrophobicContact CE2-CG 4.28Å; Y351-F406 WeakPolarHBondContact CA-O 3.39Å; Y351-F406 HydrophobicContact CD2-CB 4.45Å; Y351-F406 WeakPolarHBondContact CD2-O 3.5Å; Y351-F406 HydrophobicContact CE2-CB 4.15Å; Y351-L407 HydrophobicContact CD2-CB 4.42Å; Y351-L407 HydrophobicContact CD2-CD1 4.44Å
352	E	90.9	Very high	83.4	Confident	79 Å²	79	65.8 Å²	65.8	37%	0.369	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	145.4	-177.2	-67.9	179.3	-177.2	0	0	111.5	I365 F406	E352-I365 HydrophobicContact CB-CG2 3.81Å; E352-I365 HydrophobicContact CG-CG2 4.03Å; E352-I365 WeakPolarHBondContact OE2-CG2 3.48Å; E352-F406 HydrophobicContact CB-CB 4.43Å; E352-F406 PolarHBondContact N-O 3.44Å; E352-F406 WeakPolarHBondContact O-CB 3.28Å
353	V	86.7	Confident	83.1	Confident	38 Å²	38	69.2 Å²	69.2	23%	0.23	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	130.4	174.3	176.1	0	0	0	0	110	Y351 I355 K366 I368	Y351-V353 HydrophobicContact CD1-CG2 4.15Å; Y351-V353 HydrophobicContact CE1-CG2 3.35Å; V353-I355 HydrophobicContact CG1-CG1 4.24Å; V353-I355 PolarHBondContact O-N 3.42Å; V353-K366 PolarHBondContact N-O 3.33Å; V353-K366 PolarHBondContact O-N 3.25Å; V353-I368 HydrophobicContact CB-CD1 3.83Å; V353-I368 HydrophobicContact CB-CG1 4.38Å; V353-I368 HydrophobicContact CG2-CD1 3.28Å; V353-I368 HydrophobicContact CG2-CG1 4.08Å
354	K	84.6	Confident	82.8	Confident	119 Å²	119	71.1 Å²	71.1	52%	0.517	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	111.9	170.9	-70.9	179.6	175.6	179.1	0	109.4	I365 F406	K354-I365 HydrophobicContact CG-CG1 4.11Å; K354-F406 HydrophobicContact CD-CE1 3.84Å; K354-F406 HydrophobicContact CD-CZ 4.1Å; K354-F406 HydrophobicContact CG-CE1 4.19Å
355	I	81.3	Confident	82.4	Confident	70 Å²	70	75.4 Å²	75.4	36%	0.359	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	123.8	175.2	-56.4	177.6	0	0	0	107.9	V353 V364 K366	V353-I355 HydrophobicContact CG1-CG1 4.24Å; V353-I355 PolarHBondContact O-N 3.42Å; I355-V364 PolarHBondContact N-O 3.04Å; I355-V364 PolarHBondContact O-N 3.27Å; I355-K366 HydrophobicContact CD1-CB 3.67Å; I355-K366 HydrophobicContact CD1-CD 3.55Å; I355-K366 HydrophobicContact CD1-CG 4.22Å; I355-K366 HydrophobicContact CG1-CB 4.29Å
356	Q	73.2	Confident	82.1	Confident	105 Å²	105	81.2 Å²	81.2	49%	0.491	42%	0.417	S	S	.	.			trans	-114.5	111.3	172.7	-154.5	-173.4	1.8	0	0	107.6	T358 L359 S361	Q356-T358 WeakPolarHBondContact CG-O 3.4Å; Q356-T358 PolarHBondContact NE2-O 3.12Å; Q356-L359 PolarHBondContact NE2-O 2.87Å; Q356-L359 VanDerWaalsContact NE2-O 3.1Å; Q356-S361 WeakPolarHBondContact CG-O 3.44Å; Q356-S361 PolarHBondContact NE2-O 3.02Å
357	K	65.2	Low	81.9	Confident	191 Å²	191	84.3 Å²	84.3	83%	0.83	44%	0.436	S	S	*	.	S	Bend	trans	-72	-36.3	-176.1	-72.8	-174.3	177.6	-178.4	0	112.6
358	T	69	Low	81.8	Confident	76 Å²	76	86 Å²	86	47%	0.466	45%	0.445	S	S	.	.	S	Bend	trans	-137.5	159	176.2	73.8	0	0	0	0	109.8	Q356 C360 S361	Q356-T358 WeakPolarHBondContact CG-O 3.4Å; Q356-T358 PolarHBondContact NE2-O 3.12Å; T358-C360 PolarHBondContact O-N 3.26Å; T358-C360 VanDerWaalsContact O-N 3.11Å; T358-S361 PolarHBondContact O-N 3.13Å; T358-S361 VanDerWaalsContact O-N 3.09Å; T358-S361 WeakPolarHBondContact OG1-CB 3.3Å; T358-S361 PolarHBondContact OG1-N 3.17Å; T358-S361 VanDerWaalsContact OG1-N 3.11Å; T358-S361 PolarHBondContact OG1-OG 3.15Å
359	L	66.4	Low	81.8	Confident	144 Å²	144	81.6 Å²	81.6	75%	0.754	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-31.1	-178.7	-158.8	76.9	0	0	0	112.7	Q356	Q356-L359 PolarHBondContact NE2-O 2.87Å; Q356-L359 VanDerWaalsContact NE2-O 3.1Å
360	C	70.7	Confident	81.8	Confident	124 Å²	124	84.9 Å²	84.9	84%	0.838	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-12.7	-178.8	-61.3	0	0	0	0	114.1	T358	T358-C360 PolarHBondContact O-N 3.26Å; T358-C360 VanDerWaalsContact O-N 3.11Å
361	S	72.9	Confident	81.7	Confident	49 Å²	49	88 Å²	88	34%	0.343	46%	0.457	S	S	.	.	S	Bend	trans	-74.1	141	176.9	-64.1	0	0	0	0	110.8	Q356 T358	Q356-S361 WeakPolarHBondContact CG-O 3.44Å; Q356-S361 PolarHBondContact NE2-O 3.02Å; T358-S361 PolarHBondContact O-N 3.13Å; T358-S361 VanDerWaalsContact O-N 3.09Å; T358-S361 WeakPolarHBondContact OG1-CB 3.3Å; T358-S361 PolarHBondContact OG1-N 3.17Å; T358-S361 VanDerWaalsContact OG1-N 3.11Å; T358-S361 PolarHBondContact OG1-OG 3.15Å
362	K	75.7	Confident	81.8	Confident	184 Å²	184	87.3 Å²	87.3	80%	0.8	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-58.4	139.6	169.9	-69	-179.3	-179.4	176.2	0	109.7	V364	K362-V364 PolarHBondContact O-N 2.91Å
363	P	78.3	Confident	81.9	Confident	74 Å²	74	84.5 Å²	84.5	48%	0.481	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-64.7	123.4	177.4	26.5	-33.1	0	0	0	109.8
364	V	83.7	Confident	82.2	Confident	98 Å²	98	82.7 Å²	82.7	59%	0.594	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.9	127.2	174.7	-179.2	0	0	0	0	108.1	I355 K362	I355-V364 PolarHBondContact N-O 3.04Å; I355-V364 PolarHBondContact O-N 3.27Å; K362-V364 PolarHBondContact O-N 2.91Å
365	I	85.2	Confident	82.7	Confident	91 Å²	91	77 Å²	77	47%	0.467	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	123.7	175	-59.9	175.1	0	0	0	107.8	E352 K354	E352-I365 HydrophobicContact CB-CG2 3.81Å; E352-I365 HydrophobicContact CG-CG2 4.03Å; E352-I365 WeakPolarHBondContact OE2-CG2 3.48Å; K354-I365 HydrophobicContact CG-CG1 4.11Å
366	K	86.5	Confident	83.3	Confident	123 Å²	123	73.7 Å²	73.7	54%	0.535	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	120.1	173.9	-175.5	177.9	-177.9	178.1	0	109.3	V353 I355 I368	V353-K366 PolarHBondContact N-O 3.33Å; V353-K366 PolarHBondContact O-N 3.25Å; I355-K366 HydrophobicContact CD1-CB 3.67Å; I355-K366 HydrophobicContact CD1-CD 3.55Å; I355-K366 HydrophobicContact CD1-CG 4.22Å; I355-K366 HydrophobicContact CG1-CB 4.29Å; K366-I368 PolarHBondContact O-N 2.99Å
367	T	89	Confident	84.2	Confident	64 Å²	64	73.4 Å²	73.4	39%	0.393	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	123.8	170	-48.4	0	0	0	0	109.1	L369 D370	T367-L369 WeakPolarHBondContact CG2-O 3.42Å; T367-D370 HydrophobicContact CG2-CB 4.06Å
368	I	90.2	Very high	85.5	Confident	46 Å²	46	67.5 Å²	67.5	24%	0.236	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-36.1	179.5	-61.3	-171.1	0	0	0	111	Y351 V353 K366 G567	Y351-I368 HydrophobicContact CD1-CB 4.12Å; Y351-I368 HydrophobicContact CD1-CD1 4.36Å; Y351-I368 HydrophobicContact CE1-CD1 4.23Å; Y351-I368 PolarHBondContact O-N 3.44Å; V353-I368 HydrophobicContact CB-CD1 3.83Å; V353-I368 HydrophobicContact CB-CG1 4.38Å; V353-I368 HydrophobicContact CG2-CD1 3.28Å; V353-I368 HydrophobicContact CG2-CG1 4.08Å; K366-I368 PolarHBondContact O-N 2.99Å; I368-G567 WeakPolarHBondContact O-CA 3.47Å
369	L	91.8	Very high	86.7	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	135.7	172.7	-59.7	173.7	0	0	0	107.4	I349 S350 Y351 T367 V372 L394 V397	I349-L369 HydrophobicContact CG2-CD1 4.21Å; S350-L369 CarbonylContact C-O 3.56Å; S350-L369 VanDerWaalsContact CA-O 3.22Å; S350-L369 WeakPolarHBondContact CA-O 3.4Å; S350-L369 WeakPolarHBondContact CB-O 3.36Å; Y351-L369 PolarHBondContact N-O 3.18Å; Y351-L369 PolarHBondContact O-N 3.28Å; T367-L369 WeakPolarHBondContact CG2-O 3.42Å; L369-V372 HydrophobicContact CB-CG2 4.43Å; L369-L394 HydrophobicContact CD1-CB 4.17Å; L369-L394 HydrophobicContact CD1-CD1 4.13Å; L369-L394 HydrophobicContact CD2-CB 4.08Å; L369-V397 HydrophobicContact CD1-CG2 4.07Å
370	D	92.2	Very high	88.1	Confident	71 Å²	71	57.3 Å²	57.3	38%	0.38	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	111.9	-175.2	-175.4	36.3	0	0	0	109.5	T367 V372 G567 Q568	T367-D370 HydrophobicContact CG2-CB 4.06Å; D370-V372 PolarHBondContact O-N 3.19Å; D370-G567 PolarHBondContact N-O 2.9Å; D370-Q568 HydrophobicContact CB-CG 3.87Å; D370-Q568 PolarHBondContact OD2-NE2 2.78Å
371	D	90.8	Very high	89.3	Confident	85 Å²	85	51.4 Å²	51.4	46%	0.455	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	42.5	52.3	178.4	-159.3	35.9	0	0	0	116.8	H348 I349 S350	H348-D371 WeakPolarHBondContact CA-OD1 3.46Å; H348-D371 WeakPolarHBondContact CB-OD1 3.39Å; H348-D371 IonicContact CE1-OD1 3.79Å; H348-D371 IonicContact CE1-OD2 3.04Å; H348-D371 IonicContact CG-OD1 3.45Å; H348-D371 VanDerWaalsContact CG-OD1 3.23Å; H348-D371 IonicContact ND1-OD1 2.72Å; H348-D371 PolarHBondContact ND1-OD1 2.87Å; H348-D371 IonicContact ND1-OD2 3.86Å; H348-D371 PolarHBondContact ND1-OD2 3.01Å; I349-D371 PolarHBondContact O-N 3.17Å; S350-D371 PolarHBondContact OG-N 3.22Å; S350-D371 VanDerWaalsContact OG-N 3.08Å
372	V	92.7	Very high	90.4	Very high	2 Å²	2	49 Å²	49	1%	0.012	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	124.1	-175.5	177.6	0	0	0	0	111.2	F346 H348 I349 L369 D370 L394 G567 I569	F346-V372 HydrophobicContact CD2-CG1 3.99Å; F346-V372 WeakPolarHBondContact CD2-O 3.48Å; F346-V372 HydrophobicContact CE2-CG1 3.53Å; H348-V372 PolarHBondContact N-O 3.07Å; I349-V372 HydrophobicContact CB-CB 4.41Å; I349-V372 WeakPolarHBondContact CB-O 3.43Å; I349-V372 PolarHBondContact N-O 3.43Å; I349-V372 PolarHBondContact O-N 3.2Å; L369-V372 HydrophobicContact CB-CG2 4.43Å; D370-V372 PolarHBondContact O-N 3.19Å; V372-L394 HydrophobicContact CG1-CD1 3.97Å; V372-L394 HydrophobicContact CG1-CD2 4.21Å; V372-G567 WeakPolarHBondContact CG2-O 3.18Å; V372-I569 HydrophobicContact CG1-CD1 3.62Å; V372-I569 HydrophobicContact CG1-CG1 3.88Å
373	S	93.5	Very high	91.4	Very high	20 Å²	20	40.3 Å²	40.3	14%	0.14	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	142.6	179.1	-65.2	0	0	0	0	112.9	F346 H348 I569	F346-S373 VanDerWaalsContact O-CA 3.32Å; F346-S373 WeakPolarHBondContact O-CA 3.35Å; H348-S373 PolarHBondContact N-OG 3.45Å; S373-I569 VanDerWaalsContact O-CD1 3.26Å; S373-I569 WeakPolarHBondContact O-CD1 3.48Å
374	G	93.6	Very high	92.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.1	176.2	-177.8	0	0	0	0	0	115.6	S345 F346	S345-G374 WeakPolarHBondContact CA-O 3.39Å; F346-G374 WeakPolarHBondContact CD1-O 3.43Å; F346-G374 VanDerWaalsContact CZ-CA 3.4Å; F346-G374 PolarHBondContact N-O 3.07Å; F346-G374 PolarHBondContact O-N 2.94Å
375	I	94.1	Very high	92.6	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	127.6	-172.7	-58.2	178.6	0	0	0	110.8	K343 R377 H572 E653 V654 I657	K343-I375 HydrophobicContact CD-CG2 4.3Å; K343-I375 HydrophobicContact CG-CG2 4.05Å; I375-R377 HydrophobicContact CG2-CG 4.17Å; I375-H572 PolarHBondContact N-NE2 2.77Å; I375-H572 PolarHBondContact O-CE1 2.67Å; I375-H572 VanDerWaalsContact O-CE1 3.32Å; I375-H572 PolarHBondContact O-NE2 3.42Å; I375-E653 HydrophobicContact CD1-CB 3.64Å; I375-E653 HydrophobicContact CD1-CG 3.42Å; I375-E653 VanDerWaalsContact CD1-CG 3.42Å; I375-V654 HydrophobicContact CD1-CG2 3.7Å; I375-V654 HydrophobicContact CG1-CG2 3.38Å; I375-I657 HydrophobicContact CD1-CD1 4Å
376	L	94.5	Very high	92.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	116.9	177	-53.4	172.6	0	0	0	108.9	L344 F346 N381 L398 I544	L344-L376 HydrophobicContact CB-CB 4.35Å; L344-L376 HydrophobicContact CD2-CD1 4.18Å; L344-L376 PolarHBondContact N-O 2.81Å; L344-L376 PolarHBondContact O-N 3.12Å; F346-L376 HydrophobicContact CE1-CD1 4.02Å; F346-L376 HydrophobicContact CE1-CD2 4.46Å; F346-L376 HydrophobicContact CE1-CG 3.98Å; L376-N381 HydrophobicContact CD2-CB 3.89Å; L376-L398 HydrophobicContact CD1-CD1 3.83Å; L376-I544 HydrophobicContact CB-CD1 4.22Å; L376-I544 HydrophobicContact CB-CG1 4.39Å; L376-I544 HydrophobicContact CD1-CD1 3.42Å; L376-I544 VanDerWaalsContact CD1-CD1 3.42Å; L376-I544 HydrophobicContact CD1-CG1 3.78Å; L376-I544 HydrophobicContact CD1-CG2 3.92Å; L376-I544 HydrophobicContact CG-CD1 4.44Å
377	R	92.5	Very high	93	Very high	99 Å²	99	27.9 Å²	27.9	37%	0.374	16%	0.155	S	C	.	.			trans	-97	161.3	-176.9	-64	-178	-173.8	81.5	-1.3	110.7	I375 G379 N381 E653	I375-R377 HydrophobicContact CG2-CG 4.17Å; R377-G379 PolarHBondContact O-N 3.46Å; R377-N381 PolarHBondContact O-ND2 3.06Å; R377-E653 IonicContact CZ-OE1 2.84Å; R377-E653 IonicContact CZ-OE2 2.93Å; R377-E653 IonicContact NE-OE1 3.78Å; R377-E653 IonicContact NH2-OE1 2.6Å; R377-E653 PolarHBondContact NH2-OE1 3Å; R377-E653 IonicContact NH2-OE2 3.55Å; R377-E653 PolarHBondContact NH2-OE2 3.49Å
378	P	93.2	Very high	92.8	Very high	66 Å²	66	28.8 Å²	28.8	43%	0.429	18%	0.177	S	C	.	.	S	Bend	trans	-50.9	126	169.5	-27.3	36.2	0	0	0	111.3	T542	P378-T542 VanDerWaalsContact CA-OG1 3.31Å; P378-T542 WeakPolarHBondContact CA-OG1 3.47Å
379	G	93.6	Very high	92.8	Very high	6 Å²	6	26.8 Å²	26.8	6%	0.062	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	138.2	-170.6	-166.4	0	0	0	0	0	113	R377 N381 R541 I543	R377-G379 PolarHBondContact O-N 3.46Å; G379-N381 PolarHBondContact O-ND2 2.96Å; G379-R541 PolarHBondContact N-O 3.48Å; G379-R541 VanDerWaalsContact N-O 3.14Å; G379-I543 PolarHBondContact O-N 3.21Å
380	M	95.2	Very high	92.8	Very high	0 Å²	0	27 Å²	27	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	110.6	176.2	-70.2	-165.4	71.6	0	0	111.5	V530 L533 K534 A537 F545 L557 F558 D559 T560	M380-V530 HydrophobicContact CE-CG1 3.77Å; M380-L533 HydrophobicContact CE-CB 4.04Å; M380-K534 HydrophobicContact CG-CD 3.9Å; M380-K534 WeakPolarHBondContact SD-CA 3.25Å; M380-K534 HydrophobicContact SD-CB 3.53Å; M380-K534 VanDerWaalsContact SD-CB 3.53Å; M380-K534 HydrophobicContact SD-CD 3.29Å; M380-K534 WeakPolarHBondContact SD-CD 3.49Å; M380-K534 HydrophobicContact SD-CG 4.02Å; M380-A537 HydrophobicContact CG-CB 3.69Å; M380-F545 HydrophobicContact CB-CE1 4.22Å; M380-F545 HydrophobicContact CE-CE1 3.53Å; M380-F545 HydrophobicContact CE-CZ 3.7Å; M380-L557 HydrophobicContact SD-CB 4.35Å; M380-F558 HydrophobicContact CE-CD1 4.43Å; M380-D559 PolarHBondContact N-OD2 3.08Å; M380-D559 WeakPolarHBondContact O-CB 3.39Å; M380-D559 PolarHBondContact O-N 3.11Å; M380-T560 PolarHBondContact O-N 2.98Å
381	N	96.6	Very high	92.8	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	114.9	179	-50.2	-87	0	0	0	110	L376 R377 G379 I543 I544 F545 T560	L376-N381 HydrophobicContact CD2-CB 3.89Å; R377-N381 PolarHBondContact O-ND2 3.06Å; G379-N381 PolarHBondContact O-ND2 2.96Å; N381-I543 WeakPolarHBondContact CB-O 3.34Å; N381-I543 PolarHBondContact N-O 3.41Å; N381-I543 PolarHBondContact ND2-O 2.84Å; N381-I544 HydrophobicContact CB-CG1 4.34Å; N381-I544 WeakPolarHBondContact O-CA 3.41Å; N381-F545 WeakPolarHBondContact O-CD1 3.45Å; N381-F545 PolarHBondContact O-N 3.26Å; N381-T560 VanDerWaalsContact OD1-CB 3.27Å; N381-T560 WeakPolarHBondContact OD1-CB 3.32Å; N381-T560 PolarHBondContact OD1-OG1 3.45Å
382	A	96.5	Very high	92.8	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	132.9	-178.7	0	0	0	0	0	111.4	F545 I547 F558 T560 L561 T562	A382-F545 CarbonylContact C-O 3.57Å; A382-F545 WeakPolarHBondContact CA-O 3.39Å; A382-F545 HydrophobicContact CB-CE1 4.42Å; A382-F545 HydrophobicContact CB-CE2 3.77Å; A382-F545 HydrophobicContact CB-CZ 3.69Å; A382-I547 HydrophobicContact CB-CG2 4.45Å; A382-F558 HydrophobicContact CB-CD1 4.26Å; A382-F558 HydrophobicContact CB-CD2 3.62Å; A382-F558 HydrophobicContact CB-CE1 4.39Å; A382-F558 HydrophobicContact CB-CE2 3.76Å; A382-F558 HydrophobicContact CB-CG 3.88Å; A382-F558 HydrophobicContact CB-CZ 4.15Å; A382-T560 PolarHBondContact N-O 3.24Å; A382-L561 HydrophobicContact CB-CD1 4.2Å; A382-T562 PolarHBondContact O-N 3.03Å
383	L	95.9	Very high	92.8	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	123.2	169.7	-52.9	179.8	0	0	0	109	L394 L395 I544 F545 S546 I547 T562	L383-L394 HydrophobicContact CD1-CD2 4.38Å; L383-L394 HydrophobicContact CD2-CD2 4.48Å; L383-L395 HydrophobicContact CD1-CB 4.36Å; L383-L395 HydrophobicContact CD1-CD1 4.06Å; L383-I544 HydrophobicContact CD1-CG2 4.26Å; L383-I544 HydrophobicContact CG-CG2 4.37Å; L383-F545 PolarHBondContact N-O 2.84Å; L383-S546 CarbonylContact O-C 3.57Å; L383-S546 WeakPolarHBondContact O-CA 3.31Å; L383-I547 PolarHBondContact O-N 2.97Å; L383-T562 WeakPolarHBondContact CA-O 3.46Å; L383-T562 HydrophobicContact CD2-CG2 4.18Å
384	M	94.8	Very high	92.8	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	157.8	-175.4	180	167.4	174.2	0	0	111.3	P550 L561 T562 L563 I564 P597 M601	M384-P550 HydrophobicContact SD-CG 4.2Å; M384-L561 HydrophobicContact CB-CD1 4.13Å; M384-T562 PolarHBondContact N-O 3.28Å; M384-L563 HydrophobicContact CB-CD2 3.84Å; M384-L563 HydrophobicContact CG-CD2 3.98Å; M384-L563 WeakPolarHBondContact O-CA 3.31Å; M384-I564 PolarHBondContact O-N 3.22Å; M384-P597 HydrophobicContact CE-CB 3.61Å; M384-P597 WeakPolarHBondContact CE-O 3.43Å; M384-P597 HydrophobicContact SD-CB 3.95Å; M384-M601 HydrophobicContact CE-CG 3.37Å; M384-M601 HydrophobicContact CE-SD 3.68Å; M384-M601 HydrophobicContact CG-SD 4.31Å
385	G	92.2	Very high	92.9	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	14%	0.143	C	C	.	.			trans	150	172.4	-177.2	0	0	0	0	0	112.7	K391	G385-K391 WeakPolarHBondContact O-CE 3.45Å; G385-K391 PolarHBondContact O-NZ 3.41Å
386	P	90.3	Very high	92.7	Very high	8 Å²	8	21.7 Å²	21.7	5%	0.052	14%	0.144	C	C	.	.	S	Bend	trans	-59.8	161.2	-177.3	-25.7	35.3	0	0	0	114.5	G388 S389 K391 Y565 M601 I604	P386-G388 PolarHBondContact O-N 3.39Å; P386-S389 VanDerWaalsContact O-CB 3.24Å; P386-S389 WeakPolarHBondContact O-CB 3.3Å; P386-S389 PolarHBondContact O-N 2.97Å; P386-S389 VanDerWaalsContact O-N 3.15Å; P386-S389 PolarHBondContact O-OG 3.11Å; P386-K391 PolarHBondContact O-NZ 3.34Å; P386-Y565 HydrophobicContact CG-CD2 4.11Å; P386-M601 HydrophobicContact CB-CE 4.3Å; P386-M601 HydrophobicContact CG-CE 4.04Å; P386-I604 HydrophobicContact CG-CB 4.46Å; P386-I604 HydrophobicContact CG-CG2 3.51Å
387	T	89.6	Confident	92.6	Very high	116 Å²	116	21.9 Å²	21.9	71%	0.712	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	137.7	172	52.6	0	0	0	0	109.9	S389	T387-S389 VanDerWaalsContact C-N 3.25Å; T387-S389 PolarHBondContact O-N 2.87Å
388	G	86	Confident	92.6	Very high	83 Å²	83	17.1 Å²	17.1	86%	0.856	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.2	3.2	-175.7	0	0	0	0	0	116.1	P386 G390	P386-G388 PolarHBondContact O-N 3.39Å; G388-G390 PolarHBondContact O-N 2.97Å
389	S	89.7	Confident	92.4	Very high	4 Å²	4	14 Å²	14	3%	0.028	11%	0.106	C	C	.	.	S	Bend	trans	-71.3	-7.9	-179.8	74	0	0	0	0	115.6	P386 T387 K391 I564 G567	P386-S389 VanDerWaalsContact O-CB 3.24Å; P386-S389 WeakPolarHBondContact O-CB 3.3Å; P386-S389 PolarHBondContact O-N 2.97Å; P386-S389 VanDerWaalsContact O-N 3.15Å; P386-S389 PolarHBondContact O-OG 3.11Å; T387-S389 VanDerWaalsContact C-N 3.25Å; T387-S389 PolarHBondContact O-N 2.87Å; S389-K391 WeakPolarHBondContact OG-CG 3.24Å; S389-I564 WeakPolarHBondContact CB-O 3.31Å; S389-I564 VanDerWaalsContact O-CG2 3.31Å; S389-I564 WeakPolarHBondContact O-CG2 3.46Å; S389-I564 PolarHBondContact OG-O 3.23Å; S389-G567 PolarHBondContact O-N 3.42Å
390	G	90.3	Very high	92.1	Very high	6 Å²	6	14.4 Å²	14.4	6%	0.062	11%	0.11	C	C	.	.	S	Bend	trans	103.8	1.8	179.7	0	0	0	0	0	115.6	G388 S392 S393 L394	G388-G390 PolarHBondContact O-N 2.97Å; G390-S392 PolarHBondContact O-N 2.96Å; G390-S393 CarbonylContact O-C 3.58Å; G390-S393 WeakPolarHBondContact O-CA 3.49Å; G390-S393 WeakPolarHBondContact O-CB 3.42Å; G390-S393 PolarHBondContact O-N 3.15Å; G390-L394 PolarHBondContact O-N 3.02Å
391	K	92.7	Very high	91.6	Very high	9 Å²	9	15.4 Å²	15.4	4%	0.039	11%	0.114	C	C	.	.	H	α-helix	trans	-49	-58.5	-178.6	-53.6	-177.5	-64.5	-76.5	0	114.4	G385 P386 S389 S393 L394 L395	G385-K391 WeakPolarHBondContact O-CE 3.45Å; G385-K391 PolarHBondContact O-NZ 3.41Å; P386-K391 PolarHBondContact O-NZ 3.34Å; S389-K391 WeakPolarHBondContact OG-CG 3.24Å; K391-S393 VanDerWaalsContact C-N 3.26Å; K391-S393 PolarHBondContact O-N 2.84Å; K391-L394 PolarHBondContact O-N 3.35Å; K391-L395 PolarHBondContact O-N 3.31Å
392	S	92.1	Very high	91.1	Very high	32 Å²	32	16.2 Å²	16.2	22%	0.224	12%	0.118	C	C	.	.	H	α-helix	trans	-67	-29.7	-179.9	-52.2	0	0	0	0	111.8	G390 L395 D396 D515	G390-S392 PolarHBondContact O-N 2.96Å; S392-L395 PolarHBondContact O-N 2.9Å; S392-D396 WeakPolarHBondContact O-CB 3.37Å; S392-D396 PolarHBondContact O-N 3.19Å; S392-D515 WeakPolarHBondContact CB-OD1 3.46Å; S392-D515 PolarHBondContact OG-OD1 2.99Å
393	S	92.2	Very high	90.4	Very high	23 Å²	23	17.8 Å²	17.8	16%	0.161	13%	0.126	C	C	.	.	H	α-helix	trans	-68.7	-43.4	175	-59.7	0	0	0	0	111.4	G390 K391 D396 V397	G390-S393 CarbonylContact O-C 3.58Å; G390-S393 WeakPolarHBondContact O-CA 3.49Å; G390-S393 WeakPolarHBondContact O-CB 3.42Å; G390-S393 PolarHBondContact O-N 3.15Å; K391-S393 VanDerWaalsContact C-N 3.26Å; K391-S393 PolarHBondContact O-N 2.84Å; S393-D396 PolarHBondContact O-N 2.69Å; S393-V397 VanDerWaalsContact O-CG2 3.29Å; S393-V397 WeakPolarHBondContact O-CG2 2.97Å; S393-V397 PolarHBondContact O-N 2.97Å
394	L	94.2	Very high	89.7	Confident	1 Å²	1	21.5 Å²	21.5	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-60.6	-47.6	172.9	-178.4	64.2	0	0	0	110.1	L369 V372 L383 G390 K391 D396 V397 L398 I564	L369-L394 HydrophobicContact CD1-CB 4.17Å; L369-L394 HydrophobicContact CD1-CD1 4.13Å; L369-L394 HydrophobicContact CD2-CB 4.08Å; V372-L394 HydrophobicContact CG1-CD1 3.97Å; V372-L394 HydrophobicContact CG1-CD2 4.21Å; L383-L394 HydrophobicContact CD1-CD2 4.38Å; L383-L394 HydrophobicContact CD2-CD2 4.48Å; G390-L394 PolarHBondContact O-N 3.02Å; K391-L394 PolarHBondContact O-N 3.35Å; L394-D396 VanDerWaalsContact C-N 3.34Å; L394-D396 PolarHBondContact O-N 3.19Å; L394-V397 PolarHBondContact O-N 3.25Å; L394-V397 VanDerWaalsContact O-N 3.13Å; L394-L398 HydrophobicContact CD1-CD1 4.5Å; L394-L398 HydrophobicContact CD1-CD2 4.41Å; L394-L398 HydrophobicContact CD1-CG 4.27Å; L394-L398 HydrophobicContact CG-CD1 4.19Å; L394-L398 HydrophobicContact CG-CG 4.33Å; L394-L398 VanDerWaalsContact O-CG 3.29Å; L394-L398 WeakPolarHBondContact O-CG 3.35Å; L394-L398 PolarHBondContact O-N 3.42Å; L394-I564 HydrophobicContact CB-CD1 4.41Å; L394-I564 HydrophobicContact CD2-CD1 3.38Å
395	L	93.9	Very high	89.1	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-57.4	-45.3	177.7	-165.8	75.3	0	0	0	112.3	L383 K391 S392 V397 L398 A399 Y428 F513 L514 D515 I544	L383-L395 HydrophobicContact CD1-CB 4.36Å; L383-L395 HydrophobicContact CD1-CD1 4.06Å; K391-L395 PolarHBondContact O-N 3.31Å; S392-L395 PolarHBondContact O-N 2.9Å; L395-V397 VanDerWaalsContact C-N 3.34Å; L395-V397 PolarHBondContact O-N 2.71Å; L395-L398 PolarHBondContact O-N 3.3Å; L395-A399 WeakPolarHBondContact O-CB 3.44Å; L395-A399 PolarHBondContact O-N 2.89Å; L395-Y428 HydrophobicContact CD2-CE2 4.22Å; L395-Y428 HydrophobicContact CG-CE2 4.26Å; L395-F513 HydrophobicContact CD1-CB 4.23Å; L395-F513 HydrophobicContact CD1-CD1 3.77Å; L395-F513 HydrophobicContact CD1-CG 4.49Å; L395-F513 HydrophobicContact CG-CB 4.39Å; L395-F513 HydrophobicContact CG-CD1 4.39Å; L395-L514 WeakPolarHBondContact CD2-O 3.47Å; L395-D515 HydrophobicContact CD2-CB 3.86Å; L395-I544 HydrophobicContact CD1-CB 4.33Å; L395-I544 HydrophobicContact CD1-CG2 3.68Å
396	D	91.6	Very high	88.7	Confident	2 Å²	2	32.7 Å²	32.7	1%	0.011	20%	0.199	C	C	.	.	H	α-helix	trans	-62.6	-38.4	176.6	-73.1	-16.9	0	0	0	112.2	S392 S393 L394 G400 R401 K402 Y428 K966	S392-D396 WeakPolarHBondContact O-CB 3.37Å; S392-D396 PolarHBondContact O-N 3.19Å; S393-D396 PolarHBondContact O-N 2.69Å; L394-D396 VanDerWaalsContact C-N 3.34Å; L394-D396 PolarHBondContact O-N 3.19Å; D396-G400 PolarHBondContact O-N 2.81Å; D396-R401 PolarHBondContact O-N 2.95Å; D396-K402 HydrophobicContact CB-CD 4.02Å; D396-K402 HydrophobicContact CB-CG 3.82Å; D396-K402 VanDerWaalsContact OD2-CE 3.24Å; D396-K402 WeakPolarHBondContact OD2-CE 3.07Å; D396-K402 IonicContact OD2-NZ 3.23Å; D396-K402 PolarHBondContact OD2-NZ 3.16Å; D396-K402 VanDerWaalsContact OD2-NZ 3.15Å; D396-Y428 PolarHBondContact OD1-OH 3.08Å; D396-K966 IonicContact OD1-NZ 2.71Å; D396-K966 PolarHBondContact OD1-NZ 3.27Å; D396-K966 WeakPolarHBondContact OD2-CD 3.03Å; D396-K966 IonicContact OD2-NZ 3.95Å
397	V	91.8	Very high	88.7	Confident	3 Å²	3	34.9 Å²	34.9	2%	0.018	21%	0.21	C	C	.	.	H	α-helix	trans	-66.5	-47.8	176.6	167.7	0	0	0	0	110.7	I349 Y351 L369 S393 L394 L395 A399 G400 K402 L407	I349-V397 HydrophobicContact CG2-CG1 3.78Å; Y351-V397 HydrophobicContact CG-CG2 4.37Å; L369-V397 HydrophobicContact CD1-CG2 4.07Å; S393-V397 VanDerWaalsContact O-CG2 3.29Å; S393-V397 WeakPolarHBondContact O-CG2 2.97Å; S393-V397 PolarHBondContact O-N 2.97Å; L394-V397 PolarHBondContact O-N 3.25Å; L394-V397 VanDerWaalsContact O-N 3.13Å; L395-V397 VanDerWaalsContact C-N 3.34Å; L395-V397 PolarHBondContact O-N 2.71Å; V397-A399 PolarHBondContact O-N 2.83Å; V397-G400 PolarHBondContact O-N 3.13Å; V397-K402 HydrophobicContact CG2-CB 4.07Å; V397-K402 HydrophobicContact CG2-CG 3.71Å; V397-L407 HydrophobicContact CB-CD1 4.41Å; V397-L407 HydrophobicContact CG1-CD1 3.48Å; V397-L407 VanDerWaalsContact CG1-CD1 3.48Å; V397-L407 HydrophobicContact CG1-CD2 4.02Å; V397-L407 HydrophobicContact CG1-CG 4.42Å; V397-L407 HydrophobicContact CG2-CD1 3.96Å
398	L	92.3	Very high	88.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-61.5	-33.5	178.2	-62.4	-178.7	0	0	0	112	L344 F346 L376 L394 L395 G400 V411 Q418 F513	L344-L398 HydrophobicContact CD2-CD1 4.4Å; L344-L398 HydrophobicContact CD2-CD2 3.92Å; F346-L398 HydrophobicContact CB-CD2 3.59Å; F346-L398 HydrophobicContact CD1-CD1 4.24Å; F346-L398 HydrophobicContact CD1-CD2 3.68Å; F346-L398 HydrophobicContact CE1-CD1 4.41Å; F346-L398 HydrophobicContact CG-CD2 3.77Å; L376-L398 HydrophobicContact CD1-CD1 3.83Å; L394-L398 HydrophobicContact CD1-CD1 4.5Å; L394-L398 HydrophobicContact CD1-CD2 4.41Å; L394-L398 HydrophobicContact CD1-CG 4.27Å; L394-L398 HydrophobicContact CG-CD1 4.19Å; L394-L398 HydrophobicContact CG-CG 4.33Å; L394-L398 VanDerWaalsContact O-CG 3.29Å; L394-L398 WeakPolarHBondContact O-CG 3.35Å; L394-L398 PolarHBondContact O-N 3.42Å; L395-L398 PolarHBondContact O-N 3.3Å; L398-G400 VanDerWaalsContact C-N 3.28Å; L398-G400 PolarHBondContact O-N 3.43Å; L398-V411 HydrophobicContact CD2-CG1 4.35Å; L398-V411 HydrophobicContact CD2-CG2 4.15Å; L398-Q418 PolarHBondContact O-NE2 3.38Å; L398-F513 HydrophobicContact CB-CE1 3.74Å; L398-F513 HydrophobicContact CB-CZ 4.28Å
399	A	89.9	Confident	88.8	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-3.4	175.1	0	0	0	0	0	114.4	L395 V397 R401 Y428 F513	L395-A399 WeakPolarHBondContact O-CB 3.44Å; L395-A399 PolarHBondContact O-N 2.89Å; V397-A399 PolarHBondContact O-N 2.83Å; A399-R401 VanDerWaalsContact C-N 3.31Å; A399-R401 HydrophobicContact CB-CG 4.15Å; A399-R401 PolarHBondContact O-N 3.25Å; A399-Y428 HydrophobicContact CB-CD2 3.54Å; A399-Y428 HydrophobicContact CB-CE2 3.96Å; A399-F513 HydrophobicContact CB-CD1 4.44Å; A399-F513 HydrophobicContact CB-CD2 3.89Å; A399-F513 HydrophobicContact CB-CE2 4.04Å; A399-F513 HydrophobicContact CB-CG 4.1Å; A399-F513 HydrophobicContact CB-CZ 4.38Å
400	G	86.5	Confident	88.8	Confident	14 Å²	14	35 Å²	35	14%	0.144	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	24.1	-177.2	0	0	0	0	0	114.2	D396 V397 L398 K423	D396-G400 PolarHBondContact O-N 2.81Å; V397-G400 PolarHBondContact O-N 3.13Å; L398-G400 VanDerWaalsContact C-N 3.28Å; L398-G400 PolarHBondContact O-N 3.43Å; G400-K423 WeakPolarHBondContact O-CE 3.39Å; G400-K423 PolarHBondContact O-NZ 2.88Å
401	R	84.7	Confident	88.8	Confident	21 Å²	21	35.7 Å²	35.7	8%	0.079	20%	0.199	C	C	.	.			trans	-97	-3	-175.9	-68.3	-172	170.6	-149.2	-9.9	114.6	D396 A399 Y428 S773 Y965 K966	D396-R401 PolarHBondContact O-N 2.95Å; A399-R401 VanDerWaalsContact C-N 3.31Å; A399-R401 HydrophobicContact CB-CG 4.15Å; A399-R401 PolarHBondContact O-N 3.25Å; R401-Y428 VanDerWaalsContact CZ-CB 3.47Å; R401-Y428 VanDerWaalsContact CZ-CD1 3.41Å; R401-Y428 VanDerWaalsContact CZ-CG 3.46Å; R401-S773 PolarHBondContact NH2-OG 3.3Å; R401-Y965 WeakPolarHBondContact O-CD1 3.43Å; R401-K966 PolarHBondContact O-N 2.04Å
402	K	85.9	Confident	88.7	Confident	17 Å²	17	35.4 Å²	35.4	7%	0.074	20%	0.198	C	C	.	.	S	Bend	trans	-90.6	157.8	169.7	-68.8	-54.7	-173.2	-171.6	0	112.6	Y351 D396 V397 P404 Y965 K966	Y351-K402 HydrophobicContact CE1-CD 4.26Å; Y351-K402 HydrophobicContact CE1-CG 4.43Å; Y351-K402 HydrophobicContact CE2-CB 4.01Å; Y351-K402 HydrophobicContact CE2-CG 4.28Å; D396-K402 HydrophobicContact CB-CD 4.02Å; D396-K402 HydrophobicContact CB-CG 3.82Å; D396-K402 VanDerWaalsContact OD2-CE 3.24Å; D396-K402 WeakPolarHBondContact OD2-CE 3.07Å; D396-K402 IonicContact OD2-NZ 3.23Å; D396-K402 PolarHBondContact OD2-NZ 3.16Å; D396-K402 VanDerWaalsContact OD2-NZ 3.15Å; V397-K402 HydrophobicContact CG2-CB 4.07Å; V397-K402 HydrophobicContact CG2-CG 3.71Å; K402-P404 WeakPolarHBondContact O-CD 3.32Å; K402-Y965 VanDerWaalsContact C-CD1 3.46Å; K402-Y965 VanDerWaalsContact O-CD1 3.3Å; K402-Y965 WeakPolarHBondContact O-CD1 3.04Å; K402-Y965 VanDerWaalsContact O-CE1 3.3Å; K402-Y965 WeakPolarHBondContact O-CE1 3.49Å; K402-K966 WeakPolarHBondContact CD-O 3.06Å; K402-K966 PolarHBondContact NZ-O 3.14Å
403	D	80.9	Confident	88.5	Confident	33 Å²	33	34.9 Å²	34.9	18%	0.176	19%	0.193	C	C	.	.			trans	-67.3	120.6	175.2	-171.9	-16.9	0	0	0	109	K405 Y965	D403-K405 PolarHBondContact O-N 3.35Å; D403-K405 VanDerWaalsContact O-N 3.14Å; D403-K405 WeakPolarHBondContact OD1-CB 3.36Å; D403-K405 VanDerWaalsContact OD1-CG 3.32Å; D403-K405 WeakPolarHBondContact OD1-CG 3.49Å; D403-K405 PolarHBondContact OD1-N 2.81Å; D403-Y965 HydrophobicContact CB-CD2 4.49Å; D403-Y965 HydrophobicContact CB-CG 4.41Å
404	P	81.8	Confident	88.2	Confident	78 Å²	78	38.4 Å²	38.4	51%	0.506	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-64.1	-15.5	-179.6	26.5	-36	0	0	0	113.5	K402 F406 L407	K402-P404 WeakPolarHBondContact O-CD 3.32Å; P404-F406 PolarHBondContact O-N 3.43Å; P404-L407 PolarHBondContact O-N 2.95Å
405	K	83.4	Confident	87.7	Confident	171 Å²	171	39.3 Å²	39.3	74%	0.743	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-61.8	-26.9	-178.9	-72.1	177.7	-178.4	179.6	0	114.5	D403	D403-K405 PolarHBondContact O-N 3.35Å; D403-K405 VanDerWaalsContact O-N 3.14Å; D403-K405 WeakPolarHBondContact OD1-CB 3.36Å; D403-K405 VanDerWaalsContact OD1-CG 3.32Å; D403-K405 WeakPolarHBondContact OD1-CG 3.49Å; D403-K405 PolarHBondContact OD1-N 2.81Å
406	F	83.8	Confident	87.3	Confident	65 Å²	65	46.3 Å²	46.3	29%	0.285	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-116.4	17.5	-177.9	-51.5	-73.7	0	0	0	112.5	Y351 E352 K354 P404	Y351-F406 WeakPolarHBondContact CA-O 3.39Å; Y351-F406 HydrophobicContact CD2-CB 4.45Å; Y351-F406 WeakPolarHBondContact CD2-O 3.5Å; Y351-F406 HydrophobicContact CE2-CB 4.15Å; E352-F406 HydrophobicContact CB-CB 4.43Å; E352-F406 PolarHBondContact N-O 3.44Å; E352-F406 WeakPolarHBondContact O-CB 3.28Å; K354-F406 HydrophobicContact CD-CE1 3.84Å; K354-F406 HydrophobicContact CD-CZ 4.1Å; K354-F406 HydrophobicContact CG-CE1 4.19Å; P404-F406 PolarHBondContact O-N 3.43Å
407	L	89	Confident	86.9	Confident	55 Å²	55	49.6 Å²	49.6	29%	0.288	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	125.3	-178.7	179.3	67.6	0	0	0	109.1	I349 Y351 V397 P404	I349-L407 HydrophobicContact CG2-CD1 3.97Å; Y351-L407 HydrophobicContact CD2-CB 4.42Å; Y351-L407 HydrophobicContact CD2-CD1 4.44Å; V397-L407 HydrophobicContact CB-CD1 4.41Å; V397-L407 HydrophobicContact CG1-CD1 3.48Å; V397-L407 VanDerWaalsContact CG1-CD1 3.48Å; V397-L407 HydrophobicContact CG1-CD2 4.02Å; V397-L407 HydrophobicContact CG1-CG 4.42Å; V397-L407 HydrophobicContact CG2-CD1 3.96Å; P404-L407 PolarHBondContact O-N 2.95Å
408	S	89.9	Confident	86.5	Confident	59 Å²	59	52.5 Å²	52.5	41%	0.413	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	158.2	166.6	63.2	0	0	0	0	110.4	I349 S350	I349-S408 WeakPolarHBondContact CA-O 3.37Å; S350-S408 WeakPolarHBondContact CB-OG 3.5Å; S350-S408 PolarHBondContact N-O 3.28Å; S350-S408 VanDerWaalsContact N-O 3.16Å; S350-S408 PolarHBondContact N-OG 2.85Å; S350-S408 PolarHBondContact O-N 3.49Å; S350-S408 PolarHBondContact O-OG 3.3Å
409	G	88.3	Confident	85.8	Confident	44 Å²	44	55.3 Å²	55.3	45%	0.454	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	97.5	-178.4	-177.9	0	0	0	0	0	114.4	H347 H348	H347-G409 VanDerWaalsContact O-CA 3.28Å; H347-G409 WeakPolarHBondContact O-CA 3.47Å; H348-G409 VanDerWaalsContact O-CA 3.26Å; H348-G409 WeakPolarHBondContact O-CA 3.35Å
410	K	89.4	Confident	85	Confident	101 Å²	101	63.4 Å²	63.4	44%	0.439	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	134	-175.7	-62.9	178.3	-174.8	173.7	0	110.8	H347 L412 E662	H347-K410 HydrophobicContact CB-CB 4.45Å; H347-K410 PolarHBondContact CD2-O 3.34Å; H347-K410 PolarHBondContact N-O 3.08Å; H347-K410 PolarHBondContact O-N 3.15Å; K410-L412 HydrophobicContact CB-CD2 4.48Å; K410-E662 IonicContact NZ-OE1 3.25Å
411	V	91	Very high	84.4	Confident	21 Å²	21	63.8 Å²	63.8	13%	0.127	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	121.4	168.6	-177.6	0	0	0	0	108.4	L344 F346 I349 L398 Q418	L344-V411 HydrophobicContact CD1-CG1 4.48Å; L344-V411 HydrophobicContact CD2-CG1 4.17Å; L344-V411 HydrophobicContact CG-CG1 4.31Å; F346-V411 HydrophobicContact CB-CG2 4.37Å; I349-V411 HydrophobicContact CD1-CG2 3.74Å; I349-V411 HydrophobicContact CG1-CG2 4.47Å; L398-V411 HydrophobicContact CD2-CG1 4.35Å; L398-V411 HydrophobicContact CD2-CG2 4.15Å; V411-Q418 PolarHBondContact O-N 3.2Å
412	L	90.4	Very high	84.1	Confident	3 Å²	3	63 Å²	63	2%	0.016	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	140.4	-178.7	-50	-179.6	0	0	0	110.8	S345 K410 R416 P417 I657 L661	S345-L412 PolarHBondContact N-O 3.46Å; S345-L412 PolarHBondContact O-N 3.27Å; K410-L412 HydrophobicContact CB-CD2 4.48Å; L412-R416 CarbonylContact C-O 3.52Å; L412-R416 VanDerWaalsContact CA-O 3.22Å; L412-R416 WeakPolarHBondContact CA-O 3.37Å; L412-P417 HydrophobicContact CD2-CB 4.4Å; L412-I657 HydrophobicContact CD1-CG2 4.18Å; L412-L661 HydrophobicContact CD1-CD2 4.04Å; L412-L661 HydrophobicContact CD2-CD2 3.55Å; L412-L661 HydrophobicContact CG-CD2 4.47Å
413	I	88.4	Confident	83.7	Confident	22 Å²	22	64.9 Å²	64.9	11%	0.113	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	118.6	178	-58.3	161.4	0	0	0	106.6	A342 G415 R416 Q418 F422	A342-I413 HydrophobicContact CB-CG2 3.76Å; I413-G415 PolarHBondContact O-N 3.3Å; I413-G415 VanDerWaalsContact O-N 3.1Å; I413-R416 PolarHBondContact N-O 3.44Å; I413-R416 PolarHBondContact O-N 3.21Å; I413-Q418 HydrophobicContact CD1-CB 4.27Å; I413-Q418 HydrophobicContact CD1-CG 4.15Å; I413-F422 HydrophobicContact CD1-CD2 3.33Å; I413-F422 HydrophobicContact CD1-CE1 4.39Å; I413-F422 HydrophobicContact CD1-CE2 3.07Å; I413-F422 HydrophobicContact CD1-CG 4.14Å; I413-F422 HydrophobicContact CD1-CZ 3.63Å; I413-F422 HydrophobicContact CG1-CE2 4.19Å; I413-F422 HydrophobicContact CG1-CZ 4.48Å
414	D	86.3	Confident	83.3	Confident	97 Å²	97	65.1 Å²	65.1	52%	0.519	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	34.1	-173.8	-60.9	-45.1	0	0	0	113	A342 K343 R416	A342-D414 WeakPolarHBondContact CA-OD1 3.35Å; A342-D414 WeakPolarHBondContact CA-OD2 3.19Å; A342-D414 WeakPolarHBondContact CB-OD2 3.47Å; K343-D414 PolarHBondContact N-OD1 3.43Å; K343-D414 PolarHBondContact O-N 2.95Å; D414-R416 VanDerWaalsContact C-N 3.29Å; D414-R416 PolarHBondContact O-N 3.01Å
415	G	82.6	Confident	83.1	Confident	19 Å²	19	65 Å²	65	20%	0.196	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	4.7	-178.2	0	0	0	0	0	115.4	I413	I413-G415 PolarHBondContact O-N 3.3Å; I413-G415 VanDerWaalsContact O-N 3.1Å
416	R	84.7	Confident	83.3	Confident	148 Å²	148	57 Å²	57	56%	0.558	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.5	150.4	175	-64.2	-177.2	-178.2	177.5	1.5	111.2	L412 I413 D414	L412-R416 CarbonylContact C-O 3.52Å; L412-R416 VanDerWaalsContact CA-O 3.22Å; L412-R416 WeakPolarHBondContact CA-O 3.37Å; I413-R416 PolarHBondContact N-O 3.44Å; I413-R416 PolarHBondContact O-N 3.21Å; D414-R416 VanDerWaalsContact C-N 3.29Å; D414-R416 PolarHBondContact O-N 3.01Å
417	P	84.3	Confident	83.6	Confident	71 Å²	71	53.9 Å²	53.9	46%	0.461	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	149.4	175.5	26.3	-34.6	0	0	0	111.1	L412	L412-P417 HydrophobicContact CD2-CB 4.4Å
418	Q	82.2	Confident	83.8	Confident	63 Å²	63	51.2 Å²	51.2	29%	0.294	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-55.4	124.1	176.9	-176	-178.9	74.6	0	0	111	L398 V411 I413 F422	L398-Q418 PolarHBondContact O-NE2 3.38Å; V411-Q418 PolarHBondContact O-N 3.2Å; I413-Q418 HydrophobicContact CD1-CB 4.27Å; I413-Q418 HydrophobicContact CD1-CG 4.15Å; Q418-F422 VanDerWaalsContact CD-CD1 3.47Å; Q418-F422 HydrophobicContact CG-CB 3.34Å; Q418-F422 HydrophobicContact CG-CD1 3.71Å; Q418-F422 HydrophobicContact CG-CD2 4.12Å; Q418-F422 HydrophobicContact CG-CE1 4.46Å; Q418-F422 HydrophobicContact CG-CG 3.45Å; Q418-F422 VanDerWaalsContact CG-CG 3.45Å
419	P	78.9	Confident	83.9	Confident	59 Å²	59	48.5 Å²	48.5	38%	0.383	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-66.2	149.7	176.6	26.7	-32.7	0	0	0	110.2	N421 F422 I425	P419-N421 PolarHBondContact O-N 3.42Å; P419-N421 VanDerWaalsContact O-N 3.11Å; P419-F422 HydrophobicContact CG-CB 4.07Å; P419-F422 HydrophobicContact CG-CD2 4.4Å; P419-F422 WeakPolarHBondContact O-CB 3.47Å; P419-F422 PolarHBondContact O-N 2.71Å; P419-I425 HydrophobicContact CG-CD1 4.13Å
420	K	72.7	Confident	84.1	Confident	170 Å²	170	47.2 Å²	47.2	74%	0.739	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-30.8	177.7	-67.2	-176.3	179.5	179.5	0	112.9	F422	K420-F422 VanDerWaalsContact C-N 3.26Å; K420-F422 PolarHBondContact O-N 3.11Å
421	N	73	Confident	84.1	Confident	23 Å²	23	45.9 Å²	45.9	12%	0.123	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	12.9	177.2	-64.4	-10.4	0	0	0	113.1	P419 K423 C424 I425 I678	P419-N421 PolarHBondContact O-N 3.42Å; P419-N421 VanDerWaalsContact O-N 3.11Å; N421-K423 PolarHBondContact O-N 2.95Å; N421-K423 VanDerWaalsContact O-N 3.13Å; N421-C424 WeakPolarHBondContact O-CB 3.18Å; N421-C424 PolarHBondContact O-N 2.9Å; N421-I425 PolarHBondContact O-N 2.82Å; N421-I678 WeakPolarHBondContact OD1-CA 3.43Å; N421-I678 WeakPolarHBondContact OD1-CG1 3.3Å
422	F	80.3	Confident	83.8	Confident	5 Å²	5	50.2 Å²	50.2	2%	0.022	26%	0.256	C	S	.	.	H	α-helix	trans	-55.7	-35	-177.8	-175.8	-112	0	0	0	112.6	I413 Q418 P419 K420 C424 I425 S426 F513	I413-F422 HydrophobicContact CD1-CD2 3.33Å; I413-F422 HydrophobicContact CD1-CE1 4.39Å; I413-F422 HydrophobicContact CD1-CE2 3.07Å; I413-F422 HydrophobicContact CD1-CG 4.14Å; I413-F422 HydrophobicContact CD1-CZ 3.63Å; I413-F422 HydrophobicContact CG1-CE2 4.19Å; I413-F422 HydrophobicContact CG1-CZ 4.48Å; Q418-F422 VanDerWaalsContact CD-CD1 3.47Å; Q418-F422 HydrophobicContact CG-CB 3.34Å; Q418-F422 HydrophobicContact CG-CD1 3.71Å; Q418-F422 HydrophobicContact CG-CD2 4.12Å; Q418-F422 HydrophobicContact CG-CE1 4.46Å; Q418-F422 HydrophobicContact CG-CG 3.45Å; Q418-F422 VanDerWaalsContact CG-CG 3.45Å; P419-F422 HydrophobicContact CG-CB 4.07Å; P419-F422 HydrophobicContact CG-CD2 4.4Å; P419-F422 WeakPolarHBondContact O-CB 3.47Å; P419-F422 PolarHBondContact O-N 2.71Å; K420-F422 VanDerWaalsContact C-N 3.26Å; K420-F422 PolarHBondContact O-N 3.11Å; F422-C424 PolarHBondContact O-N 3.09Å; F422-C424 VanDerWaalsContact O-N 3.15Å; F422-I425 PolarHBondContact O-N 2.87Å; F422-S426 WeakPolarHBondContact O-CB 3.41Å; F422-S426 PolarHBondContact O-N 2.83Å; F422-S426 PolarHBondContact O-OG 2.89Å; F422-F513 AromaticContact CE1-CE2 3.8Å; F422-F513 HydrophobicContact CE1-CE2 3.8Å; F422-F513 HydrophobicContact CE1-CZ 4.12Å; F422-F513 AromaticContact CZ-CE2 3.85Å; F422-F513 HydrophobicContact CZ-CE2 3.85Å; F422-F513 HydrophobicContact CZ-CZ 4.12Å
423	K	77.2	Confident	83.6	Confident	56 Å²	56	51.6 Å²	51.6	24%	0.243	26%	0.263	C	S	.	.	H	α-helix	trans	-56.2	-30.5	175	-63.2	-179.3	178.8	-177.6	0	113.9	G400 N421	G400-K423 WeakPolarHBondContact O-CE 3.39Å; G400-K423 PolarHBondContact O-NZ 2.88Å; N421-K423 PolarHBondContact O-N 2.95Å; N421-K423 VanDerWaalsContact O-N 3.13Å
424	C	71.7	Confident	83.5	Confident	38 Å²	38	52.2 Å²	52.2	26%	0.257	27%	0.266	S	S	.	.	H	α-helix	trans	-87	-21.6	178.1	-56	0	0	0	0	112.5	N421 F422	N421-C424 WeakPolarHBondContact O-CB 3.18Å; N421-C424 PolarHBondContact O-N 2.9Å; F422-C424 PolarHBondContact O-N 3.09Å; F422-C424 VanDerWaalsContact O-N 3.15Å
425	I	78	Confident	83.7	Confident	76 Å²	76	48.7 Å²	48.7	39%	0.39	25%	0.248	S	C	.	.	H	α-helix	trans	-95.1	-35.7	-175.7	-59.2	167.6	0	0	0	111	P419 N421 F422 P509 P510	P419-I425 HydrophobicContact CG-CD1 4.13Å; N421-I425 PolarHBondContact O-N 2.82Å; F422-I425 PolarHBondContact O-N 2.87Å; I425-P509 WeakPolarHBondContact O-CA 3.47Å; I425-P509 VanDerWaalsContact O-CB 3.24Å; I425-P509 WeakPolarHBondContact O-CB 3.37Å; I425-P510 HydrophobicContact CG2-CG 4.34Å
426	S	87.2	Confident	84.1	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.007	25%	0.245	C	C	.	.	S	Bend	trans	-85.1	143.3	175.7	67.5	0	0	0	0	111.3	F422	F422-S426 WeakPolarHBondContact O-CB 3.41Å; F422-S426 PolarHBondContact O-N 2.83Å; F422-S426 PolarHBondContact O-OG 2.89Å
427	G	90	Very high	84.3	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	138.3	168.6	0	0	0	0	0	110.3	E504 P509 V511 F513	G427-E504 WeakPolarHBondContact CA-OE2 3.16Å; G427-P509 VanDerWaalsContact N-CB 3.3Å; G427-V511 PolarHBondContact N-O 2.79Å; G427-V511 VanDerWaalsContact N-O 3.07Å; G427-F513 WeakPolarHBondContact O-CD2 3.04Å; G427-F513 PolarHBondContact O-N 2.91Å
428	Y	92.4	Very high	84.6	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	117.6	173.6	-178	-72.3	0	0	0	110.6	L395 D396 A399 R401 V430 E504 F513 K966	L395-Y428 HydrophobicContact CD2-CE2 4.22Å; L395-Y428 HydrophobicContact CG-CE2 4.26Å; D396-Y428 PolarHBondContact OD1-OH 3.08Å; A399-Y428 HydrophobicContact CB-CD2 3.54Å; A399-Y428 HydrophobicContact CB-CE2 3.96Å; R401-Y428 VanDerWaalsContact CZ-CB 3.47Å; R401-Y428 VanDerWaalsContact CZ-CD1 3.41Å; R401-Y428 VanDerWaalsContact CZ-CG 3.46Å; Y428-V430 HydrophobicContact CD1-CG1 4.07Å; Y428-V430 HydrophobicContact CE1-CB 4.45Å; Y428-V430 HydrophobicContact CE1-CG1 3.7Å; Y428-E504 PolarHBondContact N-OE2 3.04Å; Y428-F513 CarbonylContact C-O 3.55Å; Y428-F513 WeakPolarHBondContact CA-O 3.35Å; Y428-F513 HydrophobicContact CD2-CB 3.54Å; Y428-F513 HydrophobicContact CD2-CG 4.24Å; Y428-F513 HydrophobicContact CE2-CB 4.22Å; Y428-F513 HydrophobicContact CG-CB 4.21Å; Y428-K966 PolarHBondContact OH-NZ 3.17Å; Y428-K966 VanDerWaalsContact OH-NZ 3.1Å
429	V	93.2	Very high	85.2	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.006	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	119.1	176.6	-177	0	0	0	0	108.4	I501 E504 L512 F513 L514 D515	V429-I501 HydrophobicContact CG1-CG1 4.4Å; V429-I501 HydrophobicContact CG2-CG1 4.13Å; V429-E504 HydrophobicContact CG2-CB 4.32Å; V429-E504 HydrophobicContact CG2-CG 3.97Å; V429-L512 HydrophobicContact CG2-CD1 4.25Å; V429-F513 PolarHBondContact N-O 2.74Å; V429-L514 HydrophobicContact CB-CB 4.26Å; V429-L514 HydrophobicContact CB-CD2 4.07Å; V429-L514 HydrophobicContact CB-CG 3.98Å; V429-L514 HydrophobicContact CG1-CD2 4.39Å; V429-L514 HydrophobicContact CG2-CD2 4.05Å; V429-L514 HydrophobicContact CG2-CG 4.11Å; V429-D515 PolarHBondContact O-N 2.82Å
430	V	91.2	Very high	85.9	Confident	17 Å²	17	34.9 Å²	34.9	10%	0.103	18%	0.179	C	C	.	.			trans	-72	162.9	176.2	-76	0	0	0	0	111.7	Y428 D432 I434 K497	Y428-V430 HydrophobicContact CD1-CG1 4.07Å; Y428-V430 HydrophobicContact CE1-CB 4.45Å; Y428-V430 HydrophobicContact CE1-CG1 3.7Å; V430-D432 WeakPolarHBondContact CG2-O 3.47Å; V430-I434 HydrophobicContact CG2-CB 4.47Å; V430-I434 HydrophobicContact CG2-CD1 3.95Å; V430-I434 HydrophobicContact CG2-CG1 4.07Å; V430-K497 PolarHBondContact O-NZ 3.28Å
431	Q	89.6	Confident	87.1	Confident	73 Å²	73	26.8 Å²	26.8	34%	0.341	14%	0.144	S	C	.	.	S	Bend	trans	-59.7	-57.5	177	-175.5	177.5	15.4	0	0	110.9	K497 D515 E516	Q431-K497 PolarHBondContact O-NZ 3.28Å; Q431-D515 VanDerWaalsContact CA-O 3.32Å; Q431-D515 WeakPolarHBondContact CA-O 3.24Å; Q431-D515 HydrophobicContact CB-CB 4.43Å; Q431-E516 HydrophobicContact CG-CB 4.32Å; Q431-E516 PolarHBondContact NE2-OE2 2.84Å
432	D	85.9	Confident	88.2	Confident	112 Å²	112	28.9 Å²	28.9	60%	0.599	15%	0.15	S	C	*	.	S	Bend	trans	-77.3	131.7	174.1	-62.3	-35.1	0	0	0	110.8	V430 I434	V430-D432 WeakPolarHBondContact CG2-O 3.47Å; D432-I434 PolarHBondContact O-N 3.49Å
433	D	85.8	Confident	89	Confident	33 Å²	33	31 Å²	31	18%	0.176	16%	0.16	C	C	.	.			trans	-73.8	90.4	-179.3	-62	-33.4	0	0	0	111.3	V435 R496 K497	D433-V435 HydrophobicContact CB-CG2 4.41Å; D433-V435 PolarHBondContact O-N 2.81Å; D433-R496 HydrophobicContact CB-CG 4.02Å; D433-R496 IonicContact OD2-NE 2.6Å; D433-R496 PolarHBondContact OD2-NE 2.85Å; D433-R496 IonicContact OD2-NH2 2.63Å; D433-K497 WeakPolarHBondContact OD1-CD 3.29Å; D433-K497 WeakPolarHBondContact OD1-CE 3.39Å; D433-K497 IonicContact OD1-NZ 2.82Å; D433-K497 PolarHBondContact OD1-NZ 3.14Å
434	I	86.3	Confident	89.8	Confident	34 Å²	34	28.6 Å²	28.6	17%	0.174	15%	0.15	C	C	.	.			trans	-78.9	86.8	176.4	-55.8	172.6	0	0	0	108.8	V430 D432 V765 L766 H769	V430-I434 HydrophobicContact CG2-CB 4.47Å; V430-I434 HydrophobicContact CG2-CD1 3.95Å; V430-I434 HydrophobicContact CG2-CG1 4.07Å; D432-I434 PolarHBondContact O-N 3.49Å; I434-V765 HydrophobicContact CD1-CG1 3.95Å; I434-V765 HydrophobicContact CG1-CG1 4.39Å; I434-L766 HydrophobicContact CG2-CB 4.2Å; I434-L766 HydrophobicContact CG2-CD1 3.59Å; I434-H769 HydrophobicContact CB-CB 4.48Å; I434-H769 HydrophobicContact CD1-CB 3.73Å; I434-H769 HydrophobicContact CG2-CB 4.02Å
435	V	91.1	Very high	91	Very high	23 Å²	23	26.8 Å²	26.8	14%	0.139	14%	0.138	C	C	.	.			trans	-128.5	145	177.6	-169.1	0	0	0	0	109.4	D433 G437 N444 V483 T499 M503	D433-V435 HydrophobicContact CB-CG2 4.41Å; D433-V435 PolarHBondContact O-N 2.81Å; V435-G437 PolarHBondContact O-N 2.8Å; V435-G437 VanDerWaalsContact O-N 3.16Å; V435-N444 HydrophobicContact CG1-CB 4.27Å; V435-N444 WeakPolarHBondContact CG1-OD1 3.2Å; V435-V483 HydrophobicContact CB-CG1 4.32Å; V435-V483 HydrophobicContact CG1-CB 4.5Å; V435-V483 HydrophobicContact CG1-CG1 4.1Å; V435-V483 HydrophobicContact CG1-CG2 4.07Å; V435-T499 HydrophobicContact CG1-CG2 4.34Å; V435-M503 HydrophobicContact CB-CE 4.31Å; V435-M503 HydrophobicContact CG1-CE 4.21Å; V435-M503 HydrophobicContact CG1-SD 4.41Å; V435-M503 HydrophobicContact CG2-CE 3.71Å
436	M	90.5	Very high	91.8	Very high	28 Å²	28	24.8 Å²	24.8	14%	0.138	13%	0.131	C	C	.	.			trans	-73.8	108	177.3	-164.8	69.5	-174.3	0	0	110.4	T438 L439 N444 N698 L766	M436-T438 VanDerWaalsContact C-N 3.31Å; M436-T438 PolarHBondContact O-N 3.01Å; M436-L439 HydrophobicContact CB-CD1 4.47Å; M436-L439 HydrophobicContact CG-CD1 3.81Å; M436-L439 PolarHBondContact O-N 3.29Å; M436-N444 PolarHBondContact N-OD1 2.92Å; M436-N444 PolarHBondContact O-ND2 3.05Å; M436-N698 HydrophobicContact CE-CB 3.97Å; M436-N698 WeakPolarHBondContact CE-ND2 3.5Å; M436-N698 WeakPolarHBondContact CE-OD1 3.38Å; M436-L766 HydrophobicContact SD-CD2 3.61Å
437	G	89.6	Confident	92.1	Very high	11 Å²	11	25.4 Å²	25.4	11%	0.113	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-24	-172.8	0	0	0	0	0	115.8	V435 L439 G484	V435-G437 PolarHBondContact O-N 2.8Å; V435-G437 VanDerWaalsContact O-N 3.16Å; G437-L439 VanDerWaalsContact C-N 3.34Å; G437-G484 WeakPolarHBondContact CA-O 3.47Å; G437-G484 PolarHBondContact O-N 3.27Å
438	T	90.1	Very high	92.3	Very high	14 Å²	14	25.4 Å²	25.4	9%	0.086	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-14.3	-179.9	55.2	0	0	0	0	113.6	M436 T485 N698 R701 D702	M436-T438 VanDerWaalsContact C-N 3.31Å; M436-T438 PolarHBondContact O-N 3.01Å; T438-T485 HydrophobicContact CG2-CG2 4.37Å; T438-N698 WeakPolarHBondContact CB-OD1 3.28Å; T438-N698 VanDerWaalsContact CG2-OD1 3.22Å; T438-N698 WeakPolarHBondContact CG2-OD1 3.2Å; T438-N698 PolarHBondContact OG1-OD1 2.96Å; T438-R701 VanDerWaalsContact O-CD 3.26Å; T438-R701 WeakPolarHBondContact O-CD 3.25Å; T438-R701 PolarHBondContact O-NH1 3.25Å; T438-R701 VanDerWaalsContact O-NH1 3.08Å; T438-D702 HydrophobicContact CG2-CB 4.15Å
439	L	93.6	Very high	92.3	Very high	5 Å²	5	25.5 Å²	25.5	3%	0.026	13%	0.134	C	C	.	.	S	Bend	trans	-94.4	156.8	177.3	-86.8	65.3	0	0	0	111.2	M436 G437 E443 N444 V483 R694 L697	M436-L439 HydrophobicContact CB-CD1 4.47Å; M436-L439 HydrophobicContact CG-CD1 3.81Å; M436-L439 PolarHBondContact O-N 3.29Å; G437-L439 VanDerWaalsContact C-N 3.34Å; L439-E443 WeakPolarHBondContact CA-OE2 3.33Å; L439-E443 HydrophobicContact CB-CB 4.09Å; L439-E443 HydrophobicContact CD2-CB 4.13Å; L439-E443 HydrophobicContact CG-CB 4.17Å; L439-N444 VanDerWaalsContact CB-ND2 3.32Å; L439-N444 WeakPolarHBondContact CB-ND2 3.26Å; L439-V483 PolarHBondContact O-N 2.97Å; L439-R694 HydrophobicContact CD1-CG 4.31Å; L439-R694 HydrophobicContact CD2-CG 3.95Å; L439-L697 HydrophobicContact CG-CD2 4.49Å
440	T	95.4	Very high	92.2	Very high	13 Å²	13	25.7 Å²	25.7	8%	0.08	14%	0.135	C	C	.	.	B	Isolated β-bridge	trans	-74.9	164.5	171.3	71.3	0	0	0	0	111.5	R442 E443 N444 D480 S481 K482	T440-R442 VanDerWaalsContact C-N 3.31Å; T440-R442 PolarHBondContact O-N 3.16Å; T440-E443 PolarHBondContact N-OE2 2.91Å; T440-E443 PolarHBondContact O-N 2.94Å; T440-E443 WeakPolarHBondContact OG1-CB 2.94Å; T440-E443 WeakPolarHBondContact OG1-CG 3.17Å; T440-E443 PolarHBondContact OG1-N 2.9Å; T440-E443 VanDerWaalsContact OG1-N 3.14Å; T440-E443 PolarHBondContact OG1-OE2 3.08Å; T440-N444 PolarHBondContact O-N 3.37Å; T440-N444 PolarHBondContact O-ND2 2.63Å; T440-D480 WeakPolarHBondContact CG2-O 3.16Å; T440-S481 WeakPolarHBondContact CA-O 3.33Å; T440-S481 WeakPolarHBondContact CB-O 3.31Å; T440-K482 HydrophobicContact CG2-CG 4.49Å
441	V	96.5	Very high	92.2	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-55.9	-48.2	174.6	172	0	0	0	0	110.4	E443 N444 L445 L475 V478 A479 S481 V483 V491 T499	V441-E443 PolarHBondContact O-N 3.32Å; V441-N444 PolarHBondContact O-N 3.47Å; V441-L445 HydrophobicContact CG1-CD1 4.27Å; V441-L445 WeakPolarHBondContact O-CG 3.43Å; V441-L445 PolarHBondContact O-N 3.4Å; V441-L445 VanDerWaalsContact O-N 3.12Å; V441-L475 HydrophobicContact CG1-CD1 4.03Å; V441-V478 WeakPolarHBondContact CG2-O 3.22Å; V441-A479 PolarHBondContact N-O 2.86Å; V441-S481 PolarHBondContact N-O 2.78Å; V441-S481 VanDerWaalsContact N-O 3.14Å; V441-V483 HydrophobicContact CG2-CG2 4.04Å; V441-V491 HydrophobicContact CG2-CG1 4.08Å; V441-T499 HydrophobicContact CB-CG2 4.4Å; V441-T499 HydrophobicContact CG1-CG2 3.93Å; V441-T499 HydrophobicContact CG2-CG2 4.35Å
442	R	96.9	Very high	92.1	Very high	66 Å²	66	22.2 Å²	22.2	25%	0.249	12%	0.117	C	C	.	.	H	α-helix	trans	-60.6	-42.5	177.3	-174.1	-174.8	-53.5	-74.5	1.7	112.2	T440 L445 S446 V466 N467 I470 A479 D480	T440-R442 VanDerWaalsContact C-N 3.31Å; T440-R442 PolarHBondContact O-N 3.16Å; R442-L445 PolarHBondContact O-N 2.99Å; R442-S446 VanDerWaalsContact O-CB 3.27Å; R442-S446 WeakPolarHBondContact O-CB 3.32Å; R442-S446 PolarHBondContact O-N 3.29Å; R442-S446 PolarHBondContact O-OG 2.68Å; R442-V466 HydrophobicContact CG-CG1 4.23Å; R442-N467 PolarHBondContact NH1-OD1 3.26Å; R442-I470 HydrophobicContact CB-CD1 4.24Å; R442-I470 HydrophobicContact CG-CD1 4.23Å; R442-A479 VanDerWaalsContact CB-O 3.26Å; R442-A479 WeakPolarHBondContact CB-O 3.24Å; R442-A479 PolarHBondContact N-O 2.98Å; R442-D480 WeakPolarHBondContact CD-OD1 3.34Å; R442-D480 IonicContact CZ-OD1 2.69Å; R442-D480 IonicContact CZ-OD2 3.91Å; R442-D480 IonicContact NE-OD1 3.13Å; R442-D480 PolarHBondContact NE-OD1 3.15Å; R442-D480 IonicContact NE-OD2 3.86Å; R442-D480 PolarHBondContact NE-OD2 3.38Å; R442-D480 IonicContact NH2-OD1 2.68Å; R442-D480 IonicContact NH2-OD2 3.28Å; R442-D480 PolarHBondContact NH2-OD2 3.19Å
443	E	96.3	Very high	92.1	Very high	51 Å²	51	17.6 Å²	17.6	24%	0.238	9%	0.092	C	C	.	.	H	α-helix	trans	-67	-39.6	180	-74.2	167.7	166.2	0	0	112.8	L439 T440 V441 S446 F447 R701	L439-E443 WeakPolarHBondContact CA-OE2 3.33Å; L439-E443 HydrophobicContact CB-CB 4.09Å; L439-E443 HydrophobicContact CD2-CB 4.13Å; L439-E443 HydrophobicContact CG-CB 4.17Å; T440-E443 PolarHBondContact N-OE2 2.91Å; T440-E443 PolarHBondContact O-N 2.94Å; T440-E443 WeakPolarHBondContact OG1-CB 2.94Å; T440-E443 WeakPolarHBondContact OG1-CG 3.17Å; T440-E443 PolarHBondContact OG1-N 2.9Å; T440-E443 VanDerWaalsContact OG1-N 3.14Å; T440-E443 PolarHBondContact OG1-OE2 3.08Å; V441-E443 PolarHBondContact O-N 3.32Å; E443-S446 PolarHBondContact O-N 3.47Å; E443-F447 VanDerWaalsContact O-CB 3.23Å; E443-F447 WeakPolarHBondContact O-CB 3.48Å; E443-F447 PolarHBondContact O-N 3Å; E443-R701 IonicContact OE1-CZ 3.7Å; E443-R701 IonicContact OE1-NH1 2.67Å; E443-R701 PolarHBondContact OE1-NH1 3.32Å; E443-R701 IonicContact OE1-NH2 2.91Å; E443-R701 PolarHBondContact OE1-NH2 3.32Å; E443-R701 IonicContact OE2-CZ 3.15Å; E443-R701 IonicContact OE2-NH1 2.76Å; E443-R701 PolarHBondContact OE2-NH1 2.83Å; E443-R701 IonicContact OE2-NH2 3.34Å; E443-R701 PolarHBondContact OE2-NH2 2.88Å
444	N	95.5	Very high	91.7	Very high	5 Å²	5	19.1 Å²	19.1	3%	0.027	10%	0.103	C	C	.	.	H	α-helix	trans	-61.1	-44.9	174.2	-82.8	-75.8	0	0	0	111	V435 M436 L439 T440 V441 F447 S448 M503	V435-N444 HydrophobicContact CG1-CB 4.27Å; V435-N444 WeakPolarHBondContact CG1-OD1 3.2Å; M436-N444 PolarHBondContact N-OD1 2.92Å; M436-N444 PolarHBondContact O-ND2 3.05Å; L439-N444 VanDerWaalsContact CB-ND2 3.32Å; L439-N444 WeakPolarHBondContact CB-ND2 3.26Å; T440-N444 PolarHBondContact O-N 3.37Å; T440-N444 PolarHBondContact O-ND2 2.63Å; V441-N444 PolarHBondContact O-N 3.47Å; N444-F447 PolarHBondContact O-N 2.88Å; N444-S448 PolarHBondContact O-N 3.28Å; N444-M503 HydrophobicContact CB-SD 4.09Å
445	L	95.6	Very high	91.1	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-65.2	-45.7	176.3	-67.5	175.5	0	0	0	112.3	V441 R442 F447 S448 A449 V466 I470 M503 I506	V441-L445 HydrophobicContact CG1-CD1 4.27Å; V441-L445 WeakPolarHBondContact O-CG 3.43Å; V441-L445 PolarHBondContact O-N 3.4Å; V441-L445 VanDerWaalsContact O-N 3.12Å; R442-L445 PolarHBondContact O-N 2.99Å; L445-F447 VanDerWaalsContact C-N 3.3Å; L445-F447 PolarHBondContact O-N 3.08Å; L445-S448 WeakPolarHBondContact O-CB 3.39Å; L445-S448 PolarHBondContact O-N 3.11Å; L445-A449 WeakPolarHBondContact O-CB 3.26Å; L445-A449 PolarHBondContact O-N 3Å; L445-V466 HydrophobicContact CB-CG1 3.78Å; L445-V466 HydrophobicContact CB-CG2 4.32Å; L445-V466 HydrophobicContact CD1-CG1 4.37Å; L445-I470 HydrophobicContact CD1-CD1 4.05Å; L445-I470 HydrophobicContact CD1-CG1 3.43Å; L445-I470 VanDerWaalsContact CD1-CG1 3.43Å; L445-M503 HydrophobicContact CD2-CG 4.05Å; L445-I506 HydrophobicContact CB-CD1 4.32Å; L445-I506 HydrophobicContact CD2-CD1 4.11Å
446	S	94.8	Very high	90.5	Very high	34 Å²	34	28.3 Å²	28.3	24%	0.238	14%	0.144	C	C	.	.	H	α-helix	trans	-62.8	-35.5	176.6	-69.8	0	0	0	0	112.7	R442 E443 A449 A450	R442-S446 VanDerWaalsContact O-CB 3.27Å; R442-S446 WeakPolarHBondContact O-CB 3.32Å; R442-S446 PolarHBondContact O-N 3.29Å; R442-S446 PolarHBondContact O-OG 2.68Å; E443-S446 PolarHBondContact O-N 3.47Å; S446-A449 PolarHBondContact O-N 3Å; S446-A450 VanDerWaalsContact O-CB 3.32Å; S446-A450 WeakPolarHBondContact O-CB 3.4Å; S446-A450 PolarHBondContact O-N 3.03Å
447	F	94.2	Very high	90.1	Very high	14 Å²	14	31.8 Å²	31.8	6%	0.061	16%	0.156	C	C	.	.	H	α-helix	trans	-64.9	-46.8	173.4	177.6	-95.4	0	0	0	111.1	E443 N444 L445 A449 A450 L451 K690 V691 R694 Y775 Y776	E443-F447 VanDerWaalsContact O-CB 3.23Å; E443-F447 WeakPolarHBondContact O-CB 3.48Å; E443-F447 PolarHBondContact O-N 3Å; N444-F447 PolarHBondContact O-N 2.88Å; L445-F447 VanDerWaalsContact C-N 3.3Å; L445-F447 PolarHBondContact O-N 3.08Å; F447-A449 PolarHBondContact O-N 3.44Å; F447-A450 PolarHBondContact O-N 2.89Å; F447-L451 HydrophobicContact CD1-CD1 4.19Å; F447-L451 HydrophobicContact CD2-CD1 4.39Å; F447-L451 HydrophobicContact CE1-CD1 3.51Å; F447-L451 HydrophobicContact CE2-CD1 3.76Å; F447-L451 HydrophobicContact CZ-CD1 3.27Å; F447-L451 HydrophobicContact CZ-CG 4.46Å; F447-L451 PolarHBondContact O-N 3.5Å; F447-K690 HydrophobicContact CE2-CB 4.48Å; F447-V691 HydrophobicContact CE2-CG2 4.32Å; F447-V691 HydrophobicContact CZ-CG2 4.13Å; F447-R694 HydrophobicContact CD2-CB 4.17Å; F447-R694 HydrophobicContact CE2-CB 3.96Å; F447-R694 HydrophobicContact CE2-CG 4.48Å; F447-Y775 HydrophobicContact CD1-CD1 4.44Å; F447-Y775 HydrophobicContact CD1-CE1 4.49Å; F447-Y775 HydrophobicContact CE1-CD1 4.03Å; F447-Y775 HydrophobicContact CE1-CE1 4.46Å; F447-Y776 HydrophobicContact CZ-CE1 4.35Å
448	S	92.9	Very high	90.1	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-58.5	-46.4	174	-171.2	0	0	0	0	111.6	N444 L445 A450 L451 R452 M503 Y775	N444-S448 PolarHBondContact O-N 3.28Å; L445-S448 WeakPolarHBondContact O-CB 3.39Å; L445-S448 PolarHBondContact O-N 3.11Å; S448-A450 VanDerWaalsContact C-N 3.35Å; S448-A450 PolarHBondContact O-N 3.26Å; S448-L451 PolarHBondContact O-N 3.3Å; S448-R452 WeakPolarHBondContact O-CB 3.5Å; S448-R452 PolarHBondContact O-N 2.87Å; S448-R452 WeakPolarHBondContact OG-CD 3.35Å; S448-M503 PolarHBondContact OG-O 3.12Å; S448-Y775 PolarHBondContact OG-OH 3.07Å
449	A	92.8	Very high	90	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.008	19%	0.187	C	C	.	.	H	α-helix	trans	-61.4	-38.5	176.8	0	0	0	0	0	113.5	L445 S446 F447 L451 M453 V466 I506	L445-A449 WeakPolarHBondContact O-CB 3.26Å; L445-A449 PolarHBondContact O-N 3Å; S446-A449 PolarHBondContact O-N 3Å; F447-A449 PolarHBondContact O-N 3.44Å; A449-L451 PolarHBondContact O-N 3.32Å; A449-M453 HydrophobicContact CB-CG 4.46Å; A449-M453 HydrophobicContact CB-SD 3.81Å; A449-M453 VanDerWaalsContact O-CB 3.31Å; A449-M453 WeakPolarHBondContact O-CB 3.4Å; A449-M453 WeakPolarHBondContact O-CG 3.17Å; A449-M453 PolarHBondContact O-N 3.3Å; A449-V466 HydrophobicContact CB-CG2 3.85Å; A449-I506 VanDerWaalsContact CA-CG2 3.46Å; A449-I506 HydrophobicContact CB-CG2 3.74Å
450	A	91.8	Very high	89.8	Confident	5 Å²	5	43.2 Å²	43.2	4%	0.041	22%	0.215	C	C	.	.	H	α-helix	trans	-68.3	-23	-179.7	0	0	0	0	0	113.9	S446 F447 S448 R686 K690	S446-A450 VanDerWaalsContact O-CB 3.32Å; S446-A450 WeakPolarHBondContact O-CB 3.4Å; S446-A450 PolarHBondContact O-N 3.03Å; F447-A450 PolarHBondContact O-N 2.89Å; S448-A450 VanDerWaalsContact C-N 3.35Å; S448-A450 PolarHBondContact O-N 3.26Å; A450-R686 PolarHBondContact O-NE 3.24Å; A450-K690 HydrophobicContact CB-CD 3.91Å; A450-K690 HydrophobicContact CB-CG 3.94Å
451	L	90.6	Very high	89.7	Confident	1 Å²	1	47 Å²	47	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-107.3	-34.5	-173.7	-67.1	-177.6	0	0	0	113.9	F447 S448 A449 A682 Q687 K690 V691 Y775 Y776	F447-L451 HydrophobicContact CD1-CD1 4.19Å; F447-L451 HydrophobicContact CD2-CD1 4.39Å; F447-L451 HydrophobicContact CE1-CD1 3.51Å; F447-L451 HydrophobicContact CE2-CD1 3.76Å; F447-L451 HydrophobicContact CZ-CD1 3.27Å; F447-L451 HydrophobicContact CZ-CG 4.46Å; F447-L451 PolarHBondContact O-N 3.5Å; S448-L451 PolarHBondContact O-N 3.3Å; A449-L451 PolarHBondContact O-N 3.32Å; L451-A682 WeakPolarHBondContact O-CB 3.28Å; L451-Q687 HydrophobicContact CD2-CB 4.13Å; L451-Q687 HydrophobicContact CD2-CG 4.09Å; L451-K690 HydrophobicContact CD2-CB 4.08Å; L451-V691 HydrophobicContact CD1-CG2 4.43Å; L451-Y775 HydrophobicContact CD1-CD1 4.18Å; L451-Y776 HydrophobicContact CD1-CD1 3.89Å
452	R	88.7	Confident	89.5	Confident	17 Å²	17	47.5 Å²	47.5	6%	0.064	23%	0.234	C	C	.	.	H	α-helix	trans	-99.9	-20.8	-174	-62.6	173.1	66.3	165.8	-0.7	114.3	S448 M503 E504 T507 A681 Y775	S448-R452 WeakPolarHBondContact O-CB 3.5Å; S448-R452 PolarHBondContact O-N 2.87Å; S448-R452 WeakPolarHBondContact OG-CD 3.35Å; R452-M503 PolarHBondContact NH1-O 2.98Å; R452-E504 IonicContact CZ-OE1 3.46Å; R452-E504 IonicContact CZ-OE2 3.62Å; R452-E504 IonicContact NH1-OE1 2.78Å; R452-E504 PolarHBondContact NH1-OE1 3.03Å; R452-E504 IonicContact NH1-OE2 3.71Å; R452-E504 PolarHBondContact NH1-OE2 3.34Å; R452-E504 IonicContact NH2-OE2 3.23Å; R452-E504 PolarHBondContact NH2-OE2 2.92Å; R452-T507 HydrophobicContact CB-CG2 3.46Å; R452-T507 VanDerWaalsContact CB-CG2 3.46Å; R452-T507 HydrophobicContact CG-CG2 4.33Å; R452-T507 VanDerWaalsContact NE-CG2 3.31Å; R452-T507 PolarHBondContact NH2-OG1 2.9Å; R452-A681 WeakPolarHBondContact O-CB 3.1Å; R452-Y775 HydrophobicContact CG-CD1 4.4Å; R452-Y775 HydrophobicContact CG-CD2 4.32Å; R452-Y775 HydrophobicContact CG-CE2 4.43Å; R452-Y775 HydrophobicContact CG-CG 4.3Å; R452-Y775 VanDerWaalsContact NH1-CE2 3.35Å; R452-Y775 PolarHBondContact NH1-OH 3.38Å
453	M	85.7	Confident	89.3	Confident	14 Å²	14	47.9 Å²	47.9	7%	0.069	24%	0.241	C	C	.	.	S	Bend	trans	-80.6	146.4	173.7	-62	179.4	70.4	0	0	110.6	A449 Y457 R462 K465 I506	A449-M453 HydrophobicContact CB-CG 4.46Å; A449-M453 HydrophobicContact CB-SD 3.81Å; A449-M453 VanDerWaalsContact O-CB 3.31Å; A449-M453 WeakPolarHBondContact O-CB 3.4Å; A449-M453 WeakPolarHBondContact O-CG 3.17Å; A449-M453 PolarHBondContact O-N 3.3Å; M453-Y457 HydrophobicContact CB-CD2 4.33Å; M453-Y457 HydrophobicContact CE-CD1 3.94Å; M453-Y457 HydrophobicContact CE-CD2 3.8Å; M453-Y457 HydrophobicContact CE-CE1 4.11Å; M453-Y457 HydrophobicContact CE-CE2 3.98Å; M453-Y457 HydrophobicContact CE-CG 3.77Å; M453-R462 HydrophobicContact CE-CG 4.25Å; M453-R462 HydrophobicContact SD-CB 4.43Å; M453-R462 HydrophobicContact SD-CG 3.9Å; M453-K465 HydrophobicContact CE-CB 4.24Å; M453-K465 HydrophobicContact CE-CG 4.02Å; M453-K465 HydrophobicContact SD-CB 4.47Å; M453-K465 HydrophobicContact SD-CG 4.22Å; M453-I506 HydrophobicContact CG-CG2 3.74Å; M453-I506 HydrophobicContact SD-CG2 3.92Å
454	T	77.9	Confident	89.2	Confident	65 Å²	65	50.3 Å²	50.3	40%	0.399	25%	0.253	S	S	.	.			trans	-63.3	163.9	178.9	60.3	0	0	0	0	111.9	H456 Y457 R462	T454-H456 VanDerWaalsContact C-N 3.26Å; T454-H456 PolarHBondContact O-N 3.13Å; T454-Y457 WeakPolarHBondContact OG1-CE2 3.33Å; T454-R462 PolarHBondContact O-NH2 3.35Å
455	M	72	Confident	89.1	Confident	76 Å²	76	52 Å²	52	37%	0.374	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-24.2	-177.1	-76.1	-66.8	155.9	0	0	114.5	Y457 R462 A682 R686	M455-Y457 PolarHBondContact O-N 3.31Å; M455-Y457 VanDerWaalsContact O-N 3.16Å; M455-R462 PolarHBondContact O-NH2 2.92Å; M455-A682 HydrophobicContact CE-CB 3.77Å; M455-R686 HydrophobicContact CE-CB 4.2Å; M455-R686 HydrophobicContact CE-CG 4.36Å
456	H	78.7	Confident	89.1	Confident	175 Å²	175	52 Å²	52	81%	0.81	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-25.2	-175.4	-61.8	-65	0	0	0	113.8	T454	T454-H456 VanDerWaalsContact C-N 3.26Å; T454-H456 PolarHBondContact O-N 3.13Å
457	Y	83.2	Confident	89.2	Confident	100 Å²	100	53.1 Å²	53.1	39%	0.392	26%	0.263	S	S	.	.	S	Bend	trans	-72.9	138.9	177.8	-65.9	-83.2	0	0	0	112.1	M453 T454 M455 E461 R462	M453-Y457 HydrophobicContact CB-CD2 4.33Å; M453-Y457 HydrophobicContact CE-CD1 3.94Å; M453-Y457 HydrophobicContact CE-CD2 3.8Å; M453-Y457 HydrophobicContact CE-CE1 4.11Å; M453-Y457 HydrophobicContact CE-CE2 3.98Å; M453-Y457 HydrophobicContact CE-CG 3.77Å; T454-Y457 WeakPolarHBondContact OG1-CE2 3.33Å; M455-Y457 PolarHBondContact O-N 3.31Å; M455-Y457 VanDerWaalsContact O-N 3.16Å; Y457-E461 VanDerWaalsContact CA-OE2 3.23Å; Y457-E461 WeakPolarHBondContact CA-OE2 3.35Å; Y457-E461 HydrophobicContact CD1-CB 4.18Å; Y457-R462 PolarHBondContact O-NH1 3.22Å; Y457-R462 PolarHBondContact O-NH2 3.27Å
458	T	89.1	Confident	89.2	Confident	62 Å²	62	53.3 Å²	53.3	38%	0.38	27%	0.265	S	S	.	.			trans	-70.4	173.3	168.5	63.2	0	0	0	0	110.9	E460 E461 R462	T458-E460 VanDerWaalsContact C-N 3.31Å; T458-E461 PolarHBondContact N-OE2 2.92Å; T458-E461 WeakPolarHBondContact OG1-CB 3.35Å; T458-E461 VanDerWaalsContact OG1-CD 3.28Å; T458-E461 WeakPolarHBondContact OG1-CG 3.38Å; T458-E461 PolarHBondContact OG1-N 3.3Å; T458-E461 VanDerWaalsContact OG1-N 3.11Å; T458-E461 PolarHBondContact OG1-OE2 3.44Å; T458-R462 WeakPolarHBondContact O-CG 3.3Å; T458-R462 PolarHBondContact O-N 3.42Å; T458-R462 PolarHBondContact O-NH1 3.45Å
459	T	87.4	Confident	89.2	Confident	77 Å²	77	53.5 Å²	53.5	47%	0.472	27%	0.266	S	S	.	.	H	α-helix	trans	-72	-35.7	176.4	-59.4	0	0	0	0	110.1	R462 N463	T459-R462 PolarHBondContact O-N 2.99Å; T459-N463 VanDerWaalsContact O-CG 3.26Å; T459-N463 PolarHBondContact O-N 2.74Å; T459-N463 PolarHBondContact O-ND2 2.76Å
460	E	91	Very high	89.3	Confident	131 Å²	131	53.5 Å²	53.5	61%	0.612	27%	0.265	S	S	*	.	H	α-helix	trans	-64.6	-47.1	179	-65.1	64.1	-141.9	0	0	110.3	T458 R462 N463 Q464	T458-E460 VanDerWaalsContact C-N 3.31Å; E460-R462 VanDerWaalsContact C-N 3.32Å; E460-R462 PolarHBondContact O-N 3.43Å; E460-N463 PolarHBondContact O-N 3.26Å; E460-Q464 WeakPolarHBondContact O-CB 3.33Å; E460-Q464 PolarHBondContact O-N 3.2Å
461	E	92.4	Very high	89.5	Confident	94 Å²	94	57.5 Å²	57.5	44%	0.439	29%	0.286	S	S	.	.	H	α-helix	trans	-62	-38.4	174.5	-75.2	165.3	-176.8	0	0	112.6	Y457 T458 Q464 K465	Y457-E461 VanDerWaalsContact CA-OE2 3.23Å; Y457-E461 WeakPolarHBondContact CA-OE2 3.35Å; Y457-E461 HydrophobicContact CD1-CB 4.18Å; T458-E461 PolarHBondContact N-OE2 2.92Å; T458-E461 WeakPolarHBondContact OG1-CB 3.35Å; T458-E461 VanDerWaalsContact OG1-CD 3.28Å; T458-E461 WeakPolarHBondContact OG1-CG 3.38Å; T458-E461 PolarHBondContact OG1-N 3.3Å; T458-E461 VanDerWaalsContact OG1-N 3.11Å; T458-E461 PolarHBondContact OG1-OE2 3.44Å; E461-Q464 PolarHBondContact O-N 3.47Å; E461-K465 WeakPolarHBondContact O-CB 3.27Å; E461-K465 PolarHBondContact O-N 3.01Å
462	R	91.8	Very high	89.5	Confident	9 Å²	9	59 Å²	59	3%	0.034	29%	0.293	C	S	.	.	H	α-helix	trans	-65.1	-43.3	175.1	-72	-175.5	-168.1	87.6	8.5	111.4	M453 T454 M455 Y457 T458 T459 E460 Q464 K465 V466 R686	M453-R462 HydrophobicContact CE-CG 4.25Å; M453-R462 HydrophobicContact SD-CB 4.43Å; M453-R462 HydrophobicContact SD-CG 3.9Å; T454-R462 PolarHBondContact O-NH2 3.35Å; M455-R462 PolarHBondContact O-NH2 2.92Å; Y457-R462 PolarHBondContact O-NH1 3.22Å; Y457-R462 PolarHBondContact O-NH2 3.27Å; T458-R462 WeakPolarHBondContact O-CG 3.3Å; T458-R462 PolarHBondContact O-N 3.42Å; T458-R462 PolarHBondContact O-NH1 3.45Å; T459-R462 PolarHBondContact O-N 2.99Å; E460-R462 VanDerWaalsContact C-N 3.32Å; E460-R462 PolarHBondContact O-N 3.43Å; R462-Q464 VanDerWaalsContact C-N 3.34Å; R462-K465 WeakPolarHBondContact O-CB 3.38Å; R462-K465 PolarHBondContact O-N 2.88Å; R462-V466 WeakPolarHBondContact O-CG2 3.38Å; R462-V466 PolarHBondContact O-N 3.03Å; R462-R686 VanDerWaalsContact CZ-CZ 3.46Å; R462-R686 VanDerWaalsContact CZ-NH1 3.29Å; R462-R686 VanDerWaalsContact NE-NH2 3.16Å; R462-R686 VanDerWaalsContact NH2-NH1 3.12Å
463	N	93.7	Very high	89.7	Confident	75 Å²	75	58.3 Å²	58.3	40%	0.401	29%	0.291	S	S	.	.	H	α-helix	trans	-65.9	-40	177.6	-69.3	-17	0	0	0	111.2	T459 E460 K465 V466 N467	T459-N463 VanDerWaalsContact O-CG 3.26Å; T459-N463 PolarHBondContact O-N 2.74Å; T459-N463 PolarHBondContact O-ND2 2.76Å; E460-N463 PolarHBondContact O-N 3.26Å; N463-K465 VanDerWaalsContact C-N 3.31Å; N463-K465 PolarHBondContact O-N 3.19Å; N463-V466 WeakPolarHBondContact O-CB 3.4Å; N463-V466 PolarHBondContact O-N 3.15Å; N463-N467 PolarHBondContact O-N 3.45Å; N463-N467 PolarHBondContact O-ND2 3.06Å
464	Q	94.5	Very high	90	Very high	102 Å²	102	59.8 Å²	59.8	48%	0.477	31%	0.309	S	S	.	.	H	α-helix	trans	-61.4	-41.9	173.5	-172.3	59.4	27.2	0	0	111.1	E460 E461 R462 V466 N467 D468	E460-Q464 WeakPolarHBondContact O-CB 3.33Å; E460-Q464 PolarHBondContact O-N 3.2Å; E461-Q464 PolarHBondContact O-N 3.47Å; R462-Q464 VanDerWaalsContact C-N 3.34Å; Q464-V466 VanDerWaalsContact C-N 3.32Å; Q464-V466 PolarHBondContact O-N 2.72Å; Q464-N467 WeakPolarHBondContact O-CB 3.43Å; Q464-N467 PolarHBondContact O-N 2.85Å; Q464-D468 PolarHBondContact O-N 3.42Å
465	K	92.6	Very high	90.8	Very high	40 Å²	40	56.7 Å²	56.7	17%	0.174	29%	0.291	C	S	.	.	H	α-helix	trans	-61.6	-39.9	175.2	-172.5	58.7	169.3	-175.7	0	112.7	M453 E461 R462 N463 D468 I469 E508	M453-K465 HydrophobicContact CE-CB 4.24Å; M453-K465 HydrophobicContact CE-CG 4.02Å; M453-K465 HydrophobicContact SD-CB 4.47Å; M453-K465 HydrophobicContact SD-CG 4.22Å; E461-K465 WeakPolarHBondContact O-CB 3.27Å; E461-K465 PolarHBondContact O-N 3.01Å; R462-K465 WeakPolarHBondContact O-CB 3.38Å; R462-K465 PolarHBondContact O-N 2.88Å; N463-K465 VanDerWaalsContact C-N 3.31Å; N463-K465 PolarHBondContact O-N 3.19Å; K465-D468 PolarHBondContact O-N 2.82Å; K465-I469 HydrophobicContact CD-CD1 4.47Å; K465-I469 HydrophobicContact CG-CD1 4.28Å; K465-I469 WeakPolarHBondContact O-CG1 3.32Å; K465-I469 PolarHBondContact O-N 2.85Å; K465-I469 VanDerWaalsContact O-N 3.15Å; K465-E508 WeakPolarHBondContact CE-OE1 3.37Å; K465-E508 IonicContact NZ-OE1 2.84Å; K465-E508 PolarHBondContact NZ-OE1 2.74Å; K465-E508 IonicContact NZ-OE2 3.61Å
466	V	95.4	Very high	91.9	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.006	30%	0.296	C	S	.	.	H	α-helix	trans	-63	-45.8	174.7	169.1	0	0	0	0	110.3	R442 L445 A449 R462 N463 Q464 D468 I469 I470 I506	R442-V466 HydrophobicContact CG-CG1 4.23Å; L445-V466 HydrophobicContact CB-CG1 3.78Å; L445-V466 HydrophobicContact CB-CG2 4.32Å; L445-V466 HydrophobicContact CD1-CG1 4.37Å; A449-V466 HydrophobicContact CB-CG2 3.85Å; R462-V466 WeakPolarHBondContact O-CG2 3.38Å; R462-V466 PolarHBondContact O-N 3.03Å; N463-V466 WeakPolarHBondContact O-CB 3.4Å; N463-V466 PolarHBondContact O-N 3.15Å; Q464-V466 VanDerWaalsContact C-N 3.32Å; Q464-V466 PolarHBondContact O-N 2.72Å; V466-D468 PolarHBondContact O-N 2.93Å; V466-I469 PolarHBondContact O-N 3.11Å; V466-I470 HydrophobicContact CG1-CD1 3.77Å; V466-I470 HydrophobicContact CG1-CG1 4.38Å; V466-I470 VanDerWaalsContact O-CG1 3.28Å; V466-I470 WeakPolarHBondContact O-CG1 3.13Å; V466-I470 PolarHBondContact O-N 2.84Å; V466-I506 HydrophobicContact CG2-CD1 4.4Å
467	N	96.3	Very high	92.7	Very high	56 Å²	56	53.9 Å²	53.9	30%	0.299	30%	0.297	S	S	.	.	H	α-helix	trans	-59.4	-46.9	176.2	-67.6	-23.5	0	0	0	111.7	R442 N463 Q464 I469 I470 D471	R442-N467 PolarHBondContact NH1-OD1 3.26Å; N463-N467 PolarHBondContact O-N 3.45Å; N463-N467 PolarHBondContact O-ND2 3.06Å; Q464-N467 WeakPolarHBondContact O-CB 3.43Å; Q464-N467 PolarHBondContact O-N 2.85Å; N467-I469 PolarHBondContact O-N 3.07Å; N467-I470 PolarHBondContact O-N 2.92Å; N467-I470 VanDerWaalsContact O-N 3.12Å; N467-D471 PolarHBondContact O-N 3.1Å
468	D	93.8	Very high	93.3	Very high	19 Å²	19	50 Å²	50	10%	0.102	28%	0.283	C	S	.	.	H	α-helix	trans	-55.4	-38.7	177.1	-76	-35.8	0	0	0	112.5	R336 Q464 K465 V466 E472	R336-D468 IonicContact NH2-OD1 3.7Å; R336-D468 PolarHBondContact NH2-OD1 2.84Å; Q464-D468 PolarHBondContact O-N 3.42Å; K465-D468 PolarHBondContact O-N 2.82Å; V466-D468 PolarHBondContact O-N 2.93Å; D468-E472 VanDerWaalsContact O-CB 3.26Å; D468-E472 WeakPolarHBondContact O-CB 3.07Å; D468-E472 PolarHBondContact O-N 3.03Å
469	I	93.9	Very high	93.6	Very high	3 Å²	3	47.1 Å²	47.1	2%	0.015	27%	0.266	C	S	.	.	H	α-helix	trans	-76	-38.2	-179.9	-71.7	171	0	0	0	111.2	K465 V466 N467 D471 E472 L473 I506	K465-I469 HydrophobicContact CD-CD1 4.47Å; K465-I469 HydrophobicContact CG-CD1 4.28Å; K465-I469 WeakPolarHBondContact O-CG1 3.32Å; K465-I469 PolarHBondContact O-N 2.85Å; K465-I469 VanDerWaalsContact O-N 3.15Å; V466-I469 PolarHBondContact O-N 3.11Å; N467-I469 PolarHBondContact O-N 3.07Å; I469-D471 VanDerWaalsContact C-N 3.3Å; I469-D471 PolarHBondContact O-N 3.38Å; I469-E472 PolarHBondContact O-N 3.05Å; I469-L473 HydrophobicContact CG2-CD1 3.66Å; I469-L473 HydrophobicContact CG2-CG 4.34Å; I469-L473 WeakPolarHBondContact O-CB 3.4Å; I469-L473 VanDerWaalsContact O-CG 3.26Å; I469-L473 WeakPolarHBondContact O-CG 3.13Å; I469-L473 PolarHBondContact O-N 3.3Å; I469-I506 HydrophobicContact CD1-CD1 3.43Å; I469-I506 VanDerWaalsContact CD1-CD1 3.43Å; I469-I506 HydrophobicContact CD1-CG1 4.34Å
470	I	95.8	Very high	94	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-61.2	-43.8	174.1	-66.6	168.8	0	0	0	109.8	R442 L445 V466 N467 L473 G474 L475 N476 A479	R442-I470 HydrophobicContact CB-CD1 4.24Å; R442-I470 HydrophobicContact CG-CD1 4.23Å; L445-I470 HydrophobicContact CD1-CD1 4.05Å; L445-I470 HydrophobicContact CD1-CG1 3.43Å; L445-I470 VanDerWaalsContact CD1-CG1 3.43Å; V466-I470 HydrophobicContact CG1-CD1 3.77Å; V466-I470 HydrophobicContact CG1-CG1 4.38Å; V466-I470 VanDerWaalsContact O-CG1 3.28Å; V466-I470 WeakPolarHBondContact O-CG1 3.13Å; V466-I470 PolarHBondContact O-N 2.84Å; N467-I470 PolarHBondContact O-N 2.92Å; N467-I470 VanDerWaalsContact O-N 3.12Å; I470-L473 PolarHBondContact O-N 2.9Å; I470-G474 PolarHBondContact O-N 2.85Å; I470-G474 VanDerWaalsContact O-N 3.09Å; I470-L475 HydrophobicContact CG2-CB 3.89Å; I470-L475 PolarHBondContact O-N 3.24Å; I470-N476 VanDerWaalsContact CG2-OD1 3.25Å; I470-N476 WeakPolarHBondContact CG2-OD1 3.14Å; I470-A479 HydrophobicContact CD1-CB 4.21Å; I470-A479 HydrophobicContact CG2-CB 3.89Å
471	D	94.1	Very high	94.2	Very high	89 Å²	89	44.6 Å²	44.6	48%	0.476	26%	0.258	S	S	.	.	H	α-helix	trans	-61.9	-47.6	174.6	-74.3	-38	0	0	0	111.5	N467 I469 L473 G474 N476	N467-D471 PolarHBondContact O-N 3.1Å; I469-D471 VanDerWaalsContact C-N 3.3Å; I469-D471 PolarHBondContact O-N 3.38Å; D471-L473 VanDerWaalsContact C-N 3.27Å; D471-L473 PolarHBondContact O-N 2.99Å; D471-G474 PolarHBondContact O-N 2.69Å; D471-G474 VanDerWaalsContact O-N 3.1Å; D471-N476 VanDerWaalsContact OD1-CG 3.22Å; D471-N476 PolarHBondContact OD1-ND2 3Å; D471-N476 PolarHBondContact OD1-OD1 3.31Å
472	E	90.8	Very high	94.2	Very high	33 Å²	33	45.1 Å²	45.1	15%	0.154	26%	0.259	C	S	.	.	H	α-helix	trans	-63.1	-31.9	-178.9	178	166.2	-166.1	0	0	113.4	D468 I469 L536 R539	D468-E472 VanDerWaalsContact O-CB 3.26Å; D468-E472 WeakPolarHBondContact O-CB 3.07Å; D468-E472 PolarHBondContact O-N 3.03Å; I469-E472 PolarHBondContact O-N 3.05Å; E472-L536 HydrophobicContact CG-CD2 4Å; E472-L536 WeakPolarHBondContact OE1-CD2 3.47Å; E472-R539 VanDerWaalsContact OE1-CD 3.29Å; E472-R539 WeakPolarHBondContact OE1-CD 3.41Å; E472-R539 IonicContact OE1-CZ 3.67Å; E472-R539 IonicContact OE1-NE 3.9Å; E472-R539 PolarHBondContact OE1-NE 3.43Å; E472-R539 IonicContact OE1-NH1 3.94Å; E472-R539 PolarHBondContact OE1-NH1 3.32Å; E472-R539 IonicContact OE1-NH2 3.78Å; E472-R539 IonicContact OE2-CZ 2.64Å; E472-R539 IonicContact OE2-NH1 3.66Å; E472-R539 PolarHBondContact OE2-NH1 3.04Å; E472-R539 IonicContact OE2-NH2 2.84Å
473	L	93	Very high	94.3	Very high	2 Å²	2	45 Å²	45	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-89.1	-7.9	177.6	-64.9	170.6	0	0	0	113.2	I469 I470 D471 L475 R498 I501 L505 T532 L536	I469-L473 HydrophobicContact CG2-CD1 3.66Å; I469-L473 HydrophobicContact CG2-CG 4.34Å; I469-L473 WeakPolarHBondContact O-CB 3.4Å; I469-L473 VanDerWaalsContact O-CG 3.26Å; I469-L473 WeakPolarHBondContact O-CG 3.13Å; I469-L473 PolarHBondContact O-N 3.3Å; I470-L473 PolarHBondContact O-N 2.9Å; D471-L473 VanDerWaalsContact C-N 3.27Å; D471-L473 PolarHBondContact O-N 2.99Å; L473-L475 HydrophobicContact CB-CD1 3.89Å; L473-L475 HydrophobicContact CB-CG 3.94Å; L473-L475 HydrophobicContact CD1-CD1 4.06Å; L473-R498 WeakPolarHBondContact CD1-O 3.43Å; L473-R498 WeakPolarHBondContact O-CD 3.44Å; L473-R498 PolarHBondContact O-NH1 3.47Å; L473-I501 HydrophobicContact CD2-CG2 4.29Å; L473-L505 HydrophobicContact CD1-CD1 4.49Å; L473-L505 HydrophobicContact CD2-CD1 3.9Å; L473-L505 HydrophobicContact CG-CD1 4.47Å; L473-T532 HydrophobicContact CD2-CG2 3.56Å; L473-L536 HydrophobicContact CD2-CD1 4.32Å
474	G	92.7	Very high	94.1	Very high	45 Å²	45	42 Å²	42	46%	0.464	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	64	45.7	-175.1	0	0	0	0	0	112.4	I470 D471 R498	I470-G474 PolarHBondContact O-N 2.85Å; I470-G474 VanDerWaalsContact O-N 3.09Å; D471-G474 PolarHBondContact O-N 2.69Å; D471-G474 VanDerWaalsContact O-N 3.1Å; G474-R498 PolarHBondContact O-NH1 2.91Å
475	L	94.8	Very high	93.6	Very high	1 Å²	1	40 Å²	40	1%	0.005	24%	0.241	C	C	.	.			trans	-106.2	11.1	-179	-68.9	175	0	0	0	113.4	V441 I470 L473 A477 V478 A479 E495 R498	V441-L475 HydrophobicContact CG1-CD1 4.03Å; I470-L475 HydrophobicContact CG2-CB 3.89Å; I470-L475 PolarHBondContact O-N 3.24Å; L473-L475 HydrophobicContact CB-CD1 3.89Å; L473-L475 HydrophobicContact CB-CG 3.94Å; L473-L475 HydrophobicContact CD1-CD1 4.06Å; L475-A477 VanDerWaalsContact C-N 3.32Å; L475-A477 PolarHBondContact O-N 3.43Å; L475-V478 HydrophobicContact CB-CG2 4.27Å; L475-V478 HydrophobicContact CD2-CG2 3.83Å; L475-V478 CarbonylContact O-C 3.48Å; L475-V478 WeakPolarHBondContact O-CG2 3.39Å; L475-V478 PolarHBondContact O-N 2.89Å; L475-V478 VanDerWaalsContact O-N 3.07Å; L475-A479 PolarHBondContact O-N 2.81Å; L475-E495 HydrophobicContact CD2-CB 4.09Å; L475-E495 HydrophobicContact CD2-CG 4.15Å; L475-R498 HydrophobicContact CD1-CB 4.1Å; L475-R498 HydrophobicContact CD2-CB 4.01Å; L475-R498 HydrophobicContact CG-CB 4.31Å
476	N	95.2	Very high	93	Very high	92 Å²	92	47.9 Å²	47.9	49%	0.492	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-55.6	-42.1	-175.2	-69.5	-21.6	0	0	0	113.8	I470 D471 V478	I470-N476 VanDerWaalsContact CG2-OD1 3.25Å; I470-N476 WeakPolarHBondContact CG2-OD1 3.14Å; D471-N476 VanDerWaalsContact OD1-CG 3.22Å; D471-N476 PolarHBondContact OD1-ND2 3Å; D471-N476 PolarHBondContact OD1-OD1 3.31Å; N476-V478 VanDerWaalsContact C-N 3.25Å; N476-V478 PolarHBondContact O-N 3.32Å
477	A	94.8	Very high	92.2	Very high	99 Å²	99	55 Å²	55	82%	0.818	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-65.7	-26.8	-179.5	0	0	0	0	0	113.5	L475	L475-A477 VanDerWaalsContact C-N 3.32Å; L475-A477 PolarHBondContact O-N 3.43Å
478	V	95.5	Very high	91.5	Very high	19 Å²	19	56.6 Å²	56.6	12%	0.115	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-115.4	9.6	-174.9	-63.4	0	0	0	0	113	V441 L475 N476 D480 S481 V491 E495	V441-V478 WeakPolarHBondContact CG2-O 3.22Å; L475-V478 HydrophobicContact CB-CG2 4.27Å; L475-V478 HydrophobicContact CD2-CG2 3.83Å; L475-V478 CarbonylContact O-C 3.48Å; L475-V478 WeakPolarHBondContact O-CG2 3.39Å; L475-V478 PolarHBondContact O-N 2.89Å; L475-V478 VanDerWaalsContact O-N 3.07Å; N476-V478 VanDerWaalsContact C-N 3.25Å; N476-V478 PolarHBondContact O-N 3.32Å; V478-D480 VanDerWaalsContact C-N 3.28Å; V478-D480 PolarHBondContact O-N 3.23Å; V478-S481 WeakPolarHBondContact O-CB 3.4Å; V478-S481 PolarHBondContact O-N 3.17Å; V478-S481 VanDerWaalsContact O-N 3.07Å; V478-V491 HydrophobicContact CB-CG1 4.03Å; V478-V491 HydrophobicContact CG1-CG1 4.44Å; V478-V491 HydrophobicContact CG2-CG1 4.49Å; V478-E495 WeakPolarHBondContact CG1-OE1 3.46Å; V478-E495 HydrophobicContact CG2-CB 4.37Å; V478-E495 HydrophobicContact CG2-CG 4.19Å
479	A	95.8	Very high	91.3	Very high	1 Å²	1	67.4 Å²	67.4	1%	0.008	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-41.6	-173.1	0	0	0	0	0	112.5	V441 R442 I470 L475	V441-A479 PolarHBondContact N-O 2.86Å; R442-A479 VanDerWaalsContact CB-O 3.26Å; R442-A479 WeakPolarHBondContact CB-O 3.24Å; R442-A479 PolarHBondContact N-O 2.98Å; I470-A479 HydrophobicContact CD1-CB 4.21Å; I470-A479 HydrophobicContact CG2-CB 3.89Å; L475-A479 PolarHBondContact O-N 2.81Å
480	D	95.8	Very high	91.1	Very high	103 Å²	103	68.8 Å²	68.8	55%	0.551	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	9.8	-178.1	-61.2	-61.2	0	0	0	112.8	T440 R442 V478	T440-D480 WeakPolarHBondContact CG2-O 3.16Å; R442-D480 WeakPolarHBondContact CD-OD1 3.34Å; R442-D480 IonicContact CZ-OD1 2.69Å; R442-D480 IonicContact CZ-OD2 3.91Å; R442-D480 IonicContact NE-OD1 3.13Å; R442-D480 PolarHBondContact NE-OD1 3.15Å; R442-D480 IonicContact NE-OD2 3.86Å; R442-D480 PolarHBondContact NE-OD2 3.38Å; R442-D480 IonicContact NH2-OD1 2.68Å; R442-D480 IonicContact NH2-OD2 3.28Å; R442-D480 PolarHBondContact NH2-OD2 3.19Å; V478-D480 VanDerWaalsContact C-N 3.28Å; V478-D480 PolarHBondContact O-N 3.23Å
481	S	95.1	Very high	91	Very high	53 Å²	53	69.9 Å²	69.9	37%	0.371	39%	0.388	S	S	.	.	S	Bend	trans	-85.2	142.8	173.1	-65.1	0	0	0	0	111.3	T440 V441 V478	T440-S481 WeakPolarHBondContact CA-O 3.33Å; T440-S481 WeakPolarHBondContact CB-O 3.31Å; V441-S481 PolarHBondContact N-O 2.78Å; V441-S481 VanDerWaalsContact N-O 3.14Å; V478-S481 WeakPolarHBondContact O-CB 3.4Å; V478-S481 PolarHBondContact O-N 3.17Å; V478-S481 VanDerWaalsContact O-N 3.07Å
482	K	93.7	Very high	90.9	Very high	105 Å²	105	67.3 Å²	67.3	46%	0.457	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-63.7	137.9	172.7	-69.1	-177.5	-178.7	177.4	0	110	T440 G484 G490 V491	T440-K482 HydrophobicContact CG2-CG 4.49Å; K482-G484 PolarHBondContact O-N 3.09Å; K482-G490 WeakPolarHBondContact O-CA 3.12Å; K482-V491 PolarHBondContact O-N 2.88Å
483	V	93.3	Very high	90.8	Very high	6 Å²	6	67.2 Å²	67.2	4%	0.036	39%	0.385	C	S	.	.			trans	-63.2	-34.1	179.1	175.7	0	0	0	0	111.2	V435 L439 V441 G490 V491 R496 T499	V435-V483 HydrophobicContact CB-CG1 4.32Å; V435-V483 HydrophobicContact CG1-CB 4.5Å; V435-V483 HydrophobicContact CG1-CG1 4.1Å; V435-V483 HydrophobicContact CG1-CG2 4.07Å; L439-V483 PolarHBondContact O-N 2.97Å; V441-V483 HydrophobicContact CG2-CG2 4.04Å; V483-G490 WeakPolarHBondContact O-CA 3.39Å; V483-V491 HydrophobicContact CG1-CG2 4.2Å; V483-V491 PolarHBondContact O-N 3.15Å; V483-V491 VanDerWaalsContact O-N 3.07Å; V483-R496 HydrophobicContact CG1-CG 3.88Å; V483-T499 HydrophobicContact CG2-CG2 4.49Å
484	G	89.4	Confident	90.7	Very high	12 Å²	12	67.2 Å²	67.2	12%	0.124	39%	0.386	C	S	.	.			trans	92.5	153.4	-180	0	0	0	0	0	112.5	G437 K482 V488	G437-G484 WeakPolarHBondContact CA-O 3.47Å; G437-G484 PolarHBondContact O-N 3.27Å; K482-G484 PolarHBondContact O-N 3.09Å; G484-V488 CarbonylContact C-O 3.59Å; G484-V488 VanDerWaalsContact CA-O 3.23Å; G484-V488 WeakPolarHBondContact CA-O 3.49Å
485	T	84.3	Confident	90.8	Very high	60 Å²	60	67.1 Å²	67.1	37%	0.368	37%	0.373	S	S	.	.			trans	-108.1	179.6	174.1	63.4	0	0	0	0	109.4	T438 L487 V488	T438-T485 HydrophobicContact CG2-CG2 4.37Å; T485-L487 PolarHBondContact O-N 2.93Å; T485-L487 PolarHBondContact OG1-N 3.17Å; T485-V488 PolarHBondContact N-O 3.05Å; T485-V488 CarbonylContact O-C 3.58Å; T485-V488 PolarHBondContact OG1-N 2.86Å
486	E	80	Confident	90.7	Very high	205 Å²	205	72.1 Å²	72.1	96%	0.958	39%	0.392	S	S	*	.	S	Bend	trans	-61.5	-29.4	174.3	-64.5	175.1	179.9	0	0	112.4
487	L	77.9	Confident	90.6	Very high	152 Å²	152	68 Å²	68	80%	0.796	37%	0.37	S	S	*	.	S	Bend	trans	-92.3	-34.7	-179.7	-60.8	175.1	0	0	0	112.5	T485	T485-L487 PolarHBondContact O-N 2.93Å; T485-L487 PolarHBondContact OG1-N 3.17Å
488	V	82.8	Confident	90.6	Very high	89 Å²	89	64.9 Å²	64.9	54%	0.539	34%	0.337	S	S	.	.	S	Bend	trans	-109	112.7	-177.2	-177.9	0	0	0	0	109.5	G484 T485 G490	G484-V488 CarbonylContact C-O 3.59Å; G484-V488 VanDerWaalsContact CA-O 3.23Å; G484-V488 WeakPolarHBondContact CA-O 3.49Å; T485-V488 PolarHBondContact N-O 3.05Å; T485-V488 CarbonylContact O-C 3.58Å; T485-V488 PolarHBondContact OG1-N 2.86Å; V488-G490 PolarHBondContact O-N 3.39Å
489	R	87.8	Confident	90.6	Very high	245 Å²	245	64 Å²	64	93%	0.925	33%	0.331	S	S	*	.			trans	-56.4	133	176.2	-174.4	177.7	178.1	172.7	-0.3	110.8
490	G	90.9	Very high	90.5	Very high	33 Å²	33	64.1 Å²	64.1	34%	0.34	33%	0.332	S	S	.	.			trans	-131.9	-134.6	172.5	0	0	0	0	0	111.7	K482 V483 V488	K482-G490 WeakPolarHBondContact O-CA 3.12Å; V483-G490 WeakPolarHBondContact O-CA 3.39Å; V488-G490 PolarHBondContact O-N 3.39Å
491	V	93.3	Very high	90.5	Very high	23 Å²	23	59.2 Å²	59.2	14%	0.139	31%	0.306	C	S	.	.	S	Bend	trans	-66.2	160.1	-179.1	-56.2	0	0	0	0	112.2	V441 V478 K482 V483 E495 R496	V441-V491 HydrophobicContact CG2-CG1 4.08Å; V478-V491 HydrophobicContact CB-CG1 4.03Å; V478-V491 HydrophobicContact CG1-CG1 4.44Å; V478-V491 HydrophobicContact CG2-CG1 4.49Å; K482-V491 PolarHBondContact O-N 2.88Å; V483-V491 HydrophobicContact CG1-CG2 4.2Å; V483-V491 PolarHBondContact O-N 3.15Å; V483-V491 VanDerWaalsContact O-N 3.07Å; V491-E495 HydrophobicContact CB-CB 3.98Å; V491-E495 HydrophobicContact CG2-CB 4.13Å; V491-R496 HydrophobicContact CG2-CB 3.93Å
492	S	91.8	Very high	90.4	Very high	36 Å²	36	56.7 Å²	56.7	25%	0.252	29%	0.288	S	S	.	.			trans	-64.9	157	177.2	68.5	0	0	0	0	111.9	G494 E495 R496 M525	S492-G494 VanDerWaalsContact C-N 3.26Å; S492-G494 PolarHBondContact O-N 3.03Å; S492-E495 VanDerWaalsContact CB-OE2 3.31Å; S492-E495 WeakPolarHBondContact CB-OE2 3.27Å; S492-E495 PolarHBondContact N-OE2 3.47Å; S492-E495 PolarHBondContact O-N 2.92Å; S492-E495 WeakPolarHBondContact OG-CB 3.45Å; S492-E495 VanDerWaalsContact OG-CG 3.23Å; S492-E495 WeakPolarHBondContact OG-CG 3.37Å; S492-E495 PolarHBondContact OG-N 3.15Å; S492-E495 PolarHBondContact OG-OE2 3.3Å; S492-R496 PolarHBondContact O-N 2.98Å; S492-M525 WeakPolarHBondContact OG-CE 3.36Å
493	G	89.5	Confident	90.4	Very high	31 Å²	31	52.1 Å²	52.1	32%	0.32	27%	0.269	S	S	.	.	H	α-helix	trans	-55.4	-38.7	179.5	0	0	0	0	0	113.5	R496 K497 L521	G493-R496 PolarHBondContact O-N 2.8Å; G493-K497 PolarHBondContact O-N 2.91Å; G493-L521 VanDerWaalsContact C-CD2 3.43Å
494	G	90.8	Very high	90.4	Very high	2 Å²	2	52 Å²	52	2%	0.021	27%	0.267	C	S	.	.	H	α-helix	trans	-69.6	-35.2	176.6	0	0	0	0	0	113.6	S492 R498	S492-G494 VanDerWaalsContact C-N 3.26Å; S492-G494 PolarHBondContact O-N 3.03Å; G494-R498 WeakPolarHBondContact O-CG 3.38Å; G494-R498 PolarHBondContact O-N 2.95Å; G494-R498 PolarHBondContact O-NE 2.83Å
495	E	93.5	Very high	90.5	Very high	43 Å²	43	51.5 Å²	51.5	20%	0.201	26%	0.262	C	S	.	.	H	α-helix	trans	-70.5	-40.5	173.6	-72.6	161.4	158.7	0	0	111.6	L475 V478 V491 S492 K497 R498 T499	L475-E495 HydrophobicContact CD2-CB 4.09Å; L475-E495 HydrophobicContact CD2-CG 4.15Å; V478-E495 WeakPolarHBondContact CG1-OE1 3.46Å; V478-E495 HydrophobicContact CG2-CB 4.37Å; V478-E495 HydrophobicContact CG2-CG 4.19Å; V491-E495 HydrophobicContact CB-CB 3.98Å; V491-E495 HydrophobicContact CG2-CB 4.13Å; S492-E495 VanDerWaalsContact CB-OE2 3.31Å; S492-E495 WeakPolarHBondContact CB-OE2 3.27Å; S492-E495 PolarHBondContact N-OE2 3.47Å; S492-E495 PolarHBondContact O-N 2.92Å; S492-E495 WeakPolarHBondContact OG-CB 3.45Å; S492-E495 VanDerWaalsContact OG-CG 3.23Å; S492-E495 WeakPolarHBondContact OG-CG 3.37Å; S492-E495 PolarHBondContact OG-N 3.15Å; S492-E495 PolarHBondContact OG-OE2 3.3Å; E495-K497 VanDerWaalsContact C-N 3.32Å; E495-K497 PolarHBondContact O-N 3.38Å; E495-R498 PolarHBondContact O-N 3.29Å; E495-T499 PolarHBondContact O-N 2.74Å; E495-T499 PolarHBondContact O-OG1 3.13Å
496	R	93.7	Very high	90.8	Very high	105 Å²	105	48.7 Å²	48.7	40%	0.396	25%	0.245	S	C	.	.	H	α-helix	trans	-59.6	-44.3	172.8	-173	176.9	67.3	-168.6	0.6	110.9	D433 V483 V491 S492 G493 R498 T499 S500	D433-R496 HydrophobicContact CB-CG 4.02Å; D433-R496 IonicContact OD2-NE 2.6Å; D433-R496 PolarHBondContact OD2-NE 2.85Å; D433-R496 IonicContact OD2-NH2 2.63Å; V483-R496 HydrophobicContact CG1-CG 3.88Å; V491-R496 HydrophobicContact CG2-CB 3.93Å; S492-R496 PolarHBondContact O-N 2.98Å; G493-R496 PolarHBondContact O-N 2.8Å; R496-R498 PolarHBondContact O-N 2.78Å; R496-T499 WeakPolarHBondContact O-CB 3.04Å; R496-T499 PolarHBondContact O-N 2.97Å; R496-T499 VanDerWaalsContact O-N 3.16Å; R496-S500 PolarHBondContact O-N 3.47Å
497	K	93.8	Very high	91.1	Very high	6 Å²	6	40.8 Å²	40.8	3%	0.026	21%	0.21	C	C	.	.	H	α-helix	trans	-61.5	-45.4	175.9	-166.5	60.6	168.1	-173.9	0	112	V430 Q431 D433 G493 E495 T499 S500 I501 L521 V529	V430-K497 PolarHBondContact O-NZ 3.28Å; Q431-K497 PolarHBondContact O-NZ 3.28Å; D433-K497 WeakPolarHBondContact OD1-CD 3.29Å; D433-K497 WeakPolarHBondContact OD1-CE 3.39Å; D433-K497 IonicContact OD1-NZ 2.82Å; D433-K497 PolarHBondContact OD1-NZ 3.14Å; G493-K497 PolarHBondContact O-N 2.91Å; E495-K497 VanDerWaalsContact C-N 3.32Å; E495-K497 PolarHBondContact O-N 3.38Å; K497-T499 VanDerWaalsContact C-N 3.28Å; K497-T499 PolarHBondContact O-N 2.91Å; K497-S500 WeakPolarHBondContact O-CB 3.47Å; K497-S500 PolarHBondContact O-N 3.37Å; K497-I501 HydrophobicContact CG-CD1 4.41Å; K497-I501 WeakPolarHBondContact O-CG1 3.42Å; K497-I501 PolarHBondContact O-N 2.98Å; K497-L521 HydrophobicContact CB-CD1 4.49Å; K497-V529 HydrophobicContact CB-CG2 4.4Å; K497-V529 HydrophobicContact CG-CG1 4.27Å; K497-V529 HydrophobicContact CG-CG2 4.49Å
498	R	94.2	Very high	91.5	Very high	34 Å²	34	37.2 Å²	37.2	13%	0.128	19%	0.19	C	C	.	.	H	α-helix	trans	-61.2	-36.8	174.4	-74.7	-175.8	-72.4	159.5	-4.9	112.1	L473 G474 L475 G494 E495 R496 I501 G502 V529	L473-R498 WeakPolarHBondContact CD1-O 3.43Å; L473-R498 WeakPolarHBondContact O-CD 3.44Å; L473-R498 PolarHBondContact O-NH1 3.47Å; G474-R498 PolarHBondContact O-NH1 2.91Å; L475-R498 HydrophobicContact CD1-CB 4.1Å; L475-R498 HydrophobicContact CD2-CB 4.01Å; L475-R498 HydrophobicContact CG-CB 4.31Å; G494-R498 WeakPolarHBondContact O-CG 3.38Å; G494-R498 PolarHBondContact O-N 2.95Å; G494-R498 PolarHBondContact O-NE 2.83Å; E495-R498 PolarHBondContact O-N 3.29Å; R496-R498 PolarHBondContact O-N 2.78Å; R498-I501 PolarHBondContact O-N 2.9Å; R498-G502 PolarHBondContact O-N 3.1Å; R498-V529 HydrophobicContact CG-CG2 4.28Å
499	T	95.2	Very high	91.8	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.7	-44	174.6	-57	0	0	0	0	111.2	V435 V441 V483 E495 R496 K497 I501 G502 M503	V435-T499 HydrophobicContact CG1-CG2 4.34Å; V441-T499 HydrophobicContact CB-CG2 4.4Å; V441-T499 HydrophobicContact CG1-CG2 3.93Å; V441-T499 HydrophobicContact CG2-CG2 4.35Å; V483-T499 HydrophobicContact CG2-CG2 4.49Å; E495-T499 PolarHBondContact O-N 2.74Å; E495-T499 PolarHBondContact O-OG1 3.13Å; R496-T499 WeakPolarHBondContact O-CB 3.04Å; R496-T499 PolarHBondContact O-N 2.97Å; R496-T499 VanDerWaalsContact O-N 3.16Å; K497-T499 VanDerWaalsContact C-N 3.28Å; K497-T499 PolarHBondContact O-N 2.91Å; T499-I501 PolarHBondContact O-N 3.44Å; T499-G502 PolarHBondContact O-N 3.03Å; T499-G502 VanDerWaalsContact O-N 3.12Å; T499-M503 WeakPolarHBondContact O-CG 3.42Å; T499-M503 PolarHBondContact O-N 3.46Å
500	S	94.4	Very high	91.8	Very high	3 Å²	3	23 Å²	23	2%	0.021	13%	0.131	C	C	.	.	H	α-helix	trans	-59.7	-44.8	174.5	-174.7	0	0	0	0	112	R496 K497 G502 M503	R496-S500 PolarHBondContact O-N 3.47Å; K497-S500 WeakPolarHBondContact O-CB 3.47Å; K497-S500 PolarHBondContact O-N 3.37Å; S500-G502 VanDerWaalsContact C-N 3.32Å; S500-G502 PolarHBondContact O-N 2.81Å; S500-M503 PolarHBondContact O-N 2.79Å
501	I	94.6	Very high	91.8	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-59.5	-44.2	172.9	-64.8	165	0	0	0	110.6	V429 L473 K497 R498 T499 M503 E504 L505 L512 L514 V529 L533 L536	V429-I501 HydrophobicContact CG1-CG1 4.4Å; V429-I501 HydrophobicContact CG2-CG1 4.13Å; L473-I501 HydrophobicContact CD2-CG2 4.29Å; K497-I501 HydrophobicContact CG-CD1 4.41Å; K497-I501 WeakPolarHBondContact O-CG1 3.42Å; K497-I501 PolarHBondContact O-N 2.98Å; R498-I501 PolarHBondContact O-N 2.9Å; T499-I501 PolarHBondContact O-N 3.44Å; I501-M503 VanDerWaalsContact C-N 3.34Å; I501-M503 PolarHBondContact O-N 3.1Å; I501-E504 PolarHBondContact O-N 3.1Å; I501-E504 VanDerWaalsContact O-N 3.16Å; I501-L505 HydrophobicContact CG2-CD1 3.78Å; I501-L505 HydrophobicContact CG2-CG 4.14Å; I501-L505 WeakPolarHBondContact O-CG 3.28Å; I501-L505 PolarHBondContact O-N 2.66Å; I501-L512 HydrophobicContact CG2-CD2 4.33Å; I501-L514 HydrophobicContact CD1-CD2 3.89Å; I501-L514 HydrophobicContact CG1-CD2 3.76Å; I501-V529 HydrophobicContact CD1-CG1 3.95Å; I501-L533 HydrophobicContact CD1-CD2 4.13Å; I501-L533 HydrophobicContact CG2-CD2 4.49Å; I501-L536 HydrophobicContact CG2-CD1 4.26Å
502	G	94.4	Very high	91.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-60.8	-38.8	179.7	0	0	0	0	0	114	R498 T499 S500 E504 L505 I506	R498-G502 PolarHBondContact O-N 3.1Å; T499-G502 PolarHBondContact O-N 3.03Å; T499-G502 VanDerWaalsContact O-N 3.12Å; S500-G502 VanDerWaalsContact C-N 3.32Å; S500-G502 PolarHBondContact O-N 2.81Å; G502-E504 PolarHBondContact O-N 3.28Å; G502-L505 PolarHBondContact O-N 3.46Å; G502-L505 VanDerWaalsContact O-N 3.12Å; G502-I506 WeakPolarHBondContact O-CG1 3.26Å; G502-I506 PolarHBondContact O-N 3.39Å
503	M	93.4	Very high	92	Very high	10 Å²	10	18.7 Å²	18.7	5%	0.049	10%	0.096	C	C	.	.	H	α-helix	trans	-60.4	-34	176.8	-70.3	-165.8	-60.1	0	0	112.5	V435 N444 L445 S448 R452 T499 S500 I501	V435-M503 HydrophobicContact CB-CE 4.31Å; V435-M503 HydrophobicContact CG1-CE 4.21Å; V435-M503 HydrophobicContact CG1-SD 4.41Å; V435-M503 HydrophobicContact CG2-CE 3.71Å; N444-M503 HydrophobicContact CB-SD 4.09Å; L445-M503 HydrophobicContact CD2-CG 4.05Å; S448-M503 PolarHBondContact OG-O 3.12Å; R452-M503 PolarHBondContact NH1-O 2.98Å; T499-M503 WeakPolarHBondContact O-CG 3.42Å; T499-M503 PolarHBondContact O-N 3.46Å; S500-M503 PolarHBondContact O-N 2.79Å; I501-M503 VanDerWaalsContact C-N 3.34Å; I501-M503 PolarHBondContact O-N 3.1Å
504	E	92.3	Very high	92.3	Very high	3 Å²	3	17.2 Å²	17.2	1%	0.014	8%	0.081	C	C	.	.	H	α-helix	trans	-81.7	-26.3	176.3	-66.8	-57.5	135.1	0	0	113.2	G427 Y428 V429 R452 I501 G502 I506 T507 P509 L512	G427-E504 WeakPolarHBondContact CA-OE2 3.16Å; Y428-E504 PolarHBondContact N-OE2 3.04Å; V429-E504 HydrophobicContact CG2-CB 4.32Å; V429-E504 HydrophobicContact CG2-CG 3.97Å; R452-E504 IonicContact CZ-OE1 3.46Å; R452-E504 IonicContact CZ-OE2 3.62Å; R452-E504 IonicContact NH1-OE1 2.78Å; R452-E504 PolarHBondContact NH1-OE1 3.03Å; R452-E504 IonicContact NH1-OE2 3.71Å; R452-E504 PolarHBondContact NH1-OE2 3.34Å; R452-E504 IonicContact NH2-OE2 3.23Å; R452-E504 PolarHBondContact NH2-OE2 2.92Å; I501-E504 PolarHBondContact O-N 3.1Å; I501-E504 VanDerWaalsContact O-N 3.16Å; G502-E504 PolarHBondContact O-N 3.28Å; E504-I506 VanDerWaalsContact C-N 3.31Å; E504-I506 PolarHBondContact O-N 3.02Å; E504-T507 PolarHBondContact O-OG1 3.38Å; E504-P509 WeakPolarHBondContact O-CD 3.16Å; E504-P509 WeakPolarHBondContact O-CG 3.22Å; E504-L512 HydrophobicContact CB-CD1 4.12Å
505	L	92.3	Very high	92.5	Very high	1 Å²	1	17.2 Å²	17.2	1%	0.005	8%	0.081	C	C	.	.	H	α-helix	trans	-75.2	-18.2	178.6	-72.9	173.9	0	0	0	114	L473 I501 G502 T507 E508 L512 L536	L473-L505 HydrophobicContact CD1-CD1 4.49Å; L473-L505 HydrophobicContact CD2-CD1 3.9Å; L473-L505 HydrophobicContact CG-CD1 4.47Å; I501-L505 HydrophobicContact CG2-CD1 3.78Å; I501-L505 HydrophobicContact CG2-CG 4.14Å; I501-L505 WeakPolarHBondContact O-CG 3.28Å; I501-L505 PolarHBondContact O-N 2.66Å; G502-L505 PolarHBondContact O-N 3.46Å; G502-L505 VanDerWaalsContact O-N 3.12Å; L505-T507 PolarHBondContact O-N 3.25Å; L505-E508 WeakPolarHBondContact O-CA 3.44Å; L505-E508 PolarHBondContact O-N 2.85Å; L505-L512 HydrophobicContact CD2-CD2 4.16Å; L505-L536 HydrophobicContact CD1-CD1 3.71Å; L505-L536 HydrophobicContact CD1-CD2 3.64Å; L505-L536 HydrophobicContact CD1-CG 4.36Å; L505-L536 HydrophobicContact CD2-CD1 4.46Å; L505-L536 HydrophobicContact CD2-CD2 4.1Å
506	I	91.1	Very high	92.5	Very high	2 Å²	2	16.5 Å²	16.5	1%	0.01	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-37.4	179.3	-62.4	-56.2	0	0	0	112.4	L445 A449 M453 V466 I469 G502 E504 E508	L445-I506 HydrophobicContact CB-CD1 4.32Å; L445-I506 HydrophobicContact CD2-CD1 4.11Å; A449-I506 VanDerWaalsContact CA-CG2 3.46Å; A449-I506 HydrophobicContact CB-CG2 3.74Å; M453-I506 HydrophobicContact CG-CG2 3.74Å; M453-I506 HydrophobicContact SD-CG2 3.92Å; V466-I506 HydrophobicContact CG2-CD1 4.4Å; I469-I506 HydrophobicContact CD1-CD1 3.43Å; I469-I506 VanDerWaalsContact CD1-CD1 3.43Å; I469-I506 HydrophobicContact CD1-CG1 4.34Å; G502-I506 WeakPolarHBondContact O-CG1 3.26Å; G502-I506 PolarHBondContact O-N 3.39Å; E504-I506 VanDerWaalsContact C-N 3.31Å; E504-I506 PolarHBondContact O-N 3.02Å; I506-E508 PolarHBondContact O-N 2.88Å
507	T	85.4	Confident	92.5	Very high	38 Å²	38	11.6 Å²	11.6	23%	0.233	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	5.5	179.6	55.2	0	0	0	0	113.9	R452 E504 L505	R452-T507 HydrophobicContact CB-CG2 3.46Å; R452-T507 VanDerWaalsContact CB-CG2 3.46Å; R452-T507 HydrophobicContact CG-CG2 4.33Å; R452-T507 VanDerWaalsContact NE-CG2 3.31Å; R452-T507 PolarHBondContact NH2-OG1 2.9Å; E504-T507 PolarHBondContact O-OG1 3.38Å; L505-T507 PolarHBondContact O-N 3.25Å
508	E	86.8	Confident	92.4	Very high	78 Å²	78	12.2 Å²	12.2	36%	0.364	6%	0.064	S	C	.	.			trans	46.8	52.2	-174	-58	-165.5	119	0	0	113.7	K465 L505 I506	K465-E508 WeakPolarHBondContact CE-OE1 3.37Å; K465-E508 IonicContact NZ-OE1 2.84Å; K465-E508 PolarHBondContact NZ-OE1 2.74Å; K465-E508 IonicContact NZ-OE2 3.61Å; L505-E508 WeakPolarHBondContact O-CA 3.44Å; L505-E508 PolarHBondContact O-N 2.85Å; I506-E508 PolarHBondContact O-N 2.88Å
509	P	89	Confident	92.2	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.079	C	C	.	.			trans	-63.5	136.6	-173.5	27.9	-36.8	0	0	0	110.9	I425 G427 E504 V511 R541	I425-P509 WeakPolarHBondContact O-CA 3.47Å; I425-P509 VanDerWaalsContact O-CB 3.24Å; I425-P509 WeakPolarHBondContact O-CB 3.37Å; G427-P509 VanDerWaalsContact N-CB 3.3Å; E504-P509 WeakPolarHBondContact O-CD 3.16Å; E504-P509 WeakPolarHBondContact O-CG 3.22Å; P509-V511 PolarHBondContact O-N 3.1Å; P509-R541 PolarHBondContact O-NH1 3.34Å
510	P	86.6	Confident	91.8	Very high	36 Å²	36	18 Å²	18	23%	0.234	12%	0.119	C	C	.	.	S	Bend	trans	-69.1	-27.2	175.5	27.6	-33.9	0	0	0	111.8	A342 I425 T542	A342-P510 HydrophobicContact CB-CB 4.12Å; I425-P510 HydrophobicContact CG2-CG 4.34Å; P510-T542 PolarHBondContact O-N 3.4Å
511	V	92.1	Very high	91.7	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	126.3	176.2	-170.8	0	0	0	0	109.8	A342 L344 G427 P509 F513 T542 I544	A342-V511 HydrophobicContact CB-CG2 3.81Å; L344-V511 HydrophobicContact CD1-CG1 4.47Å; G427-V511 PolarHBondContact N-O 2.79Å; G427-V511 VanDerWaalsContact N-O 3.07Å; P509-V511 PolarHBondContact O-N 3.1Å; V511-F513 HydrophobicContact CB-CE2 4.27Å; V511-F513 HydrophobicContact CG1-CD2 4.2Å; V511-F513 HydrophobicContact CG1-CE1 4.07Å; V511-F513 HydrophobicContact CG1-CE2 3.6Å; V511-F513 HydrophobicContact CG1-CZ 3.53Å; V511-T542 CarbonylContact C-O 3.6Å; V511-T542 WeakPolarHBondContact CA-O 3.16Å; V511-T542 HydrophobicContact CG1-CG2 4.35Å; V511-I544 HydrophobicContact CG1-CD1 3.81Å
512	L	94.4	Very high	91.5	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	119.9	176.4	-179	67.2	0	0	0	109.9	V429 I501 E504 L505 L514 L533 T542 I543 I544	V429-L512 HydrophobicContact CG2-CD1 4.25Å; I501-L512 HydrophobicContact CG2-CD2 4.33Å; E504-L512 HydrophobicContact CB-CD1 4.12Å; L505-L512 HydrophobicContact CD2-CD2 4.16Å; L512-L514 HydrophobicContact CD2-CD1 3.97Å; L512-L514 HydrophobicContact CG-CD1 3.85Å; L512-L514 HydrophobicContact CG-CG 4.38Å; L512-L533 HydrophobicContact CD2-CD2 4.38Å; L512-T542 PolarHBondContact N-O 3.48Å; L512-I543 HydrophobicContact CB-CG1 4.46Å; L512-I543 WeakPolarHBondContact O-CA 3.3Å; L512-I544 PolarHBondContact O-N 2.95Å
513	F	95.2	Very high	91.2	Very high	0 Å²	0	26 Å²	26	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	136.3	175.7	-59.2	-84.4	0	0	0	110.4	L344 L395 L398 A399 F422 G427 Y428 V429 V511 I544	L344-F513 HydrophobicContact CD1-CE1 4.21Å; L344-F513 HydrophobicContact CD1-CZ 3.81Å; L395-F513 HydrophobicContact CD1-CB 4.23Å; L395-F513 HydrophobicContact CD1-CD1 3.77Å; L395-F513 HydrophobicContact CD1-CG 4.49Å; L395-F513 HydrophobicContact CG-CB 4.39Å; L395-F513 HydrophobicContact CG-CD1 4.39Å; L398-F513 HydrophobicContact CB-CE1 3.74Å; L398-F513 HydrophobicContact CB-CZ 4.28Å; A399-F513 HydrophobicContact CB-CD1 4.44Å; A399-F513 HydrophobicContact CB-CD2 3.89Å; A399-F513 HydrophobicContact CB-CE2 4.04Å; A399-F513 HydrophobicContact CB-CG 4.1Å; A399-F513 HydrophobicContact CB-CZ 4.38Å; F422-F513 AromaticContact CE1-CE2 3.8Å; F422-F513 HydrophobicContact CE1-CE2 3.8Å; F422-F513 HydrophobicContact CE1-CZ 4.12Å; F422-F513 AromaticContact CZ-CE2 3.85Å; F422-F513 HydrophobicContact CZ-CE2 3.85Å; F422-F513 HydrophobicContact CZ-CZ 4.12Å; G427-F513 WeakPolarHBondContact O-CD2 3.04Å; G427-F513 PolarHBondContact O-N 2.91Å; Y428-F513 CarbonylContact C-O 3.55Å; Y428-F513 WeakPolarHBondContact CA-O 3.35Å; Y428-F513 HydrophobicContact CD2-CB 3.54Å; Y428-F513 HydrophobicContact CD2-CG 4.24Å; Y428-F513 HydrophobicContact CE2-CB 4.22Å; Y428-F513 HydrophobicContact CG-CB 4.21Å; V429-F513 PolarHBondContact N-O 2.74Å; V511-F513 HydrophobicContact CB-CE2 4.27Å; V511-F513 HydrophobicContact CG1-CD2 4.2Å; V511-F513 HydrophobicContact CG1-CE1 4.07Å; V511-F513 HydrophobicContact CG1-CE2 3.6Å; V511-F513 HydrophobicContact CG1-CZ 3.53Å; F513-I544 CarbonylContact C-O 3.51Å; F513-I544 VanDerWaalsContact CA-O 3.25Å; F513-I544 WeakPolarHBondContact CA-O 3.42Å; F513-I544 HydrophobicContact CD1-CB 3.99Å; F513-I544 HydrophobicContact CD1-CD1 3.95Å; F513-I544 HydrophobicContact CD1-CG2 4.38Å; F513-I544 HydrophobicContact CE1-CB 4.36Å; F513-I544 HydrophobicContact CE1-CD1 3.45Å; F513-I544 VanDerWaalsContact CE1-CD1 3.45Å; F513-I544 HydrophobicContact CE1-CG1 4.47Å; F513-I544 HydrophobicContact CZ-CD1 4.16Å
514	L	95.6	Very high	91.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	121.7	173.9	-52.7	95.4	0	0	0	111.7	L395 V429 I501 L512 P517 L533 I543 I544 F545 S546	L395-L514 WeakPolarHBondContact CD2-O 3.47Å; V429-L514 HydrophobicContact CB-CB 4.26Å; V429-L514 HydrophobicContact CB-CD2 4.07Å; V429-L514 HydrophobicContact CB-CG 3.98Å; V429-L514 HydrophobicContact CG1-CD2 4.39Å; V429-L514 HydrophobicContact CG2-CD2 4.05Å; V429-L514 HydrophobicContact CG2-CG 4.11Å; I501-L514 HydrophobicContact CD1-CD2 3.89Å; I501-L514 HydrophobicContact CG1-CD2 3.76Å; L512-L514 HydrophobicContact CD2-CD1 3.97Å; L512-L514 HydrophobicContact CG-CD1 3.85Å; L512-L514 HydrophobicContact CG-CG 4.38Å; L514-P517 HydrophobicContact CB-CB 4.09Å; L514-P517 HydrophobicContact CB-CG 4.03Å; L514-P517 HydrophobicContact CD2-CB 3.98Å; L514-P517 HydrophobicContact CD2-CG 4.46Å; L514-L533 HydrophobicContact CD1-CD1 4.39Å; L514-L533 HydrophobicContact CD1-CD2 4.05Å; L514-L533 HydrophobicContact CD2-CD1 4.1Å; L514-L533 HydrophobicContact CD2-CD2 3.79Å; L514-I543 HydrophobicContact CD1-CG2 3.47Å; L514-I543 VanDerWaalsContact CD1-CG2 3.47Å; L514-I544 PolarHBondContact N-O 3.39Å; L514-F545 HydrophobicContact CB-CB 3.88Å; L514-F545 HydrophobicContact CD1-CB 4.19Å; L514-F545 CarbonylContact O-C 3.6Å; L514-F545 WeakPolarHBondContact O-CA 3.3Å; L514-F545 WeakPolarHBondContact O-CB 3.27Å; L514-S546 PolarHBondContact O-N 2.87Å
515	D	94.4	Very high	91.1	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.011	21%	0.205	C	C	.	.	S	Bend	trans	-86.9	111.5	175.3	-156.5	7	0	0	0	108.9	S392 L395 V429 Q431 S546 K966	S392-D515 WeakPolarHBondContact CB-OD1 3.46Å; S392-D515 PolarHBondContact OG-OD1 2.99Å; L395-D515 HydrophobicContact CD2-CB 3.86Å; V429-D515 PolarHBondContact O-N 2.82Å; Q431-D515 VanDerWaalsContact CA-O 3.32Å; Q431-D515 WeakPolarHBondContact CA-O 3.24Å; Q431-D515 HydrophobicContact CB-CB 4.43Å; D515-S546 WeakPolarHBondContact CA-OG 3.49Å; D515-S546 PolarHBondContact OD1-OG 3.07Å; D515-K966 IonicContact OD2-NZ 3.77Å; D515-K966 PolarHBondContact OD2-NZ 3.25Å
516	E	92.9	Very high	91.2	Very high	29 Å²	29	35.4 Å²	35.4	14%	0.136	21%	0.206	C	C	.	.	S	Bend	trans	45.4	61.3	177	-61.4	-169.2	177.2	0	0	115.1	Q431 T518 T519 S546	Q431-E516 HydrophobicContact CG-CB 4.32Å; Q431-E516 PolarHBondContact NE2-OE2 2.84Å; E516-T518 PolarHBondContact O-N 2.99Å; E516-T519 PolarHBondContact O-N 2.85Å; E516-T519 PolarHBondContact OE2-OG1 2.76Å; E516-S546 VanDerWaalsContact CA-O 3.29Å; E516-S546 WeakPolarHBondContact CA-O 2.86Å; E516-S546 PolarHBondContact N-O 3.46Å; E516-S546 PolarHBondContact N-OG 2.86Å
517	P	94.2	Very high	91.3	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.006	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-5.8	-171.6	29.4	-35.1	0	0	0	114.9	L514 L533 F545 S546	L514-P517 HydrophobicContact CB-CB 4.09Å; L514-P517 HydrophobicContact CB-CG 4.03Å; L514-P517 HydrophobicContact CD2-CB 3.98Å; L514-P517 HydrophobicContact CD2-CG 4.46Å; P517-L533 HydrophobicContact CG-CD1 4.37Å; P517-F545 HydrophobicContact CG-CB 4.12Å; P517-F545 HydrophobicContact CG-CD2 4.37Å; P517-F545 HydrophobicContact CG-CG 4.48Å; P517-S546 WeakPolarHBondContact CD-O 3.31Å
518	T	92.8	Very high	91.6	Very high	20 Å²	20	36.8 Å²	36.8	12%	0.123	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-6.1	-178.8	54	0	0	0	0	113.2	E516 L521 A526 V530 I547	E516-T518 PolarHBondContact O-N 2.99Å; T518-L521 PolarHBondContact O-N 2.67Å; T518-A526 HydrophobicContact CG2-CB 3.86Å; T518-V530 HydrophobicContact CG2-CG2 3.75Å; T518-I547 HydrophobicContact CG2-CD1 3.94Å; T518-I547 WeakPolarHBondContact OG1-CD1 3.47Å
519	T	89.7	Confident	91.9	Very high	73 Å²	73	33 Å²	33	45%	0.448	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	135.7	177.6	-77.9	0	0	0	0	110.6	E516 L521	E516-T519 PolarHBondContact O-N 2.85Å; E516-T519 PolarHBondContact OE2-OG1 2.76Å; T519-L521 VanDerWaalsContact C-N 3.26Å; T519-L521 PolarHBondContact O-N 2.87Å
520	G	86.5	Confident	92.2	Very high	82 Å²	82	33.1 Å²	33.1	85%	0.845	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.4	4.9	179.6	0	0	0	0	0	115.3
521	L	91	Very high	92.6	Very high	35 Å²	35	36.9 Å²	36.9	18%	0.183	21%	0.209	C	C	.	.	S	Bend	trans	-104.8	147.7	175.8	-59.2	-178.2	0	0	0	111	G493 K497 T518 T519 M525 A526 V529	G493-L521 VanDerWaalsContact C-CD2 3.43Å; K497-L521 HydrophobicContact CB-CD1 4.49Å; T518-L521 PolarHBondContact O-N 2.67Å; T519-L521 VanDerWaalsContact C-N 3.26Å; T519-L521 PolarHBondContact O-N 2.87Å; L521-M525 HydrophobicContact CB-CB 4.3Å; L521-A526 HydrophobicContact CB-CB 4.22Å; L521-V529 HydrophobicContact CD1-CG2 3.85Å
522	D	90.7	Very high	92.6	Very high	96 Å²	96	37.8 Å²	37.8	51%	0.513	21%	0.214	S	C	.	.			trans	-64.8	162.8	165.6	71.4	49.3	0	0	0	110.7	Y524 M525 A526	D522-Y524 PolarHBondContact O-N 3.43Å; D522-Y524 WeakPolarHBondContact OD1-CA 3.29Å; D522-Y524 WeakPolarHBondContact OD1-CB 3.45Å; D522-Y524 PolarHBondContact OD1-N 2.88Å; D522-M525 PolarHBondContact O-N 2.56Å; D522-M525 WeakPolarHBondContact OD1-CB 3.42Å; D522-M525 WeakPolarHBondContact OD1-CG 3.47Å; D522-M525 PolarHBondContact OD1-N 3.31Å; D522-M525 WeakPolarHBondContact OD2-CG 3.39Å; D522-A526 VanDerWaalsContact O-CB 3.27Å; D522-A526 WeakPolarHBondContact O-CB 3.29Å; D522-A526 PolarHBondContact O-N 3.03Å
523	A	89.2	Confident	92.6	Very high	40 Å²	40	37.8 Å²	37.8	33%	0.331	21%	0.214	S	C	.	.	H	α-helix	trans	-60.8	-31.2	-176.2	0	0	0	0	0	114.5	G527 K551	A523-G527 PolarHBondContact O-N 3.4Å; A523-K551 HydrophobicContact CB-CD 3.77Å
524	Y	91.3	Very high	92.6	Very high	161 Å²	161	39.3 Å²	39.3	63%	0.631	22%	0.221	S	C	*	.	H	α-helix	trans	-73.9	-50.6	-179.4	173.7	-94.8	0	0	0	110.2	D522 G527 Q528	D522-Y524 PolarHBondContact O-N 3.43Å; D522-Y524 WeakPolarHBondContact OD1-CA 3.29Å; D522-Y524 WeakPolarHBondContact OD1-CB 3.45Å; D522-Y524 PolarHBondContact OD1-N 2.88Å; Y524-G527 WeakPolarHBondContact O-CA 3.32Å; Y524-G527 PolarHBondContact O-N 3.06Å; Y524-G527 VanDerWaalsContact O-N 3.13Å; Y524-Q528 HydrophobicContact CD1-CG 4.46Å; Y524-Q528 HydrophobicContact CE1-CG 4.06Å; Y524-Q528 PolarHBondContact O-N 2.86Å; Y524-Q528 PolarHBondContact OH-NE2 2.94Å
525	M	92.4	Very high	92.4	Very high	45 Å²	45	41.7 Å²	41.7	22%	0.222	24%	0.24	C	C	.	.	H	α-helix	trans	-61.2	-43.5	176.8	-71.1	-61.6	-150	0	0	111.8	S492 L521 D522 G527 Q528 V529	S492-M525 WeakPolarHBondContact OG-CE 3.36Å; L521-M525 HydrophobicContact CB-CB 4.3Å; D522-M525 PolarHBondContact O-N 2.56Å; D522-M525 WeakPolarHBondContact OD1-CB 3.42Å; D522-M525 WeakPolarHBondContact OD1-CG 3.47Å; D522-M525 PolarHBondContact OD1-N 3.31Å; D522-M525 WeakPolarHBondContact OD2-CG 3.39Å; M525-G527 VanDerWaalsContact C-N 3.29Å; M525-G527 PolarHBondContact O-N 3.44Å; M525-Q528 PolarHBondContact O-N 2.93Å; M525-Q528 VanDerWaalsContact O-N 3.13Å; M525-V529 WeakPolarHBondContact O-CG2 3.22Å; M525-V529 PolarHBondContact O-N 3.46Å
526	A	93.4	Very high	92.3	Very high	5 Å²	5	41.6 Å²	41.6	4%	0.041	24%	0.24	C	C	.	.	H	α-helix	trans	-56.6	-44.6	172.7	0	0	0	0	0	111.4	T518 L521 D522 Q528 V529 V530 I554	T518-A526 HydrophobicContact CG2-CB 3.86Å; L521-A526 HydrophobicContact CB-CB 4.22Å; D522-A526 VanDerWaalsContact O-CB 3.27Å; D522-A526 WeakPolarHBondContact O-CB 3.29Å; D522-A526 PolarHBondContact O-N 3.03Å; A526-Q528 VanDerWaalsContact C-N 3.34Å; A526-Q528 PolarHBondContact O-N 3.25Å; A526-V529 PolarHBondContact O-N 3.14Å; A526-V530 VanDerWaalsContact O-CG2 3.31Å; A526-V530 WeakPolarHBondContact O-CG2 3.41Å; A526-V530 PolarHBondContact O-N 3.13Å; A526-I554 HydrophobicContact CB-CD1 4.07Å
527	G	92.8	Very high	92.3	Very high	11 Å²	11	40.5 Å²	40.5	11%	0.113	24%	0.236	C	C	.	.	H	α-helix	trans	-60.3	-39.6	175	0	0	0	0	0	113.3	A523 Y524 M525 K531	A523-G527 PolarHBondContact O-N 3.4Å; Y524-G527 WeakPolarHBondContact O-CA 3.32Å; Y524-G527 PolarHBondContact O-N 3.06Å; Y524-G527 VanDerWaalsContact O-N 3.13Å; M525-G527 VanDerWaalsContact C-N 3.29Å; M525-G527 PolarHBondContact O-N 3.44Å; G527-K531 WeakPolarHBondContact O-CB 3.49Å; G527-K531 VanDerWaalsContact O-CG 3.25Å; G527-K531 WeakPolarHBondContact O-CG 3.29Å; G527-K531 PolarHBondContact O-N 2.83Å
528	Q	92.4	Very high	92.2	Very high	58 Å²	58	48.4 Å²	48.4	27%	0.271	27%	0.271	S	S	.	.	H	α-helix	trans	-66.7	-45.1	176.4	-63.6	-58.6	-17.9	0	0	112.1	Y524 M525 A526 V530 K531 T532	Y524-Q528 HydrophobicContact CD1-CG 4.46Å; Y524-Q528 HydrophobicContact CE1-CG 4.06Å; Y524-Q528 PolarHBondContact O-N 2.86Å; Y524-Q528 PolarHBondContact OH-NE2 2.94Å; M525-Q528 PolarHBondContact O-N 2.93Å; M525-Q528 VanDerWaalsContact O-N 3.13Å; A526-Q528 VanDerWaalsContact C-N 3.34Å; A526-Q528 PolarHBondContact O-N 3.25Å; Q528-V530 VanDerWaalsContact C-N 3.33Å; Q528-V530 PolarHBondContact O-N 3.46Å; Q528-K531 WeakPolarHBondContact O-CB 3.39Å; Q528-K531 PolarHBondContact O-N 2.75Å; Q528-T532 PolarHBondContact O-N 3.1Å; Q528-T532 PolarHBondContact O-OG1 3.12Å; Q528-T532 VanDerWaalsContact O-OG1 3.13Å
529	V	93.8	Very high	91.9	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-57.8	-46.4	176.4	173.6	0	0	0	0	110.9	K497 R498 I501 L521 M525 A526 K531 T532 L533	K497-V529 HydrophobicContact CB-CG2 4.4Å; K497-V529 HydrophobicContact CG-CG1 4.27Å; K497-V529 HydrophobicContact CG-CG2 4.49Å; R498-V529 HydrophobicContact CG-CG2 4.28Å; I501-V529 HydrophobicContact CD1-CG1 3.95Å; L521-V529 HydrophobicContact CD1-CG2 3.85Å; M525-V529 WeakPolarHBondContact O-CG2 3.22Å; M525-V529 PolarHBondContact O-N 3.46Å; A526-V529 PolarHBondContact O-N 3.14Å; V529-K531 PolarHBondContact O-N 3.11Å; V529-T532 WeakPolarHBondContact O-CB 3.13Å; V529-T532 PolarHBondContact O-N 3.26Å; V529-L533 WeakPolarHBondContact O-CG 3.21Å; V529-L533 PolarHBondContact O-N 3.25Å
530	V	95	Very high	91.9	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.006	27%	0.269	C	S	.	.	H	α-helix	trans	-66.5	-37.1	179	178.2	0	0	0	0	111.7	M380 T518 A526 Q528 T532 L533 K534 I554 L557 F558	M380-V530 HydrophobicContact CE-CG1 3.77Å; T518-V530 HydrophobicContact CG2-CG2 3.75Å; A526-V530 VanDerWaalsContact O-CG2 3.31Å; A526-V530 WeakPolarHBondContact O-CG2 3.41Å; A526-V530 PolarHBondContact O-N 3.13Å; Q528-V530 VanDerWaalsContact C-N 3.33Å; Q528-V530 PolarHBondContact O-N 3.46Å; V530-T532 VanDerWaalsContact C-N 3.33Å; V530-T532 PolarHBondContact O-N 3.28Å; V530-L533 WeakPolarHBondContact O-CB 3.49Å; V530-L533 PolarHBondContact O-N 2.63Å; V530-K534 PolarHBondContact O-N 3.47Å; V530-I554 HydrophobicContact CB-CG1 4.5Å; V530-I554 HydrophobicContact CB-CG2 4.46Å; V530-I554 HydrophobicContact CG1-CG2 4.05Å; V530-I554 HydrophobicContact CG2-CD1 4.41Å; V530-I554 HydrophobicContact CG2-CG1 4.32Å; V530-I554 HydrophobicContact CG2-CG2 3.98Å; V530-L557 HydrophobicContact CB-CD1 4.42Å; V530-L557 HydrophobicContact CG1-CB 4.31Å; V530-L557 HydrophobicContact CG1-CD1 3.66Å; V530-F558 HydrophobicContact CG1-CE1 4.5Å
531	K	93.8	Very high	92.1	Very high	115 Å²	115	45.5 Å²	45.5	50%	0.5	23%	0.23	S	C	.	.	H	α-helix	trans	-61.5	-41.4	173	-76.7	172.2	-176.9	178.5	0	111.8	G527 Q528 V529 K534 A535 L557	G527-K531 WeakPolarHBondContact O-CB 3.49Å; G527-K531 VanDerWaalsContact O-CG 3.25Å; G527-K531 WeakPolarHBondContact O-CG 3.29Å; G527-K531 PolarHBondContact O-N 2.83Å; Q528-K531 WeakPolarHBondContact O-CB 3.39Å; Q528-K531 PolarHBondContact O-N 2.75Å; V529-K531 PolarHBondContact O-N 3.11Å; K531-K534 WeakPolarHBondContact O-CB 3.39Å; K531-K534 PolarHBondContact O-N 3.26Å; K531-A535 PolarHBondContact O-N 2.74Å; K531-L557 HydrophobicContact CG-CD1 4.13Å
532	T	92.9	Very high	92.3	Very high	19 Å²	19	43.9 Å²	43.9	12%	0.117	22%	0.221	C	C	.	.	H	α-helix	trans	-60.9	-44.5	173	-55.3	0	0	0	0	111	L473 Q528 V529 V530 K534 A535 L536	L473-T532 HydrophobicContact CD2-CG2 3.56Å; Q528-T532 PolarHBondContact O-N 3.1Å; Q528-T532 PolarHBondContact O-OG1 3.12Å; Q528-T532 VanDerWaalsContact O-OG1 3.13Å; V529-T532 WeakPolarHBondContact O-CB 3.13Å; V529-T532 PolarHBondContact O-N 3.26Å; V530-T532 VanDerWaalsContact C-N 3.33Å; V530-T532 PolarHBondContact O-N 3.28Å; T532-K534 VanDerWaalsContact C-N 3.31Å; T532-K534 PolarHBondContact O-N 3.39Å; T532-A535 WeakPolarHBondContact O-CB 3.25Å; T532-A535 PolarHBondContact O-N 3.37Å; T532-A535 VanDerWaalsContact O-N 3.17Å; T532-L536 HydrophobicContact CG2-CD1 4.29Å; T532-L536 WeakPolarHBondContact O-CG 3.44Å; T532-L536 PolarHBondContact O-N 3.18Å
533	L	94.9	Very high	92.5	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.8	-40	173.2	-64.9	175.8	0	0	0	112	M380 I501 L512 L514 P517 V529 V530 A535 L536 A537 I543	M380-L533 HydrophobicContact CE-CB 4.04Å; I501-L533 HydrophobicContact CD1-CD2 4.13Å; I501-L533 HydrophobicContact CG2-CD2 4.49Å; L512-L533 HydrophobicContact CD2-CD2 4.38Å; L514-L533 HydrophobicContact CD1-CD1 4.39Å; L514-L533 HydrophobicContact CD1-CD2 4.05Å; L514-L533 HydrophobicContact CD2-CD1 4.1Å; L514-L533 HydrophobicContact CD2-CD2 3.79Å; P517-L533 HydrophobicContact CG-CD1 4.37Å; V529-L533 WeakPolarHBondContact O-CG 3.21Å; V529-L533 PolarHBondContact O-N 3.25Å; V530-L533 WeakPolarHBondContact O-CB 3.49Å; V530-L533 PolarHBondContact O-N 2.63Å; L533-A535 VanDerWaalsContact C-N 3.34Å; L533-A535 PolarHBondContact O-N 3.36Å; L533-L536 HydrophobicContact CD2-CD1 4.26Å; L533-L536 WeakPolarHBondContact O-CB 3.41Å; L533-L536 PolarHBondContact O-N 3.38Å; L533-A537 WeakPolarHBondContact O-CB 3.41Å; L533-A537 PolarHBondContact O-N 3.2Å; L533-I543 HydrophobicContact CB-CD1 4.31Å; L533-I543 HydrophobicContact CD2-CD1 4.33Å; L533-I543 HydrophobicContact CD2-CG2 4.36Å; L533-I543 WeakPolarHBondContact O-CD1 3.42Å
534	K	94.6	Very high	92.9	Very high	32 Å²	32	37.4 Å²	37.4	14%	0.139	18%	0.181	C	C	.	.	H	α-helix	trans	-62.5	-42.3	175.3	-172.5	66.3	-179.9	-171.9	0	111.8	M380 V530 K531 T532 L536 A537 K538 L557 D559	M380-K534 HydrophobicContact CG-CD 3.9Å; M380-K534 WeakPolarHBondContact SD-CA 3.25Å; M380-K534 HydrophobicContact SD-CB 3.53Å; M380-K534 VanDerWaalsContact SD-CB 3.53Å; M380-K534 HydrophobicContact SD-CD 3.29Å; M380-K534 WeakPolarHBondContact SD-CD 3.49Å; M380-K534 HydrophobicContact SD-CG 4.02Å; V530-K534 PolarHBondContact O-N 3.47Å; K531-K534 WeakPolarHBondContact O-CB 3.39Å; K531-K534 PolarHBondContact O-N 3.26Å; T532-K534 VanDerWaalsContact C-N 3.31Å; T532-K534 PolarHBondContact O-N 3.39Å; K534-L536 VanDerWaalsContact C-N 3.31Å; K534-L536 PolarHBondContact O-N 3.22Å; K534-A537 PolarHBondContact O-N 2.89Å; K534-K538 WeakPolarHBondContact O-CG 3.38Å; K534-K538 PolarHBondContact O-N 3.08Å; K534-L557 WeakPolarHBondContact CD-O 3.48Å; K534-L557 PolarHBondContact NZ-O 3.22Å; K534-D559 IonicContact NZ-OD1 2.64Å; K534-D559 PolarHBondContact NZ-OD1 3.04Å; K534-D559 IonicContact NZ-OD2 2.84Å; K534-D559 PolarHBondContact NZ-OD2 3.07Å
535	A	92.5	Very high	93.1	Very high	50 Å²	50	29.7 Å²	29.7	41%	0.413	15%	0.151	S	C	.	.	H	α-helix	trans	-61.8	-40.8	176.6	0	0	0	0	0	111.5	K531 T532 L533 K538	K531-A535 PolarHBondContact O-N 2.74Å; T532-A535 WeakPolarHBondContact O-CB 3.25Å; T532-A535 PolarHBondContact O-N 3.37Å; T532-A535 VanDerWaalsContact O-N 3.17Å; L533-A535 VanDerWaalsContact C-N 3.34Å; L533-A535 PolarHBondContact O-N 3.36Å; A535-K538 PolarHBondContact O-N 3.39Å
536	L	91.7	Very high	93.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-64.6	-43.7	174.7	-70	164.2	0	0	0	112.4	E472 L473 I501 L505 T532 L533 K534 K538 R539 I543	E472-L536 HydrophobicContact CG-CD2 4Å; E472-L536 WeakPolarHBondContact OE1-CD2 3.47Å; L473-L536 HydrophobicContact CD2-CD1 4.32Å; I501-L536 HydrophobicContact CG2-CD1 4.26Å; L505-L536 HydrophobicContact CD1-CD1 3.71Å; L505-L536 HydrophobicContact CD1-CD2 3.64Å; L505-L536 HydrophobicContact CD1-CG 4.36Å; L505-L536 HydrophobicContact CD2-CD1 4.46Å; L505-L536 HydrophobicContact CD2-CD2 4.1Å; T532-L536 HydrophobicContact CG2-CD1 4.29Å; T532-L536 WeakPolarHBondContact O-CG 3.44Å; T532-L536 PolarHBondContact O-N 3.18Å; L533-L536 HydrophobicContact CD2-CD1 4.26Å; L533-L536 WeakPolarHBondContact O-CB 3.41Å; L533-L536 PolarHBondContact O-N 3.38Å; K534-L536 VanDerWaalsContact C-N 3.31Å; K534-L536 PolarHBondContact O-N 3.22Å; L536-K538 VanDerWaalsContact C-N 3.34Å; L536-K538 PolarHBondContact O-N 3.4Å; L536-R539 WeakPolarHBondContact O-CB 3.29Å; L536-R539 PolarHBondContact O-N 3.36Å; L536-I543 HydrophobicContact CB-CD1 3.75Å
537	A	93.1	Very high	93.3	Very high	7 Å²	7	27.3 Å²	27.3	6%	0.058	14%	0.138	C	C	.	.	H	α-helix	trans	-64.2	-37.7	177.9	0	0	0	0	0	112.1	M380 L533 K534 R539 G540 I543	M380-A537 HydrophobicContact CG-CB 3.69Å; L533-A537 WeakPolarHBondContact O-CB 3.41Å; L533-A537 PolarHBondContact O-N 3.2Å; K534-A537 PolarHBondContact O-N 2.89Å; A537-R539 PolarHBondContact O-N 3.05Å; A537-R539 VanDerWaalsContact O-N 3.15Å; A537-G540 PolarHBondContact O-N 2.99Å; A537-I543 HydrophobicContact CB-CD1 3.9Å; A537-I543 HydrophobicContact CB-CG1 4.24Å
538	K	91.8	Very high	93	Very high	167 Å²	167	29.7 Å²	29.7	73%	0.726	15%	0.146	S	C	*	.	H	α-helix	trans	-59.6	-23.7	175.8	-78.5	179.8	177.9	-174.6	0	113.4	K534 A535 L536 G540	K534-K538 WeakPolarHBondContact O-CG 3.38Å; K534-K538 PolarHBondContact O-N 3.08Å; A535-K538 PolarHBondContact O-N 3.39Å; L536-K538 VanDerWaalsContact C-N 3.34Å; L536-K538 PolarHBondContact O-N 3.4Å; K538-G540 PolarHBondContact O-N 2.96Å
539	R	87.6	Confident	92.7	Very high	90 Å²	90	31.4 Å²	31.4	34%	0.34	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	2	174.3	-62.2	-174.7	-179.7	-169.9	10.6	113.7	E472 L536 A537	E472-R539 VanDerWaalsContact OE1-CD 3.29Å; E472-R539 WeakPolarHBondContact OE1-CD 3.41Å; E472-R539 IonicContact OE1-CZ 3.67Å; E472-R539 IonicContact OE1-NE 3.9Å; E472-R539 PolarHBondContact OE1-NE 3.43Å; E472-R539 IonicContact OE1-NH1 3.94Å; E472-R539 PolarHBondContact OE1-NH1 3.32Å; E472-R539 IonicContact OE1-NH2 3.78Å; E472-R539 IonicContact OE2-CZ 2.64Å; E472-R539 IonicContact OE2-NH1 3.66Å; E472-R539 PolarHBondContact OE2-NH1 3.04Å; E472-R539 IonicContact OE2-NH2 2.84Å; L536-R539 WeakPolarHBondContact O-CB 3.29Å; L536-R539 PolarHBondContact O-N 3.36Å; A537-R539 PolarHBondContact O-N 3.05Å; A537-R539 VanDerWaalsContact O-N 3.15Å
540	G	87.8	Confident	92.6	Very high	20 Å²	20	31.6 Å²	31.6	21%	0.206	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	100.1	5	177.8	0	0	0	0	0	114.4	G341 A537 K538	G341-G540 WeakPolarHBondContact CA-O 3.45Å; G341-G540 PolarHBondContact N-O 2.97Å; G341-G540 VanDerWaalsContact N-O 3.07Å; A537-G540 PolarHBondContact O-N 2.99Å; K538-G540 PolarHBondContact O-N 2.96Å
541	R	91.7	Very high	92.5	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.015	18%	0.18	C	C	.	.			trans	-75.5	145.5	178.6	-64.1	175.6	-177.4	-107.3	11	111.6	I339 G379 P509 I543	I339-R541 HydrophobicContact CD1-CG 4.43Å; I339-R541 HydrophobicContact CG2-CG 4.41Å; G379-R541 PolarHBondContact N-O 3.48Å; G379-R541 VanDerWaalsContact N-O 3.14Å; P509-R541 PolarHBondContact O-NH1 3.34Å; R541-I543 HydrophobicContact CB-CG1 4.36Å
542	T	94.4	Very high	92.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	110	170.3	-57.5	0	0	0	0	108.9	A342 P378 P510 V511 L512 I544	A342-T542 PolarHBondContact N-OG1 3.2Å; A342-T542 WeakPolarHBondContact O-CB 3.33Å; A342-T542 PolarHBondContact O-OG1 3.48Å; P378-T542 VanDerWaalsContact CA-OG1 3.31Å; P378-T542 WeakPolarHBondContact CA-OG1 3.47Å; P510-T542 PolarHBondContact O-N 3.4Å; V511-T542 CarbonylContact C-O 3.6Å; V511-T542 WeakPolarHBondContact CA-O 3.16Å; V511-T542 HydrophobicContact CG1-CG2 4.35Å; L512-T542 PolarHBondContact N-O 3.48Å; T542-I544 HydrophobicContact CG2-CD1 4.28Å; T542-I544 HydrophobicContact CG2-CG1 4.2Å
543	I	95.9	Very high	92.4	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	126.1	179.7	-54.2	-173	0	0	0	108.6	G379 N381 L512 L514 L533 L536 A537 R541 F545	G379-I543 PolarHBondContact O-N 3.21Å; N381-I543 WeakPolarHBondContact CB-O 3.34Å; N381-I543 PolarHBondContact N-O 3.41Å; N381-I543 PolarHBondContact ND2-O 2.84Å; L512-I543 HydrophobicContact CB-CG1 4.46Å; L512-I543 WeakPolarHBondContact O-CA 3.3Å; L514-I543 HydrophobicContact CD1-CG2 3.47Å; L514-I543 VanDerWaalsContact CD1-CG2 3.47Å; L533-I543 HydrophobicContact CB-CD1 4.31Å; L533-I543 HydrophobicContact CD2-CD1 4.33Å; L533-I543 HydrophobicContact CD2-CG2 4.36Å; L533-I543 WeakPolarHBondContact O-CD1 3.42Å; L536-I543 HydrophobicContact CB-CD1 3.75Å; A537-I543 HydrophobicContact CB-CD1 3.9Å; A537-I543 HydrophobicContact CB-CG1 4.24Å; R541-I543 HydrophobicContact CB-CG1 4.36Å; I543-F545 HydrophobicContact CG2-CD1 4.1Å
544	I	96.4	Very high	92.4	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	122.6	-179.3	-53.8	163.5	0	0	0	107.2	L344 L376 N381 L383 L395 V511 L512 F513 L514 T542	L344-I544 HydrophobicContact CD1-CD1 4.16Å; L376-I544 HydrophobicContact CB-CD1 4.22Å; L376-I544 HydrophobicContact CB-CG1 4.39Å; L376-I544 HydrophobicContact CD1-CD1 3.42Å; L376-I544 VanDerWaalsContact CD1-CD1 3.42Å; L376-I544 HydrophobicContact CD1-CG1 3.78Å; L376-I544 HydrophobicContact CD1-CG2 3.92Å; L376-I544 HydrophobicContact CG-CD1 4.44Å; N381-I544 HydrophobicContact CB-CG1 4.34Å; N381-I544 WeakPolarHBondContact O-CA 3.41Å; L383-I544 HydrophobicContact CD1-CG2 4.26Å; L383-I544 HydrophobicContact CG-CG2 4.37Å; L395-I544 HydrophobicContact CD1-CB 4.33Å; L395-I544 HydrophobicContact CD1-CG2 3.68Å; V511-I544 HydrophobicContact CG1-CD1 3.81Å; L512-I544 PolarHBondContact O-N 2.95Å; F513-I544 CarbonylContact C-O 3.51Å; F513-I544 VanDerWaalsContact CA-O 3.25Å; F513-I544 WeakPolarHBondContact CA-O 3.42Å; F513-I544 HydrophobicContact CD1-CB 3.99Å; F513-I544 HydrophobicContact CD1-CD1 3.95Å; F513-I544 HydrophobicContact CD1-CG2 4.38Å; F513-I544 HydrophobicContact CE1-CB 4.36Å; F513-I544 HydrophobicContact CE1-CD1 3.45Å; F513-I544 VanDerWaalsContact CE1-CD1 3.45Å; F513-I544 HydrophobicContact CE1-CG1 4.47Å; F513-I544 HydrophobicContact CZ-CD1 4.16Å; L514-I544 PolarHBondContact N-O 3.39Å; T542-I544 HydrophobicContact CG2-CD1 4.28Å; T542-I544 HydrophobicContact CG2-CG1 4.2Å
545	F	96.7	Very high	92.4	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	146.9	-178.6	60.5	-83.6	0	0	0	112.5	M380 N381 A382 L383 L514 P517 I543 I547 F558	M380-F545 HydrophobicContact CB-CE1 4.22Å; M380-F545 HydrophobicContact CE-CE1 3.53Å; M380-F545 HydrophobicContact CE-CZ 3.7Å; N381-F545 WeakPolarHBondContact O-CD1 3.45Å; N381-F545 PolarHBondContact O-N 3.26Å; A382-F545 CarbonylContact C-O 3.57Å; A382-F545 WeakPolarHBondContact CA-O 3.39Å; A382-F545 HydrophobicContact CB-CE1 4.42Å; A382-F545 HydrophobicContact CB-CE2 3.77Å; A382-F545 HydrophobicContact CB-CZ 3.69Å; L383-F545 PolarHBondContact N-O 2.84Å; L514-F545 HydrophobicContact CB-CB 3.88Å; L514-F545 HydrophobicContact CD1-CB 4.19Å; L514-F545 CarbonylContact O-C 3.6Å; L514-F545 WeakPolarHBondContact O-CA 3.3Å; L514-F545 WeakPolarHBondContact O-CB 3.27Å; P517-F545 HydrophobicContact CG-CB 4.12Å; P517-F545 HydrophobicContact CG-CD2 4.37Å; P517-F545 HydrophobicContact CG-CG 4.48Å; I543-F545 HydrophobicContact CG2-CD1 4.1Å; F545-I547 HydrophobicContact CD2-CB 4.28Å; F545-I547 HydrophobicContact CE2-CB 4.3Å; F545-I547 HydrophobicContact CE2-CD1 4.47Å; F545-I547 HydrophobicContact CE2-CG2 4.27Å; F545-F558 HydrophobicContact CE2-CD1 4.26Å; F545-F558 AromaticContact CE2-CE1 3.63Å; F545-F558 HydrophobicContact CE2-CE1 3.63Å; F545-F558 AromaticContact CE2-CZ 3.93Å; F545-F558 HydrophobicContact CE2-CZ 3.93Å; F545-F558 AromaticContact CZ-CD1 3.59Å; F545-F558 HydrophobicContact CZ-CD1 3.59Å; F545-F558 AromaticContact CZ-CE1 3.4Å; F545-F558 HydrophobicContact CZ-CE1 3.4Å; F545-F558 VanDerWaalsContact CZ-CE1 3.4Å; F545-F558 HydrophobicContact CZ-CG 4.45Å; F545-F558 HydrophobicContact CZ-CZ 4.11Å
546	S	95.8	Very high	92.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	142	168.7	51.5	0	0	0	0	110.2	L383 L514 D515 E516 P517	L383-S546 CarbonylContact O-C 3.57Å; L383-S546 WeakPolarHBondContact O-CA 3.31Å; L514-S546 PolarHBondContact O-N 2.87Å; D515-S546 WeakPolarHBondContact CA-OG 3.49Å; D515-S546 PolarHBondContact OD1-OG 3.07Å; E516-S546 VanDerWaalsContact CA-O 3.29Å; E516-S546 WeakPolarHBondContact CA-O 2.86Å; E516-S546 PolarHBondContact N-O 3.46Å; E516-S546 PolarHBondContact N-OG 2.86Å; P517-S546 WeakPolarHBondContact CD-O 3.31Å
547	I	93.7	Very high	92.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.206	C	C	.	.			trans	-143.2	144.8	174.7	-166.2	152.4	0	0	0	111.1	A382 L383 T518 F545 P550 I554 F558	A382-I547 HydrophobicContact CB-CG2 4.45Å; L383-I547 PolarHBondContact O-N 2.97Å; T518-I547 HydrophobicContact CG2-CD1 3.94Å; T518-I547 WeakPolarHBondContact OG1-CD1 3.47Å; F545-I547 HydrophobicContact CD2-CB 4.28Å; F545-I547 HydrophobicContact CE2-CB 4.3Å; F545-I547 HydrophobicContact CE2-CD1 4.47Å; F545-I547 HydrophobicContact CE2-CG2 4.27Å; I547-P550 HydrophobicContact CD1-CB 3.74Å; I547-P550 HydrophobicContact CD1-CG 4.42Å; I547-P550 HydrophobicContact CG1-CB 4.05Å; I547-P550 HydrophobicContact CG1-CG 4.36Å; I547-P550 HydrophobicContact CG2-CG 4.2Å; I547-I554 HydrophobicContact CD1-CG2 3.86Å; I547-F558 HydrophobicContact CD1-CZ 4.21Å; I547-F558 HydrophobicContact CG2-CE2 4.27Å; I547-F558 HydrophobicContact CG2-CZ 4.09Å
548	H	86.1	Confident	92.7	Very high	61 Å²	61	43.4 Å²	43.4	28%	0.282	20%	0.204	S	C	.	.	S	Bend	trans	-113	126.6	175.4	-169.5	-86.4	0	0	0	108.8
549	Q	85.9	Confident	92.8	Very high	94 Å²	94	37.9 Å²	37.9	44%	0.439	18%	0.182	S	C	.	.	S	Bend	trans	40	65	174.6	-68.4	172.2	-20.3	0	0	115	M601	Q549-M601 HydrophobicContact CG-CG 4.4Å
550	P	92.7	Very high	93.2	Very high	4 Å²	4	34 Å²	34	3%	0.026	17%	0.168	C	C	.	.			trans	-72.6	145.2	178.5	28.3	-32.1	0	0	0	112.4	M384 I547 I554 F558 N595 P597	M384-P550 HydrophobicContact SD-CG 4.2Å; I547-P550 HydrophobicContact CD1-CB 3.74Å; I547-P550 HydrophobicContact CD1-CG 4.42Å; I547-P550 HydrophobicContact CG1-CB 4.05Å; I547-P550 HydrophobicContact CG1-CG 4.36Å; I547-P550 HydrophobicContact CG2-CG 4.2Å; P550-I554 HydrophobicContact CB-CB 4.15Å; P550-I554 HydrophobicContact CB-CG2 3.71Å; P550-F558 HydrophobicContact CB-CZ 4.3Å; P550-F558 HydrophobicContact CG-CE2 4.13Å; P550-F558 HydrophobicContact CG-CZ 4.25Å; P550-N595 PolarHBondContact O-ND2 2.98Å; P550-P597 HydrophobicContact CG-CB 3.79Å; P550-P597 HydrophobicContact CG-CG 3.89Å
551	K	91.8	Very high	93.6	Very high	120 Å²	120	33 Å²	33	52%	0.522	16%	0.158	S	C	.	.			trans	-58.8	152.3	166.1	-68.3	-162.9	174.2	-171	0	111.4	A523 S553 I554 Y555	A523-K551 HydrophobicContact CB-CD 3.77Å; K551-S553 PolarHBondContact O-N 3.17Å; K551-S553 VanDerWaalsContact O-N 3.12Å; K551-I554 WeakPolarHBondContact O-CA 3.48Å; K551-I554 WeakPolarHBondContact O-CB 3.15Å; K551-I554 PolarHBondContact O-N 2.98Å; K551-Y555 PolarHBondContact O-N 2.81Å
552	Y	92.3	Very high	93.8	Very high	117 Å²	117	32.9 Å²	32.9	46%	0.459	16%	0.158	S	C	.	.	H	α-helix	trans	-52.3	-38	177	-175.2	-136.1	0	0	0	113.8	I554 Y555 K556 N595 P596	Y552-I554 VanDerWaalsContact C-N 3.27Å; Y552-I554 PolarHBondContact O-N 3.49Å; Y552-Y555 HydrophobicContact CD2-CD1 4.14Å; Y552-Y555 HydrophobicContact CE2-CD1 4.3Å; Y552-Y555 PolarHBondContact O-N 2.85Å; Y552-K556 HydrophobicContact CD2-CG 4.35Å; Y552-K556 HydrophobicContact CE1-CD 4.32Å; Y552-K556 HydrophobicContact CE2-CD 4.48Å; Y552-K556 HydrophobicContact CE2-CG 4.02Å; Y552-K556 WeakPolarHBondContact O-CG 3.27Å; Y552-K556 PolarHBondContact O-N 2.93Å; Y552-K556 VanDerWaalsContact O-N 3.09Å; Y552-K556 WeakPolarHBondContact OH-CE 3.31Å; Y552-N595 WeakPolarHBondContact CA-OD1 3.43Å; Y552-N595 VanDerWaalsContact CB-OD1 3.26Å; Y552-N595 WeakPolarHBondContact CB-OD1 3.49Å; Y552-N595 PolarHBondContact N-OD1 3.46Å; Y552-N595 VanDerWaalsContact N-OD1 3.15Å; Y552-P596 HydrophobicContact CD2-CG 4.39Å; Y552-P596 HydrophobicContact CE2-CG 4.27Å
553	S	92.8	Very high	93.8	Very high	74 Å²	74	32.9 Å²	32.9	52%	0.517	16%	0.158	S	C	.	.	H	α-helix	trans	-61.4	-33.1	177.6	57.3	0	0	0	0	113.4	K551	K551-S553 PolarHBondContact O-N 3.17Å; K551-S553 VanDerWaalsContact O-N 3.12Å
554	I	94.4	Very high	93.7	Very high	7 Å²	7	32.9 Å²	32.9	4%	0.036	16%	0.158	C	C	.	.	H	α-helix	trans	-78.7	-45.4	175.7	-71.9	171.3	0	0	0	109.7	A526 V530 I547 P550 K551 Y552 K556 L557 F558	A526-I554 HydrophobicContact CB-CD1 4.07Å; V530-I554 HydrophobicContact CB-CG1 4.5Å; V530-I554 HydrophobicContact CB-CG2 4.46Å; V530-I554 HydrophobicContact CG1-CG2 4.05Å; V530-I554 HydrophobicContact CG2-CD1 4.41Å; V530-I554 HydrophobicContact CG2-CG1 4.32Å; V530-I554 HydrophobicContact CG2-CG2 3.98Å; I547-I554 HydrophobicContact CD1-CG2 3.86Å; P550-I554 HydrophobicContact CB-CB 4.15Å; P550-I554 HydrophobicContact CB-CG2 3.71Å; K551-I554 WeakPolarHBondContact O-CA 3.48Å; K551-I554 WeakPolarHBondContact O-CB 3.15Å; K551-I554 PolarHBondContact O-N 2.98Å; Y552-I554 VanDerWaalsContact C-N 3.27Å; Y552-I554 PolarHBondContact O-N 3.49Å; I554-K556 VanDerWaalsContact C-N 3.29Å; I554-K556 PolarHBondContact O-N 3.15Å; I554-L557 WeakPolarHBondContact O-CB 3.33Å; I554-L557 PolarHBondContact O-N 3.34Å; I554-F558 HydrophobicContact CG2-CE1 3.7Å; I554-F558 HydrophobicContact CG2-CZ 3.62Å; I554-F558 WeakPolarHBondContact O-CE1 3.45Å
555	Y	94.3	Very high	93.5	Very high	4 Å²	4	33.1 Å²	33.1	2%	0.016	16%	0.159	C	C	.	.	H	α-helix	trans	-55.7	-40.6	-179.7	173.9	-110	0	0	0	113.5	K551 Y552 L557 F558 L561 K576 P579 P596 P597 F600	K551-Y555 PolarHBondContact O-N 2.81Å; Y552-Y555 HydrophobicContact CD2-CD1 4.14Å; Y552-Y555 HydrophobicContact CE2-CD1 4.3Å; Y552-Y555 PolarHBondContact O-N 2.85Å; Y555-L557 PolarHBondContact O-N 3.39Å; Y555-F558 AromaticContact CD2-CD2 3.78Å; Y555-F558 HydrophobicContact CD2-CD2 3.78Å; Y555-F558 HydrophobicContact CD2-CE2 4Å; Y555-F558 HydrophobicContact CE2-CD2 4.4Å; Y555-F558 WeakPolarHBondContact O-CG 3.25Å; Y555-F558 PolarHBondContact O-N 3.2Å; Y555-L561 HydrophobicContact CE2-CD2 4.23Å; Y555-K576 PolarHBondContact OH-N 3.47Å; Y555-K576 PolarHBondContact OH-O 3.33Å; Y555-P579 WeakPolarHBondContact OH-CG 3.44Å; Y555-P596 HydrophobicContact CD1-CB 4.39Å; Y555-P596 HydrophobicContact CD1-CG 4.44Å; Y555-P596 HydrophobicContact CE1-CB 3.92Å; Y555-P596 HydrophobicContact CE1-CG 4.16Å; Y555-P597 HydrophobicContact CD1-CG 4.27Å; Y555-P597 HydrophobicContact CD2-CG 3.62Å; Y555-P597 HydrophobicContact CE2-CG 4.37Å; Y555-P597 HydrophobicContact CG-CG 3.55Å; Y555-F600 HydrophobicContact CE2-CE2 4.14Å
556	K	93.7	Very high	93.2	Very high	108 Å²	108	39.2 Å²	39.2	47%	0.47	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-21.9	177.5	-75.3	-177.9	-175.7	-179.5	0	114.5	Y552 I554	Y552-K556 HydrophobicContact CD2-CG 4.35Å; Y552-K556 HydrophobicContact CE1-CD 4.32Å; Y552-K556 HydrophobicContact CE2-CD 4.48Å; Y552-K556 HydrophobicContact CE2-CG 4.02Å; Y552-K556 WeakPolarHBondContact O-CG 3.27Å; Y552-K556 PolarHBondContact O-N 2.93Å; Y552-K556 VanDerWaalsContact O-N 3.09Å; Y552-K556 WeakPolarHBondContact OH-CE 3.31Å; I554-K556 VanDerWaalsContact C-N 3.29Å; I554-K556 PolarHBondContact O-N 3.15Å
557	L	94.6	Very high	92.9	Very high	42 Å²	42	39.2 Å²	39.2	22%	0.22	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-16.5	-175.8	-60	175.1	0	0	0	113	M380 V530 K531 K534 I554 Y555	M380-L557 HydrophobicContact SD-CB 4.35Å; V530-L557 HydrophobicContact CB-CD1 4.42Å; V530-L557 HydrophobicContact CG1-CB 4.31Å; V530-L557 HydrophobicContact CG1-CD1 3.66Å; K531-L557 HydrophobicContact CG-CD1 4.13Å; K534-L557 WeakPolarHBondContact CD-O 3.48Å; K534-L557 PolarHBondContact NZ-O 3.22Å; I554-L557 WeakPolarHBondContact O-CB 3.33Å; I554-L557 PolarHBondContact O-N 3.34Å; Y555-L557 PolarHBondContact O-N 3.39Å
558	F	95.4	Very high	92.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.192	C	C	.	.			trans	-69.8	143.1	-176.9	-54.7	-16.1	0	0	0	111.3	M380 A382 V530 F545 I547 P550 I554 Y555 A575	M380-F558 HydrophobicContact CE-CD1 4.43Å; A382-F558 HydrophobicContact CB-CD1 4.26Å; A382-F558 HydrophobicContact CB-CD2 3.62Å; A382-F558 HydrophobicContact CB-CE1 4.39Å; A382-F558 HydrophobicContact CB-CE2 3.76Å; A382-F558 HydrophobicContact CB-CG 3.88Å; A382-F558 HydrophobicContact CB-CZ 4.15Å; V530-F558 HydrophobicContact CG1-CE1 4.5Å; F545-F558 HydrophobicContact CE2-CD1 4.26Å; F545-F558 AromaticContact CE2-CE1 3.63Å; F545-F558 HydrophobicContact CE2-CE1 3.63Å; F545-F558 AromaticContact CE2-CZ 3.93Å; F545-F558 HydrophobicContact CE2-CZ 3.93Å; F545-F558 AromaticContact CZ-CD1 3.59Å; F545-F558 HydrophobicContact CZ-CD1 3.59Å; F545-F558 AromaticContact CZ-CE1 3.4Å; F545-F558 HydrophobicContact CZ-CE1 3.4Å; F545-F558 VanDerWaalsContact CZ-CE1 3.4Å; F545-F558 HydrophobicContact CZ-CG 4.45Å; F545-F558 HydrophobicContact CZ-CZ 4.11Å; I547-F558 HydrophobicContact CD1-CZ 4.21Å; I547-F558 HydrophobicContact CG2-CE2 4.27Å; I547-F558 HydrophobicContact CG2-CZ 4.09Å; P550-F558 HydrophobicContact CB-CZ 4.3Å; P550-F558 HydrophobicContact CG-CE2 4.13Å; P550-F558 HydrophobicContact CG-CZ 4.25Å; I554-F558 HydrophobicContact CG2-CE1 3.7Å; I554-F558 HydrophobicContact CG2-CZ 3.62Å; I554-F558 WeakPolarHBondContact O-CE1 3.45Å; Y555-F558 AromaticContact CD2-CD2 3.78Å; Y555-F558 HydrophobicContact CD2-CD2 3.78Å; Y555-F558 HydrophobicContact CD2-CE2 4Å; Y555-F558 HydrophobicContact CE2-CD2 4.4Å; Y555-F558 WeakPolarHBondContact O-CG 3.25Å; Y555-F558 PolarHBondContact O-N 3.2Å; F558-A575 HydrophobicContact CB-CB 3.67Å
559	D	95.2	Very high	93.2	Very high	50 Å²	50	39.1 Å²	39.1	27%	0.267	18%	0.181	S	C	.	.	S	Bend	trans	-97.3	-44	173.6	-61.4	-49.7	0	0	0	110.3	M380 K534 L574 A575	M380-D559 PolarHBondContact N-OD2 3.08Å; M380-D559 WeakPolarHBondContact O-CB 3.39Å; M380-D559 PolarHBondContact O-N 3.11Å; K534-D559 IonicContact NZ-OD1 2.64Å; K534-D559 PolarHBondContact NZ-OD1 3.04Å; K534-D559 IonicContact NZ-OD2 2.84Å; K534-D559 PolarHBondContact NZ-OD2 3.07Å; D559-L574 WeakPolarHBondContact O-CA 3.29Å; D559-A575 PolarHBondContact O-N 2.92Å
560	T	95.2	Very high	93.6	Very high	9 Å²	9	34.6 Å²	34.6	6%	0.055	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	139.9	177.5	-46	0	0	0	0	109.9	M380 N381 A382 G573	M380-T560 PolarHBondContact O-N 2.98Å; N381-T560 VanDerWaalsContact OD1-CB 3.27Å; N381-T560 WeakPolarHBondContact OD1-CB 3.32Å; N381-T560 PolarHBondContact OD1-OG1 3.45Å; A382-T560 PolarHBondContact N-O 3.24Å; T560-G573 CarbonylContact C-O 3.49Å; T560-G573 VanDerWaalsContact CA-O 3.27Å; T560-G573 WeakPolarHBondContact CA-O 3.46Å; T560-G573 WeakPolarHBondContact CG2-O 2.85Å
561	L	95.9	Very high	93.7	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	134	173.5	-178.6	69.7	0	0	0	109.8	A382 M384 Y555 L563 Y571 G573 A575 P579 F600	A382-L561 HydrophobicContact CB-CD1 4.2Å; M384-L561 HydrophobicContact CB-CD1 4.13Å; Y555-L561 HydrophobicContact CE2-CD2 4.23Å; L561-L563 HydrophobicContact CD1-CD2 4.43Å; L561-L563 HydrophobicContact CD2-CD2 4.22Å; L561-L563 HydrophobicContact CD2-CG 4.22Å; L561-L563 HydrophobicContact CG-CD2 4.34Å; L561-L563 HydrophobicContact CG-CG 4.37Å; L561-Y571 HydrophobicContact CB-CE1 4.42Å; L561-Y571 HydrophobicContact CD2-CD1 4.47Å; L561-G573 PolarHBondContact N-O 2.73Å; L561-G573 PolarHBondContact O-N 3.18Å; L561-A575 HydrophobicContact CB-CB 4.16Å; L561-P579 HydrophobicContact CD2-CB 4.22Å; L561-P579 HydrophobicContact CD2-CG 4.16Å; L561-F600 HydrophobicContact CD2-CD2 4.14Å; L561-F600 HydrophobicContact CD2-CE2 3.93Å
562	T	95.6	Very high	93.8	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	121.1	169.6	-48.9	0	0	0	0	109.5	A382 L383 M384 I564 I569 Y571 H572	A382-T562 PolarHBondContact O-N 3.03Å; L383-T562 WeakPolarHBondContact CA-O 3.46Å; L383-T562 HydrophobicContact CD2-CG2 4.18Å; M384-T562 PolarHBondContact N-O 3.28Å; T562-I564 HydrophobicContact CG2-CD1 4.42Å; T562-I564 HydrophobicContact CG2-CG1 4.08Å; T562-I569 HydrophobicContact CG2-CD1 4.27Å; T562-I569 HydrophobicContact CG2-CG1 4.26Å; T562-Y571 CarbonylContact C-O 3.56Å; T562-Y571 VanDerWaalsContact CA-O 3.28Å; T562-Y571 WeakPolarHBondContact CA-O 3.47Å; T562-H572 HydrophobicContact CG2-CB 4.3Å; T562-H572 PolarHBondContact OG1-ND1 3.07Å
563	L	95	Very high	93.9	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	129.5	174.6	-63.6	178.1	0	0	0	109.8	M384 L561 I569 I570 Y571 F583 F600	M384-L563 HydrophobicContact CB-CD2 3.84Å; M384-L563 HydrophobicContact CG-CD2 3.98Å; M384-L563 WeakPolarHBondContact O-CA 3.31Å; L561-L563 HydrophobicContact CD1-CD2 4.43Å; L561-L563 HydrophobicContact CD2-CD2 4.22Å; L561-L563 HydrophobicContact CD2-CG 4.22Å; L561-L563 HydrophobicContact CG-CD2 4.34Å; L561-L563 HydrophobicContact CG-CG 4.37Å; L563-I569 WeakPolarHBondContact O-CA 3.37Å; L563-I570 HydrophobicContact CB-CB 4.22Å; L563-I570 PolarHBondContact O-N 2.96Å; L563-Y571 PolarHBondContact N-O 3.15Å; L563-F583 HydrophobicContact CD1-CE2 3.62Å; L563-F583 HydrophobicContact CD1-CZ 3.71Å; L563-F600 HydrophobicContact CD1-CB 4.05Å; L563-F600 HydrophobicContact CD1-CD2 4.39Å; L563-F600 HydrophobicContact CD1-CG 4.17Å
564	I	93.7	Very high	94	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	132.6	-175.9	-55.4	171.2	0	0	0	110	M384 S389 L394 T562 Q568	M384-I564 PolarHBondContact O-N 3.22Å; S389-I564 WeakPolarHBondContact CB-O 3.31Å; S389-I564 VanDerWaalsContact O-CG2 3.31Å; S389-I564 WeakPolarHBondContact O-CG2 3.46Å; S389-I564 PolarHBondContact OG-O 3.23Å; L394-I564 HydrophobicContact CB-CD1 4.41Å; L394-I564 HydrophobicContact CD2-CD1 3.38Å; T562-I564 HydrophobicContact CG2-CD1 4.42Å; T562-I564 HydrophobicContact CG2-CG1 4.08Å; I564-Q568 CarbonylContact C-O 3.46Å; I564-Q568 VanDerWaalsContact CA-O 3.29Å; I564-Q568 WeakPolarHBondContact CA-O 3.44Å; I564-Q568 WeakPolarHBondContact CG2-O 3.37Å
565	Y	92.6	Very high	93.8	Very high	5 Å²	5	26.3 Å²	26.3	2%	0.02	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	130.8	173.9	-179.3	-108.9	0	0	0	110.5	P386 G567 Q568 I570 I604 M630 H631 I638	P386-Y565 HydrophobicContact CG-CD2 4.11Å; Y565-G567 PolarHBondContact O-N 2.87Å; Y565-Q568 PolarHBondContact N-O 3.13Å; Y565-Q568 PolarHBondContact O-N 3.33Å; Y565-I570 HydrophobicContact CG-CD1 4.13Å; Y565-I604 HydrophobicContact CD2-CG2 3.58Å; Y565-I604 HydrophobicContact CE2-CG2 4.03Å; Y565-I604 HydrophobicContact CG-CG2 4.24Å; Y565-M630 HydrophobicContact CE2-CE 4.27Å; Y565-M630 HydrophobicContact CE2-CG 4.04Å; Y565-M630 HydrophobicContact CE2-SD 4.28Å; Y565-M630 PolarHBondContact OH-O 2.86Å; Y565-H631 WeakPolarHBondContact OH-CA 3.23Å; Y565-I638 HydrophobicContact CD1-CD1 4.03Å
566	R	89.5	Confident	93.6	Very high	128 Å²	128	31.4 Å²	31.4	48%	0.483	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	42	36.7	-179.1	-67.8	-169.9	174.9	-158	0.6	115.4	H631	R566-H631 PolarHBondContact NH1-CD2 3.49Å; R566-H631 PolarHBondContact NH1-NE2 3.4Å
567	G	89.6	Confident	93.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.3	2.2	177.9	0	0	0	0	0	116	I368 D370 V372 S389 Y565	I368-G567 WeakPolarHBondContact O-CA 3.47Å; D370-G567 PolarHBondContact N-O 2.9Å; V372-G567 WeakPolarHBondContact CG2-O 3.18Å; S389-G567 PolarHBondContact O-N 3.42Å; Y565-G567 PolarHBondContact O-N 2.87Å
568	Q	93.4	Very high	93.3	Very high	46 Å²	46	34.3 Å²	34.3	22%	0.215	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	155.5	-179.8	-65.8	174.1	-49.6	0	0	110.5	D370 I564 Y565 I638	D370-Q568 HydrophobicContact CB-CG 3.87Å; D370-Q568 PolarHBondContact OD2-NE2 2.78Å; I564-Q568 CarbonylContact C-O 3.46Å; I564-Q568 VanDerWaalsContact CA-O 3.29Å; I564-Q568 WeakPolarHBondContact CA-O 3.44Å; I564-Q568 WeakPolarHBondContact CG2-O 3.37Å; Y565-Q568 PolarHBondContact N-O 3.13Å; Y565-Q568 PolarHBondContact O-N 3.33Å; Q568-I638 HydrophobicContact CB-CD1 4.01Å; Q568-I638 HydrophobicContact CB-CG1 4.09Å; Q568-I638 HydrophobicContact CB-CG2 4.27Å
569	I	94.2	Very high	93.1	Very high	13 Å²	13	34.3 Å²	34.3	7%	0.067	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	133.5	179.9	-67.5	175.7	0	0	0	110.1	F346 V372 S373 T562 L563 H572 W641	F346-I569 HydrophobicContact CE2-CD1 4.17Å; F346-I569 HydrophobicContact CZ-CD1 4.5Å; V372-I569 HydrophobicContact CG1-CD1 3.62Å; V372-I569 HydrophobicContact CG1-CG1 3.88Å; S373-I569 VanDerWaalsContact O-CD1 3.26Å; S373-I569 WeakPolarHBondContact O-CD1 3.48Å; T562-I569 HydrophobicContact CG2-CD1 4.27Å; T562-I569 HydrophobicContact CG2-CG1 4.26Å; L563-I569 WeakPolarHBondContact O-CA 3.37Å; I569-H572 HydrophobicContact CG2-CB 3.92Å; I569-W641 HydrophobicContact CG2-CD2 4.43Å; I569-W641 HydrophobicContact CG2-CZ2 4.3Å
570	I	93.5	Very high	93	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-32	169.9	-69.2	177.9	0	0	0	111.5	L563 Y565 Y582 F583 I604 L637 I638 W641	L563-I570 HydrophobicContact CB-CB 4.22Å; L563-I570 PolarHBondContact O-N 2.96Å; Y565-I570 HydrophobicContact CG-CD1 4.13Å; I570-Y582 WeakPolarHBondContact O-CE1 3.41Å; I570-Y582 PolarHBondContact O-OH 3Å; I570-F583 HydrophobicContact CG2-CE1 4.28Å; I570-F583 HydrophobicContact CG2-CZ 4Å; I570-I604 HydrophobicContact CD1-CD1 4.03Å; I570-I604 HydrophobicContact CD1-CG1 3.84Å; I570-L637 HydrophobicContact CD1-CB 4.13Å; I570-L637 HydrophobicContact CD1-CD1 4.19Å; I570-L637 HydrophobicContact CG1-CB 4.19Å; I570-L637 HydrophobicContact CG2-CB 3.99Å; I570-L637 HydrophobicContact CG2-CD1 4.44Å; I570-I638 HydrophobicContact CG1-CG1 4.22Å; I570-W641 WeakPolarHBondContact O-CB 3.3Å
571	Y	94.7	Very high	92.8	Very high	3 Å²	3	40.9 Å²	40.9	1%	0.012	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	137	179	177.4	-99.1	0	0	0	110	L561 T562 L563 L574 E578 P579 Y582 W641 M646	L561-Y571 HydrophobicContact CB-CE1 4.42Å; L561-Y571 HydrophobicContact CD2-CD1 4.47Å; T562-Y571 CarbonylContact C-O 3.56Å; T562-Y571 VanDerWaalsContact CA-O 3.28Å; T562-Y571 WeakPolarHBondContact CA-O 3.47Å; L563-Y571 PolarHBondContact N-O 3.15Å; Y571-L574 PolarHBondContact OH-O 3.25Å; Y571-E578 WeakPolarHBondContact OH-CB 3.42Å; Y571-P579 HydrophobicContact CD1-CB 4.12Å; Y571-P579 HydrophobicContact CE1-CB 3.73Å; Y571-P579 HydrophobicContact CE1-CG 4.33Å; Y571-P579 HydrophobicContact CE2-CB 4.45Å; Y571-Y582 AromaticContact CD2-CD1 3.48Å; Y571-Y582 HydrophobicContact CD2-CD1 3.48Å; Y571-Y582 VanDerWaalsContact CD2-CD1 3.48Å; Y571-Y582 AromaticContact CD2-CE1 3.97Å; Y571-Y582 HydrophobicContact CD2-CE1 3.97Å; Y571-Y582 AromaticContact CD2-CG 3.79Å; Y571-Y582 HydrophobicContact CD2-CG 3.79Å; Y571-Y582 HydrophobicContact CE2-CD1 4.17Å; Y571-Y582 HydrophobicContact CE2-CG 4.06Å; Y571-Y582 HydrophobicContact CG-CD1 4.25Å; Y571-W641 HydrophobicContact CD2-CE3 4.35Å; Y571-W641 AromaticContact CD2-CZ3 3.79Å; Y571-W641 HydrophobicContact CD2-CZ3 3.79Å; Y571-W641 HydrophobicContact CE2-CZ3 4.38Å; Y571-W641 HydrophobicContact CG-CZ3 4.46Å; Y571-M646 HydrophobicContact CE2-CE 4.42Å; Y571-M646 HydrophobicContact CE2-SD 4.38Å
572	H	95.1	Very high	92.7	Very high	7 Å²	7	41.2 Å²	41.2	3%	0.032	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	112.7	172.3	179.2	78.3	0	0	0	110.4	I375 T562 I569 W641	I375-H572 PolarHBondContact N-NE2 2.77Å; I375-H572 PolarHBondContact O-CE1 2.67Å; I375-H572 VanDerWaalsContact O-CE1 3.32Å; I375-H572 PolarHBondContact O-NE2 3.42Å; T562-H572 HydrophobicContact CG2-CB 4.3Å; T562-H572 PolarHBondContact OG1-ND1 3.07Å; I569-H572 HydrophobicContact CG2-CB 3.92Å; H572-W641 HydrophobicContact CB-CH2 4.13Å; H572-W641 HydrophobicContact CB-CZ2 3.77Å; H572-W641 VanDerWaalsContact O-CH2 3.25Å; H572-W641 WeakPolarHBondContact O-CH2 3.26Å
573	G	93.8	Very high	92.5	Very high	20 Å²	20	41.2 Å²	41.2	21%	0.206	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.8	-165.3	-175.9	0	0	0	0	0	113.9	T560 L561	T560-G573 CarbonylContact C-O 3.49Å; T560-G573 VanDerWaalsContact CA-O 3.27Å; T560-G573 WeakPolarHBondContact CA-O 3.46Å; T560-G573 WeakPolarHBondContact CG2-O 2.85Å; L561-G573 PolarHBondContact N-O 2.73Å; L561-G573 PolarHBondContact O-N 3.18Å
574	L	94.5	Very high	92.3	Very high	113 Å²	113	43.2 Å²	43.2	59%	0.592	21%	0.207	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-62.3	141.1	176	-67.2	172.7	0	0	0	110.4	D559 Y571 E578 P579	D559-L574 WeakPolarHBondContact O-CA 3.29Å; Y571-L574 PolarHBondContact OH-O 3.25Å; L574-E578 HydrophobicContact CB-CG 4.29Å; L574-P579 WeakPolarHBondContact O-CD 3.44Å
575	A	91.1	Very high	92.1	Very high	5 Å²	5	51.6 Å²	51.6	4%	0.041	24%	0.239	C	C	.	.	S	Bend	trans	-76.4	-171.8	174	0	0	0	0	0	111.8	F558 D559 L561	F558-A575 HydrophobicContact CB-CB 3.67Å; D559-A575 PolarHBondContact O-N 2.92Å; L561-A575 HydrophobicContact CB-CB 4.16Å
576	K	88.9	Confident	91.9	Very high	111 Å²	111	52.7 Å²	52.7	48%	0.483	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	81	-108.3	176.7	-48.8	166.7	-176	169.9	0	113.2	Y555	Y555-K576 PolarHBondContact OH-N 3.47Å; Y555-K576 PolarHBondContact OH-O 3.33Å
577	K	90.4	Very high	91.8	Very high	153 Å²	153	47 Å²	47	67%	0.665	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-26.5	-172.7	-65.7	-173.3	178	-174.4	0	113.1	I580 R581	K577-I580 PolarHBondContact O-N 3.02Å; K577-R581 WeakPolarHBondContact O-CG 3.36Å; K577-R581 PolarHBondContact O-N 2.98Å
578	E	92.1	Very high	91.7	Very high	57 Å²	57	47.1 Å²	47.1	27%	0.266	23%	0.226	S	C	.	.	H	α-helix	trans	-61.5	-43.5	-176.7	-66	-54.6	124.3	0	0	114.8	Y571 L574 I580 R581 Y582	Y571-E578 WeakPolarHBondContact OH-CB 3.42Å; L574-E578 HydrophobicContact CB-CG 4.29Å; E578-I580 VanDerWaalsContact C-N 3.33Å; E578-I580 PolarHBondContact O-N 3.13Å; E578-R581 WeakPolarHBondContact O-CB 3.32Å; E578-R581 PolarHBondContact O-N 3.13Å; E578-R581 IonicContact OE1-CZ 3.1Å; E578-R581 IonicContact OE1-NH1 3.92Å; E578-R581 PolarHBondContact OE1-NH1 3.32Å; E578-Y582 PolarHBondContact O-N 3.08Å
579	P	92.1	Very high	91.4	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.8	-36.5	175.9	23.7	-34.1	0	0	0	112.1	Y555 L561 Y571 L574 R581 Y582 F583 F600	Y555-P579 WeakPolarHBondContact OH-CG 3.44Å; L561-P579 HydrophobicContact CD2-CB 4.22Å; L561-P579 HydrophobicContact CD2-CG 4.16Å; Y571-P579 HydrophobicContact CD1-CB 4.12Å; Y571-P579 HydrophobicContact CE1-CB 3.73Å; Y571-P579 HydrophobicContact CE1-CG 4.33Å; Y571-P579 HydrophobicContact CE2-CB 4.45Å; L574-P579 WeakPolarHBondContact O-CD 3.44Å; P579-R581 VanDerWaalsContact C-N 3.3Å; P579-R581 PolarHBondContact O-N 3.4Å; P579-Y582 WeakPolarHBondContact O-CB 3.45Å; P579-Y582 PolarHBondContact O-N 3.48Å; P579-F583 WeakPolarHBondContact O-CD2 3.37Å; P579-F583 PolarHBondContact O-N 2.96Å; P579-F600 HydrophobicContact CB-CE1 4.03Å; P579-F600 HydrophobicContact CB-CE2 4.03Å; P579-F600 HydrophobicContact CB-CZ 3.55Å; P579-F600 HydrophobicContact CG-CE2 4.02Å; P579-F600 HydrophobicContact CG-CZ 3.66Å
580	I	92.2	Very high	91.1	Very high	56 Å²	56	49.3 Å²	49.3	29%	0.287	24%	0.244	S	C	.	.	H	α-helix	trans	-62.1	-41.4	175.1	-55.1	173.4	0	0	0	110.1	K577 E578 G584 C590 P596 F600	K577-I580 PolarHBondContact O-N 3.02Å; E578-I580 VanDerWaalsContact C-N 3.33Å; E578-I580 PolarHBondContact O-N 3.13Å; I580-G584 PolarHBondContact O-N 3.26Å; I580-C590 HydrophobicContact CG2-CB 4.16Å; I580-P596 HydrophobicContact CD1-CB 3.93Å; I580-P596 HydrophobicContact CD1-CG 3.83Å; I580-P596 HydrophobicContact CG1-CB 4.18Å; I580-F600 HydrophobicContact CG1-CE1 4.2Å; I580-F600 HydrophobicContact CG1-CZ 3.91Å
581	R	92.1	Very high	90.7	Very high	142 Å²	142	56.2 Å²	56.2	54%	0.536	28%	0.277	S	S	.	.	H	α-helix	trans	-65	-39.6	174.8	-72.5	172.1	168.2	-176	-10.7	112.4	K577 E578 P579 G584 R585	K577-R581 WeakPolarHBondContact O-CG 3.36Å; K577-R581 PolarHBondContact O-N 2.98Å; E578-R581 WeakPolarHBondContact O-CB 3.32Å; E578-R581 PolarHBondContact O-N 3.13Å; E578-R581 IonicContact OE1-CZ 3.1Å; E578-R581 IonicContact OE1-NH1 3.92Å; E578-R581 PolarHBondContact OE1-NH1 3.32Å; P579-R581 VanDerWaalsContact C-N 3.3Å; P579-R581 PolarHBondContact O-N 3.4Å; R581-G584 PolarHBondContact O-N 3.2Å; R581-R585 WeakPolarHBondContact O-CG 3.43Å; R581-R585 PolarHBondContact O-N 2.97Å
582	Y	92.9	Very high	89.9	Confident	7 Å²	7	63.1 Å²	63.1	3%	0.027	31%	0.313	C	S	.	.	H	α-helix	trans	-60.3	-54.9	176.1	172.4	-115.9	0	0	0	111.4	I570 Y571 E578 P579 G584 R585 L586 W641 M646	I570-Y582 WeakPolarHBondContact O-CE1 3.41Å; I570-Y582 PolarHBondContact O-OH 3Å; Y571-Y582 AromaticContact CD2-CD1 3.48Å; Y571-Y582 HydrophobicContact CD2-CD1 3.48Å; Y571-Y582 VanDerWaalsContact CD2-CD1 3.48Å; Y571-Y582 AromaticContact CD2-CE1 3.97Å; Y571-Y582 HydrophobicContact CD2-CE1 3.97Å; Y571-Y582 AromaticContact CD2-CG 3.79Å; Y571-Y582 HydrophobicContact CD2-CG 3.79Å; Y571-Y582 HydrophobicContact CE2-CD1 4.17Å; Y571-Y582 HydrophobicContact CE2-CG 4.06Å; Y571-Y582 HydrophobicContact CG-CD1 4.25Å; E578-Y582 PolarHBondContact O-N 3.08Å; P579-Y582 WeakPolarHBondContact O-CB 3.45Å; P579-Y582 PolarHBondContact O-N 3.48Å; Y582-G584 VanDerWaalsContact C-N 3.26Å; Y582-G584 PolarHBondContact O-N 3.4Å; Y582-R585 WeakPolarHBondContact O-CB 3.43Å; Y582-R585 PolarHBondContact O-N 3.13Å; Y582-R585 VanDerWaalsContact O-N 3.11Å; Y582-L586 HydrophobicContact CD1-CD1 4.34Å; Y582-L586 HydrophobicContact CE1-CD1 3.77Å; Y582-L586 HydrophobicContact CE2-CD1 4.07Å; Y582-L586 HydrophobicContact CE2-CG 4.38Å; Y582-L586 PolarHBondContact O-N 3.23Å; Y582-W641 HydrophobicContact CE1-CE3 4.4Å; Y582-W641 HydrophobicContact CE2-CE3 4.22Å; Y582-W641 AromaticContact CZ-CE3 3.87Å; Y582-W641 VanDerWaalsContact OH-CA 3.24Å; Y582-W641 WeakPolarHBondContact OH-CA 3.4Å; Y582-W641 PolarHBondContact OH-N 2.79Å; Y582-M646 HydrophobicContact CD2-CE 3.15Å; Y582-M646 HydrophobicContact CE2-CE 3.91Å; Y582-M646 HydrophobicContact CG-CE 3.76Å
583	F	91.9	Very high	89.4	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-63.6	-32.6	177.2	-74.1	-71.4	0	0	0	112.3	L563 I570 P579 L586 G587 Y588 F599 F600 V603 L637	L563-F583 HydrophobicContact CD1-CE2 3.62Å; L563-F583 HydrophobicContact CD1-CZ 3.71Å; I570-F583 HydrophobicContact CG2-CE1 4.28Å; I570-F583 HydrophobicContact CG2-CZ 4Å; P579-F583 WeakPolarHBondContact O-CD2 3.37Å; P579-F583 PolarHBondContact O-N 2.96Å; F583-L586 HydrophobicContact CD1-CD1 4.35Å; F583-L586 CarbonylContact O-C 3.57Å; F583-L586 WeakPolarHBondContact O-CB 3.48Å; F583-L586 PolarHBondContact O-N 2.97Å; F583-L586 VanDerWaalsContact O-N 3.14Å; F583-G587 PolarHBondContact O-N 2.94Å; F583-Y588 CarbonylContact C-O 3.55Å; F583-Y588 HydrophobicContact CD1-CD2 4.18Å; F583-Y588 PolarHBondContact O-N 3.36Å; F583-F599 HydrophobicContact CB-CE1 3.97Å; F583-F599 HydrophobicContact CB-CZ 4.26Å; F583-F599 HydrophobicContact CG-CE1 4.39Å; F583-F600 AromaticContact CD2-CD1 3.44Å; F583-F600 HydrophobicContact CD2-CD1 3.44Å; F583-F600 VanDerWaalsContact CD2-CD1 3.44Å; F583-F600 AromaticContact CD2-CE1 3.59Å; F583-F600 HydrophobicContact CD2-CE1 3.59Å; F583-F600 HydrophobicContact CD2-CG 4.47Å; F583-F600 HydrophobicContact CE2-CB 4.48Å; F583-F600 AromaticContact CE2-CD1 3.46Å; F583-F600 HydrophobicContact CE2-CD1 3.46Å; F583-F600 VanDerWaalsContact CE2-CD1 3.46Å; F583-F600 AromaticContact CE2-CE1 3.95Å; F583-F600 HydrophobicContact CE2-CE1 3.95Å; F583-F600 HydrophobicContact CE2-CG 4.08Å; F583-F600 HydrophobicContact CG-CD1 4.41Å; F583-F600 HydrophobicContact CZ-CD1 4.43Å; F583-V603 HydrophobicContact CD1-CG1 4.01Å; F583-V603 HydrophobicContact CE1-CG1 3.93Å; F583-L637 HydrophobicContact CD1-CD2 4.47Å; F583-L637 HydrophobicContact CE1-CD2 4.02Å
584	G	90.4	Very high	89.1	Confident	41 Å²	41	74.1 Å²	74.1	42%	0.423	36%	0.361	S	S	.	.	H	α-helix	trans	-61.3	-40.6	171.6	0	0	0	0	0	113.7	I580 R581 Y582 L586 G587 Y588	I580-G584 PolarHBondContact O-N 3.26Å; R581-G584 PolarHBondContact O-N 3.2Å; Y582-G584 VanDerWaalsContact C-N 3.26Å; Y582-G584 PolarHBondContact O-N 3.4Å; G584-L586 VanDerWaalsContact C-N 3.25Å; G584-L586 PolarHBondContact O-N 3.18Å; G584-G587 PolarHBondContact O-N 2.97Å; G584-G587 VanDerWaalsContact O-N 3.15Å; G584-Y588 WeakPolarHBondContact CA-O 3.46Å; G584-Y588 PolarHBondContact N-O 2.92Å
585	R	89.5	Confident	89	Confident	176 Å²	176	69.9 Å²	69.9	66%	0.664	34%	0.339	S	S	*	.	H	α-helix	trans	-66.7	-28.7	173.6	-70.2	177.1	-166.2	177.1	4	112.5	R581 Y582 G587	R581-R585 WeakPolarHBondContact O-CG 3.43Å; R581-R585 PolarHBondContact O-N 2.97Å; Y582-R585 WeakPolarHBondContact O-CB 3.43Å; Y582-R585 PolarHBondContact O-N 3.13Å; Y582-R585 VanDerWaalsContact O-N 3.11Å; R585-G587 PolarHBondContact O-N 3.05Å
586	L	88.1	Confident	89	Confident	29 Å²	29	70.1 Å²	70.1	15%	0.152	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-2	175.1	-67.1	-177	0	0	0	113.3	Y582 F583 G584 Y588 R610 L637 D640	Y582-L586 HydrophobicContact CD1-CD1 4.34Å; Y582-L586 HydrophobicContact CE1-CD1 3.77Å; Y582-L586 HydrophobicContact CE2-CD1 4.07Å; Y582-L586 HydrophobicContact CE2-CG 4.38Å; Y582-L586 PolarHBondContact O-N 3.23Å; F583-L586 HydrophobicContact CD1-CD1 4.35Å; F583-L586 CarbonylContact O-C 3.57Å; F583-L586 WeakPolarHBondContact O-CB 3.48Å; F583-L586 PolarHBondContact O-N 2.97Å; F583-L586 VanDerWaalsContact O-N 3.14Å; G584-L586 VanDerWaalsContact C-N 3.25Å; G584-L586 PolarHBondContact O-N 3.18Å; L586-Y588 HydrophobicContact CB-CD2 3.9Å; L586-Y588 HydrophobicContact CB-CE2 4.16Å; L586-R610 PolarHBondContact O-NE 3.17Å; L586-R610 PolarHBondContact O-NH2 3.1Å; L586-L637 HydrophobicContact CD1-CD2 4.05Å; L586-D640 HydrophobicContact CD1-CB 4.22Å; L586-D640 HydrophobicContact CD2-CB 3.81Å
587	G	87.2	Confident	89.2	Confident	7 Å²	7	64.9 Å²	64.9	7%	0.072	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.6	7.2	178.5	0	0	0	0	0	115.1	F583 G584 R585 Q611	F583-G587 PolarHBondContact O-N 2.94Å; G584-G587 PolarHBondContact O-N 2.97Å; G584-G587 VanDerWaalsContact O-N 3.15Å; R585-G587 PolarHBondContact O-N 3.05Å; G587-Q611 PolarHBondContact O-N 3.4Å
588	Y	88.2	Confident	89.3	Confident	3 Å²	3	59.8 Å²	59.8	1%	0.012	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-94.9	121.1	175.5	-60.1	-81.1	0	0	0	110.8	F583 G584 L586 V603 C608 R610 L637	F583-Y588 CarbonylContact C-O 3.55Å; F583-Y588 HydrophobicContact CD1-CD2 4.18Å; F583-Y588 PolarHBondContact O-N 3.36Å; G584-Y588 WeakPolarHBondContact CA-O 3.46Å; G584-Y588 PolarHBondContact N-O 2.92Å; L586-Y588 HydrophobicContact CB-CD2 3.9Å; L586-Y588 HydrophobicContact CB-CE2 4.16Å; Y588-V603 HydrophobicContact CD1-CG1 4.04Å; Y588-V603 HydrophobicContact CD1-CG2 3.95Å; Y588-V603 HydrophobicContact CD2-CG1 4.14Å; Y588-V603 HydrophobicContact CE1-CG1 3.91Å; Y588-V603 HydrophobicContact CE2-CG1 4.03Å; Y588-V603 HydrophobicContact CG-CG1 4.14Å; Y588-V603 HydrophobicContact CG-CG2 4.12Å; Y588-C608 HydrophobicContact CD1-CB 4.34Å; Y588-C608 WeakPolarHBondContact CE1-O 3.46Å; Y588-R610 HydrophobicContact CD1-CG 4.05Å; Y588-R610 HydrophobicContact CD2-CG 4.29Å; Y588-R610 HydrophobicContact CE1-CB 4.46Å; Y588-R610 HydrophobicContact CE1-CG 3.42Å; Y588-R610 VanDerWaalsContact CE1-CG 3.42Å; Y588-R610 HydrophobicContact CE2-CG 3.7Å; Y588-R610 HydrophobicContact CG-CG 4.45Å; Y588-R610 WeakPolarHBondContact OH-CG 3.33Å; Y588-L637 HydrophobicContact CE2-CD2 3.88Å
589	V	86.7	Confident	89.3	Confident	82 Å²	82	57.2 Å²	57.2	50%	0.497	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-97.9	120.7	179.5	-177.6	0	0	0	0	109.3	F599	V589-F599 WeakPolarHBondContact O-CE2 3.45Å
590	C	87	Confident	89.3	Confident	24 Å²	24	57.2 Å²	57.2	16%	0.162	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-80.7	121.9	170	-177.6	0	0	0	0	108.9	I580 F599	I580-C590 HydrophobicContact CG2-CB 4.16Å; C590-F599 HydrophobicContact CB-CD1 3.9Å; C590-F599 HydrophobicContact CB-CD2 4.06Å; C590-F599 HydrophobicContact CB-CE1 3.89Å; C590-F599 HydrophobicContact CB-CE2 4.03Å; C590-F599 HydrophobicContact CB-CG 3.98Å; C590-F599 HydrophobicContact CB-CZ 3.94Å
591	E	85.9	Confident	89.3	Confident	145 Å²	145	54.6 Å²	54.6	68%	0.678	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-61	142	175	-65.5	179.6	177.1	0	0	111.3	H593 N594	E591-H593 PolarHBondContact O-N 3.48Å; E591-N594 HydrophobicContact CB-CB 4.29Å; E591-N594 PolarHBondContact O-N 3.34Å; E591-N594 VanDerWaalsContact O-N 3.16Å
592	N	77.3	Confident	89.2	Confident	147 Å²	147	49.5 Å²	49.5	79%	0.786	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	126.1	168.6	-62.8	-34.4	0	0	0	106.6
593	H	84.2	Confident	89	Confident	202 Å²	202	49.2 Å²	49.2	94%	0.935	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.5	-13.3	-173.4	-45.3	-64	0	0	0	117	E591	E591-H593 PolarHBondContact O-N 3.48Å
594	N	88.4	Confident	88.9	Confident	56 Å²	56	49.2 Å²	49.2	30%	0.299	25%	0.254	S	S	.	.	S	Bend	trans	-75.5	146.9	170.8	-160.6	3.6	0	0	0	110.9	E591 P596	E591-N594 HydrophobicContact CB-CB 4.29Å; E591-N594 PolarHBondContact O-N 3.34Å; E591-N594 VanDerWaalsContact O-N 3.16Å; N594-P596 WeakPolarHBondContact O-CD 2.85Å
595	N	91.4	Very high	88.7	Confident	25 Å²	25	49.4 Å²	49.4	13%	0.134	24%	0.244	C	C	.	.			trans	-76.3	118.8	176.7	-176.3	28.8	0	0	0	108.6	P550 Y552 P597 D598 F599	P550-N595 PolarHBondContact O-ND2 2.98Å; Y552-N595 WeakPolarHBondContact CA-OD1 3.43Å; Y552-N595 VanDerWaalsContact CB-OD1 3.26Å; Y552-N595 WeakPolarHBondContact CB-OD1 3.49Å; Y552-N595 PolarHBondContact N-OD1 3.46Å; Y552-N595 VanDerWaalsContact N-OD1 3.15Å; N595-P597 VanDerWaalsContact C-CD 3.43Å; N595-P597 WeakPolarHBondContact OD1-CD 3.42Å; N595-D598 HydrophobicContact CB-CB 4.2Å; N595-D598 VanDerWaalsContact CB-OD2 3.28Å; N595-D598 WeakPolarHBondContact CB-OD2 3.4Å; N595-D598 PolarHBondContact ND2-OD2 3.31Å; N595-D598 PolarHBondContact O-N 2.82Å; N595-F599 PolarHBondContact O-N 3.27Å
596	P	92.4	Very high	88.3	Confident	10 Å²	10	41.1 Å²	41.1	7%	0.065	21%	0.213	C	C	.	.	H	α-helix	trans	-54.5	-40.6	-174.4	-25.4	32.7	0	0	0	115.8	Y552 Y555 I580 N594 D598 F599 F600	Y552-P596 HydrophobicContact CD2-CG 4.39Å; Y552-P596 HydrophobicContact CE2-CG 4.27Å; Y555-P596 HydrophobicContact CD1-CB 4.39Å; Y555-P596 HydrophobicContact CD1-CG 4.44Å; Y555-P596 HydrophobicContact CE1-CB 3.92Å; Y555-P596 HydrophobicContact CE1-CG 4.16Å; I580-P596 HydrophobicContact CD1-CB 3.93Å; I580-P596 HydrophobicContact CD1-CG 3.83Å; I580-P596 HydrophobicContact CG1-CB 4.18Å; N594-P596 WeakPolarHBondContact O-CD 2.85Å; P596-D598 VanDerWaalsContact C-N 3.32Å; P596-D598 PolarHBondContact O-N 3.08Å; P596-F599 WeakPolarHBondContact O-CB 3.49Å; P596-F599 PolarHBondContact O-N 3.45Å; P596-F600 HydrophobicContact CB-CE2 4.15Å; P596-F600 HydrophobicContact CB-CZ 3.98Å; P596-F600 WeakPolarHBondContact O-CD1 3.02Å; P596-F600 WeakPolarHBondContact O-CD2 3.36Å; P596-F600 WeakPolarHBondContact O-CE2 3.46Å; P596-F600 WeakPolarHBondContact O-CG 3.31Å; P596-F600 PolarHBondContact O-N 3.44Å
597	P	92.3	Very high	88	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.1	-39.7	171.9	-22.1	33.2	0	0	0	113.9	M384 P550 Y555 N595 F600 M601	M384-P597 HydrophobicContact CE-CB 3.61Å; M384-P597 WeakPolarHBondContact CE-O 3.43Å; M384-P597 HydrophobicContact SD-CB 3.95Å; P550-P597 HydrophobicContact CG-CB 3.79Å; P550-P597 HydrophobicContact CG-CG 3.89Å; Y555-P597 HydrophobicContact CD1-CG 4.27Å; Y555-P597 HydrophobicContact CD2-CG 3.62Å; Y555-P597 HydrophobicContact CE2-CG 4.37Å; Y555-P597 HydrophobicContact CG-CG 3.55Å; N595-P597 VanDerWaalsContact C-CD 3.43Å; N595-P597 WeakPolarHBondContact OD1-CD 3.42Å; P597-F600 PolarHBondContact O-N 3.13Å; P597-M601 WeakPolarHBondContact O-CG 3.24Å; P597-M601 PolarHBondContact O-N 3.27Å
598	D	92.8	Very high	87.6	Confident	47 Å²	47	47.2 Å²	47.2	25%	0.251	24%	0.243	S	C	.	.	H	α-helix	trans	-70.6	-45.8	179.7	-60.7	-25.9	0	0	0	108.9	N595 P596 F600 M601 D602	N595-D598 HydrophobicContact CB-CB 4.2Å; N595-D598 VanDerWaalsContact CB-OD2 3.28Å; N595-D598 WeakPolarHBondContact CB-OD2 3.4Å; N595-D598 PolarHBondContact ND2-OD2 3.31Å; N595-D598 PolarHBondContact O-N 2.82Å; P596-D598 VanDerWaalsContact C-N 3.32Å; P596-D598 PolarHBondContact O-N 3.08Å; D598-F600 VanDerWaalsContact C-N 3.31Å; D598-F600 PolarHBondContact O-N 3.07Å; D598-M601 CarbonylContact O-C 3.58Å; D598-M601 WeakPolarHBondContact O-CA 3.35Å; D598-M601 WeakPolarHBondContact O-CB 3.42Å; D598-M601 PolarHBondContact O-N 3.42Å; D598-D602 PolarHBondContact O-N 2.85Å
599	F	92.6	Very high	86.9	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.009	26%	0.262	C	S	.	.	H	α-helix	trans	-50.9	-45.2	170.5	166.4	-103.3	0	0	0	113.4	F583 V589 C590 N595 P596 M601 D602 V603	F583-F599 HydrophobicContact CB-CE1 3.97Å; F583-F599 HydrophobicContact CB-CZ 4.26Å; F583-F599 HydrophobicContact CG-CE1 4.39Å; V589-F599 WeakPolarHBondContact O-CE2 3.45Å; C590-F599 HydrophobicContact CB-CD1 3.9Å; C590-F599 HydrophobicContact CB-CD2 4.06Å; C590-F599 HydrophobicContact CB-CE1 3.89Å; C590-F599 HydrophobicContact CB-CE2 4.03Å; C590-F599 HydrophobicContact CB-CG 3.98Å; C590-F599 HydrophobicContact CB-CZ 3.94Å; N595-F599 PolarHBondContact O-N 3.27Å; P596-F599 WeakPolarHBondContact O-CB 3.49Å; P596-F599 PolarHBondContact O-N 3.45Å; F599-M601 VanDerWaalsContact C-N 3.26Å; F599-M601 PolarHBondContact O-N 2.93Å; F599-D602 PolarHBondContact O-N 3.16Å; F599-V603 HydrophobicContact CD2-CG2 4.07Å; F599-V603 HydrophobicContact CE1-CG2 4.25Å; F599-V603 HydrophobicContact CE2-CG2 3.65Å; F599-V603 HydrophobicContact CZ-CG2 3.76Å; F599-V603 WeakPolarHBondContact O-CB 3.45Å; F599-V603 VanDerWaalsContact O-CG2 3.25Å; F599-V603 WeakPolarHBondContact O-CG2 3.37Å; F599-V603 PolarHBondContact O-N 3.4Å
600	F	92.6	Very high	86.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.3	-33.3	177.1	-55.8	-35.8	0	0	0	112.5	Y555 L561 L563 P579 I580 F583 P596 P597 D598 I604	Y555-F600 HydrophobicContact CE2-CE2 4.14Å; L561-F600 HydrophobicContact CD2-CD2 4.14Å; L561-F600 HydrophobicContact CD2-CE2 3.93Å; L563-F600 HydrophobicContact CD1-CB 4.05Å; L563-F600 HydrophobicContact CD1-CD2 4.39Å; L563-F600 HydrophobicContact CD1-CG 4.17Å; P579-F600 HydrophobicContact CB-CE1 4.03Å; P579-F600 HydrophobicContact CB-CE2 4.03Å; P579-F600 HydrophobicContact CB-CZ 3.55Å; P579-F600 HydrophobicContact CG-CE2 4.02Å; P579-F600 HydrophobicContact CG-CZ 3.66Å; I580-F600 HydrophobicContact CG1-CE1 4.2Å; I580-F600 HydrophobicContact CG1-CZ 3.91Å; F583-F600 AromaticContact CD2-CD1 3.44Å; F583-F600 HydrophobicContact CD2-CD1 3.44Å; F583-F600 VanDerWaalsContact CD2-CD1 3.44Å; F583-F600 AromaticContact CD2-CE1 3.59Å; F583-F600 HydrophobicContact CD2-CE1 3.59Å; F583-F600 HydrophobicContact CD2-CG 4.47Å; F583-F600 HydrophobicContact CE2-CB 4.48Å; F583-F600 AromaticContact CE2-CD1 3.46Å; F583-F600 HydrophobicContact CE2-CD1 3.46Å; F583-F600 VanDerWaalsContact CE2-CD1 3.46Å; F583-F600 AromaticContact CE2-CE1 3.95Å; F583-F600 HydrophobicContact CE2-CE1 3.95Å; F583-F600 HydrophobicContact CE2-CG 4.08Å; F583-F600 HydrophobicContact CG-CD1 4.41Å; F583-F600 HydrophobicContact CZ-CD1 4.43Å; P596-F600 HydrophobicContact CB-CE2 4.15Å; P596-F600 HydrophobicContact CB-CZ 3.98Å; P596-F600 WeakPolarHBondContact O-CD1 3.02Å; P596-F600 WeakPolarHBondContact O-CD2 3.36Å; P596-F600 WeakPolarHBondContact O-CE2 3.46Å; P596-F600 WeakPolarHBondContact O-CG 3.31Å; P596-F600 PolarHBondContact O-N 3.44Å; P597-F600 PolarHBondContact O-N 3.13Å; D598-F600 VanDerWaalsContact C-N 3.31Å; D598-F600 PolarHBondContact O-N 3.07Å; F600-I604 WeakPolarHBondContact O-CD1 3.29Å; F600-I604 WeakPolarHBondContact O-CG1 3.05Å; F600-I604 PolarHBondContact O-N 3.19Å
601	M	90.8	Very high	85.4	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-74.1	-41.2	176.5	-62.8	-66.9	-64.4	0	0	111.1	M384 P386 Q549 P597 D598 F599 V603 I604 H605	M384-M601 HydrophobicContact CE-CG 3.37Å; M384-M601 HydrophobicContact CE-SD 3.68Å; M384-M601 HydrophobicContact CG-SD 4.31Å; P386-M601 HydrophobicContact CB-CE 4.3Å; P386-M601 HydrophobicContact CG-CE 4.04Å; Q549-M601 HydrophobicContact CG-CG 4.4Å; P597-M601 WeakPolarHBondContact O-CG 3.24Å; P597-M601 PolarHBondContact O-N 3.27Å; D598-M601 CarbonylContact O-C 3.58Å; D598-M601 WeakPolarHBondContact O-CA 3.35Å; D598-M601 WeakPolarHBondContact O-CB 3.42Å; D598-M601 PolarHBondContact O-N 3.42Å; F599-M601 VanDerWaalsContact C-N 3.26Å; F599-M601 PolarHBondContact O-N 2.93Å; M601-V603 VanDerWaalsContact C-N 3.3Å; M601-V603 PolarHBondContact O-N 3.04Å; M601-I604 CarbonylContact O-C 3.51Å; M601-I604 PolarHBondContact O-N 3.47Å; M601-I604 VanDerWaalsContact O-N 3.08Å; M601-H605 WeakPolarHBondContact O-CB 3.33Å; M601-H605 VanDerWaalsContact O-CG 3.25Å; M601-H605 PolarHBondContact O-N 2.89Å; M601-H605 PolarHBondContact O-ND1 3.39Å; M601-H605 VanDerWaalsContact O-ND1 3.14Å
602	D	90.2	Very high	84	Confident	36 Å²	36	53.6 Å²	53.6	19%	0.193	27%	0.27	C	S	.	.	H	α-helix	trans	-63	-39	178.5	-56.6	-16.9	0	0	0	110.9	D598 F599 H605 G606 E607	D598-D602 PolarHBondContact O-N 2.85Å; F599-D602 PolarHBondContact O-N 3.16Å; D602-H605 PolarHBondContact O-N 3.31Å; D602-G606 PolarHBondContact O-N 3.47Å; D602-E607 HydrophobicContact CB-CB 4.31Å; D602-E607 PolarHBondContact O-N 3.49Å
603	V	90.1	Very high	82.9	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61.4	-46.1	170.4	171.2	0	0	0	0	111.1	F583 Y588 F599 M601 H605 G606 C608 V633 L637	F583-V603 HydrophobicContact CD1-CG1 4.01Å; F583-V603 HydrophobicContact CE1-CG1 3.93Å; Y588-V603 HydrophobicContact CD1-CG1 4.04Å; Y588-V603 HydrophobicContact CD1-CG2 3.95Å; Y588-V603 HydrophobicContact CD2-CG1 4.14Å; Y588-V603 HydrophobicContact CE1-CG1 3.91Å; Y588-V603 HydrophobicContact CE2-CG1 4.03Å; Y588-V603 HydrophobicContact CG-CG1 4.14Å; Y588-V603 HydrophobicContact CG-CG2 4.12Å; F599-V603 HydrophobicContact CD2-CG2 4.07Å; F599-V603 HydrophobicContact CE1-CG2 4.25Å; F599-V603 HydrophobicContact CE2-CG2 3.65Å; F599-V603 HydrophobicContact CZ-CG2 3.76Å; F599-V603 WeakPolarHBondContact O-CB 3.45Å; F599-V603 VanDerWaalsContact O-CG2 3.25Å; F599-V603 WeakPolarHBondContact O-CG2 3.37Å; F599-V603 PolarHBondContact O-N 3.4Å; M601-V603 VanDerWaalsContact C-N 3.3Å; M601-V603 PolarHBondContact O-N 3.04Å; V603-H605 VanDerWaalsContact C-N 3.31Å; V603-H605 PolarHBondContact O-N 3.48Å; V603-G606 PolarHBondContact O-N 3.02Å; V603-G606 VanDerWaalsContact O-N 3.12Å; V603-C608 HydrophobicContact CG2-CB 3.87Å; V603-V633 VanDerWaalsContact O-CG1 3.31Å; V603-V633 WeakPolarHBondContact O-CG1 3.13Å; V603-L637 HydrophobicContact CG1-CD1 3.98Å; V603-L637 HydrophobicContact CG1-CD2 4.42Å
604	I	88.6	Confident	81.3	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-66.6	-33.5	178.5	-66.5	165	0	0	0	111.6	P386 Y565 I570 F600 M601 G606 M630 L637	P386-I604 HydrophobicContact CG-CB 4.46Å; P386-I604 HydrophobicContact CG-CG2 3.51Å; Y565-I604 HydrophobicContact CD2-CG2 3.58Å; Y565-I604 HydrophobicContact CE2-CG2 4.03Å; Y565-I604 HydrophobicContact CG-CG2 4.24Å; I570-I604 HydrophobicContact CD1-CD1 4.03Å; I570-I604 HydrophobicContact CD1-CG1 3.84Å; F600-I604 WeakPolarHBondContact O-CD1 3.29Å; F600-I604 WeakPolarHBondContact O-CG1 3.05Å; F600-I604 PolarHBondContact O-N 3.19Å; M601-I604 CarbonylContact O-C 3.51Å; M601-I604 PolarHBondContact O-N 3.47Å; M601-I604 VanDerWaalsContact O-N 3.08Å; I604-G606 PolarHBondContact O-N 3.48Å; I604-M630 WeakPolarHBondContact O-CG 3.47Å; I604-L637 HydrophobicContact CG1-CD1 4.27Å
605	H	86.4	Confident	79.6	Confident	46 Å²	46	49.8 Å²	49.8	21%	0.213	27%	0.27	C	S	.	.	H	α-helix	trans	-75	-11.4	175.1	-64.3	142.6	0	0	0	113.2	M601 D602 V603 E607	M601-H605 WeakPolarHBondContact O-CB 3.33Å; M601-H605 VanDerWaalsContact O-CG 3.25Å; M601-H605 PolarHBondContact O-N 2.89Å; M601-H605 PolarHBondContact O-ND1 3.39Å; M601-H605 VanDerWaalsContact O-ND1 3.14Å; D602-H605 PolarHBondContact O-N 3.31Å; V603-H605 VanDerWaalsContact C-N 3.31Å; V603-H605 PolarHBondContact O-N 3.48Å; H605-E607 HydrophobicContact CB-CG 4.23Å
606	G	81.9	Confident	77.7	Confident	2 Å²	2	52.7 Å²	52.7	2%	0.021	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	21.9	-179.3	0	0	0	0	0	113.9	D602 V603 I604 R629	D602-G606 PolarHBondContact O-N 3.47Å; V603-G606 PolarHBondContact O-N 3.02Å; V603-G606 VanDerWaalsContact O-N 3.12Å; I604-G606 PolarHBondContact O-N 3.48Å; G606-R629 PolarHBondContact O-NH2 3.46Å
607	E	80.9	Confident	75.8	Confident	127 Å²	127	52.9 Å²	52.9	59%	0.593	29%	0.291	S	S	*	.			trans	-79.8	-35.5	175.8	-64.9	-175.6	-175.3	0	0	111.4	D602 H605	D602-E607 HydrophobicContact CB-CB 4.31Å; D602-E607 PolarHBondContact O-N 3.49Å; H605-E607 HydrophobicContact CB-CG 4.23Å
608	C	79.3	Confident	73.8	Confident	37 Å²	37	57.4 Å²	57.4	25%	0.25	32%	0.319	C	S	.	.	S	Bend	trans	-88.3	124.5	171.8	-58.1	0	0	0	0	110.3	Y588 V603	Y588-C608 HydrophobicContact CD1-CB 4.34Å; Y588-C608 WeakPolarHBondContact CE1-O 3.46Å; V603-C608 HydrophobicContact CG2-CB 3.87Å
609	L	72.2	Confident	71.8	Confident	77 Å²	77	63.3 Å²	63.3	40%	0.403	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-89.9	148.5	174.7	-60.2	175.6	0	0	0	110.9	Q611 D617 V621	L609-Q611 PolarHBondContact O-N 2.81Å; L609-D617 HydrophobicContact CD2-CB 4.25Å; L609-V621 HydrophobicContact CD1-CG2 4.14Å; L609-V621 HydrophobicContact CD2-CG2 4.43Å
610	R	75.7	Confident	70.1	Confident	40 Å²	40	63.7 Å²	63.7	15%	0.151	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-67.4	120.3	174.3	-64.8	176.7	115.6	153.7	3.7	109.6	L586 Y588 D617 D640	L586-R610 PolarHBondContact O-NE 3.17Å; L586-R610 PolarHBondContact O-NH2 3.1Å; Y588-R610 HydrophobicContact CD1-CG 4.05Å; Y588-R610 HydrophobicContact CD2-CG 4.29Å; Y588-R610 HydrophobicContact CE1-CB 4.46Å; Y588-R610 HydrophobicContact CE1-CG 3.42Å; Y588-R610 VanDerWaalsContact CE1-CG 3.42Å; Y588-R610 HydrophobicContact CE2-CG 3.7Å; Y588-R610 HydrophobicContact CG-CG 4.45Å; Y588-R610 WeakPolarHBondContact OH-CG 3.33Å; R610-D617 WeakPolarHBondContact CB-OD2 3.46Å; R610-D617 WeakPolarHBondContact CG-OD2 3.32Å; R610-D617 PolarHBondContact N-OD2 3.42Å; R610-D640 IonicContact CZ-OD2 3.67Å; R610-D640 VanDerWaalsContact CZ-OD2 3.32Å; R610-D640 IonicContact NH1-OD2 2.68Å; R610-D640 PolarHBondContact NH1-OD2 2.93Å; R610-D640 VanDerWaalsContact NH1-OD2 3.1Å; R610-D640 IonicContact NH2-OD2 3.32Å; R610-D640 PolarHBondContact NH2-OD2 2.95Å
611	Q	68	Low	68.3	Low	136 Å²	136	67.3 Å²	67.3	64%	0.636	37%	0.369	S	S	*	.	S	Bend	trans	-82.9	-27.9	-178	-67.1	-177.2	1.1	0	0	112.6	G587 L609	G587-Q611 PolarHBondContact O-N 3.4Å; L609-Q611 PolarHBondContact O-N 2.81Å
612	N	56.7	Low	66.5	Low	135 Å²	135	73.8 Å²	73.8	72%	0.722	40%	0.404	S	S	*	.	S	Bend	trans	-138.1	101.2	-177.7	-78.6	-30.1	0	0	0	110.6
613	G	54.1	Low	64.9	Low	45 Å²	45	75 Å²	75	46%	0.464	41%	0.408	S	S	.	.			trans	-163.4	150.2	173.8	0	0	0	0	0	111.5	T615	G613-T615 PolarHBondContact O-N 2.76Å
614	N	50.8	Low	63.3	Low	179 Å²	179	84.4 Å²	84.4	96%	0.957	45%	0.452	S	S	*	.	S	Bend	trans	-63.2	-7.8	-178.2	-75.5	-7.5	0	0	0	114.2
615	T	52	Low	62.4	Low	100 Å²	100	88.5 Å²	88.5	61%	0.613	47%	0.473	S	S	*	.	S	Bend	trans	-125.9	98.1	167.6	49.4	0	0	0	0	106.5	G613 D617	G613-T615 PolarHBondContact O-N 2.76Å; T615-D617 PolarHBondContact O-N 3.17Å
616	P	50.7	Low	61.9	Low	87 Å²	87	90.9 Å²	90.9	57%	0.565	49%	0.491	S	S	*	.			trans	-61.6	138.2	169.4	31.1	-35.1	0	0	0	106.6	V618	P616-V618 HydrophobicContact CB-CG2 3.82Å; P616-V618 HydrophobicContact CG-CG2 3.84Å; P616-V618 PolarHBondContact O-N 3.29Å
617	D	53.5	Low	61.5	Low	13 Å²	13	97.3 Å²	97.3	7%	0.07	52%	0.521	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	24.2	-178.9	-69	-35.3	0	0	0	113.2	L609 R610 T615 Q619 I620 V621	L609-D617 HydrophobicContact CD2-CB 4.25Å; R610-D617 WeakPolarHBondContact CB-OD2 3.46Å; R610-D617 WeakPolarHBondContact CG-OD2 3.32Å; R610-D617 PolarHBondContact N-OD2 3.42Å; T615-D617 PolarHBondContact O-N 3.17Å; D617-Q619 PolarHBondContact O-N 3.43Å; D617-Q619 VanDerWaalsContact O-N 3.15Å; D617-I620 HydrophobicContact CB-CB 4.26Å; D617-I620 HydrophobicContact CB-CD1 3.99Å; D617-I620 HydrophobicContact CB-CG1 4.22Å; D617-I620 WeakPolarHBondContact O-CA 3.46Å; D617-I620 WeakPolarHBondContact O-CB 3.15Å; D617-I620 PolarHBondContact O-N 2.81Å; D617-I620 WeakPolarHBondContact OD1-CD1 3.18Å; D617-V621 PolarHBondContact O-N 3.04Å
618	V	49.9	Very low	61.4	Low	96 Å²	96	95.3 Å²	95.3	58%	0.582	51%	0.511	S	S	*	.	H	α-helix	trans	-55.4	-32.6	179.6	-179.8	0	0	0	0	110.9	P616 I620	P616-V618 HydrophobicContact CB-CG2 3.82Å; P616-V618 HydrophobicContact CG-CG2 3.84Å; P616-V618 PolarHBondContact O-N 3.29Å; V618-I620 VanDerWaalsContact C-N 3.33Å; V618-I620 PolarHBondContact O-N 3.38Å
619	Q	50.5	Low	61.3	Low	171 Å²	171	96.5 Å²	96.5	80%	0.799	51%	0.511	S	S	*	.	H	α-helix	trans	-73.9	-19.8	174.5	-66.8	-176.6	4.4	0	0	114	D617	D617-Q619 PolarHBondContact O-N 3.43Å; D617-Q619 VanDerWaalsContact O-N 3.15Å
620	I	56.8	Low	61.7	Low	9 Å²	9	94.8 Å²	94.8	5%	0.046	50%	0.501	C	S	.	.	H	α-helix	trans	-86.3	-23.4	-179.7	-51.9	-178	0	0	0	110.9	D617 V618 D622 H623 R629 V633	D617-I620 HydrophobicContact CB-CB 4.26Å; D617-I620 HydrophobicContact CB-CD1 3.99Å; D617-I620 HydrophobicContact CB-CG1 4.22Å; D617-I620 WeakPolarHBondContact O-CA 3.46Å; D617-I620 WeakPolarHBondContact O-CB 3.15Å; D617-I620 PolarHBondContact O-N 2.81Å; D617-I620 WeakPolarHBondContact OD1-CD1 3.18Å; V618-I620 VanDerWaalsContact C-N 3.33Å; V618-I620 PolarHBondContact O-N 3.38Å; I620-D622 VanDerWaalsContact C-N 3.31Å; I620-D622 PolarHBondContact O-N 3.47Å; I620-H623 PolarHBondContact O-N 3.48Å; I620-R629 HydrophobicContact CG2-CB 4.31Å; I620-R629 HydrophobicContact CG2-CG 4Å; I620-V633 HydrophobicContact CD1-CG2 4.12Å; I620-V633 HydrophobicContact CG2-CG2 4.22Å
621	V	55	Low	62.1	Low	76 Å²	76	95.5 Å²	95.5	46%	0.461	51%	0.506	S	S	.	.	H	α-helix	trans	-70	-26.5	-178.2	-178.4	0	0	0	0	112.5	L609 D617 H623	L609-V621 HydrophobicContact CD1-CG2 4.14Å; L609-V621 HydrophobicContact CD2-CG2 4.43Å; D617-V621 PolarHBondContact O-N 3.04Å; V621-H623 VanDerWaalsContact C-N 3.25Å; V621-H623 PolarHBondContact O-N 2.92Å
622	D	52.9	Low	62.9	Low	138 Å²	138	91.5 Å²	91.5	74%	0.738	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-10.3	-179.3	-74.3	-19.1	0	0	0	114.2	I620 H624	I620-D622 VanDerWaalsContact C-N 3.31Å; I620-D622 PolarHBondContact O-N 3.47Å; D622-H624 PolarHBondContact O-N 3.18Å
623	H	56.5	Low	64.3	Low	62 Å²	62	85.2 Å²	85.2	29%	0.287	46%	0.455	S	S	.	.			trans	-84.3	107.6	176.7	-76.1	-77.5	0	0	0	111.3	I620 V621 D625 E628 R629	I620-H623 PolarHBondContact O-N 3.48Å; V621-H623 VanDerWaalsContact C-N 3.25Å; V621-H623 PolarHBondContact O-N 2.92Å; H623-D625 PolarHBondContact O-N 3.17Å; H623-E628 IonicContact CE1-OE1 3.28Å; H623-E628 PolarHBondContact CE1-OE1 3.22Å; H623-E628 VanDerWaalsContact CE1-OE1 3.28Å; H623-E628 IonicContact CE1-OE2 3.39Å; H623-E628 PolarHBondContact CE1-OE2 2.94Å; H623-E628 IonicContact CG-OE2 3.4Å; H623-E628 IonicContact ND1-OE1 3.52Å; H623-E628 IonicContact ND1-OE2 2.75Å; H623-E628 PolarHBondContact ND1-OE2 2.91Å; H623-R629 HydrophobicContact CB-CG 3.82Å; H623-R629 WeakPolarHBondContact O-CD 3.24Å
624	H	57	Low	65.8	Low	197 Å²	197	83.1 Å²	83.1	91%	0.912	43%	0.433	S	S	*	.			trans	-66.1	-19	176.3	-100.6	-68.4	0	0	0	113.9	D622	D622-H624 PolarHBondContact O-N 3.18Å
625	D	70.5	Confident	67.5	Low	85 Å²	85	79.3 Å²	79.3	46%	0.455	41%	0.41	S	S	.	.			trans	-90.8	116.4	179.8	-168.1	-5.5	0	0	0	111.8	H623 Q627 E628 R629	H623-D625 PolarHBondContact O-N 3.17Å; D625-Q627 PolarHBondContact O-N 3.18Å; D625-Q627 PolarHBondContact OD1-N 2.69Å; D625-E628 HydrophobicContact CB-CB 4.3Å; D625-E628 PolarHBondContact O-N 3.39Å; D625-R629 PolarHBondContact O-N 2.93Å
626	T	74.3	Confident	69.3	Low	96 Å²	96	77.3 Å²	77.3	59%	0.589	39%	0.393	S	S	*	.	H	α-helix	trans	-54.5	-33.4	175.3	-47	0	0	0	0	112.2	M630	T626-M630 WeakPolarHBondContact O-CB 3.47Å; T626-M630 PolarHBondContact O-N 2.85Å
627	Q	75.1	Confident	71.1	Confident	137 Å²	137	73.1 Å²	73.1	64%	0.64	37%	0.366	S	S	*	.	H	α-helix	trans	-71.7	-36.1	-178.2	-64.8	-162.5	-5.5	0	0	113.1	D625 H631	D625-Q627 PolarHBondContact O-N 3.18Å; D625-Q627 PolarHBondContact OD1-N 2.69Å; Q627-H631 PolarHBondContact O-N 3.43Å; Q627-H631 VanDerWaalsContact O-N 3.08Å
628	E	77.5	Confident	72.9	Confident	86 Å²	86	73 Å²	73	40%	0.402	37%	0.366	S	S	.	.	H	α-helix	trans	-71.7	-43.2	179	-170.5	171.3	-159.8	0	0	110.6	H623 D625 M630 H631 L632	H623-E628 IonicContact CE1-OE1 3.28Å; H623-E628 PolarHBondContact CE1-OE1 3.22Å; H623-E628 VanDerWaalsContact CE1-OE1 3.28Å; H623-E628 IonicContact CE1-OE2 3.39Å; H623-E628 PolarHBondContact CE1-OE2 2.94Å; H623-E628 IonicContact CG-OE2 3.4Å; H623-E628 IonicContact ND1-OE1 3.52Å; H623-E628 IonicContact ND1-OE2 2.75Å; H623-E628 PolarHBondContact ND1-OE2 2.91Å; D625-E628 HydrophobicContact CB-CB 4.3Å; D625-E628 PolarHBondContact O-N 3.39Å; E628-M630 PolarHBondContact O-N 2.66Å; E628-H631 WeakPolarHBondContact O-CA 3.47Å; E628-H631 VanDerWaalsContact O-CB 3.3Å; E628-H631 WeakPolarHBondContact O-CB 3.47Å; E628-H631 PolarHBondContact O-N 3.06Å; E628-L632 HydrophobicContact CG-CD1 4.44Å; E628-L632 WeakPolarHBondContact O-CG 3.44Å; E628-L632 PolarHBondContact O-N 3.21Å
629	R	78.2	Confident	74.8	Confident	62 Å²	62	74.4 Å²	74.4	23%	0.234	37%	0.366	C	S	.	.	H	α-helix	trans	-56.8	-49.1	172.6	-72.1	-178.6	53.4	179.4	-3.5	112.2	G606 I620 H623 D625 H631 L632 V633	G606-R629 PolarHBondContact O-NH2 3.46Å; I620-R629 HydrophobicContact CG2-CB 4.31Å; I620-R629 HydrophobicContact CG2-CG 4Å; H623-R629 HydrophobicContact CB-CG 3.82Å; H623-R629 WeakPolarHBondContact O-CD 3.24Å; D625-R629 PolarHBondContact O-N 2.93Å; R629-H631 PolarHBondContact O-N 3.09Å; R629-L632 PolarHBondContact O-N 3.04Å; R629-V633 WeakPolarHBondContact O-CG2 3.47Å; R629-V633 PolarHBondContact O-N 2.89Å
630	M	80.9	Confident	76.8	Confident	41 Å²	41	68 Å²	68	20%	0.202	34%	0.337	C	S	.	.	H	α-helix	trans	-57.7	-34.4	174.8	-176.6	-175.1	74.7	0	0	112	Y565 I604 T626 E628 G634	Y565-M630 HydrophobicContact CE2-CE 4.27Å; Y565-M630 HydrophobicContact CE2-CG 4.04Å; Y565-M630 HydrophobicContact CE2-SD 4.28Å; Y565-M630 PolarHBondContact OH-O 2.86Å; I604-M630 WeakPolarHBondContact O-CG 3.47Å; T626-M630 WeakPolarHBondContact O-CB 3.47Å; T626-M630 PolarHBondContact O-N 2.85Å; E628-M630 PolarHBondContact O-N 2.66Å; M630-G634 PolarHBondContact O-N 3.49Å
631	H	83.8	Confident	78.5	Confident	54 Å²	54	68.4 Å²	68.4	25%	0.25	34%	0.338	C	S	.	.	H	α-helix	trans	-69	-49.9	177.6	-174.8	-113.8	0	0	0	112.4	Y565 R566 Q627 E628 R629 G634 Q635	Y565-H631 WeakPolarHBondContact OH-CA 3.23Å; R566-H631 PolarHBondContact NH1-CD2 3.49Å; R566-H631 PolarHBondContact NH1-NE2 3.4Å; Q627-H631 PolarHBondContact O-N 3.43Å; Q627-H631 VanDerWaalsContact O-N 3.08Å; E628-H631 WeakPolarHBondContact O-CA 3.47Å; E628-H631 VanDerWaalsContact O-CB 3.3Å; E628-H631 WeakPolarHBondContact O-CB 3.47Å; E628-H631 PolarHBondContact O-N 3.06Å; R629-H631 PolarHBondContact O-N 3.09Å; H631-G634 PolarHBondContact O-N 3.28Å; H631-Q635 PolarHBondContact CE1-NE2 2.94Å; H631-Q635 PolarHBondContact NE2-NE2 3.16Å; H631-Q635 WeakPolarHBondContact O-CG 3.31Å; H631-Q635 PolarHBondContact O-N 3.41Å
632	L	84.3	Confident	80.1	Confident	52 Å²	52	70.6 Å²	70.6	27%	0.272	34%	0.343	S	S	.	.	H	α-helix	trans	-62.6	-49.6	-179.1	-66.9	172.3	0	0	0	111.4	E628 R629 G634 Q635 Q636	E628-L632 HydrophobicContact CG-CD1 4.44Å; E628-L632 WeakPolarHBondContact O-CG 3.44Å; E628-L632 PolarHBondContact O-N 3.21Å; R629-L632 PolarHBondContact O-N 3.04Å; L632-G634 VanDerWaalsContact C-N 3.34Å; L632-G634 PolarHBondContact O-N 3.01Å; L632-Q635 PolarHBondContact O-N 3.4Å; L632-Q636 WeakPolarHBondContact O-CG 3.26Å; L632-Q636 PolarHBondContact O-N 3.44Å
633	V	85.7	Confident	81.9	Confident	4 Å²	4	68.5 Å²	68.5	2%	0.024	34%	0.335	C	S	.	.	H	α-helix	trans	-62.1	-44.2	178.2	176.2	0	0	0	0	110.7	V603 I620 R629 Q635 Q636 L637	V603-V633 VanDerWaalsContact O-CG1 3.31Å; V603-V633 WeakPolarHBondContact O-CG1 3.13Å; I620-V633 HydrophobicContact CD1-CG2 4.12Å; I620-V633 HydrophobicContact CG2-CG2 4.22Å; R629-V633 WeakPolarHBondContact O-CG2 3.47Å; R629-V633 PolarHBondContact O-N 2.89Å; V633-Q635 PolarHBondContact O-N 3.48Å; V633-Q636 PolarHBondContact O-N 3.17Å; V633-L637 HydrophobicContact CG1-CD1 4.06Å; V633-L637 HydrophobicContact CG1-CG 4.39Å; V633-L637 VanDerWaalsContact O-CG 3.31Å; V633-L637 WeakPolarHBondContact O-CG 3.45Å; V633-L637 PolarHBondContact O-N 3.01Å
634	G	86.1	Confident	83.6	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-60.2	-41.8	177.3	0	0	0	0	0	113.2	M630 H631 L632 L637 I638	M630-G634 PolarHBondContact O-N 3.49Å; H631-G634 PolarHBondContact O-N 3.28Å; L632-G634 VanDerWaalsContact C-N 3.34Å; L632-G634 PolarHBondContact O-N 3.01Å; G634-L637 PolarHBondContact O-N 2.89Å; G634-I638 VanDerWaalsContact O-CD1 3.31Å; G634-I638 WeakPolarHBondContact O-CD1 3.42Å; G634-I638 VanDerWaalsContact O-CG1 3.3Å; G634-I638 WeakPolarHBondContact O-CG1 3.35Å; G634-I638 PolarHBondContact O-N 3.09Å; G634-I638 VanDerWaalsContact O-N 3.15Å
635	Q	87.1	Confident	85.2	Confident	100 Å²	100	64.2 Å²	64.2	47%	0.467	32%	0.318	S	S	.	.	H	α-helix	trans	-64.7	-42.4	175.9	-76.6	-172.6	-27.4	0	0	112.4	H631 L632 V633 L637 I638 Q639	H631-Q635 PolarHBondContact CE1-NE2 2.94Å; H631-Q635 PolarHBondContact NE2-NE2 3.16Å; H631-Q635 WeakPolarHBondContact O-CG 3.31Å; H631-Q635 PolarHBondContact O-N 3.41Å; L632-Q635 PolarHBondContact O-N 3.4Å; V633-Q635 PolarHBondContact O-N 3.48Å; Q635-L637 PolarHBondContact O-N 2.9Å; Q635-I638 PolarHBondContact O-N 3.04Å; Q635-Q639 PolarHBondContact O-N 3.47Å; Q635-Q639 VanDerWaalsContact O-N 3.13Å
636	Q	88.4	Confident	86.1	Confident	57 Å²	57	62.4 Å²	62.4	27%	0.266	31%	0.307	S	S	.	.	H	α-helix	trans	-59.6	-46.5	175	-71.2	176.9	-6.3	0	0	111.3	L632 V633 I638 Q639 D640	L632-Q636 WeakPolarHBondContact O-CG 3.26Å; L632-Q636 PolarHBondContact O-N 3.44Å; V633-Q636 PolarHBondContact O-N 3.17Å; Q636-I638 VanDerWaalsContact C-N 3.26Å; Q636-I638 PolarHBondContact O-N 2.85Å; Q636-Q639 PolarHBondContact O-N 2.83Å; Q636-Q639 VanDerWaalsContact O-N 3.12Å; Q636-D640 WeakPolarHBondContact O-CB 3.37Å; Q636-D640 PolarHBondContact O-N 3.47Å
637	L	90.4	Very high	86.8	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-61.4	-32.4	178.8	-71.3	173.8	0	0	0	113.3	I570 F583 L586 Y588 V603 I604 V633 G634 Q635 W641	I570-L637 HydrophobicContact CD1-CB 4.13Å; I570-L637 HydrophobicContact CD1-CD1 4.19Å; I570-L637 HydrophobicContact CG1-CB 4.19Å; I570-L637 HydrophobicContact CG2-CB 3.99Å; I570-L637 HydrophobicContact CG2-CD1 4.44Å; F583-L637 HydrophobicContact CD1-CD2 4.47Å; F583-L637 HydrophobicContact CE1-CD2 4.02Å; L586-L637 HydrophobicContact CD1-CD2 4.05Å; Y588-L637 HydrophobicContact CE2-CD2 3.88Å; V603-L637 HydrophobicContact CG1-CD1 3.98Å; V603-L637 HydrophobicContact CG1-CD2 4.42Å; I604-L637 HydrophobicContact CG1-CD1 4.27Å; V633-L637 HydrophobicContact CG1-CD1 4.06Å; V633-L637 HydrophobicContact CG1-CG 4.39Å; V633-L637 VanDerWaalsContact O-CG 3.31Å; V633-L637 WeakPolarHBondContact O-CG 3.45Å; V633-L637 PolarHBondContact O-N 3.01Å; G634-L637 PolarHBondContact O-N 2.89Å; Q635-L637 PolarHBondContact O-N 2.9Å; L637-W641 WeakPolarHBondContact O-CB 3.28Å; L637-W641 PolarHBondContact O-N 3.1Å
638	I	89.9	Confident	87.5	Confident	10 Å²	10	57 Å²	57	5%	0.051	28%	0.278	C	S	.	.	H	α-helix	trans	-68.3	-45.3	174.7	-69.1	155.5	0	0	0	110.5	Y565 Q568 I570 G634 Q635 Q636 D640 W641 Q642	Y565-I638 HydrophobicContact CD1-CD1 4.03Å; Q568-I638 HydrophobicContact CB-CD1 4.01Å; Q568-I638 HydrophobicContact CB-CG1 4.09Å; Q568-I638 HydrophobicContact CB-CG2 4.27Å; I570-I638 HydrophobicContact CG1-CG1 4.22Å; G634-I638 VanDerWaalsContact O-CD1 3.31Å; G634-I638 WeakPolarHBondContact O-CD1 3.42Å; G634-I638 VanDerWaalsContact O-CG1 3.3Å; G634-I638 WeakPolarHBondContact O-CG1 3.35Å; G634-I638 PolarHBondContact O-N 3.09Å; G634-I638 VanDerWaalsContact O-N 3.15Å; Q635-I638 PolarHBondContact O-N 3.04Å; Q636-I638 VanDerWaalsContact C-N 3.26Å; Q636-I638 PolarHBondContact O-N 2.85Å; I638-D640 VanDerWaalsContact C-N 3.35Å; I638-W641 PolarHBondContact O-N 2.9Å; I638-Q642 WeakPolarHBondContact O-CG 3.3Å; I638-Q642 PolarHBondContact O-N 3.02Å
639	Q	91	Very high	88.2	Confident	126 Å²	126	58.5 Å²	58.5	59%	0.589	28%	0.284	S	S	*	.	H	α-helix	trans	-64.7	-40.9	177.7	-172.7	175.1	6.5	0	0	111.6	Q635 Q636 W641 Q642 T643	Q635-Q639 PolarHBondContact O-N 3.47Å; Q635-Q639 VanDerWaalsContact O-N 3.13Å; Q636-Q639 PolarHBondContact O-N 2.83Å; Q636-Q639 VanDerWaalsContact O-N 3.12Å; Q639-W641 VanDerWaalsContact C-N 3.31Å; Q639-W641 PolarHBondContact O-N 3.46Å; Q639-Q642 PolarHBondContact O-N 3.21Å; Q639-T643 WeakPolarHBondContact O-CG2 3.48Å; Q639-T643 PolarHBondContact O-N 3.41Å; Q639-T643 PolarHBondContact O-OG1 3.06Å
640	D	91	Very high	88.8	Confident	35 Å²	35	56.7 Å²	56.7	19%	0.187	28%	0.28	C	S	.	.	H	α-helix	trans	-61.5	-39.8	175.1	-70.4	-22.1	0	0	0	111.6	L586 R610 Q636 I638 T643 S644	L586-D640 HydrophobicContact CD1-CB 4.22Å; L586-D640 HydrophobicContact CD2-CB 3.81Å; R610-D640 IonicContact CZ-OD2 3.67Å; R610-D640 VanDerWaalsContact CZ-OD2 3.32Å; R610-D640 IonicContact NH1-OD2 2.68Å; R610-D640 PolarHBondContact NH1-OD2 2.93Å; R610-D640 VanDerWaalsContact NH1-OD2 3.1Å; R610-D640 IonicContact NH2-OD2 3.32Å; R610-D640 PolarHBondContact NH2-OD2 2.95Å; Q636-D640 WeakPolarHBondContact O-CB 3.37Å; Q636-D640 PolarHBondContact O-N 3.47Å; I638-D640 VanDerWaalsContact C-N 3.35Å; D640-T643 PolarHBondContact O-OG1 3.44Å; D640-S644 WeakPolarHBondContact O-CB 3.41Å; D640-S644 PolarHBondContact O-N 3.01Å; D640-S644 VanDerWaalsContact O-N 3.17Å
641	W	92.4	Very high	89.2	Confident	19 Å²	19	58.4 Å²	58.4	7%	0.072	29%	0.289	C	S	.	.	H	α-helix	trans	-64.8	-50.4	174.7	176.6	-110.1	0	0	0	111.6	I569 I570 Y571 H572 Y582 L637 I638 Q639 T643 S644 M646 A647	I569-W641 HydrophobicContact CG2-CD2 4.43Å; I569-W641 HydrophobicContact CG2-CZ2 4.3Å; I570-W641 WeakPolarHBondContact O-CB 3.3Å; Y571-W641 HydrophobicContact CD2-CE3 4.35Å; Y571-W641 AromaticContact CD2-CZ3 3.79Å; Y571-W641 HydrophobicContact CD2-CZ3 3.79Å; Y571-W641 HydrophobicContact CE2-CZ3 4.38Å; Y571-W641 HydrophobicContact CG-CZ3 4.46Å; H572-W641 HydrophobicContact CB-CH2 4.13Å; H572-W641 HydrophobicContact CB-CZ2 3.77Å; H572-W641 VanDerWaalsContact O-CH2 3.25Å; H572-W641 WeakPolarHBondContact O-CH2 3.26Å; Y582-W641 HydrophobicContact CE1-CE3 4.4Å; Y582-W641 HydrophobicContact CE2-CE3 4.22Å; Y582-W641 AromaticContact CZ-CE3 3.87Å; Y582-W641 VanDerWaalsContact OH-CA 3.24Å; Y582-W641 WeakPolarHBondContact OH-CA 3.4Å; Y582-W641 PolarHBondContact OH-N 2.79Å; L637-W641 WeakPolarHBondContact O-CB 3.28Å; L637-W641 PolarHBondContact O-N 3.1Å; I638-W641 PolarHBondContact O-N 2.9Å; Q639-W641 VanDerWaalsContact C-N 3.31Å; Q639-W641 PolarHBondContact O-N 3.46Å; W641-T643 PolarHBondContact O-N 3.46Å; W641-S644 WeakPolarHBondContact O-CB 3.44Å; W641-S644 PolarHBondContact O-N 3.37Å; W641-S644 PolarHBondContact O-OG 3.46Å; W641-M646 HydrophobicContact CH2-CB 4.17Å; W641-M646 HydrophobicContact CZ3-CB 4.04Å; W641-A647 HydrophobicContact CD2-CB 3.98Å; W641-A647 HydrophobicContact CE3-CB 4.47Å; W641-A647 HydrophobicContact CG-CB 4.37Å; W641-A647 HydrophobicContact CH2-CB 4.33Å; W641-A647 HydrophobicContact CZ2-CB 3.82Å; W641-A647 WeakPolarHBondContact O-CB 3.46Å
642	Q	89.2	Confident	89.6	Confident	122 Å²	122	61.6 Å²	61.6	57%	0.57	31%	0.305	S	S	*	.	H	α-helix	trans	-59.8	-32.6	-178.5	-73	176.5	-11.4	0	0	113.1	I638 Q639	I638-Q642 WeakPolarHBondContact O-CG 3.3Å; I638-Q642 PolarHBondContact O-N 3.02Å; Q639-Q642 PolarHBondContact O-N 3.21Å
643	T	90.7	Very high	89.8	Confident	93 Å²	93	61 Å²	61	57%	0.571	30%	0.301	S	S	*	.	H	α-helix	trans	-84.8	-12.5	177.6	53.7	0	0	0	0	113.6	Q639 D640 W641	Q639-T643 WeakPolarHBondContact O-CG2 3.48Å; Q639-T643 PolarHBondContact O-N 3.41Å; Q639-T643 PolarHBondContact O-OG1 3.06Å; D640-T643 PolarHBondContact O-OG1 3.44Å; W641-T643 PolarHBondContact O-N 3.46Å
644	S	91.3	Very high	90	Very high	18 Å²	18	61 Å²	61	13%	0.126	30%	0.3	C	S	.	.	S	Bend	trans	-71.4	145	-176.4	76.1	0	0	0	0	113.7	D640 W641 M646 A647 Q648	D640-S644 WeakPolarHBondContact O-CB 3.41Å; D640-S644 PolarHBondContact O-N 3.01Å; D640-S644 VanDerWaalsContact O-N 3.17Å; W641-S644 WeakPolarHBondContact O-CB 3.44Å; W641-S644 PolarHBondContact O-N 3.37Å; W641-S644 PolarHBondContact O-OG 3.46Å; S644-M646 PolarHBondContact O-N 3.39Å; S644-A647 PolarHBondContact O-N 3.49Å; S644-A647 WeakPolarHBondContact OG-CB 3.26Å; S644-A647 PolarHBondContact OG-N 3.12Å; S644-Q648 PolarHBondContact O-N 3.45Å
645	E	91.5	Very high	90.1	Very high	152 Å²	152	63.2 Å²	63.2	71%	0.71	32%	0.316	S	S	*	.	H	α-helix	trans	-56.6	-33.7	172.4	-63.6	177.6	171.1	0	0	112.2	Q648 H649	E645-Q648 PolarHBondContact O-N 3.02Å; E645-H649 WeakPolarHBondContact O-CB 3.4Å; E645-H649 PolarHBondContact O-N 3.49Å
646	M	89.2	Confident	90.1	Very high	47 Å²	47	61.2 Å²	61.2	23%	0.232	31%	0.313	C	S	.	.	H	α-helix	trans	-67	-41.3	179.4	-73.9	-175.5	-72	0	0	112.1	Y571 Y582 W641 S644 V650	Y571-M646 HydrophobicContact CE2-CE 4.42Å; Y571-M646 HydrophobicContact CE2-SD 4.38Å; Y582-M646 HydrophobicContact CD2-CE 3.15Å; Y582-M646 HydrophobicContact CE2-CE 3.91Å; Y582-M646 HydrophobicContact CG-CE 3.76Å; W641-M646 HydrophobicContact CH2-CB 4.17Å; W641-M646 HydrophobicContact CZ3-CB 4.04Å; S644-M646 PolarHBondContact O-N 3.39Å; M646-V650 VanDerWaalsContact O-CG2 3.32Å; M646-V650 WeakPolarHBondContact O-CG2 3.26Å; M646-V650 PolarHBondContact O-N 3.09Å; M646-V650 VanDerWaalsContact O-N 3.08Å
647	A	89	Confident	90.1	Very high	13 Å²	13	59.1 Å²	59.1	11%	0.107	30%	0.304	C	S	.	.	H	α-helix	trans	-66.9	-40.4	175.9	0	0	0	0	0	111.6	W641 S644 V650 L651	W641-A647 HydrophobicContact CD2-CB 3.98Å; W641-A647 HydrophobicContact CE3-CB 4.47Å; W641-A647 HydrophobicContact CG-CB 4.37Å; W641-A647 HydrophobicContact CH2-CB 4.33Å; W641-A647 HydrophobicContact CZ2-CB 3.82Å; W641-A647 WeakPolarHBondContact O-CB 3.46Å; S644-A647 PolarHBondContact O-N 3.49Å; S644-A647 WeakPolarHBondContact OG-CB 3.26Å; S644-A647 PolarHBondContact OG-N 3.12Å; A647-V650 PolarHBondContact O-N 3.46Å; A647-L651 WeakPolarHBondContact O-CB 3.41Å; A647-L651 PolarHBondContact O-N 2.88Å
648	Q	91	Very high	89.7	Confident	106 Å²	106	60 Å²	60	50%	0.495	31%	0.31	S	S	.	.	H	α-helix	trans	-60.3	-47.3	175.6	-68.5	178.7	-2	0	0	111.4	S644 E645 V650 L651 E652	S644-Q648 PolarHBondContact O-N 3.45Å; E645-Q648 PolarHBondContact O-N 3.02Å; Q648-V650 VanDerWaalsContact C-N 3.33Å; Q648-V650 PolarHBondContact O-N 3.17Å; Q648-L651 PolarHBondContact O-N 2.98Å; Q648-L651 VanDerWaalsContact O-N 3.13Å; Q648-E652 WeakPolarHBondContact O-CB 3.3Å; Q648-E652 WeakPolarHBondContact O-CG 3.38Å; Q648-E652 PolarHBondContact O-N 3.46Å
649	H	91.4	Very high	89.4	Confident	118 Å²	118	63.5 Å²	63.5	55%	0.546	33%	0.329	S	S	.	.	H	α-helix	trans	-61.4	-39.8	177.1	-177.2	-82.5	0	0	0	112.6	E645 E653	E645-H649 WeakPolarHBondContact O-CB 3.4Å; E645-H649 PolarHBondContact O-N 3.49Å; H649-E653 PolarHBondContact O-N 3.4Å
650	V	89.7	Confident	88.9	Confident	23 Å²	23	66.8 Å²	66.8	14%	0.139	34%	0.336	C	S	.	.	H	α-helix	trans	-63.2	-45.5	174.1	170.6	0	0	0	0	110.4	M646 A647 Q648 E653 V654	M646-V650 VanDerWaalsContact O-CG2 3.32Å; M646-V650 WeakPolarHBondContact O-CG2 3.26Å; M646-V650 PolarHBondContact O-N 3.09Å; M646-V650 VanDerWaalsContact O-N 3.08Å; A647-V650 PolarHBondContact O-N 3.46Å; Q648-V650 VanDerWaalsContact C-N 3.33Å; Q648-V650 PolarHBondContact O-N 3.17Å; V650-E653 PolarHBondContact O-N 3.35Å; V650-V654 HydrophobicContact CG1-CG2 4.2Å; V650-V654 WeakPolarHBondContact O-CB 3.16Å; V650-V654 WeakPolarHBondContact O-CG2 3.5Å; V650-V654 PolarHBondContact O-N 3.44Å
651	L	90.3	Very high	88.2	Confident	77 Å²	77	65.8 Å²	65.8	40%	0.403	33%	0.331	S	S	.	.	H	α-helix	trans	-66.1	-37.3	-179.5	-171.3	65.3	0	0	0	112.4	A647 Q648 V654 S655	A647-L651 WeakPolarHBondContact O-CB 3.41Å; A647-L651 PolarHBondContact O-N 2.88Å; Q648-L651 PolarHBondContact O-N 2.98Å; Q648-L651 VanDerWaalsContact O-N 3.13Å; L651-V654 PolarHBondContact O-N 3.12Å; L651-S655 VanDerWaalsContact O-CB 3.28Å; L651-S655 WeakPolarHBondContact O-CB 3.38Å; L651-S655 PolarHBondContact O-N 2.84Å; L651-S655 PolarHBondContact O-OG 3.32Å
652	E	91.2	Very high	87.4	Confident	122 Å²	122	68.9 Å²	68.9	57%	0.57	35%	0.346	S	S	*	.	H	α-helix	trans	-61.9	-45.8	171.9	-75.9	177.3	-175.6	0	0	111.6	Q648 V654 S655 S656	Q648-E652 WeakPolarHBondContact O-CB 3.3Å; Q648-E652 WeakPolarHBondContact O-CG 3.38Å; Q648-E652 PolarHBondContact O-N 3.46Å; E652-V654 PolarHBondContact O-N 2.97Å; E652-S655 WeakPolarHBondContact CA-OG 3.38Å; E652-S655 PolarHBondContact O-OG 3.33Å; E652-S656 WeakPolarHBondContact O-CB 3.31Å; E652-S656 PolarHBondContact O-N 3.12Å
653	E	90.1	Very high	86.7	Confident	40 Å²	40	70.9 Å²	70.9	19%	0.187	35%	0.353	C	S	.	.	H	α-helix	trans	-65.8	-41.3	177.4	-167	-175.5	162.6	0	0	111.3	K343 I375 R377 H649 V650 S656 I657	K343-E653 IonicContact NZ-OE1 2.65Å; K343-E653 PolarHBondContact NZ-OE1 3.42Å; I375-E653 HydrophobicContact CD1-CB 3.64Å; I375-E653 HydrophobicContact CD1-CG 3.42Å; I375-E653 VanDerWaalsContact CD1-CG 3.42Å; R377-E653 IonicContact CZ-OE1 2.84Å; R377-E653 IonicContact CZ-OE2 2.93Å; R377-E653 IonicContact NE-OE1 3.78Å; R377-E653 IonicContact NH2-OE1 2.6Å; R377-E653 PolarHBondContact NH2-OE1 3Å; R377-E653 IonicContact NH2-OE2 3.55Å; R377-E653 PolarHBondContact NH2-OE2 3.49Å; H649-E653 PolarHBondContact O-N 3.4Å; V650-E653 PolarHBondContact O-N 3.35Å; E653-S656 PolarHBondContact O-N 3.38Å; E653-S656 PolarHBondContact O-OG 2.94Å; E653-I657 WeakPolarHBondContact O-CG1 3.36Å; E653-I657 PolarHBondContact O-N 2.97Å
654	V	88.7	Confident	85.6	Confident	2 Å²	2	72.7 Å²	72.7	1%	0.012	35%	0.35	C	S	.	.	H	α-helix	trans	-61	-54.1	175.9	169.6	0	0	0	0	109.8	H347 I375 V650 L651 E652 S656 I657 A658	H347-V654 HydrophobicContact CB-CG1 4.31Å; H347-V654 WeakPolarHBondContact CE1-CG1 3.47Å; H347-V654 PolarHBondContact CE1-O 2.82Å; H347-V654 WeakPolarHBondContact ND1-CG1 3.36Å; I375-V654 HydrophobicContact CD1-CG2 3.7Å; I375-V654 HydrophobicContact CG1-CG2 3.38Å; V650-V654 HydrophobicContact CG1-CG2 4.2Å; V650-V654 WeakPolarHBondContact O-CB 3.16Å; V650-V654 WeakPolarHBondContact O-CG2 3.5Å; V650-V654 PolarHBondContact O-N 3.44Å; L651-V654 PolarHBondContact O-N 3.12Å; E652-V654 PolarHBondContact O-N 2.97Å; V654-S656 VanDerWaalsContact C-N 3.28Å; V654-S656 PolarHBondContact O-N 3.45Å; V654-I657 WeakPolarHBondContact O-CB 3.48Å; V654-I657 PolarHBondContact O-N 2.87Å; V654-A658 PolarHBondContact O-N 3.05Å; V654-A658 VanDerWaalsContact O-N 3.11Å
655	S	88.1	Confident	84.6	Confident	48 Å²	48	77 Å²	77	34%	0.336	37%	0.368	S	S	.	.	H	α-helix	trans	-61.1	-34.9	179.5	60.7	0	0	0	0	112.6	L651 E652 I657 A658 N659	L651-S655 VanDerWaalsContact O-CB 3.28Å; L651-S655 WeakPolarHBondContact O-CB 3.38Å; L651-S655 PolarHBondContact O-N 2.84Å; L651-S655 PolarHBondContact O-OG 3.32Å; E652-S655 WeakPolarHBondContact CA-OG 3.38Å; E652-S655 PolarHBondContact O-OG 3.33Å; S655-I657 VanDerWaalsContact C-N 3.27Å; S655-I657 PolarHBondContact O-N 2.85Å; S655-A658 PolarHBondContact O-N 3.17Å; S655-N659 WeakPolarHBondContact O-CB 3.47Å; S655-N659 PolarHBondContact O-N 3.12Å; S655-N659 PolarHBondContact O-ND2 3.32Å
656	S	88.7	Confident	83.3	Confident	57 Å²	57	76.6 Å²	76.6	40%	0.399	37%	0.371	S	S	.	.	H	α-helix	trans	-60.4	-35.5	173.8	82.9	0	0	0	0	112.8	E652 E653 V654 R660	E652-S656 WeakPolarHBondContact O-CB 3.31Å; E652-S656 PolarHBondContact O-N 3.12Å; E653-S656 PolarHBondContact O-N 3.38Å; E653-S656 PolarHBondContact O-OG 2.94Å; V654-S656 VanDerWaalsContact C-N 3.28Å; V654-S656 PolarHBondContact O-N 3.45Å; S656-R660 VanDerWaalsContact O-CG 3.3Å; S656-R660 WeakPolarHBondContact O-CG 3.34Å; S656-R660 PolarHBondContact O-N 2.9Å
657	I	86.3	Confident	81.9	Confident	14 Å²	14	77.6 Å²	77.6	7%	0.072	39%	0.393	C	S	.	.	H	α-helix	trans	-72.7	-43.5	177.1	-62.6	163.7	0	0	0	110.1	K343 I375 L412 E653 V654 S655 R660 L661	K343-I657 HydrophobicContact CD-CD1 4.39Å; I375-I657 HydrophobicContact CD1-CD1 4Å; L412-I657 HydrophobicContact CD1-CG2 4.18Å; E653-I657 WeakPolarHBondContact O-CG1 3.36Å; E653-I657 PolarHBondContact O-N 2.97Å; V654-I657 WeakPolarHBondContact O-CB 3.48Å; V654-I657 PolarHBondContact O-N 2.87Å; S655-I657 VanDerWaalsContact C-N 3.27Å; S655-I657 PolarHBondContact O-N 2.85Å; I657-R660 PolarHBondContact O-N 3.5Å; I657-L661 PolarHBondContact O-N 3.02Å
658	A	82.1	Confident	80.2	Confident	17 Å²	17	78.8 Å²	78.8	14%	0.14	40%	0.401	C	S	.	.	H	α-helix	trans	-61.7	-45.5	176.8	0	0	0	0	0	112	V654 S655 R660 L661 E662	V654-A658 PolarHBondContact O-N 3.05Å; V654-A658 VanDerWaalsContact O-N 3.11Å; S655-A658 PolarHBondContact O-N 3.17Å; A658-R660 PolarHBondContact O-N 3.29Å; A658-L661 WeakPolarHBondContact O-CB 3.3Å; A658-L661 PolarHBondContact O-N 3.29Å; A658-E662 PolarHBondContact O-N 2.85Å
659	N	84.1	Confident	78.2	Confident	85 Å²	85	83 Å²	83	46%	0.455	42%	0.418	S	S	.	.	H	α-helix	trans	-61	-33.1	178.9	-72.6	-22.5	0	0	0	112.4	S655 K663	S655-N659 WeakPolarHBondContact O-CB 3.47Å; S655-N659 PolarHBondContact O-N 3.12Å; S655-N659 PolarHBondContact O-ND2 3.32Å; N659-K663 WeakPolarHBondContact O-CG 3.49Å; N659-K663 PolarHBondContact O-N 3.33Å; N659-K663 VanDerWaalsContact O-N 3.13Å
660	R	81.7	Confident	76	Confident	194 Å²	194	87.2 Å²	87.2	73%	0.732	44%	0.435	S	S	*	.	H	α-helix	trans	-67	-37.6	174.1	-74.7	173.5	65.1	177.5	0.7	112.1	S656 I657 A658 Y664	S656-R660 VanDerWaalsContact O-CG 3.3Å; S656-R660 WeakPolarHBondContact O-CG 3.34Å; S656-R660 PolarHBondContact O-N 2.9Å; I657-R660 PolarHBondContact O-N 3.5Å; A658-R660 PolarHBondContact O-N 3.29Å; R660-Y664 PolarHBondContact O-N 2.72Å
661	L	76.2	Confident	73.8	Confident	14 Å²	14	90.5 Å²	90.5	7%	0.073	46%	0.459	C	S	.	.	H	α-helix	trans	-67.3	-46.6	175.9	179.7	65	0	0	0	111.1	L412 I657 A658 K663 Y664 E665	L412-L661 HydrophobicContact CD1-CD2 4.04Å; L412-L661 HydrophobicContact CD2-CD2 3.55Å; L412-L661 HydrophobicContact CG-CD2 4.47Å; I657-L661 PolarHBondContact O-N 3.02Å; A658-L661 WeakPolarHBondContact O-CB 3.3Å; A658-L661 PolarHBondContact O-N 3.29Å; L661-K663 VanDerWaalsContact C-N 3.3Å; L661-K663 PolarHBondContact O-N 2.76Å; L661-Y664 CarbonylContact O-C 3.55Å; L661-Y664 WeakPolarHBondContact O-CA 3.41Å; L661-Y664 WeakPolarHBondContact O-CB 3.37Å; L661-Y664 PolarHBondContact O-N 2.84Å; L661-E665 HydrophobicContact CD1-CG 4.18Å; L661-E665 HydrophobicContact CG-CG 4.31Å; L661-E665 PolarHBondContact O-N 3.45Å
662	E	75.3	Confident	71.4	Confident	84 Å²	84	95.2 Å²	95.2	39%	0.393	48%	0.476	S	S	.	.	H	α-helix	trans	-62.7	-37.5	-179.4	-68.5	-173	173.9	0	0	112.2	K410 A658 Y664 E665 N666	K410-E662 IonicContact NZ-OE1 3.25Å; A658-E662 PolarHBondContact O-N 2.85Å; E662-Y664 VanDerWaalsContact C-N 3.3Å; E662-Y664 PolarHBondContact O-N 3.2Å; E662-E665 PolarHBondContact O-N 3.25Å; E662-N666 VanDerWaalsContact O-CB 3.27Å; E662-N666 WeakPolarHBondContact O-CB 3.5Å; E662-N666 VanDerWaalsContact O-CG 3.28Å; E662-N666 PolarHBondContact O-N 2.9Å; E662-N666 PolarHBondContact O-ND2 3.12Å
663	K	74.1	Confident	69	Low	164 Å²	164	96.4 Å²	96.4	71%	0.713	49%	0.486	S	S	*	.	H	α-helix	trans	-61.4	-38.1	171.2	-74.9	177.4	-177.9	-178.1	0	112.4	N659 L661 G667	N659-K663 WeakPolarHBondContact O-CG 3.49Å; N659-K663 PolarHBondContact O-N 3.33Å; N659-K663 VanDerWaalsContact O-N 3.13Å; L661-K663 VanDerWaalsContact C-N 3.3Å; L661-K663 PolarHBondContact O-N 2.76Å; K663-G667 PolarHBondContact O-N 3.08Å
664	Y	67.6	Low	66.5	Low	132 Å²	132	103.3 Å²	103.3	52%	0.518	52%	0.516	S	S	.	.	H	α-helix	trans	-71.2	-43.9	178	-171.2	-95.8	0	0	0	112.1	R660 L661 E662 G667 S668	R660-Y664 PolarHBondContact O-N 2.72Å; L661-Y664 CarbonylContact O-C 3.55Å; L661-Y664 WeakPolarHBondContact O-CA 3.41Å; L661-Y664 WeakPolarHBondContact O-CB 3.37Å; L661-Y664 PolarHBondContact O-N 2.84Å; E662-Y664 VanDerWaalsContact C-N 3.3Å; E662-Y664 PolarHBondContact O-N 3.2Å; Y664-G667 PolarHBondContact O-N 3.02Å; Y664-S668 PolarHBondContact O-N 3.18Å; Y664-S668 VanDerWaalsContact O-N 3.15Å
665	E	69.6	Low	63.8	Low	107 Å²	107	106.7 Å²	106.7	50%	0.5	54%	0.543	S	S	.	.	H	α-helix	trans	-67.4	-37.2	178.4	-71.2	-173.3	164.7	0	0	112.6	L661 E662	L661-E665 HydrophobicContact CD1-CG 4.18Å; L661-E665 HydrophobicContact CG-CG 4.31Å; L661-E665 PolarHBondContact O-N 3.45Å; E662-E665 PolarHBondContact O-N 3.25Å
666	N	64.7	Low	61.6	Low	144 Å²	144	108.9 Å²	108.9	77%	0.77	56%	0.555	S	S	*	*	H	α-helix	trans	-75.2	-24.4	177	-71.6	-23.9	0	0	0	113	E662	E662-N666 VanDerWaalsContact O-CB 3.27Å; E662-N666 WeakPolarHBondContact O-CB 3.5Å; E662-N666 VanDerWaalsContact O-CG 3.28Å; E662-N666 PolarHBondContact O-N 2.9Å; E662-N666 PolarHBondContact O-ND2 3.12Å
667	G	60.1	Low	59.4	Low	68 Å²	68	112.6 Å²	112.6	70%	0.701	57%	0.57	S	S	*	*	H	α-helix	trans	-91.3	-23.5	-177.7	0	0	0	0	0	115.6	K663 Y664	K663-G667 PolarHBondContact O-N 3.08Å; Y664-G667 PolarHBondContact O-N 3.02Å
668	S	54.1	Low	57.9	Low	39 Å²	39	116.6 Å²	116.6	27%	0.273	59%	0.591	S	S	.	*	S	Bend	trans	-104.9	117.8	-176.6	-162.9	0	0	0	0	111.1	Y664 K670	Y664-S668 PolarHBondContact O-N 3.18Å; Y664-S668 VanDerWaalsContact O-N 3.15Å; S668-K670 PolarHBondContact O-N 3.01Å; S668-K670 VanDerWaalsContact O-N 3.17Å
669	K	48.5	Very low	56.7	Low	195 Å²	195	120 Å²	120	85%	0.848	61%	0.613	S	S	*	*			trans	-46.6	125.4	170.1	-80.2	179.2	176.1	176.9	0	108.4	S671	K669-S671 VanDerWaalsContact C-N 3.26Å; K669-S671 PolarHBondContact O-N 3.2Å
670	K	43.8	Very low	56.2	Low	206 Å²	206	118.5 Å²	118.5	90%	0.896	60%	0.603	S	S	*	*			trans	-45.4	86.7	171.6	-74.9	-179.9	175.7	176.2	0	110.8	S668 K672	S668-K670 PolarHBondContact O-N 3.01Å; S668-K670 VanDerWaalsContact O-N 3.17Å; K670-K672 PolarHBondContact O-N 3.43Å; K670-K672 VanDerWaalsContact O-N 3.1Å
671	S	43.8	Very low	55.8	Low	92 Å²	92	111 Å²	111	64%	0.643	58%	0.582	S	S	*	*			trans	-60.7	116	153.9	-93.9	0	0	0	0	103.8	K669 D673	K669-S671 VanDerWaalsContact C-N 3.26Å; K669-S671 PolarHBondContact O-N 3.2Å; S671-D673 PolarHBondContact O-N 2.87Å
672	K	40.6	Very low	56.1	Low	176 Å²	176	110.6 Å²	110.6	77%	0.765	58%	0.581	S	S	*	*			trans	-59.1	92.2	168.7	-73.7	176.4	175.5	176.3	0	105.7	K670 K674	K670-K672 PolarHBondContact O-N 3.43Å; K670-K672 VanDerWaalsContact O-N 3.1Å; K672-K674 PolarHBondContact O-N 3.36Å
673	D	41.6	Very low	56.6	Low	147 Å²	147	109.5 Å²	109.5	79%	0.786	58%	0.583	S	S	*	*			trans	-55.6	100.6	160.5	-78.3	-16.9	0	0	0	104.3	S671 A675	S671-D673 PolarHBondContact O-N 2.87Å; D673-A675 PolarHBondContact O-N 2.99Å
674	K	35.9	Very low	57.3	Low	185 Å²	185	106 Å²	106	80%	0.804	57%	0.566	S	S	*	*			trans	-43.3	132.6	168.3	-73	177.4	177.8	174.9	0	104.8	K672 V676	K672-K674 PolarHBondContact O-N 3.36Å; K674-V676 VanDerWaalsContact C-N 3.27Å; K674-V676 WeakPolarHBondContact O-CG2 3.33Å; K674-V676 PolarHBondContact O-N 2.9Å
675	A	34	Very low	58.4	Low	72 Å²	72	107.3 Å²	107.3	60%	0.595	57%	0.574	S	S	*	*			trans	-47.7	101.9	174.4	0	0	0	0	0	107.2	D673 D677	D673-A675 PolarHBondContact O-N 2.99Å; A675-D677 PolarHBondContact O-N 3.2Å
676	V	40.9	Very low	59.3	Low	94 Å²	94	104.7 Å²	104.7	57%	0.57	56%	0.56	S	S	*	*			trans	-71.6	94.9	175.8	178.8	0	0	0	0	102.3	K674	K674-V676 VanDerWaalsContact C-N 3.27Å; K674-V676 WeakPolarHBondContact O-CG2 3.33Å; K674-V676 PolarHBondContact O-N 2.9Å
677	D	42.8	Very low	60.7	Low	136 Å²	136	97.9 Å²	97.9	73%	0.727	52%	0.523	S	S	*	.			trans	-51.4	143.6	168.8	-79.6	-31.9	0	0	0	107.5	A675 S679	A675-D677 PolarHBondContact O-N 3.2Å; D677-S679 PolarHBondContact O-N 3.48Å
678	I	54.3	Low	62.3	Low	98 Å²	98	96.2 Å²	96.2	50%	0.503	50%	0.498	S	S	.	.			trans	-60.6	92	178.3	-58.1	163.3	0	0	0	107	N421 F680	N421-I678 WeakPolarHBondContact OD1-CA 3.43Å; N421-I678 WeakPolarHBondContact OD1-CG1 3.3Å; I678-F680 PolarHBondContact O-N 2.6Å; I678-F680 VanDerWaalsContact O-N 3.17Å
679	S	57.7	Low	64.2	Low	88 Å²	88	101.2 Å²	101.2	62%	0.615	52%	0.515	S	S	*	.			trans	-74.5	108.4	177.6	48.5	0	0	0	0	106.7	D677 A681	D677-S679 PolarHBondContact O-N 3.48Å; S679-A681 PolarHBondContact O-N 3.35Å
680	F	72.2	Confident	66.3	Low	54 Å²	54	95.7 Å²	95.7	24%	0.237	49%	0.491	C	S	.	.			trans	-62.6	136.6	168.6	-68.7	-92.4	0	0	0	108.3	I678 A682 Q687 Y776 Q777	I678-F680 PolarHBondContact O-N 2.6Å; I678-F680 VanDerWaalsContact O-N 3.17Å; F680-A682 PolarHBondContact O-N 3.43Å; F680-Q687 VanDerWaalsContact CB-NE2 3.27Å; F680-Y776 VanDerWaalsContact CE1-C 3.49Å; F680-Q777 HydrophobicContact CD2-CG 3.69Å; F680-Q777 HydrophobicContact CE1-CG 4.22Å; F680-Q777 HydrophobicContact CE2-CG 3.33Å; F680-Q777 HydrophobicContact CG-CG 4.28Å; F680-Q777 HydrophobicContact CZ-CB 4.47Å; F680-Q777 HydrophobicContact CZ-CG 3.62Å
681	A	74.8	Confident	68.7	Low	36 Å²	36	86 Å²	86	30%	0.298	45%	0.449	S	S	.	.	S	Bend	trans	-61.8	-32.8	-179.4	0	0	0	0	0	112	R452 S679	R452-A681 WeakPolarHBondContact O-CB 3.1Å; S679-A681 PolarHBondContact O-N 3.35Å
682	A	81.7	Confident	71.1	Confident	6 Å²	6	82.5 Å²	82.5	5%	0.05	42%	0.424	C	S	.	.	S	Bend	trans	-96.1	148.7	177.6	0	0	0	0	0	114.1	L451 M455 F680 Q687	L451-A682 WeakPolarHBondContact O-CB 3.28Å; M455-A682 HydrophobicContact CE-CB 3.77Å; F680-A682 PolarHBondContact O-N 3.43Å; A682-Q687 HydrophobicContact CB-CG 3.79Å; A682-Q687 PolarHBondContact O-NE2 3.26Å
683	S	86.4	Confident	73.7	Confident	61 Å²	61	81.4 Å²	81.4	43%	0.427	42%	0.416	S	S	.	.			trans	-70.7	149.9	172.4	64.1	0	0	0	0	110.5	F685 R686 Q687	S683-F685 VanDerWaalsContact C-N 3.3Å; S683-F685 PolarHBondContact O-N 2.85Å; S683-R686 PolarHBondContact O-N 3.42Å; S683-R686 VanDerWaalsContact O-N 3.09Å; S683-R686 WeakPolarHBondContact OG-CB 3.48Å; S683-Q687 WeakPolarHBondContact O-CG 3.43Å; S683-Q687 PolarHBondContact O-N 3.41Å
684	Y	88.8	Confident	76.1	Confident	91 Å²	91	75.1 Å²	75.1	36%	0.357	38%	0.381	S	S	.	.	H	α-helix	trans	-51.8	-45.9	-176.5	-179	-93.9	0	0	0	113.2	R686 Q687 L688 V780 F783	Y684-R686 PolarHBondContact O-N 2.96Å; Y684-Q687 WeakPolarHBondContact O-CB 3.5Å; Y684-Q687 PolarHBondContact O-N 2.87Å; Y684-L688 PolarHBondContact O-N 3.3Å; Y684-V780 HydrophobicContact CD2-CG2 3.53Å; Y684-V780 HydrophobicContact CE2-CG2 3.31Å; Y684-V780 HydrophobicContact CG-CG2 4.34Å; Y684-F783 WeakPolarHBondContact OH-CD2 3.3Å
685	F	90.5	Very high	78.7	Confident	158 Å²	158	67.4 Å²	67.4	69%	0.693	35%	0.35	S	S	*	.	H	α-helix	trans	-67.6	-36.4	-178.8	-171.2	-102.9	0	0	0	113	S683 L688 K689	S683-F685 VanDerWaalsContact C-N 3.3Å; S683-F685 PolarHBondContact O-N 2.85Å; F685-L688 PolarHBondContact O-N 3.47Å; F685-K689 WeakPolarHBondContact O-CB 3.21Å; F685-K689 PolarHBondContact O-N 2.91Å
686	R	88.8	Confident	81.4	Confident	53 Å²	53	67.6 Å²	67.6	20%	0.2	34%	0.34	C	S	.	.	H	α-helix	trans	-67.1	-41.5	174.3	-175.1	-174.9	178.9	131.9	9.6	111.1	A450 M455 R462 S683 Y684 L688 K689 K690	A450-R686 PolarHBondContact O-NE 3.24Å; M455-R686 HydrophobicContact CE-CB 4.2Å; M455-R686 HydrophobicContact CE-CG 4.36Å; R462-R686 VanDerWaalsContact CZ-CZ 3.46Å; R462-R686 VanDerWaalsContact CZ-NH1 3.29Å; R462-R686 VanDerWaalsContact NE-NH2 3.16Å; R462-R686 VanDerWaalsContact NH2-NH1 3.12Å; S683-R686 PolarHBondContact O-N 3.42Å; S683-R686 VanDerWaalsContact O-N 3.09Å; S683-R686 WeakPolarHBondContact OG-CB 3.48Å; Y684-R686 PolarHBondContact O-N 2.96Å; R686-L688 VanDerWaalsContact C-N 3.33Å; R686-K689 PolarHBondContact O-N 3.29Å; R686-K690 WeakPolarHBondContact O-CB 3.23Å; R686-K690 PolarHBondContact O-N 3.39Å
687	Q	92.5	Very high	83.8	Confident	1 Å²	1	64 Å²	64	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-56.3	-51.7	173.7	-63.4	174.7	25.1	0	0	109.8	L451 F680 A682 S683 Y684 K689 K690 V691 Q777 V780	L451-Q687 HydrophobicContact CD2-CB 4.13Å; L451-Q687 HydrophobicContact CD2-CG 4.09Å; F680-Q687 VanDerWaalsContact CB-NE2 3.27Å; A682-Q687 HydrophobicContact CB-CG 3.79Å; A682-Q687 PolarHBondContact O-NE2 3.26Å; S683-Q687 WeakPolarHBondContact O-CG 3.43Å; S683-Q687 PolarHBondContact O-N 3.41Å; Y684-Q687 WeakPolarHBondContact O-CB 3.5Å; Y684-Q687 PolarHBondContact O-N 2.87Å; Q687-K689 PolarHBondContact O-N 3.04Å; Q687-K690 PolarHBondContact O-N 3.49Å; Q687-V691 VanDerWaalsContact O-CG2 3.26Å; Q687-V691 WeakPolarHBondContact O-CG2 3.39Å; Q687-V691 PolarHBondContact O-N 3.13Å; Q687-Q777 VanDerWaalsContact OE1-N 3.11Å; Q687-V780 HydrophobicContact CB-CB 4.46Å; Q687-V780 HydrophobicContact CB-CG1 3.91Å; Q687-V780 HydrophobicContact CB-CG2 3.94Å
688	L	93.6	Very high	85.9	Confident	33 Å²	33	58.5 Å²	58.5	17%	0.173	29%	0.288	C	S	.	.	H	α-helix	trans	-58.6	-50.9	178.9	-173.1	65.2	0	0	0	112.5	Y684 F685 R686 K690 V691 C692 V780 F783	Y684-L688 PolarHBondContact O-N 3.3Å; F685-L688 PolarHBondContact O-N 3.47Å; R686-L688 VanDerWaalsContact C-N 3.33Å; L688-K690 VanDerWaalsContact C-N 3.29Å; L688-K690 PolarHBondContact O-N 3.38Å; L688-V691 PolarHBondContact O-N 3.09Å; L688-C692 VanDerWaalsContact O-CB 3.24Å; L688-C692 WeakPolarHBondContact O-CB 3.48Å; L688-C692 PolarHBondContact O-N 3.28Å; L688-C692 PolarHBondContact O-SG 3.15Å; L688-V780 HydrophobicContact CB-CG1 4.17Å; L688-V780 HydrophobicContact CD1-CG1 4.22Å; L688-F783 HydrophobicContact CD1-CB 4.29Å
689	K	94.3	Very high	87.4	Confident	144 Å²	144	55.5 Å²	55.5	63%	0.626	27%	0.273	S	S	*	.	H	α-helix	trans	-56.8	-42.4	179.4	-175	175.7	-179.3	176.3	0	112.3	F685 R686 Q687 W693	F685-K689 WeakPolarHBondContact O-CB 3.21Å; F685-K689 PolarHBondContact O-N 2.91Å; R686-K689 PolarHBondContact O-N 3.29Å; Q687-K689 PolarHBondContact O-N 3.04Å; K689-W693 VanDerWaalsContact O-CB 3.32Å; K689-W693 WeakPolarHBondContact O-CB 3.23Å; K689-W693 PolarHBondContact O-N 3.15Å
690	K	93.6	Very high	88.8	Confident	79 Å²	79	57.3 Å²	57.3	34%	0.343	28%	0.275	S	S	.	.	H	α-helix	trans	-75.4	-38.5	-177.9	-73.5	-70.1	-178.7	-179.8	0	113	F447 A450 L451 R686 Q687 L688 R694	F447-K690 HydrophobicContact CE2-CB 4.48Å; A450-K690 HydrophobicContact CB-CD 3.91Å; A450-K690 HydrophobicContact CB-CG 3.94Å; L451-K690 HydrophobicContact CD2-CB 4.08Å; R686-K690 WeakPolarHBondContact O-CB 3.23Å; R686-K690 PolarHBondContact O-N 3.39Å; Q687-K690 PolarHBondContact O-N 3.49Å; L688-K690 VanDerWaalsContact C-N 3.29Å; L688-K690 PolarHBondContact O-N 3.38Å; K690-R694 PolarHBondContact O-N 3.22Å
691	V	94	Very high	89.6	Confident	1 Å²	1	58 Å²	58	1%	0.006	28%	0.276	C	S	.	.	H	α-helix	trans	-66.9	-43.7	174.1	-178.5	0	0	0	0	110	F447 L451 Q687 L688 W693 R694 S695 Y776 V780 S784	F447-V691 HydrophobicContact CE2-CG2 4.32Å; F447-V691 HydrophobicContact CZ-CG2 4.13Å; L451-V691 HydrophobicContact CD1-CG2 4.43Å; Q687-V691 VanDerWaalsContact O-CG2 3.26Å; Q687-V691 WeakPolarHBondContact O-CG2 3.39Å; Q687-V691 PolarHBondContact O-N 3.13Å; L688-V691 PolarHBondContact O-N 3.09Å; V691-W693 PolarHBondContact O-N 3.5Å; V691-R694 WeakPolarHBondContact O-CB 3.27Å; V691-R694 PolarHBondContact O-N 3.15Å; V691-S695 PolarHBondContact O-N 2.86Å; V691-S695 PolarHBondContact O-OG 3.05Å; V691-S695 VanDerWaalsContact O-OG 3.05Å; V691-Y776 HydrophobicContact CG2-CD1 3.61Å; V691-Y776 HydrophobicContact CG2-CE1 4.03Å; V691-Y776 HydrophobicContact CG2-CG 4.08Å; V691-V780 HydrophobicContact CB-CG1 4.21Å; V691-V780 HydrophobicContact CG2-CG1 3.97Å; V691-S784 WeakPolarHBondContact CG1-OG 3.25Å
692	C	93.9	Very high	89.8	Confident	19 Å²	19	59.5 Å²	59.5	13%	0.128	28%	0.279	C	S	.	.	H	α-helix	trans	-59.3	-46.6	174.3	-70.8	0	0	0	0	112.6	L688 R694 S695 I696 S784 C788	L688-C692 VanDerWaalsContact O-CB 3.24Å; L688-C692 WeakPolarHBondContact O-CB 3.48Å; L688-C692 PolarHBondContact O-N 3.28Å; L688-C692 PolarHBondContact O-SG 3.15Å; C692-R694 VanDerWaalsContact C-N 3.3Å; C692-R694 PolarHBondContact O-N 3.49Å; C692-S695 PolarHBondContact O-N 3.39Å; C692-I696 WeakPolarHBondContact O-CG1 3.46Å; C692-I696 PolarHBondContact O-N 2.9Å; C692-S784 VanDerWaalsContact CA-OG 3.25Å; C692-S784 WeakPolarHBondContact CA-OG 3.46Å; C692-S784 PolarHBondContact N-OG 3.45Å; C692-S784 VanDerWaalsContact N-OG 3.16Å; C692-S784 PolarHBondContact SG-OG 3.49Å; C692-C788 WeakPolarHBondContact CB-SG 3.27Å; C692-C788 PolarHBondContact SG-SG 3.34Å
693	W	94.6	Very high	89.5	Confident	154 Å²	154	62.3 Å²	62.3	58%	0.583	30%	0.297	S	S	*	.	H	α-helix	trans	-54	-47.9	174	167.2	-101.9	0	0	0	111.6	K689 V691 I696 L697	K689-W693 VanDerWaalsContact O-CB 3.32Å; K689-W693 WeakPolarHBondContact O-CB 3.23Å; K689-W693 PolarHBondContact O-N 3.15Å; V691-W693 PolarHBondContact O-N 3.5Å; W693-I696 PolarHBondContact O-N 3.45Å; W693-L697 HydrophobicContact CZ2-CD2 4.3Å; W693-L697 VanDerWaalsContact O-CB 3.31Å; W693-L697 WeakPolarHBondContact O-CB 3.38Å; W693-L697 PolarHBondContact O-N 2.65Å
694	R	93.4	Very high	89.1	Confident	15 Å²	15	64.9 Å²	64.9	6%	0.057	31%	0.305	C	S	.	.	H	α-helix	trans	-62.6	-43.7	178.3	-177.9	179.1	69.1	171.4	1.8	112	L439 F447 K690 V691 C692 L697 N698 E770	L439-R694 HydrophobicContact CD1-CG 4.31Å; L439-R694 HydrophobicContact CD2-CG 3.95Å; F447-R694 HydrophobicContact CD2-CB 4.17Å; F447-R694 HydrophobicContact CE2-CB 3.96Å; F447-R694 HydrophobicContact CE2-CG 4.48Å; K690-R694 PolarHBondContact O-N 3.22Å; V691-R694 WeakPolarHBondContact O-CB 3.27Å; V691-R694 PolarHBondContact O-N 3.15Å; C692-R694 VanDerWaalsContact C-N 3.3Å; C692-R694 PolarHBondContact O-N 3.49Å; R694-L697 PolarHBondContact O-N 3.3Å; R694-N698 WeakPolarHBondContact O-CB 3.09Å; R694-N698 PolarHBondContact O-N 3.16Å; R694-E770 IonicContact CZ-OE1 3.45Å; R694-E770 IonicContact CZ-OE2 3.47Å; R694-E770 VanDerWaalsContact NH1-CD 3.33Å; R694-E770 IonicContact NH1-OE1 3.49Å; R694-E770 PolarHBondContact NH1-OE1 3.08Å; R694-E770 IonicContact NH1-OE2 2.64Å; R694-E770 PolarHBondContact NH1-OE2 2.81Å; R694-E770 IonicContact NH2-OE1 2.93Å; R694-E770 IonicContact NH2-OE2 2.68Å; R694-E770 PolarHBondContact NH2-OE2 3.5Å
695	S	90.7	Very high	88.4	Confident	23 Å²	23	62.5 Å²	62.5	16%	0.161	30%	0.304	C	S	.	.	H	α-helix	trans	-62.6	-44.1	179.4	-58.1	0	0	0	0	111.9	V691 C692 N698 L699 S784	V691-S695 PolarHBondContact O-N 2.86Å; V691-S695 PolarHBondContact O-OG 3.05Å; V691-S695 VanDerWaalsContact O-OG 3.05Å; C692-S695 PolarHBondContact O-N 3.39Å; S695-N698 WeakPolarHBondContact O-CB 3.45Å; S695-N698 PolarHBondContact O-N 3.33Å; S695-L699 PolarHBondContact O-N 3.07Å; S695-S784 PolarHBondContact OG-OG 3.07Å
696	I	90.3	Very high	87.7	Confident	75 Å²	75	56.2 Å²	56.2	39%	0.385	28%	0.28	S	S	.	.	H	α-helix	trans	-64.8	-45.7	176.4	-65.6	169.6	0	0	0	110.6	C692 W693 N698 L699 L700 C788	C692-I696 WeakPolarHBondContact O-CG1 3.46Å; C692-I696 PolarHBondContact O-N 2.9Å; W693-I696 PolarHBondContact O-N 3.45Å; I696-N698 VanDerWaalsContact C-N 3.26Å; I696-N698 PolarHBondContact O-N 2.94Å; I696-L699 WeakPolarHBondContact O-CB 3.4Å; I696-L699 PolarHBondContact O-N 3.27Å; I696-L700 HydrophobicContact CG2-CD1 4.11Å; I696-L700 HydrophobicContact CG2-CG 4.5Å; I696-L700 WeakPolarHBondContact O-CG 3.22Å; I696-L700 PolarHBondContact O-N 2.91Å; I696-C788 HydrophobicContact CD1-CB 4.4Å; I696-C788 HydrophobicContact CG1-CB 3.89Å
697	L	91	Very high	87.5	Confident	19 Å²	19	57 Å²	57	10%	0.099	29%	0.291	C	S	.	.	H	α-helix	trans	-62.2	-37.4	178.9	-172.8	62.6	0	0	0	111.7	L439 W693 R694 L700 R701	L439-L697 HydrophobicContact CG-CD2 4.49Å; W693-L697 HydrophobicContact CZ2-CD2 4.3Å; W693-L697 VanDerWaalsContact O-CB 3.31Å; W693-L697 WeakPolarHBondContact O-CB 3.38Å; W693-L697 PolarHBondContact O-N 2.65Å; R694-L697 PolarHBondContact O-N 3.3Å; L697-L700 PolarHBondContact O-N 3.27Å; L697-R701 HydrophobicContact CD1-CG 4.41Å; L697-R701 WeakPolarHBondContact O-CB 3.49Å; L697-R701 VanDerWaalsContact O-CG 3.31Å; L697-R701 WeakPolarHBondContact O-CG 3.47Å; L697-R701 PolarHBondContact O-N 3.46Å; L697-R701 VanDerWaalsContact O-N 3.07Å
698	N	87.8	Confident	87.1	Confident	20 Å²	20	61.4 Å²	61.4	11%	0.107	31%	0.313	C	S	.	.	H	α-helix	trans	-62.3	-48.1	173.8	-173.6	55.1	0	0	0	111.4	M436 T438 R694 S695 I696 L700 R701 D702	M436-N698 HydrophobicContact CE-CB 3.97Å; M436-N698 WeakPolarHBondContact CE-ND2 3.5Å; M436-N698 WeakPolarHBondContact CE-OD1 3.38Å; T438-N698 WeakPolarHBondContact CB-OD1 3.28Å; T438-N698 VanDerWaalsContact CG2-OD1 3.22Å; T438-N698 WeakPolarHBondContact CG2-OD1 3.2Å; T438-N698 PolarHBondContact OG1-OD1 2.96Å; R694-N698 WeakPolarHBondContact O-CB 3.09Å; R694-N698 PolarHBondContact O-N 3.16Å; S695-N698 WeakPolarHBondContact O-CB 3.45Å; S695-N698 PolarHBondContact O-N 3.33Å; I696-N698 VanDerWaalsContact C-N 3.26Å; I696-N698 PolarHBondContact O-N 2.94Å; N698-L700 VanDerWaalsContact C-N 3.27Å; N698-L700 PolarHBondContact O-N 3.15Å; N698-R701 PolarHBondContact O-N 3.41Å; N698-R701 VanDerWaalsContact O-N 3.11Å; N698-D702 PolarHBondContact O-N 3.35Å
699	L	84.5	Confident	86.5	Confident	35 Å²	35	61.4 Å²	61.4	18%	0.183	31%	0.312	C	S	.	.	H	α-helix	trans	-58.8	-38.4	178.8	-179.7	61.4	0	0	0	112.4	S695 I696 P792 T793	S695-L699 PolarHBondContact O-N 3.07Å; I696-L699 WeakPolarHBondContact O-CB 3.4Å; I696-L699 PolarHBondContact O-N 3.27Å; L699-P792 HydrophobicContact CD2-CB 4.14Å; L699-T793 HydrophobicContact CD1-CG2 3.42Å; L699-T793 VanDerWaalsContact CD1-CG2 3.42Å; L699-T793 HydrophobicContact CD2-CG2 4Å; L699-T793 HydrophobicContact CG-CG2 4.37Å
700	L	87	Confident	86	Confident	127 Å²	127	56.4 Å²	56.4	67%	0.665	29%	0.294	S	S	*	.	H	α-helix	trans	-73.7	-29.3	177.5	-67.3	174.3	0	0	0	113.3	I696 L697 N698	I696-L700 HydrophobicContact CG2-CD1 4.11Å; I696-L700 HydrophobicContact CG2-CG 4.5Å; I696-L700 WeakPolarHBondContact O-CG 3.22Å; I696-L700 PolarHBondContact O-N 2.91Å; L697-L700 PolarHBondContact O-N 3.27Å; N698-L700 VanDerWaalsContact C-N 3.27Å; N698-L700 PolarHBondContact O-N 3.15Å
701	R	88.4	Confident	85.8	Confident	69 Å²	69	57.4 Å²	57.4	26%	0.26	30%	0.302	S	S	.	.	H	α-helix	trans	-94.3	-20	-175.3	-74.2	-177.2	176.8	175.7	6.2	114.6	T438 E443 L697 N698 P703	T438-R701 VanDerWaalsContact O-CD 3.26Å; T438-R701 WeakPolarHBondContact O-CD 3.25Å; T438-R701 PolarHBondContact O-NH1 3.25Å; T438-R701 VanDerWaalsContact O-NH1 3.08Å; E443-R701 IonicContact OE1-CZ 3.7Å; E443-R701 IonicContact OE1-NH1 2.67Å; E443-R701 PolarHBondContact OE1-NH1 3.32Å; E443-R701 IonicContact OE1-NH2 2.91Å; E443-R701 PolarHBondContact OE1-NH2 3.32Å; E443-R701 IonicContact OE2-CZ 3.15Å; E443-R701 IonicContact OE2-NH1 2.76Å; E443-R701 PolarHBondContact OE2-NH1 2.83Å; E443-R701 IonicContact OE2-NH2 3.34Å; E443-R701 PolarHBondContact OE2-NH2 2.88Å; L697-R701 HydrophobicContact CD1-CG 4.41Å; L697-R701 WeakPolarHBondContact O-CB 3.49Å; L697-R701 VanDerWaalsContact O-CG 3.31Å; L697-R701 WeakPolarHBondContact O-CG 3.47Å; L697-R701 PolarHBondContact O-N 3.46Å; L697-R701 VanDerWaalsContact O-N 3.07Å; N698-R701 PolarHBondContact O-N 3.41Å; N698-R701 VanDerWaalsContact O-N 3.11Å; R701-P703 VanDerWaalsContact O-CD 3.23Å; R701-P703 WeakPolarHBondContact O-CD 3.3Å
702	D	79.7	Confident	85.7	Confident	66 Å²	66	60.3 Å²	60.3	35%	0.353	32%	0.32	S	S	.	.			trans	-113.1	70.2	170.7	-169	9	0	0	0	110	T438 N698 L704	T438-D702 HydrophobicContact CG2-CB 4.15Å; N698-D702 PolarHBondContact O-N 3.35Å; D702-L704 PolarHBondContact O-N 3.25Å
703	P	75.7	Confident	85.6	Confident	66 Å²	66	59.4 Å²	59.4	43%	0.429	31%	0.314	S	S	.	.	H	α-helix	trans	-69.6	-18.3	-174.6	30.3	-36.6	0	0	0	111.9	R701 A705 S706 V707	R701-P703 VanDerWaalsContact O-CD 3.23Å; R701-P703 WeakPolarHBondContact O-CD 3.3Å; P703-A705 VanDerWaalsContact C-N 3.32Å; P703-A705 PolarHBondContact O-N 3.19Å; P703-S706 PolarHBondContact O-N 3.1Å; P703-S706 VanDerWaalsContact O-N 3.1Å; P703-V707 HydrophobicContact CB-CG2 3.8Å; P703-V707 WeakPolarHBondContact O-CB 3.44Å; P703-V707 VanDerWaalsContact O-CG2 3.23Å; P703-V707 WeakPolarHBondContact O-CG2 3.43Å; P703-V707 PolarHBondContact O-N 2.84Å
704	L	78.5	Confident	85.5	Confident	115 Å²	115	55.2 Å²	55.2	60%	0.602	30%	0.302	S	S	*	.	H	α-helix	trans	-56.7	-46.3	-171.5	-172.6	149.5	0	0	0	111.4	D702 S706 I708	D702-L704 PolarHBondContact O-N 3.25Å; L704-S706 PolarHBondContact O-N 3.24Å; L704-I708 HydrophobicContact CD2-CD1 3.57Å; L704-I708 HydrophobicContact CG-CD1 3.91Å; L704-I708 WeakPolarHBondContact O-CB 3.49Å; L704-I708 WeakPolarHBondContact O-CD1 3.41Å; L704-I708 WeakPolarHBondContact O-CG1 3.32Å; L704-I708 PolarHBondContact O-N 3.35Å
705	A	73	Confident	85.5	Confident	40 Å²	40	61.8 Å²	61.8	33%	0.331	33%	0.332	S	S	.	.	H	α-helix	trans	-68.1	-36.2	179.9	0	0	0	0	0	113.3	P703 Q709	P703-A705 VanDerWaalsContact C-N 3.32Å; P703-A705 PolarHBondContact O-N 3.19Å; A705-Q709 WeakPolarHBondContact O-CG 3.28Å; A705-Q709 PolarHBondContact O-NE2 3.18Å
706	S	77.2	Confident	85.7	Confident	27 Å²	27	61.7 Å²	61.7	19%	0.189	33%	0.328	C	S	.	.	H	α-helix	trans	-81.4	-43.1	-177	-171.9	0	0	0	0	112.4	P703 L704 Q709 T710	P703-S706 PolarHBondContact O-N 3.1Å; P703-S706 VanDerWaalsContact O-N 3.1Å; L704-S706 PolarHBondContact O-N 3.24Å; S706-Q709 PolarHBondContact O-N 2.84Å; S706-T710 WeakPolarHBondContact O-CB 3.21Å; S706-T710 PolarHBondContact O-N 2.91Å; S706-T710 PolarHBondContact O-OG1 3.12Å
707	V	83.8	Confident	86	Confident	70 Å²	70	58.1 Å²	58.1	42%	0.424	31%	0.31	S	S	.	.	H	α-helix	trans	-66.5	-44.4	-178.7	171.5	0	0	0	0	110.8	P703 Q709 T710 I711	P703-V707 HydrophobicContact CB-CG2 3.8Å; P703-V707 WeakPolarHBondContact O-CB 3.44Å; P703-V707 VanDerWaalsContact O-CG2 3.23Å; P703-V707 WeakPolarHBondContact O-CG2 3.43Å; P703-V707 PolarHBondContact O-N 2.84Å; V707-Q709 VanDerWaalsContact C-N 3.3Å; V707-Q709 PolarHBondContact O-N 3.42Å; V707-T710 WeakPolarHBondContact O-CB 3.31Å; V707-T710 PolarHBondContact O-N 3.32Å; V707-I711 HydrophobicContact CG1-CD1 3.66Å; V707-I711 HydrophobicContact CG1-CG1 4.26Å; V707-I711 WeakPolarHBondContact O-CG1 3.4Å; V707-I711 PolarHBondContact O-N 3.37Å
708	I	84.3	Confident	86.2	Confident	92 Å²	92	60.5 Å²	60.5	47%	0.472	32%	0.322	S	S	.	.	H	α-helix	trans	-58.5	-44.7	177.2	-69.1	171.8	0	0	0	110.5	L704 T710 I711 V712	L704-I708 HydrophobicContact CD2-CD1 3.57Å; L704-I708 HydrophobicContact CG-CD1 3.91Å; L704-I708 WeakPolarHBondContact O-CB 3.49Å; L704-I708 WeakPolarHBondContact O-CD1 3.41Å; L704-I708 WeakPolarHBondContact O-CG1 3.32Å; L704-I708 PolarHBondContact O-N 3.35Å; I708-T710 PolarHBondContact O-N 3.43Å; I708-I711 PolarHBondContact O-N 3.39Å; I708-V712 VanDerWaalsContact O-CG2 3.28Å; I708-V712 WeakPolarHBondContact O-CG2 3.29Å; I708-V712 PolarHBondContact O-N 3.26Å
709	Q	80.5	Confident	86.5	Confident	33 Å²	33	61.3 Å²	61.3	15%	0.154	33%	0.33	C	S	.	.	H	α-helix	trans	-64.7	-41.1	178.4	-68.9	175.9	35.5	0	0	112	A705 S706 V707 V712 Y713	A705-Q709 WeakPolarHBondContact O-CG 3.28Å; A705-Q709 PolarHBondContact O-NE2 3.18Å; S706-Q709 PolarHBondContact O-N 2.84Å; V707-Q709 VanDerWaalsContact C-N 3.3Å; V707-Q709 PolarHBondContact O-N 3.42Å; Q709-V712 PolarHBondContact O-N 2.92Å; Q709-Y713 VanDerWaalsContact O-CD2 3.24Å; Q709-Y713 WeakPolarHBondContact O-CD2 3.25Å; Q709-Y713 PolarHBondContact O-N 3.12Å
710	T	84.5	Confident	87	Confident	40 Å²	40	61.1 Å²	61.1	25%	0.245	33%	0.328	C	S	.	.	H	α-helix	trans	-60.2	-45.1	176.3	-59.7	0	0	0	0	111.3	S706 V707 I708 Y713 L714 F801	S706-T710 WeakPolarHBondContact O-CB 3.21Å; S706-T710 PolarHBondContact O-N 2.91Å; S706-T710 PolarHBondContact O-OG1 3.12Å; V707-T710 WeakPolarHBondContact O-CB 3.31Å; V707-T710 PolarHBondContact O-N 3.32Å; I708-T710 PolarHBondContact O-N 3.43Å; T710-Y713 PolarHBondContact O-N 2.97Å; T710-L714 PolarHBondContact O-N 3.44Å; T710-F801 HydrophobicContact CG2-CE2 3.39Å; T710-F801 HydrophobicContact CG2-CZ 3.69Å; T710-F801 WeakPolarHBondContact O-CE2 3.49Å
711	I	89.7	Confident	87.3	Confident	99 Å²	99	55 Å²	55	51%	0.508	30%	0.296	S	S	.	.	H	α-helix	trans	-64.9	-40.8	177.5	-68.1	168.6	0	0	0	111.6	V707 I708 Y713 L714 F715	V707-I711 HydrophobicContact CG1-CD1 3.66Å; V707-I711 HydrophobicContact CG1-CG1 4.26Å; V707-I711 WeakPolarHBondContact O-CG1 3.4Å; V707-I711 PolarHBondContact O-N 3.37Å; I708-I711 PolarHBondContact O-N 3.39Å; I711-Y713 VanDerWaalsContact C-N 3.27Å; I711-Y713 PolarHBondContact O-N 3.32Å; I711-L714 WeakPolarHBondContact O-CB 3.48Å; I711-L714 PolarHBondContact O-N 2.97Å; I711-F715 PolarHBondContact O-N 3.5Å
712	V	91.1	Very high	87.7	Confident	63 Å²	63	57.2 Å²	57.2	38%	0.382	31%	0.312	S	S	.	.	H	α-helix	trans	-59.6	-39.5	177.1	168.5	0	0	0	0	111.2	I708 Q709 F716	I708-V712 VanDerWaalsContact O-CG2 3.28Å; I708-V712 WeakPolarHBondContact O-CG2 3.29Å; I708-V712 PolarHBondContact O-N 3.26Å; Q709-V712 PolarHBondContact O-N 2.92Å; V712-F716 VanDerWaalsContact O-CB 3.28Å; V712-F716 WeakPolarHBondContact O-CB 3.08Å; V712-F716 PolarHBondContact O-N 3.32Å
713	Y	91.6	Very high	88.4	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-67	-39.5	175.3	-83.8	-69.9	0	0	0	113.2	Q709 T710 I711 F716 A717 Q748 V749 V752 P797 I798 M802	Q709-Y713 VanDerWaalsContact O-CD2 3.24Å; Q709-Y713 WeakPolarHBondContact O-CD2 3.25Å; Q709-Y713 PolarHBondContact O-N 3.12Å; T710-Y713 PolarHBondContact O-N 2.97Å; I711-Y713 VanDerWaalsContact C-N 3.27Å; I711-Y713 PolarHBondContact O-N 3.32Å; Y713-F716 PolarHBondContact O-N 3.34Å; Y713-A717 VanDerWaalsContact O-CB 3.28Å; Y713-A717 WeakPolarHBondContact O-CB 3.13Å; Y713-A717 PolarHBondContact O-N 2.9Å; Y713-Q748 HydrophobicContact CE1-CG 4.24Å; Y713-V749 HydrophobicContact CE1-CG2 4.41Å; Y713-V752 HydrophobicContact CE2-CB 4.46Å; Y713-V752 HydrophobicContact CE2-CG1 3.84Å; Y713-V752 HydrophobicContact CE2-CG2 4.31Å; Y713-P797 HydrophobicContact CD2-CB 3.31Å; Y713-P797 HydrophobicContact CD2-CG 4.14Å; Y713-P797 HydrophobicContact CE2-CB 3.85Å; Y713-P797 HydrophobicContact CE2-CG 4.42Å; Y713-P797 HydrophobicContact CG-CB 3.83Å; Y713-I798 HydrophobicContact CE1-CG1 4.14Å; Y713-M802 HydrophobicContact CD1-CE 3.65Å; Y713-M802 HydrophobicContact CE1-CE 3.87Å
714	L	93.2	Very high	89.3	Confident	65 Å²	65	57.4 Å²	57.4	34%	0.34	31%	0.311	S	S	.	.	H	α-helix	trans	-60.5	-49.5	174.6	174.9	62.3	0	0	0	111.3	T710 I711 F716 A717 L718 F801 I804	T710-L714 PolarHBondContact O-N 3.44Å; I711-L714 WeakPolarHBondContact O-CB 3.48Å; I711-L714 PolarHBondContact O-N 2.97Å; L714-F716 PolarHBondContact O-N 2.68Å; L714-A717 PolarHBondContact O-N 3.2Å; L714-L718 HydrophobicContact CD1-CD1 3.97Å; L714-L718 HydrophobicContact CD1-CG 4.27Å; L714-L718 HydrophobicContact CG-CD1 4.19Å; L714-L718 WeakPolarHBondContact O-CG 3.4Å; L714-L718 PolarHBondContact O-N 3.36Å; L714-F801 HydrophobicContact CB-CD1 3.82Å; L714-F801 HydrophobicContact CB-CE1 3.85Å; L714-F801 HydrophobicContact CB-CG 4.19Å; L714-F801 HydrophobicContact CB-CZ 4.24Å; L714-F801 HydrophobicContact CD1-CD1 3.66Å; L714-F801 HydrophobicContact CD1-CE1 3.84Å; L714-F801 HydrophobicContact CD2-CE1 4.44Å; L714-F801 HydrophobicContact CG-CD1 4.3Å; L714-F801 HydrophobicContact CG-CE1 4.24Å; L714-I804 HydrophobicContact CD1-CD1 4.1Å
715	F	94.3	Very high	90	Very high	154 Å²	154	57.6 Å²	57.6	68%	0.675	31%	0.307	S	S	*	.	H	α-helix	trans	-62.5	-44.1	178.7	-177.2	-98.6	0	0	0	111.6	I711 L718 S719	I711-F715 PolarHBondContact O-N 3.5Å; F715-L718 PolarHBondContact O-N 3.28Å; F715-S719 WeakPolarHBondContact O-CB 3.23Å; F715-S719 PolarHBondContact O-N 3.26Å; F715-S719 PolarHBondContact O-OG 2.6Å
716	F	94.5	Very high	90.9	Very high	20 Å²	20	62.1 Å²	62.1	9%	0.088	32%	0.321	C	S	.	.	H	α-helix	trans	-59.9	-49.4	176.6	-177.5	-91.3	0	0	0	111.7	V712 Y713 L714 L718 S719 M720 F744 Q748 M802	V712-F716 VanDerWaalsContact O-CB 3.28Å; V712-F716 WeakPolarHBondContact O-CB 3.08Å; V712-F716 PolarHBondContact O-N 3.32Å; Y713-F716 PolarHBondContact O-N 3.34Å; L714-F716 PolarHBondContact O-N 2.68Å; F716-L718 VanDerWaalsContact C-N 3.34Å; F716-L718 PolarHBondContact O-N 2.9Å; F716-S719 WeakPolarHBondContact CA-OG 3.38Å; F716-S719 PolarHBondContact O-N 3.49Å; F716-S719 PolarHBondContact O-OG 2.78Å; F716-M720 HydrophobicContact CD1-CG 4.21Å; F716-M720 HydrophobicContact CD2-CE 4.46Å; F716-M720 HydrophobicContact CD2-CG 4.35Å; F716-M720 HydrophobicContact CE1-CB 4.48Å; F716-M720 HydrophobicContact CE1-CG 3.72Å; F716-M720 HydrophobicContact CE2-CE 3.7Å; F716-M720 HydrophobicContact CE2-CG 3.88Å; F716-M720 HydrophobicContact CZ-CE 4.04Å; F716-M720 HydrophobicContact CZ-CG 3.53Å; F716-M720 HydrophobicContact CZ-SD 4.38Å; F716-M720 PolarHBondContact O-N 3.23Å; F716-F744 HydrophobicContact CZ-CB 4.26Å; F716-F744 WeakPolarHBondContact CZ-O 3.45Å; F716-Q748 HydrophobicContact CB-CG 4.36Å; F716-Q748 HydrophobicContact CD1-CB 4.13Å; F716-Q748 HydrophobicContact CD1-CG 3.77Å; F716-Q748 HydrophobicContact CD2-CB 4.02Å; F716-Q748 HydrophobicContact CD2-CG 3.72Å; F716-Q748 HydrophobicContact CE1-CB 3.74Å; F716-Q748 HydrophobicContact CE1-CG 3.94Å; F716-Q748 HydrophobicContact CE2-CB 3.62Å; F716-Q748 HydrophobicContact CE2-CG 3.88Å; F716-Q748 HydrophobicContact CG-CB 4.26Å; F716-Q748 HydrophobicContact CG-CG 3.66Å; F716-Q748 HydrophobicContact CZ-CB 3.47Å; F716-Q748 VanDerWaalsContact CZ-CB 3.47Å; F716-Q748 HydrophobicContact CZ-CG 3.99Å; F716-M802 HydrophobicContact CD1-CE 3.78Å; F716-M802 HydrophobicContact CE1-CE 4.03Å
717	A	94.9	Very high	91.4	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-61.7	-40.3	-179.1	0	0	0	0	0	112.7	Y713 L714 G721 F801 I804 C805	Y713-A717 VanDerWaalsContact O-CB 3.28Å; Y713-A717 WeakPolarHBondContact O-CB 3.13Å; Y713-A717 PolarHBondContact O-N 2.9Å; L714-A717 PolarHBondContact O-N 3.2Å; A717-G721 PolarHBondContact O-N 2.56Å; A717-F801 HydrophobicContact CB-CB 4.16Å; A717-F801 WeakPolarHBondContact CB-O 3.44Å; A717-I804 HydrophobicContact CB-CB 4.43Å; A717-C805 HydrophobicContact CB-CB 4.24Å
718	L	95.5	Very high	91.5	Very high	69 Å²	69	61.5 Å²	61.5	36%	0.361	31%	0.313	S	S	.	.	H	α-helix	trans	-67	-47.4	174.5	-71.1	172.1	0	0	0	111.6	L714 F715 F716 M720 G721 I722 I804 M808	L714-L718 HydrophobicContact CD1-CD1 3.97Å; L714-L718 HydrophobicContact CD1-CG 4.27Å; L714-L718 HydrophobicContact CG-CD1 4.19Å; L714-L718 WeakPolarHBondContact O-CG 3.4Å; L714-L718 PolarHBondContact O-N 3.36Å; F715-L718 PolarHBondContact O-N 3.28Å; F716-L718 VanDerWaalsContact C-N 3.34Å; F716-L718 PolarHBondContact O-N 2.9Å; L718-M720 PolarHBondContact O-N 2.97Å; L718-G721 PolarHBondContact O-N 2.9Å; L718-I722 WeakPolarHBondContact O-CB 3.45Å; L718-I722 WeakPolarHBondContact O-CD1 3.05Å; L718-I722 WeakPolarHBondContact O-CG1 3.49Å; L718-I722 PolarHBondContact O-N 3.49Å; L718-I804 HydrophobicContact CD2-CG2 4.04Å; L718-M808 HydrophobicContact CD2-SD 4.43Å
719	S	95.5	Very high	91.6	Very high	37 Å²	37	60.9 Å²	60.9	26%	0.259	31%	0.311	S	S	.	.	H	α-helix	trans	-60.3	-47.7	-179.6	68.5	0	0	0	0	112	F715 F716 I722 V723	F715-S719 WeakPolarHBondContact O-CB 3.23Å; F715-S719 PolarHBondContact O-N 3.26Å; F715-S719 PolarHBondContact O-OG 2.6Å; F716-S719 WeakPolarHBondContact CA-OG 3.38Å; F716-S719 PolarHBondContact O-N 3.49Å; F716-S719 PolarHBondContact O-OG 2.78Å; S719-I722 PolarHBondContact O-N 2.64Å; S719-V723 VanDerWaalsContact O-CG2 3.27Å; S719-V723 WeakPolarHBondContact O-CG2 3.33Å; S719-V723 PolarHBondContact O-N 3.41Å
720	M	94.6	Very high	91.9	Very high	31 Å²	31	59.8 Å²	59.8	15%	0.153	31%	0.307	C	S	.	.	H	α-helix	trans	-69.8	-36.4	177.8	-69	-62.5	160.2	0	0	112	F716 L718 I722 V723 Y724 L741 F744	F716-M720 HydrophobicContact CD1-CG 4.21Å; F716-M720 HydrophobicContact CD2-CE 4.46Å; F716-M720 HydrophobicContact CD2-CG 4.35Å; F716-M720 HydrophobicContact CE1-CB 4.48Å; F716-M720 HydrophobicContact CE1-CG 3.72Å; F716-M720 HydrophobicContact CE2-CE 3.7Å; F716-M720 HydrophobicContact CE2-CG 3.88Å; F716-M720 HydrophobicContact CZ-CE 4.04Å; F716-M720 HydrophobicContact CZ-CG 3.53Å; F716-M720 HydrophobicContact CZ-SD 4.38Å; F716-M720 PolarHBondContact O-N 3.23Å; L718-M720 PolarHBondContact O-N 2.97Å; M720-I722 VanDerWaalsContact C-N 3.31Å; M720-I722 PolarHBondContact O-N 2.64Å; M720-V723 PolarHBondContact O-N 2.85Å; M720-Y724 WeakPolarHBondContact O-CB 3.49Å; M720-Y724 WeakPolarHBondContact O-CD2 3.37Å; M720-Y724 PolarHBondContact O-N 3.21Å; M720-Y724 HydrophobicContact SD-CD2 4.25Å; M720-Y724 HydrophobicContact SD-CE2 3.87Å; M720-L741 HydrophobicContact CB-CD1 4.23Å; M720-F744 HydrophobicContact CE-CB 4Å; M720-F744 HydrophobicContact CE-CD1 4.49Å; M720-F744 HydrophobicContact CE-CG 4.12Å; M720-F744 HydrophobicContact SD-CB 4.06Å; M720-F744 HydrophobicContact SD-CD2 4.47Å; M720-F744 HydrophobicContact SD-CG 4.41Å
721	G	93.8	Very high	91.9	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-62.9	-34.7	173.8	0	0	0	0	0	113.3	A717 L718 F725	A717-G721 PolarHBondContact O-N 2.56Å; L718-G721 PolarHBondContact O-N 2.9Å; G721-F725 VanDerWaalsContact O-CA 3.27Å; G721-F725 WeakPolarHBondContact O-CA 3.42Å; G721-F725 WeakPolarHBondContact O-CB 3.36Å; G721-F725 PolarHBondContact O-N 3.22Å
722	I	95.2	Very high	91.6	Very high	115 Å²	115	58 Å²	58	59%	0.59	29%	0.294	S	S	*	.	H	α-helix	trans	-75	-47.6	175.3	-67.7	164.3	0	0	0	110.8	L718 S719 M720 Y724 F725 M808	L718-I722 WeakPolarHBondContact O-CB 3.45Å; L718-I722 WeakPolarHBondContact O-CD1 3.05Å; L718-I722 WeakPolarHBondContact O-CG1 3.49Å; L718-I722 PolarHBondContact O-N 3.49Å; S719-I722 PolarHBondContact O-N 2.64Å; M720-I722 VanDerWaalsContact C-N 3.31Å; M720-I722 PolarHBondContact O-N 2.64Å; I722-Y724 VanDerWaalsContact C-N 3.32Å; I722-Y724 PolarHBondContact O-N 3.06Å; I722-F725 WeakPolarHBondContact O-CB 3.41Å; I722-F725 PolarHBondContact O-N 3.43Å; I722-M808 HydrophobicContact CG1-CE 3.89Å
723	V	95.3	Very high	91.5	Very high	106 Å²	106	56.4 Å²	56.4	64%	0.642	29%	0.286	S	S	*	.	H	α-helix	trans	-61.8	-41.3	-178.2	169.8	0	0	0	0	111.5	S719 M720	S719-V723 VanDerWaalsContact O-CG2 3.27Å; S719-V723 WeakPolarHBondContact O-CG2 3.33Å; S719-V723 PolarHBondContact O-N 3.41Å; M720-V723 PolarHBondContact O-N 2.85Å
724	Y	93.6	Very high	91.4	Very high	30 Å²	30	56.4 Å²	56.4	12%	0.118	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	27.5	179.8	-63.9	-76.7	0	0	0	112.6	M720 I722 Q726 M727 N737 L741 F744 A809	M720-Y724 WeakPolarHBondContact O-CB 3.49Å; M720-Y724 WeakPolarHBondContact O-CD2 3.37Å; M720-Y724 PolarHBondContact O-N 3.21Å; M720-Y724 HydrophobicContact SD-CD2 4.25Å; M720-Y724 HydrophobicContact SD-CE2 3.87Å; I722-Y724 VanDerWaalsContact C-N 3.32Å; I722-Y724 PolarHBondContact O-N 3.06Å; Y724-Q726 PolarHBondContact O-N 3.37Å; Y724-Q726 VanDerWaalsContact O-N 3.17Å; Y724-M727 HydrophobicContact CD1-CG 4.47Å; Y724-M727 HydrophobicContact CD1-SD 4.04Å; Y724-M727 HydrophobicContact CG-SD 4.41Å; Y724-M727 VanDerWaalsContact O-CG 3.32Å; Y724-M727 WeakPolarHBondContact O-CG 3.44Å; Y724-N737 HydrophobicContact CD1-CB 3.99Å; Y724-N737 HydrophobicContact CE1-CB 4.12Å; Y724-N737 VanDerWaalsContact CE1-O 3.25Å; Y724-N737 WeakPolarHBondContact CE1-O 3.4Å; Y724-L741 HydrophobicContact CD1-CB 4.32Å; Y724-L741 HydrophobicContact CD2-CB 4.06Å; Y724-L741 HydrophobicContact CD2-CD1 3.69Å; Y724-L741 HydrophobicContact CD2-CG 4.42Å; Y724-L741 HydrophobicContact CE1-CB 4.49Å; Y724-L741 HydrophobicContact CE2-CB 4.23Å; Y724-L741 HydrophobicContact CE2-CD1 4.28Å; Y724-L741 HydrophobicContact CG-CB 4.09Å; Y724-L741 HydrophobicContact CG-CD1 4.18Å; Y724-F744 HydrophobicContact CE2-CD2 4.36Å; Y724-F744 WeakPolarHBondContact OH-CE2 3.26Å; Y724-A809 VanDerWaalsContact O-CA 3.3Å; Y724-A809 WeakPolarHBondContact O-CA 3.44Å
725	F	94	Very high	91.2	Very high	118 Å²	118	54.5 Å²	54.5	52%	0.518	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	121.2	-175.7	-173.4	-98.9	0	0	0	111.7	G721 I722 M727 M808	G721-F725 VanDerWaalsContact O-CA 3.27Å; G721-F725 WeakPolarHBondContact O-CA 3.42Å; G721-F725 WeakPolarHBondContact O-CB 3.36Å; G721-F725 PolarHBondContact O-N 3.22Å; I722-F725 WeakPolarHBondContact O-CB 3.41Å; I722-F725 PolarHBondContact O-N 3.43Å; F725-M727 PolarHBondContact O-N 3.49Å; F725-M808 HydrophobicContact CD2-CE 4.32Å
726	Q	91	Very high	91	Very high	135 Å²	135	53.6 Å²	53.6	63%	0.631	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	42.2	66.4	179	-62.9	-173.1	-2.8	0	0	113.9	Y724 N728 M808	Y724-Q726 PolarHBondContact O-N 3.37Å; Y724-Q726 VanDerWaalsContact O-N 3.17Å; Q726-N728 PolarHBondContact O-N 3.15Å; Q726-M808 PolarHBondContact N-O 3.3Å
727	M	89.5	Confident	91	Very high	16 Å²	16	55.1 Å²	55.1	8%	0.079	28%	0.283	C	S	.	.			trans	-55.3	134.3	-177.9	-61.4	179.6	-63.7	0	0	112.2	Y724 F725 N737 R738 L741 A809 L811	Y724-M727 HydrophobicContact CD1-CG 4.47Å; Y724-M727 HydrophobicContact CD1-SD 4.04Å; Y724-M727 HydrophobicContact CG-SD 4.41Å; Y724-M727 VanDerWaalsContact O-CG 3.32Å; Y724-M727 WeakPolarHBondContact O-CG 3.44Å; F725-M727 PolarHBondContact O-N 3.49Å; M727-N737 HydrophobicContact CG-CB 4.19Å; M727-N737 HydrophobicContact SD-CB 3.79Å; M727-R738 HydrophobicContact CE-CB 4.35Å; M727-R738 HydrophobicContact CE-CG 3.33Å; M727-R738 HydrophobicContact SD-CB 4.45Å; M727-R738 HydrophobicContact SD-CG 3.79Å; M727-L741 HydrophobicContact CE-CD2 3.95Å; M727-L741 HydrophobicContact SD-CD2 4.29Å; M727-A809 HydrophobicContact CE-CB 4.2Å; M727-A809 PolarHBondContact N-O 3.21Å; M727-A809 VanDerWaalsContact N-O 3.1Å; M727-L811 HydrophobicContact CE-CD2 3.71Å; M727-L811 HydrophobicContact CE-CG 4.42Å
728	N	86.1	Confident	90.9	Very high	69 Å²	69	55.4 Å²	55.4	37%	0.369	28%	0.284	S	S	.	.			trans	-75	157.7	175.8	59	-5.2	0	0	0	112.4	Q726 S730 S733 G734 R738	Q726-N728 PolarHBondContact O-N 3.15Å; N728-S730 VanDerWaalsContact C-N 3.28Å; N728-S730 PolarHBondContact ND2-OG 3.27Å; N728-S730 PolarHBondContact O-N 2.84Å; N728-S730 PolarHBondContact OD1-OG 3.47Å; N728-S733 PolarHBondContact ND2-OG 3.48Å; N728-S733 PolarHBondContact OD1-OG 2.9Å; N728-G734 WeakPolarHBondContact O-CA 3.4Å; N728-R738 PolarHBondContact O-NH1 3.48Å; N728-R738 VanDerWaalsContact O-NH1 3.09Å
729	D	85.9	Confident	90.8	Very high	79 Å²	79	52.3 Å²	52.3	42%	0.422	27%	0.268	S	S	.	.			trans	-95.3	26.9	176.9	-63.5	-17.5	0	0	0	112.1	R738 F903 C904	D729-R738 IonicContact OD1-CZ 3.88Å; D729-R738 VanDerWaalsContact OD1-CZ 3.28Å; D729-R738 IonicContact OD1-NH1 2.81Å; D729-R738 PolarHBondContact OD1-NH1 3.4Å; D729-R738 VanDerWaalsContact OD1-NH1 3.13Å; D729-R738 IonicContact OD1-NH2 3.19Å; D729-R738 PolarHBondContact OD1-NH2 2.91Å; D729-F903 WeakPolarHBondContact O-CA 3.26Å; D729-C904 PolarHBondContact O-N 2.89Å
730	S	87.2	Confident	90.7	Very high	9 Å²	9	50.8 Å²	50.8	6%	0.063	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-72.4	149	177.3	63.7	0	0	0	0	111.2	N728 E732 S733 G734 C904	N728-S730 VanDerWaalsContact C-N 3.28Å; N728-S730 PolarHBondContact ND2-OG 3.27Å; N728-S730 PolarHBondContact O-N 2.84Å; N728-S730 PolarHBondContact OD1-OG 3.47Å; S730-E732 PolarHBondContact O-N 3.46Å; S730-S733 PolarHBondContact OG-N 3.19Å; S730-S733 PolarHBondContact OG-OG 3.26Å; S730-G734 WeakPolarHBondContact O-CA 3.39Å; S730-G734 PolarHBondContact O-N 3.17Å; S730-C904 CarbonylContact C-O 3.47Å; S730-C904 WeakPolarHBondContact CA-O 3.41Å
731	L	84.4	Confident	90.7	Very high	32 Å²	32	49.3 Å²	49.3	17%	0.168	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-30.9	175.5	-173.7	65.2	0	0	0	111.8	I735 F903 C904 P905 R915 Q918	L731-I735 HydrophobicContact CD1-CD1 4.49Å; L731-F903 HydrophobicContact CB-CB 4.43Å; L731-F903 HydrophobicContact CD1-CB 4Å; L731-C904 PolarHBondContact N-O 3.25Å; L731-P905 HydrophobicContact CB-CB 4.5Å; L731-P905 HydrophobicContact CD2-CB 4.43Å; L731-R915 HydrophobicContact CD2-CB 4.36Å; L731-Q918 HydrophobicContact CD1-CB 4.03Å; L731-Q918 HydrophobicContact CD1-CG 4.16Å
732	E	82.3	Confident	90.8	Very high	69 Å²	69	49.3 Å²	49.3	32%	0.322	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-37	-175.5	-62.4	79.1	-171.5	0	0	113.3	S730 P905 M906	S730-E732 PolarHBondContact O-N 3.46Å; E732-P905 WeakPolarHBondContact OE1-CA 3.23Å; E732-M906 PolarHBondContact OE1-N 3.01Å; E732-M906 VanDerWaalsContact OE1-N 3.16Å; E732-M906 PolarHBondContact OE2-N 3.44Å
733	S	88.2	Confident	90.7	Very high	31 Å²	31	44.4 Å²	44.4	22%	0.217	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.2	-25.7	-173.4	57.1	0	0	0	0	114.5	N728 S730 I735 Q736 N737	N728-S733 PolarHBondContact ND2-OG 3.48Å; N728-S733 PolarHBondContact OD1-OG 2.9Å; S730-S733 PolarHBondContact OG-N 3.19Å; S730-S733 PolarHBondContact OG-OG 3.26Å; S733-I735 PolarHBondContact O-N 3.19Å; S733-Q736 PolarHBondContact O-N 3.05Å; S733-N737 WeakPolarHBondContact O-CB 3.37Å; S733-N737 VanDerWaalsContact O-CG 3.24Å; S733-N737 PolarHBondContact O-N 3.33Å
734	G	89.7	Confident	90.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.4	-39	-169.6	0	0	0	0	0	114.5	N728 S730 R738	N728-G734 WeakPolarHBondContact O-CA 3.4Å; S730-G734 WeakPolarHBondContact O-CA 3.39Å; S730-G734 PolarHBondContact O-N 3.17Å; G734-R738 WeakPolarHBondContact O-CG 3.28Å; G734-R738 PolarHBondContact O-N 3.34Å; G734-R738 PolarHBondContact O-NH1 3.39Å
735	I	90.3	Very high	90.8	Very high	24 Å²	24	41.7 Å²	41.7	12%	0.123	21%	0.205	C	C	.	.	H	α-helix	trans	-72.6	-46.9	177.8	-62	173.4	0	0	0	110.7	L731 S733 N737 R738 T739 F903 Y923	L731-I735 HydrophobicContact CD1-CD1 4.49Å; S733-I735 PolarHBondContact O-N 3.19Å; I735-N737 PolarHBondContact O-N 3.48Å; I735-R738 PolarHBondContact O-N 3.29Å; I735-T739 HydrophobicContact CG2-CG2 4.25Å; I735-T739 WeakPolarHBondContact O-CB 3.43Å; I735-T739 VanDerWaalsContact O-CG2 3.23Å; I735-T739 WeakPolarHBondContact O-CG2 3.24Å; I735-T739 PolarHBondContact O-N 3.49Å; I735-T739 PolarHBondContact O-OG1 3.24Å; I735-F903 HydrophobicContact CD1-CB 4.48Å; I735-F903 HydrophobicContact CD1-CD2 3.76Å; I735-F903 HydrophobicContact CD1-CE2 4.16Å; I735-F903 HydrophobicContact CD1-CG 4.07Å; I735-F903 HydrophobicContact CG1-CD1 3.94Å; I735-F903 HydrophobicContact CG1-CD2 3.53Å; I735-F903 HydrophobicContact CG1-CE1 3.95Å; I735-F903 HydrophobicContact CG1-CE2 3.55Å; I735-F903 HydrophobicContact CG1-CG 3.73Å; I735-F903 HydrophobicContact CG1-CZ 3.77Å; I735-Y923 HydrophobicContact CG2-CD1 4.42Å; I735-Y923 HydrophobicContact CG2-CD2 3.58Å; I735-Y923 HydrophobicContact CG2-CE2 3.77Å; I735-Y923 HydrophobicContact CG2-CG 3.93Å
736	Q	90.5	Very high	90.9	Very high	136 Å²	136	36 Å²	36	64%	0.636	18%	0.18	S	C	*	.	H	α-helix	trans	-64.7	-40.7	-177.9	-172.6	175.3	1.4	0	0	111.6	S733 T739 G740	S733-Q736 PolarHBondContact O-N 3.05Å; Q736-T739 WeakPolarHBondContact CA-OG1 3.38Å; Q736-T739 PolarHBondContact O-OG1 3.22Å; Q736-G740 PolarHBondContact O-N 2.96Å
737	N	93	Very high	91.1	Very high	52 Å²	52	31.5 Å²	31.5	28%	0.278	16%	0.16	S	C	.	.	H	α-helix	trans	-65.2	-45.4	178.8	-72.8	-10.3	0	0	0	111.8	Y724 M727 S733 I735 G740 L741	Y724-N737 HydrophobicContact CD1-CB 3.99Å; Y724-N737 HydrophobicContact CE1-CB 4.12Å; Y724-N737 VanDerWaalsContact CE1-O 3.25Å; Y724-N737 WeakPolarHBondContact CE1-O 3.4Å; M727-N737 HydrophobicContact CG-CB 4.19Å; M727-N737 HydrophobicContact SD-CB 3.79Å; S733-N737 WeakPolarHBondContact O-CB 3.37Å; S733-N737 VanDerWaalsContact O-CG 3.24Å; S733-N737 PolarHBondContact O-N 3.33Å; I735-N737 PolarHBondContact O-N 3.48Å; N737-G740 PolarHBondContact O-N 3.42Å; N737-L741 WeakPolarHBondContact O-CB 3.12Å; N737-L741 PolarHBondContact O-N 3.09Å
738	R	93.5	Very high	91.3	Very high	6 Å²	6	32.2 Å²	32.2	2%	0.023	16%	0.164	C	C	.	.	H	α-helix	trans	-64.3	-44.7	177.4	-79.7	174.8	172.2	90.7	-6	112.9	M727 N728 D729 G734 I735 L741 F742 E897 M898 L901	M727-R738 HydrophobicContact CE-CB 4.35Å; M727-R738 HydrophobicContact CE-CG 3.33Å; M727-R738 HydrophobicContact SD-CB 4.45Å; M727-R738 HydrophobicContact SD-CG 3.79Å; N728-R738 PolarHBondContact O-NH1 3.48Å; N728-R738 VanDerWaalsContact O-NH1 3.09Å; D729-R738 IonicContact OD1-CZ 3.88Å; D729-R738 VanDerWaalsContact OD1-CZ 3.28Å; D729-R738 IonicContact OD1-NH1 2.81Å; D729-R738 PolarHBondContact OD1-NH1 3.4Å; D729-R738 VanDerWaalsContact OD1-NH1 3.13Å; D729-R738 IonicContact OD1-NH2 3.19Å; D729-R738 PolarHBondContact OD1-NH2 2.91Å; G734-R738 WeakPolarHBondContact O-CG 3.28Å; G734-R738 PolarHBondContact O-N 3.34Å; G734-R738 PolarHBondContact O-NH1 3.39Å; I735-R738 PolarHBondContact O-N 3.29Å; R738-L741 PolarHBondContact O-N 3.23Å; R738-F742 WeakPolarHBondContact O-CD2 3.37Å; R738-F742 PolarHBondContact O-N 3.49Å; R738-F742 VanDerWaalsContact O-N 3.13Å; R738-E897 IonicContact CZ-OE1 3.26Å; R738-E897 IonicContact NE-OE1 2.92Å; R738-E897 PolarHBondContact NE-OE1 2.87Å; R738-E897 IonicContact NH2-OE1 2.85Å; R738-M898 HydrophobicContact CB-CE 3.51Å; R738-M898 HydrophobicContact CG-CE 4.35Å; R738-L901 VanDerWaalsContact NE-CD1 3.29Å
739	T	92.5	Very high	91.7	Very high	4 Å²	4	29 Å²	29	3%	0.025	15%	0.146	C	C	.	.	H	α-helix	trans	-65.7	-41.6	178.2	52.1	0	0	0	0	111.5	I735 Q736 Y743 L894 M898 Y923	I735-T739 HydrophobicContact CG2-CG2 4.25Å; I735-T739 WeakPolarHBondContact O-CB 3.43Å; I735-T739 VanDerWaalsContact O-CG2 3.23Å; I735-T739 WeakPolarHBondContact O-CG2 3.24Å; I735-T739 PolarHBondContact O-N 3.49Å; I735-T739 PolarHBondContact O-OG1 3.24Å; Q736-T739 WeakPolarHBondContact CA-OG1 3.38Å; Q736-T739 PolarHBondContact O-OG1 3.22Å; T739-Y743 WeakPolarHBondContact O-CB 3.46Å; T739-Y743 PolarHBondContact O-N 2.92Å; T739-L894 HydrophobicContact CG2-CD1 4.48Å; T739-L894 HydrophobicContact CG2-CD2 3.54Å; T739-M898 HydrophobicContact CG2-CE 4.11Å; T739-Y923 HydrophobicContact CG2-CE1 3.64Å; T739-Y923 HydrophobicContact CG2-CE2 4.4Å; T739-Y923 VanDerWaalsContact CG2-OH 3.3Å; T739-Y923 WeakPolarHBondContact CG2-OH 3.36Å
740	G	93.5	Very high	92.1	Very high	4 Å²	4	25.2 Å²	25.2	4%	0.041	13%	0.126	C	C	.	.	H	α-helix	trans	-60.1	-48.5	173.4	0	0	0	0	0	112.5	Q736 N737 F742 Y743 F744	Q736-G740 PolarHBondContact O-N 2.96Å; N737-G740 PolarHBondContact O-N 3.42Å; G740-F742 PolarHBondContact O-N 3.36Å; G740-Y743 WeakPolarHBondContact O-CB 3.44Å; G740-Y743 PolarHBondContact O-N 3.47Å; G740-F744 WeakPolarHBondContact O-CD2 3.22Å; G740-F744 PolarHBondContact O-N 2.99Å
741	L	95	Very high	92.4	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-54.9	-52.7	177.1	174.7	63.9	0	0	0	111.9	M720 Y724 M727 N737 R738 Y743 F744 C745 A809 L811	M720-L741 HydrophobicContact CB-CD1 4.23Å; Y724-L741 HydrophobicContact CD1-CB 4.32Å; Y724-L741 HydrophobicContact CD2-CB 4.06Å; Y724-L741 HydrophobicContact CD2-CD1 3.69Å; Y724-L741 HydrophobicContact CD2-CG 4.42Å; Y724-L741 HydrophobicContact CE1-CB 4.49Å; Y724-L741 HydrophobicContact CE2-CB 4.23Å; Y724-L741 HydrophobicContact CE2-CD1 4.28Å; Y724-L741 HydrophobicContact CG-CB 4.09Å; Y724-L741 HydrophobicContact CG-CD1 4.18Å; M727-L741 HydrophobicContact CE-CD2 3.95Å; M727-L741 HydrophobicContact SD-CD2 4.29Å; N737-L741 WeakPolarHBondContact O-CB 3.12Å; N737-L741 PolarHBondContact O-N 3.09Å; R738-L741 PolarHBondContact O-N 3.23Å; L741-Y743 VanDerWaalsContact C-N 3.3Å; L741-Y743 PolarHBondContact O-N 3.43Å; L741-F744 PolarHBondContact O-N 2.96Å; L741-C745 WeakPolarHBondContact O-CB 3.31Å; L741-C745 PolarHBondContact O-N 3.23Å; L741-C745 PolarHBondContact O-SG 3.04Å; L741-A809 HydrophobicContact CD2-CB 3.49Å; L741-A809 VanDerWaalsContact CD2-CB 3.49Å; L741-L811 HydrophobicContact CD2-CD1 4.2Å; L741-L811 HydrophobicContact CD2-CD2 4.35Å; L741-L811 HydrophobicContact CD2-CG 4.43Å
742	F	95.3	Very high	92.7	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.9	-38.6	179.3	-67	-30	0	0	0	112.4	R738 G740 C745 T746 L811 F821 M890 L893 L894 M896 E897	R738-F742 WeakPolarHBondContact O-CD2 3.37Å; R738-F742 PolarHBondContact O-N 3.49Å; R738-F742 VanDerWaalsContact O-N 3.13Å; G740-F742 PolarHBondContact O-N 3.36Å; F742-C745 PolarHBondContact O-N 2.9Å; F742-T746 WeakPolarHBondContact O-CB 3.49Å; F742-T746 PolarHBondContact O-N 3.28Å; F742-T746 PolarHBondContact O-OG1 3.49Å; F742-T746 VanDerWaalsContact O-OG1 3.14Å; F742-L811 HydrophobicContact CE1-CD1 3.75Å; F742-L811 HydrophobicContact CE1-CD2 4Å; F742-L811 HydrophobicContact CZ-CD1 4.24Å; F742-L811 HydrophobicContact CZ-CD2 3.78Å; F742-F821 HydrophobicContact CD1-CE2 4.09Å; F742-F821 HydrophobicContact CE1-CD2 4.02Å; F742-F821 AromaticContact CE1-CE2 3.85Å; F742-F821 HydrophobicContact CE1-CE2 3.85Å; F742-M890 VanDerWaalsContact C-SD 3.51Å; F742-M890 HydrophobicContact CB-CE 4.03Å; F742-M890 HydrophobicContact CB-SD 3.84Å; F742-L893 HydrophobicContact CB-CB 4.27Å; F742-L893 HydrophobicContact CB-CD1 3.99Å; F742-L893 HydrophobicContact CD1-CB 4.14Å; F742-L893 HydrophobicContact CD1-CD1 4.08Å; F742-L893 HydrophobicContact CD2-CB 3.79Å; F742-L893 HydrophobicContact CE1-CB 4.42Å; F742-L893 HydrophobicContact CE2-CB 4.09Å; F742-L893 WeakPolarHBondContact CE2-O 3.43Å; F742-L893 HydrophobicContact CG-CB 3.82Å; F742-L893 HydrophobicContact CG-CD1 4.1Å; F742-L893 HydrophobicContact CZ-CB 4.39Å; F742-L894 HydrophobicContact CD2-CD2 3.78Å; F742-L894 HydrophobicContact CD2-CG 4.18Å; F742-L894 HydrophobicContact CE2-CD2 4.27Å; F742-M896 HydrophobicContact CZ-CE 4.45Å; F742-E897 HydrophobicContact CE2-CB 3.63Å; F742-E897 HydrophobicContact CE2-CG 4.01Å; F742-E897 HydrophobicContact CZ-CB 3.74Å; F742-E897 HydrophobicContact CZ-CG 4Å
743	Y	94.8	Very high	93.2	Very high	12 Å²	12	23.4 Å²	23.4	5%	0.047	12%	0.116	C	C	.	.	H	α-helix	trans	-60.9	-47.2	176.9	-179.9	-98.8	0	0	0	111.9	T739 G740 L741 T746 L747 M861 F866 L867 M890	T739-Y743 WeakPolarHBondContact O-CB 3.46Å; T739-Y743 PolarHBondContact O-N 2.92Å; G740-Y743 WeakPolarHBondContact O-CB 3.44Å; G740-Y743 PolarHBondContact O-N 3.47Å; L741-Y743 VanDerWaalsContact C-N 3.3Å; L741-Y743 PolarHBondContact O-N 3.43Å; Y743-T746 PolarHBondContact O-N 2.9Å; Y743-L747 HydrophobicContact CE1-CD1 4.01Å; Y743-L747 VanDerWaalsContact O-CB 3.27Å; Y743-L747 WeakPolarHBondContact O-CB 3.46Å; Y743-L747 PolarHBondContact O-N 3.33Å; Y743-M861 HydrophobicContact CE2-CG 4.13Å; Y743-M861 WeakPolarHBondContact OH-CG 3.22Å; Y743-M861 PolarHBondContact OH-SD 3.36Å; Y743-F866 AromaticContact CD1-CD1 3.79Å; Y743-F866 HydrophobicContact CD1-CD1 3.79Å; Y743-F866 AromaticContact CD1-CE1 3.9Å; Y743-F866 HydrophobicContact CD1-CE1 3.9Å; Y743-F866 HydrophobicContact CD2-CB 3.73Å; Y743-F866 AromaticContact CD2-CD1 3.56Å; Y743-F866 HydrophobicContact CD2-CD1 3.56Å; Y743-F866 HydrophobicContact CD2-CE1 4.45Å; Y743-F866 AromaticContact CD2-CG 3.87Å; Y743-F866 HydrophobicContact CD2-CG 3.87Å; Y743-F866 HydrophobicContact CE1-CD1 4.09Å; Y743-F866 HydrophobicContact CE1-CE1 4.31Å; Y743-F866 HydrophobicContact CE2-CB 4.18Å; Y743-F866 AromaticContact CE2-CD1 3.87Å; Y743-F866 HydrophobicContact CE2-CD1 3.87Å; Y743-F866 HydrophobicContact CE2-CG 4.43Å; Y743-F866 HydrophobicContact CG-CB 4.36Å; Y743-F866 AromaticContact CG-CD1 3.49Å; Y743-F866 HydrophobicContact CG-CD1 3.49Å; Y743-F866 VanDerWaalsContact CG-CD1 3.49Å; Y743-F866 AromaticContact CG-CE1 3.96Å; Y743-F866 HydrophobicContact CG-CE1 3.96Å; Y743-F866 HydrophobicContact CG-CG 4.01Å; Y743-L867 HydrophobicContact CE2-CG 4.39Å; Y743-L867 VanDerWaalsContact OH-CD1 3.28Å; Y743-L867 WeakPolarHBondContact OH-CD1 3.43Å; Y743-M890 VanDerWaalsContact CA-SD 3.52Å; Y743-M890 PolarHBondContact N-SD 3.49Å; Y743-M890 VanDerWaalsContact N-SD 3.41Å
744	F	95	Very high	93.3	Very high	78 Å²	78	23.7 Å²	23.7	34%	0.342	12%	0.115	S	C	.	.	H	α-helix	trans	-66.8	-39.2	177.2	-70.6	-61.4	0	0	0	112.5	F716 M720 Y724 G740 L741 L747 Q748	F716-F744 HydrophobicContact CZ-CB 4.26Å; F716-F744 WeakPolarHBondContact CZ-O 3.45Å; M720-F744 HydrophobicContact CE-CB 4Å; M720-F744 HydrophobicContact CE-CD1 4.49Å; M720-F744 HydrophobicContact CE-CG 4.12Å; M720-F744 HydrophobicContact SD-CB 4.06Å; M720-F744 HydrophobicContact SD-CD2 4.47Å; M720-F744 HydrophobicContact SD-CG 4.41Å; Y724-F744 HydrophobicContact CE2-CD2 4.36Å; Y724-F744 WeakPolarHBondContact OH-CE2 3.26Å; G740-F744 WeakPolarHBondContact O-CD2 3.22Å; G740-F744 PolarHBondContact O-N 2.99Å; L741-F744 PolarHBondContact O-N 2.96Å; F744-L747 PolarHBondContact O-N 2.99Å; F744-Q748 WeakPolarHBondContact O-CB 3.44Å; F744-Q748 PolarHBondContact O-N 3.22Å
745	C	95.5	Very high	93.1	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.1	-48.8	174	-72.3	0	0	0	0	111.7	L741 F742 L747 Q748 V749 L825	L741-C745 WeakPolarHBondContact O-CB 3.31Å; L741-C745 PolarHBondContact O-N 3.23Å; L741-C745 PolarHBondContact O-SG 3.04Å; F742-C745 PolarHBondContact O-N 2.9Å; C745-L747 VanDerWaalsContact C-N 3.33Å; C745-L747 PolarHBondContact O-N 3.35Å; C745-Q748 PolarHBondContact O-N 2.97Å; C745-V749 WeakPolarHBondContact O-CB 3.21Å; C745-V749 VanDerWaalsContact O-CG2 3.22Å; C745-V749 WeakPolarHBondContact O-CG2 3.26Å; C745-V749 PolarHBondContact O-N 3.34Å; C745-V749 VanDerWaalsContact O-N 3.08Å; C745-L825 HydrophobicContact CB-CD2 4.43Å
746	T	95.7	Very high	92.9	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-61.6	-41.8	176	-63.5	0	0	0	0	111.4	F742 Y743 V749 I750 T828 F886 S889	F742-T746 WeakPolarHBondContact O-CB 3.49Å; F742-T746 PolarHBondContact O-N 3.28Å; F742-T746 PolarHBondContact O-OG1 3.49Å; F742-T746 VanDerWaalsContact O-OG1 3.14Å; Y743-T746 PolarHBondContact O-N 2.9Å; T746-V749 PolarHBondContact O-N 3.46Å; T746-I750 HydrophobicContact CG2-CD1 3.77Å; T746-I750 VanDerWaalsContact O-CG1 3.31Å; T746-I750 WeakPolarHBondContact O-CG1 3.34Å; T746-I750 PolarHBondContact O-N 2.99Å; T746-I750 VanDerWaalsContact O-N 3.11Å; T746-T828 HydrophobicContact CG2-CG2 4.23Å; T746-F886 HydrophobicContact CG2-CB 4.48Å; T746-F886 HydrophobicContact CG2-CD1 3.52Å; T746-F886 HydrophobicContact CG2-CE1 3.96Å; T746-F886 HydrophobicContact CG2-CG 4.11Å; T746-S889 WeakPolarHBondContact CG2-OG 3.29Å; T746-S889 PolarHBondContact OG1-OG 3.3Å
747	L	94.7	Very high	92.7	Very high	40 Å²	40	18.7 Å²	18.7	21%	0.209	10%	0.1	C	C	.	.	H	α-helix	trans	-59.3	-49.4	177.4	-174	151.5	0	0	0	111.2	Y743 F744 C745 V749 I750 F751 M861 F886	Y743-L747 HydrophobicContact CE1-CD1 4.01Å; Y743-L747 VanDerWaalsContact O-CB 3.27Å; Y743-L747 WeakPolarHBondContact O-CB 3.46Å; Y743-L747 PolarHBondContact O-N 3.33Å; F744-L747 PolarHBondContact O-N 2.99Å; C745-L747 VanDerWaalsContact C-N 3.33Å; C745-L747 PolarHBondContact O-N 3.35Å; L747-V749 PolarHBondContact O-N 2.76Å; L747-I750 PolarHBondContact O-N 3.09Å; L747-F751 HydrophobicContact CD2-CD2 4.29Å; L747-F751 HydrophobicContact CG-CD2 4.11Å; L747-F751 HydrophobicContact CG-CE2 4.33Å; L747-F751 WeakPolarHBondContact O-CD2 3.28Å; L747-F751 PolarHBondContact O-N 3.24Å; L747-M861 HydrophobicContact CD1-CE 3.49Å; L747-M861 VanDerWaalsContact CD1-CE 3.49Å; L747-M861 HydrophobicContact CD1-SD 4.15Å; L747-M861 HydrophobicContact CG-CE 3.91Å; L747-F886 HydrophobicContact CB-CE1 4.21Å
748	Q	93.8	Very high	92.4	Very high	31 Å²	31	20.2 Å²	20.2	15%	0.145	11%	0.105	C	C	.	.	H	α-helix	trans	-60	-49.7	179.2	-179.1	63.2	17.5	0	0	112.1	Y713 F716 F744 C745 I750 F751 V752	Y713-Q748 HydrophobicContact CE1-CG 4.24Å; F716-Q748 HydrophobicContact CB-CG 4.36Å; F716-Q748 HydrophobicContact CD1-CB 4.13Å; F716-Q748 HydrophobicContact CD1-CG 3.77Å; F716-Q748 HydrophobicContact CD2-CB 4.02Å; F716-Q748 HydrophobicContact CD2-CG 3.72Å; F716-Q748 HydrophobicContact CE1-CB 3.74Å; F716-Q748 HydrophobicContact CE1-CG 3.94Å; F716-Q748 HydrophobicContact CE2-CB 3.62Å; F716-Q748 HydrophobicContact CE2-CG 3.88Å; F716-Q748 HydrophobicContact CG-CB 4.26Å; F716-Q748 HydrophobicContact CG-CG 3.66Å; F716-Q748 HydrophobicContact CZ-CB 3.47Å; F716-Q748 VanDerWaalsContact CZ-CB 3.47Å; F716-Q748 HydrophobicContact CZ-CG 3.99Å; F744-Q748 WeakPolarHBondContact O-CB 3.44Å; F744-Q748 PolarHBondContact O-N 3.22Å; C745-Q748 PolarHBondContact O-N 2.97Å; Q748-I750 PolarHBondContact O-N 3.11Å; Q748-F751 PolarHBondContact O-N 3.08Å; Q748-V752 HydrophobicContact CG-CG2 4.4Å; Q748-V752 VanDerWaalsContact O-CG2 3.29Å; Q748-V752 WeakPolarHBondContact O-CG2 3.18Å; Q748-V752 PolarHBondContact O-N 3.14Å; Q748-V752 VanDerWaalsContact O-N 3.13Å
749	V	94.7	Very high	91.9	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-60.8	-30.1	-178	168.8	0	0	0	0	111.8	Y713 C745 T746 L747 N753 I798 M802 L825 T828 T829	Y713-V749 HydrophobicContact CE1-CG2 4.41Å; C745-V749 WeakPolarHBondContact O-CB 3.21Å; C745-V749 VanDerWaalsContact O-CG2 3.22Å; C745-V749 WeakPolarHBondContact O-CG2 3.26Å; C745-V749 PolarHBondContact O-N 3.34Å; C745-V749 VanDerWaalsContact O-N 3.08Å; T746-V749 PolarHBondContact O-N 3.46Å; L747-V749 PolarHBondContact O-N 2.76Å; V749-N753 PolarHBondContact O-ND2 3.21Å; V749-I798 HydrophobicContact CG1-CD1 3.97Å; V749-I798 HydrophobicContact CG2-CD1 4.16Å; V749-I798 HydrophobicContact CG2-CG1 4.5Å; V749-M802 HydrophobicContact CG2-CE 4.29Å; V749-L825 VanDerWaalsContact CG1-O 3.27Å; V749-L825 WeakPolarHBondContact CG1-O 3.27Å; V749-L825 HydrophobicContact CG2-CD2 4.3Å; V749-T828 HydrophobicContact CG1-CG2 4.03Å; V749-T829 HydrophobicContact CG1-CG2 4.4Å
750	I	95.3	Very high	91.6	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-81.2	-50	176.5	-68.1	172.3	0	0	0	111.4	T746 L747 Q748 V752 N753 T828 A832 Y857 I885 F886	T746-I750 HydrophobicContact CG2-CD1 3.77Å; T746-I750 VanDerWaalsContact O-CG1 3.31Å; T746-I750 WeakPolarHBondContact O-CG1 3.34Å; T746-I750 PolarHBondContact O-N 2.99Å; T746-I750 VanDerWaalsContact O-N 3.11Å; L747-I750 PolarHBondContact O-N 3.09Å; Q748-I750 PolarHBondContact O-N 3.11Å; I750-V752 PolarHBondContact O-N 3.07Å; I750-N753 WeakPolarHBondContact O-CB 3.43Å; I750-N753 PolarHBondContact O-N 3.07Å; I750-N753 VanDerWaalsContact O-N 3.15Å; I750-N753 PolarHBondContact O-ND2 3.39Å; I750-T828 HydrophobicContact CD1-CG2 3.9Å; I750-T828 HydrophobicContact CG1-CG2 3.69Å; I750-A832 HydrophobicContact CB-CB 4.42Å; I750-A832 HydrophobicContact CG1-CB 4.24Å; I750-A832 HydrophobicContact CG2-CB 4.21Å; I750-Y857 HydrophobicContact CG2-CD1 3.85Å; I750-Y857 HydrophobicContact CG2-CD2 3.62Å; I750-Y857 HydrophobicContact CG2-CE1 3.91Å; I750-Y857 HydrophobicContact CG2-CE2 3.68Å; I750-Y857 HydrophobicContact CG2-CG 3.7Å; I750-Y857 WeakPolarHBondContact O-CE2 3.35Å; I750-I885 HydrophobicContact CD1-CB 4.38Å; I750-I885 HydrophobicContact CD1-CG2 3.89Å; I750-I885 HydrophobicContact CG1-CG2 4.43Å; I750-F886 HydrophobicContact CB-CE2 4.41Å; I750-F886 HydrophobicContact CB-CZ 4.21Å; I750-F886 HydrophobicContact CD1-CD1 4.05Å; I750-F886 HydrophobicContact CD1-CD2 3.5Å; I750-F886 HydrophobicContact CD1-CE1 3.88Å; I750-F886 HydrophobicContact CD1-CE2 3.32Å; I750-F886 HydrophobicContact CD1-CG 3.87Å; I750-F886 HydrophobicContact CD1-CZ 3.51Å; I750-F886 HydrophobicContact CG1-CE2 4.43Å; I750-F886 HydrophobicContact CG1-CZ 4.42Å; I750-F886 HydrophobicContact CG2-CE2 4.07Å; I750-F886 HydrophobicContact CG2-CZ 4.23Å
751	F	92.9	Very high	91.3	Very high	53 Å²	53	23.7 Å²	23.7	23%	0.232	12%	0.122	C	C	.	.	H	α-helix	trans	-71.2	-24.8	-171.7	-85.7	-102	0	0	0	114.2	L747 Q748 N753 L754 V858 M861 F886	L747-F751 HydrophobicContact CD2-CD2 4.29Å; L747-F751 HydrophobicContact CG-CD2 4.11Å; L747-F751 HydrophobicContact CG-CE2 4.33Å; L747-F751 WeakPolarHBondContact O-CD2 3.28Å; L747-F751 PolarHBondContact O-N 3.24Å; Q748-F751 PolarHBondContact O-N 3.08Å; F751-N753 PolarHBondContact O-N 3.33Å; F751-N753 VanDerWaalsContact O-N 3.07Å; F751-L754 HydrophobicContact CD1-CD1 3.98Å; F751-L754 WeakPolarHBondContact O-CB 3.33Å; F751-L754 VanDerWaalsContact O-CG 3.27Å; F751-L754 WeakPolarHBondContact O-CG 3.36Å; F751-L754 PolarHBondContact O-N 3.05Å; F751-L754 VanDerWaalsContact O-N 3.11Å; F751-V858 HydrophobicContact CZ-CG2 4.3Å; F751-M861 HydrophobicContact CD2-CE 4.3Å; F751-M861 HydrophobicContact CE2-CE 3.23Å; F751-M861 HydrophobicContact CZ-CE 3.53Å; F751-F886 HydrophobicContact CE2-CZ 4.16Å
752	V	90.6	Very high	90.7	Very high	19 Å²	19	30.1 Å²	30.1	12%	0.115	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-60.9	-18.6	172.4	170.4	0	0	0	0	112.6	Y713 Q748 I750 L754 K794	Y713-V752 HydrophobicContact CE2-CB 4.46Å; Y713-V752 HydrophobicContact CE2-CG1 3.84Å; Y713-V752 HydrophobicContact CE2-CG2 4.31Å; Q748-V752 HydrophobicContact CG-CG2 4.4Å; Q748-V752 VanDerWaalsContact O-CG2 3.29Å; Q748-V752 WeakPolarHBondContact O-CG2 3.18Å; Q748-V752 PolarHBondContact O-N 3.14Å; Q748-V752 VanDerWaalsContact O-N 3.13Å; I750-V752 PolarHBondContact O-N 3.07Å; V752-L754 PolarHBondContact O-N 3.17Å; V752-K794 PolarHBondContact O-NZ 3.41Å
753	N	91.8	Very high	90.3	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-75.4	-7.2	177.5	-67.5	-68.4	0	0	0	114.3	V749 I750 F751 A755 T756 T829 A832	V749-N753 PolarHBondContact O-ND2 3.21Å; I750-N753 WeakPolarHBondContact O-CB 3.43Å; I750-N753 PolarHBondContact O-N 3.07Å; I750-N753 VanDerWaalsContact O-N 3.15Å; I750-N753 PolarHBondContact O-ND2 3.39Å; F751-N753 PolarHBondContact O-N 3.33Å; F751-N753 VanDerWaalsContact O-N 3.07Å; N753-A755 VanDerWaalsContact C-N 3.27Å; N753-A755 PolarHBondContact O-N 3.38Å; N753-T756 VanDerWaalsContact O-CB 3.3Å; N753-T756 WeakPolarHBondContact O-CB 3.02Å; N753-T756 PolarHBondContact O-N 3.24Å; N753-T756 PolarHBondContact O-OG1 3.31Å; N753-T829 PolarHBondContact ND2-OG1 2.73Å; N753-T829 VanDerWaalsContact ND2-OG1 3.08Å; N753-T829 PolarHBondContact OD1-OG1 2.79Å; N753-A832 HydrophobicContact CB-CB 4.35Å; N753-A832 WeakPolarHBondContact ND2-CB 3.36Å
754	L	90.4	Very high	89.9	Confident	37 Å²	37	32.5 Å²	32.5	19%	0.194	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-59.8	-37.8	172.9	-65.6	179.4	0	0	0	111.8	F751 V752 T756 I757 I853 Y857	F751-L754 HydrophobicContact CD1-CD1 3.98Å; F751-L754 WeakPolarHBondContact O-CB 3.33Å; F751-L754 VanDerWaalsContact O-CG 3.27Å; F751-L754 WeakPolarHBondContact O-CG 3.36Å; F751-L754 PolarHBondContact O-N 3.05Å; F751-L754 VanDerWaalsContact O-N 3.11Å; V752-L754 PolarHBondContact O-N 3.17Å; L754-T756 PolarHBondContact O-N 3.37Å; L754-I757 WeakPolarHBondContact O-CB 3.12Å; L754-I757 PolarHBondContact O-N 3.16Å; L754-I853 HydrophobicContact CD2-CB 4.36Å; L754-I853 HydrophobicContact CD2-CD1 4.44Å; L754-I853 HydrophobicContact CD2-CG1 4.31Å; L754-I853 HydrophobicContact CD2-CG2 3.24Å; L754-Y857 HydrophobicContact CD2-CD2 4.27Å; L754-Y857 HydrophobicContact CD2-CE2 4.2Å
755	A	85.6	Confident	89.5	Confident	47 Å²	47	32.8 Å²	32.8	39%	0.388	17%	0.169	S	C	.	.	H	α-helix	trans	-64.4	-25.1	178.3	0	0	0	0	0	113.6	N753 I757 E758	N753-A755 VanDerWaalsContact C-N 3.27Å; N753-A755 PolarHBondContact O-N 3.38Å; A755-I757 PolarHBondContact O-N 3.13Å; A755-E758 PolarHBondContact O-N 3.27Å
756	T	86.3	Confident	89.1	Confident	8 Å²	8	33.8 Å²	33.8	5%	0.049	17%	0.174	C	C	.	.	H	α-helix	trans	-63.2	-27.8	178.7	-52.7	0	0	0	0	112	N753 L754 F760 K794 L837	N753-T756 VanDerWaalsContact O-CB 3.3Å; N753-T756 WeakPolarHBondContact O-CB 3.02Å; N753-T756 PolarHBondContact O-N 3.24Å; N753-T756 PolarHBondContact O-OG1 3.31Å; L754-T756 PolarHBondContact O-N 3.37Å; T756-F760 PolarHBondContact O-N 3.24Å; T756-F760 VanDerWaalsContact O-N 3.1Å; T756-K794 WeakPolarHBondContact OG1-CE 3.18Å; T756-K794 PolarHBondContact OG1-NZ 3.03Å; T756-L837 HydrophobicContact CG2-CD2 4.15Å
757	I	87.9	Confident	88.8	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63.9	-47	-179.1	-64.4	179.2	0	0	0	110.9	L754 A755 L759 F760 I761 A836 F846 A849 I853	L754-I757 WeakPolarHBondContact O-CB 3.12Å; L754-I757 PolarHBondContact O-N 3.16Å; A755-I757 PolarHBondContact O-N 3.13Å; I757-L759 PolarHBondContact O-N 3.33Å; I757-F760 PolarHBondContact O-N 2.98Å; I757-I761 HydrophobicContact CG2-CD1 3.63Å; I757-I761 HydrophobicContact CG2-CG1 4.37Å; I757-I761 VanDerWaalsContact O-CG1 3.3Å; I757-I761 WeakPolarHBondContact O-CG1 3.36Å; I757-I761 PolarHBondContact O-N 2.64Å; I757-A836 HydrophobicContact CG1-CB 4.24Å; I757-F846 HydrophobicContact CG2-CD2 3.96Å; I757-F846 HydrophobicContact CG2-CE2 4.3Å; I757-A849 HydrophobicContact CG2-CB 3.7Å; I757-I853 HydrophobicContact CD1-CB 4.04Å; I757-I853 HydrophobicContact CD1-CD1 3.86Å; I757-I853 HydrophobicContact CD1-CG2 3.35Å
758	E	85.3	Confident	88.4	Confident	83 Å²	83	34.5 Å²	34.5	39%	0.388	18%	0.177	S	C	.	.	H	α-helix	trans	-62.1	-47	-177.7	-166.8	-174.4	157	0	0	111	A755 F760 I761 K762 F846	A755-E758 PolarHBondContact O-N 3.27Å; E758-F760 PolarHBondContact O-N 3.43Å; E758-I761 PolarHBondContact O-N 2.85Å; E758-K762 HydrophobicContact CG-CD 4.34Å; E758-K762 PolarHBondContact O-N 3.5Å; E758-K762 VanDerWaalsContact O-N 3.09Å; E758-K762 WeakPolarHBondContact OE1-CE 3.39Å; E758-K762 IonicContact OE1-NZ 3.47Å; E758-K762 PolarHBondContact OE1-NZ 3.15Å; E758-F846 HydrophobicContact CB-CD2 3.98Å; E758-F846 HydrophobicContact CB-CE2 3.65Å; E758-F846 HydrophobicContact CB-CZ 4.44Å; E758-F846 HydrophobicContact CG-CD2 4.26Å; E758-F846 HydrophobicContact CG-CE2 4.17Å
759	L	83	Confident	88.1	Confident	55 Å²	55	33.5 Å²	33.5	29%	0.288	17%	0.173	S	C	.	.	H	α-helix	trans	-57.8	-47.9	179	-172.1	76.3	0	0	0	111.2	I757 K762 E763 D789	I757-L759 PolarHBondContact O-N 3.33Å; L759-K762 PolarHBondContact O-N 3.14Å; L759-E763 PolarHBondContact O-N 3.45Å; L759-E763 VanDerWaalsContact O-N 3.12Å; L759-D789 WeakPolarHBondContact CD2-OD2 2.95Å
760	F	86.9	Confident	87.8	Confident	4 Å²	4	34 Å²	34	2%	0.018	18%	0.175	C	C	.	.	H	α-helix	trans	-68.5	-39.3	-178.2	-169.9	-96.4	0	0	0	112.9	T756 I757 E758 E763 R764 Y781 L837 S840 A841 L959	T756-F760 PolarHBondContact O-N 3.24Å; T756-F760 VanDerWaalsContact O-N 3.1Å; I757-F760 PolarHBondContact O-N 2.98Å; E758-F760 PolarHBondContact O-N 3.43Å; F760-E763 PolarHBondContact O-N 3.44Å; F760-R764 VanDerWaalsContact O-CB 3.26Å; F760-R764 WeakPolarHBondContact O-CB 3.44Å; F760-R764 PolarHBondContact O-N 3.34Å; F760-Y781 HydrophobicContact CE2-CE1 4.02Å; F760-Y781 HydrophobicContact CZ-CE1 4.45Å; F760-L837 HydrophobicContact CB-CD2 4.17Å; F760-L837 HydrophobicContact CD2-CD2 3.51Å; F760-L837 HydrophobicContact CE2-CD2 3.98Å; F760-L837 HydrophobicContact CG-CD2 3.88Å; F760-S840 WeakPolarHBondContact CD1-OG 3.27Å; F760-A841 HydrophobicContact CE1-CB 4.13Å; F760-L959 HydrophobicContact CE1-CD2 4.42Å; F760-L959 HydrophobicContact CZ-CD1 4.13Å; F760-L959 HydrophobicContact CZ-CD2 3.93Å; F760-L959 HydrophobicContact CZ-CG 4.46Å
761	I	86.7	Confident	87.3	Confident	28 Å²	28	34.4 Å²	34.4	14%	0.144	18%	0.178	C	C	.	.	H	α-helix	trans	-64.9	-40.8	178.8	-70.3	174.4	0	0	0	111	I757 E758 R764 F846 A849	I757-I761 HydrophobicContact CG2-CD1 3.63Å; I757-I761 HydrophobicContact CG2-CG1 4.37Å; I757-I761 VanDerWaalsContact O-CG1 3.3Å; I757-I761 WeakPolarHBondContact O-CG1 3.36Å; I757-I761 PolarHBondContact O-N 2.64Å; E758-I761 PolarHBondContact O-N 2.85Å; I761-R764 WeakPolarHBondContact O-CB 3.47Å; I761-R764 PolarHBondContact O-N 2.83Å; I761-F846 HydrophobicContact CD1-CB 4.14Å; I761-A849 HydrophobicContact CD1-CB 4.24Å
762	K	83.4	Confident	86.7	Confident	137 Å²	137	33 Å²	33	60%	0.596	17%	0.174	S	C	*	.	H	α-helix	trans	-63.4	-48	176.2	-75.9	175.5	170.3	171.8	0	111.5	E758 L759 R764	E758-K762 HydrophobicContact CG-CD 4.34Å; E758-K762 PolarHBondContact O-N 3.5Å; E758-K762 VanDerWaalsContact O-N 3.09Å; E758-K762 WeakPolarHBondContact OE1-CE 3.39Å; E758-K762 IonicContact OE1-NZ 3.47Å; E758-K762 PolarHBondContact OE1-NZ 3.15Å; L759-K762 PolarHBondContact O-N 3.14Å; K762-R764 VanDerWaalsContact C-N 3.31Å; K762-R764 PolarHBondContact O-N 3.27Å
763	E	86.2	Confident	86.3	Confident	34 Å²	34	32.1 Å²	32.1	16%	0.159	17%	0.169	C	C	.	.	H	α-helix	trans	-70.8	-24.2	179.5	-73.1	-177	-159	0	0	114	L759 F760 V765 L766 F767 K785	L759-E763 PolarHBondContact O-N 3.45Å; L759-E763 VanDerWaalsContact O-N 3.12Å; F760-E763 PolarHBondContact O-N 3.44Å; E763-V765 PolarHBondContact O-N 2.94Å; E763-V765 VanDerWaalsContact O-N 3.17Å; E763-L766 WeakPolarHBondContact O-CA 3.44Å; E763-L766 WeakPolarHBondContact O-CB 3.41Å; E763-L766 PolarHBondContact O-N 3.04Å; E763-F767 PolarHBondContact O-N 3.34Å; E763-K785 IonicContact OE1-NZ 3.48Å; E763-K785 PolarHBondContact OE1-NZ 3Å; E763-K785 VanDerWaalsContact OE2-CE 3.29Å; E763-K785 WeakPolarHBondContact OE2-CE 3.32Å; E763-K785 IonicContact OE2-NZ 3.74Å; E763-K785 PolarHBondContact OE2-NZ 3.16Å
764	R	86.7	Confident	85.8	Confident	27 Å²	27	32.8 Å²	32.8	10%	0.102	18%	0.176	C	C	.	.	H	α-helix	trans	-55.7	-35.1	179.2	177.1	177.4	170.3	-179.5	-4	112.3	F760 I761 K762 F767 I768 S840 A841 V843 T844	F760-R764 VanDerWaalsContact O-CB 3.26Å; F760-R764 WeakPolarHBondContact O-CB 3.44Å; F760-R764 PolarHBondContact O-N 3.34Å; I761-R764 WeakPolarHBondContact O-CB 3.47Å; I761-R764 PolarHBondContact O-N 2.83Å; K762-R764 VanDerWaalsContact C-N 3.31Å; K762-R764 PolarHBondContact O-N 3.27Å; R764-F767 PolarHBondContact O-N 3.08Å; R764-I768 HydrophobicContact CG-CD1 3.89Å; R764-I768 HydrophobicContact CG-CG1 4.36Å; R764-I768 VanDerWaalsContact O-CG1 3.24Å; R764-I768 WeakPolarHBondContact O-CG1 3.49Å; R764-I768 PolarHBondContact O-N 3.31Å; R764-S840 PolarHBondContact NH1-O 2.72Å; R764-A841 PolarHBondContact NH1-O 3.27Å; R764-V843 PolarHBondContact NH1-O 3.32Å; R764-T844 VanDerWaalsContact NH2-CG2 3.31Å
765	V	85.5	Confident	85.6	Confident	84 Å²	84	31.1 Å²	31.1	51%	0.509	17%	0.167	S	C	.	.	H	α-helix	trans	-63.7	-45.2	177.1	179.6	0	0	0	0	110.8	I434 E763 I768 H769	I434-V765 HydrophobicContact CD1-CG1 3.95Å; I434-V765 HydrophobicContact CG1-CG1 4.39Å; E763-V765 PolarHBondContact O-N 2.94Å; E763-V765 VanDerWaalsContact O-N 3.17Å; V765-I768 PolarHBondContact O-N 3.43Å; V765-H769 PolarHBondContact O-N 2.68Å; V765-H769 VanDerWaalsContact O-N 3.13Å
766	L	87.7	Confident	85.8	Confident	22 Å²	22	29 Å²	29	12%	0.115	15%	0.149	C	C	.	.	H	α-helix	trans	-61.2	-46.7	174.1	179.6	66.3	0	0	0	111.3	I434 M436 E763 I768 H769 E770	I434-L766 HydrophobicContact CG2-CB 4.2Å; I434-L766 HydrophobicContact CG2-CD1 3.59Å; M436-L766 HydrophobicContact SD-CD2 3.61Å; E763-L766 WeakPolarHBondContact O-CA 3.44Å; E763-L766 WeakPolarHBondContact O-CB 3.41Å; E763-L766 PolarHBondContact O-N 3.04Å; L766-I768 PolarHBondContact O-N 3.34Å; L766-H769 PolarHBondContact O-N 3.38Å; L766-E770 HydrophobicContact CD1-CG 4.1Å; L766-E770 WeakPolarHBondContact CD1-OE1 3.19Å; L766-E770 HydrophobicContact CG-CG 4.42Å; L766-E770 WeakPolarHBondContact O-CB 3.26Å; L766-E770 WeakPolarHBondContact O-CG 3.43Å; L766-E770 PolarHBondContact O-N 3.45Å
767	F	90.1	Very high	85.9	Confident	3 Å²	3	32 Å²	32	1%	0.013	16%	0.162	C	C	.	.	H	α-helix	trans	-58.8	-46	177.8	165.6	-105.2	0	0	0	112.9	E763 R764 H769 E770 S771 Y776 V778 Y781 L959	E763-F767 PolarHBondContact O-N 3.34Å; R764-F767 PolarHBondContact O-N 3.08Å; F767-H769 VanDerWaalsContact C-N 3.32Å; F767-H769 PolarHBondContact O-N 3.27Å; F767-E770 PolarHBondContact O-N 3.43Å; F767-S771 WeakPolarHBondContact O-CB 3.37Å; F767-S771 PolarHBondContact O-N 3.21Å; F767-Y776 AromaticContact CD2-CE2 3.94Å; F767-Y776 HydrophobicContact CD2-CE2 3.94Å; F767-Y776 HydrophobicContact CE2-CE2 4.14Å; F767-V778 HydrophobicContact CZ-CB 4.3Å; F767-V778 HydrophobicContact CZ-CG1 3.91Å; F767-V778 HydrophobicContact CZ-CG2 4Å; F767-Y781 HydrophobicContact CB-CD2 4.34Å; F767-Y781 HydrophobicContact CB-CE1 4.21Å; F767-Y781 HydrophobicContact CB-CE2 3.9Å; F767-Y781 HydrophobicContact CD1-CE1 4.46Å; F767-Y781 AromaticContact CD2-CD1 3.38Å; F767-Y781 HydrophobicContact CD2-CD1 3.38Å; F767-Y781 AromaticContact CD2-CD2 3.61Å; F767-Y781 HydrophobicContact CD2-CD2 3.61Å; F767-Y781 AromaticContact CD2-CE1 3.78Å; F767-Y781 HydrophobicContact CD2-CE1 3.78Å; F767-Y781 AromaticContact CD2-CE2 3.99Å; F767-Y781 HydrophobicContact CD2-CE2 3.99Å; F767-Y781 AromaticContact CD2-CG 3.28Å; F767-Y781 HydrophobicContact CD2-CG 3.28Å; F767-Y781 AromaticContact CE2-CD1 3.56Å; F767-Y781 HydrophobicContact CE2-CD1 3.56Å; F767-Y781 HydrophobicContact CE2-CD2 4.37Å; F767-Y781 HydrophobicContact CE2-CE1 4.29Å; F767-Y781 AromaticContact CE2-CG 3.61Å; F767-Y781 HydrophobicContact CE2-CG 3.61Å; F767-Y781 AromaticContact CG-CD1 3.96Å; F767-Y781 HydrophobicContact CG-CD1 3.96Å; F767-Y781 HydrophobicContact CG-CD2 4.3Å; F767-Y781 AromaticContact CG-CE1 3.87Å; F767-Y781 HydrophobicContact CG-CE1 3.87Å; F767-Y781 HydrophobicContact CG-CE2 4.22Å; F767-Y781 HydrophobicContact CG-CG 4.17Å; F767-Y781 HydrophobicContact CZ-CD1 4.28Å; F767-L959 HydrophobicContact CD1-CD2 4.38Å; F767-L959 HydrophobicContact CE1-CD2 3.91Å
768	I	86.8	Confident	86	Confident	52 Å²	52	32.7 Å²	32.7	27%	0.267	17%	0.167	S	C	.	.	H	α-helix	trans	-61.3	-45.7	178.8	-69.4	166.3	0	0	0	109.9	R764 V765 L766 S772 L962	R764-I768 HydrophobicContact CG-CD1 3.89Å; R764-I768 HydrophobicContact CG-CG1 4.36Å; R764-I768 VanDerWaalsContact O-CG1 3.24Å; R764-I768 WeakPolarHBondContact O-CG1 3.49Å; R764-I768 PolarHBondContact O-N 3.31Å; V765-I768 PolarHBondContact O-N 3.43Å; L766-I768 PolarHBondContact O-N 3.34Å; I768-S772 WeakPolarHBondContact O-CB 3.5Å; I768-S772 PolarHBondContact O-N 3.34Å; I768-S772 PolarHBondContact O-OG 3.22Å; I768-L962 HydrophobicContact CD1-CD2 3.5Å; I768-L962 VanDerWaalsContact CD1-CD2 3.5Å; I768-L962 HydrophobicContact CG1-CD2 3.5Å; I768-L962 VanDerWaalsContact CG1-CD2 3.5Å
769	H	87.1	Confident	86.4	Confident	10 Å²	10	29.4 Å²	29.4	5%	0.046	15%	0.153	C	C	.	.	H	α-helix	trans	-58.7	-56.4	178.3	178.3	72	0	0	0	111.3	I434 V765 L766 F767 S771 S772 S773	I434-H769 HydrophobicContact CB-CB 4.48Å; I434-H769 HydrophobicContact CD1-CB 3.73Å; I434-H769 HydrophobicContact CG2-CB 4.02Å; V765-H769 PolarHBondContact O-N 2.68Å; V765-H769 VanDerWaalsContact O-N 3.13Å; L766-H769 PolarHBondContact O-N 3.38Å; F767-H769 VanDerWaalsContact C-N 3.32Å; F767-H769 PolarHBondContact O-N 3.27Å; H769-S771 PolarHBondContact O-N 3.01Å; H769-S772 PolarHBondContact O-N 3.42Å; H769-S772 PolarHBondContact O-OG 3.05Å; H769-S773 PolarHBondContact O-N 3.21Å; H769-S773 PolarHBondContact O-OG 3.42Å
770	E	88.5	Confident	86.9	Confident	10 Å²	10	26.8 Å²	26.8	5%	0.047	14%	0.139	C	C	.	.	H	α-helix	trans	-63.7	-40.8	-177.1	-69.1	-178.2	157	0	0	112.8	R694 L766 F767 S772 S773 G774 Y775 Y776	R694-E770 IonicContact CZ-OE1 3.45Å; R694-E770 IonicContact CZ-OE2 3.47Å; R694-E770 VanDerWaalsContact NH1-CD 3.33Å; R694-E770 IonicContact NH1-OE1 3.49Å; R694-E770 PolarHBondContact NH1-OE1 3.08Å; R694-E770 IonicContact NH1-OE2 2.64Å; R694-E770 PolarHBondContact NH1-OE2 2.81Å; R694-E770 IonicContact NH2-OE1 2.93Å; R694-E770 IonicContact NH2-OE2 2.68Å; R694-E770 PolarHBondContact NH2-OE2 3.5Å; L766-E770 HydrophobicContact CD1-CG 4.1Å; L766-E770 WeakPolarHBondContact CD1-OE1 3.19Å; L766-E770 HydrophobicContact CG-CG 4.42Å; L766-E770 WeakPolarHBondContact O-CB 3.26Å; L766-E770 WeakPolarHBondContact O-CG 3.43Å; L766-E770 PolarHBondContact O-N 3.45Å; F767-E770 PolarHBondContact O-N 3.43Å; E770-S772 VanDerWaalsContact C-N 3.33Å; E770-S773 PolarHBondContact O-N 2.91Å; E770-G774 PolarHBondContact O-N 3.39Å; E770-G774 VanDerWaalsContact O-N 3.1Å; E770-Y775 HydrophobicContact CB-CD2 4.22Å; E770-Y775 HydrophobicContact CB-CG 4.08Å; E770-Y775 HydrophobicContact CG-CD1 4.47Å; E770-Y775 HydrophobicContact CG-CD2 4.49Å; E770-Y775 HydrophobicContact CG-CG 4.34Å; E770-Y775 WeakPolarHBondContact O-CB 3.49Å; E770-Y775 WeakPolarHBondContact O-CD2 3.44Å; E770-Y775 PolarHBondContact O-N 3.18Å; E770-Y776 HydrophobicContact CB-CE1 3.96Å; E770-Y776 WeakPolarHBondContact OE2-CE1 3.27Å; E770-Y776 VanDerWaalsContact OE2-CZ 3.22Å; E770-Y776 PolarHBondContact OE2-OH 3.47Å
771	S	84.4	Confident	87.1	Confident	9 Å²	9	27.1 Å²	27.1	6%	0.063	14%	0.141	C	C	.	.	H	α-helix	trans	-70.3	-30.5	177.6	-163.1	0	0	0	0	112.3	F767 H769 K964	F767-S771 WeakPolarHBondContact O-CB 3.37Å; F767-S771 PolarHBondContact O-N 3.21Å; H769-S771 PolarHBondContact O-N 3.01Å; S771-K964 PolarHBondContact OG-NZ 3.07Å
772	S	79.7	Confident	87.5	Confident	23 Å²	23	26.6 Å²	26.6	16%	0.161	14%	0.137	C	C	.	.	H	α-helix	trans	-75.1	-32.4	174.5	76.5	0	0	0	0	113	I768 H769 E770 G774	I768-S772 WeakPolarHBondContact O-CB 3.5Å; I768-S772 PolarHBondContact O-N 3.34Å; I768-S772 PolarHBondContact O-OG 3.22Å; H769-S772 PolarHBondContact O-N 3.42Å; H769-S772 PolarHBondContact O-OG 3.05Å; E770-S772 VanDerWaalsContact C-N 3.33Å; S772-G774 VanDerWaalsContact C-N 3.3Å
773	S	82.3	Confident	87.9	Confident	2 Å²	2	24.5 Å²	24.5	1%	0.014	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-1.3	175.4	-63.2	0	0	0	0	113.3	R401 H769 E770	R401-S773 PolarHBondContact NH2-OG 3.3Å; H769-S773 PolarHBondContact O-N 3.21Å; H769-S773 PolarHBondContact O-OG 3.42Å; E770-S773 PolarHBondContact O-N 2.91Å
774	G	80.7	Confident	88.3	Confident	13 Å²	13	22.9 Å²	22.9	13%	0.134	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	81	25.9	172.6	0	0	0	0	0	115.6	E770 S772	E770-G774 PolarHBondContact O-N 3.39Å; E770-G774 VanDerWaalsContact O-N 3.1Å; S772-G774 VanDerWaalsContact C-N 3.3Å
775	Y	87.3	Confident	88.5	Confident	3 Å²	3	22 Å²	22	1%	0.012	12%	0.118	C	C	.	.	S	Bend	trans	-66.7	-48.2	178.6	-79.9	-118.1	0	0	0	112.4	F447 S448 L451 R452 E770	F447-Y775 HydrophobicContact CD1-CD1 4.44Å; F447-Y775 HydrophobicContact CD1-CE1 4.49Å; F447-Y775 HydrophobicContact CE1-CD1 4.03Å; F447-Y775 HydrophobicContact CE1-CE1 4.46Å; S448-Y775 PolarHBondContact OG-OH 3.07Å; L451-Y775 HydrophobicContact CD1-CD1 4.18Å; R452-Y775 HydrophobicContact CG-CD1 4.4Å; R452-Y775 HydrophobicContact CG-CD2 4.32Å; R452-Y775 HydrophobicContact CG-CE2 4.43Å; R452-Y775 HydrophobicContact CG-CG 4.3Å; R452-Y775 VanDerWaalsContact NH1-CE2 3.35Å; R452-Y775 PolarHBondContact NH1-OH 3.38Å; E770-Y775 HydrophobicContact CB-CD2 4.22Å; E770-Y775 HydrophobicContact CB-CG 4.08Å; E770-Y775 HydrophobicContact CG-CD1 4.47Å; E770-Y775 HydrophobicContact CG-CD2 4.49Å; E770-Y775 HydrophobicContact CG-CG 4.34Å; E770-Y775 WeakPolarHBondContact O-CB 3.49Å; E770-Y775 WeakPolarHBondContact O-CD2 3.44Å; E770-Y775 PolarHBondContact O-N 3.18Å
776	Y	89	Confident	88.8	Confident	1 Å²	1	18.9 Å²	18.9	0%	0.004	10%	0.099	C	C	.	.	S	Bend	trans	-155.7	164.3	-176.9	51.4	-107.3	0	0	0	111.8	F447 L451 F680 V691 F767 E770 Y781	F447-Y776 HydrophobicContact CZ-CE1 4.35Å; L451-Y776 HydrophobicContact CD1-CD1 3.89Å; F680-Y776 VanDerWaalsContact CE1-C 3.49Å; V691-Y776 HydrophobicContact CG2-CD1 3.61Å; V691-Y776 HydrophobicContact CG2-CE1 4.03Å; V691-Y776 HydrophobicContact CG2-CG 4.08Å; F767-Y776 AromaticContact CD2-CE2 3.94Å; F767-Y776 HydrophobicContact CD2-CE2 3.94Å; F767-Y776 HydrophobicContact CE2-CE2 4.14Å; E770-Y776 HydrophobicContact CB-CE1 3.96Å; E770-Y776 WeakPolarHBondContact OE2-CE1 3.27Å; E770-Y776 VanDerWaalsContact OE2-CZ 3.22Å; E770-Y776 PolarHBondContact OE2-OH 3.47Å; Y776-Y781 HydrophobicContact CE2-CD2 4.22Å; Y776-Y781 HydrophobicContact CE2-CG 4.24Å
777	Q	88.3	Confident	89	Confident	71 Å²	71	22.1 Å²	22.1	33%	0.332	12%	0.115	S	C	.	.			trans	-73.3	153.5	174.8	-66	179.6	10.1	0	0	112.5	F680 Q687 S779 V780 Y781	F680-Q777 HydrophobicContact CD2-CG 3.69Å; F680-Q777 HydrophobicContact CE1-CG 4.22Å; F680-Q777 HydrophobicContact CE2-CG 3.33Å; F680-Q777 HydrophobicContact CG-CG 4.28Å; F680-Q777 HydrophobicContact CZ-CB 4.47Å; F680-Q777 HydrophobicContact CZ-CG 3.62Å; Q687-Q777 VanDerWaalsContact OE1-N 3.11Å; Q777-S779 VanDerWaalsContact C-N 3.26Å; Q777-S779 PolarHBondContact O-N 3.2Å; Q777-V780 HydrophobicContact CB-CG2 4.2Å; Q777-V780 WeakPolarHBondContact O-CB 3.23Å; Q777-V780 PolarHBondContact O-N 2.83Å; Q777-V780 VanDerWaalsContact O-N 3.13Å; Q777-Y781 PolarHBondContact O-N 3.44Å
778	V	91.1	Very high	89	Confident	15 Å²	15	22.6 Å²	22.6	9%	0.091	12%	0.119	C	C	.	.	H	α-helix	trans	-58.8	-38.2	178.4	177.8	0	0	0	0	112.1	F767 V780 Y781 F782 Y956 L959	F767-V778 HydrophobicContact CZ-CB 4.3Å; F767-V778 HydrophobicContact CZ-CG1 3.91Å; F767-V778 HydrophobicContact CZ-CG2 4Å; V778-V780 VanDerWaalsContact C-N 3.35Å; V778-V780 PolarHBondContact O-N 3.02Å; V778-Y781 PolarHBondContact O-N 2.83Å; V778-F782 WeakPolarHBondContact O-CB 3.27Å; V778-F782 PolarHBondContact O-N 3.45Å; V778-Y956 HydrophobicContact CG1-CD2 4.47Å; V778-Y956 HydrophobicContact CG1-CE2 4.22Å; V778-L959 HydrophobicContact CG1-CB 3.81Å
779	S	92.6	Very high	89	Confident	14 Å²	14	20.7 Å²	20.7	10%	0.098	11%	0.109	C	C	.	.	H	α-helix	trans	-60.8	-42	176.6	42.6	0	0	0	0	112.3	Q777 Y781 F782 F783	Q777-S779 VanDerWaalsContact C-N 3.26Å; Q777-S779 PolarHBondContact O-N 3.2Å; S779-Y781 PolarHBondContact O-N 2.94Å; S779-F782 PolarHBondContact O-N 3.37Å; S779-F783 WeakPolarHBondContact O-CD2 3.35Å; S779-F783 PolarHBondContact O-N 2.97Å
780	V	93.2	Very high	89.2	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-59.6	-47.6	178.4	174.2	0	0	0	0	111.2	Y684 Q687 L688 V691 Q777 V778 S784	Y684-V780 HydrophobicContact CD2-CG2 3.53Å; Y684-V780 HydrophobicContact CE2-CG2 3.31Å; Y684-V780 HydrophobicContact CG-CG2 4.34Å; Q687-V780 HydrophobicContact CB-CB 4.46Å; Q687-V780 HydrophobicContact CB-CG1 3.91Å; Q687-V780 HydrophobicContact CB-CG2 3.94Å; L688-V780 HydrophobicContact CB-CG1 4.17Å; L688-V780 HydrophobicContact CD1-CG1 4.22Å; V691-V780 HydrophobicContact CB-CG1 4.21Å; V691-V780 HydrophobicContact CG2-CG1 3.97Å; Q777-V780 HydrophobicContact CB-CG2 4.2Å; Q777-V780 WeakPolarHBondContact O-CB 3.23Å; Q777-V780 PolarHBondContact O-N 2.83Å; Q777-V780 VanDerWaalsContact O-N 3.13Å; V778-V780 VanDerWaalsContact C-N 3.35Å; V778-V780 PolarHBondContact O-N 3.02Å; V780-S784 WeakPolarHBondContact O-CB 3.36Å; V780-S784 PolarHBondContact O-N 3.39Å
781	Y	92.9	Very high	89.3	Confident	12 Å²	12	23 Å²	23	5%	0.047	12%	0.121	C	C	.	.	H	α-helix	trans	-60.9	-48.4	176.6	173.4	-98.2	0	0	0	111.7	F760 F767 Y776 Q777 V778 S779 S784 K785	F760-Y781 HydrophobicContact CE2-CE1 4.02Å; F760-Y781 HydrophobicContact CZ-CE1 4.45Å; F767-Y781 HydrophobicContact CB-CD2 4.34Å; F767-Y781 HydrophobicContact CB-CE1 4.21Å; F767-Y781 HydrophobicContact CB-CE2 3.9Å; F767-Y781 HydrophobicContact CD1-CE1 4.46Å; F767-Y781 AromaticContact CD2-CD1 3.38Å; F767-Y781 HydrophobicContact CD2-CD1 3.38Å; F767-Y781 AromaticContact CD2-CD2 3.61Å; F767-Y781 HydrophobicContact CD2-CD2 3.61Å; F767-Y781 AromaticContact CD2-CE1 3.78Å; F767-Y781 HydrophobicContact CD2-CE1 3.78Å; F767-Y781 AromaticContact CD2-CE2 3.99Å; F767-Y781 HydrophobicContact CD2-CE2 3.99Å; F767-Y781 AromaticContact CD2-CG 3.28Å; F767-Y781 HydrophobicContact CD2-CG 3.28Å; F767-Y781 AromaticContact CE2-CD1 3.56Å; F767-Y781 HydrophobicContact CE2-CD1 3.56Å; F767-Y781 HydrophobicContact CE2-CD2 4.37Å; F767-Y781 HydrophobicContact CE2-CE1 4.29Å; F767-Y781 AromaticContact CE2-CG 3.61Å; F767-Y781 HydrophobicContact CE2-CG 3.61Å; F767-Y781 AromaticContact CG-CD1 3.96Å; F767-Y781 HydrophobicContact CG-CD1 3.96Å; F767-Y781 HydrophobicContact CG-CD2 4.3Å; F767-Y781 AromaticContact CG-CE1 3.87Å; F767-Y781 HydrophobicContact CG-CE1 3.87Å; F767-Y781 HydrophobicContact CG-CE2 4.22Å; F767-Y781 HydrophobicContact CG-CG 4.17Å; F767-Y781 HydrophobicContact CZ-CD1 4.28Å; Y776-Y781 HydrophobicContact CE2-CD2 4.22Å; Y776-Y781 HydrophobicContact CE2-CG 4.24Å; Q777-Y781 PolarHBondContact O-N 3.44Å; V778-Y781 PolarHBondContact O-N 2.83Å; S779-Y781 PolarHBondContact O-N 2.94Å; Y781-S784 PolarHBondContact O-N 3.24Å; Y781-K785 WeakPolarHBondContact O-CB 3.19Å; Y781-K785 PolarHBondContact O-N 3.03Å
782	F	93.5	Very high	89.5	Confident	16 Å²	16	24.9 Å²	24.9	7%	0.07	13%	0.133	C	C	.	.	H	α-helix	trans	-57.9	-53.1	-178.5	177.6	-99.4	0	0	0	112	V778 S779 S784 K785 V786 Y952 C955 Y956 L959	V778-F782 WeakPolarHBondContact O-CB 3.27Å; V778-F782 PolarHBondContact O-N 3.45Å; S779-F782 PolarHBondContact O-N 3.37Å; F782-S784 PolarHBondContact O-N 3.26Å; F782-K785 PolarHBondContact O-N 2.89Å; F782-V786 HydrophobicContact CE1-CG2 4.29Å; F782-V786 HydrophobicContact CE2-CG2 4.25Å; F782-V786 HydrophobicContact CZ-CG2 4.05Å; F782-V786 WeakPolarHBondContact O-CG2 3.47Å; F782-V786 PolarHBondContact O-N 3.49Å; F782-Y952 HydrophobicContact CE2-CD1 4.16Å; F782-Y952 AromaticContact CZ-CD1 3.73Å; F782-Y952 HydrophobicContact CZ-CD1 3.73Å; F782-Y952 HydrophobicContact CZ-CG 4.04Å; F782-Y952 WeakPolarHBondContact CZ-O 3.16Å; F782-C955 HydrophobicContact CE2-CB 4.16Å; F782-Y956 HydrophobicContact CB-CD2 4.2Å; F782-Y956 HydrophobicContact CD1-CD2 4.33Å; F782-Y956 HydrophobicContact CG-CD2 4.17Å; F782-L959 HydrophobicContact CD2-CD1 4.07Å
783	F	93.3	Very high	89.8	Confident	94 Å²	94	24.4 Å²	24.4	41%	0.412	13%	0.13	S	C	.	.	H	α-helix	trans	-66.2	-38.4	179.8	-71.6	-62.1	0	0	0	112.4	Y684 L688 S779 K785 V786 I787	Y684-F783 WeakPolarHBondContact OH-CD2 3.3Å; L688-F783 HydrophobicContact CD1-CB 4.29Å; S779-F783 WeakPolarHBondContact O-CD2 3.35Å; S779-F783 PolarHBondContact O-N 2.97Å; F783-K785 PolarHBondContact O-N 2.88Å; F783-V786 PolarHBondContact O-N 2.84Å; F783-I787 HydrophobicContact CB-CD1 4.41Å; F783-I787 VanDerWaalsContact O-CB 3.32Å; F783-I787 WeakPolarHBondContact O-CB 3.47Å; F783-I787 VanDerWaalsContact O-CG1 3.26Å; F783-I787 WeakPolarHBondContact O-CG1 3.45Å; F783-I787 PolarHBondContact O-N 3.48Å
784	S	93.2	Very high	90.2	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-61.6	-43.5	175.7	-176.5	0	0	0	0	111.9	V691 C692 S695 V780 Y781 F782 C788	V691-S784 WeakPolarHBondContact CG1-OG 3.25Å; C692-S784 VanDerWaalsContact CA-OG 3.25Å; C692-S784 WeakPolarHBondContact CA-OG 3.46Å; C692-S784 PolarHBondContact N-OG 3.45Å; C692-S784 VanDerWaalsContact N-OG 3.16Å; C692-S784 PolarHBondContact SG-OG 3.49Å; S695-S784 PolarHBondContact OG-OG 3.07Å; V780-S784 WeakPolarHBondContact O-CB 3.36Å; V780-S784 PolarHBondContact O-N 3.39Å; Y781-S784 PolarHBondContact O-N 3.24Å; F782-S784 PolarHBondContact O-N 3.26Å; S784-C788 VanDerWaalsContact O-CB 3.26Å; S784-C788 WeakPolarHBondContact O-CB 3.26Å; S784-C788 PolarHBondContact O-N 2.93Å
785	K	91.8	Very high	90.8	Very high	9 Å²	9	24.9 Å²	24.9	4%	0.039	13%	0.129	C	C	.	.	H	α-helix	trans	-64.5	-44.5	178.6	-169.9	67.9	171.7	171.4	0	111.6	E763 Y781 F782 F783 D789 I790	E763-K785 IonicContact OE1-NZ 3.48Å; E763-K785 PolarHBondContact OE1-NZ 3Å; E763-K785 VanDerWaalsContact OE2-CE 3.29Å; E763-K785 WeakPolarHBondContact OE2-CE 3.32Å; E763-K785 IonicContact OE2-NZ 3.74Å; E763-K785 PolarHBondContact OE2-NZ 3.16Å; Y781-K785 WeakPolarHBondContact O-CB 3.19Å; Y781-K785 PolarHBondContact O-N 3.03Å; F782-K785 PolarHBondContact O-N 2.89Å; F783-K785 PolarHBondContact O-N 2.88Å; K785-D789 HydrophobicContact CD-CB 4.15Å; K785-D789 WeakPolarHBondContact CD-OD2 3.48Å; K785-D789 WeakPolarHBondContact CE-OD2 3.42Å; K785-D789 IonicContact NZ-OD2 2.85Å; K785-D789 PolarHBondContact NZ-OD2 3.27Å; K785-D789 WeakPolarHBondContact O-CB 3.23Å; K785-D789 PolarHBondContact O-N 2.94Å; K785-I790 PolarHBondContact O-N 3.46Å; K785-I790 VanDerWaalsContact O-N 3.07Å
786	V	91.9	Very high	91	Very high	18 Å²	18	29.3 Å²	29.3	11%	0.109	15%	0.153	C	C	.	.	I	π-helix	trans	-64.3	-49.4	177.8	174.9	0	0	0	0	111	F782 F783 I791 Y952	F782-V786 HydrophobicContact CE1-CG2 4.29Å; F782-V786 HydrophobicContact CE2-CG2 4.25Å; F782-V786 HydrophobicContact CZ-CG2 4.05Å; F782-V786 WeakPolarHBondContact O-CG2 3.47Å; F782-V786 PolarHBondContact O-N 3.49Å; F783-V786 PolarHBondContact O-N 2.84Å; V786-I791 WeakPolarHBondContact O-CG1 3.32Å; V786-I791 PolarHBondContact O-N 2.95Å; V786-I791 VanDerWaalsContact O-N 3.08Å; V786-Y952 HydrophobicContact CG1-CE2 4.46Å; V786-Y952 HydrophobicContact CG2-CD1 4.2Å; V786-Y952 HydrophobicContact CG2-CE1 3.83Å
787	I	91.7	Very high	91.1	Very high	89 Å²	89	29.5 Å²	29.5	46%	0.456	15%	0.154	S	C	.	.	I	π-helix	trans	-76.5	-42.4	-171.6	-64.1	168.9	0	0	0	112.8	F783 P792	F783-I787 HydrophobicContact CB-CD1 4.41Å; F783-I787 VanDerWaalsContact O-CB 3.32Å; F783-I787 WeakPolarHBondContact O-CB 3.47Å; F783-I787 VanDerWaalsContact O-CG1 3.26Å; F783-I787 WeakPolarHBondContact O-CG1 3.45Å; F783-I787 PolarHBondContact O-N 3.48Å; I787-P792 VanDerWaalsContact O-CD 3.28Å; I787-P792 WeakPolarHBondContact O-CD 3.33Å
788	C	90.1	Very high	91.4	Very high	13 Å²	13	26.1 Å²	26.1	9%	0.088	14%	0.138	C	C	.	.	I	π-helix	trans	-101.6	-12.1	-168.3	-66.3	0	0	0	0	114.6	C692 I696 S784	C692-C788 WeakPolarHBondContact CB-SG 3.27Å; C692-C788 PolarHBondContact SG-SG 3.34Å; I696-C788 HydrophobicContact CD1-CB 4.4Å; I696-C788 HydrophobicContact CG1-CB 3.89Å; S784-C788 VanDerWaalsContact O-CB 3.26Å; S784-C788 WeakPolarHBondContact O-CB 3.26Å; S784-C788 PolarHBondContact O-N 2.93Å
789	D	87	Confident	91.6	Very high	13 Å²	13	29.6 Å²	29.6	7%	0.07	16%	0.156	C	C	.	.	I	π-helix	trans	-119.5	-59.5	179.6	-179.2	30.4	0	0	0	110.8	L759 K785 P792 T793	L759-D789 WeakPolarHBondContact CD2-OD2 2.95Å; K785-D789 HydrophobicContact CD-CB 4.15Å; K785-D789 WeakPolarHBondContact CD-OD2 3.48Å; K785-D789 WeakPolarHBondContact CE-OD2 3.42Å; K785-D789 IonicContact NZ-OD2 2.85Å; K785-D789 PolarHBondContact NZ-OD2 3.27Å; K785-D789 WeakPolarHBondContact O-CB 3.23Å; K785-D789 PolarHBondContact O-N 2.94Å; D789-P792 WeakPolarHBondContact O-CD 3.17Å; D789-T793 VanDerWaalsContact O-CB 3.3Å; D789-T793 WeakPolarHBondContact O-CB 3.37Å; D789-T793 WeakPolarHBondContact O-CG2 3.23Å; D789-T793 PolarHBondContact O-N 3.26Å; D789-T793 PolarHBondContact O-OG1 2.83Å
790	I	89.9	Confident	91.6	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.01	18%	0.175	C	C	.	.	I	π-helix	trans	-66.8	-48.5	-174.2	-62.5	177.8	0	0	0	112.3	K785 T793 K794 L830 A833 L837	K785-I790 PolarHBondContact O-N 3.46Å; K785-I790 VanDerWaalsContact O-N 3.07Å; I790-T793 PolarHBondContact O-N 2.87Å; I790-T793 PolarHBondContact O-OG1 3.41Å; I790-K794 HydrophobicContact CG2-CG 4.2Å; I790-K794 VanDerWaalsContact O-CB 3.27Å; I790-K794 WeakPolarHBondContact O-CB 3.28Å; I790-K794 VanDerWaalsContact O-CG 3.32Å; I790-K794 WeakPolarHBondContact O-CG 3.37Å; I790-K794 PolarHBondContact O-N 2.84Å; I790-L830 HydrophobicContact CG2-CD2 4.27Å; I790-A833 HydrophobicContact CG2-CB 3.82Å; I790-L837 HydrophobicContact CD1-CD1 3.1Å; I790-L837 HydrophobicContact CD1-CD2 3.94Å; I790-L837 HydrophobicContact CD1-CG 3.76Å
791	I	90.5	Very high	91.6	Very high	66 Å²	66	35 Å²	35	34%	0.338	18%	0.182	S	C	.	.	H	α-helix	trans	-59.9	-54.4	-179.8	-70	173.8	0	0	0	110.5	V786 T793 K794 V795 L830	V786-I791 WeakPolarHBondContact O-CG1 3.32Å; V786-I791 PolarHBondContact O-N 2.95Å; V786-I791 VanDerWaalsContact O-N 3.08Å; I791-T793 PolarHBondContact O-N 3.44Å; I791-K794 PolarHBondContact O-N 3.08Å; I791-V795 HydrophobicContact CG2-CB 4.41Å; I791-V795 HydrophobicContact CG2-CG2 4.17Å; I791-V795 WeakPolarHBondContact O-CA 3.39Å; I791-V795 WeakPolarHBondContact O-CB 3.4Å; I791-V795 WeakPolarHBondContact O-CG2 3.26Å; I791-V795 PolarHBondContact O-N 3.22Å; I791-L830 HydrophobicContact CG1-CD2 3.99Å
792	P	88.8	Confident	91.7	Very high	48 Å²	48	34.5 Å²	34.5	31%	0.312	18%	0.18	S	C	.	.	H	α-helix	trans	-60.5	-43.8	178.5	-26.8	36.2	0	0	0	113.9	L699 I787 D789 K794 L796	L699-P792 HydrophobicContact CD2-CB 4.14Å; I787-P792 VanDerWaalsContact O-CD 3.28Å; I787-P792 WeakPolarHBondContact O-CD 3.33Å; D789-P792 WeakPolarHBondContact O-CD 3.17Å; P792-K794 PolarHBondContact O-N 3.45Å; P792-L796 WeakPolarHBondContact O-CB 3.48Å; P792-L796 PolarHBondContact O-N 3.5Å
793	T	87.5	Confident	91.8	Very high	14 Å²	14	34.7 Å²	34.7	9%	0.086	18%	0.183	C	C	.	.	H	α-helix	trans	-72.1	-28.5	-175.7	55.2	0	0	0	0	113.8	L699 D789 I790 I791 P797	L699-T793 HydrophobicContact CD1-CG2 3.42Å; L699-T793 VanDerWaalsContact CD1-CG2 3.42Å; L699-T793 HydrophobicContact CD2-CG2 4Å; L699-T793 HydrophobicContact CG-CG2 4.37Å; D789-T793 VanDerWaalsContact O-CB 3.3Å; D789-T793 WeakPolarHBondContact O-CB 3.37Å; D789-T793 WeakPolarHBondContact O-CG2 3.23Å; D789-T793 PolarHBondContact O-N 3.26Å; D789-T793 PolarHBondContact O-OG1 2.83Å; I790-T793 PolarHBondContact O-N 2.87Å; I790-T793 PolarHBondContact O-OG1 3.41Å; I791-T793 PolarHBondContact O-N 3.44Å; T793-P797 WeakPolarHBondContact O-CD 3.45Å; T793-P797 WeakPolarHBondContact O-CG 3.28Å
794	K	90.9	Very high	91.9	Very high	3 Å²	3	32.9 Å²	32.9	1%	0.013	18%	0.177	C	C	.	.	H	α-helix	trans	-103.9	-36.9	-175.1	-55.6	-55.7	-179.1	178.3	0	113.7	V752 T756 I790 I791 P792 I798 T829	V752-K794 PolarHBondContact O-NZ 3.41Å; T756-K794 WeakPolarHBondContact OG1-CE 3.18Å; T756-K794 PolarHBondContact OG1-NZ 3.03Å; I790-K794 HydrophobicContact CG2-CG 4.2Å; I790-K794 VanDerWaalsContact O-CB 3.27Å; I790-K794 WeakPolarHBondContact O-CB 3.28Å; I790-K794 VanDerWaalsContact O-CG 3.32Å; I790-K794 WeakPolarHBondContact O-CG 3.37Å; I790-K794 PolarHBondContact O-N 2.84Å; I791-K794 PolarHBondContact O-N 3.08Å; P792-K794 PolarHBondContact O-N 3.45Å; K794-I798 WeakPolarHBondContact O-CD1 3.23Å; K794-I798 WeakPolarHBondContact O-CG1 3.29Å; K794-T829 HydrophobicContact CB-CG2 4.16Å
795	V	92.7	Very high	92	Very high	21 Å²	21	33 Å²	33	13%	0.127	18%	0.177	C	C	.	.	H	α-helix	trans	-83.2	-40.1	-177	178.4	0	0	0	0	111.2	I791 I798 L799 C826 L830	I791-V795 HydrophobicContact CG2-CB 4.41Å; I791-V795 HydrophobicContact CG2-CG2 4.17Å; I791-V795 WeakPolarHBondContact O-CA 3.39Å; I791-V795 WeakPolarHBondContact O-CB 3.4Å; I791-V795 WeakPolarHBondContact O-CG2 3.26Å; I791-V795 PolarHBondContact O-N 3.22Å; V795-I798 PolarHBondContact O-N 3.36Å; V795-L799 HydrophobicContact CG1-CD1 3.73Å; V795-L799 HydrophobicContact CG1-CG 4Å; V795-L799 WeakPolarHBondContact O-CG 3.4Å; V795-L799 PolarHBondContact O-N 3.47Å; V795-C826 HydrophobicContact CG1-CB 4.41Å; V795-L830 HydrophobicContact CG2-CD1 4.1Å; V795-L830 HydrophobicContact CG2-CD2 3.98Å; V795-L830 HydrophobicContact CG2-CG 4.08Å
796	L	91.3	Very high	92.2	Very high	97 Å²	97	32.5 Å²	32.5	51%	0.508	18%	0.175	S	C	.	.	H	α-helix	trans	-61.2	-45	-176.5	-172.5	67.8	0	0	0	113	P792 I798 L799 L800	P792-L796 WeakPolarHBondContact O-CB 3.48Å; P792-L796 PolarHBondContact O-N 3.5Å; L796-I798 VanDerWaalsContact C-N 3.28Å; L796-I798 PolarHBondContact O-N 2.87Å; L796-L799 PolarHBondContact O-N 3.4Å; L796-L800 HydrophobicContact CD1-CD1 4.05Å; L796-L800 HydrophobicContact CD1-CG 4.2Å; L796-L800 HydrophobicContact CD2-CD1 4.43Å; L796-L800 HydrophobicContact CG-CD1 3.82Å; L796-L800 HydrophobicContact CG-CG 4.33Å; L796-L800 WeakPolarHBondContact O-CB 3.23Å; L796-L800 VanDerWaalsContact O-CG 3.3Å; L796-L800 WeakPolarHBondContact O-CG 3.36Å; L796-L800 PolarHBondContact O-N 2.94Å
797	P	91.9	Very high	92.3	Very high	4 Å²	4	38.5 Å²	38.5	3%	0.026	20%	0.196	C	C	.	.	H	α-helix	trans	-63.1	-33.4	177.3	-24.9	36.8	0	0	0	113.6	Y713 T793 F801	Y713-P797 HydrophobicContact CD2-CB 3.31Å; Y713-P797 HydrophobicContact CD2-CG 4.14Å; Y713-P797 HydrophobicContact CE2-CB 3.85Å; Y713-P797 HydrophobicContact CE2-CG 4.42Å; Y713-P797 HydrophobicContact CG-CB 3.83Å; T793-P797 WeakPolarHBondContact O-CD 3.45Å; T793-P797 WeakPolarHBondContact O-CG 3.28Å; P797-F801 HydrophobicContact CB-CD2 4.23Å; P797-F801 HydrophobicContact CB-CE2 4.47Å; P797-F801 WeakPolarHBondContact O-CB 3.34Å; P797-F801 WeakPolarHBondContact O-CD2 3.27Å; P797-F801 PolarHBondContact O-N 3.17Å
798	I	93.9	Very high	92.4	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-64.7	-55.1	175.9	-67.1	174.4	0	0	0	109	Y713 V749 K794 V795 L796 L800 F801 M802 P803 E822 L825 T829	Y713-I798 HydrophobicContact CE1-CG1 4.14Å; V749-I798 HydrophobicContact CG1-CD1 3.97Å; V749-I798 HydrophobicContact CG2-CD1 4.16Å; V749-I798 HydrophobicContact CG2-CG1 4.5Å; K794-I798 WeakPolarHBondContact O-CD1 3.23Å; K794-I798 WeakPolarHBondContact O-CG1 3.29Å; V795-I798 PolarHBondContact O-N 3.36Å; L796-I798 VanDerWaalsContact C-N 3.28Å; L796-I798 PolarHBondContact O-N 2.87Å; I798-L800 PolarHBondContact O-N 2.87Å; I798-L800 VanDerWaalsContact O-N 3.11Å; I798-F801 PolarHBondContact O-N 3.28Å; I798-M802 HydrophobicContact CB-CG 4.41Å; I798-M802 HydrophobicContact CG2-CB 4.28Å; I798-M802 HydrophobicContact CG2-CG 3.98Å; I798-M802 VanDerWaalsContact O-CB 3.28Å; I798-M802 WeakPolarHBondContact O-CB 3.48Å; I798-M802 PolarHBondContact O-N 3.06Å; I798-P803 WeakPolarHBondContact O-CD 3.42Å; I798-E822 WeakPolarHBondContact CG2-OE2 3.33Å; I798-L825 HydrophobicContact CG2-CB 3.94Å; I798-T829 HydrophobicContact CD1-CG2 3.35Å
799	L	94.5	Very high	92.6	Very high	88 Å²	88	35.9 Å²	35.9	46%	0.461	18%	0.181	S	C	.	.	H	α-helix	trans	-59.6	-26.7	-179.2	-66.9	178.6	0	0	0	113.9	V795 L796 P803 E822	V795-L799 HydrophobicContact CG1-CD1 3.73Å; V795-L799 HydrophobicContact CG1-CG 4Å; V795-L799 WeakPolarHBondContact O-CG 3.4Å; V795-L799 PolarHBondContact O-N 3.47Å; L796-L799 PolarHBondContact O-N 3.4Å; L799-P803 VanDerWaalsContact O-CG 3.31Å; L799-P803 WeakPolarHBondContact O-CG 3.21Å; L799-E822 HydrophobicContact CD2-CB 4.4Å
800	L	92.9	Very high	92.9	Very high	96 Å²	96	37 Å²	37	50%	0.503	20%	0.195	S	C	.	.	H	α-helix	trans	-89.1	-41.5	-179.8	-68.7	177.6	0	0	0	113.3	L796 I798	L796-L800 HydrophobicContact CD1-CD1 4.05Å; L796-L800 HydrophobicContact CD1-CG 4.2Å; L796-L800 HydrophobicContact CD2-CD1 4.43Å; L796-L800 HydrophobicContact CG-CD1 3.82Å; L796-L800 HydrophobicContact CG-CG 4.33Å; L796-L800 WeakPolarHBondContact O-CB 3.23Å; L796-L800 VanDerWaalsContact O-CG 3.3Å; L796-L800 WeakPolarHBondContact O-CG 3.36Å; L796-L800 PolarHBondContact O-N 2.94Å; I798-L800 PolarHBondContact O-N 2.87Å; I798-L800 VanDerWaalsContact O-N 3.11Å
801	F	94.2	Very high	93	Very high	33 Å²	33	37.1 Å²	37.1	15%	0.145	20%	0.196	C	C	.	.	H	α-helix	trans	-107.9	-30.2	-169.6	-56.7	-63.3	0	0	0	114.7	T710 L714 A717 P797 I798 P803 I804	T710-F801 HydrophobicContact CG2-CE2 3.39Å; T710-F801 HydrophobicContact CG2-CZ 3.69Å; T710-F801 WeakPolarHBondContact O-CE2 3.49Å; L714-F801 HydrophobicContact CB-CD1 3.82Å; L714-F801 HydrophobicContact CB-CE1 3.85Å; L714-F801 HydrophobicContact CB-CG 4.19Å; L714-F801 HydrophobicContact CB-CZ 4.24Å; L714-F801 HydrophobicContact CD1-CD1 3.66Å; L714-F801 HydrophobicContact CD1-CE1 3.84Å; L714-F801 HydrophobicContact CD2-CE1 4.44Å; L714-F801 HydrophobicContact CG-CD1 4.3Å; L714-F801 HydrophobicContact CG-CE1 4.24Å; A717-F801 HydrophobicContact CB-CB 4.16Å; A717-F801 WeakPolarHBondContact CB-O 3.44Å; P797-F801 HydrophobicContact CB-CD2 4.23Å; P797-F801 HydrophobicContact CB-CE2 4.47Å; P797-F801 WeakPolarHBondContact O-CB 3.34Å; P797-F801 WeakPolarHBondContact O-CD2 3.27Å; P797-F801 PolarHBondContact O-N 3.17Å; I798-F801 PolarHBondContact O-N 3.28Å; F801-P803 VanDerWaalsContact C-N 3.29Å; F801-I804 HydrophobicContact CD1-CD1 4.15Å; F801-I804 VanDerWaalsContact O-CB 3.29Å; F801-I804 WeakPolarHBondContact O-CB 3.34Å; F801-I804 PolarHBondContact O-N 3.31Å
802	M	94.4	Very high	93	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-63	-27.4	175.6	-69.8	-68.3	162	0	0	114.2	Y713 F716 V749 I798 I804 C805 Y806 F821 E822 L825	Y713-M802 HydrophobicContact CD1-CE 3.65Å; Y713-M802 HydrophobicContact CE1-CE 3.87Å; F716-M802 HydrophobicContact CD1-CE 3.78Å; F716-M802 HydrophobicContact CE1-CE 4.03Å; V749-M802 HydrophobicContact CG2-CE 4.29Å; I798-M802 HydrophobicContact CB-CG 4.41Å; I798-M802 HydrophobicContact CG2-CB 4.28Å; I798-M802 HydrophobicContact CG2-CG 3.98Å; I798-M802 VanDerWaalsContact O-CB 3.28Å; I798-M802 WeakPolarHBondContact O-CB 3.48Å; I798-M802 PolarHBondContact O-N 3.06Å; M802-I804 PolarHBondContact O-N 3.5Å; M802-C805 PolarHBondContact O-N 3.46Å; M802-Y806 PolarHBondContact O-N 2.89Å; M802-F821 HydrophobicContact CB-CE1 4.2Å; M802-E822 WeakPolarHBondContact CB-OE1 3.33Å; M802-L825 HydrophobicContact CB-CD1 4.18Å; M802-L825 HydrophobicContact CG-CD1 3.97Å; M802-L825 HydrophobicContact SD-CD1 4.16Å
803	P	95.6	Very high	93.1	Very high	21 Å²	21	41.8 Å²	41.8	14%	0.136	21%	0.21	C	C	.	.	H	α-helix	trans	-57.9	-35.7	170	-27.5	36	0	0	0	113.1	I798 L799 F801 C805 Y806 W807 F818 E822	I798-P803 WeakPolarHBondContact O-CD 3.42Å; L799-P803 VanDerWaalsContact O-CG 3.31Å; L799-P803 WeakPolarHBondContact O-CG 3.21Å; F801-P803 VanDerWaalsContact C-N 3.29Å; P803-C805 VanDerWaalsContact C-N 3.33Å; P803-C805 PolarHBondContact O-N 3.4Å; P803-Y806 WeakPolarHBondContact O-CB 3.31Å; P803-Y806 PolarHBondContact O-N 2.93Å; P803-W807 PolarHBondContact O-N 3.02Å; P803-F818 HydrophobicContact CB-CE2 3.87Å; P803-F818 HydrophobicContact CB-CZ 4.08Å; P803-F818 HydrophobicContact CG-CE2 3.96Å; P803-F818 HydrophobicContact CG-CZ 3.91Å; P803-E822 WeakPolarHBondContact CD-OE1 3.36Å; P803-E822 WeakPolarHBondContact CG-OE1 3.45Å
804	I	95.4	Very high	93.3	Very high	55 Å²	55	45 Å²	45	28%	0.282	23%	0.229	S	C	.	.	H	α-helix	trans	-59.2	-48.3	178.4	-58.9	172.9	0	0	0	109.6	L714 A717 L718 F801 M802 Y806 M808	L714-I804 HydrophobicContact CD1-CD1 4.1Å; A717-I804 HydrophobicContact CB-CB 4.43Å; L718-I804 HydrophobicContact CD2-CG2 4.04Å; F801-I804 HydrophobicContact CD1-CD1 4.15Å; F801-I804 VanDerWaalsContact O-CB 3.29Å; F801-I804 WeakPolarHBondContact O-CB 3.34Å; F801-I804 PolarHBondContact O-N 3.31Å; M802-I804 PolarHBondContact O-N 3.5Å; I804-Y806 PolarHBondContact O-N 3.28Å; I804-M808 HydrophobicContact CG2-CG 4.32Å; I804-M808 HydrophobicContact CG2-SD 3.62Å; I804-M808 WeakPolarHBondContact O-CB 3.22Å; I804-M808 VanDerWaalsContact O-CG 3.22Å; I804-M808 WeakPolarHBondContact O-CG 3.49Å; I804-M808 PolarHBondContact O-N 3.31Å
805	C	94.9	Very high	93.4	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.014	26%	0.26	C	S	.	.	H	α-helix	trans	-63.1	-41.1	177.8	-170.1	0	0	0	0	112	A717 M802 P803 A809	A717-C805 HydrophobicContact CB-CB 4.24Å; M802-C805 PolarHBondContact O-N 3.46Å; P803-C805 VanDerWaalsContact C-N 3.33Å; P803-C805 PolarHBondContact O-N 3.4Å; C805-A809 WeakPolarHBondContact O-CB 3.31Å; C805-A809 PolarHBondContact O-N 3.44Å
806	Y	95.3	Very high	93.4	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-60.1	-49.1	-179.8	-173.8	-87.6	0	0	0	112.4	M802 P803 I804 G810 L811 Q812 F818 F821	M802-Y806 PolarHBondContact O-N 2.89Å; P803-Y806 WeakPolarHBondContact O-CB 3.31Å; P803-Y806 PolarHBondContact O-N 2.93Å; I804-Y806 PolarHBondContact O-N 3.28Å; Y806-G810 PolarHBondContact O-N 3.48Å; Y806-L811 HydrophobicContact CD2-CB 4.08Å; Y806-L811 HydrophobicContact CD2-CD1 3.48Å; Y806-L811 VanDerWaalsContact CD2-CD1 3.48Å; Y806-L811 HydrophobicContact CD2-CG 4.42Å; Y806-L811 HydrophobicContact CE1-CB 4.23Å; Y806-L811 HydrophobicContact CE2-CB 3.8Å; Y806-L811 HydrophobicContact CE2-CD1 3.8Å; Y806-L811 HydrophobicContact CE2-CG 4.48Å; Y806-L811 HydrophobicContact CG-CB 4.43Å; Y806-L811 HydrophobicContact CG-CD1 4.14Å; Y806-Q812 WeakPolarHBondContact CE1-O 3.3Å; Y806-Q812 PolarHBondContact OH-O 2.95Å; Y806-F818 AromaticContact CD1-CD2 3.82Å; Y806-F818 HydrophobicContact CD1-CD2 3.82Å; Y806-F818 HydrophobicContact CD2-CD2 4.36Å; Y806-F818 HydrophobicContact CE1-CB 3.91Å; Y806-F818 HydrophobicContact CE1-CD2 4.08Å; Y806-F818 HydrophobicContact CE1-CG 4.45Å; Y806-F818 AromaticContact CG-CD2 3.97Å; Y806-F818 HydrophobicContact CG-CD2 3.97Å; Y806-F818 PolarHBondContact OH-N 2.73Å; Y806-F821 HydrophobicContact CD2-CB 4.1Å; Y806-F821 AromaticContact CD2-CD1 3.6Å; Y806-F821 HydrophobicContact CD2-CD1 3.6Å; Y806-F821 AromaticContact CD2-CD2 3.95Å; Y806-F821 HydrophobicContact CD2-CD2 3.95Å; Y806-F821 AromaticContact CD2-CE1 3.93Å; Y806-F821 HydrophobicContact CD2-CE1 3.93Å; Y806-F821 HydrophobicContact CD2-CE2 4.28Å; Y806-F821 AromaticContact CD2-CG 3.62Å; Y806-F821 HydrophobicContact CD2-CG 3.62Å; Y806-F821 HydrophobicContact CD2-CZ 4.27Å; Y806-F821 HydrophobicContact CE2-CB 3.87Å; Y806-F821 HydrophobicContact CE2-CD1 4.25Å; Y806-F821 HydrophobicContact CE2-CD2 4.22Å; Y806-F821 AromaticContact CE2-CG 3.88Å; Y806-F821 HydrophobicContact CE2-CG 3.88Å; Y806-F821 HydrophobicContact CG-CD1 4.42Å
807	W	95.1	Very high	93.4	Very high	144 Å²	144	49.1 Å²	49.1	55%	0.545	26%	0.257	S	S	.	.	H	α-helix	trans	-75.3	-37.1	-177.8	-64.6	113.3	0	0	0	112.7	P803 G810	P803-W807 PolarHBondContact O-N 3.02Å; W807-G810 PolarHBondContact O-N 3.41Å
808	M	94.7	Very high	93.6	Very high	46 Å²	46	50.3 Å²	50.3	23%	0.227	26%	0.262	C	S	.	.	H	α-helix	trans	-66.3	-36.9	175.5	-72.4	-178.6	73.3	0	0	112.5	L718 I722 F725 Q726 I804 G810	L718-M808 HydrophobicContact CD2-SD 4.43Å; I722-M808 HydrophobicContact CG1-CE 3.89Å; F725-M808 HydrophobicContact CD2-CE 4.32Å; Q726-M808 PolarHBondContact N-O 3.3Å; I804-M808 HydrophobicContact CG2-CG 4.32Å; I804-M808 HydrophobicContact CG2-SD 3.62Å; I804-M808 WeakPolarHBondContact O-CB 3.22Å; I804-M808 VanDerWaalsContact O-CG 3.22Å; I804-M808 WeakPolarHBondContact O-CG 3.49Å; I804-M808 PolarHBondContact O-N 3.31Å; M808-G810 VanDerWaalsContact C-N 3.26Å; M808-G810 PolarHBondContact O-N 3.11Å
809	A	93.8	Very high	93.6	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-72	-18.7	179.8	0	0	0	0	0	113.9	Y724 M727 L741 C805 L811	Y724-A809 VanDerWaalsContact O-CA 3.3Å; Y724-A809 WeakPolarHBondContact O-CA 3.44Å; M727-A809 HydrophobicContact CE-CB 4.2Å; M727-A809 PolarHBondContact N-O 3.21Å; M727-A809 VanDerWaalsContact N-O 3.1Å; L741-A809 HydrophobicContact CD2-CB 3.49Å; L741-A809 VanDerWaalsContact CD2-CB 3.49Å; C805-A809 WeakPolarHBondContact O-CB 3.31Å; C805-A809 PolarHBondContact O-N 3.44Å; A809-L811 HydrophobicContact CB-CG 4.29Å
810	G	92.2	Very high	93.7	Very high	36 Å²	36	51.2 Å²	51.2	37%	0.371	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.7	32.5	-179.8	0	0	0	0	0	114.3	Y806 W807 M808	Y806-G810 PolarHBondContact O-N 3.48Å; W807-G810 PolarHBondContact O-N 3.41Å; M808-G810 VanDerWaalsContact C-N 3.26Å; M808-G810 PolarHBondContact O-N 3.11Å
811	L	92.8	Very high	93.8	Very high	6 Å²	6	46.7 Å²	46.7	3%	0.031	24%	0.241	C	C	.	.			trans	-64.6	175.2	175.1	-66.4	171.7	0	0	0	112.3	M727 L741 F742 Y806 A809 K813 F821 E897	M727-L811 HydrophobicContact CE-CD2 3.71Å; M727-L811 HydrophobicContact CE-CG 4.42Å; L741-L811 HydrophobicContact CD2-CD1 4.2Å; L741-L811 HydrophobicContact CD2-CD2 4.35Å; L741-L811 HydrophobicContact CD2-CG 4.43Å; F742-L811 HydrophobicContact CE1-CD1 3.75Å; F742-L811 HydrophobicContact CE1-CD2 4Å; F742-L811 HydrophobicContact CZ-CD1 4.24Å; F742-L811 HydrophobicContact CZ-CD2 3.78Å; Y806-L811 HydrophobicContact CD2-CB 4.08Å; Y806-L811 HydrophobicContact CD2-CD1 3.48Å; Y806-L811 VanDerWaalsContact CD2-CD1 3.48Å; Y806-L811 HydrophobicContact CD2-CG 4.42Å; Y806-L811 HydrophobicContact CE1-CB 4.23Å; Y806-L811 HydrophobicContact CE2-CB 3.8Å; Y806-L811 HydrophobicContact CE2-CD1 3.8Å; Y806-L811 HydrophobicContact CE2-CG 4.48Å; Y806-L811 HydrophobicContact CG-CB 4.43Å; Y806-L811 HydrophobicContact CG-CD1 4.14Å; A809-L811 HydrophobicContact CB-CG 4.29Å; L811-K813 PolarHBondContact O-N 3.16Å; L811-F821 HydrophobicContact CD1-CE2 4.32Å; L811-E897 HydrophobicContact CD2-CG 4.14Å; L811-E897 WeakPolarHBondContact CD2-OE1 3.21Å
812	Q	90.9	Very high	93.8	Very high	25 Å²	25	45.5 Å²	45.5	12%	0.117	24%	0.236	C	C	.	.			trans	-46.8	128	-178.6	-83.1	-177.6	23.9	0	0	114	Y806 T814 A817 M896 E897 T900	Y806-Q812 WeakPolarHBondContact CE1-O 3.3Å; Y806-Q812 PolarHBondContact OH-O 2.95Å; Q812-T814 PolarHBondContact O-N 2.8Å; Q812-T814 VanDerWaalsContact O-N 3.17Å; Q812-A817 HydrophobicContact CB-CB 3.97Å; Q812-M896 PolarHBondContact NE2-O 3.15Å; Q812-E897 WeakPolarHBondContact CG-OE2 3.48Å; Q812-E897 PolarHBondContact N-OE2 2.93Å; Q812-E897 VanDerWaalsContact N-OE2 3.16Å; Q812-E897 VanDerWaalsContact NE2-CA 3.35Å; Q812-E897 PolarHBondContact NE2-O 3.23Å; Q812-T900 PolarHBondContact NE2-OG1 3.13Å
813	K	89.2	Confident	93.9	Very high	186 Å²	186	48.5 Å²	48.5	81%	0.809	25%	0.252	S	S	*	.			trans	-77.4	-0.9	-175.8	-60.1	179.1	-177.5	176.6	0	114.5	L811	L811-K813 PolarHBondContact O-N 3.16Å
814	T	92.6	Very high	94	Very high	81 Å²	81	47.5 Å²	47.5	50%	0.497	25%	0.245	S	C	.	.			trans	-75.2	133.8	-178.1	65.6	0	0	0	0	110.4	Q812 G816 A817 F818	Q812-T814 PolarHBondContact O-N 2.8Å; Q812-T814 VanDerWaalsContact O-N 3.17Å; T814-G816 PolarHBondContact O-N 2.9Å; T814-A817 PolarHBondContact O-N 3.42Å; T814-A817 VanDerWaalsContact O-N 3.12Å; T814-A817 WeakPolarHBondContact OG1-CB 3.45Å; T814-A817 PolarHBondContact OG1-N 2.83Å; T814-F818 PolarHBondContact O-N 3.37Å
815	F	93.1	Very high	94	Very high	153 Å²	153	44.9 Å²	44.9	67%	0.671	23%	0.232	S	C	*	.	H	α-helix	trans	-59.1	-35.1	179.6	-180	-104	0	0	0	112.5	F818 M819	F815-F818 HydrophobicContact CD2-CD1 4.41Å; F815-F818 HydrophobicContact CE2-CD1 4.36Å; F815-F818 PolarHBondContact O-N 3.48Å; F815-M819 HydrophobicContact CD1-CG 4.08Å; F815-M819 HydrophobicContact CD2-CG 4.38Å; F815-M819 HydrophobicContact CE1-CG 3.56Å; F815-M819 HydrophobicContact CE1-SD 4.37Å; F815-M819 HydrophobicContact CE2-CG 3.9Å; F815-M819 HydrophobicContact CE2-SD 4.05Å; F815-M819 HydrophobicContact CG-CG 4.47Å; F815-M819 HydrophobicContact CZ-CG 3.46Å; F815-M819 VanDerWaalsContact CZ-CG 3.46Å; F815-M819 HydrophobicContact CZ-SD 3.7Å; F815-M819 WeakPolarHBondContact O-CG 3.48Å; F815-M819 PolarHBondContact O-N 3.02Å
816	G	92.8	Very high	94.1	Very high	51 Å²	51	45.4 Å²	45.4	53%	0.526	24%	0.235	S	C	.	.	H	α-helix	trans	-62.6	-39.8	176.2	0	0	0	0	0	113.4	T814 F820	T814-G816 PolarHBondContact O-N 2.9Å; G816-F820 VanDerWaalsContact O-CB 3.31Å; G816-F820 WeakPolarHBondContact O-CB 3.29Å; G816-F820 PolarHBondContact O-N 3.24Å
817	A	92.1	Very high	94.2	Very high	4 Å²	4	45.8 Å²	45.8	3%	0.033	24%	0.237	C	C	.	.	H	α-helix	trans	-66.7	-45.5	175.6	0	0	0	0	0	111.1	Q812 T814 M819 F820 F821 M896	Q812-A817 HydrophobicContact CB-CB 3.97Å; T814-A817 PolarHBondContact O-N 3.42Å; T814-A817 VanDerWaalsContact O-N 3.12Å; T814-A817 WeakPolarHBondContact OG1-CB 3.45Å; T814-A817 PolarHBondContact OG1-N 2.83Å; A817-M819 PolarHBondContact O-N 3.49Å; A817-F820 PolarHBondContact O-N 3.36Å; A817-F820 VanDerWaalsContact O-N 3.16Å; A817-F821 WeakPolarHBondContact O-CB 3.48Å; A817-F821 PolarHBondContact O-N 3.26Å; A817-M896 VanDerWaalsContact CA-SD 3.58Å; A817-M896 HydrophobicContact CB-CE 4.26Å; A817-M896 HydrophobicContact CB-CG 3.89Å; A817-M896 HydrophobicContact CB-SD 3.72Å
818	F	95	Very high	94.2	Very high	30 Å²	30	38.9 Å²	38.9	13%	0.132	21%	0.211	C	C	.	.	H	α-helix	trans	-56.8	-49.1	176.3	168.7	-107.6	0	0	0	112.5	P803 Y806 T814 F815 F820 F821 E822	P803-F818 HydrophobicContact CB-CE2 3.87Å; P803-F818 HydrophobicContact CB-CZ 4.08Å; P803-F818 HydrophobicContact CG-CE2 3.96Å; P803-F818 HydrophobicContact CG-CZ 3.91Å; Y806-F818 AromaticContact CD1-CD2 3.82Å; Y806-F818 HydrophobicContact CD1-CD2 3.82Å; Y806-F818 HydrophobicContact CD2-CD2 4.36Å; Y806-F818 HydrophobicContact CE1-CB 3.91Å; Y806-F818 HydrophobicContact CE1-CD2 4.08Å; Y806-F818 HydrophobicContact CE1-CG 4.45Å; Y806-F818 AromaticContact CG-CD2 3.97Å; Y806-F818 HydrophobicContact CG-CD2 3.97Å; Y806-F818 PolarHBondContact OH-N 2.73Å; T814-F818 PolarHBondContact O-N 3.37Å; F815-F818 HydrophobicContact CD2-CD1 4.41Å; F815-F818 HydrophobicContact CE2-CD1 4.36Å; F815-F818 PolarHBondContact O-N 3.48Å; F818-F820 VanDerWaalsContact C-N 3.3Å; F818-F820 PolarHBondContact O-N 3.37Å; F818-F821 WeakPolarHBondContact O-CB 3.37Å; F818-F821 PolarHBondContact O-N 3.25Å; F818-E822 HydrophobicContact CD2-CG 4.39Å; F818-E822 HydrophobicContact CE1-CG 4.48Å; F818-E822 HydrophobicContact CE2-CG 3.8Å; F818-E822 HydrophobicContact CZ-CG 3.86Å; F818-E822 PolarHBondContact O-N 2.91Å
819	M	95.1	Very high	94.3	Very high	94 Å²	94	36.7 Å²	36.7	46%	0.463	20%	0.2	S	C	.	.	H	α-helix	trans	-65.2	-34.1	178.6	-69.5	-61.1	-65.7	0	0	112.5	F815 A817 L823	F815-M819 HydrophobicContact CD1-CG 4.08Å; F815-M819 HydrophobicContact CD2-CG 4.38Å; F815-M819 HydrophobicContact CE1-CG 3.56Å; F815-M819 HydrophobicContact CE1-SD 4.37Å; F815-M819 HydrophobicContact CE2-CG 3.9Å; F815-M819 HydrophobicContact CE2-SD 4.05Å; F815-M819 HydrophobicContact CG-CG 4.47Å; F815-M819 HydrophobicContact CZ-CG 3.46Å; F815-M819 VanDerWaalsContact CZ-CG 3.46Å; F815-M819 HydrophobicContact CZ-SD 3.7Å; F815-M819 WeakPolarHBondContact O-CG 3.48Å; F815-M819 PolarHBondContact O-N 3.02Å; A817-M819 PolarHBondContact O-N 3.49Å; M819-L823 VanDerWaalsContact O-CB 3.24Å; M819-L823 WeakPolarHBondContact O-CB 3.33Å; M819-L823 PolarHBondContact O-N 3.44Å
820	F	94.8	Very high	94.4	Very high	13 Å²	13	37.8 Å²	37.8	6%	0.057	21%	0.206	C	C	.	.	H	α-helix	trans	-71.2	-39.7	176.9	-170.5	-92.6	0	0	0	112.1	G816 A817 F818 L823 I824 M896 L937 V941	G816-F820 VanDerWaalsContact O-CB 3.31Å; G816-F820 WeakPolarHBondContact O-CB 3.29Å; G816-F820 PolarHBondContact O-N 3.24Å; A817-F820 PolarHBondContact O-N 3.36Å; A817-F820 VanDerWaalsContact O-N 3.16Å; F818-F820 VanDerWaalsContact C-N 3.3Å; F818-F820 PolarHBondContact O-N 3.37Å; F820-L823 PolarHBondContact O-N 3.1Å; F820-I824 HydrophobicContact CD1-CG1 3.94Å; F820-I824 HydrophobicContact CE1-CD1 4.01Å; F820-I824 HydrophobicContact CE1-CG1 3.4Å; F820-I824 VanDerWaalsContact CE1-CG1 3.4Å; F820-I824 HydrophobicContact CE2-CG1 4.41Å; F820-I824 HydrophobicContact CZ-CD1 3.81Å; F820-I824 HydrophobicContact CZ-CG1 3.66Å; F820-I824 WeakPolarHBondContact O-CG1 3.44Å; F820-I824 PolarHBondContact O-N 2.92Å; F820-M896 HydrophobicContact CB-SD 4.16Å; F820-M896 HydrophobicContact CD1-CB 4.15Å; F820-M896 HydrophobicContact CD1-CG 4.25Å; F820-M896 HydrophobicContact CD1-SD 3.97Å; F820-L937 HydrophobicContact CD1-CD1 4.01Å; F820-L937 HydrophobicContact CD1-CD2 4.37Å; F820-L937 HydrophobicContact CD1-CG 4.35Å; F820-L937 HydrophobicContact CD2-CD2 3.97Å; F820-L937 HydrophobicContact CD2-CG 4.22Å; F820-L937 HydrophobicContact CE1-CD1 3.34Å; F820-L937 HydrophobicContact CE1-CD2 4.24Å; F820-L937 HydrophobicContact CE1-CG 3.75Å; F820-L937 HydrophobicContact CE2-CD1 4.18Å; F820-L937 HydrophobicContact CE2-CD2 3.83Å; F820-L937 HydrophobicContact CE2-CG 3.59Å; F820-L937 HydrophobicContact CG-CD2 4.25Å; F820-L937 HydrophobicContact CZ-CD1 3.46Å; F820-L937 VanDerWaalsContact CZ-CD1 3.46Å; F820-L937 HydrophobicContact CZ-CD2 4Å; F820-L937 HydrophobicContact CZ-CG 3.34Å; F820-V941 HydrophobicContact CE2-CG2 3.57Å; F820-V941 HydrophobicContact CZ-CG2 3.78Å
821	F	95.6	Very high	94.5	Very high	1 Å²	1	36 Å²	36	0%	0.004	19%	0.188	C	C	.	.	H	α-helix	trans	-55.8	-53.7	171.8	171.3	-91	0	0	0	110.8	F742 M802 Y806 L811 A817 F818 L823 I824 L825 L893 M896	F742-F821 HydrophobicContact CD1-CE2 4.09Å; F742-F821 HydrophobicContact CE1-CD2 4.02Å; F742-F821 AromaticContact CE1-CE2 3.85Å; F742-F821 HydrophobicContact CE1-CE2 3.85Å; M802-F821 HydrophobicContact CB-CE1 4.2Å; Y806-F821 HydrophobicContact CD2-CB 4.1Å; Y806-F821 AromaticContact CD2-CD1 3.6Å; Y806-F821 HydrophobicContact CD2-CD1 3.6Å; Y806-F821 AromaticContact CD2-CD2 3.95Å; Y806-F821 HydrophobicContact CD2-CD2 3.95Å; Y806-F821 AromaticContact CD2-CE1 3.93Å; Y806-F821 HydrophobicContact CD2-CE1 3.93Å; Y806-F821 HydrophobicContact CD2-CE2 4.28Å; Y806-F821 AromaticContact CD2-CG 3.62Å; Y806-F821 HydrophobicContact CD2-CG 3.62Å; Y806-F821 HydrophobicContact CD2-CZ 4.27Å; Y806-F821 HydrophobicContact CE2-CB 3.87Å; Y806-F821 HydrophobicContact CE2-CD1 4.25Å; Y806-F821 HydrophobicContact CE2-CD2 4.22Å; Y806-F821 AromaticContact CE2-CG 3.88Å; Y806-F821 HydrophobicContact CE2-CG 3.88Å; Y806-F821 HydrophobicContact CG-CD1 4.42Å; L811-F821 HydrophobicContact CD1-CE2 4.32Å; A817-F821 WeakPolarHBondContact O-CB 3.48Å; A817-F821 PolarHBondContact O-N 3.26Å; F818-F821 WeakPolarHBondContact O-CB 3.37Å; F818-F821 PolarHBondContact O-N 3.25Å; F821-L823 PolarHBondContact O-N 2.75Å; F821-I824 PolarHBondContact O-N 3.38Å; F821-L825 HydrophobicContact CD1-CD1 4.12Å; F821-L825 HydrophobicContact CE1-CD1 3.5Å; F821-L825 HydrophobicContact CE2-CD1 4.05Å; F821-L825 HydrophobicContact CZ-CD1 3.45Å; F821-L825 VanDerWaalsContact CZ-CD1 3.45Å; F821-L825 HydrophobicContact CZ-CG 4.45Å; F821-L825 WeakPolarHBondContact O-CG 3.15Å; F821-L825 PolarHBondContact O-N 3.49Å; F821-L825 VanDerWaalsContact O-N 3.08Å; F821-L893 HydrophobicContact CB-CD2 4.38Å; F821-L893 HydrophobicContact CD2-CD2 3.6Å; F821-L893 HydrophobicContact CE2-CD2 4.26Å; F821-L893 HydrophobicContact CG-CD2 4.28Å; F821-M896 HydrophobicContact CB-CE 4.31Å; F821-M896 HydrophobicContact CB-SD 4.22Å
822	E	95.4	Very high	94.7	Very high	7 Å²	7	35.8 Å²	35.8	3%	0.033	19%	0.186	C	C	.	.	H	α-helix	trans	-59.7	-44.8	177.1	-74.9	-62.4	152.5	0	0	112.2	I798 L799 M802 P803 F818 I824 L825 C826	I798-E822 WeakPolarHBondContact CG2-OE2 3.33Å; L799-E822 HydrophobicContact CD2-CB 4.4Å; M802-E822 WeakPolarHBondContact CB-OE1 3.33Å; P803-E822 WeakPolarHBondContact CD-OE1 3.36Å; P803-E822 WeakPolarHBondContact CG-OE1 3.45Å; F818-E822 HydrophobicContact CD2-CG 4.39Å; F818-E822 HydrophobicContact CE1-CG 4.48Å; F818-E822 HydrophobicContact CE2-CG 3.8Å; F818-E822 HydrophobicContact CZ-CG 3.86Å; F818-E822 PolarHBondContact O-N 2.91Å; E822-I824 PolarHBondContact O-N 3.3Å; E822-L825 PolarHBondContact O-N 3.32Å; E822-C826 WeakPolarHBondContact O-CB 3.32Å; E822-C826 PolarHBondContact O-N 3.47Å; E822-C826 PolarHBondContact O-SG 2.89Å
823	L	96.2	Very high	94.8	Very high	64 Å²	64	34.6 Å²	34.6	34%	0.335	18%	0.181	S	C	.	.	H	α-helix	trans	-59.7	-47.5	178.4	177.4	65.1	0	0	0	111.9	M819 F820 F821 C826 L827 W938 V941	M819-L823 VanDerWaalsContact O-CB 3.24Å; M819-L823 WeakPolarHBondContact O-CB 3.33Å; M819-L823 PolarHBondContact O-N 3.44Å; F820-L823 PolarHBondContact O-N 3.1Å; F821-L823 PolarHBondContact O-N 2.75Å; L823-C826 PolarHBondContact O-N 2.9Å; L823-L827 HydrophobicContact CD1-CD1 3.92Å; L823-L827 HydrophobicContact CD1-CG 4.14Å; L823-L827 HydrophobicContact CG-CD1 4.01Å; L823-L827 WeakPolarHBondContact O-CB 3.14Å; L823-L827 VanDerWaalsContact O-CG 3.29Å; L823-L827 WeakPolarHBondContact O-CG 3.25Å; L823-L827 PolarHBondContact O-N 3.22Å; L823-W938 HydrophobicContact CD2-CH2 4.49Å; L823-W938 HydrophobicContact CD2-CZ3 4.1Å; L823-V941 HydrophobicContact CD2-CG2 4.35Å
824	I	96.4	Very high	95.1	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-62.7	-44.2	179.3	-75	-69.5	0	0	0	110.8	F820 F821 E822 L827 T828 L893 N940 V941 L944	F820-I824 HydrophobicContact CD1-CG1 3.94Å; F820-I824 HydrophobicContact CE1-CD1 4.01Å; F820-I824 HydrophobicContact CE1-CG1 3.4Å; F820-I824 VanDerWaalsContact CE1-CG1 3.4Å; F820-I824 HydrophobicContact CE2-CG1 4.41Å; F820-I824 HydrophobicContact CZ-CD1 3.81Å; F820-I824 HydrophobicContact CZ-CG1 3.66Å; F820-I824 WeakPolarHBondContact O-CG1 3.44Å; F820-I824 PolarHBondContact O-N 2.92Å; F821-I824 PolarHBondContact O-N 3.38Å; E822-I824 PolarHBondContact O-N 3.3Å; I824-L827 PolarHBondContact O-N 2.9Å; I824-T828 VanDerWaalsContact O-CB 3.25Å; I824-T828 WeakPolarHBondContact O-CB 3.49Å; I824-T828 PolarHBondContact O-N 3.08Å; I824-T828 PolarHBondContact O-OG1 3.01Å; I824-L893 HydrophobicContact CB-CD2 4.15Å; I824-L893 HydrophobicContact CG2-CD1 4.46Å; I824-L893 HydrophobicContact CG2-CD2 3.93Å; I824-L893 HydrophobicContact CG2-CG 3.88Å; I824-N940 HydrophobicContact CD1-CB 4.44Å; I824-V941 HydrophobicContact CD1-CG2 3.64Å; I824-V941 HydrophobicContact CG1-CG2 4.48Å; I824-L944 HydrophobicContact CD1-CD1 3.98Å; I824-L944 HydrophobicContact CG2-CD1 4.39Å
825	L	96.7	Very high	95.2	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-64	-43.2	177.7	-66.5	-174.7	0	0	0	111.7	C745 V749 I798 M802 F821 E822 L827 T828 T829 L893	C745-L825 HydrophobicContact CB-CD2 4.43Å; V749-L825 VanDerWaalsContact CG1-O 3.27Å; V749-L825 WeakPolarHBondContact CG1-O 3.27Å; V749-L825 HydrophobicContact CG2-CD2 4.3Å; I798-L825 HydrophobicContact CG2-CB 3.94Å; M802-L825 HydrophobicContact CB-CD1 4.18Å; M802-L825 HydrophobicContact CG-CD1 3.97Å; M802-L825 HydrophobicContact SD-CD1 4.16Å; F821-L825 HydrophobicContact CD1-CD1 4.12Å; F821-L825 HydrophobicContact CE1-CD1 3.5Å; F821-L825 HydrophobicContact CE2-CD1 4.05Å; F821-L825 HydrophobicContact CZ-CD1 3.45Å; F821-L825 VanDerWaalsContact CZ-CD1 3.45Å; F821-L825 HydrophobicContact CZ-CG 4.45Å; F821-L825 WeakPolarHBondContact O-CG 3.15Å; F821-L825 PolarHBondContact O-N 3.49Å; F821-L825 VanDerWaalsContact O-N 3.08Å; E822-L825 PolarHBondContact O-N 3.32Å; L825-L827 PolarHBondContact O-N 3.46Å; L825-T828 WeakPolarHBondContact O-CB 3.42Å; L825-T828 PolarHBondContact O-N 3.11Å; L825-T829 PolarHBondContact O-N 3.47Å; L825-L893 HydrophobicContact CD2-CD1 4.09Å
826	C	96.4	Very high	95.2	Very high	12 Å²	12	14.7 Å²	14.7	8%	0.081	9%	0.087	C	C	.	.	H	α-helix	trans	-60.2	-46	175.8	-70	0	0	0	0	112.1	V795 E822 L823 T828 T829 L830	V795-C826 HydrophobicContact CG1-CB 4.41Å; E822-C826 WeakPolarHBondContact O-CB 3.32Å; E822-C826 PolarHBondContact O-N 3.47Å; E822-C826 PolarHBondContact O-SG 2.89Å; L823-C826 PolarHBondContact O-N 2.9Å; C826-T828 VanDerWaalsContact C-N 3.33Å; C826-T828 PolarHBondContact O-N 3.11Å; C826-T829 WeakPolarHBondContact O-CG2 3.49Å; C826-T829 PolarHBondContact O-N 3.17Å; C826-L830 VanDerWaalsContact O-CG 3.27Å; C826-L830 WeakPolarHBondContact O-CG 3.27Å; C826-L830 PolarHBondContact O-N 3.01Å; C826-L830 VanDerWaalsContact O-N 3.07Å
827	L	96.4	Very high	95.2	Very high	8 Å²	8	12.3 Å²	12.3	4%	0.042	6%	0.063	C	C	.	.	H	α-helix	trans	-68.2	-34.7	177.7	-68	175.9	0	0	0	112.5	L823 I824 L825 L830 A831 V941 L944 M945	L823-L827 HydrophobicContact CD1-CD1 3.92Å; L823-L827 HydrophobicContact CD1-CG 4.14Å; L823-L827 HydrophobicContact CG-CD1 4.01Å; L823-L827 WeakPolarHBondContact O-CB 3.14Å; L823-L827 VanDerWaalsContact O-CG 3.29Å; L823-L827 WeakPolarHBondContact O-CG 3.25Å; L823-L827 PolarHBondContact O-N 3.22Å; I824-L827 PolarHBondContact O-N 2.9Å; L825-L827 PolarHBondContact O-N 3.46Å; L827-L830 PolarHBondContact O-N 2.88Å; L827-A831 WeakPolarHBondContact O-CB 3.28Å; L827-A831 PolarHBondContact O-N 3.36Å; L827-V941 HydrophobicContact CD1-CB 4.44Å; L827-V941 HydrophobicContact CD1-CG1 3.65Å; L827-L944 HydrophobicContact CB-CB 4.15Å; L827-L944 HydrophobicContact CB-CD1 4.1Å; L827-M945 HydrophobicContact CD1-CE 4.12Å; L827-M945 HydrophobicContact CD1-CG 4.36Å; L827-M945 HydrophobicContact CD2-CE 3.37Å; L827-M945 HydrophobicContact CD2-CG 4.32Å; L827-M945 HydrophobicContact CD2-SD 3.69Å; L827-M945 HydrophobicContact CG-CE 4.39Å
828	T	96.7	Very high	95.3	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-60.9	-49.2	175.3	-61	0	0	0	0	110.6	T746 V749 I750 I824 L825 C826 L830 A831 A832 I885 S889	T746-T828 HydrophobicContact CG2-CG2 4.23Å; V749-T828 HydrophobicContact CG1-CG2 4.03Å; I750-T828 HydrophobicContact CD1-CG2 3.9Å; I750-T828 HydrophobicContact CG1-CG2 3.69Å; I824-T828 VanDerWaalsContact O-CB 3.25Å; I824-T828 WeakPolarHBondContact O-CB 3.49Å; I824-T828 PolarHBondContact O-N 3.08Å; I824-T828 PolarHBondContact O-OG1 3.01Å; L825-T828 WeakPolarHBondContact O-CB 3.42Å; L825-T828 PolarHBondContact O-N 3.11Å; C826-T828 VanDerWaalsContact C-N 3.33Å; C826-T828 PolarHBondContact O-N 3.11Å; T828-L830 VanDerWaalsContact C-N 3.34Å; T828-L830 PolarHBondContact O-N 3.07Å; T828-A831 PolarHBondContact O-N 3.32Å; T828-A832 WeakPolarHBondContact O-CB 3.31Å; T828-A832 PolarHBondContact O-N 3.47Å; T828-I885 HydrophobicContact CG2-CG2 3.8Å; T828-S889 WeakPolarHBondContact OG1-CB 3.43Å; T828-S889 PolarHBondContact OG1-OG 3.13Å
829	T	95.5	Very high	95.3	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-66.4	-35.4	176.8	-172.7	0	0	0	0	112.3	V749 N753 K794 I798 L825 C826 A832 A833	V749-T829 HydrophobicContact CG1-CG2 4.4Å; N753-T829 PolarHBondContact ND2-OG1 2.73Å; N753-T829 VanDerWaalsContact ND2-OG1 3.08Å; N753-T829 PolarHBondContact OD1-OG1 2.79Å; K794-T829 HydrophobicContact CB-CG2 4.16Å; I798-T829 HydrophobicContact CD1-CG2 3.35Å; L825-T829 PolarHBondContact O-N 3.47Å; C826-T829 WeakPolarHBondContact O-CG2 3.49Å; C826-T829 PolarHBondContact O-N 3.17Å; T829-A832 PolarHBondContact O-N 2.68Å; T829-A833 VanDerWaalsContact O-CB 3.27Å; T829-A833 WeakPolarHBondContact O-CB 3.16Å; T829-A833 PolarHBondContact O-N 3.49Å
830	L	95.7	Very high	95.1	Very high	22 Å²	22	8.6 Å²	8.6	12%	0.115	4%	0.044	C	C	.	.	H	α-helix	trans	-70.1	-36.8	-180	-71	172.7	0	0	0	111.6	I790 I791 V795 C826 L827 T828 A833 A834 M948 Y952	I790-L830 HydrophobicContact CG2-CD2 4.27Å; I791-L830 HydrophobicContact CG1-CD2 3.99Å; V795-L830 HydrophobicContact CG2-CD1 4.1Å; V795-L830 HydrophobicContact CG2-CD2 3.98Å; V795-L830 HydrophobicContact CG2-CG 4.08Å; C826-L830 VanDerWaalsContact O-CG 3.27Å; C826-L830 WeakPolarHBondContact O-CG 3.27Å; C826-L830 PolarHBondContact O-N 3.01Å; C826-L830 VanDerWaalsContact O-N 3.07Å; L827-L830 PolarHBondContact O-N 2.88Å; T828-L830 VanDerWaalsContact C-N 3.34Å; T828-L830 PolarHBondContact O-N 3.07Å; L830-A833 PolarHBondContact O-N 2.76Å; L830-A834 WeakPolarHBondContact O-CB 3.34Å; L830-A834 PolarHBondContact O-N 2.86Å; L830-M948 HydrophobicContact CB-CG 4.4Å; L830-M948 HydrophobicContact CB-SD 3.65Å; L830-M948 HydrophobicContact CD1-SD 4.36Å; L830-Y952 PolarHBondContact O-OH 3Å
831	A	96	Very high	94.9	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-65	-44.2	172.2	0	0	0	0	0	111.6	L827 T828 A834 I835 I885 I947 M948	L827-A831 WeakPolarHBondContact O-CB 3.28Å; L827-A831 PolarHBondContact O-N 3.36Å; T828-A831 PolarHBondContact O-N 3.32Å; A831-A834 WeakPolarHBondContact O-CB 3.45Å; A831-A834 PolarHBondContact O-N 3.36Å; A831-I835 PolarHBondContact O-N 3.39Å; A831-I885 HydrophobicContact CB-CD1 3.87Å; A831-I885 HydrophobicContact CB-CG1 4.34Å; A831-I885 HydrophobicContact CB-CG2 4.49Å; A831-I947 HydrophobicContact CB-CG2 4.4Å; A831-M948 HydrophobicContact CB-CB 4.08Å
832	A	95.7	Very high	94.6	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-62.5	-44.4	174.9	0	0	0	0	0	111.7	I750 N753 T828 T829 A834 I835 A836 Y857	I750-A832 HydrophobicContact CB-CB 4.42Å; I750-A832 HydrophobicContact CG1-CB 4.24Å; I750-A832 HydrophobicContact CG2-CB 4.21Å; N753-A832 HydrophobicContact CB-CB 4.35Å; N753-A832 WeakPolarHBondContact ND2-CB 3.36Å; T828-A832 WeakPolarHBondContact O-CB 3.31Å; T828-A832 PolarHBondContact O-N 3.47Å; T829-A832 PolarHBondContact O-N 2.68Å; A832-A834 VanDerWaalsContact C-N 3.3Å; A832-A834 PolarHBondContact O-N 2.64Å; A832-I835 PolarHBondContact O-N 3.45Å; A832-A836 PolarHBondContact O-N 2.93Å; A832-Y857 HydrophobicContact CB-CE1 4.5Å; A832-Y857 WeakPolarHBondContact CB-OH 3.24Å; A832-Y857 PolarHBondContact O-OH 3.48Å
833	A	94.2	Very high	94.4	Very high	0 Å²	0	10 Å²	10	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-59.7	-38.4	174.3	0	0	0	0	0	112.3	I790 T829 L830 I835 A836 L837	I790-A833 HydrophobicContact CG2-CB 3.82Å; T829-A833 VanDerWaalsContact O-CB 3.27Å; T829-A833 WeakPolarHBondContact O-CB 3.16Å; T829-A833 PolarHBondContact O-N 3.49Å; L830-A833 PolarHBondContact O-N 2.76Å; A833-I835 PolarHBondContact O-N 3Å; A833-A836 PolarHBondContact O-N 2.92Å; A833-L837 WeakPolarHBondContact O-CG 3.44Å; A833-L837 PolarHBondContact O-N 3.46Å
834	A	94.9	Very high	93.9	Very high	0 Å²	0	11 Å²	11	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-62.1	-41.9	176.1	0	0	0	0	0	112.2	L830 A831 A832 L837 F838 M948 F951 Y952	L830-A834 WeakPolarHBondContact O-CB 3.34Å; L830-A834 PolarHBondContact O-N 2.86Å; A831-A834 WeakPolarHBondContact O-CB 3.45Å; A831-A834 PolarHBondContact O-N 3.36Å; A832-A834 VanDerWaalsContact C-N 3.3Å; A832-A834 PolarHBondContact O-N 2.64Å; A834-L837 PolarHBondContact O-N 3.26Å; A834-F838 PolarHBondContact O-N 2.98Å; A834-M948 HydrophobicContact CB-CG 4.42Å; A834-F951 HydrophobicContact CB-CB 3.81Å; A834-Y952 HydrophobicContact CB-CD1 3.8Å; A834-Y952 HydrophobicContact CB-CD2 4.01Å; A834-Y952 HydrophobicContact CB-CE1 3.68Å; A834-Y952 HydrophobicContact CB-CE2 3.92Å; A834-Y952 HydrophobicContact CB-CG 3.94Å
835	I	94.8	Very high	93.6	Very high	2 Å²	2	14.7 Å²	14.7	1%	0.01	9%	0.087	C	C	.	.	H	α-helix	trans	-62.4	-48.4	173.1	-64.5	179.3	0	0	0	110.2	A831 A832 A833 L837 F838 I839 Y857 M860 I885 F951	A831-I835 PolarHBondContact O-N 3.39Å; A832-I835 PolarHBondContact O-N 3.45Å; A833-I835 PolarHBondContact O-N 3Å; I835-L837 VanDerWaalsContact C-N 3.3Å; I835-L837 PolarHBondContact O-N 3.46Å; I835-F838 PolarHBondContact O-N 2.96Å; I835-F838 VanDerWaalsContact O-N 3.12Å; I835-I839 HydrophobicContact CG2-CG1 4.34Å; I835-I839 WeakPolarHBondContact O-CG1 3.47Å; I835-I839 PolarHBondContact O-N 2.66Å; I835-Y857 HydrophobicContact CG2-CE1 4.38Å; I835-M860 HydrophobicContact CD1-CE 3.81Å; I835-M860 HydrophobicContact CD1-SD 4.18Å; I835-I885 HydrophobicContact CD1-CD1 3.45Å; I835-I885 VanDerWaalsContact CD1-CD1 3.45Å; I835-I885 HydrophobicContact CD1-CG1 4.43Å; I835-I885 HydrophobicContact CG1-CD1 4.4Å; I835-F951 HydrophobicContact CD1-CD2 4.19Å; I835-F951 HydrophobicContact CD1-CE2 3.9Å; I835-F951 HydrophobicContact CD1-CZ 4.24Å; I835-F951 HydrophobicContact CG1-CB 4.42Å; I835-F951 HydrophobicContact CG1-CD1 4.01Å; I835-F951 HydrophobicContact CG1-CD2 3.55Å; I835-F951 HydrophobicContact CG1-CE1 4.13Å; I835-F951 HydrophobicContact CG1-CE2 3.69Å; I835-F951 HydrophobicContact CG1-CG 3.73Å; I835-F951 HydrophobicContact CG1-CZ 3.98Å
836	A	93.8	Very high	93.2	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-58.5	-40.5	179.6	0	0	0	0	0	113	I757 A832 A833 S840 I853	I757-A836 HydrophobicContact CG1-CB 4.24Å; A832-A836 PolarHBondContact O-N 2.93Å; A833-A836 PolarHBondContact O-N 2.92Å; A836-S840 WeakPolarHBondContact O-CB 3.39Å; A836-S840 PolarHBondContact O-N 2.96Å; A836-S840 PolarHBondContact O-OG 3Å; A836-I853 VanDerWaalsContact CA-CD1 3.49Å; A836-I853 HydrophobicContact CB-CD1 3.49Å; A836-I853 VanDerWaalsContact CB-CD1 3.49Å
837	L	92.7	Very high	93	Very high	2 Å²	2	20.5 Å²	20.5	1%	0.01	12%	0.123	C	C	.	.	H	α-helix	trans	-66.8	-41.6	174.2	-74.1	-176.5	0	0	0	113	T756 F760 I790 A833 A834 I835 I839 S840 A841 Y952	T756-L837 HydrophobicContact CG2-CD2 4.15Å; F760-L837 HydrophobicContact CB-CD2 4.17Å; F760-L837 HydrophobicContact CD2-CD2 3.51Å; F760-L837 HydrophobicContact CE2-CD2 3.98Å; F760-L837 HydrophobicContact CG-CD2 3.88Å; I790-L837 HydrophobicContact CD1-CD1 3.1Å; I790-L837 HydrophobicContact CD1-CD2 3.94Å; I790-L837 HydrophobicContact CD1-CG 3.76Å; A833-L837 WeakPolarHBondContact O-CG 3.44Å; A833-L837 PolarHBondContact O-N 3.46Å; A834-L837 PolarHBondContact O-N 3.26Å; I835-L837 VanDerWaalsContact C-N 3.3Å; I835-L837 PolarHBondContact O-N 3.46Å; L837-I839 VanDerWaalsContact C-N 3.35Å; L837-I839 PolarHBondContact O-N 3.43Å; L837-S840 VanDerWaalsContact CA-OG 3.31Å; L837-S840 WeakPolarHBondContact CA-OG 3.35Å; L837-S840 PolarHBondContact O-N 2.87Å; L837-S840 PolarHBondContact O-OG 3.47Å; L837-S840 VanDerWaalsContact O-OG 3.05Å; L837-A841 VanDerWaalsContact O-CB 3.3Å; L837-A841 WeakPolarHBondContact O-CB 3.41Å; L837-A841 PolarHBondContact O-N 3.48Å; L837-Y952 HydrophobicContact CD1-CD1 4.34Å; L837-Y952 HydrophobicContact CD1-CE1 3.71Å
838	F	94.3	Very high	92.9	Very high	35 Å²	35	23.4 Å²	23.4	15%	0.154	14%	0.139	C	C	.	.	H	α-helix	trans	-62.4	-43.1	177.7	169.6	-109.2	0	0	0	111.9	A834 I835 A841 S842 F951 L954 C955 R958	A834-F838 PolarHBondContact O-N 2.98Å; I835-F838 PolarHBondContact O-N 2.96Å; I835-F838 VanDerWaalsContact O-N 3.12Å; F838-A841 PolarHBondContact O-N 3.47Å; F838-S842 WeakPolarHBondContact O-CB 3.44Å; F838-S842 PolarHBondContact O-N 2.96Å; F838-S842 VanDerWaalsContact O-N 3.07Å; F838-S842 PolarHBondContact O-OG 3.32Å; F838-F951 HydrophobicContact CB-CD1 4.09Å; F838-F951 AromaticContact CD1-CD1 3.86Å; F838-F951 HydrophobicContact CD1-CD1 3.86Å; F838-F951 AromaticContact CD1-CE1 3.98Å; F838-F951 HydrophobicContact CD1-CE1 3.98Å; F838-F951 HydrophobicContact CE1-CE1 4.42Å; F838-F951 HydrophobicContact CG-CD1 4.07Å; F838-L954 HydrophobicContact CD2-CB 3.6Å; F838-L954 HydrophobicContact CE2-CB 3.67Å; F838-L954 HydrophobicContact CG-CB 4.35Å; F838-L954 HydrophobicContact CZ-CB 4.49Å; F838-C955 HydrophobicContact CB-CB 4.22Å; F838-R958 HydrophobicContact CD2-CG 4.18Å; F838-R958 HydrophobicContact CE2-CG 3.72Å
839	I	93.4	Very high	92.8	Very high	15 Å²	15	23.4 Å²	23.4	8%	0.077	14%	0.139	C	C	.	.	H	α-helix	trans	-65.7	-45	177.2	-62.6	-58	0	0	0	110.8	I835 L837 A841 S842 V843 A849 I852 I856	I835-I839 HydrophobicContact CG2-CG1 4.34Å; I835-I839 WeakPolarHBondContact O-CG1 3.47Å; I835-I839 PolarHBondContact O-N 2.66Å; L837-I839 VanDerWaalsContact C-N 3.35Å; L837-I839 PolarHBondContact O-N 3.43Å; I839-A841 VanDerWaalsContact C-N 3.33Å; I839-A841 PolarHBondContact O-N 3.49Å; I839-S842 PolarHBondContact O-N 3.47Å; I839-S842 VanDerWaalsContact O-N 3.08Å; I839-V843 PolarHBondContact O-N 2.95Å; I839-A849 HydrophobicContact CG2-CB 4.08Å; I839-I852 HydrophobicContact CD1-CG2 4.06Å; I839-I852 HydrophobicContact CG2-CG2 4.34Å; I839-I856 HydrophobicContact CD1-CD1 4.11Å
840	S	91	Very high	92.6	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-69.8	-25	178.4	58.9	0	0	0	0	114.1	F760 R764 A836 L837	F760-S840 WeakPolarHBondContact CD1-OG 3.27Å; R764-S840 PolarHBondContact NH1-O 2.72Å; A836-S840 WeakPolarHBondContact O-CB 3.39Å; A836-S840 PolarHBondContact O-N 2.96Å; A836-S840 PolarHBondContact O-OG 3Å; L837-S840 VanDerWaalsContact CA-OG 3.31Å; L837-S840 WeakPolarHBondContact CA-OG 3.35Å; L837-S840 PolarHBondContact O-N 2.87Å; L837-S840 PolarHBondContact O-OG 3.47Å; L837-S840 VanDerWaalsContact O-OG 3.05Å
841	A	90.4	Very high	92.6	Very high	3 Å²	3	27 Å²	27	3%	0.025	17%	0.165	C	C	.	.	H	α-helix	trans	-71.8	-33.5	168	0	0	0	0	0	112.2	F760 R764 L837 F838 I839 R958 L959	F760-A841 HydrophobicContact CE1-CB 4.13Å; R764-A841 PolarHBondContact NH1-O 3.27Å; L837-A841 VanDerWaalsContact O-CB 3.3Å; L837-A841 WeakPolarHBondContact O-CB 3.41Å; L837-A841 PolarHBondContact O-N 3.48Å; F838-A841 PolarHBondContact O-N 3.47Å; I839-A841 VanDerWaalsContact C-N 3.33Å; I839-A841 PolarHBondContact O-N 3.49Å; A841-R958 HydrophobicContact CB-CB 4.25Å; A841-L959 HydrophobicContact CB-CD2 4.32Å; A841-L959 HydrophobicContact CB-CG 4.3Å
842	S	90.7	Very high	92.5	Very high	32 Å²	32	29 Å²	29	22%	0.224	18%	0.175	C	C	.	.	H	α-helix	trans	-82.8	-39.1	-177.1	-58.6	0	0	0	0	112.8	F838 I839	F838-S842 WeakPolarHBondContact O-CB 3.44Å; F838-S842 PolarHBondContact O-N 2.96Å; F838-S842 VanDerWaalsContact O-N 3.07Å; F838-S842 PolarHBondContact O-OG 3.32Å; I839-S842 PolarHBondContact O-N 3.47Å; I839-S842 VanDerWaalsContact O-N 3.08Å
843	V	90.2	Very high	92.5	Very high	15 Å²	15	29 Å²	29	9%	0.091	18%	0.175	C	C	.	.			trans	-109.7	132.4	-175.4	-178.6	0	0	0	0	109.9	R764 I839 V845 L848 A849 I852	R764-V843 PolarHBondContact NH1-O 3.32Å; I839-V843 PolarHBondContact O-N 2.95Å; V843-V845 WeakPolarHBondContact CG1-O 3.24Å; V843-L848 HydrophobicContact CG1-CB 4.04Å; V843-L848 HydrophobicContact CG1-CD2 3.89Å; V843-L848 HydrophobicContact CG1-CG 3.99Å; V843-A849 HydrophobicContact CB-CB 4.15Å; V843-A849 HydrophobicContact CG1-CB 4.09Å; V843-I852 HydrophobicContact CG2-CD1 4.13Å
844	T	85	Confident	92.5	Very high	86 Å²	86	30.5 Å²	30.5	53%	0.528	19%	0.185	S	C	.	.			trans	-88.1	-20.2	179.8	49.9	0	0	0	0	113.5	R764	R764-T844 VanDerWaalsContact NH2-CG2 3.31Å
845	V	90.3	Very high	92.4	Very high	76 Å²	76	36.2 Å²	36.2	46%	0.461	22%	0.215	S	C	.	.			trans	-98.4	122.1	-174	-178.1	0	0	0	0	110	V843 G847 L848 A849	V843-V845 WeakPolarHBondContact CG1-O 3.24Å; V845-G847 PolarHBondContact O-N 3.42Å; V845-L848 HydrophobicContact CB-CB 4.22Å; V845-L848 HydrophobicContact CG1-CB 4.38Å; V845-L848 PolarHBondContact O-N 3.2Å; V845-A849 WeakPolarHBondContact O-CB 3.32Å; V845-A849 PolarHBondContact O-N 3.03Å
846	F	89.7	Confident	92.4	Very high	89 Å²	89	38.5 Å²	38.5	39%	0.39	23%	0.226	S	C	.	.	H	α-helix	trans	-55.7	-52.3	-179.2	172.4	-106.1	0	0	0	113.2	I757 E758 I761 L848 A849 N850	I757-F846 HydrophobicContact CG2-CD2 3.96Å; I757-F846 HydrophobicContact CG2-CE2 4.3Å; E758-F846 HydrophobicContact CB-CD2 3.98Å; E758-F846 HydrophobicContact CB-CE2 3.65Å; E758-F846 HydrophobicContact CB-CZ 4.44Å; E758-F846 HydrophobicContact CG-CD2 4.26Å; E758-F846 HydrophobicContact CG-CE2 4.17Å; I761-F846 HydrophobicContact CD1-CB 4.14Å; F846-L848 VanDerWaalsContact C-N 3.33Å; F846-L848 PolarHBondContact O-N 3.22Å; F846-A849 PolarHBondContact O-N 3.13Å; F846-N850 WeakPolarHBondContact O-CB 3.48Å; F846-N850 PolarHBondContact O-N 3.49Å
847	G	92.5	Very high	92.4	Very high	45 Å²	45	38.5 Å²	38.5	46%	0.464	23%	0.226	S	C	.	.	H	α-helix	trans	-59.4	-41	-177.5	0	0	0	0	0	113.4	V845 A851	V845-G847 PolarHBondContact O-N 3.42Å; G847-A851 PolarHBondContact O-N 3.15Å; G847-A851 VanDerWaalsContact O-N 3.08Å
848	L	93.6	Very high	92.5	Very high	69 Å²	69	42.3 Å²	42.3	36%	0.361	25%	0.25	S	C	.	.	H	α-helix	trans	-68.6	-43.2	176.4	-180	61.5	0	0	0	111.7	V843 V845 F846 N850 A851 I852	V843-L848 HydrophobicContact CG1-CB 4.04Å; V843-L848 HydrophobicContact CG1-CD2 3.89Å; V843-L848 HydrophobicContact CG1-CG 3.99Å; V845-L848 HydrophobicContact CB-CB 4.22Å; V845-L848 HydrophobicContact CG1-CB 4.38Å; V845-L848 PolarHBondContact O-N 3.2Å; F846-L848 VanDerWaalsContact C-N 3.33Å; F846-L848 PolarHBondContact O-N 3.22Å; L848-N850 VanDerWaalsContact C-N 3.34Å; L848-N850 PolarHBondContact O-N 2.91Å; L848-A851 PolarHBondContact O-N 3.33Å; L848-I852 HydrophobicContact CD1-CD1 3.95Å; L848-I852 HydrophobicContact CD1-CG1 4.27Å; L848-I852 HydrophobicContact CG-CD1 3.88Å; L848-I852 VanDerWaalsContact O-CG1 3.31Å; L848-I852 WeakPolarHBondContact O-CG1 3.4Å; L848-I852 PolarHBondContact O-N 2.97Å
849	A	93.6	Very high	92.3	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60.7	-43.8	177.4	0	0	0	0	0	111.6	I757 I761 I839 V843 V845 F846 I852 I853	I757-A849 HydrophobicContact CG2-CB 3.7Å; I761-A849 HydrophobicContact CD1-CB 4.24Å; I839-A849 HydrophobicContact CG2-CB 4.08Å; V843-A849 HydrophobicContact CB-CB 4.15Å; V843-A849 HydrophobicContact CG1-CB 4.09Å; V845-A849 WeakPolarHBondContact O-CB 3.32Å; V845-A849 PolarHBondContact O-N 3.03Å; F846-A849 PolarHBondContact O-N 3.13Å; A849-I852 PolarHBondContact O-N 2.92Å; A849-I853 WeakPolarHBondContact O-CG2 3.45Å; A849-I853 PolarHBondContact O-N 3.4Å
850	N	93.2	Very high	92.3	Very high	52 Å²	52	46 Å²	46	28%	0.278	27%	0.266	S	S	.	.	H	α-helix	trans	-61.9	-46.8	177.3	-167.4	53.7	0	0	0	111.8	F846 L848 I852 I853 S854	F846-N850 WeakPolarHBondContact O-CB 3.48Å; F846-N850 PolarHBondContact O-N 3.49Å; L848-N850 VanDerWaalsContact C-N 3.34Å; L848-N850 PolarHBondContact O-N 2.91Å; N850-I852 PolarHBondContact O-N 3.42Å; N850-I853 WeakPolarHBondContact O-CG2 3.34Å; N850-I853 PolarHBondContact O-N 2.97Å; N850-S854 WeakPolarHBondContact O-CB 3.47Å; N850-S854 PolarHBondContact O-N 3.45Å; N850-S854 PolarHBondContact O-OG 2.64Å; N850-S854 VanDerWaalsContact O-OG 3.04Å
851	A	94.5	Very high	92.4	Very high	47 Å²	47	47.1 Å²	47.1	39%	0.388	27%	0.271	S	S	.	.	H	α-helix	trans	-59.8	-46.2	177.2	0	0	0	0	0	112.3	G847 L848 I853 S854 I855	G847-A851 PolarHBondContact O-N 3.15Å; G847-A851 VanDerWaalsContact O-N 3.08Å; L848-A851 PolarHBondContact O-N 3.33Å; A851-I853 PolarHBondContact O-N 3.07Å; A851-S854 PolarHBondContact O-N 3.49Å; A851-I855 WeakPolarHBondContact O-CD1 3.04Å; A851-I855 VanDerWaalsContact O-CG1 3.26Å; A851-I855 WeakPolarHBondContact O-CG1 3.45Å; A851-I855 PolarHBondContact O-N 2.86Å; A851-I855 VanDerWaalsContact O-N 3.09Å
852	I	94.8	Very high	92.4	Very high	40 Å²	40	48.3 Å²	48.3	21%	0.205	28%	0.281	C	S	.	.	H	α-helix	trans	-61.4	-47.2	179.9	-69.7	167.4	0	0	0	111	I839 V843 L848 A849 N850 I855 I856	I839-I852 HydrophobicContact CD1-CG2 4.06Å; I839-I852 HydrophobicContact CG2-CG2 4.34Å; V843-I852 HydrophobicContact CG2-CD1 4.13Å; L848-I852 HydrophobicContact CD1-CD1 3.95Å; L848-I852 HydrophobicContact CD1-CG1 4.27Å; L848-I852 HydrophobicContact CG-CD1 3.88Å; L848-I852 VanDerWaalsContact O-CG1 3.31Å; L848-I852 WeakPolarHBondContact O-CG1 3.4Å; L848-I852 PolarHBondContact O-N 2.97Å; A849-I852 PolarHBondContact O-N 2.92Å; N850-I852 PolarHBondContact O-N 3.42Å; I852-I855 PolarHBondContact O-N 3.08Å; I852-I856 HydrophobicContact CG2-CD1 3.77Å; I852-I856 VanDerWaalsContact O-CG1 3.3Å; I852-I856 WeakPolarHBondContact O-CG1 3.43Å; I852-I856 PolarHBondContact O-N 3.26Å
853	I	94.1	Very high	92.3	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-67.6	-38	-178.3	-166.9	166.9	0	0	0	112.1	L754 I757 A836 A849 N850 A851 I855 I856 Y857	L754-I853 HydrophobicContact CD2-CB 4.36Å; L754-I853 HydrophobicContact CD2-CD1 4.44Å; L754-I853 HydrophobicContact CD2-CG1 4.31Å; L754-I853 HydrophobicContact CD2-CG2 3.24Å; I757-I853 HydrophobicContact CD1-CB 4.04Å; I757-I853 HydrophobicContact CD1-CD1 3.86Å; I757-I853 HydrophobicContact CD1-CG2 3.35Å; A836-I853 VanDerWaalsContact CA-CD1 3.49Å; A836-I853 HydrophobicContact CB-CD1 3.49Å; A836-I853 VanDerWaalsContact CB-CD1 3.49Å; A849-I853 WeakPolarHBondContact O-CG2 3.45Å; A849-I853 PolarHBondContact O-N 3.4Å; N850-I853 WeakPolarHBondContact O-CG2 3.34Å; N850-I853 PolarHBondContact O-N 2.97Å; A851-I853 PolarHBondContact O-N 3.07Å; I853-I855 VanDerWaalsContact C-N 3.32Å; I853-I855 PolarHBondContact O-N 3.42Å; I853-I856 PolarHBondContact O-N 3.36Å; I853-Y857 HydrophobicContact CD1-CE1 4.21Å; I853-Y857 HydrophobicContact CD1-CE2 3.83Å; I853-Y857 WeakPolarHBondContact CD1-OH 3.5Å; I853-Y857 HydrophobicContact CG1-CD1 4.23Å; I853-Y857 HydrophobicContact CG1-CD2 4.07Å; I853-Y857 HydrophobicContact CG1-CE1 3.89Å; I853-Y857 HydrophobicContact CG1-CE2 3.72Å; I853-Y857 HydrophobicContact CG1-CG 4.32Å; I853-Y857 WeakPolarHBondContact O-CB 3.36Å; I853-Y857 PolarHBondContact O-N 2.87Å
854	S	94.1	Very high	92.3	Very high	32 Å²	32	47.1 Å²	47.1	22%	0.224	27%	0.271	C	S	.	.	H	α-helix	trans	-63.3	-42.5	178.4	-65.6	0	0	0	0	110.4	N850 A851 Y857 V858	N850-S854 WeakPolarHBondContact O-CB 3.47Å; N850-S854 PolarHBondContact O-N 3.45Å; N850-S854 PolarHBondContact O-OG 2.64Å; N850-S854 VanDerWaalsContact O-OG 3.04Å; A851-S854 PolarHBondContact O-N 3.49Å; S854-Y857 PolarHBondContact O-N 2.98Å; S854-V858 WeakPolarHBondContact O-CB 3.42Å; S854-V858 VanDerWaalsContact O-CG2 3.23Å; S854-V858 WeakPolarHBondContact O-CG2 3.36Å; S854-V858 PolarHBondContact O-N 3.4Å
855	I	94.5	Very high	92.2	Very high	121 Å²	121	43.4 Å²	43.4	62%	0.621	25%	0.25	S	C	*	.	H	α-helix	trans	-61.4	-45.8	174.5	-66.3	164.5	0	0	0	110.7	A851 I852 I853 Y857 V858 F859	A851-I855 WeakPolarHBondContact O-CD1 3.04Å; A851-I855 VanDerWaalsContact O-CG1 3.26Å; A851-I855 WeakPolarHBondContact O-CG1 3.45Å; A851-I855 PolarHBondContact O-N 2.86Å; A851-I855 VanDerWaalsContact O-N 3.09Å; I852-I855 PolarHBondContact O-N 3.08Å; I853-I855 VanDerWaalsContact C-N 3.32Å; I853-I855 PolarHBondContact O-N 3.42Å; I855-Y857 PolarHBondContact O-N 2.95Å; I855-V858 PolarHBondContact O-N 3.47Å; I855-F859 VanDerWaalsContact O-CB 3.28Å; I855-F859 WeakPolarHBondContact O-CB 3.32Å; I855-F859 PolarHBondContact O-N 3.33Å
856	I	93.9	Very high	91.9	Very high	50 Å²	50	43 Å²	43	26%	0.256	24%	0.242	S	C	.	.	H	α-helix	trans	-60.5	-45.2	178.1	-69.1	168	0	0	0	110.8	I839 I852 I853 F859 M860	I839-I856 HydrophobicContact CD1-CD1 4.11Å; I852-I856 HydrophobicContact CG2-CD1 3.77Å; I852-I856 VanDerWaalsContact O-CG1 3.3Å; I852-I856 WeakPolarHBondContact O-CG1 3.43Å; I852-I856 PolarHBondContact O-N 3.26Å; I853-I856 PolarHBondContact O-N 3.36Å; I856-F859 PolarHBondContact O-N 2.94Å; I856-M860 HydrophobicContact CG2-CE 3.81Å; I856-M860 HydrophobicContact CG2-CG 4.48Å; I856-M860 HydrophobicContact CG2-SD 4.17Å; I856-M860 WeakPolarHBondContact O-CB 3.42Å; I856-M860 VanDerWaalsContact O-CG 3.31Å; I856-M860 WeakPolarHBondContact O-CG 3.46Å; I856-M860 PolarHBondContact O-N 3.2Å
857	Y	94.6	Very high	91.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-67.4	-43.4	179.6	-72.8	-10.1	0	0	0	112.8	I750 L754 A832 I835 I853 S854 I855 F859 M860 M861	I750-Y857 HydrophobicContact CG2-CD1 3.85Å; I750-Y857 HydrophobicContact CG2-CD2 3.62Å; I750-Y857 HydrophobicContact CG2-CE1 3.91Å; I750-Y857 HydrophobicContact CG2-CE2 3.68Å; I750-Y857 HydrophobicContact CG2-CG 3.7Å; I750-Y857 WeakPolarHBondContact O-CE2 3.35Å; L754-Y857 HydrophobicContact CD2-CD2 4.27Å; L754-Y857 HydrophobicContact CD2-CE2 4.2Å; A832-Y857 HydrophobicContact CB-CE1 4.5Å; A832-Y857 WeakPolarHBondContact CB-OH 3.24Å; A832-Y857 PolarHBondContact O-OH 3.48Å; I835-Y857 HydrophobicContact CG2-CE1 4.38Å; I853-Y857 HydrophobicContact CD1-CE1 4.21Å; I853-Y857 HydrophobicContact CD1-CE2 3.83Å; I853-Y857 WeakPolarHBondContact CD1-OH 3.5Å; I853-Y857 HydrophobicContact CG1-CD1 4.23Å; I853-Y857 HydrophobicContact CG1-CD2 4.07Å; I853-Y857 HydrophobicContact CG1-CE1 3.89Å; I853-Y857 HydrophobicContact CG1-CE2 3.72Å; I853-Y857 HydrophobicContact CG1-CG 4.32Å; I853-Y857 WeakPolarHBondContact O-CB 3.36Å; I853-Y857 PolarHBondContact O-N 2.87Å; S854-Y857 PolarHBondContact O-N 2.98Å; I855-Y857 PolarHBondContact O-N 2.95Å; Y857-F859 VanDerWaalsContact C-N 3.3Å; Y857-F859 PolarHBondContact O-N 2.82Å; Y857-M860 PolarHBondContact O-N 3.09Å; Y857-M861 WeakPolarHBondContact O-CB 3.28Å; Y857-M861 PolarHBondContact O-N 3.25Å
858	V	93.6	Very high	91.3	Very high	82 Å²	82	45 Å²	45	50%	0.497	25%	0.245	S	C	.	.	H	α-helix	trans	-61.6	-41	175	170.7	0	0	0	0	110.6	F751 S854 I855 M861 A862	F751-V858 HydrophobicContact CZ-CG2 4.3Å; S854-V858 WeakPolarHBondContact O-CB 3.42Å; S854-V858 VanDerWaalsContact O-CG2 3.23Å; S854-V858 WeakPolarHBondContact O-CG2 3.36Å; S854-V858 PolarHBondContact O-N 3.4Å; I855-V858 PolarHBondContact O-N 3.47Å; V858-M861 WeakPolarHBondContact O-CB 3.4Å; V858-M861 PolarHBondContact O-N 2.76Å; V858-A862 PolarHBondContact O-N 2.97Å; V858-A862 VanDerWaalsContact O-N 3.15Å
859	F	91.4	Very high	90.7	Very high	106 Å²	106	44.8 Å²	44.8	47%	0.465	24%	0.244	S	C	.	.	H	α-helix	trans	-64.4	-47.4	175.8	-169.3	-98.3	0	0	0	111.7	I855 I856 Y857 M861 A862 F863 L880	I855-F859 VanDerWaalsContact O-CB 3.28Å; I855-F859 WeakPolarHBondContact O-CB 3.32Å; I855-F859 PolarHBondContact O-N 3.33Å; I856-F859 PolarHBondContact O-N 2.94Å; Y857-F859 VanDerWaalsContact C-N 3.3Å; Y857-F859 PolarHBondContact O-N 2.82Å; F859-M861 VanDerWaalsContact C-N 3.26Å; F859-M861 PolarHBondContact O-N 3.46Å; F859-A862 PolarHBondContact O-N 3.31Å; F859-F863 HydrophobicContact CD1-CD2 4.21Å; F859-F863 AromaticContact CD1-CE2 3.96Å; F859-F863 HydrophobicContact CD1-CE2 3.96Å; F859-F863 HydrophobicContact CD2-CE2 4.18Å; F859-F863 HydrophobicContact CE1-CD2 4.05Å; F859-F863 AromaticContact CE1-CE2 3.51Å; F859-F863 HydrophobicContact CE1-CE2 3.51Å; F859-F863 HydrophobicContact CE1-CZ 4.44Å; F859-F863 AromaticContact CE2-CE2 3.76Å; F859-F863 HydrophobicContact CE2-CE2 3.76Å; F859-F863 HydrophobicContact CE2-CZ 4.4Å; F859-F863 HydrophobicContact CG-CE2 4.3Å; F859-F863 HydrophobicContact CZ-CD2 4.4Å; F859-F863 AromaticContact CZ-CE2 3.43Å; F859-F863 HydrophobicContact CZ-CE2 3.43Å; F859-F863 VanDerWaalsContact CZ-CE2 3.43Å; F859-F863 HydrophobicContact CZ-CZ 4.04Å; F859-F863 WeakPolarHBondContact O-CD2 3.41Å; F859-L880 HydrophobicContact CE1-CD1 3.91Å; F859-L880 HydrophobicContact CE1-CD2 4.07Å; F859-L880 HydrophobicContact CE1-CG 4.44Å; F859-L880 HydrophobicContact CZ-CD1 3.65Å
860	M	93	Very high	89.7	Confident	20 Å²	20	45.1 Å²	45.1	10%	0.099	25%	0.246	C	C	.	.	H	α-helix	trans	-61	-35.7	175.4	-71.9	-176.8	175.8	0	0	112.4	I835 I856 Y857 F863 F883 S884 I885 F886	I835-M860 HydrophobicContact CD1-CE 3.81Å; I835-M860 HydrophobicContact CD1-SD 4.18Å; I856-M860 HydrophobicContact CG2-CE 3.81Å; I856-M860 HydrophobicContact CG2-CG 4.48Å; I856-M860 HydrophobicContact CG2-SD 4.17Å; I856-M860 WeakPolarHBondContact O-CB 3.42Å; I856-M860 VanDerWaalsContact O-CG 3.31Å; I856-M860 WeakPolarHBondContact O-CG 3.46Å; I856-M860 PolarHBondContact O-N 3.2Å; Y857-M860 PolarHBondContact O-N 3.09Å; M860-F863 PolarHBondContact O-N 3.18Å; M860-F883 WeakPolarHBondContact CE-O 3.06Å; M860-S884 PolarHBondContact O-OG 3.49Å; M860-I885 HydrophobicContact SD-CD1 4.37Å; M860-I885 HydrophobicContact SD-CG1 4.21Å; M860-F886 HydrophobicContact CB-CD2 3.97Å; M860-F886 HydrophobicContact CB-CE2 4.43Å
861	M	93.1	Very high	88.9	Confident	25 Å²	25	47.8 Å²	47.8	12%	0.123	26%	0.255	C	S	.	.	H	α-helix	trans	-62.2	-39.9	177.8	178.7	-165.7	-66	0	0	112.2	Y743 L747 F751 Y857 V858 F859 F863 S864 L867 F886	Y743-M861 HydrophobicContact CE2-CG 4.13Å; Y743-M861 WeakPolarHBondContact OH-CG 3.22Å; Y743-M861 PolarHBondContact OH-SD 3.36Å; L747-M861 HydrophobicContact CD1-CE 3.49Å; L747-M861 VanDerWaalsContact CD1-CE 3.49Å; L747-M861 HydrophobicContact CD1-SD 4.15Å; L747-M861 HydrophobicContact CG-CE 3.91Å; F751-M861 HydrophobicContact CD2-CE 4.3Å; F751-M861 HydrophobicContact CE2-CE 3.23Å; F751-M861 HydrophobicContact CZ-CE 3.53Å; Y857-M861 WeakPolarHBondContact O-CB 3.28Å; Y857-M861 PolarHBondContact O-N 3.25Å; V858-M861 WeakPolarHBondContact O-CB 3.4Å; V858-M861 PolarHBondContact O-N 2.76Å; F859-M861 VanDerWaalsContact C-N 3.26Å; F859-M861 PolarHBondContact O-N 3.46Å; M861-F863 VanDerWaalsContact C-N 3.28Å; M861-F863 PolarHBondContact O-N 2.94Å; M861-S864 WeakPolarHBondContact O-CB 3.49Å; M861-S864 PolarHBondContact O-N 3.34Å; M861-S864 PolarHBondContact O-OG 3.17Å; M861-L867 HydrophobicContact CG-CD1 4.44Å; M861-F886 HydrophobicContact CB-CD1 4.45Å; M861-F886 HydrophobicContact CB-CD2 4.13Å; M861-F886 HydrophobicContact CB-CE1 4.15Å; M861-F886 HydrophobicContact CB-CE2 3.78Å; M861-F886 HydrophobicContact CB-CG 4.46Å; M861-F886 HydrophobicContact CB-CZ 3.81Å; M861-F886 HydrophobicContact CE-CE1 4.46Å; M861-F886 HydrophobicContact CE-CZ 4.04Å; M861-F886 HydrophobicContact CG-CD1 4.47Å; M861-F886 HydrophobicContact CG-CE1 4.07Å; M861-F886 HydrophobicContact CG-CZ 4.13Å
862	A	90.2	Very high	88.3	Confident	28 Å²	28	49.8 Å²	49.8	23%	0.231	27%	0.266	C	S	.	.	H	α-helix	trans	-60.5	-37.4	177.6	0	0	0	0	0	112.3	V858 F859 S864 I868	V858-A862 PolarHBondContact O-N 2.97Å; V858-A862 VanDerWaalsContact O-N 3.15Å; F859-A862 PolarHBondContact O-N 3.31Å; A862-S864 VanDerWaalsContact C-N 3.27Å; A862-S864 PolarHBondContact O-N 3.18Å; A862-I868 HydrophobicContact CB-CD1 4.33Å
863	F	88.7	Confident	87.7	Confident	18 Å²	18	49.1 Å²	49.1	8%	0.079	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	20.1	178.5	-61.4	-78.7	0	0	0	114.1	F859 M860 M861 G865 M873 L877 L880	F859-F863 HydrophobicContact CD1-CD2 4.21Å; F859-F863 AromaticContact CD1-CE2 3.96Å; F859-F863 HydrophobicContact CD1-CE2 3.96Å; F859-F863 HydrophobicContact CD2-CE2 4.18Å; F859-F863 HydrophobicContact CE1-CD2 4.05Å; F859-F863 AromaticContact CE1-CE2 3.51Å; F859-F863 HydrophobicContact CE1-CE2 3.51Å; F859-F863 HydrophobicContact CE1-CZ 4.44Å; F859-F863 AromaticContact CE2-CE2 3.76Å; F859-F863 HydrophobicContact CE2-CE2 3.76Å; F859-F863 HydrophobicContact CE2-CZ 4.4Å; F859-F863 HydrophobicContact CG-CE2 4.3Å; F859-F863 HydrophobicContact CZ-CD2 4.4Å; F859-F863 AromaticContact CZ-CE2 3.43Å; F859-F863 HydrophobicContact CZ-CE2 3.43Å; F859-F863 VanDerWaalsContact CZ-CE2 3.43Å; F859-F863 HydrophobicContact CZ-CZ 4.04Å; F859-F863 WeakPolarHBondContact O-CD2 3.41Å; M860-F863 PolarHBondContact O-N 3.18Å; M861-F863 VanDerWaalsContact C-N 3.28Å; M861-F863 PolarHBondContact O-N 2.94Å; F863-G865 VanDerWaalsContact C-N 3.28Å; F863-G865 PolarHBondContact O-N 2.76Å; F863-M873 HydrophobicContact CD1-CE 3.94Å; F863-M873 HydrophobicContact CD1-SD 3.81Å; F863-M873 HydrophobicContact CE1-CE 4.49Å; F863-M873 HydrophobicContact CE1-SD 4.11Å; F863-L877 HydrophobicContact CE1-CB 4.46Å; F863-L877 HydrophobicContact CZ-CD2 4.49Å; F863-L880 HydrophobicContact CD1-CB 4.46Å; F863-L880 HydrophobicContact CD2-CB 4.41Å; F863-L880 HydrophobicContact CE1-CB 4.38Å; F863-L880 HydrophobicContact CE1-CD1 4.43Å; F863-L880 HydrophobicContact CE2-CB 4.37Å; F863-L880 HydrophobicContact CE2-CD1 4.15Å; F863-L880 HydrophobicContact CG-CB 4.48Å; F863-L880 HydrophobicContact CZ-CB 4.34Å; F863-L880 HydrophobicContact CZ-CD1 3.85Å
864	S	89.3	Confident	87.2	Confident	3 Å²	3	51.4 Å²	51.4	2%	0.021	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-26	177.7	56.9	0	0	0	0	114	M861 A862 F866	M861-S864 WeakPolarHBondContact O-CB 3.49Å; M861-S864 PolarHBondContact O-N 3.34Å; M861-S864 PolarHBondContact O-OG 3.17Å; A862-S864 VanDerWaalsContact C-N 3.27Å; A862-S864 PolarHBondContact O-N 3.18Å; S864-F866 PolarHBondContact OG-N 2.89Å
865	G	83.4	Confident	86.8	Confident	8 Å²	8	56.2 Å²	56.2	8%	0.082	31%	0.309	C	S	.	.	S	Bend	trans	91.5	-4.5	-170.6	0	0	0	0	0	114.3	F863 I868 Q927	F863-G865 VanDerWaalsContact C-N 3.28Å; F863-G865 PolarHBondContact O-N 2.76Å; G865-I868 CarbonylContact C-O 3.59Å; G865-I868 WeakPolarHBondContact CA-O 3.3Å; G865-Q927 PolarHBondContact O-OE1 3.05Å
866	F	85.2	Confident	86.4	Confident	69 Å²	69	59.2 Å²	59.2	30%	0.303	31%	0.313	S	S	.	.	S	Bend	trans	-89.6	-51.6	176.9	178.9	-109.7	0	0	0	112.4	Y743 S864	Y743-F866 AromaticContact CD1-CD1 3.79Å; Y743-F866 HydrophobicContact CD1-CD1 3.79Å; Y743-F866 AromaticContact CD1-CE1 3.9Å; Y743-F866 HydrophobicContact CD1-CE1 3.9Å; Y743-F866 HydrophobicContact CD2-CB 3.73Å; Y743-F866 AromaticContact CD2-CD1 3.56Å; Y743-F866 HydrophobicContact CD2-CD1 3.56Å; Y743-F866 HydrophobicContact CD2-CE1 4.45Å; Y743-F866 AromaticContact CD2-CG 3.87Å; Y743-F866 HydrophobicContact CD2-CG 3.87Å; Y743-F866 HydrophobicContact CE1-CD1 4.09Å; Y743-F866 HydrophobicContact CE1-CE1 4.31Å; Y743-F866 HydrophobicContact CE2-CB 4.18Å; Y743-F866 AromaticContact CE2-CD1 3.87Å; Y743-F866 HydrophobicContact CE2-CD1 3.87Å; Y743-F866 HydrophobicContact CE2-CG 4.43Å; Y743-F866 HydrophobicContact CG-CB 4.36Å; Y743-F866 AromaticContact CG-CD1 3.49Å; Y743-F866 HydrophobicContact CG-CD1 3.49Å; Y743-F866 VanDerWaalsContact CG-CD1 3.49Å; Y743-F866 AromaticContact CG-CE1 3.96Å; Y743-F866 HydrophobicContact CG-CE1 3.96Å; Y743-F866 HydrophobicContact CG-CG 4.01Å; S864-F866 PolarHBondContact OG-N 2.89Å
867	L	84.9	Confident	86.1	Confident	103 Å²	103	59.1 Å²	59.1	54%	0.539	31%	0.312	S	S	.	.	S	Bend	trans	-75.2	-34.1	-178.4	-65.9	179.1	0	0	0	113	Y743 M861	Y743-L867 HydrophobicContact CE2-CG 4.39Å; Y743-L867 VanDerWaalsContact OH-CD1 3.28Å; Y743-L867 WeakPolarHBondContact OH-CD1 3.43Å; M861-L867 HydrophobicContact CG-CD1 4.44Å
868	I	83.7	Confident	85.5	Confident	71 Å²	71	60.4 Å²	60.4	36%	0.364	32%	0.321	S	S	.	.	S	Bend	trans	-128.6	124.6	-178	-54.3	172.7	0	0	0	107.3	A862 G865 L870 M873	A862-I868 HydrophobicContact CB-CD1 4.33Å; G865-I868 CarbonylContact C-O 3.59Å; G865-I868 WeakPolarHBondContact CA-O 3.3Å; I868-L870 PolarHBondContact O-N 2.81Å; I868-M873 HydrophobicContact CB-CE 3.46Å; I868-M873 VanDerWaalsContact CB-CE 3.46Å; I868-M873 HydrophobicContact CD1-CE 4.42Å; I868-M873 HydrophobicContact CG2-CE 3.33Å; I868-M873 HydrophobicContact CG2-CG 3.9Å; I868-M873 HydrophobicContact CG2-SD 4.45Å
869	N	80.2	Confident	85.2	Confident	66 Å²	66	63 Å²	63	35%	0.353	32%	0.323	S	S	.	.			trans	-68.3	121.3	176.3	-173.3	-29.4	0	0	0	109.8	K871 S872	N869-K871 PolarHBondContact O-N 3.18Å; N869-K871 PolarHBondContact OD1-N 2.97Å; N869-K871 VanDerWaalsContact OD1-N 3.08Å; N869-S872 PolarHBondContact O-N 2.88Å; N869-S872 PolarHBondContact O-OG 3Å
870	L	74	Confident	85	Confident	7 Å²	7	59.3 Å²	59.3	4%	0.037	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-59.5	-31.5	-174.7	-68.2	163.1	0	0	0	113	I868 S872 M873 R881 R887	I868-L870 PolarHBondContact O-N 2.81Å; L870-S872 PolarHBondContact O-N 3.45Å; L870-M873 HydrophobicContact CD2-CE 3.79Å; L870-M873 HydrophobicContact CD2-SD 3.8Å; L870-M873 PolarHBondContact O-N 2.99Å; L870-R881 HydrophobicContact CD2-CB 4.16Å; L870-R887 VanDerWaalsContact CD1-NE 3.33Å
871	K	76.8	Confident	84.7	Confident	108 Å²	108	60 Å²	60	47%	0.47	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-65.6	-27.5	177.7	-70.6	-175.7	179.4	176.7	0	112.9	N869 E925 D926 E928	N869-K871 PolarHBondContact O-N 3.18Å; N869-K871 PolarHBondContact OD1-N 2.97Å; N869-K871 VanDerWaalsContact OD1-N 3.08Å; K871-E925 WeakPolarHBondContact CE-O 3.41Å; K871-E925 PolarHBondContact NZ-O 3.36Å; K871-E925 VanDerWaalsContact NZ-O 3.13Å; K871-D926 WeakPolarHBondContact CD-O 3.35Å; K871-D926 WeakPolarHBondContact CE-O 3.43Å; K871-D926 IonicContact NZ-OD1 2.79Å; K871-D926 PolarHBondContact NZ-OD1 2.96Å; K871-D926 VanDerWaalsContact NZ-OD1 3.15Å; K871-E928 HydrophobicContact CG-CG 4.08Å
872	S	81.1	Confident	84.5	Confident	89 Å²	89	63.8 Å²	63.8	62%	0.622	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-86.3	-6.9	-178.8	68.7	0	0	0	0	113.7	N869 L870	N869-S872 PolarHBondContact O-N 2.88Å; N869-S872 PolarHBondContact O-OG 3Å; L870-S872 PolarHBondContact O-N 3.45Å
873	M	81.6	Confident	84.5	Confident	26 Å²	26	68.5 Å²	68.5	13%	0.128	34%	0.338	C	S	.	.	S	Bend	trans	-77.3	139.4	-176.9	-64.4	-174.5	-178.8	0	0	111.7	F863 I868 L870 V875	F863-M873 HydrophobicContact CD1-CE 3.94Å; F863-M873 HydrophobicContact CD1-SD 3.81Å; F863-M873 HydrophobicContact CE1-CE 4.49Å; F863-M873 HydrophobicContact CE1-SD 4.11Å; I868-M873 HydrophobicContact CB-CE 3.46Å; I868-M873 VanDerWaalsContact CB-CE 3.46Å; I868-M873 HydrophobicContact CD1-CE 4.42Å; I868-M873 HydrophobicContact CG2-CE 3.33Å; I868-M873 HydrophobicContact CG2-CG 3.9Å; I868-M873 HydrophobicContact CG2-SD 4.45Å; L870-M873 HydrophobicContact CD2-CE 3.79Å; L870-M873 HydrophobicContact CD2-SD 3.8Å; L870-M873 PolarHBondContact O-N 2.99Å; M873-V875 PolarHBondContact O-N 3.32Å
874	A	84.3	Confident	84.7	Confident	48 Å²	48	67.7 Å²	67.7	40%	0.397	34%	0.335	S	S	.	.			trans	-59.1	137.3	173.4	0	0	0	0	0	111.1	W876 L877 S878	A874-W876 HydrophobicContact CB-CG 4.5Å; A874-W876 PolarHBondContact O-N 2.95Å; A874-W876 VanDerWaalsContact O-N 3.08Å; A874-L877 PolarHBondContact O-N 3.2Å; A874-S878 PolarHBondContact O-N 3.36Å
875	V	84.6	Confident	85	Confident	133 Å²	133	67.6 Å²	67.6	81%	0.806	33%	0.334	S	S	*	.	H	α-helix	trans	-54	-36.1	-174.9	-178.6	0	0	0	0	112.3	M873 L877 S878	M873-V875 PolarHBondContact O-N 3.32Å; V875-L877 VanDerWaalsContact C-N 3.27Å; V875-L877 PolarHBondContact O-N 3.41Å; V875-S878 WeakPolarHBondContact O-CB 3.3Å; V875-S878 PolarHBondContact O-N 3.45Å
876	W	88	Confident	85.5	Confident	184 Å²	184	67.2 Å²	67.2	70%	0.697	33%	0.33	S	S	*	.	H	α-helix	trans	-68.5	-19.8	179.3	75.6	-92.5	0	0	0	114.3	A874 W879	A874-W876 HydrophobicContact CB-CG 4.5Å; A874-W876 PolarHBondContact O-N 2.95Å; A874-W876 VanDerWaalsContact O-N 3.08Å; W876-W879 PolarHBondContact O-NE1 3.4Å
877	L	85.7	Confident	85.9	Confident	47 Å²	47	65 Å²	65	25%	0.246	32%	0.319	C	S	.	.	H	α-helix	trans	-96.4	-20.6	173.8	-77.3	169.1	0	0	0	112.6	F863 A874 V875 W879 L880	F863-L877 HydrophobicContact CE1-CB 4.46Å; F863-L877 HydrophobicContact CZ-CD2 4.49Å; A874-L877 PolarHBondContact O-N 3.2Å; V875-L877 VanDerWaalsContact C-N 3.27Å; V875-L877 PolarHBondContact O-N 3.41Å; L877-W879 PolarHBondContact O-N 3.14Å; L877-W879 VanDerWaalsContact O-N 3.12Å; L877-L880 HydrophobicContact CD2-CD1 3.6Å; L877-L880 WeakPolarHBondContact O-CB 3.42Å; L877-L880 PolarHBondContact O-N 3.13Å
878	S	82.8	Confident	86.3	Confident	27 Å²	27	61 Å²	61	19%	0.189	30%	0.297	C	S	.	.	H	α-helix	trans	-57.4	-32.6	-172	-175.6	0	0	0	0	113.3	A874 V875 L880 R881	A874-S878 PolarHBondContact O-N 3.36Å; V875-S878 WeakPolarHBondContact O-CB 3.3Å; V875-S878 PolarHBondContact O-N 3.45Å; S878-L880 PolarHBondContact O-N 3.31Å; S878-R881 WeakPolarHBondContact O-CB 3.43Å; S878-R881 VanDerWaalsContact O-CD 3.23Å; S878-R881 WeakPolarHBondContact O-CD 3.28Å; S878-R881 WeakPolarHBondContact O-CG 3.45Å; S878-R881 PolarHBondContact O-N 3.46Å; S878-R881 VanDerWaalsContact O-N 3.17Å
879	W	87.4	Confident	86.9	Confident	138 Å²	138	57.6 Å²	57.6	52%	0.523	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-62.9	-24	178.6	66.7	-89.7	0	0	0	113.9	W876 L877 R881 Y882 F883	W876-W879 PolarHBondContact O-NE1 3.4Å; L877-W879 PolarHBondContact O-N 3.14Å; L877-W879 VanDerWaalsContact O-N 3.12Å; W879-R881 PolarHBondContact O-N 2.91Å; W879-Y882 WeakPolarHBondContact O-CD2 3.45Å; W879-Y882 PolarHBondContact O-N 3.35Å; W879-F883 AromaticContact CE3-CD2 3.87Å; W879-F883 HydrophobicContact CE3-CD2 3.87Å; W879-F883 AromaticContact CE3-CE2 3.67Å; W879-F883 HydrophobicContact CE3-CE2 3.67Å; W879-F883 AromaticContact CZ3-CD2 3.81Å; W879-F883 HydrophobicContact CZ3-CD2 3.81Å; W879-F883 AromaticContact CZ3-CE2 3.59Å; W879-F883 HydrophobicContact CZ3-CE2 3.59Å
880	L	86.8	Confident	87.5	Confident	27 Å²	27	54.7 Å²	54.7	14%	0.141	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-65.3	-23.9	178.1	-70.9	167.2	0	0	0	112.8	F859 F863 L877 S878 Y882 F883 S884	F859-L880 HydrophobicContact CE1-CD1 3.91Å; F859-L880 HydrophobicContact CE1-CD2 4.07Å; F859-L880 HydrophobicContact CE1-CG 4.44Å; F859-L880 HydrophobicContact CZ-CD1 3.65Å; F863-L880 HydrophobicContact CD1-CB 4.46Å; F863-L880 HydrophobicContact CD2-CB 4.41Å; F863-L880 HydrophobicContact CE1-CB 4.38Å; F863-L880 HydrophobicContact CE1-CD1 4.43Å; F863-L880 HydrophobicContact CE2-CB 4.37Å; F863-L880 HydrophobicContact CE2-CD1 4.15Å; F863-L880 HydrophobicContact CG-CB 4.48Å; F863-L880 HydrophobicContact CZ-CB 4.34Å; F863-L880 HydrophobicContact CZ-CD1 3.85Å; L877-L880 HydrophobicContact CD2-CD1 3.6Å; L877-L880 WeakPolarHBondContact O-CB 3.42Å; L877-L880 PolarHBondContact O-N 3.13Å; S878-L880 PolarHBondContact O-N 3.31Å; L880-Y882 PolarHBondContact O-N 2.94Å; L880-F883 PolarHBondContact O-N 3.04Å; L880-S884 PolarHBondContact O-N 3.47Å
881	R	86.9	Confident	88.4	Confident	34 Å²	34	54.4 Å²	54.4	13%	0.128	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-58.2	-31	176.1	82.3	-165.8	176.3	147.3	-8	112.4	L870 S878 W879 F883 S884 R887 E928	L870-R881 HydrophobicContact CD2-CB 4.16Å; S878-R881 WeakPolarHBondContact O-CB 3.43Å; S878-R881 VanDerWaalsContact O-CD 3.23Å; S878-R881 WeakPolarHBondContact O-CD 3.28Å; S878-R881 WeakPolarHBondContact O-CG 3.45Å; S878-R881 PolarHBondContact O-N 3.46Å; S878-R881 VanDerWaalsContact O-N 3.17Å; W879-R881 PolarHBondContact O-N 2.91Å; R881-F883 VanDerWaalsContact C-N 3.28Å; R881-F883 PolarHBondContact O-N 3.4Å; R881-S884 PolarHBondContact O-N 3.26Å; R881-R887 HydrophobicContact CB-CG 4.5Å; R881-R887 WeakPolarHBondContact O-CB 3.13Å; R881-E928 IonicContact CZ-OE2 2.76Å; R881-E928 IonicContact NH1-OE2 3.84Å; R881-E928 PolarHBondContact NH1-OE2 3.36Å; R881-E928 IonicContact NH2-OE2 3.15Å
882	Y	88.3	Confident	89.2	Confident	106 Å²	106	49.2 Å²	49.2	42%	0.416	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-76.2	-13.5	179.3	-61.4	-70.3	0	0	0	113.5	W879 L880 Y888	W879-Y882 WeakPolarHBondContact O-CD2 3.45Å; W879-Y882 PolarHBondContact O-N 3.35Å; L880-Y882 PolarHBondContact O-N 2.94Å; Y882-Y888 VanDerWaalsContact O-CE2 3.26Å; Y882-Y888 WeakPolarHBondContact O-CE2 3.49Å; Y882-Y888 PolarHBondContact O-OH 3.21Å
883	F	90.2	Very high	89.8	Confident	127 Å²	127	45 Å²	45	56%	0.557	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-93.2	-10.3	171.8	-74.3	-83.3	0	0	0	112.3	M860 W879 L880 R881 I885	M860-F883 WeakPolarHBondContact CE-O 3.06Å; W879-F883 AromaticContact CE3-CD2 3.87Å; W879-F883 HydrophobicContact CE3-CD2 3.87Å; W879-F883 AromaticContact CE3-CE2 3.67Å; W879-F883 HydrophobicContact CE3-CE2 3.67Å; W879-F883 AromaticContact CZ3-CD2 3.81Å; W879-F883 HydrophobicContact CZ3-CD2 3.81Å; W879-F883 AromaticContact CZ3-CE2 3.59Å; W879-F883 HydrophobicContact CZ3-CE2 3.59Å; L880-F883 PolarHBondContact O-N 3.04Å; R881-F883 VanDerWaalsContact C-N 3.28Å; R881-F883 PolarHBondContact O-N 3.4Å; F883-I885 PolarHBondContact O-N 3.02Å
884	S	93.2	Very high	90.4	Very high	1 Å²	1	44 Å²	44	1%	0.007	21%	0.206	C	C	.	.			trans	-81.3	117.8	-177.1	177.6	0	0	0	0	111.8	M860 L880 R881 F886 R887 Y888	M860-S884 PolarHBondContact O-OG 3.49Å; L880-S884 PolarHBondContact O-N 3.47Å; R881-S884 PolarHBondContact O-N 3.26Å; S884-F886 PolarHBondContact O-N 3.21Å; S884-F886 WeakPolarHBondContact OG-CB 3.25Å; S884-F886 PolarHBondContact OG-N 3.49Å; S884-R887 PolarHBondContact O-N 3.06Å; S884-R887 PolarHBondContact OG-N 3.4Å; S884-Y888 VanDerWaalsContact O-CD2 3.3Å; S884-Y888 WeakPolarHBondContact O-CD2 3.45Å
885	I	95.3	Very high	90.8	Very high	1 Å²	1	42 Å²	42	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-58.8	-38.2	169	-64.2	176.2	0	0	0	110.5	I750 T828 A831 I835 M860 F883 R887 Y888 S889 L944 I947	I750-I885 HydrophobicContact CD1-CB 4.38Å; I750-I885 HydrophobicContact CD1-CG2 3.89Å; I750-I885 HydrophobicContact CG1-CG2 4.43Å; T828-I885 HydrophobicContact CG2-CG2 3.8Å; A831-I885 HydrophobicContact CB-CD1 3.87Å; A831-I885 HydrophobicContact CB-CG1 4.34Å; A831-I885 HydrophobicContact CB-CG2 4.49Å; I835-I885 HydrophobicContact CD1-CD1 3.45Å; I835-I885 VanDerWaalsContact CD1-CD1 3.45Å; I835-I885 HydrophobicContact CD1-CG1 4.43Å; I835-I885 HydrophobicContact CG1-CD1 4.4Å; M860-I885 HydrophobicContact SD-CD1 4.37Å; M860-I885 HydrophobicContact SD-CG1 4.21Å; F883-I885 PolarHBondContact O-N 3.02Å; I885-R887 VanDerWaalsContact C-N 3.31Å; I885-R887 PolarHBondContact O-N 2.9Å; I885-Y888 PolarHBondContact O-N 2.94Å; I885-S889 WeakPolarHBondContact O-CB 3.35Å; I885-S889 PolarHBondContact O-N 3.4Å; I885-L944 HydrophobicContact CB-CD2 4.5Å; I885-L944 HydrophobicContact CG2-CD2 3.75Å; I885-I947 HydrophobicContact CD1-CG2 4.2Å; I885-I947 HydrophobicContact CG1-CD1 4.27Å; I885-I947 HydrophobicContact CG1-CG2 4.03Å
886	F	94.6	Very high	91.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.5	-40.3	178.8	-76.1	-98.7	0	0	0	111.7	T746 L747 I750 F751 M860 M861 S884 Y888 S889 M890	T746-F886 HydrophobicContact CG2-CB 4.48Å; T746-F886 HydrophobicContact CG2-CD1 3.52Å; T746-F886 HydrophobicContact CG2-CE1 3.96Å; T746-F886 HydrophobicContact CG2-CG 4.11Å; L747-F886 HydrophobicContact CB-CE1 4.21Å; I750-F886 HydrophobicContact CB-CE2 4.41Å; I750-F886 HydrophobicContact CB-CZ 4.21Å; I750-F886 HydrophobicContact CD1-CD1 4.05Å; I750-F886 HydrophobicContact CD1-CD2 3.5Å; I750-F886 HydrophobicContact CD1-CE1 3.88Å; I750-F886 HydrophobicContact CD1-CE2 3.32Å; I750-F886 HydrophobicContact CD1-CG 3.87Å; I750-F886 HydrophobicContact CD1-CZ 3.51Å; I750-F886 HydrophobicContact CG1-CE2 4.43Å; I750-F886 HydrophobicContact CG1-CZ 4.42Å; I750-F886 HydrophobicContact CG2-CE2 4.07Å; I750-F886 HydrophobicContact CG2-CZ 4.23Å; F751-F886 HydrophobicContact CE2-CZ 4.16Å; M860-F886 HydrophobicContact CB-CD2 3.97Å; M860-F886 HydrophobicContact CB-CE2 4.43Å; M861-F886 HydrophobicContact CB-CD1 4.45Å; M861-F886 HydrophobicContact CB-CD2 4.13Å; M861-F886 HydrophobicContact CB-CE1 4.15Å; M861-F886 HydrophobicContact CB-CE2 3.78Å; M861-F886 HydrophobicContact CB-CG 4.46Å; M861-F886 HydrophobicContact CB-CZ 3.81Å; M861-F886 HydrophobicContact CE-CE1 4.46Å; M861-F886 HydrophobicContact CE-CZ 4.04Å; M861-F886 HydrophobicContact CG-CD1 4.47Å; M861-F886 HydrophobicContact CG-CE1 4.07Å; M861-F886 HydrophobicContact CG-CZ 4.13Å; S884-F886 PolarHBondContact O-N 3.21Å; S884-F886 WeakPolarHBondContact OG-CB 3.25Å; S884-F886 PolarHBondContact OG-N 3.49Å; F886-Y888 PolarHBondContact O-N 2.91Å; F886-S889 PolarHBondContact O-N 3.26Å; F886-M890 VanDerWaalsContact O-CB 3.29Å; F886-M890 WeakPolarHBondContact O-CB 3.5Å; F886-M890 WeakPolarHBondContact O-CG 3.38Å; F886-M890 PolarHBondContact O-N 3.1Å
887	R	93.1	Very high	91.4	Very high	21 Å²	21	27.7 Å²	27.7	8%	0.079	12%	0.121	C	C	.	.	H	α-helix	trans	-63.2	-41.1	-178.9	177.4	57.2	-177.4	85.8	-4.6	112.7	L870 R881 S884 I885 G891 E928	L870-R887 VanDerWaalsContact CD1-NE 3.33Å; R881-R887 HydrophobicContact CB-CG 4.5Å; R881-R887 WeakPolarHBondContact O-CB 3.13Å; S884-R887 PolarHBondContact O-N 3.06Å; S884-R887 PolarHBondContact OG-N 3.4Å; I885-R887 VanDerWaalsContact C-N 3.31Å; I885-R887 PolarHBondContact O-N 2.9Å; R887-G891 WeakPolarHBondContact O-CA 3.38Å; R887-G891 PolarHBondContact O-N 3.35Å; R887-E928 PolarHBondContact NH2-O 3.43Å
888	Y	94.4	Very high	91.7	Very high	20 Å²	20	25.4 Å²	25.4	8%	0.078	11%	0.11	C	C	.	.	H	α-helix	trans	-72.4	-41.7	177.6	-68.2	-67.3	0	0	0	111.8	Y882 S884 I885 F886 G891 G892 Y939 N940 I947	Y882-Y888 VanDerWaalsContact O-CE2 3.26Å; Y882-Y888 WeakPolarHBondContact O-CE2 3.49Å; Y882-Y888 PolarHBondContact O-OH 3.21Å; S884-Y888 VanDerWaalsContact O-CD2 3.3Å; S884-Y888 WeakPolarHBondContact O-CD2 3.45Å; I885-Y888 PolarHBondContact O-N 2.94Å; F886-Y888 PolarHBondContact O-N 2.91Å; Y888-G891 PolarHBondContact O-N 3.34Å; Y888-G892 PolarHBondContact O-N 3.44Å; Y888-Y939 HydrophobicContact CD1-CE1 4.25Å; Y888-Y939 HydrophobicContact CE1-CD1 4.42Å; Y888-Y939 AromaticContact CE1-CE1 3.65Å; Y888-Y939 HydrophobicContact CE1-CE1 3.65Å; Y888-Y939 AromaticContact CE1-CZ 3.86Å; Y888-N940 WeakPolarHBondContact O-CB 3.39Å; Y888-N940 PolarHBondContact O-OD1 3.03Å; Y888-I947 HydrophobicContact CD2-CD1 3.83Å; Y888-I947 HydrophobicContact CE2-CD1 3.72Å
889	S	95.3	Very high	92	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-60.4	-55.4	176.6	-165	0	0	0	0	110.9	T746 T828 I885 F886 G891 G892 L893	T746-S889 WeakPolarHBondContact CG2-OG 3.29Å; T746-S889 PolarHBondContact OG1-OG 3.3Å; T828-S889 WeakPolarHBondContact OG1-CB 3.43Å; T828-S889 PolarHBondContact OG1-OG 3.13Å; I885-S889 WeakPolarHBondContact O-CB 3.35Å; I885-S889 PolarHBondContact O-N 3.4Å; F886-S889 PolarHBondContact O-N 3.26Å; S889-G891 PolarHBondContact O-N 2.92Å; S889-G892 PolarHBondContact O-N 3.48Å; S889-L893 VanDerWaalsContact O-CG 3.28Å; S889-L893 WeakPolarHBondContact O-CG 3.27Å; S889-L893 PolarHBondContact O-N 2.89Å
890	M	93.2	Very high	91.9	Very high	4 Å²	4	27 Å²	27	2%	0.02	13%	0.125	C	C	.	.	H	α-helix	trans	-61.7	-42.4	177.5	-70.8	-60.8	-69.4	0	0	112.4	F742 Y743 F886 G892 L893 L894	F742-M890 VanDerWaalsContact C-SD 3.51Å; F742-M890 HydrophobicContact CB-CE 4.03Å; F742-M890 HydrophobicContact CB-SD 3.84Å; Y743-M890 VanDerWaalsContact CA-SD 3.52Å; Y743-M890 PolarHBondContact N-SD 3.49Å; Y743-M890 VanDerWaalsContact N-SD 3.41Å; F886-M890 VanDerWaalsContact O-CB 3.29Å; F886-M890 WeakPolarHBondContact O-CB 3.5Å; F886-M890 WeakPolarHBondContact O-CG 3.38Å; F886-M890 PolarHBondContact O-N 3.1Å; M890-G892 VanDerWaalsContact C-N 3.35Å; M890-G892 PolarHBondContact O-N 3.3Å; M890-L893 PolarHBondContact O-N 3.08Å; M890-L894 HydrophobicContact CB-CD1 4.5Å; M890-L894 HydrophobicContact CE-CD1 3.96Å; M890-L894 HydrophobicContact CE-CG 4.38Å; M890-L894 VanDerWaalsContact O-CB 3.25Å; M890-L894 WeakPolarHBondContact O-CB 3.35Å; M890-L894 VanDerWaalsContact O-CG 3.3Å; M890-L894 WeakPolarHBondContact O-CG 3.49Å; M890-L894 PolarHBondContact O-N 3.12Å
891	G	92.3	Very high	92.1	Very high	1 Å²	1	27 Å²	27	1%	0.01	13%	0.125	C	C	.	.	H	α-helix	trans	-58.2	-45	177.6	0	0	0	0	0	112.7	R887 Y888 S889 A895	R887-G891 WeakPolarHBondContact O-CA 3.38Å; R887-G891 PolarHBondContact O-N 3.35Å; Y888-G891 PolarHBondContact O-N 3.34Å; S889-G891 PolarHBondContact O-N 2.92Å; G891-A895 WeakPolarHBondContact O-CB 3.39Å; G891-A895 PolarHBondContact O-N 2.91Å
892	G	93.4	Very high	92.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-67.3	-47.6	177.4	0	0	0	0	0	112.9	Y888 S889 M890 M896	Y888-G892 PolarHBondContact O-N 3.44Å; S889-G892 PolarHBondContact O-N 3.48Å; M890-G892 VanDerWaalsContact C-N 3.35Å; M890-G892 PolarHBondContact O-N 3.3Å; G892-M896 WeakPolarHBondContact O-CB 3.44Å; G892-M896 PolarHBondContact O-N 3.38Å; G892-M896 VanDerWaalsContact O-N 3.13Å
893	L	94.5	Very high	92.3	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-64.8	-44.2	-178.6	-65.3	176.8	0	0	0	112.2	F742 F821 I824 L825 S889 M890 E897	F742-L893 HydrophobicContact CB-CB 4.27Å; F742-L893 HydrophobicContact CB-CD1 3.99Å; F742-L893 HydrophobicContact CD1-CB 4.14Å; F742-L893 HydrophobicContact CD1-CD1 4.08Å; F742-L893 HydrophobicContact CD2-CB 3.79Å; F742-L893 HydrophobicContact CE1-CB 4.42Å; F742-L893 HydrophobicContact CE2-CB 4.09Å; F742-L893 WeakPolarHBondContact CE2-O 3.43Å; F742-L893 HydrophobicContact CG-CB 3.82Å; F742-L893 HydrophobicContact CG-CD1 4.1Å; F742-L893 HydrophobicContact CZ-CB 4.39Å; F821-L893 HydrophobicContact CB-CD2 4.38Å; F821-L893 HydrophobicContact CD2-CD2 3.6Å; F821-L893 HydrophobicContact CE2-CD2 4.26Å; F821-L893 HydrophobicContact CG-CD2 4.28Å; I824-L893 HydrophobicContact CB-CD2 4.15Å; I824-L893 HydrophobicContact CG2-CD1 4.46Å; I824-L893 HydrophobicContact CG2-CD2 3.93Å; I824-L893 HydrophobicContact CG2-CG 3.88Å; L825-L893 HydrophobicContact CD2-CD1 4.09Å; S889-L893 VanDerWaalsContact O-CG 3.28Å; S889-L893 WeakPolarHBondContact O-CG 3.27Å; S889-L893 PolarHBondContact O-N 2.89Å; M890-L893 PolarHBondContact O-N 3.08Å; L893-E897 PolarHBondContact O-N 3.36Å; L893-E897 VanDerWaalsContact O-N 3.11Å
894	L	93.5	Very high	92.1	Very high	6 Å²	6	24 Å²	24	3%	0.031	12%	0.117	C	C	.	.	H	α-helix	trans	-70.5	-42	179.1	-70.9	169.7	0	0	0	112.4	T739 F742 M890 M896 E897 M898 Y923 L924 I929	T739-L894 HydrophobicContact CG2-CD1 4.48Å; T739-L894 HydrophobicContact CG2-CD2 3.54Å; F742-L894 HydrophobicContact CD2-CD2 3.78Å; F742-L894 HydrophobicContact CD2-CG 4.18Å; F742-L894 HydrophobicContact CE2-CD2 4.27Å; M890-L894 HydrophobicContact CB-CD1 4.5Å; M890-L894 HydrophobicContact CE-CD1 3.96Å; M890-L894 HydrophobicContact CE-CG 4.38Å; M890-L894 VanDerWaalsContact O-CB 3.25Å; M890-L894 WeakPolarHBondContact O-CB 3.35Å; M890-L894 VanDerWaalsContact O-CG 3.3Å; M890-L894 WeakPolarHBondContact O-CG 3.49Å; M890-L894 PolarHBondContact O-N 3.12Å; L894-M896 PolarHBondContact O-N 3.37Å; L894-E897 PolarHBondContact O-N 2.83Å; L894-M898 HydrophobicContact CD2-CE 3.84Å; L894-M898 HydrophobicContact CD2-CG 4.27Å; L894-M898 VanDerWaalsContact O-CB 3.27Å; L894-M898 WeakPolarHBondContact O-CB 3.32Å; L894-M898 WeakPolarHBondContact O-CG 3.25Å; L894-M898 PolarHBondContact O-N 3.2Å; L894-Y923 HydrophobicContact CD1-CE1 4.2Å; L894-Y923 HydrophobicContact CD2-CE1 4.41Å; L894-L924 HydrophobicContact CB-CD2 4.08Å; L894-I929 HydrophobicContact CB-CD1 4.09Å; L894-I929 HydrophobicContact CD1-CD1 3.84Å
895	A	92.5	Very high	91.6	Very high	5 Å²	5	25.3 Å²	25.3	4%	0.041	13%	0.125	C	C	.	.	H	α-helix	trans	-61.4	-35.9	177.4	0	0	0	0	0	111.9	G891 K899 I929 L937	G891-A895 WeakPolarHBondContact O-CB 3.39Å; G891-A895 PolarHBondContact O-N 2.91Å; A895-K899 WeakPolarHBondContact O-CB 3.46Å; A895-I929 HydrophobicContact CB-CG2 3.96Å; A895-L937 HydrophobicContact CB-CD1 4.22Å
896	M	92.4	Very high	90.7	Very high	15 Å²	15	30.6 Å²	30.6	7%	0.074	15%	0.151	C	C	.	.	H	α-helix	trans	-65.5	-54.7	174.6	-179.9	-157	76.8	0	0	111.5	F742 Q812 A817 F820 F821 G892 L894 L937	F742-M896 HydrophobicContact CZ-CE 4.45Å; Q812-M896 PolarHBondContact NE2-O 3.15Å; A817-M896 VanDerWaalsContact CA-SD 3.58Å; A817-M896 HydrophobicContact CB-CE 4.26Å; A817-M896 HydrophobicContact CB-CG 3.89Å; A817-M896 HydrophobicContact CB-SD 3.72Å; F820-M896 HydrophobicContact CB-SD 4.16Å; F820-M896 HydrophobicContact CD1-CB 4.15Å; F820-M896 HydrophobicContact CD1-CG 4.25Å; F820-M896 HydrophobicContact CD1-SD 3.97Å; F821-M896 HydrophobicContact CB-CE 4.31Å; F821-M896 HydrophobicContact CB-SD 4.22Å; G892-M896 WeakPolarHBondContact O-CB 3.44Å; G892-M896 PolarHBondContact O-N 3.38Å; G892-M896 VanDerWaalsContact O-N 3.13Å; L894-M896 PolarHBondContact O-N 3.37Å; M896-L937 HydrophobicContact CB-CD1 4.16Å
897	E	93.4	Very high	89.4	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-74.1	-45.9	-172	-179.7	65.9	-173.7	0	0	113.2	R738 F742 L811 Q812 L893 L894 K899 L901	R738-E897 IonicContact CZ-OE1 3.26Å; R738-E897 IonicContact NE-OE1 2.92Å; R738-E897 PolarHBondContact NE-OE1 2.87Å; R738-E897 IonicContact NH2-OE1 2.85Å; F742-E897 HydrophobicContact CE2-CB 3.63Å; F742-E897 HydrophobicContact CE2-CG 4.01Å; F742-E897 HydrophobicContact CZ-CB 3.74Å; F742-E897 HydrophobicContact CZ-CG 4Å; L811-E897 HydrophobicContact CD2-CG 4.14Å; L811-E897 WeakPolarHBondContact CD2-OE1 3.21Å; Q812-E897 WeakPolarHBondContact CG-OE2 3.48Å; Q812-E897 PolarHBondContact N-OE2 2.93Å; Q812-E897 VanDerWaalsContact N-OE2 3.16Å; Q812-E897 VanDerWaalsContact NE2-CA 3.35Å; Q812-E897 PolarHBondContact NE2-O 3.23Å; L893-E897 PolarHBondContact O-N 3.36Å; L893-E897 VanDerWaalsContact O-N 3.11Å; L894-E897 PolarHBondContact O-N 2.83Å; E897-K899 PolarHBondContact O-N 3.25Å; E897-L901 HydrophobicContact CG-CD1 3.99Å; E897-L901 WeakPolarHBondContact O-CD1 3.28Å; E897-L901 WeakPolarHBondContact O-CG 3.49Å; E897-L901 WeakPolarHBondContact OE1-CD1 3.19Å
898	M	91.2	Very high	87.8	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-76.8	-21.3	-169.1	-63.2	-65	171.4	0	0	113.5	R738 T739 L894 T900 L901 F903 G920 L924	R738-M898 HydrophobicContact CB-CE 3.51Å; R738-M898 HydrophobicContact CG-CE 4.35Å; T739-M898 HydrophobicContact CG2-CE 4.11Å; L894-M898 HydrophobicContact CD2-CE 3.84Å; L894-M898 HydrophobicContact CD2-CG 4.27Å; L894-M898 VanDerWaalsContact O-CB 3.27Å; L894-M898 WeakPolarHBondContact O-CB 3.32Å; L894-M898 WeakPolarHBondContact O-CG 3.25Å; L894-M898 PolarHBondContact O-N 3.2Å; M898-T900 VanDerWaalsContact C-N 3.25Å; M898-T900 PolarHBondContact O-N 3.43Å; M898-L901 PolarHBondContact O-N 3.43Å; M898-F903 HydrophobicContact SD-CE2 3.84Å; M898-F903 HydrophobicContact SD-CZ 3.77Å; M898-G920 CarbonylContact O-C 3.57Å; M898-G920 WeakPolarHBondContact O-CA 3.2Å; M898-L924 HydrophobicContact CB-CD1 3.96Å; M898-L924 HydrophobicContact CB-CD2 4.03Å; M898-L924 HydrophobicContact CB-CG 3.92Å; M898-L924 HydrophobicContact CG-CD2 4.36Å
899	K	89.1	Confident	86	Confident	104 Å²	104	46.2 Å²	46.2	45%	0.452	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-29.9	-175.1	-178.7	170.5	-178.8	162.9	0	113.5	A895 E897 Y931 I932	A895-K899 WeakPolarHBondContact O-CB 3.46Å; E897-K899 PolarHBondContact O-N 3.25Å; K899-Y931 PolarHBondContact NZ-O 3.39Å; K899-I932 PolarHBondContact NZ-O 3.06Å
900	T	86.4	Confident	84	Confident	95 Å²	95	54.5 Å²	54.5	58%	0.583	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-1.7	-176.3	71.7	0	0	0	0	113.9	Q812 M898	Q812-T900 PolarHBondContact NE2-OG1 3.13Å; M898-T900 VanDerWaalsContact C-N 3.25Å; M898-T900 PolarHBondContact O-N 3.43Å
901	L	89.9	Confident	82.2	Confident	27 Å²	27	57.5 Å²	57.5	14%	0.141	31%	0.305	C	S	.	.			trans	-101.9	147.2	-172	-65.5	175.8	0	0	0	112.1	R738 E897 M898 F903 G920	R738-L901 VanDerWaalsContact NE-CD1 3.29Å; E897-L901 HydrophobicContact CG-CD1 3.99Å; E897-L901 WeakPolarHBondContact O-CD1 3.28Å; E897-L901 WeakPolarHBondContact O-CG 3.49Å; E897-L901 WeakPolarHBondContact OE1-CD1 3.19Å; M898-L901 PolarHBondContact O-N 3.43Å; L901-F903 HydrophobicContact CB-CE2 4Å; L901-F903 HydrophobicContact CB-CZ 3.95Å; L901-F903 HydrophobicContact CD1-CZ 3.98Å; L901-G920 PolarHBondContact O-N 3.28Å
902	R	89.5	Confident	80.5	Confident	153 Å²	153	64.8 Å²	64.8	58%	0.577	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.4	126.6	172.5	-177.1	177.8	-175.3	-167	0.1	108.3	C917 N919	R902-C917 HydrophobicContact CG-CB 4.23Å; R902-N919 WeakPolarHBondContact CG-OD1 3.28Å
903	F	90.2	Very high	79.1	Confident	0 Å²	0	70 Å²	70	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	126.1	-176.3	-59.5	-82.7	0	0	0	110.1	D729 L731 I735 M898 L901 C917 Q918	D729-F903 WeakPolarHBondContact O-CA 3.26Å; L731-F903 HydrophobicContact CB-CB 4.43Å; L731-F903 HydrophobicContact CD1-CB 4Å; I735-F903 HydrophobicContact CD1-CB 4.48Å; I735-F903 HydrophobicContact CD1-CD2 3.76Å; I735-F903 HydrophobicContact CD1-CE2 4.16Å; I735-F903 HydrophobicContact CD1-CG 4.07Å; I735-F903 HydrophobicContact CG1-CD1 3.94Å; I735-F903 HydrophobicContact CG1-CD2 3.53Å; I735-F903 HydrophobicContact CG1-CE1 3.95Å; I735-F903 HydrophobicContact CG1-CE2 3.55Å; I735-F903 HydrophobicContact CG1-CG 3.73Å; I735-F903 HydrophobicContact CG1-CZ 3.77Å; M898-F903 HydrophobicContact SD-CE2 3.84Å; M898-F903 HydrophobicContact SD-CZ 3.77Å; L901-F903 HydrophobicContact CB-CE2 4Å; L901-F903 HydrophobicContact CB-CZ 3.95Å; L901-F903 HydrophobicContact CD1-CZ 3.98Å; F903-C917 CarbonylContact O-C 3.42Å; F903-C917 WeakPolarHBondContact O-CA 3.39Å; F903-C917 WeakPolarHBondContact O-CB 3.23Å; F903-Q918 PolarHBondContact N-O 3.4Å; F903-Q918 PolarHBondContact O-N 3.48Å
904	C	86.6	Confident	77.6	Confident	51 Å²	51	77.8 Å²	77.8	35%	0.345	42%	0.418	S	S	.	.	B	Isolated β-bridge	trans	-116.7	143.4	-179.8	-72.5	0	0	0	0	110.7	D729 S730 L731 C917	D729-C904 PolarHBondContact O-N 2.89Å; S730-C904 CarbonylContact C-O 3.47Å; S730-C904 WeakPolarHBondContact CA-O 3.41Å; L731-C904 PolarHBondContact N-O 3.25Å; C904-C917 VanDerWaalsContact CA-SG 3.56Å; C904-C917 HydrophobicContact CB-CB 4.05Å; C904-C917 WeakPolarHBondContact CB-SG 3.4Å; C904-C917 WeakPolarHBondContact SG-CB 3.17Å; C904-C917 CovalentContact SG-SG 2.04Å; C904-C917 PolarHBondContact SG-SG 3.3Å
905	P	83	Confident	76.6	Confident	28 Å²	28	83.7 Å²	83.7	18%	0.182	44%	0.439	C	S	.	.			trans	-63.8	149.6	176.4	29.1	-35.5	0	0	0	110.9	L731 E732 N907 R915	L731-P905 HydrophobicContact CB-CB 4.5Å; L731-P905 HydrophobicContact CD2-CB 4.43Å; E732-P905 WeakPolarHBondContact OE1-CA 3.23Å; P905-N907 PolarHBondContact O-N 3.36Å; P905-R915 HydrophobicContact CB-CB 4.07Å; P905-R915 HydrophobicContact CG-CB 4.03Å; P905-R915 WeakPolarHBondContact CG-O 3.48Å
906	M	76.9	Confident	76.1	Confident	111 Å²	111	91.3 Å²	91.3	55%	0.547	47%	0.474	S	S	.	.			trans	-66.6	131.6	173.8	-78.7	165.3	58.2	0	0	110.3	E732 N908 S909	E732-M906 PolarHBondContact OE1-N 3.01Å; E732-M906 VanDerWaalsContact OE1-N 3.16Å; E732-M906 PolarHBondContact OE2-N 3.44Å; M906-N908 PolarHBondContact O-N 3.41Å; M906-S909 PolarHBondContact O-N 3.46Å
907	N	67.4	Low	75.7	Confident	168 Å²	168	92.6 Å²	92.6	90%	0.898	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-4.3	-175	-91.2	-4.7	0	0	0	116	P905	P905-N907 PolarHBondContact O-N 3.36Å
908	N	59.8	Low	75.3	Confident	148 Å²	148	97.1 Å²	97.1	79%	0.791	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	16.4	-172.3	-72	-4.3	0	0	0	114.8	M906 N910	M906-N908 PolarHBondContact O-N 3.41Å; N908-N910 PolarHBondContact O-N 2.95Å
909	S	55	Low	75.3	Confident	54 Å²	54	101 Å²	101	38%	0.378	53%	0.526	S	S	.	.			trans	-81.9	102.3	171.9	49.2	0	0	0	0	110.2	M906 T911	M906-S909 PolarHBondContact O-N 3.46Å; S909-T911 PolarHBondContact O-N 3.33Å
910	N	54.1	Low	75.3	Confident	173 Å²	173	96.1 Å²	96.1	93%	0.925	51%	0.505	S	S	*	.			trans	-65.6	36.3	168.3	-78.5	-14.4	0	0	0	112.6	N908	N908-N910 PolarHBondContact O-N 2.95Å
911	T	56.3	Low	75.4	Confident	68 Å²	68	93 Å²	93	42%	0.417	49%	0.485	S	S	.	.			trans	-94.3	131.1	177.3	51.9	0	0	0	0	109	S909 I913	S909-T911 PolarHBondContact O-N 3.33Å; T911-I913 PolarHBondContact O-N 3.27Å
912	T	55.2	Low	75.4	Confident	153 Å²	153	94 Å²	94	94%	0.939	49%	0.493	S	S	*	.	S	Bend	trans	-60.4	9.8	174.4	32.1	0	0	0	0	114.8
913	I	63.4	Low	75.3	Confident	111 Å²	111	88.7 Å²	88.7	57%	0.569	47%	0.473	S	S	*	.	S	Bend	trans	-113.6	106.2	-177.8	-54.7	175.2	0	0	0	107.4	T911 R915	T911-I913 PolarHBondContact O-N 3.27Å; I913-R915 VanDerWaalsContact C-N 3.3Å; I913-R915 HydrophobicContact CG2-CG 4.37Å; I913-R915 PolarHBondContact O-N 2.89Å
914	N	64.2	Low	75.3	Confident	163 Å²	163	88.7 Å²	88.7	87%	0.872	47%	0.473	S	S	*	.			trans	-62.1	89.6	169.6	-84.3	-20.5	0	0	0	109.6	Q916	N914-Q916 PolarHBondContact O-N 2.89Å
915	R	72.4	Confident	75.3	Confident	130 Å²	130	91.4 Å²	91.4	49%	0.491	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-71.8	125.2	171.6	-67.9	-177.9	178.6	-178.8	-1.3	108.2	L731 P905 I913	L731-R915 HydrophobicContact CD2-CB 4.36Å; P905-R915 HydrophobicContact CB-CB 4.07Å; P905-R915 HydrophobicContact CG-CB 4.03Å; P905-R915 WeakPolarHBondContact CG-O 3.48Å; I913-R915 VanDerWaalsContact C-N 3.3Å; I913-R915 HydrophobicContact CG2-CG 4.37Å; I913-R915 PolarHBondContact O-N 2.89Å
916	Q	80.9	Confident	75.4	Confident	164 Å²	164	93.8 Å²	93.8	77%	0.766	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-88.9	150.8	175.9	-66.4	-175.9	-11.6	0	0	109.9	N914 Q918	N914-Q916 PolarHBondContact O-N 2.89Å; Q916-Q918 PolarHBondContact O-N 3.44Å
917	C	84.4	Confident	75.8	Confident	43 Å²	43	89.4 Å²	89.4	29%	0.291	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-61.3	131.9	171.3	-56.2	0	0	0	0	110.1	R902 F903 C904	R902-C917 HydrophobicContact CG-CB 4.23Å; F903-C917 CarbonylContact O-C 3.42Å; F903-C917 WeakPolarHBondContact O-CA 3.39Å; F903-C917 WeakPolarHBondContact O-CB 3.23Å; C904-C917 VanDerWaalsContact CA-SG 3.56Å; C904-C917 HydrophobicContact CB-CB 4.05Å; C904-C917 WeakPolarHBondContact CB-SG 3.4Å; C904-C917 WeakPolarHBondContact SG-CB 3.17Å; C904-C917 CovalentContact SG-SG 2.04Å; C904-C917 PolarHBondContact SG-SG 3.3Å
918	Q	86.4	Confident	76.6	Confident	95 Å²	95	85.4 Å²	85.4	44%	0.444	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	139.8	177.8	-65.8	-176.1	-19.9	0	0	110.1	L731 F903 Q916	L731-Q918 HydrophobicContact CD1-CB 4.03Å; L731-Q918 HydrophobicContact CD1-CG 4.16Å; F903-Q918 PolarHBondContact N-O 3.4Å; F903-Q918 PolarHBondContact O-N 3.48Å; Q916-Q918 PolarHBondContact O-N 3.44Å
919	N	89.8	Confident	77.9	Confident	83 Å²	83	78.8 Å²	78.8	44%	0.444	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	144.9	171.5	-69.6	-14.8	0	0	0	109	R902 T921 T922	R902-N919 WeakPolarHBondContact CG-OD1 3.28Å; N919-T921 WeakPolarHBondContact CB-OG1 3.46Å; N919-T921 PolarHBondContact O-N 2.89Å; N919-T922 WeakPolarHBondContact O-CB 3.47Å; N919-T922 PolarHBondContact O-N 3.3Å; N919-T922 PolarHBondContact O-OG1 2.93Å
920	G	88.9	Confident	79.4	Confident	0 Å²	0	78.7 Å²	78.7	0%	0	41%	0.409	C	S	.	.	H	α-helix	trans	-59.1	-21.1	175.4	0	0	0	0	0	113.1	M898 L901 T922 Y923 L924	M898-G920 CarbonylContact O-C 3.57Å; M898-G920 WeakPolarHBondContact O-CA 3.2Å; L901-G920 PolarHBondContact O-N 3.28Å; G920-T922 VanDerWaalsContact C-N 3.28Å; G920-T922 PolarHBondContact O-N 2.97Å; G920-Y923 WeakPolarHBondContact O-CB 3.3Å; G920-Y923 PolarHBondContact O-N 3.41Å; G920-L924 PolarHBondContact O-N 3.38Å
921	T	90	Very high	81	Confident	29 Å²	29	72.1 Å²	72.1	18%	0.178	37%	0.371	C	S	.	.	H	α-helix	trans	-60.4	-34	171.6	57.4	0	0	0	0	113.2	N919 Y923 L924 E925 Y931	N919-T921 WeakPolarHBondContact CB-OG1 3.46Å; N919-T921 PolarHBondContact O-N 2.89Å; T921-Y923 VanDerWaalsContact C-N 3.29Å; T921-Y923 PolarHBondContact O-N 3.03Å; T921-L924 WeakPolarHBondContact O-CB 3.43Å; T921-L924 PolarHBondContact O-N 2.89Å; T921-L924 VanDerWaalsContact O-N 3.1Å; T921-E925 WeakPolarHBondContact O-CG 3.47Å; T921-E925 PolarHBondContact O-N 3.45Å; T921-Y931 HydrophobicContact CG2-CD2 4.09Å; T921-Y931 HydrophobicContact CG2-CE2 3.56Å
922	T	88.7	Confident	82.2	Confident	48 Å²	48	75.2 Å²	75.2	29%	0.294	38%	0.384	S	S	.	.	H	α-helix	trans	-62	-39.4	176.4	-54.7	0	0	0	0	110.9	N919 G920 L924 E925 D926	N919-T922 WeakPolarHBondContact O-CB 3.47Å; N919-T922 PolarHBondContact O-N 3.3Å; N919-T922 PolarHBondContact O-OG1 2.93Å; G920-T922 VanDerWaalsContact C-N 3.28Å; G920-T922 PolarHBondContact O-N 2.97Å; T922-L924 VanDerWaalsContact C-N 3.35Å; T922-L924 PolarHBondContact O-N 2.91Å; T922-E925 PolarHBondContact O-N 3.48Å; T922-D926 PolarHBondContact O-N 3.03Å
923	Y	88.1	Confident	83.7	Confident	42 Å²	42	71.1 Å²	71.1	17%	0.165	36%	0.359	C	S	.	.	H	α-helix	trans	-65.1	-38.6	174	-179.5	-94.4	0	0	0	112.1	I735 T739 L894 G920 T921 D926 Q927	I735-Y923 HydrophobicContact CG2-CD1 4.42Å; I735-Y923 HydrophobicContact CG2-CD2 3.58Å; I735-Y923 HydrophobicContact CG2-CE2 3.77Å; I735-Y923 HydrophobicContact CG2-CG 3.93Å; T739-Y923 HydrophobicContact CG2-CE1 3.64Å; T739-Y923 HydrophobicContact CG2-CE2 4.4Å; T739-Y923 VanDerWaalsContact CG2-OH 3.3Å; T739-Y923 WeakPolarHBondContact CG2-OH 3.36Å; L894-Y923 HydrophobicContact CD1-CE1 4.2Å; L894-Y923 HydrophobicContact CD2-CE1 4.41Å; G920-Y923 WeakPolarHBondContact O-CB 3.3Å; G920-Y923 PolarHBondContact O-N 3.41Å; T921-Y923 VanDerWaalsContact C-N 3.29Å; T921-Y923 PolarHBondContact O-N 3.03Å; Y923-D926 PolarHBondContact O-N 2.94Å; Y923-Q927 HydrophobicContact CD1-CG 4.29Å; Y923-Q927 HydrophobicContact CE1-CG 3.75Å; Y923-Q927 HydrophobicContact CE2-CG 4.15Å; Y923-Q927 WeakPolarHBondContact O-CG 3.41Å; Y923-Q927 PolarHBondContact O-N 2.97Å
924	L	89.4	Confident	84.7	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-65.4	-40.9	176.8	-63	175.2	0	0	0	112.1	L894 M898 G920 T921 T922 D926 Q927 E928 I929 Y931	L894-L924 HydrophobicContact CB-CD2 4.08Å; M898-L924 HydrophobicContact CB-CD1 3.96Å; M898-L924 HydrophobicContact CB-CD2 4.03Å; M898-L924 HydrophobicContact CB-CG 3.92Å; M898-L924 HydrophobicContact CG-CD2 4.36Å; G920-L924 PolarHBondContact O-N 3.38Å; T921-L924 WeakPolarHBondContact O-CB 3.43Å; T921-L924 PolarHBondContact O-N 2.89Å; T921-L924 VanDerWaalsContact O-N 3.1Å; T922-L924 VanDerWaalsContact C-N 3.35Å; T922-L924 PolarHBondContact O-N 2.91Å; L924-D926 VanDerWaalsContact C-N 3.28Å; L924-D926 PolarHBondContact O-N 3.06Å; L924-Q927 PolarHBondContact O-N 3.34Å; L924-E928 PolarHBondContact O-N 3.34Å; L924-I929 HydrophobicContact CB-CB 4.45Å; L924-I929 HydrophobicContact CD2-CB 4.07Å; L924-I929 HydrophobicContact CD2-CD1 4.11Å; L924-I929 HydrophobicContact CD2-CG2 4.08Å; L924-I929 PolarHBondContact O-N 3.48Å; L924-Y931 HydrophobicContact CB-CD1 3.57Å; L924-Y931 HydrophobicContact CB-CE1 3.93Å; L924-Y931 HydrophobicContact CB-CG 4.34Å; L924-Y931 HydrophobicContact CD1-CD1 3.83Å; L924-Y931 HydrophobicContact CD1-CD2 4.39Å; L924-Y931 HydrophobicContact CD1-CG 3.71Å; L924-Y931 HydrophobicContact CG-CD1 4.36Å
925	E	87.4	Confident	85.9	Confident	108 Å²	108	68.5 Å²	68.5	51%	0.505	35%	0.346	S	S	.	.	H	α-helix	trans	-62.7	-35.9	173.1	-68.6	176	164.6	0	0	111.7	K871 T921 T922 E928 Y931	K871-E925 WeakPolarHBondContact CE-O 3.41Å; K871-E925 PolarHBondContact NZ-O 3.36Å; K871-E925 VanDerWaalsContact NZ-O 3.13Å; T921-E925 WeakPolarHBondContact O-CG 3.47Å; T921-E925 PolarHBondContact O-N 3.45Å; T922-E925 PolarHBondContact O-N 3.48Å; E925-E928 PolarHBondContact O-N 3.19Å; E925-Y931 HydrophobicContact CG-CE1 3.78Å; E925-Y931 WeakPolarHBondContact CG-OH 3.31Å; E925-Y931 PolarHBondContact OE1-OH 3.28Å
926	D	84.9	Confident	86.5	Confident	78 Å²	78	63.6 Å²	63.6	42%	0.417	33%	0.33	S	S	.	.	H	α-helix	trans	-69.9	-33.1	176.5	-82.2	-17.5	0	0	0	114.1	K871 T922 Y923 L924 E928	K871-D926 WeakPolarHBondContact CD-O 3.35Å; K871-D926 WeakPolarHBondContact CE-O 3.43Å; K871-D926 IonicContact NZ-OD1 2.79Å; K871-D926 PolarHBondContact NZ-OD1 2.96Å; K871-D926 VanDerWaalsContact NZ-OD1 3.15Å; T922-D926 PolarHBondContact O-N 3.03Å; Y923-D926 PolarHBondContact O-N 2.94Å; L924-D926 VanDerWaalsContact C-N 3.28Å; L924-D926 PolarHBondContact O-N 3.06Å; D926-E928 VanDerWaalsContact C-N 3.34Å
927	Q	84.9	Confident	86.9	Confident	20 Å²	20	58 Å²	58	9%	0.093	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	7.1	177	-63.2	-57.9	-29.4	0	0	114.1	G865 Y923 L924 I929	G865-Q927 PolarHBondContact O-OE1 3.05Å; Y923-Q927 HydrophobicContact CD1-CG 4.29Å; Y923-Q927 HydrophobicContact CE1-CG 3.75Å; Y923-Q927 HydrophobicContact CE2-CG 4.15Å; Y923-Q927 WeakPolarHBondContact O-CG 3.41Å; Y923-Q927 PolarHBondContact O-N 2.97Å; L924-Q927 PolarHBondContact O-N 3.34Å; Q927-I929 HydrophobicContact CB-CD1 3.76Å; Q927-I929 HydrophobicContact CB-CG1 3.84Å; Q927-I929 PolarHBondContact O-N 3.11Å
928	E	84.7	Confident	87.3	Confident	83 Å²	83	61.9 Å²	61.9	39%	0.388	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	39.8	-173.2	-57.9	-175.4	169	0	0	112.6	K871 R881 R887 L924 E925 D926	K871-E928 HydrophobicContact CG-CG 4.08Å; R881-E928 IonicContact CZ-OE2 2.76Å; R881-E928 IonicContact NH1-OE2 3.84Å; R881-E928 PolarHBondContact NH1-OE2 3.36Å; R881-E928 IonicContact NH2-OE2 3.15Å; R887-E928 PolarHBondContact NH2-O 3.43Å; L924-E928 PolarHBondContact O-N 3.34Å; E925-E928 PolarHBondContact O-N 3.19Å; D926-E928 VanDerWaalsContact C-N 3.34Å
929	I	86.7	Confident	87.6	Confident	9 Å²	9	61.2 Å²	61.2	5%	0.046	31%	0.308	C	S	.	.			trans	-95	114.2	176.4	-60.8	172.3	0	0	0	107.3	L894 A895 L924 Q927 Y931	L894-I929 HydrophobicContact CB-CD1 4.09Å; L894-I929 HydrophobicContact CD1-CD1 3.84Å; A895-I929 HydrophobicContact CB-CG2 3.96Å; L924-I929 HydrophobicContact CB-CB 4.45Å; L924-I929 HydrophobicContact CD2-CB 4.07Å; L924-I929 HydrophobicContact CD2-CD1 4.11Å; L924-I929 HydrophobicContact CD2-CG2 4.08Å; L924-I929 PolarHBondContact O-N 3.48Å; Q927-I929 HydrophobicContact CB-CD1 3.76Å; Q927-I929 HydrophobicContact CB-CG1 3.84Å; Q927-I929 PolarHBondContact O-N 3.11Å; I929-Y931 WeakPolarHBondContact O-CD1 3.43Å
930	P	87	Confident	87.8	Confident	52 Å²	52	57.3 Å²	57.3	34%	0.338	29%	0.287	S	S	.	.			trans	-68.4	138.7	177.2	31.6	-35.9	0	0	0	109.8	D936	P930-D936 VanDerWaalsContact C-CB 3.48Å; P930-D936 HydrophobicContact CB-CB 3.79Å; P930-D936 HydrophobicContact CG-CB 4.14Å; P930-D936 WeakPolarHBondContact O-CB 3.27Å
931	Y	86.6	Confident	88.1	Confident	35 Å²	35	57.9 Å²	57.9	14%	0.137	29%	0.29	C	S	.	.			trans	-146.3	-2.4	-175.4	66.2	-91.4	0	0	0	114.8	K899 T921 L924 E925 I929 D936	K899-Y931 PolarHBondContact NZ-O 3.39Å; T921-Y931 HydrophobicContact CG2-CD2 4.09Å; T921-Y931 HydrophobicContact CG2-CE2 3.56Å; L924-Y931 HydrophobicContact CB-CD1 3.57Å; L924-Y931 HydrophobicContact CB-CE1 3.93Å; L924-Y931 HydrophobicContact CB-CG 4.34Å; L924-Y931 HydrophobicContact CD1-CD1 3.83Å; L924-Y931 HydrophobicContact CD1-CD2 4.39Å; L924-Y931 HydrophobicContact CD1-CG 3.71Å; L924-Y931 HydrophobicContact CG-CD1 4.36Å; E925-Y931 HydrophobicContact CG-CE1 3.78Å; E925-Y931 WeakPolarHBondContact CG-OH 3.31Å; E925-Y931 PolarHBondContact OE1-OH 3.28Å; I929-Y931 WeakPolarHBondContact O-CD1 3.43Å; Y931-D936 PolarHBondContact N-OD2 2.95Å
932	I	82.7	Confident	88.3	Confident	134 Å²	134	59.5 Å²	59.5	69%	0.687	30%	0.3	S	S	*	.	S	Bend	trans	-72.4	-51.8	-168.9	-61.2	172.4	0	0	0	109.1	K899 D936	K899-I932 PolarHBondContact NZ-O 3.06Å; I932-D936 PolarHBondContact N-OD2 3.44Å
933	T	86.6	Confident	88.6	Confident	67 Å²	67	57.7 Å²	57.7	41%	0.411	29%	0.29	S	S	.	.	S	Bend	trans	-93.3	157.3	-177.1	72.7	0	0	0	0	111.5	W935 D936	T933-W935 PolarHBondContact O-N 3.41Å; T933-W935 PolarHBondContact OG1-N 2.89Å; T933-D936 PolarHBondContact N-OD2 3.32Å; T933-D936 WeakPolarHBondContact O-CB 3.39Å; T933-D936 PolarHBondContact O-N 3.35Å; T933-D936 PolarHBondContact OG1-N 3.11Å; T933-D936 PolarHBondContact OG1-OD1 3.36Å; T933-D936 PolarHBondContact OG1-OD2 2.83Å
934	G	83.3	Confident	89	Confident	54 Å²	54	55.7 Å²	55.7	56%	0.557	28%	0.283	S	S	*	.	H	α-helix	trans	-61	-28.6	170	0	0	0	0	0	112.4	D936 L937 W938	G934-D936 VanDerWaalsContact C-N 3.29Å; G934-D936 PolarHBondContact O-N 2.78Å; G934-L937 PolarHBondContact O-N 3.37Å; G934-W938 PolarHBondContact O-N 3.04Å
935	W	89.3	Confident	89.3	Confident	164 Å²	164	59 Å²	59	62%	0.621	30%	0.299	S	S	*	.	H	α-helix	trans	-64.9	-32.6	176.7	-176.2	-109.5	0	0	0	112.6	T933 L937 W938 Y939 V942	T933-W935 PolarHBondContact O-N 3.41Å; T933-W935 PolarHBondContact OG1-N 2.89Å; W935-L937 PolarHBondContact O-N 3.38Å; W935-W938 HydrophobicContact CE3-CB 4.31Å; W935-W938 CarbonylContact O-C 3.59Å; W935-W938 PolarHBondContact O-N 2.96Å; W935-W938 VanDerWaalsContact O-N 3.13Å; W935-Y939 WeakPolarHBondContact O-CB 3.24Å; W935-Y939 PolarHBondContact O-N 3.04Å; W935-V942 HydrophobicContact CH2-CG2 4.33Å
936	D	86.7	Confident	89.7	Confident	28 Å²	28	58.1 Å²	58.1	15%	0.15	30%	0.301	C	S	.	.	H	α-helix	trans	-61.9	-32.7	-179.9	-58.8	-22.9	0	0	0	112.2	P930 Y931 I932 T933 G934 N940	P930-D936 VanDerWaalsContact C-CB 3.48Å; P930-D936 HydrophobicContact CB-CB 3.79Å; P930-D936 HydrophobicContact CG-CB 4.14Å; P930-D936 WeakPolarHBondContact O-CB 3.27Å; Y931-D936 PolarHBondContact N-OD2 2.95Å; I932-D936 PolarHBondContact N-OD2 3.44Å; T933-D936 PolarHBondContact N-OD2 3.32Å; T933-D936 WeakPolarHBondContact O-CB 3.39Å; T933-D936 PolarHBondContact O-N 3.35Å; T933-D936 PolarHBondContact OG1-N 3.11Å; T933-D936 PolarHBondContact OG1-OD1 3.36Å; T933-D936 PolarHBondContact OG1-OD2 2.83Å; G934-D936 VanDerWaalsContact C-N 3.29Å; G934-D936 PolarHBondContact O-N 2.78Å; D936-N940 PolarHBondContact O-ND2 3.28Å; D936-N940 VanDerWaalsContact O-ND2 3.15Å
937	L	88.2	Confident	90.2	Very high	45 Å²	45	55.3 Å²	55.3	24%	0.236	29%	0.285	C	S	.	.	H	α-helix	trans	-70.6	-50.4	173.5	-171.1	68.1	0	0	0	110.9	F820 A895 M896 G934 W935 Y939 N940	F820-L937 HydrophobicContact CD1-CD1 4.01Å; F820-L937 HydrophobicContact CD1-CD2 4.37Å; F820-L937 HydrophobicContact CD1-CG 4.35Å; F820-L937 HydrophobicContact CD2-CD2 3.97Å; F820-L937 HydrophobicContact CD2-CG 4.22Å; F820-L937 HydrophobicContact CE1-CD1 3.34Å; F820-L937 HydrophobicContact CE1-CD2 4.24Å; F820-L937 HydrophobicContact CE1-CG 3.75Å; F820-L937 HydrophobicContact CE2-CD1 4.18Å; F820-L937 HydrophobicContact CE2-CD2 3.83Å; F820-L937 HydrophobicContact CE2-CG 3.59Å; F820-L937 HydrophobicContact CG-CD2 4.25Å; F820-L937 HydrophobicContact CZ-CD1 3.46Å; F820-L937 VanDerWaalsContact CZ-CD1 3.46Å; F820-L937 HydrophobicContact CZ-CD2 4Å; F820-L937 HydrophobicContact CZ-CG 3.34Å; A895-L937 HydrophobicContact CB-CD1 4.22Å; M896-L937 HydrophobicContact CB-CD1 4.16Å; G934-L937 PolarHBondContact O-N 3.37Å; W935-L937 PolarHBondContact O-N 3.38Å; L937-Y939 VanDerWaalsContact C-N 3.29Å; L937-Y939 PolarHBondContact O-N 3.16Å; L937-N940 PolarHBondContact O-N 3.5Å
938	W	92.3	Very high	90.7	Very high	125 Å²	125	55.5 Å²	55.5	47%	0.473	29%	0.287	S	S	.	.	H	α-helix	trans	-68.2	-23.5	-179.2	-71.1	109.4	0	0	0	113.9	L823 G934 W935 N940 V941 V942	L823-W938 HydrophobicContact CD2-CH2 4.49Å; L823-W938 HydrophobicContact CD2-CZ3 4.1Å; G934-W938 PolarHBondContact O-N 3.04Å; W935-W938 HydrophobicContact CE3-CB 4.31Å; W935-W938 CarbonylContact O-C 3.59Å; W935-W938 PolarHBondContact O-N 2.96Å; W935-W938 VanDerWaalsContact O-N 3.13Å; W938-N940 PolarHBondContact O-N 2.84Å; W938-V941 HydrophobicContact CE3-CB 4.05Å; W938-V941 HydrophobicContact CE3-CG1 4.09Å; W938-V941 HydrophobicContact CE3-CG2 3.94Å; W938-V941 HydrophobicContact CZ3-CG1 4.26Å; W938-V941 HydrophobicContact CZ3-CG2 4.26Å; W938-V941 WeakPolarHBondContact O-CB 3.33Å; W938-V941 PolarHBondContact O-N 3.41Å; W938-V941 VanDerWaalsContact O-N 3.09Å; W938-V942 WeakPolarHBondContact O-CG2 3.49Å; W938-V942 PolarHBondContact O-N 2.81Å
939	Y	93	Very high	91.3	Very high	82 Å²	82	55.7 Å²	55.7	32%	0.322	29%	0.29	S	S	.	.	H	α-helix	trans	-54.8	-39.6	174.3	169.1	-101.1	0	0	0	111.6	Y888 W935 L937 V942 G943	Y888-Y939 HydrophobicContact CD1-CE1 4.25Å; Y888-Y939 HydrophobicContact CE1-CD1 4.42Å; Y888-Y939 AromaticContact CE1-CE1 3.65Å; Y888-Y939 HydrophobicContact CE1-CE1 3.65Å; Y888-Y939 AromaticContact CE1-CZ 3.86Å; W935-Y939 WeakPolarHBondContact O-CB 3.24Å; W935-Y939 PolarHBondContact O-N 3.04Å; L937-Y939 VanDerWaalsContact C-N 3.29Å; L937-Y939 PolarHBondContact O-N 3.16Å; Y939-V942 PolarHBondContact O-N 3.3Å; Y939-G943 PolarHBondContact O-N 2.77Å
940	N	93.6	Very high	91.7	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-67.6	-40	177.9	-63.2	-67.5	0	0	0	112.3	I824 Y888 D936 L937 W938 G943 L944	I824-N940 HydrophobicContact CD1-CB 4.44Å; Y888-N940 WeakPolarHBondContact O-CB 3.39Å; Y888-N940 PolarHBondContact O-OD1 3.03Å; D936-N940 PolarHBondContact O-ND2 3.28Å; D936-N940 VanDerWaalsContact O-ND2 3.15Å; L937-N940 PolarHBondContact O-N 3.5Å; W938-N940 PolarHBondContact O-N 2.84Å; N940-G943 PolarHBondContact O-N 3.16Å; N940-L944 WeakPolarHBondContact O-CG 3.39Å; N940-L944 PolarHBondContact O-N 3.44Å
941	V	95.3	Very high	92.1	Very high	12 Å²	12	57.2 Å²	57.2	7%	0.073	30%	0.299	C	S	.	.	H	α-helix	trans	-61.3	-46.6	174.4	172.6	0	0	0	0	110.6	F820 L823 I824 L827 W938 L944 M945	F820-V941 HydrophobicContact CE2-CG2 3.57Å; F820-V941 HydrophobicContact CZ-CG2 3.78Å; L823-V941 HydrophobicContact CD2-CG2 4.35Å; I824-V941 HydrophobicContact CD1-CG2 3.64Å; I824-V941 HydrophobicContact CG1-CG2 4.48Å; L827-V941 HydrophobicContact CD1-CB 4.44Å; L827-V941 HydrophobicContact CD1-CG1 3.65Å; W938-V941 HydrophobicContact CE3-CB 4.05Å; W938-V941 HydrophobicContact CE3-CG1 4.09Å; W938-V941 HydrophobicContact CE3-CG2 3.94Å; W938-V941 HydrophobicContact CZ3-CG1 4.26Å; W938-V941 HydrophobicContact CZ3-CG2 4.26Å; W938-V941 WeakPolarHBondContact O-CB 3.33Å; W938-V941 PolarHBondContact O-N 3.41Å; W938-V941 VanDerWaalsContact O-N 3.09Å; V941-L944 PolarHBondContact O-N 3.18Å; V941-M945 WeakPolarHBondContact O-CB 3.31Å; V941-M945 WeakPolarHBondContact O-CG 3.33Å; V941-M945 PolarHBondContact O-N 3.45Å
942	V	95.6	Very high	92.5	Very high	64 Å²	64	56.6 Å²	56.6	39%	0.388	30%	0.296	S	S	.	.	H	α-helix	trans	-64	-42.4	177.8	175.4	0	0	0	0	110.8	W935 W938 Y939 L944 M945 V946	W935-V942 HydrophobicContact CH2-CG2 4.33Å; W938-V942 WeakPolarHBondContact O-CG2 3.49Å; W938-V942 PolarHBondContact O-N 2.81Å; Y939-V942 PolarHBondContact O-N 3.3Å; V942-L944 PolarHBondContact O-N 2.85Å; V942-M945 PolarHBondContact O-N 3.2Å; V942-V946 HydrophobicContact CG1-CG2 4.19Å; V942-V946 VanDerWaalsContact O-CG2 3.28Å; V942-V946 WeakPolarHBondContact O-CG2 3.27Å; V942-V946 PolarHBondContact O-N 3.39Å
943	G	94.4	Very high	93.1	Very high	9 Å²	9	54.9 Å²	54.9	9%	0.093	29%	0.288	C	S	.	.	H	α-helix	trans	-56.7	-48.8	175.7	0	0	0	0	0	112.5	Y939 N940 M945 V946 I947	Y939-G943 PolarHBondContact O-N 2.77Å; N940-G943 PolarHBondContact O-N 3.16Å; G943-M945 PolarHBondContact O-N 3.26Å; G943-V946 PolarHBondContact O-N 2.82Å; G943-I947 WeakPolarHBondContact O-CG1 3.3Å; G943-I947 PolarHBondContact O-N 2.97Å; G943-I947 VanDerWaalsContact O-N 3.08Å
944	L	96.1	Very high	93.6	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.1	-43.3	176	-69.5	173	0	0	0	112.3	I824 L827 I885 N940 V941 V942 I947 M948	I824-L944 HydrophobicContact CD1-CD1 3.98Å; I824-L944 HydrophobicContact CG2-CD1 4.39Å; L827-L944 HydrophobicContact CB-CB 4.15Å; L827-L944 HydrophobicContact CB-CD1 4.1Å; I885-L944 HydrophobicContact CB-CD2 4.5Å; I885-L944 HydrophobicContact CG2-CD2 3.75Å; N940-L944 WeakPolarHBondContact O-CG 3.39Å; N940-L944 PolarHBondContact O-N 3.44Å; V941-L944 PolarHBondContact O-N 3.18Å; V942-L944 PolarHBondContact O-N 2.85Å; L944-I947 PolarHBondContact O-N 3.38Å; L944-M948 VanDerWaalsContact O-CB 3.27Å; L944-M948 WeakPolarHBondContact O-CB 3.22Å; L944-M948 PolarHBondContact O-N 3.17Å
945	M	96.1	Very high	94.1	Very high	70 Å²	70	53 Å²	53	35%	0.345	26%	0.262	S	S	.	.	H	α-helix	trans	-62	-42.4	176.8	-77.4	-73	-162.7	0	0	112.4	L827 V941 V942 G943 M948 I949	L827-M945 HydrophobicContact CD1-CE 4.12Å; L827-M945 HydrophobicContact CD1-CG 4.36Å; L827-M945 HydrophobicContact CD2-CE 3.37Å; L827-M945 HydrophobicContact CD2-CG 4.32Å; L827-M945 HydrophobicContact CD2-SD 3.69Å; L827-M945 HydrophobicContact CG-CE 4.39Å; V941-M945 WeakPolarHBondContact O-CB 3.31Å; V941-M945 WeakPolarHBondContact O-CG 3.33Å; V941-M945 PolarHBondContact O-N 3.45Å; V942-M945 PolarHBondContact O-N 3.2Å; G943-M945 PolarHBondContact O-N 3.26Å; M945-M948 PolarHBondContact O-N 2.84Å; M945-M948 HydrophobicContact SD-CE 3.4Å; M945-M948 WeakPolarHBondContact SD-CE 3.29Å; M945-I949 WeakPolarHBondContact O-CB 3.39Å; M945-I949 VanDerWaalsContact O-CG1 3.23Å; M945-I949 WeakPolarHBondContact O-CG1 3.32Å; M945-I949 PolarHBondContact O-N 2.89Å
946	V	96.4	Very high	94.3	Very high	89 Å²	89	48.4 Å²	48.4	54%	0.539	25%	0.245	S	C	.	.	H	α-helix	trans	-64.4	-46.4	179	169.1	0	0	0	0	110.7	V942 G943 M948 I949 A950	V942-V946 HydrophobicContact CG1-CG2 4.19Å; V942-V946 VanDerWaalsContact O-CG2 3.28Å; V942-V946 WeakPolarHBondContact O-CG2 3.27Å; V942-V946 PolarHBondContact O-N 3.39Å; G943-V946 PolarHBondContact O-N 2.82Å; V946-M948 PolarHBondContact O-N 3.45Å; V946-I949 PolarHBondContact O-N 3.1Å; V946-A950 VanDerWaalsContact O-CB 3.23Å; V946-A950 WeakPolarHBondContact O-CB 3.39Å; V946-A950 PolarHBondContact O-N 3.43Å
947	I	95.1	Very high	94.7	Very high	19 Å²	19	50.1 Å²	50.1	10%	0.097	26%	0.256	C	S	.	.	H	α-helix	trans	-59	-49.5	175.8	-68.2	171.9	0	0	0	109.9	A831 I885 Y888 G943 L944 I949 A950 F951	A831-I947 HydrophobicContact CB-CG2 4.4Å; I885-I947 HydrophobicContact CD1-CG2 4.2Å; I885-I947 HydrophobicContact CG1-CD1 4.27Å; I885-I947 HydrophobicContact CG1-CG2 4.03Å; Y888-I947 HydrophobicContact CD2-CD1 3.83Å; Y888-I947 HydrophobicContact CE2-CD1 3.72Å; G943-I947 WeakPolarHBondContact O-CG1 3.3Å; G943-I947 PolarHBondContact O-N 2.97Å; G943-I947 VanDerWaalsContact O-N 3.08Å; L944-I947 PolarHBondContact O-N 3.38Å; I947-I949 PolarHBondContact O-N 3.23Å; I947-A950 PolarHBondContact O-N 2.89Å; I947-F951 HydrophobicContact CG2-CD2 3.76Å; I947-F951 HydrophobicContact CG2-CE2 3.93Å; I947-F951 WeakPolarHBondContact O-CD2 3.33Å; I947-F951 PolarHBondContact O-N 2.68Å
948	M	95.4	Very high	94.9	Very high	24 Å²	24	53.6 Å²	53.6	12%	0.118	27%	0.266	C	S	.	.	H	α-helix	trans	-56.1	-52.4	178.7	-179.4	-168.9	69.5	0	0	111.9	L830 A831 A834 L944 M945 V946 A950 F951 Y952	L830-M948 HydrophobicContact CB-CG 4.4Å; L830-M948 HydrophobicContact CB-SD 3.65Å; L830-M948 HydrophobicContact CD1-SD 4.36Å; A831-M948 HydrophobicContact CB-CB 4.08Å; A834-M948 HydrophobicContact CB-CG 4.42Å; L944-M948 VanDerWaalsContact O-CB 3.27Å; L944-M948 WeakPolarHBondContact O-CB 3.22Å; L944-M948 PolarHBondContact O-N 3.17Å; M945-M948 PolarHBondContact O-N 2.84Å; M945-M948 HydrophobicContact SD-CE 3.4Å; M945-M948 WeakPolarHBondContact SD-CE 3.29Å; V946-M948 PolarHBondContact O-N 3.45Å; M948-A950 PolarHBondContact O-N 3.4Å; M948-F951 PolarHBondContact O-N 3.13Å; M948-Y952 HydrophobicContact CG-CD2 3.63Å; M948-Y952 HydrophobicContact CG-CE2 3.36Å; M948-Y952 WeakPolarHBondContact O-CB 3.38Å; M948-Y952 VanDerWaalsContact O-CD2 3.24Å; M948-Y952 WeakPolarHBondContact O-CD2 3.32Å; M948-Y952 PolarHBondContact O-N 3.41Å; M948-Y952 HydrophobicContact SD-CE2 3.98Å
949	I	96	Very high	94.8	Very high	88 Å²	88	47.7 Å²	47.7	45%	0.451	24%	0.244	S	C	.	.	H	α-helix	trans	-63.6	-42.9	-178.9	-68.6	166.7	0	0	0	110.8	M945 V946 I947 Y952 I953	M945-I949 WeakPolarHBondContact O-CB 3.39Å; M945-I949 VanDerWaalsContact O-CG1 3.23Å; M945-I949 WeakPolarHBondContact O-CG1 3.32Å; M945-I949 PolarHBondContact O-N 2.89Å; V946-I949 PolarHBondContact O-N 3.1Å; I947-I949 PolarHBondContact O-N 3.23Å; I949-Y952 PolarHBondContact O-N 3.49Å; I949-I953 HydrophobicContact CG2-CD1 3.7Å; I949-I953 HydrophobicContact CG2-CG1 4.33Å; I949-I953 VanDerWaalsContact O-CG1 3.28Å; I949-I953 WeakPolarHBondContact O-CG1 3.38Å; I949-I953 PolarHBondContact O-N 3Å
950	A	96.2	Very high	94.7	Very high	44 Å²	44	52.1 Å²	52.1	36%	0.364	26%	0.26	S	S	.	.	H	α-helix	trans	-60.1	-49.7	179.5	0	0	0	0	0	111.7	V946 I947 M948 Y952 I953 L954	V946-A950 VanDerWaalsContact O-CB 3.23Å; V946-A950 WeakPolarHBondContact O-CB 3.39Å; V946-A950 PolarHBondContact O-N 3.43Å; I947-A950 PolarHBondContact O-N 2.89Å; M948-A950 PolarHBondContact O-N 3.4Å; A950-Y952 PolarHBondContact O-N 3.47Å; A950-I953 PolarHBondContact O-N 3.09Å; A950-L954 WeakPolarHBondContact O-CG 3.5Å; A950-L954 PolarHBondContact O-N 3.21Å
951	F	95.7	Very high	94.4	Very high	48 Å²	48	58 Å²	58	21%	0.211	29%	0.291	C	S	.	.	H	α-helix	trans	-68.3	-33.1	178.7	-81.2	-73.9	0	0	0	112.9	A834 I835 F838 I947 M948 L954 C955	A834-F951 HydrophobicContact CB-CB 3.81Å; I835-F951 HydrophobicContact CD1-CD2 4.19Å; I835-F951 HydrophobicContact CD1-CE2 3.9Å; I835-F951 HydrophobicContact CD1-CZ 4.24Å; I835-F951 HydrophobicContact CG1-CB 4.42Å; I835-F951 HydrophobicContact CG1-CD1 4.01Å; I835-F951 HydrophobicContact CG1-CD2 3.55Å; I835-F951 HydrophobicContact CG1-CE1 4.13Å; I835-F951 HydrophobicContact CG1-CE2 3.69Å; I835-F951 HydrophobicContact CG1-CG 3.73Å; I835-F951 HydrophobicContact CG1-CZ 3.98Å; F838-F951 HydrophobicContact CB-CD1 4.09Å; F838-F951 AromaticContact CD1-CD1 3.86Å; F838-F951 HydrophobicContact CD1-CD1 3.86Å; F838-F951 AromaticContact CD1-CE1 3.98Å; F838-F951 HydrophobicContact CD1-CE1 3.98Å; F838-F951 HydrophobicContact CE1-CE1 4.42Å; F838-F951 HydrophobicContact CG-CD1 4.07Å; I947-F951 HydrophobicContact CG2-CD2 3.76Å; I947-F951 HydrophobicContact CG2-CE2 3.93Å; I947-F951 WeakPolarHBondContact O-CD2 3.33Å; I947-F951 PolarHBondContact O-N 2.68Å; M948-F951 PolarHBondContact O-N 3.13Å; F951-L954 HydrophobicContact CD1-CD1 4.24Å; F951-L954 HydrophobicContact CE1-CD1 4.48Å; F951-L954 PolarHBondContact O-N 3.43Å; F951-C955 VanDerWaalsContact O-CB 3.3Å; F951-C955 WeakPolarHBondContact O-CB 3.15Å; F951-C955 PolarHBondContact O-N 3.38Å
952	Y	94.7	Very high	93.9	Very high	22 Å²	22	58.8 Å²	58.8	9%	0.086	30%	0.295	C	S	.	.	H	α-helix	trans	-65	-42	171.8	-83.3	-39.2	0	0	0	113	F782 V786 L830 A834 L837 M948 I949 A950 C955 Y956	F782-Y952 HydrophobicContact CE2-CD1 4.16Å; F782-Y952 AromaticContact CZ-CD1 3.73Å; F782-Y952 HydrophobicContact CZ-CD1 3.73Å; F782-Y952 HydrophobicContact CZ-CG 4.04Å; F782-Y952 WeakPolarHBondContact CZ-O 3.16Å; V786-Y952 HydrophobicContact CG1-CE2 4.46Å; V786-Y952 HydrophobicContact CG2-CD1 4.2Å; V786-Y952 HydrophobicContact CG2-CE1 3.83Å; L830-Y952 PolarHBondContact O-OH 3Å; A834-Y952 HydrophobicContact CB-CD1 3.8Å; A834-Y952 HydrophobicContact CB-CD2 4.01Å; A834-Y952 HydrophobicContact CB-CE1 3.68Å; A834-Y952 HydrophobicContact CB-CE2 3.92Å; A834-Y952 HydrophobicContact CB-CG 3.94Å; L837-Y952 HydrophobicContact CD1-CD1 4.34Å; L837-Y952 HydrophobicContact CD1-CE1 3.71Å; M948-Y952 HydrophobicContact CG-CD2 3.63Å; M948-Y952 HydrophobicContact CG-CE2 3.36Å; M948-Y952 WeakPolarHBondContact O-CB 3.38Å; M948-Y952 VanDerWaalsContact O-CD2 3.24Å; M948-Y952 WeakPolarHBondContact O-CD2 3.32Å; M948-Y952 PolarHBondContact O-N 3.41Å; M948-Y952 HydrophobicContact SD-CE2 3.98Å; I949-Y952 PolarHBondContact O-N 3.49Å; A950-Y952 PolarHBondContact O-N 3.47Å; Y952-C955 PolarHBondContact O-N 2.86Å; Y952-Y956 WeakPolarHBondContact O-CB 3.41Å; Y952-Y956 PolarHBondContact O-N 3.26Å
953	I	95.8	Very high	92.8	Very high	99 Å²	99	59.9 Å²	59.9	51%	0.508	30%	0.298	S	S	.	.	H	α-helix	trans	-62.3	-45.9	174	-69	167.2	0	0	0	110.2	I949 A950 C955 Y956 V957	I949-I953 HydrophobicContact CG2-CD1 3.7Å; I949-I953 HydrophobicContact CG2-CG1 4.33Å; I949-I953 VanDerWaalsContact O-CG1 3.28Å; I949-I953 WeakPolarHBondContact O-CG1 3.38Å; I949-I953 PolarHBondContact O-N 3Å; A950-I953 PolarHBondContact O-N 3.09Å; I953-C955 VanDerWaalsContact C-N 3.33Å; I953-C955 PolarHBondContact O-N 2.82Å; I953-Y956 PolarHBondContact O-N 3.05Å; I953-V957 HydrophobicContact CG2-CG2 4.34Å; I953-V957 VanDerWaalsContact O-CG2 3.3Å; I953-V957 WeakPolarHBondContact O-CG2 3.17Å; I953-V957 PolarHBondContact O-N 3.47Å
954	L	95.7	Very high	91.6	Very high	80 Å²	80	63 Å²	63	42%	0.419	31%	0.309	S	S	.	.	H	α-helix	trans	-60.6	-42.2	177.1	-71.2	174.3	0	0	0	111.9	F838 A950 F951 V957 R958	F838-L954 HydrophobicContact CD2-CB 3.6Å; F838-L954 HydrophobicContact CE2-CB 3.67Å; F838-L954 HydrophobicContact CG-CB 4.35Å; F838-L954 HydrophobicContact CZ-CB 4.49Å; A950-L954 WeakPolarHBondContact O-CG 3.5Å; A950-L954 PolarHBondContact O-N 3.21Å; F951-L954 HydrophobicContact CD1-CD1 4.24Å; F951-L954 HydrophobicContact CE1-CD1 4.48Å; F951-L954 PolarHBondContact O-N 3.43Å; L954-V957 PolarHBondContact O-N 3.46Å; L954-R958 WeakPolarHBondContact O-CB 3.43Å; L954-R958 WeakPolarHBondContact O-CG 3.48Å; L954-R958 PolarHBondContact O-N 3.36Å
955	C	93.6	Very high	90.3	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-60.6	-48.7	174.7	-179.4	0	0	0	0	111.3	F782 F838 F951 Y952 I953 V957 R958 L959	F782-C955 HydrophobicContact CE2-CB 4.16Å; F838-C955 HydrophobicContact CB-CB 4.22Å; F951-C955 VanDerWaalsContact O-CB 3.3Å; F951-C955 WeakPolarHBondContact O-CB 3.15Å; F951-C955 PolarHBondContact O-N 3.38Å; Y952-C955 PolarHBondContact O-N 2.86Å; I953-C955 VanDerWaalsContact C-N 3.33Å; I953-C955 PolarHBondContact O-N 2.82Å; C955-V957 PolarHBondContact O-N 2.92Å; C955-R958 PolarHBondContact O-N 3.16Å; C955-L959 WeakPolarHBondContact O-CG 3.48Å; C955-L959 PolarHBondContact O-N 3.01Å
956	Y	94.3	Very high	88.5	Confident	68 Å²	68	68.7 Å²	68.7	27%	0.267	33%	0.33	S	S	.	.	H	α-helix	trans	-59.6	-44.6	177	173.9	-109.7	0	0	0	112.4	V778 F782 Y952 I953 R958 L959 R960	V778-Y956 HydrophobicContact CG1-CD2 4.47Å; V778-Y956 HydrophobicContact CG1-CE2 4.22Å; F782-Y956 HydrophobicContact CB-CD2 4.2Å; F782-Y956 HydrophobicContact CD1-CD2 4.33Å; F782-Y956 HydrophobicContact CG-CD2 4.17Å; Y952-Y956 WeakPolarHBondContact O-CB 3.41Å; Y952-Y956 PolarHBondContact O-N 3.26Å; I953-Y956 PolarHBondContact O-N 3.05Å; Y956-R958 PolarHBondContact O-N 3.24Å; Y956-L959 PolarHBondContact O-N 3.39Å; Y956-R960 WeakPolarHBondContact O-CB 3.48Å; Y956-R960 PolarHBondContact O-N 3.12Å
957	V	94.5	Very high	88.1	Confident	64 Å²	64	67.7 Å²	67.7	39%	0.388	32%	0.32	S	S	.	.	H	α-helix	trans	-60.9	-44.7	176	170.9	0	0	0	0	110.6	I953 L954 C955 L959 R960 L961	I953-V957 HydrophobicContact CG2-CG2 4.34Å; I953-V957 VanDerWaalsContact O-CG2 3.3Å; I953-V957 WeakPolarHBondContact O-CG2 3.17Å; I953-V957 PolarHBondContact O-N 3.47Å; L954-V957 PolarHBondContact O-N 3.46Å; C955-V957 PolarHBondContact O-N 2.92Å; V957-L959 PolarHBondContact O-N 3.19Å; V957-R960 PolarHBondContact O-N 2.54Å; V957-L961 HydrophobicContact CG1-CD1 3.73Å; V957-L961 HydrophobicContact CG1-CG 4.26Å; V957-L961 WeakPolarHBondContact O-CB 3.33Å; V957-L961 VanDerWaalsContact O-CG 3.29Å; V957-L961 WeakPolarHBondContact O-CG 3.45Å; V957-L961 PolarHBondContact O-N 2.87Å
958	R	93	Very high	87.7	Confident	118 Å²	118	70.2 Å²	70.2	45%	0.445	33%	0.331	S	S	.	.	H	α-helix	trans	-62.4	-41.5	176.6	-74.7	-66.7	-179	-176.2	-1.1	112.7	F838 A841 L954 C955 Y956 R960 L961 L962	F838-R958 HydrophobicContact CD2-CG 4.18Å; F838-R958 HydrophobicContact CE2-CG 3.72Å; A841-R958 HydrophobicContact CB-CB 4.25Å; L954-R958 WeakPolarHBondContact O-CB 3.43Å; L954-R958 WeakPolarHBondContact O-CG 3.48Å; L954-R958 PolarHBondContact O-N 3.36Å; C955-R958 PolarHBondContact O-N 3.16Å; Y956-R958 PolarHBondContact O-N 3.24Å; R958-R960 VanDerWaalsContact C-N 3.32Å; R958-R960 PolarHBondContact O-N 2.85Å; R958-L961 PolarHBondContact O-N 2.84Å; R958-L962 PolarHBondContact O-N 3.41Å
959	L	90.6	Very high	87.3	Confident	1 Å²	1	72.8 Å²	72.8	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-64.7	-36	175.1	-74.5	173.4	0	0	0	112.7	F760 F767 V778 F782 A841 C955 Y956 V957 L962	F760-L959 HydrophobicContact CE1-CD2 4.42Å; F760-L959 HydrophobicContact CZ-CD1 4.13Å; F760-L959 HydrophobicContact CZ-CD2 3.93Å; F760-L959 HydrophobicContact CZ-CG 4.46Å; F767-L959 HydrophobicContact CD1-CD2 4.38Å; F767-L959 HydrophobicContact CE1-CD2 3.91Å; V778-L959 HydrophobicContact CG1-CB 3.81Å; F782-L959 HydrophobicContact CD2-CD1 4.07Å; A841-L959 HydrophobicContact CB-CD2 4.32Å; A841-L959 HydrophobicContact CB-CG 4.3Å; C955-L959 WeakPolarHBondContact O-CG 3.48Å; C955-L959 PolarHBondContact O-N 3.01Å; Y956-L959 PolarHBondContact O-N 3.39Å; V957-L959 PolarHBondContact O-N 3.19Å; L959-L962 WeakPolarHBondContact O-CB 3.44Å; L959-L962 PolarHBondContact O-N 3.45Å
960	R	89.9	Confident	86.8	Confident	175 Å²	175	71.9 Å²	71.9	66%	0.66	34%	0.337	S	S	*	.	H	α-helix	trans	-71.9	-37.5	176.8	-169.8	-179.8	-178.7	-170.3	1.8	112.5	Y956 V957 R958 L962	Y956-R960 WeakPolarHBondContact O-CB 3.48Å; Y956-R960 PolarHBondContact O-N 3.12Å; V957-R960 PolarHBondContact O-N 2.54Å; R958-R960 VanDerWaalsContact C-N 3.32Å; R958-R960 PolarHBondContact O-N 2.85Å; R960-L962 PolarHBondContact O-N 3.27Å
961	L	88.6	Confident	86.2	Confident	125 Å²	125	73.6 Å²	73.6	65%	0.654	34%	0.335	S	S	*	.	H	α-helix	trans	-78.5	-7.9	177.1	-67.8	176.7	0	0	0	113.2	V957 R958 N963	V957-L961 HydrophobicContact CG1-CD1 3.73Å; V957-L961 HydrophobicContact CG1-CG 4.26Å; V957-L961 WeakPolarHBondContact O-CB 3.33Å; V957-L961 VanDerWaalsContact O-CG 3.29Å; V957-L961 WeakPolarHBondContact O-CG 3.45Å; V957-L961 PolarHBondContact O-N 2.87Å; R958-L961 PolarHBondContact O-N 2.84Å; L961-N963 PolarHBondContact O-N 2.8Å
962	L	84.1	Confident	85.6	Confident	28 Å²	28	75.3 Å²	75.3	15%	0.147	34%	0.343	C	S	.	.	S	Bend	trans	-58.2	125.7	179.6	-153.9	95.3	0	0	0	110.1	I768 R958 L959 R960 K964	I768-L962 HydrophobicContact CD1-CD2 3.5Å; I768-L962 VanDerWaalsContact CD1-CD2 3.5Å; I768-L962 HydrophobicContact CG1-CD2 3.5Å; I768-L962 VanDerWaalsContact CG1-CD2 3.5Å; R958-L962 PolarHBondContact O-N 3.41Å; L959-L962 WeakPolarHBondContact O-CB 3.44Å; L959-L962 PolarHBondContact O-N 3.45Å; R960-L962 PolarHBondContact O-N 3.27Å; L962-K964 PolarHBondContact O-N 3.41Å; L962-K964 VanDerWaalsContact O-N 3.11Å
963	N	72.1	Confident	84.9	Confident	87 Å²	87	79.1 Å²	79.1	47%	0.465	36%	0.362	S	S	.	.			trans	-66.4	116.7	178.2	-167.4	4	0	0	0	109.5	L961 Y965	L961-N963 PolarHBondContact O-N 2.8Å; N963-Y965 VanDerWaalsContact C-N 3.33Å; N963-Y965 WeakPolarHBondContact OD1-CB 3.36Å; N963-Y965 WeakPolarHBondContact OD1-CD2 3.21Å; N963-Y965 PolarHBondContact OD1-N 3.46Å; N963-Y965 VanDerWaalsContact OD1-N 3.13Å
964	K	70.7	Confident	84.1	Confident	75 Å²	75	77.6 Å²	77.6	33%	0.326	35%	0.35	S	S	.	.			trans	-88	-3.1	179	-56.4	-173.2	-174.9	-172.7	0	112.9	S771 L962	S771-K964 PolarHBondContact OG-NZ 3.07Å; L962-K964 PolarHBondContact O-N 3.41Å; L962-K964 VanDerWaalsContact O-N 3.11Å
965	Y	67.4	Low	83.1	Confident	91 Å²	91	77.4 Å²	77.4	36%	0.357	35%	0.345	S	S	.	.			trans	-81.8	142.9	175.2	-62.6	-74.7	0	0	0	110.7	R401 K402 D403 N963	R401-Y965 WeakPolarHBondContact O-CD1 3.43Å; K402-Y965 VanDerWaalsContact C-CD1 3.46Å; K402-Y965 VanDerWaalsContact O-CD1 3.3Å; K402-Y965 WeakPolarHBondContact O-CD1 3.04Å; K402-Y965 VanDerWaalsContact O-CE1 3.3Å; K402-Y965 WeakPolarHBondContact O-CE1 3.49Å; D403-Y965 HydrophobicContact CB-CD2 4.49Å; D403-Y965 HydrophobicContact CB-CG 4.41Å; N963-Y965 VanDerWaalsContact C-N 3.33Å; N963-Y965 WeakPolarHBondContact OD1-CB 3.36Å; N963-Y965 WeakPolarHBondContact OD1-CD2 3.21Å; N963-Y965 PolarHBondContact OD1-N 3.46Å; N963-Y965 VanDerWaalsContact OD1-N 3.13Å
966	K	58.5	Low	82.1	Confident	97 Å²	97	84.5 Å²	84.5	42%	0.422	38%	0.376	S	S	.	.			trans	-90.4	0	-172.9	-177.8	179.4	170.5	-155.5	0	113.9	K150 D396 R401 K402 Y428 D515	K150-K966 PolarHBondContact NZ-OXT 3.3Å; D396-K966 IonicContact OD1-NZ 2.71Å; D396-K966 PolarHBondContact OD1-NZ 3.27Å; D396-K966 WeakPolarHBondContact OD2-CD 3.03Å; D396-K966 IonicContact OD2-NZ 3.95Å; R401-K966 PolarHBondContact O-N 2.04Å; K402-K966 WeakPolarHBondContact CD-O 3.06Å; K402-K966 PolarHBondContact NZ-O 3.14Å; Y428-K966 PolarHBondContact OH-NZ 3.17Å; Y428-K966 VanDerWaalsContact OH-NZ 3.1Å; D515-K966 IonicContact OD2-NZ 3.77Å; D515-K966 PolarHBondContact OD2-NZ 3.25Å

Retrieved 966 of 966 residues in 165.9 ms (Link to these results)

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