A0A5K4FFB8_SCHMA Loading...

IQ and ubiquitin-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FFB8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 882 aa.

						>A0A5K4FFB8_SCHMA|A0A5K4FFB8
MDGTKSENEQDKVEHSEHYSNGDAEEIGKNSAVDKLNTDQKDFEANVNTKHYDVSDTIIHDNILHECVDNGKQEDIISHTSEPANFSNGSALRTNMSGKKSDTASLPPNFYSDPKDSVTVHINTECGVSLEIFLVPEKFVIMDLKIILVKDTGISHENLTLYYNGEVVNPDTPLITLANENRLLSFTVSLGNAADSFKIKLGLREIFLTSGLVVKIIGRKIAVNKDPYSQENIMLVPKKDGANIDTENIHIHWLPYDYHKPFLGGYKNTITNCIYHNASAQTKPIRRKRLGASQTSRDTQTYRMHHFGSMTVNQMSTQFSKPGFFVSNSQDRVQTPGPYETADEYLARVLTKIIIIQKYLRRWLAKRRVARLKKIRDDYIAWEKSQSEKHKNEMDRRVAHDFERRLHPKTVADFDRLYNALELWRKEEVSKIEEKNITKAEKKAALALLLDEEAELISAINRHQIKRSKEVAENIQSLCLKKASAPHRWISSIDGRITEVATAETIRAKELLDIHESLGLENLTHNERLDILLTLKQTVSSYNTKISKEIIGLVDREAELIMRGISGKILSGLRQRIRNRFVQFAKLPQVNPEVGKYLTVPTSVKETTVPLLVDNIQYCISCQRYLKKNLFPLSSRANKLFPCKSCRRSDNRGRERLDLEPYQYILTELRQNETRLVEKIKRVAIENAREEELQRLERGESPKPETDAIIDGTHEETVCVNPLPFLINKEDIRFLIDQIWESRSVLSGWTNLFDLTLARWDINEPWSPWNTIVVTREEAEIHENLSKLKVEETYADPLISLVNQRLILGKNKFIKLYRNGLRMTKELLVNNKSKENRENTSEIYQNLPHLLTHAQTHPVQSYKSTCKSPKVDISTQNKALPT
					

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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	30	Very low	31.7	Very low	219 Å²	219	156.1 Å²	156.1	100%	1.079	83%	0.832	S	S	*	*				0	37.5	0	-49	-42.4	-177.1	0	0	111.5
2	D	34.8	Very low	31.5	Very low	161 Å²	161	160.7 Å²	160.7	86%	0.861	84%	0.839	S	S	*	*				56.9	123.6	120.8	-41.5	-1.5	0	0	0	117.9
3	G	32.6	Very low	31.1	Very low	78 Å²	78	157.5 Å²	157.5	80%	0.804	83%	0.83	S	S	*	*			cis	-155.5	167.6	9	0	0	0	0	0	115
4	T	33.3	Very low	31	Very low	139 Å²	139	160.6 Å²	160.6	85%	0.853	84%	0.838	S	S	*	*			trans	-109.8	146	-165.5	48.4	0	0	0	0	113.7
5	K	36.2	Very low	30.7	Very low	196 Å²	196	161.2 Å²	161.2	85%	0.852	83%	0.834	S	S	*	*			trans	-163.1	103.7	150.8	-104.4	166	-174.2	-176.8	0	107
6	S	33.8	Very low	30.7	Very low	79 Å²	79	158.3 Å²	158.3	55%	0.552	83%	0.832	S	S	*	*				85.3	102.5	87.3	66.5	0	0	0	0	111.3
7	E	31.9	Very low	30.5	Very low	169 Å²	169	158.6 Å²	158.6	79%	0.79	83%	0.828	S	S	*	*				83	135	107.3	-73.2	165.5	-127.1	0	0	112.8
8	N	30	Very low	30.5	Very low	140 Å²	140	158.1 Å²	158.1	75%	0.749	82%	0.821	S	S	*	*			cis	-143.6	-179.8	-12	-83.7	-38.7	0	0	0	105.8
9	E	29.8	Very low	30.3	Very low	189 Å²	189	160.6 Å²	160.6	88%	0.883	82%	0.82	S	S	*	*			cis	-141.6	177.7	24.9	-63.7	174.5	119.2	0	0	111.3
10	Q	29.2	Very low	30.3	Very low	194 Å²	194	157.2 Å²	157.2	91%	0.907	81%	0.811	S	S	*	*			trans	-119.1	154.6	178.9	-66.9	-173.9	-72.1	0	0	112.6
11	D	26.7	Very low	30.1	Very low	153 Å²	153	157.7 Å²	157.7	82%	0.818	82%	0.815	S	S	*	*			trans	-58.3	150.1	176.7	-56.1	-85.6	0	0	0	114.2
12	K	29.5	Very low	30.1	Very low	211 Å²	211	151 Å²	151	92%	0.917	80%	0.802	S	S	*	*			trans	-133.2	122.8	148	-82.6	-166.7	172.8	-174.1	0	110.7
13	V	26.8	Very low	29.6	Very low	119 Å²	119	151.4 Å²	151.4	72%	0.721	80%	0.804	S	S	*	*			trans	-128.2	127.1	167.9	175	0	0	0	0	107.1
14	E	29.5	Very low	29.5	Very low	201 Å²	201	152.4 Å²	152.4	94%	0.939	81%	0.805	S	S	*	*			trans	-149.9	151.1	162	-129.9	163.2	-147.8	0	0	109.8
15	H	27.2	Very low	29.3	Very low	170 Å²	170	154.7 Å²	154.7	79%	0.787	81%	0.806	S	S	*	*			trans	-111.6	140.3	-163.3	-87.7	-76.2	0	0	0	113.4
16	S	30.1	Very low	28.8	Very low	115 Å²	115	153.4 Å²	153.4	80%	0.804	80%	0.803	S	S	*	*			trans	-179.3	165.4	140	46.5	0	0	0	0	110.1
17	E	27.7	Very low	28.7	Very low	164 Å²	164	157.2 Å²	157.2	77%	0.766	82%	0.815	S	S	*	*				-167.6	169.8	-62.3	-115.2	-173.4	162.3	0	0	107.6
18	H	30.1	Very low	28.5	Very low	149 Å²	149	152.3 Å²	152.3	69%	0.69	81%	0.81	S	S	*	*			trans	70.6	86.9	163.9	-72.6	-69.7	0	0	0	123.1
19	Y	27.5	Very low	28.3	Very low	206 Å²	206	154.7 Å²	154.7	81%	0.808	81%	0.814	S	S	*	*				61.7	128.2	108.3	-86.4	-80.8	0	0	0	124.3
20	S	29.8	Very low	28.2	Very low	92 Å²	92	152.7 Å²	152.7	64%	0.643	81%	0.809	S	S	*	*			trans	106.4	105.5	133.1	-64.7	0	0	0	0	122.3
21	N	26.5	Very low	28	Very low	168 Å²	168	148.9 Å²	148.9	90%	0.898	80%	0.804	S	S	*	*			trans	50.6	134.2	131.7	-59.1	11.1	0	0	0	123.4
22	G	28.3	Very low	28	Very low	77 Å²	77	146.4 Å²	146.4	79%	0.794	81%	0.805	S	S	*	*			trans	171.1	116.2	157.3	0	0	0	0	0	112.6
23	D	25.6	Very low	27.9	Very low	170 Å²	170	142.5 Å²	142.5	91%	0.909	80%	0.798	S	S	*	*			trans	-92.9	141.7	-178.1	-53.8	-83.3	0	0	0	112.9
24	A	30.2	Very low	28	Very low	99 Å²	99	144.4 Å²	144.4	82%	0.818	81%	0.805	S	S	*	*			trans	-167.1	139.5	152	0	0	0	0	0	114.5
25	E	28.9	Very low	27.8	Very low	188 Å²	188	142.9 Å²	142.9	88%	0.879	80%	0.795	S	S	*	*			trans	-22.6	158	148.1	-73.2	161.1	-174.5	0	0	118.4
26	E	26.5	Very low	27.9	Very low	169 Å²	169	143 Å²	143	79%	0.79	80%	0.8	S	S	*	*			cis	-169.5	-175.2	-14.8	-159.7	-165.4	-151.6	0	0	108.1
27	I	30.1	Very low	27.7	Very low	158 Å²	158	144.1 Å²	144.1	81%	0.81	80%	0.797	S	S	*	*			trans	78.8	129.9	163.4	-53.1	168.1	0	0	0	118
28	G	28.1	Very low	27.8	Very low	66 Å²	66	142.7 Å²	142.7	68%	0.68	80%	0.8	S	S	*	*			trans	125.6	58.3	132.2	0	0	0	0	0	122
29	K	26.9	Very low	27.5	Very low	190 Å²	190	141.6 Å²	141.6	83%	0.826	80%	0.799	S	S	*	*			trans	16.5	113	147	-63.8	177.3	179.5	174.7	0	119
30	N	27.4	Very low	27.5	Very low	147 Å²	147	141.1 Å²	141.1	79%	0.786	80%	0.804	S	S	*	*				172.2	139.1	101.9	-89.3	-28.6	0	0	0	115
31	S	23.8	Very low	27.5	Very low	114 Å²	114	144.3 Å²	144.3	80%	0.797	81%	0.807	S	S	*	*			trans	19.3	108.8	153.3	61.5	0	0	0	0	120.7
32	A	28.2	Very low	27.3	Very low	102 Å²	102	142.8 Å²	142.8	84%	0.843	80%	0.798	S	S	*	*			trans	-144.2	145.6	134.7	0	0	0	0	0	110.8
33	V	27.1	Very low	27.1	Very low	128 Å²	128	148.9 Å²	148.9	78%	0.776	80%	0.804	S	S	*	*			trans	-54	132.3	-178.4	173.9	0	0	0	0	113
34	D	28.8	Very low	27	Very low	159 Å²	159	150.1 Å²	150.1	85%	0.85	80%	0.804	S	S	*	*				-143.1	146.3	129.5	-138.8	-25.9	0	0	0	111.5
35	K	26.1	Very low	26.9	Very low	170 Å²	170	148.9 Å²	148.9	74%	0.739	79%	0.794	S	S	*	*			trans	-124.2	94.7	-173.7	-78.5	-173.1	177.9	-178.8	0	111.3	N37	K35-N37 PolarHBondContact O-N 2.93Å
36	L	29.4	Very low	26.6	Very low	172 Å²	172	146.5 Å²	146.5	90%	0.901	79%	0.787	S	S	*	*			trans	-84.3	105	163.1	-80.8	167.4	0	0	0	110.1	T38	L36-T38 PolarHBondContact O-N 2.83Å
37	N	25.2	Very low	26.5	Very low	139 Å²	139	143.8 Å²	143.8	74%	0.743	78%	0.782	S	S	*	*			trans	-73.7	120.1	168.9	-72.5	-17.9	0	0	0	110	K35	K35-N37 PolarHBondContact O-N 2.93Å
38	T	29.1	Very low	26.3	Very low	133 Å²	133	142 Å²	142	82%	0.816	77%	0.774	S	S	*	*			trans	-134.2	108.8	154.3	42.9	0	0	0	0	108.5	L36 Q40	L36-T38 PolarHBondContact O-N 2.83Å; T38-Q40 PolarHBondContact O-N 3.03Å; T38-Q40 VanDerWaalsContact O-N 3.17Å
39	D	25.2	Very low	26.1	Very low	127 Å²	127	143.6 Å²	143.6	68%	0.679	77%	0.77	S	S	*	*			trans	-67.1	108.5	-179.9	-76.1	-91.6	0	0	0	111.9
40	Q	27	Very low	26.1	Very low	195 Å²	195	142.1 Å²	142.1	91%	0.911	76%	0.764	S	S	*	*			trans	-127.8	95	153.3	-81	-169	-39.1	0	0	108.8	T38	T38-Q40 PolarHBondContact O-N 3.03Å; T38-Q40 VanDerWaalsContact O-N 3.17Å
41	K	28.3	Very low	25.9	Very low	159 Å²	159	143.6 Å²	143.6	69%	0.691	77%	0.766	S	S	*	*			trans	-84.5	119.5	177.8	-72.2	177.5	-178.6	168.7	0	111.2
42	D	24.2	Very low	26	Very low	136 Å²	136	144 Å²	144	73%	0.727	75%	0.751	S	S	*	*				42.9	94.7	126.1	-45.3	-33.4	0	0	0	117.1
43	F	23.9	Very low	25.8	Very low	206 Å²	206	146.3 Å²	146.3	90%	0.904	75%	0.749	S	S	*	*			trans	-139	43.4	152	-114.9	-75.9	0	0	0	112.1	A45	F43-A45 VanDerWaalsContact C-N 3.27Å; F43-A45 PolarHBondContact O-N 2.61Å
44	E	23.1	Very low	25.7	Very low	195 Å²	195	146.3 Å²	146.3	91%	0.911	75%	0.749	S	S	*	*			trans	-68.7	83.9	169.1	-69.6	-157.3	147.2	0	0	111	N46	E44-N46 PolarHBondContact O-N 3.19Å
45	A	27.3	Very low	25.6	Very low	74 Å²	74	142.9 Å²	142.9	61%	0.612	74%	0.737	S	S	*	*			trans	-65	114.3	171.3	0	0	0	0	0	109.9	F43 V47	F43-A45 VanDerWaalsContact C-N 3.27Å; F43-A45 PolarHBondContact O-N 2.61Å; A45-V47 HydrophobicContact CB-CG2 4.11Å; A45-V47 PolarHBondContact O-N 2.79Å
46	N	24	Very low	25.5	Very low	138 Å²	138	141.9 Å²	141.9	74%	0.738	74%	0.74	S	S	*	*			trans	-72.8	72.2	-178.5	-170	-22	0	0	0	111.8	E44 N48	E44-N46 PolarHBondContact O-N 3.19Å; N46-N48 VanDerWaalsContact C-N 3.27Å; N46-N48 PolarHBondContact O-N 3.15Å; N46-N48 PolarHBondContact OD1-ND2 3.33Å
47	V	24.4	Very low	25.3	Very low	112 Å²	112	138.6 Å²	138.6	68%	0.679	73%	0.727	S	S	*	*			trans	-80.4	73.3	-175.8	-179.7	0	0	0	0	110.5	A45 T49	A45-V47 HydrophobicContact CB-CG2 4.11Å; A45-V47 PolarHBondContact O-N 2.79Å; V47-T49 VanDerWaalsContact CG1-OG1 3.22Å; V47-T49 WeakPolarHBondContact CG1-OG1 3.27Å; V47-T49 PolarHBondContact O-N 2.88Å
48	N	24	Very low	25.2	Very low	121 Å²	121	139.6 Å²	139.6	65%	0.647	73%	0.731	S	S	*	*			trans	-75.5	65.2	173.6	-113.4	-81.5	0	0	0	111.4	N46 K50	N46-N48 VanDerWaalsContact C-N 3.27Å; N46-N48 PolarHBondContact O-N 3.15Å; N46-N48 PolarHBondContact OD1-ND2 3.33Å; N48-K50 VanDerWaalsContact C-N 3.35Å; N48-K50 PolarHBondContact O-N 3.2Å
49	T	25	Very low	25	Very low	98 Å²	98	139 Å²	139	60%	0.601	72%	0.722	S	S	*	*			trans	-68.5	86.9	-179.7	-57.5	0	0	0	0	111.4	V47 H51	V47-T49 VanDerWaalsContact CG1-OG1 3.22Å; V47-T49 WeakPolarHBondContact CG1-OG1 3.27Å; V47-T49 PolarHBondContact O-N 2.88Å; T49-H51 PolarHBondContact O-N 3.19Å
50	K	27	Very low	24.9	Very low	160 Å²	160	141.6 Å²	141.6	70%	0.696	73%	0.729	S	S	*	*			trans	-67.4	100	169.6	-70.5	176.6	-179.5	173.2	0	109	N48 Y52	N48-K50 VanDerWaalsContact C-N 3.35Å; N48-K50 PolarHBondContact O-N 3.2Å; K50-Y52 HydrophobicContact CB-CD2 4.43Å; K50-Y52 HydrophobicContact CB-CE2 4.27Å; K50-Y52 WeakPolarHBondContact O-CD2 3.21Å; K50-Y52 PolarHBondContact O-N 3.49Å
51	H	23.8	Very low	24.8	Very low	177 Å²	177	138.6 Å²	138.6	82%	0.819	72%	0.719	S	S	*	*			trans	-53.9	106.3	172.4	-80.2	-89.2	0	0	0	110.8	T49	T49-H51 PolarHBondContact O-N 3.19Å
52	Y	25	Very low	24.6	Very low	122 Å²	122	138.7 Å²	138.7	48%	0.478	73%	0.728	S	S	.	*			trans	-106.8	135.4	159.7	-79.9	-84.9	0	0	0	107.4	K50 V54 L478	K50-Y52 HydrophobicContact CB-CD2 4.43Å; K50-Y52 HydrophobicContact CB-CE2 4.27Å; K50-Y52 WeakPolarHBondContact O-CD2 3.21Å; K50-Y52 PolarHBondContact O-N 3.49Å; Y52-V54 PolarHBondContact O-N 2.96Å; Y52-L478 HydrophobicContact CD1-CD2 4.48Å; Y52-L478 HydrophobicContact CE1-CD2 4.31Å
53	D	24.1	Very low	24.7	Very low	151 Å²	151	139 Å²	139	81%	0.807	73%	0.728	S	S	*	*			trans	-63.6	92.5	174.1	-72.5	-46.2	0	0	0	110.3	S55	D53-S55 PolarHBondContact O-N 3.25Å
54	V	25	Very low	24.7	Very low	128 Å²	128	137.2 Å²	137.2	78%	0.776	73%	0.727	S	S	*	*			trans	-81.1	103.5	166.5	179.6	0	0	0	0	107.3	Y52	Y52-V54 PolarHBondContact O-N 2.96Å
55	S	27.3	Very low	24.9	Very low	87 Å²	87	134.6 Å²	134.6	61%	0.608	71%	0.714	S	S	*	*			trans	-60.6	136	-179.2	54.6	0	0	0	0	112.6	D53 T57	D53-S55 PolarHBondContact O-N 3.25Å; S55-T57 PolarHBondContact O-N 3.32Å; S55-T57 PolarHBondContact O-OG1 2.92Å
56	D	23.6	Very low	24.7	Very low	149 Å²	149	139.8 Å²	139.8	80%	0.797	73%	0.726	S	S	*	*			trans	-20.4	96.4	175.9	-48.9	-55	0	0	0	114.3
57	T	24.9	Very low	24.8	Very low	103 Å²	103	137.1 Å²	137.1	63%	0.632	72%	0.717	S	S	*	*			trans	-129.3	105.3	171.7	-49	0	0	0	0	107	S55 I59	S55-T57 PolarHBondContact O-N 3.32Å; S55-T57 PolarHBondContact O-OG1 2.92Å; T57-I59 HydrophobicContact CG2-CG1 4.48Å; T57-I59 PolarHBondContact O-N 2.95Å; T57-I59 VanDerWaalsContact O-N 3.14Å
58	I	23.4	Very low	24.8	Very low	161 Å²	161	137.6 Å²	137.6	83%	0.826	72%	0.72	S	S	*	*			trans	-73.3	107	-179.3	-59.9	171.8	0	0	0	107.9
59	I	24.8	Very low	24.9	Very low	121 Å²	121	138.8 Å²	138.8	62%	0.621	73%	0.726	S	S	*	*			trans	-105.3	118.5	167.6	-59.3	178.1	0	0	0	106.5	T57 D61	T57-I59 HydrophobicContact CG2-CG1 4.48Å; T57-I59 PolarHBondContact O-N 2.95Å; T57-I59 VanDerWaalsContact O-N 3.14Å; I59-D61 HydrophobicContact CG2-CB 4.49Å; I59-D61 VanDerWaalsContact CG2-OD2 3.28Å; I59-D61 WeakPolarHBondContact CG2-OD2 3.48Å; I59-D61 PolarHBondContact O-N 2.97Å
60	H	22	Very low	24.9	Very low	180 Å²	180	141.3 Å²	141.3	83%	0.833	74%	0.736	S	S	*	*			trans	-75.4	104.4	162.6	-88.3	-86.7	0	0	0	107.6
61	D	25.3	Very low	24.9	Very low	132 Å²	132	136.8 Å²	136.8	71%	0.706	74%	0.735	S	S	*	*			trans	-115.5	134.9	165.9	-91	-45.1	0	0	0	109.6	I59 I63	I59-D61 HydrophobicContact CG2-CB 4.49Å; I59-D61 VanDerWaalsContact CG2-OD2 3.28Å; I59-D61 WeakPolarHBondContact CG2-OD2 3.48Å; I59-D61 PolarHBondContact O-N 2.97Å; D61-I63 PolarHBondContact O-N 2.83Å
62	N	24.2	Very low	25.1	Very low	161 Å²	161	137.5 Å²	137.5	86%	0.861	74%	0.736	S	S	*	*			trans	-78.8	107.4	-177.2	-67.2	-39.4	0	0	0	110	L64	N62-L64 PolarHBondContact O-N 3.38Å; N62-L64 VanDerWaalsContact O-N 3.08Å
63	I	26.9	Very low	25.1	Very low	142 Å²	142	140.7 Å²	140.7	73%	0.728	76%	0.755	S	S	*	*			trans	-77.2	96	170.5	-60.1	177.9	0	0	0	108.5	D61 H65	D61-I63 PolarHBondContact O-N 2.83Å; I63-H65 PolarHBondContact O-N 2.84Å
64	L	23.8	Very low	25.3	Very low	170 Å²	170	141.8 Å²	141.8	89%	0.89	76%	0.755	S	S	*	*			trans	-69.9	105.3	164.5	-122.5	162.5	0	0	0	107.6	N62 E66	N62-L64 PolarHBondContact O-N 3.38Å; N62-L64 VanDerWaalsContact O-N 3.08Å; L64-E66 PolarHBondContact O-N 3.12Å
65	H	27.5	Very low	25.4	Very low	139 Å²	139	142.5 Å²	142.5	64%	0.644	76%	0.755	S	S	*	*			trans	-82.4	112	-173.2	-126.1	-77.7	0	0	0	110.8	I63 C67	I63-H65 PolarHBondContact O-N 2.84Å; H65-C67 VanDerWaalsContact C-N 3.32Å; H65-C67 PolarHBondContact O-N 3.06Å
66	E	23.7	Very low	25.5	Very low	184 Å²	184	146.3 Å²	146.3	86%	0.86	77%	0.767	S	S	*	*			trans	-72.9	89.1	161.6	-75.4	-171.2	127.8	0	0	109.2	L64 V68	L64-E66 PolarHBondContact O-N 3.12Å; E66-V68 PolarHBondContact O-N 3.09Å
67	C	25.3	Very low	25.8	Very low	82 Å²	82	145.3 Å²	145.3	55%	0.554	76%	0.76	S	S	*	*			trans	-78.7	97.9	167.7	-71.5	0	0	0	0	109.6	H65 D69	H65-C67 VanDerWaalsContact C-N 3.32Å; H65-C67 PolarHBondContact O-N 3.06Å; C67-D69 PolarHBondContact O-N 3.46Å; C67-D69 VanDerWaalsContact O-N 3.14Å
68	V	24.5	Very low	25.8	Very low	121 Å²	121	145.5 Å²	145.5	73%	0.733	77%	0.765	S	S	*	*			trans	-78.2	90.3	165.6	-179.5	0	0	0	0	108.3	E66 N70	E66-V68 PolarHBondContact O-N 3.09Å; V68-N70 PolarHBondContact O-N 2.64Å
69	D	26.7	Very low	26.1	Very low	146 Å²	146	146.4 Å²	146.4	78%	0.781	77%	0.766	S	S	*	*			trans	-68.3	98.7	178.3	-83.1	-36.5	0	0	0	111.5	C67 G71	C67-D69 PolarHBondContact O-N 3.46Å; C67-D69 VanDerWaalsContact O-N 3.14Å; D69-G71 PolarHBondContact O-N 3.34Å
70	N	23.7	Very low	26.1	Very low	151 Å²	151	147 Å²	147	81%	0.807	78%	0.775	S	S	*	*			trans	-75	58.6	162.4	-79.7	-65.9	0	0	0	110.5	V68 K72	V68-N70 PolarHBondContact O-N 2.64Å; N70-K72 PolarHBondContact O-N 3.12Å
71	G	28.3	Very low	26.5	Very low	65 Å²	65	144 Å²	144	67%	0.67	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-66.5	117.3	175.8	0	0	0	0	0	111	D69	D69-G71 PolarHBondContact O-N 3.34Å
72	K	27.7	Very low	26.4	Very low	192 Å²	192	146.6 Å²	146.6	84%	0.835	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-71.3	130.9	174.5	-65.1	170.3	-176.1	167.6	0	109.1	N70 E74	N70-K72 PolarHBondContact O-N 3.12Å; K72-E74 PolarHBondContact O-N 3.17Å
73	Q	25.3	Very low	27.2	Very low	189 Å²	189	144.5 Å²	144.5	88%	0.883	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-68.4	119.1	166.5	-70.7	177.9	-77.3	0	0	109.3
74	E	28.4	Very low	27.2	Very low	174 Å²	174	142.1 Å²	142.1	81%	0.813	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-99.6	117.7	164.6	-63.1	-154.6	147.7	0	0	109.4	K72 I76	K72-E74 PolarHBondContact O-N 3.17Å; E74-I76 PolarHBondContact O-N 3.46Å
75	D	26.1	Very low	27.2	Very low	143 Å²	143	140.9 Å²	140.9	77%	0.765	77%	0.773	S	S	*	*			trans	-70.7	93	179.1	-70.3	-49.8	0	0	0	111	I77	D75-I77 VanDerWaalsContact C-N 3.28Å; D75-I77 HydrophobicContact CB-CG1 4.28Å; D75-I77 PolarHBondContact O-N 3.29Å
76	I	29.9	Very low	27.3	Very low	168 Å²	168	143.8 Å²	143.8	86%	0.862	78%	0.784	S	S	*	*			trans	-74.4	87.2	165.8	-59.1	-176	0	0	0	108.7	E74 S78	E74-I76 PolarHBondContact O-N 3.46Å; I76-S78 PolarHBondContact O-N 2.9Å
77	I	30	Very low	27.5	Very low	128 Å²	128	139 Å²	139	66%	0.656	77%	0.771	S	S	*	*			trans	-71	123.8	174.1	-66.7	172.6	0	0	0	109.3	D75	D75-I77 VanDerWaalsContact C-N 3.28Å; D75-I77 HydrophobicContact CB-CG1 4.28Å; D75-I77 PolarHBondContact O-N 3.29Å
78	S	24.6	Very low	27.5	Very low	106 Å²	106	142.9 Å²	142.9	74%	0.741	79%	0.786	S	S	*	*			trans	-67.4	139.8	171.9	49.4	0	0	0	0	111.8	I76	I76-S78 PolarHBondContact O-N 2.9Å
79	H	29.5	Very low	27.6	Very low	180 Å²	180	140.1 Å²	140.1	83%	0.833	78%	0.783	S	S	*	*			trans	-113.4	130.5	168.6	-91.8	-71.4	0	0	0	110.4
80	T	24.8	Very low	27.6	Very low	133 Å²	133	139.2 Å²	139.2	82%	0.816	79%	0.788	S	S	*	*			trans	-93.1	153.6	-177.7	42.9	0	0	0	0	112.4
81	S	29.6	Very low	27.8	Very low	119 Å²	119	135.5 Å²	135.5	83%	0.832	78%	0.778	S	S	*	*			trans	-151.8	104.7	163.1	58.5	0	0	0	0	111.7
82	E	23.7	Very low	27.8	Very low	186 Å²	186	139.2 Å²	139.2	87%	0.869	78%	0.782	S	S	*	*			trans	-98.7	-162.6	161.1	-57.9	-176	129.4	0	0	109.2
83	P	41.2	Very low	27.7	Very low	117 Å²	117	140.2 Å²	140.2	76%	0.76	78%	0.78	S	S	*	*				-132.3	172.1	-90.1	41.3	-24.5	0	0	0	114.9
84	A	26	Very low	27.7	Very low	91 Å²	91	136.4 Å²	136.4	75%	0.752	77%	0.77	S	S	*	*			trans	-169.7	131.1	156	0	0	0	0	0	109
85	N	25.6	Very low	27.5	Very low	144 Å²	144	134.5 Å²	134.5	77%	0.77	77%	0.765	S	S	*	*			cis	92.8	111.6	44.6	-82.9	-14.9	0	0	0	114.7
86	F	29.6	Very low	27.5	Very low	200 Å²	200	136.2 Å²	136.2	88%	0.877	77%	0.771	S	S	*	*			trans	-174.5	121	133.3	-87.8	-64.3	0	0	0	106.8
87	S	26.3	Very low	27.3	Very low	83 Å²	83	133.9 Å²	133.9	58%	0.58	77%	0.77	S	S	*	*				67.5	137.2	76.1	105	0	0	0	0	113.3
88	N	26.7	Very low	27.2	Very low	164 Å²	164	131.5 Å²	131.5	88%	0.877	78%	0.777	S	S	*	*			cis	-154.2	172.3	1.5	-82.1	-43.5	0	0	0	107.5
89	G	26.9	Very low	27.2	Very low	64 Å²	64	136.1 Å²	136.1	66%	0.66	78%	0.784	S	S	*	*			cis	-159.7	170.3	1.2	0	0	0	0	0	109.6
90	S	26.3	Very low	27.2	Very low	127 Å²	127	137.6 Å²	137.6	89%	0.888	79%	0.788	S	S	*	*				59.8	124.7	90.3	-152.6	0	0	0	0	113.9
91	A	28	Very low	27.5	Very low	73 Å²	73	135.9 Å²	135.9	60%	0.603	78%	0.781	S	S	*	*			cis	-159.4	162.3	20.9	0	0	0	0	0	114.3
92	L	26.8	Very low	27.3	Very low	142 Å²	142	138.1 Å²	138.1	74%	0.743	78%	0.783	S	S	*	*			trans	42.2	131.8	138.5	-58.1	163.7	0	0	0	118.9
93	R	26	Very low	27.6	Very low	213 Å²	213	135.5 Å²	135.5	80%	0.804	78%	0.781	S	S	*	*			cis	-173.5	173.6	15.1	-102.9	176.4	-179.9	158.4	1.5	106.7
94	T	25.5	Very low	27.1	Very low	109 Å²	109	134.5 Å²	134.5	67%	0.669	78%	0.782	S	S	*	*			cis	-158.1	167.5	2.3	-1	0	0	0	0	110
95	N	23.7	Very low	27.2	Very low	134 Å²	134	135.8 Å²	135.8	72%	0.717	79%	0.786	S	S	*	*			trans	37.9	108.1	148.4	-55.5	-4	0	0	0	120.9
96	M	27.2	Very low	27.3	Very low	180 Å²	180	136.6 Å²	136.6	89%	0.887	79%	0.789	S	S	*	*				-176	175.2	98.2	-96.8	-56	179.6	0	0	112.7
97	S	24.5	Very low	27.2	Very low	118 Å²	118	132 Å²	132	83%	0.825	78%	0.779	S	S	*	*			trans	-66.9	143.5	-170.3	56.5	0	0	0	0	116.5
98	G	28.8	Very low	27.4	Very low	78 Å²	78	133.1 Å²	133.1	80%	0.804	79%	0.785	S	S	*	*			trans	-164.5	119.4	163.1	0	0	0	0	0	113.1
99	K	25.5	Very low	27.5	Very low	204 Å²	204	132.8 Å²	132.8	89%	0.887	78%	0.783	S	S	*	*			trans	-94.5	140.3	168.2	-66.9	175.4	178.2	175.4	0	109.4
100	K	29.5	Very low	27.6	Very low	211 Å²	211	138 Å²	138	92%	0.917	79%	0.788	S	S	*	*				-179.9	161.3	112.9	-98.2	170.7	-177.9	-177.3	0	111.8
101	S	30.7	Very low	28.1	Very low	97 Å²	97	141.9 Å²	141.9	68%	0.678	78%	0.784	S	S	*	*			trans	-87.8	154	176.4	51.1	0	0	0	0	111.9
102	D	24.5	Very low	28.8	Very low	165 Å²	165	144.2 Å²	144.2	88%	0.882	80%	0.796	S	S	*	*			trans	-62.3	140.4	172.1	-51	-79.7	0	0	0	112.4
103	T	31.1	Very low	30.1	Very low	132 Å²	132	142.7 Å²	142.7	81%	0.81	79%	0.789	S	S	*	*			trans	-136.4	142.5	168	48.7	0	0	0	0	110.1
104	A	30.1	Very low	31.7	Very low	96 Å²	96	136 Å²	136	79%	0.793	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-52.6	152.7	-166.2	0	0	0	0	0	116.3
105	S	28.6	Very low	33.3	Very low	118 Å²	118	139.3 Å²	139.3	83%	0.825	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-51.9	130.6	173.4	51.9	0	0	0	0	114
106	L	26.5	Very low	35.6	Very low	160 Å²	160	137.8 Å²	137.8	84%	0.838	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-86.8	154.4	161.4	-73.4	165.6	0	0	0	110.7
107	P	28.7	Very low	38	Very low	103 Å²	103	129.9 Å²	129.9	67%	0.669	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-66.5	161.9	170	-15.3	30.6	0	0	0	112.1	N109	P107-N109 PolarHBondContact O-N 2.93Å
108	P	30.2	Very low	40.8	Very low	108 Å²	108	124.3 Å²	124.3	70%	0.701	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-71.8	127.5	-178.1	28.8	-34.3	0	0	0	112.4	F110	P108-F110 HydrophobicContact CG-CE2 4.44Å; P108-F110 PolarHBondContact O-N 2.82Å
109	N	29.5	Very low	43.5	Very low	157 Å²	157	122.1 Å²	122.1	84%	0.84	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-64	117.8	169.8	-76	2.5	0	0	0	110.3	P107	P107-N109 PolarHBondContact O-N 2.93Å
110	F	27.8	Very low	46.4	Very low	174 Å²	174	112.4 Å²	112.4	76%	0.763	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-103.5	145.1	158.3	-84.3	-95.1	0	0	0	109	P108	P108-F110 HydrophobicContact CG-CE2 4.44Å; P108-F110 PolarHBondContact O-N 2.82Å
111	Y	36.9	Very low	49.1	Very low	207 Å²	207	104 Å²	104	81%	0.812	59%	0.586	S	S	*	*	S	Bend	trans	72.3	133.9	-169.1	-52.2	-77.5	0	0	0	114.7
112	S	42.1	Very low	51.8	Low	123 Å²	123	99.4 Å²	99.4	86%	0.86	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-95.5	121.1	172.2	-50.9	0	0	0	0	108.3
113	D	54.1	Low	54.8	Low	109 Å²	109	94.5 Å²	94.5	58%	0.583	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-61.7	141.6	179	-67.4	-58.4	0	0	0	111.9	K115	D113-K115 PolarHBondContact O-N 2.99Å
114	P	59.7	Low	57.3	Low	72 Å²	72	88.9 Å²	88.9	47%	0.468	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-64.9	132.8	175.4	26.4	-30.3	0	0	0	109.4	D116 S117 L134	P114-D116 PolarHBondContact O-N 2.99Å; P114-S117 PolarHBondContact O-N 3.03Å; P114-S117 PolarHBondContact O-OG 3.05Å; P114-L134 VanDerWaalsContact CD-CD2 3.45Å; P114-L134 HydrophobicContact CG-CD2 3.96Å
115	K	60.7	Low	59.6	Low	179 Å²	179	90 Å²	90	78%	0.778	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-10.1	-166	-73.3	-172.8	175.8	-177.1	0	116.2	D113 R182	D113-K115 PolarHBondContact O-N 2.99Å; K115-R182 PolarHBondContact O-NH1 2.96Å; K115-R182 PolarHBondContact O-NH2 3.2Å
116	D	70.2	Confident	61.8	Low	102 Å²	102	85.5 Å²	85.5	55%	0.545	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.2	32.1	-173.6	-55.9	0	0	0	0	111	P114 E137	P114-D116 PolarHBondContact O-N 2.99Å; D116-E137 PolarHBondContact O-N 3.18Å
117	S	78.3	Confident	64.3	Low	15 Å²	15	78.4 Å²	78.4	11%	0.105	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	153.8	-176.2	66.6	0	0	0	0	114.5	P114 V135	P114-S117 PolarHBondContact O-N 3.03Å; P114-S117 PolarHBondContact O-OG 3.05Å; S117-V135 CarbonylContact C-O 3.53Å; S117-V135 VanDerWaalsContact CA-O 3.24Å; S117-V135 WeakPolarHBondContact CA-O 3.41Å; S117-V135 WeakPolarHBondContact CB-O 3.48Å
118	V	83.2	Confident	67	Low	1 Å²	1	73.6 Å²	73.6	1%	0.006	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	145.2	-177.3	-168	0	0	0	0	109	V120 V135 E137 R182 L184	V118-V120 HydrophobicContact CG1-CG2 4.31Å; V118-V135 PolarHBondContact N-O 3.41Å; V118-V135 PolarHBondContact O-N 3.34Å; V118-E137 HydrophobicContact CG2-CB 4.24Å; V118-E137 HydrophobicContact CG2-CG 3.39Å; V118-R182 VanDerWaalsContact CG1-O 3.28Å; V118-R182 WeakPolarHBondContact CG1-O 3.36Å; V118-L184 HydrophobicContact CG1-CD1 3.88Å; V118-L184 HydrophobicContact CG1-CG 3.87Å
119	T	84.9	Confident	69.7	Low	31 Å²	31	68.7 Å²	68.7	19%	0.19	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	127.8	166.9	-61.9	0	0	0	0	109.5	I132 F133 R182 L183 L184	T119-I132 WeakPolarHBondContact CA-O 3.44Å; T119-F133 HydrophobicContact CG2-CD1 3.72Å; T119-F133 HydrophobicContact CG2-CE1 3.59Å; T119-F133 HydrophobicContact CG2-CZ 4.27Å; T119-R182 PolarHBondContact N-O 3.25Å; T119-L183 HydrophobicContact CG2-CD1 3.92Å; T119-L183 WeakPolarHBondContact O-CA 3.41Å; T119-L184 PolarHBondContact O-N 2.96Å
120	V	86.7	Confident	72.5	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	113.1	-174.2	-171.1	0	0	0	0	110	V118 I122 I132 V135 L144 L184 F186	V118-V120 HydrophobicContact CG1-CG2 4.31Å; V120-I122 HydrophobicContact CG1-CD1 3.97Å; V120-I122 HydrophobicContact CG1-CG1 3.81Å; V120-I132 HydrophobicContact CB-CB 4.3Å; V120-I132 PolarHBondContact N-O 3.46Å; V120-I132 PolarHBondContact O-N 3.13Å; V120-V135 HydrophobicContact CG2-CB 4.33Å; V120-V135 HydrophobicContact CG2-CG2 4.09Å; V120-L144 HydrophobicContact CB-CD2 4.44Å; V120-L144 HydrophobicContact CG1-CD1 3.88Å; V120-L144 HydrophobicContact CG1-CD2 4.24Å; V120-L144 HydrophobicContact CG2-CD1 4.5Å; V120-L144 HydrophobicContact CG2-CD2 4.24Å; V120-L184 HydrophobicContact CB-CB 4.5Å; V120-L184 HydrophobicContact CG1-CB 4.13Å; V120-L184 HydrophobicContact CG2-CB 4.28Å; V120-L184 HydrophobicContact CG2-CD1 4.29Å; V120-F186 HydrophobicContact CG1-CD2 3.59Å; V120-F186 HydrophobicContact CG1-CE2 3.7Å
121	H	87.7	Confident	75.3	Confident	36 Å²	36	54.3 Å²	54.3	17%	0.167	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	132.5	170.7	-67.2	-99.6	0	0	0	109.7	L130 E131 L183 L184 S185 F186	H121-L130 CarbonylContact C-O 3.57Å; H121-L130 WeakPolarHBondContact CA-O 3.44Å; H121-E131 IonicContact CE1-OE1 2.75Å; H121-E131 PolarHBondContact CE1-OE1 2.94Å; H121-E131 VanDerWaalsContact CE1-OE1 3.29Å; H121-E131 IonicContact ND1-OE1 2.72Å; H121-L183 WeakPolarHBondContact NE2-CD1 3.47Å; H121-L184 PolarHBondContact N-O 3.16Å; H121-S185 CarbonylContact O-C 3.57Å; H121-S185 WeakPolarHBondContact O-CA 3.2Å; H121-F186 PolarHBondContact O-N 3.4Å
122	I	86.9	Confident	77.8	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	108	-179.4	-52.7	-167.9	0	0	0	109	V120 S129 L130 I132 L148 L161 F186 V188	V120-I122 HydrophobicContact CG1-CD1 3.97Å; V120-I122 HydrophobicContact CG1-CG1 3.81Å; I122-S129 WeakPolarHBondContact O-CA 3.29Å; I122-L130 HydrophobicContact CB-CB 4.37Å; I122-L130 PolarHBondContact N-O 2.9Å; I122-L130 PolarHBondContact O-N 2.95Å; I122-I132 HydrophobicContact CD1-CD1 3.69Å; I122-I132 HydrophobicContact CG1-CD1 4.33Å; I122-L148 HydrophobicContact CD1-CD1 3.82Å; I122-L148 HydrophobicContact CD1-CD2 4.23Å; I122-L148 HydrophobicContact CD1-CG 4.26Å; I122-L148 HydrophobicContact CG2-CD1 4.32Å; I122-L161 HydrophobicContact CD1-CD2 4.36Å; I122-L161 HydrophobicContact CG2-CD2 4.15Å; I122-F186 WeakPolarHBondContact CA-O 3.42Å; I122-F186 HydrophobicContact CG1-CB 4.43Å; I122-V188 HydrophobicContact CG2-CB 4.29Å; I122-V188 HydrophobicContact CG2-CG2 3.34Å
123	N	87	Confident	79.8	Confident	62 Å²	62	41.2 Å²	41.2	33%	0.332	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	133.7	-176.8	-66	-30.1	0	0	0	110.7	S129 F186 T187 V188	N123-S129 WeakPolarHBondContact OD1-CB 3.25Å; N123-S129 PolarHBondContact OD1-OG 3.05Å; N123-F186 PolarHBondContact N-O 3.39Å; N123-T187 HydrophobicContact CB-CG2 4.3Å; N123-T187 CarbonylContact O-C 3.59Å; N123-T187 VanDerWaalsContact O-CA 3.28Å; N123-T187 WeakPolarHBondContact O-CA 3.32Å; N123-V188 PolarHBondContact O-N 3.04Å
124	T	83.7	Confident	81.1	Confident	14 Å²	14	38.4 Å²	38.4	9%	0.086	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	151.5	179.3	74.7	0	0	0	0	111.5	C126 G127 V128 I199	T124-C126 PolarHBondContact O-N 3.31Å; T124-C126 VanDerWaalsContact O-N 3.11Å; T124-G127 PolarHBondContact O-N 2.95Å; T124-V128 PolarHBondContact N-O 3.43Å; T124-V128 PolarHBondContact OG1-N 2.96Å; T124-V128 PolarHBondContact OG1-O 3.49Å; T124-I199 HydrophobicContact CG2-CD1 3.75Å
125	E	78.8	Confident	82.2	Confident	119 Å²	119	35 Å²	35	56%	0.556	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-27.1	175.6	-67.6	166.4	171.6	0	0	112.7	G127 S189 N224	E125-G127 PolarHBondContact O-N 3.33Å; E125-S189 WeakPolarHBondContact OE1-CA 3.43Å; E125-S189 WeakPolarHBondContact OE1-CB 3.02Å; E125-N224 PolarHBondContact O-ND2 2.88Å
126	C	74.9	Confident	83.2	Confident	23 Å²	23	27.8 Å²	27.8	16%	0.155	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	13.2	178.1	-49.9	0	0	0	0	114.4	T124 S196 K220	T124-C126 PolarHBondContact O-N 3.31Å; T124-C126 VanDerWaalsContact O-N 3.11Å; C126-S196 WeakPolarHBondContact SG-CB 3.13Å; C126-K220 PolarHBondContact O-NZ 2.71Å
127	G	78.9	Confident	83.7	Confident	11 Å²	11	24.3 Å²	24.3	11%	0.113	13%	0.129	C	C	.	.	S	Bend	trans	76.9	20.2	173.8	0	0	0	0	0	115.1	T124 E125 I221 A222	T124-G127 PolarHBondContact O-N 2.95Å; E125-G127 PolarHBondContact O-N 3.33Å; G127-I221 PolarHBondContact O-N 2.8Å; G127-A222 PolarHBondContact O-N 3.27Å
128	V	84.7	Confident	83.8	Confident	3 Å²	3	32 Å²	32	2%	0.018	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	138.6	174.3	-178.5	0	0	0	0	109.4	T124 L130 I199 L201 R219 K220	T124-V128 PolarHBondContact N-O 3.43Å; T124-V128 PolarHBondContact OG1-N 2.96Å; T124-V128 PolarHBondContact OG1-O 3.49Å; V128-L130 HydrophobicContact CG1-CD2 4.39Å; V128-I199 HydrophobicContact CG1-CG2 4Å; V128-L201 HydrophobicContact CG1-CD2 3.72Å; V128-L201 HydrophobicContact CG2-CD2 4.29Å; V128-R219 WeakPolarHBondContact CA-O 3.44Å; V128-K220 HydrophobicContact CG2-CD 3.98Å
129	S	87.5	Confident	83.9	Confident	4 Å²	4	33.6 Å²	33.6	3%	0.028	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	132.9	170.9	-169.1	0	0	0	0	109.7	I122 N123 G218 R219 I221	I122-S129 WeakPolarHBondContact O-CA 3.29Å; N123-S129 WeakPolarHBondContact OD1-CB 3.25Å; N123-S129 PolarHBondContact OD1-OG 3.05Å; S129-G218 WeakPolarHBondContact O-CA 3.37Å; S129-R219 PolarHBondContact N-O 2.85Å; S129-R219 PolarHBondContact O-N 2.77Å; S129-I221 VanDerWaalsContact CB-CD1 3.45Å
130	L	87.7	Confident	84	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.01	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	118.5	173.5	-59.8	176.8	0	0	0	108.3	H121 I122 V128 L148 I199 I216	H121-L130 CarbonylContact C-O 3.57Å; H121-L130 WeakPolarHBondContact CA-O 3.44Å; I122-L130 HydrophobicContact CB-CB 4.37Å; I122-L130 PolarHBondContact N-O 2.9Å; I122-L130 PolarHBondContact O-N 2.95Å; V128-L130 HydrophobicContact CG1-CD2 4.39Å; L130-L148 HydrophobicContact CD1-CD2 3.6Å; L130-I199 HydrophobicContact CD1-CG2 4.15Å; L130-I199 HydrophobicContact CD2-CG2 3.97Å; L130-I199 HydrophobicContact CG-CG2 4.29Å; L130-I216 HydrophobicContact CB-CG2 4.2Å; L130-I216 HydrophobicContact CD2-CG2 4.1Å
131	E	87.6	Confident	83.9	Confident	28 Å²	28	33.9 Å²	33.9	13%	0.131	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	112.7	172.7	-49.6	-171	156	0	0	108.5	H121 F133 I216 I217 R219	H121-E131 IonicContact CE1-OE1 2.75Å; H121-E131 PolarHBondContact CE1-OE1 2.94Å; H121-E131 VanDerWaalsContact CE1-OE1 3.29Å; H121-E131 IonicContact ND1-OE1 2.72Å; E131-F133 HydrophobicContact CB-CD2 4.46Å; E131-F133 HydrophobicContact CB-CE2 3.51Å; E131-F133 HydrophobicContact CB-CZ 3.77Å; E131-I216 CarbonylContact O-C 3.59Å; E131-I216 WeakPolarHBondContact O-CA 3.46Å; E131-I217 HydrophobicContact CB-CB 4.38Å; E131-I217 PolarHBondContact N-O 2.86Å; E131-I217 PolarHBondContact O-N 3.33Å; E131-R219 IonicContact OE1-CZ 3.34Å; E131-R219 IonicContact OE1-NH1 3.6Å; E131-R219 PolarHBondContact OE1-NH1 3.15Å; E131-R219 IonicContact OE1-NH2 3.37Å; E131-R219 IonicContact OE2-CZ 2.78Å; E131-R219 IonicContact OE2-NH1 2.76Å; E131-R219 PolarHBondContact OE2-NH1 3.44Å; E131-R219 IonicContact OE2-NH2 3.5Å; E131-R219 PolarHBondContact OE2-NH2 2.78Å
132	I	87.9	Confident	83.8	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	117.9	-176.7	-48.9	-174.1	0	0	0	109	T119 V120 I122 V135 I147 L148 V214 K215 I216	T119-I132 WeakPolarHBondContact CA-O 3.44Å; V120-I132 HydrophobicContact CB-CB 4.3Å; V120-I132 PolarHBondContact N-O 3.46Å; V120-I132 PolarHBondContact O-N 3.13Å; I122-I132 HydrophobicContact CD1-CD1 3.69Å; I122-I132 HydrophobicContact CG1-CD1 4.33Å; I132-V135 HydrophobicContact CB-CG2 4.21Å; I132-V135 HydrophobicContact CG2-CG2 3.41Å; I132-V135 VanDerWaalsContact CG2-CG2 3.41Å; I132-I147 HydrophobicContact CD1-CG2 4.37Å; I132-L148 HydrophobicContact CD1-CD2 4.21Å; I132-V214 HydrophobicContact CG2-CG1 3.32Å; I132-K215 CarbonylContact C-O 3.58Å; I132-K215 WeakPolarHBondContact CA-O 3.42Å; I132-I216 HydrophobicContact CB-CG1 4.5Å; I132-I216 HydrophobicContact CD1-CD1 4.05Å; I132-I216 HydrophobicContact CG1-CD1 4.13Å; I132-I216 HydrophobicContact CG1-CG1 4.06Å; I132-I216 HydrophobicContact CG1-CG2 4.43Å; I132-I216 HydrophobicContact CG2-CG1 4.14Å
133	F	85.2	Confident	83.7	Confident	55 Å²	55	37.7 Å²	37.7	24%	0.241	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	157.5	-178.1	-56.7	-90.7	0	0	0	111.2	T119 E131 V135 K215 I217	T119-F133 HydrophobicContact CG2-CD1 3.72Å; T119-F133 HydrophobicContact CG2-CE1 3.59Å; T119-F133 HydrophobicContact CG2-CZ 4.27Å; E131-F133 HydrophobicContact CB-CD2 4.46Å; E131-F133 HydrophobicContact CB-CE2 3.51Å; E131-F133 HydrophobicContact CB-CZ 3.77Å; F133-V135 VanDerWaalsContact C-N 3.31Å; F133-V135 PolarHBondContact O-N 2.94Å; F133-K215 HydrophobicContact CB-CB 4.5Å; F133-K215 PolarHBondContact N-O 3.09Å; F133-K215 PolarHBondContact O-N 3.21Å; F133-I217 HydrophobicContact CD2-CD1 4.43Å; F133-I217 HydrophobicContact CD2-CG1 4.45Å; F133-I217 HydrophobicContact CE2-CB 4.43Å; F133-I217 HydrophobicContact CE2-CD1 3.72Å; F133-I217 HydrophobicContact CE2-CG1 3.95Å; F133-I217 HydrophobicContact CZ-CD1 4.44Å
134	L	81.1	Confident	83.6	Confident	49 Å²	49	34.7 Å²	34.7	26%	0.257	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	66.7	23.6	179.4	-44.1	177.6	0	0	0	114.5	P114 P136 K215	P114-L134 VanDerWaalsContact CD-CD2 3.45Å; P114-L134 HydrophobicContact CG-CD2 3.96Å; L134-P136 WeakPolarHBondContact O-CD 3.32Å; L134-K215 HydrophobicContact CD1-CD 4.45Å; L134-K215 HydrophobicContact CD1-CG 4.12Å
135	V	82.2	Confident	83.7	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	123	174.9	-171	0	0	0	0	109.5	S117 V118 V120 I132 F133 F139 L144 L174 V214	S117-V135 CarbonylContact C-O 3.53Å; S117-V135 VanDerWaalsContact CA-O 3.24Å; S117-V135 WeakPolarHBondContact CA-O 3.41Å; S117-V135 WeakPolarHBondContact CB-O 3.48Å; V118-V135 PolarHBondContact N-O 3.41Å; V118-V135 PolarHBondContact O-N 3.34Å; V120-V135 HydrophobicContact CG2-CB 4.33Å; V120-V135 HydrophobicContact CG2-CG2 4.09Å; I132-V135 HydrophobicContact CB-CG2 4.21Å; I132-V135 HydrophobicContact CG2-CG2 3.41Å; I132-V135 VanDerWaalsContact CG2-CG2 3.41Å; F133-V135 VanDerWaalsContact C-N 3.31Å; F133-V135 PolarHBondContact O-N 2.94Å; V135-F139 HydrophobicContact CG1-CB 4.42Å; V135-F139 HydrophobicContact CG1-CD2 4Å; V135-F139 HydrophobicContact CG1-CG 4.45Å; V135-L144 HydrophobicContact CG1-CD2 4.22Å; V135-L144 HydrophobicContact CG2-CD2 4.47Å; V135-L174 HydrophobicContact CG1-CD1 3.66Å; V135-V214 HydrophobicContact CG2-CG1 4.25Å
136	P	82.1	Confident	84	Confident	29 Å²	29	33.7 Å²	33.7	19%	0.188	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	139.5	179.5	-22.2	34.7	0	0	0	112.9	L134 K138 F139 L212	L134-P136 WeakPolarHBondContact O-CD 3.32Å; P136-K138 PolarHBondContact O-N 2.96Å; P136-F139 HydrophobicContact CB-CD1 3.89Å; P136-F139 HydrophobicContact CB-CE1 4Å; P136-F139 HydrophobicContact CG-CD1 3.96Å; P136-F139 HydrophobicContact CG-CE1 3.61Å; P136-F139 HydrophobicContact CG-CE2 4.47Å; P136-F139 HydrophobicContact CG-CZ 3.9Å; P136-F139 WeakPolarHBondContact O-CB 3.43Å; P136-F139 PolarHBondContact O-N 3.47Å; P136-F139 VanDerWaalsContact O-N 3.09Å; P136-L212 HydrophobicContact CG-CD1 4.01Å
137	E	80.1	Confident	84.4	Confident	28 Å²	28	32.7 Å²	32.7	13%	0.131	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-25.3	179.4	-79.1	177.1	152.7	0	0	114.4	D116 V118 I175 R182	D116-E137 PolarHBondContact O-N 3.18Å; V118-E137 HydrophobicContact CG2-CB 4.24Å; V118-E137 HydrophobicContact CG2-CG 3.39Å; E137-I175 HydrophobicContact CB-CB 4.33Å; E137-I175 HydrophobicContact CB-CD1 4.39Å; E137-I175 WeakPolarHBondContact O-CB 3.48Å; E137-I175 PolarHBondContact O-N 2.99Å; E137-I175 VanDerWaalsContact O-N 3.17Å; E137-R182 IonicContact OE1-CZ 2.67Å; E137-R182 IonicContact OE1-NE 2.78Å; E137-R182 PolarHBondContact OE1-NE 2.78Å; E137-R182 IonicContact OE1-NH2 2.67Å; E137-R182 PolarHBondContact OE1-NH2 3.26Å; E137-R182 IonicContact OE2-NH2 3.5Å; E137-R182 PolarHBondContact OE2-NH2 2.96Å; E137-R182 VanDerWaalsContact OE2-NH2 3.13Å
138	K	80.2	Confident	84.6	Confident	178 Å²	178	32.3 Å²	32.3	77%	0.774	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-8.1	-176.9	-61.4	178.4	-175.8	171	0	114.4	P136	P136-K138 PolarHBondContact O-N 2.96Å
139	F	85.2	Confident	84.6	Confident	33 Å²	33	34.2 Å²	34.2	15%	0.145	17%	0.169	C	C	.	.			trans	-66.8	154.2	176.9	-82.4	22.8	0	0	0	110.4	V135 P136 D143 I147 P173 L174 L208 L212	V135-F139 HydrophobicContact CG1-CB 4.42Å; V135-F139 HydrophobicContact CG1-CD2 4Å; V135-F139 HydrophobicContact CG1-CG 4.45Å; P136-F139 HydrophobicContact CB-CD1 3.89Å; P136-F139 HydrophobicContact CB-CE1 4Å; P136-F139 HydrophobicContact CG-CD1 3.96Å; P136-F139 HydrophobicContact CG-CE1 3.61Å; P136-F139 HydrophobicContact CG-CE2 4.47Å; P136-F139 HydrophobicContact CG-CZ 3.9Å; P136-F139 WeakPolarHBondContact O-CB 3.43Å; P136-F139 PolarHBondContact O-N 3.47Å; P136-F139 VanDerWaalsContact O-N 3.09Å; F139-D143 WeakPolarHBondContact CA-OD2 3.08Å; F139-D143 HydrophobicContact CB-CB 3.95Å; F139-D143 HydrophobicContact CD2-CB 3.57Å; F139-D143 HydrophobicContact CE2-CB 4.27Å; F139-D143 HydrophobicContact CG-CB 3.91Å; F139-I147 HydrophobicContact CD2-CD1 4.17Å; F139-I147 HydrophobicContact CE2-CD1 4.07Å; F139-P173 CarbonylContact O-C 3.59Å; F139-P173 WeakPolarHBondContact O-CA 3.36Å; F139-L174 HydrophobicContact CB-CD1 4Å; F139-L174 WeakPolarHBondContact O-CG 3.46Å; F139-L174 PolarHBondContact O-N 3.28Å; F139-L208 HydrophobicContact CE2-CD1 3.92Å; F139-L208 HydrophobicContact CZ-CD1 3.93Å; F139-L212 HydrophobicContact CE1-CD1 4.15Å; F139-L212 HydrophobicContact CZ-CD1 3.83Å
140	V	87.5	Confident	84.4	Confident	37 Å²	37	39.4 Å²	39.4	22%	0.224	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-100	168.5	171.1	-65.7	0	0	0	0	111.1	M142 D143 L144 D171 T172 P173	V140-M142 HydrophobicContact CG2-CB 3.78Å; V140-M142 PolarHBondContact O-N 2.95Å; V140-D143 WeakPolarHBondContact CG2-OD2 3.28Å; V140-D143 PolarHBondContact N-OD2 2.74Å; V140-D143 WeakPolarHBondContact O-CB 3.44Å; V140-D143 PolarHBondContact O-N 3.34Å; V140-L144 PolarHBondContact O-N 2.65Å; V140-D171 WeakPolarHBondContact CG1-O 3.41Å; V140-T172 WeakPolarHBondContact CA-O 3.43Å; V140-P173 HydrophobicContact CG1-CB 4.21Å
141	I	84.1	Confident	84.1	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-63.8	-27.8	179.2	-67.8	173.7	0	0	0	111.7	D143 L144 K145 L161 V168 P170 T172 L174 L177 F186	I141-D143 VanDerWaalsContact C-N 3.29Å; I141-D143 PolarHBondContact O-N 2.74Å; I141-L144 PolarHBondContact O-N 2.96Å; I141-K145 PolarHBondContact O-N 3.19Å; I141-L161 HydrophobicContact CG2-CB 4.47Å; I141-L161 HydrophobicContact CG2-CD1 3.8Å; I141-V168 HydrophobicContact CD1-CB 3.51Å; I141-V168 HydrophobicContact CD1-CG1 3.32Å; I141-V168 HydrophobicContact CD1-CG2 4.14Å; I141-P170 PolarHBondContact N-O 2.87Å; I141-P170 VanDerWaalsContact N-O 3.16Å; I141-T172 HydrophobicContact CD1-CG2 4.32Å; I141-T172 PolarHBondContact N-O 3.02Å; I141-L174 HydrophobicContact CG1-CD2 3.9Å; I141-L177 HydrophobicContact CD1-CD1 3.8Å; I141-F186 HydrophobicContact CD1-CE1 4.15Å; I141-F186 HydrophobicContact CD1-CZ 4.38Å; I141-F186 HydrophobicContact CG1-CZ 4.4Å
142	M	85.6	Confident	83.6	Confident	64 Å²	64	39.7 Å²	39.7	32%	0.315	19%	0.194	S	C	.	.	H	α-helix	trans	-55.9	-41	167.5	-163.8	71.7	-172.5	0	0	112.1	V140 K145 I146 H156 P170	V140-M142 HydrophobicContact CG2-CB 3.78Å; V140-M142 PolarHBondContact O-N 2.95Å; M142-K145 PolarHBondContact O-N 3.33Å; M142-I146 HydrophobicContact CG-CD1 4.23Å; M142-I146 VanDerWaalsContact O-CG1 3.3Å; M142-I146 WeakPolarHBondContact O-CG1 3.36Å; M142-I146 PolarHBondContact O-N 2.99Å; M142-H156 VanDerWaalsContact CE-CE1 3.41Å; M142-H156 WeakPolarHBondContact CE-CE1 3.47Å; M142-H156 VanDerWaalsContact CE-NE2 3.34Å; M142-H156 WeakPolarHBondContact CE-NE2 3.24Å; M142-H156 VanDerWaalsContact SD-CE1 3.51Å; M142-H156 PolarHBondContact SD-NE2 2.95Å; M142-P170 HydrophobicContact CB-CB 4.12Å; M142-P170 PolarHBondContact N-O 2.98Å; M142-P170 HydrophobicContact SD-CB 3.91Å
143	D	86.4	Confident	83.2	Confident	51 Å²	51	42.2 Å²	42.2	27%	0.273	22%	0.22	S	C	.	.	H	α-helix	trans	-68.3	-37.5	178.3	-59.3	-46.8	0	0	0	111.7	F139 V140 I141 K145 I146 I147	F139-D143 WeakPolarHBondContact CA-OD2 3.08Å; F139-D143 HydrophobicContact CB-CB 3.95Å; F139-D143 HydrophobicContact CD2-CB 3.57Å; F139-D143 HydrophobicContact CE2-CB 4.27Å; F139-D143 HydrophobicContact CG-CB 3.91Å; V140-D143 WeakPolarHBondContact CG2-OD2 3.28Å; V140-D143 PolarHBondContact N-OD2 2.74Å; V140-D143 WeakPolarHBondContact O-CB 3.44Å; V140-D143 PolarHBondContact O-N 3.34Å; I141-D143 VanDerWaalsContact C-N 3.29Å; I141-D143 PolarHBondContact O-N 2.74Å; D143-K145 VanDerWaalsContact C-N 3.35Å; D143-I146 PolarHBondContact O-N 3.37Å; D143-I147 VanDerWaalsContact O-CG1 3.31Å; D143-I147 WeakPolarHBondContact O-CG1 3.46Å; D143-I147 PolarHBondContact O-N 3.28Å
144	L	84.9	Confident	83	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61.7	-42.3	171.4	-81.4	-177.6	0	0	0	111.8	V120 V135 V140 I141 I146 I147 L148 L161 L174 F186	V120-L144 HydrophobicContact CB-CD2 4.44Å; V120-L144 HydrophobicContact CG1-CD1 3.88Å; V120-L144 HydrophobicContact CG1-CD2 4.24Å; V120-L144 HydrophobicContact CG2-CD1 4.5Å; V120-L144 HydrophobicContact CG2-CD2 4.24Å; V135-L144 HydrophobicContact CG1-CD2 4.22Å; V135-L144 HydrophobicContact CG2-CD2 4.47Å; V140-L144 PolarHBondContact O-N 2.65Å; I141-L144 PolarHBondContact O-N 2.96Å; L144-I146 VanDerWaalsContact C-N 3.34Å; L144-I147 HydrophobicContact CD2-CD1 4.47Å; L144-I147 PolarHBondContact O-N 3.42Å; L144-L148 WeakPolarHBondContact O-CG 3.14Å; L144-L148 PolarHBondContact O-N 3.28Å; L144-L161 HydrophobicContact CB-CD1 4.21Å; L144-L174 HydrophobicContact CD1-CD1 4.12Å; L144-L174 HydrophobicContact CD1-CD2 3.53Å; L144-L174 HydrophobicContact CD1-CG 4.48Å; L144-L174 HydrophobicContact CD2-CD1 4.46Å; L144-L174 HydrophobicContact CG-CD1 4.06Å; L144-L174 HydrophobicContact CG-CD2 4.14Å; L144-F186 HydrophobicContact CD1-CD2 4.2Å; L144-F186 HydrophobicContact CD1-CE2 3.59Å; L144-F186 HydrophobicContact CD1-CZ 4.05Å
145	K	85.3	Confident	83	Confident	32 Å²	32	39.9 Å²	39.9	14%	0.139	22%	0.215	C	C	.	.	H	α-helix	trans	-62.4	-42	173.5	-67.9	-166	172.8	-161.7	0	111.2	I141 M142 D143 I147 L148 V149 H156 L159 L161	I141-K145 PolarHBondContact O-N 3.19Å; M142-K145 PolarHBondContact O-N 3.33Å; D143-K145 VanDerWaalsContact C-N 3.35Å; K145-I147 PolarHBondContact O-N 2.82Å; K145-L148 PolarHBondContact O-N 3.32Å; K145-V149 VanDerWaalsContact O-CB 3.32Å; K145-V149 WeakPolarHBondContact O-CB 3.49Å; K145-V149 WeakPolarHBondContact O-CG2 3.35Å; K145-V149 PolarHBondContact O-N 2.95Å; K145-H156 VanDerWaalsContact CB-CD2 3.49Å; K145-H156 WeakPolarHBondContact CB-CD2 3.41Å; K145-H156 WeakPolarHBondContact CB-NE2 3.47Å; K145-H156 WeakPolarHBondContact CD-NE2 3.28Å; K145-L159 VanDerWaalsContact CE-O 3.24Å; K145-L159 WeakPolarHBondContact CE-O 3.48Å; K145-L159 HydrophobicContact CG-CD2 4.22Å; K145-L159 PolarHBondContact NZ-O 3.15Å; K145-L161 HydrophobicContact CG-CD1 3.59Å; K145-L161 HydrophobicContact CG-CG 4.33Å
146	I	84	Confident	82.8	Confident	80 Å²	80	42.7 Å²	42.7	41%	0.41	23%	0.228	S	C	.	.	H	α-helix	trans	-62.1	-40.7	176.2	-69.3	163.4	0	0	0	111.6	M142 D143 L144 K150	M142-I146 HydrophobicContact CG-CD1 4.23Å; M142-I146 VanDerWaalsContact O-CG1 3.3Å; M142-I146 WeakPolarHBondContact O-CG1 3.36Å; M142-I146 PolarHBondContact O-N 2.99Å; D143-I146 PolarHBondContact O-N 3.37Å; L144-I146 VanDerWaalsContact C-N 3.34Å; I146-K150 VanDerWaalsContact O-CB 3.31Å; I146-K150 WeakPolarHBondContact O-CB 3.48Å; I146-K150 PolarHBondContact O-N 2.8Å
147	I	84.4	Confident	82.5	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-61	-48.3	174	-71.1	162.7	0	0	0	110.8	I132 F139 D143 L144 K145 K150 D151 I206 V214 I216	I132-I147 HydrophobicContact CD1-CG2 4.37Å; F139-I147 HydrophobicContact CD2-CD1 4.17Å; F139-I147 HydrophobicContact CE2-CD1 4.07Å; D143-I147 VanDerWaalsContact O-CG1 3.31Å; D143-I147 WeakPolarHBondContact O-CG1 3.46Å; D143-I147 PolarHBondContact O-N 3.28Å; L144-I147 HydrophobicContact CD2-CD1 4.47Å; L144-I147 PolarHBondContact O-N 3.42Å; K145-I147 PolarHBondContact O-N 2.82Å; I147-K150 PolarHBondContact O-N 3.2Å; I147-D151 PolarHBondContact O-N 3.03Å; I147-I206 HydrophobicContact CG2-CD1 4.23Å; I147-V214 HydrophobicContact CD1-CG2 4.36Å; I147-V214 HydrophobicContact CG2-CG1 4.38Å; I147-I216 HydrophobicContact CG2-CD1 3.97Å
148	L	83.2	Confident	82.4	Confident	4 Å²	4	50.8 Å²	50.8	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-64.3	-43.9	178.8	-73.4	172.8	0	0	0	112.7	I122 L130 I132 L144 K145 K150 D151 T152 L159 L161 V188	I122-L148 HydrophobicContact CD1-CD1 3.82Å; I122-L148 HydrophobicContact CD1-CD2 4.23Å; I122-L148 HydrophobicContact CD1-CG 4.26Å; I122-L148 HydrophobicContact CG2-CD1 4.32Å; L130-L148 HydrophobicContact CD1-CD2 3.6Å; I132-L148 HydrophobicContact CD1-CD2 4.21Å; L144-L148 WeakPolarHBondContact O-CG 3.14Å; L144-L148 PolarHBondContact O-N 3.28Å; K145-L148 PolarHBondContact O-N 3.32Å; L148-K150 PolarHBondContact O-N 2.93Å; L148-D151 PolarHBondContact O-N 2.91Å; L148-T152 WeakPolarHBondContact O-CB 3.24Å; L148-T152 WeakPolarHBondContact O-CG2 3.35Å; L148-T152 PolarHBondContact O-N 2.92Å; L148-T152 PolarHBondContact O-OG1 2.73Å; L148-L159 HydrophobicContact CB-CD1 3.79Å; L148-L159 HydrophobicContact CD1-CD1 4.07Å; L148-L159 HydrophobicContact CD1-CD2 3.92Å; L148-L161 HydrophobicContact CD1-CD2 4.2Å; L148-V188 HydrophobicContact CD1-CG2 4.22Å
149	V	84.5	Confident	82.4	Confident	42 Å²	42	42.4 Å²	42.4	26%	0.255	23%	0.228	S	C	.	.	H	α-helix	trans	-56.8	-39.2	173.2	164.7	0	0	0	0	110.4	K145 G153 I154 H156	K145-V149 VanDerWaalsContact O-CB 3.32Å; K145-V149 WeakPolarHBondContact O-CB 3.49Å; K145-V149 WeakPolarHBondContact O-CG2 3.35Å; K145-V149 PolarHBondContact O-N 2.95Å; V149-G153 WeakPolarHBondContact O-CA 3.36Å; V149-G153 PolarHBondContact O-N 3.41Å; V149-I154 WeakPolarHBondContact CG1-O 3.12Å; V149-I154 WeakPolarHBondContact CG2-O 3.43Å; V149-H156 HydrophobicContact CG2-CB 4.1Å
150	K	82.8	Confident	82.3	Confident	114 Å²	114	42.7 Å²	42.7	50%	0.496	23%	0.233	S	C	.	.	H	α-helix	trans	-74.8	-30.9	179.2	-166.2	170.3	-174.5	179.9	0	114.1	I146 I147 L148 I206 F207	I146-K150 VanDerWaalsContact O-CB 3.31Å; I146-K150 WeakPolarHBondContact O-CB 3.48Å; I146-K150 PolarHBondContact O-N 2.8Å; I147-K150 PolarHBondContact O-N 3.2Å; L148-K150 PolarHBondContact O-N 2.93Å; K150-I206 HydrophobicContact CD-CG2 3.85Å; K150-I206 HydrophobicContact CG-CG2 4.21Å; K150-F207 PolarHBondContact NZ-O 3.44Å
151	D	81.6	Confident	82.2	Confident	20 Å²	20	41 Å²	41	11%	0.107	22%	0.223	C	C	.	.	H	α-helix	trans	-73.9	-37.8	173.9	-163.2	51.8	0	0	0	112.6	I147 L148 R204 I206 I216	I147-D151 PolarHBondContact O-N 3.03Å; L148-D151 PolarHBondContact O-N 2.91Å; D151-R204 VanDerWaalsContact CG-NE 3.31Å; D151-R204 VanDerWaalsContact OD1-CD 3.28Å; D151-R204 WeakPolarHBondContact OD1-CD 3.44Å; D151-R204 IonicContact OD1-CZ 3.51Å; D151-R204 IonicContact OD1-NE 3.41Å; D151-R204 PolarHBondContact OD1-NE 3.03Å; D151-R204 IonicContact OD1-NH2 2.85Å; D151-R204 IonicContact OD2-CZ 3.54Å; D151-R204 IonicContact OD2-NE 3.59Å; D151-R204 PolarHBondContact OD2-NE 3.39Å; D151-R204 VanDerWaalsContact OD2-NE 3.1Å; D151-R204 IonicContact OD2-NH2 3.39Å; D151-R204 PolarHBondContact OD2-NH2 3.44Å; D151-I206 HydrophobicContact CB-CD1 3.66Å; D151-I216 HydrophobicContact CB-CD1 4.12Å
152	T	77.9	Confident	82.2	Confident	15 Å²	15	44.1 Å²	44.1	9%	0.092	24%	0.235	C	C	.	.	H	α-helix	trans	-106.7	-28	-165.5	62.5	0	0	0	0	114.7	L148 I154 K198 I199	L148-T152 WeakPolarHBondContact O-CB 3.24Å; L148-T152 WeakPolarHBondContact O-CG2 3.35Å; L148-T152 PolarHBondContact O-N 2.92Å; L148-T152 PolarHBondContact O-OG1 2.73Å; T152-I154 VanDerWaalsContact C-N 3.26Å; T152-I154 HydrophobicContact CG2-CD1 4.14Å; T152-I154 PolarHBondContact O-N 2.85Å; T152-I154 WeakPolarHBondContact OG1-CB 3.37Å; T152-I154 WeakPolarHBondContact OG1-CD1 3.42Å; T152-I154 WeakPolarHBondContact OG1-CG1 3.37Å; T152-I154 PolarHBondContact OG1-N 2.74Å; T152-K198 WeakPolarHBondContact O-CB 3.44Å; T152-I199 HydrophobicContact CG2-CG1 4.06Å
153	G	78	Confident	82.1	Confident	53 Å²	53	42.5 Å²	42.5	55%	0.546	23%	0.225	S	C	.	.			trans	66.8	27.9	-169	0	0	0	0	0	113.4	V149 K198	V149-G153 WeakPolarHBondContact O-CA 3.36Å; V149-G153 PolarHBondContact O-N 3.41Å; G153-K198 PolarHBondContact O-NZ 3.47Å
154	I	81.6	Confident	81.8	Confident	3 Å²	3	46.8 Å²	46.8	2%	0.015	25%	0.248	C	C	.	.			trans	-84.8	145.3	166.7	-60.6	168.7	0	0	0	107.7	V149 T152 N158 L190 D195 K198 I199	V149-I154 WeakPolarHBondContact CG1-O 3.12Å; V149-I154 WeakPolarHBondContact CG2-O 3.43Å; T152-I154 VanDerWaalsContact C-N 3.26Å; T152-I154 HydrophobicContact CG2-CD1 4.14Å; T152-I154 PolarHBondContact O-N 2.85Å; T152-I154 WeakPolarHBondContact OG1-CB 3.37Å; T152-I154 WeakPolarHBondContact OG1-CD1 3.42Å; T152-I154 WeakPolarHBondContact OG1-CG1 3.37Å; T152-I154 PolarHBondContact OG1-N 2.74Å; I154-N158 HydrophobicContact CG2-CB 3.81Å; I154-L190 HydrophobicContact CD1-CD2 3.95Å; I154-D195 HydrophobicContact CD1-CB 3.99Å; I154-D195 HydrophobicContact CG1-CB 3.91Å; I154-D195 HydrophobicContact CG2-CB 4.32Å; I154-K198 HydrophobicContact CD1-CB 4.46Å; I154-K198 HydrophobicContact CG1-CB 4.26Å; I154-K198 HydrophobicContact CG1-CD 3.66Å; I154-I199 HydrophobicContact CD1-CD1 4.32Å; I154-I199 HydrophobicContact CD1-CG1 4.13Å
155	S	80.8	Confident	81.4	Confident	52 Å²	52	49.3 Å²	49.3	36%	0.364	28%	0.275	S	S	.	.			trans	-69	147.1	175.2	57.6	0	0	0	0	110.7	E157 N158	S155-E157 PolarHBondContact O-N 2.7Å; S155-N158 PolarHBondContact O-N 2.65Å; S155-N158 VanDerWaalsContact O-N 3.08Å; S155-N158 WeakPolarHBondContact OG-CB 3.02Å; S155-N158 PolarHBondContact OG-N 3.31Å; S155-N158 PolarHBondContact OG-OD1 3.04Å; S155-N158 VanDerWaalsContact OG-OD1 3.06Å
156	H	78	Confident	81.3	Confident	59 Å²	59	55.2 Å²	55.2	27%	0.273	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-57.9	-32.5	178.3	-178.2	-90.5	0	0	0	112.9	M142 K145 V149	M142-H156 VanDerWaalsContact CE-CE1 3.41Å; M142-H156 WeakPolarHBondContact CE-CE1 3.47Å; M142-H156 VanDerWaalsContact CE-NE2 3.34Å; M142-H156 WeakPolarHBondContact CE-NE2 3.24Å; M142-H156 VanDerWaalsContact SD-CE1 3.51Å; M142-H156 PolarHBondContact SD-NE2 2.95Å; K145-H156 VanDerWaalsContact CB-CD2 3.49Å; K145-H156 WeakPolarHBondContact CB-CD2 3.41Å; K145-H156 WeakPolarHBondContact CB-NE2 3.47Å; K145-H156 WeakPolarHBondContact CD-NE2 3.28Å; V149-H156 HydrophobicContact CG2-CB 4.1Å
157	E	77.5	Confident	81.1	Confident	178 Å²	178	56 Å²	56	83%	0.832	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-69.9	-31	178.3	-63.5	170.8	-179.5	0	0	112.8	S155 L159	S155-E157 PolarHBondContact O-N 2.7Å; E157-L159 VanDerWaalsContact C-N 3.26Å; E157-L159 PolarHBondContact O-N 3.05Å
158	N	77.8	Confident	80.9	Confident	49 Å²	49	57.3 Å²	57.3	26%	0.262	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-79.4	-2.9	179.7	-75.2	18.2	0	0	0	113.5	I154 S155 L190 G191 D195	I154-N158 HydrophobicContact CG2-CB 3.81Å; S155-N158 PolarHBondContact O-N 2.65Å; S155-N158 VanDerWaalsContact O-N 3.08Å; S155-N158 WeakPolarHBondContact OG-CB 3.02Å; S155-N158 PolarHBondContact OG-N 3.31Å; S155-N158 PolarHBondContact OG-OD1 3.04Å; S155-N158 VanDerWaalsContact OG-OD1 3.06Å; N158-L190 WeakPolarHBondContact O-CA 3.43Å; N158-G191 PolarHBondContact O-N 3.5Å; N158-D195 PolarHBondContact ND2-OD2 3.16Å
159	L	78.9	Confident	80.8	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.016	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	110.8	-168.3	-163.9	157.4	0	0	0	111.3	K145 L148 E157 L161 V188	K145-L159 VanDerWaalsContact CE-O 3.24Å; K145-L159 WeakPolarHBondContact CE-O 3.48Å; K145-L159 HydrophobicContact CG-CD2 4.22Å; K145-L159 PolarHBondContact NZ-O 3.15Å; L148-L159 HydrophobicContact CB-CD1 3.79Å; L148-L159 HydrophobicContact CD1-CD1 4.07Å; L148-L159 HydrophobicContact CD1-CD2 3.92Å; E157-L159 VanDerWaalsContact C-N 3.26Å; E157-L159 PolarHBondContact O-N 3.05Å; L159-L161 HydrophobicContact CD2-CG 4.03Å; L159-V188 HydrophobicContact CD2-CG1 4.26Å; L159-V188 HydrophobicContact CD2-CG2 4.08Å; L159-V188 HydrophobicContact CG-CG1 3.97Å
160	T	83.8	Confident	80.5	Confident	39 Å²	39	61.9 Å²	61.9	24%	0.239	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	125	177.9	-42.9	0	0	0	0	110.2	Y162 V167 V188 S189	T160-Y162 HydrophobicContact CG2-CD2 4.4Å; T160-Y162 HydrophobicContact CG2-CE1 4.49Å; T160-Y162 HydrophobicContact CG2-CE2 3.73Å; T160-V167 HydrophobicContact CG2-CG1 4.1Å; T160-V167 HydrophobicContact CG2-CG2 4.12Å; T160-V188 WeakPolarHBondContact O-CA 3.42Å; T160-S189 WeakPolarHBondContact CB-OG 3.43Å; T160-S189 PolarHBondContact N-O 2.83Å; T160-S189 PolarHBondContact O-N 3.15Å; T160-S189 VanDerWaalsContact O-N 3.15Å
161	L	84.3	Confident	80.5	Confident	2 Å²	2	62 Å²	62	1%	0.01	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	128.3	174.3	-77	167.8	0	0	0	109.6	I122 I141 L144 K145 L148 L159 F186 V188	I122-L161 HydrophobicContact CD1-CD2 4.36Å; I122-L161 HydrophobicContact CG2-CD2 4.15Å; I141-L161 HydrophobicContact CG2-CB 4.47Å; I141-L161 HydrophobicContact CG2-CD1 3.8Å; L144-L161 HydrophobicContact CB-CD1 4.21Å; K145-L161 HydrophobicContact CG-CD1 3.59Å; K145-L161 HydrophobicContact CG-CG 4.33Å; L148-L161 HydrophobicContact CD1-CD2 4.2Å; L159-L161 HydrophobicContact CD2-CG 4.03Å; L161-F186 HydrophobicContact CB-CD1 4.35Å; L161-F186 HydrophobicContact CD2-CB 3.78Å; L161-F186 HydrophobicContact CD2-CD1 4.42Å; L161-F186 HydrophobicContact CD2-CG 4.17Å; L161-V188 HydrophobicContact CD2-CG2 3.41Å; L161-V188 VanDerWaalsContact CD2-CG2 3.41Å; L161-V188 HydrophobicContact CG-CG2 4.3Å
162	Y	84.9	Confident	80.6	Confident	65 Å²	65	62.6 Å²	62.6	26%	0.255	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	139.1	171.2	-51.7	-108.2	0	0	0	109.6	T160 E166 V167 F186 T187 S189	T160-Y162 HydrophobicContact CG2-CD2 4.4Å; T160-Y162 HydrophobicContact CG2-CE1 4.49Å; T160-Y162 HydrophobicContact CG2-CE2 3.73Å; Y162-E166 CarbonylContact C-O 3.53Å; Y162-E166 WeakPolarHBondContact CA-O 3.45Å; Y162-V167 HydrophobicContact CD1-CG2 3.62Å; Y162-V167 HydrophobicContact CE1-CG2 3.31Å; Y162-F186 VanDerWaalsContact O-CA 3.25Å; Y162-F186 WeakPolarHBondContact O-CA 3.44Å; Y162-T187 PolarHBondContact N-O 3.38Å; Y162-T187 PolarHBondContact O-N 2.99Å; Y162-S189 WeakPolarHBondContact CE2-OG 3.22Å; Y162-S189 PolarHBondContact OH-OG 2.91Å
163	Y	84.6	Confident	80.8	Confident	30 Å²	30	64.1 Å²	64.1	12%	0.118	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	126.2	169.8	-171.5	-116.4	0	0	0	108.1	G165 E166 V168 L177 L184 S185 F186	Y163-G165 PolarHBondContact O-N 3.29Å; Y163-E166 PolarHBondContact N-O 2.81Å; Y163-E166 PolarHBondContact O-N 2.77Å; Y163-V168 VanDerWaalsContact CB-CG2 3.4Å; Y163-L177 HydrophobicContact CD1-CD1 4.11Å; Y163-L177 HydrophobicContact CD1-CD2 3.93Å; Y163-L177 HydrophobicContact CD1-CG 4.42Å; Y163-L177 HydrophobicContact CE1-CB 3.99Å; Y163-L177 HydrophobicContact CE1-CD1 4.39Å; Y163-L177 HydrophobicContact CE1-CD2 3.91Å; Y163-L177 HydrophobicContact CE1-CG 4.32Å; Y163-L177 HydrophobicContact CG-CD1 4.22Å; Y163-L177 PolarHBondContact OH-O 2.87Å; Y163-L184 HydrophobicContact CE2-CD2 3.94Å; Y163-S185 VanDerWaalsContact CD2-O 3.25Å; Y163-S185 WeakPolarHBondContact CD2-O 3.36Å; Y163-F186 HydrophobicContact CD2-CD1 4.1Å; Y163-F186 AromaticContact CD2-CE1 3.97Å; Y163-F186 HydrophobicContact CD2-CE1 3.97Å; Y163-F186 HydrophobicContact CD2-CZ 4.31Å; Y163-F186 HydrophobicContact CG-CD1 4.48Å; Y163-F186 HydrophobicContact CG-CE1 4.23Å
164	N	79.7	Confident	81	Confident	141 Å²	141	61.6 Å²	61.6	75%	0.754	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	20.4	-174.2	-59.8	-27.7	0	0	0	115.5
165	G	76	Confident	80.8	Confident	54 Å²	54	66 Å²	66	56%	0.557	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.1	-9.3	-178.8	0	0	0	0	0	115.5	Y163	Y163-G165 PolarHBondContact O-N 3.29Å
166	E	82.3	Confident	80.7	Confident	156 Å²	156	67.9 Å²	67.9	73%	0.729	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.6	142.8	179.7	-63.6	-173.3	166.2	0	0	112	Y162 Y163 V168	Y162-E166 CarbonylContact C-O 3.53Å; Y162-E166 WeakPolarHBondContact CA-O 3.45Å; Y163-E166 PolarHBondContact N-O 2.81Å; Y163-E166 PolarHBondContact O-N 2.77Å; E166-V168 PolarHBondContact O-N 3.05Å
167	V	81.3	Confident	80.5	Confident	96 Å²	96	66.7 Å²	66.7	58%	0.582	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.4	119.2	175.3	-179.9	0	0	0	0	109	T160 Y162	T160-V167 HydrophobicContact CG2-CG1 4.1Å; T160-V167 HydrophobicContact CG2-CG2 4.12Å; Y162-V167 HydrophobicContact CD1-CG2 3.62Å; Y162-V167 HydrophobicContact CE1-CG2 3.31Å
168	V	79.1	Confident	80	Confident	28 Å²	28	59.6 Å²	59.6	17%	0.17	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-91.1	142.4	-175.9	-151.7	0	0	0	0	111.7	I141 Y163 E166 T172 L177 F186	I141-V168 HydrophobicContact CD1-CB 3.51Å; I141-V168 HydrophobicContact CD1-CG1 3.32Å; I141-V168 HydrophobicContact CD1-CG2 4.14Å; Y163-V168 VanDerWaalsContact CB-CG2 3.4Å; E166-V168 PolarHBondContact O-N 3.05Å; V168-T172 HydrophobicContact CG1-CG2 4.4Å; V168-L177 HydrophobicContact CG1-CD1 4.36Å; V168-F186 HydrophobicContact CG2-CE1 4.35Å
169	N	81.2	Confident	79.4	Confident	96 Å²	96	62.4 Å²	62.4	51%	0.513	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-62.1	126.9	175.8	-176.6	-3.1	0	0	0	110.4	D171 T172	N169-D171 PolarHBondContact O-N 3.02Å; N169-D171 VanDerWaalsContact O-N 3.12Å; N169-D171 PolarHBondContact OD1-N 3.25Å; N169-T172 WeakPolarHBondContact O-CB 3.43Å; N169-T172 PolarHBondContact O-N 2.96Å; N169-T172 VanDerWaalsContact O-N 3.09Å; N169-T172 PolarHBondContact O-OG1 3.47Å; N169-T172 VanDerWaalsContact O-OG1 3.1Å
170	P	79.4	Confident	78.5	Confident	47 Å²	47	71.8 Å²	71.8	31%	0.305	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-31.2	-177.9	18.4	-33.5	0	0	0	114.9	I141 M142 T172	I141-P170 PolarHBondContact N-O 2.87Å; I141-P170 VanDerWaalsContact N-O 3.16Å; M142-P170 HydrophobicContact CB-CB 4.12Å; M142-P170 PolarHBondContact N-O 2.98Å; M142-P170 HydrophobicContact SD-CB 3.91Å; P170-T172 PolarHBondContact O-N 3.34Å
171	D	82.2	Confident	77.6	Confident	117 Å²	117	76.5 Å²	76.5	63%	0.626	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-1.3	-177.3	-59.1	-34.4	0	0	0	113.8	V140 N169 P173	V140-D171 WeakPolarHBondContact CG1-O 3.41Å; N169-D171 PolarHBondContact O-N 3.02Å; N169-D171 VanDerWaalsContact O-N 3.12Å; N169-D171 PolarHBondContact OD1-N 3.25Å; D171-P173 WeakPolarHBondContact O-CD 3.4Å
172	T	82.7	Confident	77.1	Confident	31 Å²	31	81.2 Å²	81.2	19%	0.19	44%	0.438	C	S	.	.			trans	-71.2	123.3	-180	-59.9	0	0	0	0	111.2	V140 I141 V168 N169 P170 T176 L177	V140-T172 WeakPolarHBondContact CA-O 3.43Å; I141-T172 HydrophobicContact CD1-CG2 4.32Å; I141-T172 PolarHBondContact N-O 3.02Å; V168-T172 HydrophobicContact CG1-CG2 4.4Å; N169-T172 WeakPolarHBondContact O-CB 3.43Å; N169-T172 PolarHBondContact O-N 2.96Å; N169-T172 VanDerWaalsContact O-N 3.09Å; N169-T172 PolarHBondContact O-OG1 3.47Å; N169-T172 VanDerWaalsContact O-OG1 3.1Å; P170-T172 PolarHBondContact O-N 3.34Å; T172-T176 WeakPolarHBondContact CG2-OG1 3.37Å; T172-L177 HydrophobicContact CG2-CD1 4.45Å; T172-L177 HydrophobicContact CG2-CG 4.31Å
173	P	82.9	Confident	76.8	Confident	47 Å²	47	81.6 Å²	81.6	31%	0.305	45%	0.445	S	S	.	.	B	Isolated β-bridge	trans	-78.8	136.7	179.3	31	-33.3	0	0	0	111.8	F139 V140 D171 I175 T176	F139-P173 CarbonylContact O-C 3.59Å; F139-P173 WeakPolarHBondContact O-CA 3.36Å; V140-P173 HydrophobicContact CG1-CB 4.21Å; D171-P173 WeakPolarHBondContact O-CD 3.4Å; P173-I175 HydrophobicContact CB-CG2 4.35Å; P173-I175 PolarHBondContact O-N 3.48Å; P173-I175 VanDerWaalsContact O-N 3.12Å; P173-T176 HydrophobicContact CG-CG2 3.92Å; P173-T176 PolarHBondContact O-N 2.94Å; P173-T176 PolarHBondContact O-OG1 3.41Å
174	L	81.1	Confident	76.7	Confident	0 Å²	0	80.2 Å²	80.2	0%	0	44%	0.439	C	S	.	.	G	3₁₀ helix	trans	-58.1	-32.6	-169.5	-62.8	179.4	0	0	0	113.7	V135 F139 I141 L144 T176 L177 A178 L184 F186	V135-L174 HydrophobicContact CG1-CD1 3.66Å; F139-L174 HydrophobicContact CB-CD1 4Å; F139-L174 WeakPolarHBondContact O-CG 3.46Å; F139-L174 PolarHBondContact O-N 3.28Å; I141-L174 HydrophobicContact CG1-CD2 3.9Å; L144-L174 HydrophobicContact CD1-CD1 4.12Å; L144-L174 HydrophobicContact CD1-CD2 3.53Å; L144-L174 HydrophobicContact CD1-CG 4.48Å; L144-L174 HydrophobicContact CD2-CD1 4.46Å; L144-L174 HydrophobicContact CG-CD1 4.06Å; L144-L174 HydrophobicContact CG-CD2 4.14Å; L174-T176 PolarHBondContact O-N 2.98Å; L174-T176 VanDerWaalsContact O-N 3.13Å; L174-L177 PolarHBondContact O-N 3.18Å; L174-A178 PolarHBondContact O-N 2.96Å; L174-L184 HydrophobicContact CB-CD1 3.92Å; L174-L184 HydrophobicContact CD2-CD1 3.9Å; L174-L184 HydrophobicContact CG-CD1 4.32Å; L174-F186 HydrophobicContact CD2-CZ 4.26Å
175	I	78.5	Confident	76.9	Confident	95 Å²	95	76.2 Å²	76.2	49%	0.487	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-55.9	-24.4	174.1	-162.8	168.2	0	0	0	114	E137 P173	E137-I175 HydrophobicContact CB-CB 4.33Å; E137-I175 HydrophobicContact CB-CD1 4.39Å; E137-I175 WeakPolarHBondContact O-CB 3.48Å; E137-I175 PolarHBondContact O-N 2.99Å; E137-I175 VanDerWaalsContact O-N 3.17Å; P173-I175 HydrophobicContact CB-CG2 4.35Å; P173-I175 PolarHBondContact O-N 3.48Å; P173-I175 VanDerWaalsContact O-N 3.12Å
176	T	78.3	Confident	77.5	Confident	92 Å²	92	73.7 Å²	73.7	56%	0.564	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-81	-13.6	177.6	59.4	0	0	0	0	114.1	T172 P173 L174	T172-T176 WeakPolarHBondContact CG2-OG1 3.37Å; P173-T176 HydrophobicContact CG-CG2 3.92Å; P173-T176 PolarHBondContact O-N 2.94Å; P173-T176 PolarHBondContact O-OG1 3.41Å; L174-T176 PolarHBondContact O-N 2.98Å; L174-T176 VanDerWaalsContact O-N 3.13Å
177	L	73.8	Confident	77.6	Confident	34 Å²	34	69.5 Å²	69.5	18%	0.178	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-16.9	177.7	-60.4	-177.8	0	0	0	112.8	I141 Y163 V168 T172 L174 N179 L184 F186	I141-L177 HydrophobicContact CD1-CD1 3.8Å; Y163-L177 HydrophobicContact CD1-CD1 4.11Å; Y163-L177 HydrophobicContact CD1-CD2 3.93Å; Y163-L177 HydrophobicContact CD1-CG 4.42Å; Y163-L177 HydrophobicContact CE1-CB 3.99Å; Y163-L177 HydrophobicContact CE1-CD1 4.39Å; Y163-L177 HydrophobicContact CE1-CD2 3.91Å; Y163-L177 HydrophobicContact CE1-CG 4.32Å; Y163-L177 HydrophobicContact CG-CD1 4.22Å; Y163-L177 PolarHBondContact OH-O 2.87Å; V168-L177 HydrophobicContact CG1-CD1 4.36Å; T172-L177 HydrophobicContact CG2-CD1 4.45Å; T172-L177 HydrophobicContact CG2-CG 4.31Å; L174-L177 PolarHBondContact O-N 3.18Å; L177-N179 PolarHBondContact O-N 3.46Å; L177-L184 VanDerWaalsContact C-CD2 3.49Å; L177-L184 HydrophobicContact CB-CD2 3.58Å; L177-L184 WeakPolarHBondContact O-CD2 3.46Å; L177-F186 HydrophobicContact CD1-CE1 4.22Å; L177-F186 HydrophobicContact CD1-CZ 4.08Å
178	A	67.2	Low	77.8	Confident	29 Å²	29	65.1 Å²	65.1	24%	0.24	35%	0.354	C	S	.	.			trans	-73.7	115.9	-171.5	0	0	0	0	0	112	L174 L184	L174-A178 PolarHBondContact O-N 2.96Å; A178-L184 HydrophobicContact CB-CD2 4.42Å
179	N	64.5	Low	77.9	Confident	108 Å²	108	64.5 Å²	64.5	58%	0.578	35%	0.352	S	S	*	.			trans	-68.7	168.8	170.4	-62.9	-54.5	0	0	0	111.3	L177 N181 R182	L177-N179 PolarHBondContact O-N 3.46Å; N179-N181 PolarHBondContact O-N 3.06Å; N179-R182 PolarHBondContact O-N 2.94Å
180	E	61.3	Low	77.8	Confident	200 Å²	200	61 Å²	61	94%	0.935	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47	-30.7	-178.5	-60.6	-176.8	152.6	0	0	114.8	R182	E180-R182 VanDerWaalsContact C-N 3.31Å; E180-R182 PolarHBondContact O-N 3.5Å
181	N	64.7	Low	77.5	Confident	139 Å²	139	61.9 Å²	61.9	74%	0.743	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	4	179.8	-63.8	-29.1	0	0	0	114.8	N179 L183	N179-N181 PolarHBondContact O-N 3.06Å; N181-L183 HydrophobicContact CB-CB 4.46Å; N181-L183 PolarHBondContact O-N 3.07Å; N181-L183 VanDerWaalsContact O-N 3.17Å
182	R	73.8	Confident	77.3	Confident	100 Å²	100	60.2 Å²	60.2	38%	0.377	34%	0.341	S	S	.	.			trans	50.6	37.9	-176.1	-72	175.7	154	176.7	-12.7	114	K115 V118 T119 E137 N179 E180	K115-R182 PolarHBondContact O-NH1 2.96Å; K115-R182 PolarHBondContact O-NH2 3.2Å; V118-R182 VanDerWaalsContact CG1-O 3.28Å; V118-R182 WeakPolarHBondContact CG1-O 3.36Å; T119-R182 PolarHBondContact N-O 3.25Å; E137-R182 IonicContact OE1-CZ 2.67Å; E137-R182 IonicContact OE1-NE 2.78Å; E137-R182 PolarHBondContact OE1-NE 2.78Å; E137-R182 IonicContact OE1-NH2 2.67Å; E137-R182 PolarHBondContact OE1-NH2 3.26Å; E137-R182 IonicContact OE2-NH2 3.5Å; E137-R182 PolarHBondContact OE2-NH2 2.96Å; E137-R182 VanDerWaalsContact OE2-NH2 3.13Å; N179-R182 PolarHBondContact O-N 2.94Å; E180-R182 VanDerWaalsContact C-N 3.31Å; E180-R182 PolarHBondContact O-N 3.5Å
183	L	77.5	Confident	76.6	Confident	74 Å²	74	61.3 Å²	61.3	39%	0.387	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	122.1	-178	-156.5	70.9	0	0	0	109.8	T119 H121 N181	T119-L183 HydrophobicContact CG2-CD1 3.92Å; T119-L183 WeakPolarHBondContact O-CA 3.41Å; H121-L183 WeakPolarHBondContact NE2-CD1 3.47Å; N181-L183 HydrophobicContact CB-CB 4.46Å; N181-L183 PolarHBondContact O-N 3.07Å; N181-L183 VanDerWaalsContact O-N 3.17Å
184	L	83.1	Confident	76.3	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	147.4	172.5	-69.3	175.8	0	0	0	110.2	V118 T119 V120 H121 Y163 L174 L177 A178 F186	V118-L184 HydrophobicContact CG1-CD1 3.88Å; V118-L184 HydrophobicContact CG1-CG 3.87Å; T119-L184 PolarHBondContact O-N 2.96Å; V120-L184 HydrophobicContact CB-CB 4.5Å; V120-L184 HydrophobicContact CG1-CB 4.13Å; V120-L184 HydrophobicContact CG2-CB 4.28Å; V120-L184 HydrophobicContact CG2-CD1 4.29Å; H121-L184 PolarHBondContact N-O 3.16Å; Y163-L184 HydrophobicContact CE2-CD2 3.94Å; L174-L184 HydrophobicContact CB-CD1 3.92Å; L174-L184 HydrophobicContact CD2-CD1 3.9Å; L174-L184 HydrophobicContact CG-CD1 4.32Å; L177-L184 VanDerWaalsContact C-CD2 3.49Å; L177-L184 HydrophobicContact CB-CD2 3.58Å; L177-L184 WeakPolarHBondContact O-CD2 3.46Å; A178-L184 HydrophobicContact CB-CD2 4.42Å; L184-F186 HydrophobicContact CB-CD2 4.41Å; L184-F186 HydrophobicContact CB-CE2 3.85Å; L184-F186 HydrophobicContact CD1-CE2 4.08Å; L184-F186 HydrophobicContact CD1-CZ 4.4Å; L184-F186 HydrophobicContact CG-CE2 4.49Å
185	S	85	Confident	76.1	Confident	57 Å²	57	61.7 Å²	61.7	40%	0.399	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	111.4	178.8	-70.6	0	0	0	0	110.1	H121 Y163	H121-S185 CarbonylContact O-C 3.57Å; H121-S185 WeakPolarHBondContact O-CA 3.2Å; Y163-S185 VanDerWaalsContact CD2-O 3.25Å; Y163-S185 WeakPolarHBondContact CD2-O 3.36Å
186	F	87.1	Confident	76	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.009	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	155.2	176.4	-62.7	-90.3	0	0	0	111	V120 H121 I122 N123 I141 L144 L161 Y162 Y163 V168 L174 L177 L184	V120-F186 HydrophobicContact CG1-CD2 3.59Å; V120-F186 HydrophobicContact CG1-CE2 3.7Å; H121-F186 PolarHBondContact O-N 3.4Å; I122-F186 WeakPolarHBondContact CA-O 3.42Å; I122-F186 HydrophobicContact CG1-CB 4.43Å; N123-F186 PolarHBondContact N-O 3.39Å; I141-F186 HydrophobicContact CD1-CE1 4.15Å; I141-F186 HydrophobicContact CD1-CZ 4.38Å; I141-F186 HydrophobicContact CG1-CZ 4.4Å; L144-F186 HydrophobicContact CD1-CD2 4.2Å; L144-F186 HydrophobicContact CD1-CE2 3.59Å; L144-F186 HydrophobicContact CD1-CZ 4.05Å; L161-F186 HydrophobicContact CB-CD1 4.35Å; L161-F186 HydrophobicContact CD2-CB 3.78Å; L161-F186 HydrophobicContact CD2-CD1 4.42Å; L161-F186 HydrophobicContact CD2-CG 4.17Å; Y162-F186 VanDerWaalsContact O-CA 3.25Å; Y162-F186 WeakPolarHBondContact O-CA 3.44Å; Y163-F186 HydrophobicContact CD2-CD1 4.1Å; Y163-F186 AromaticContact CD2-CE1 3.97Å; Y163-F186 HydrophobicContact CD2-CE1 3.97Å; Y163-F186 HydrophobicContact CD2-CZ 4.31Å; Y163-F186 HydrophobicContact CG-CD1 4.48Å; Y163-F186 HydrophobicContact CG-CE1 4.23Å; V168-F186 HydrophobicContact CG2-CE1 4.35Å; L174-F186 HydrophobicContact CD2-CZ 4.26Å; L177-F186 HydrophobicContact CD1-CE1 4.22Å; L177-F186 HydrophobicContact CD1-CZ 4.08Å; L184-F186 HydrophobicContact CB-CD2 4.41Å; L184-F186 HydrophobicContact CB-CE2 3.85Å; L184-F186 HydrophobicContact CD1-CE2 4.08Å; L184-F186 HydrophobicContact CD1-CZ 4.4Å; L184-F186 HydrophobicContact CG-CE2 4.49Å
187	T	85.3	Confident	75.8	Confident	67 Å²	67	56 Å²	56	41%	0.411	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	143.1	161.4	49.8	0	0	0	0	110.4	N123 Y162	N123-T187 HydrophobicContact CB-CG2 4.3Å; N123-T187 CarbonylContact O-C 3.59Å; N123-T187 VanDerWaalsContact O-CA 3.28Å; N123-T187 WeakPolarHBondContact O-CA 3.32Å; Y162-T187 PolarHBondContact N-O 3.38Å; Y162-T187 PolarHBondContact O-N 2.99Å
188	V	84.5	Confident	76.1	Confident	4 Å²	4	58.1 Å²	58.1	2%	0.024	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	123	175.3	166.4	0	0	0	0	110.2	I122 N123 L148 L159 T160 L161 L190	I122-V188 HydrophobicContact CG2-CB 4.29Å; I122-V188 HydrophobicContact CG2-CG2 3.34Å; N123-V188 PolarHBondContact O-N 3.04Å; L148-V188 HydrophobicContact CD1-CG2 4.22Å; L159-V188 HydrophobicContact CD2-CG1 4.26Å; L159-V188 HydrophobicContact CD2-CG2 4.08Å; L159-V188 HydrophobicContact CG-CG1 3.97Å; T160-V188 WeakPolarHBondContact O-CA 3.42Å; L161-V188 HydrophobicContact CD2-CG2 3.41Å; L161-V188 VanDerWaalsContact CD2-CG2 3.41Å; L161-V188 HydrophobicContact CG-CG2 4.3Å; V188-L190 HydrophobicContact CG1-CD2 3.64Å; V188-L190 HydrophobicContact CG1-CG 4.19Å
189	S	81.5	Confident	76.8	Confident	16 Å²	16	57 Å²	57	11%	0.112	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	143.7	158.5	74.1	0	0	0	0	110.2	E125 T160 Y162	E125-S189 WeakPolarHBondContact OE1-CA 3.43Å; E125-S189 WeakPolarHBondContact OE1-CB 3.02Å; T160-S189 WeakPolarHBondContact CB-OG 3.43Å; T160-S189 PolarHBondContact N-O 2.83Å; T160-S189 PolarHBondContact O-N 3.15Å; T160-S189 VanDerWaalsContact O-N 3.15Å; Y162-S189 WeakPolarHBondContact CE2-OG 3.22Å; Y162-S189 PolarHBondContact OH-OG 2.91Å
190	L	78.8	Confident	77.7	Confident	23 Å²	23	54.8 Å²	54.8	12%	0.12	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	123.8	178.3	-62.2	178.7	0	0	0	109.4	I154 N158 V188 N192 D195 I199	I154-L190 HydrophobicContact CD1-CD2 3.95Å; N158-L190 WeakPolarHBondContact O-CA 3.43Å; V188-L190 HydrophobicContact CG1-CD2 3.64Å; V188-L190 HydrophobicContact CG1-CG 4.19Å; L190-N192 PolarHBondContact O-N 2.74Å; L190-D195 HydrophobicContact CD1-CB 4.38Å; L190-I199 HydrophobicContact CD1-CD1 3.92Å; L190-I199 HydrophobicContact CD2-CD1 4.47Å
191	G	72.8	Confident	78.8	Confident	65 Å²	65	45.7 Å²	45.7	67%	0.67	26%	0.264	S	S	*	.	S	Bend	trans	-62.6	-13.2	179.4	0	0	0	0	0	114.7	N158	N158-G191 PolarHBondContact O-N 3.5Å
192	N	78.1	Confident	79.6	Confident	82 Å²	82	39.8 Å²	39.8	44%	0.439	24%	0.236	S	C	.	.	S	Bend	trans	-138.8	124.7	174.2	-178.1	-6.7	0	0	0	110.2	L190 A194 D195	L190-N192 PolarHBondContact O-N 2.74Å; N192-A194 PolarHBondContact O-N 2.87Å; N192-A194 VanDerWaalsContact O-N 3.14Å; N192-A194 WeakPolarHBondContact OD1-CB 3.27Å; N192-A194 PolarHBondContact OD1-N 3.29Å; N192-D195 WeakPolarHBondContact O-CB 3.48Å; N192-D195 PolarHBondContact O-N 3.34Å
193	A	69.8	Low	80	Confident	53 Å²	53	40 Å²	40	44%	0.438	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-58.3	-27.8	178.8	0	0	0	0	0	113.4	D195 S196 Y228	A193-D195 VanDerWaalsContact C-N 3.29Å; A193-D195 PolarHBondContact O-N 3.21Å; A193-S196 VanDerWaalsContact O-CB 3.31Å; A193-S196 WeakPolarHBondContact O-CB 3.37Å; A193-S196 PolarHBondContact O-N 2.9Å; A193-S196 PolarHBondContact O-OG 3.33Å; A193-Y228 HydrophobicContact CB-CD2 3.91Å; A193-Y228 HydrophobicContact CB-CE2 3.92Å
194	A	74.7	Confident	80.2	Confident	46 Å²	46	37.9 Å²	37.9	38%	0.38	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-71.5	-18.7	176.9	0	0	0	0	0	113.8	N192 S196	N192-A194 PolarHBondContact O-N 2.87Å; N192-A194 VanDerWaalsContact O-N 3.14Å; N192-A194 WeakPolarHBondContact OD1-CB 3.27Å; N192-A194 PolarHBondContact OD1-N 3.29Å; A194-S196 PolarHBondContact O-N 3.36Å
195	D	78.6	Confident	80.3	Confident	9 Å²	9	42 Å²	42	5%	0.048	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-69.7	-16.2	174.9	-80.3	-39.4	0	0	0	112.1	I154 N158 L190 N192 A193 F197 K198	I154-D195 HydrophobicContact CD1-CB 3.99Å; I154-D195 HydrophobicContact CG1-CB 3.91Å; I154-D195 HydrophobicContact CG2-CB 4.32Å; N158-D195 PolarHBondContact ND2-OD2 3.16Å; L190-D195 HydrophobicContact CD1-CB 4.38Å; N192-D195 WeakPolarHBondContact O-CB 3.48Å; N192-D195 PolarHBondContact O-N 3.34Å; A193-D195 VanDerWaalsContact C-N 3.29Å; A193-D195 PolarHBondContact O-N 3.21Å; D195-F197 VanDerWaalsContact C-N 3.32Å; D195-F197 PolarHBondContact O-N 2.89Å; D195-K198 VanDerWaalsContact O-CB 3.29Å; D195-K198 WeakPolarHBondContact O-CB 3.49Å; D195-K198 PolarHBondContact O-N 2.78Å; D195-K198 VanDerWaalsContact O-N 3.1Å; D195-K198 WeakPolarHBondContact OD1-CD 3.31Å; D195-K198 WeakPolarHBondContact OD1-CE 3.48Å; D195-K198 IonicContact OD1-NZ 2.8Å; D195-K198 PolarHBondContact OD1-NZ 3.2Å
196	S	75.4	Confident	80.1	Confident	5 Å²	5	39.8 Å²	39.8	4%	0.035	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-58.2	-37.5	177.3	62.2	0	0	0	0	114.1	C126 A193 A194 K198 I199	C126-S196 WeakPolarHBondContact SG-CB 3.13Å; A193-S196 VanDerWaalsContact O-CB 3.31Å; A193-S196 WeakPolarHBondContact O-CB 3.37Å; A193-S196 PolarHBondContact O-N 2.9Å; A193-S196 PolarHBondContact O-OG 3.33Å; A194-S196 PolarHBondContact O-N 3.36Å; S196-K198 PolarHBondContact O-N 3.36Å; S196-I199 WeakPolarHBondContact O-CB 3.11Å; S196-I199 PolarHBondContact O-N 3.08Å; S196-I199 VanDerWaalsContact O-N 3.08Å
197	F	74.7	Confident	79.9	Confident	62 Å²	62	45.9 Å²	45.9	27%	0.272	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-60.6	-26.4	177	-70.1	-75.3	0	0	0	113.3	D195 I199 Y228 E231	D195-F197 VanDerWaalsContact C-N 3.32Å; D195-F197 PolarHBondContact O-N 2.89Å; F197-I199 PolarHBondContact O-N 3Å; F197-Y228 HydrophobicContact CD2-CD1 4.47Å; F197-Y228 AromaticContact CE2-CD1 3.47Å; F197-Y228 HydrophobicContact CE2-CD1 3.47Å; F197-Y228 VanDerWaalsContact CE2-CD1 3.47Å; F197-Y228 AromaticContact CE2-CE1 3.89Å; F197-Y228 HydrophobicContact CE2-CE1 3.89Å; F197-Y228 AromaticContact CZ-CD1 3.68Å; F197-Y228 HydrophobicContact CZ-CD1 3.68Å; F197-Y228 HydrophobicContact CZ-CE1 4.26Å; F197-E231 HydrophobicContact CD1-CB 4.39Å; F197-E231 HydrophobicContact CE1-CB 3.78Å
198	K	80.8	Confident	79.5	Confident	79 Å²	79	44.1 Å²	44.1	34%	0.343	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-72.8	-15.9	179.1	-62.4	173.5	174.1	176.5	0	112.7	T152 G153 I154 D195 S196 K200	T152-K198 WeakPolarHBondContact O-CB 3.44Å; G153-K198 PolarHBondContact O-NZ 3.47Å; I154-K198 HydrophobicContact CD1-CB 4.46Å; I154-K198 HydrophobicContact CG1-CB 4.26Å; I154-K198 HydrophobicContact CG1-CD 3.66Å; D195-K198 VanDerWaalsContact O-CB 3.29Å; D195-K198 WeakPolarHBondContact O-CB 3.49Å; D195-K198 PolarHBondContact O-N 2.78Å; D195-K198 VanDerWaalsContact O-N 3.1Å; D195-K198 WeakPolarHBondContact OD1-CD 3.31Å; D195-K198 WeakPolarHBondContact OD1-CE 3.48Å; D195-K198 IonicContact OD1-NZ 2.8Å; D195-K198 PolarHBondContact OD1-NZ 3.2Å; S196-K198 PolarHBondContact O-N 3.36Å; K198-K200 PolarHBondContact O-N 3.49Å
199	I	81.6	Confident	79.2	Confident	6 Å²	6	51.3 Å²	51.3	3%	0.031	29%	0.293	C	S	.	.	S	Bend	trans	-84.8	96.6	-179	-52.8	-169.7	0	0	0	109.2	T124 V128 L130 T152 I154 L190 S196 F197	T124-I199 HydrophobicContact CG2-CD1 3.75Å; V128-I199 HydrophobicContact CG1-CG2 4Å; L130-I199 HydrophobicContact CD1-CG2 4.15Å; L130-I199 HydrophobicContact CD2-CG2 3.97Å; L130-I199 HydrophobicContact CG-CG2 4.29Å; T152-I199 HydrophobicContact CG2-CG1 4.06Å; I154-I199 HydrophobicContact CD1-CD1 4.32Å; I154-I199 HydrophobicContact CD1-CG1 4.13Å; L190-I199 HydrophobicContact CD1-CD1 3.92Å; L190-I199 HydrophobicContact CD2-CD1 4.47Å; S196-I199 WeakPolarHBondContact O-CB 3.11Å; S196-I199 PolarHBondContact O-N 3.08Å; S196-I199 VanDerWaalsContact O-N 3.08Å; F197-I199 PolarHBondContact O-N 3Å
200	K	82.2	Confident	78.8	Confident	62 Å²	62	54.5 Å²	54.5	27%	0.27	32%	0.315	S	S	.	.			trans	-81.6	148.7	-172.6	-57.9	176	-168.7	175.9	0	112.5	K198 R204 I233 L235	K198-K200 PolarHBondContact O-N 3.49Å; K200-R204 PolarHBondContact O-NH1 3.43Å; K200-R204 PolarHBondContact O-NH2 3.26Å; K200-I233 CarbonylContact C-O 3.59Å; K200-I233 WeakPolarHBondContact CA-O 3.37Å; K200-I233 HydrophobicContact CG-CB 4.39Å; K200-I233 HydrophobicContact CG-CG2 4.41Å; K200-L235 HydrophobicContact CB-CD1 4.24Å; K200-L235 HydrophobicContact CD-CD1 3.41Å; K200-L235 VanDerWaalsContact CD-CD1 3.41Å; K200-L235 HydrophobicContact CD-CG 3.94Å; K200-L235 HydrophobicContact CG-CD1 4.44Å
201	L	83.8	Confident	78.6	Confident	8 Å²	8	56.3 Å²	56.3	4%	0.042	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-89.8	161.4	172.4	-58.6	178.6	0	0	0	111.7	V128 R204 G218 K220 N232 I233 M234 L235 W253	V128-L201 HydrophobicContact CG1-CD2 3.72Å; V128-L201 HydrophobicContact CG2-CD2 4.29Å; L201-R204 PolarHBondContact O-NH1 3.48Å; L201-G218 WeakPolarHBondContact CA-O 3.38Å; L201-K220 HydrophobicContact CD1-CB 4.3Å; L201-N232 HydrophobicContact CD1-CB 3.69Å; L201-N232 HydrophobicContact CG-CB 4.07Å; L201-I233 PolarHBondContact N-O 2.88Å; L201-M234 HydrophobicContact CB-CB 4.05Å; L201-M234 HydrophobicContact CB-CG 4.24Å; L201-L235 PolarHBondContact O-N 3.36Å; L201-W253 HydrophobicContact CD1-CZ2 4.07Å
202	G	82.5	Confident	78.9	Confident	15 Å²	15	56.7 Å²	56.7	16%	0.155	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	98	178.8	-178.4	0	0	0	0	0	114.2	R204 G218	G202-R204 PolarHBondContact O-NH1 2.87Å; G202-G218 PolarHBondContact N-O 3.09Å; G202-G218 PolarHBondContact O-N 3.36Å
203	L	82.2	Confident	79.1	Confident	105 Å²	105	55 Å²	55	55%	0.55	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	137.4	176.2	172.8	66.9	0	0	0	110.7	K215 I216 I217	L203-K215 HydrophobicContact CD1-CB 4.43Å; L203-I216 CarbonylContact C-O 3.59Å; L203-I216 WeakPolarHBondContact CA-O 3.35Å; L203-I217 HydrophobicContact CD1-CD1 4.3Å; L203-I217 HydrophobicContact CD1-CG1 3.71Å
204	R	81.5	Confident	79.8	Confident	29 Å²	29	52.5 Å²	52.5	11%	0.109	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	157.8	173.6	-73.1	-177.9	-69.1	-71.6	8.8	111.3	D151 K200 L201 G202 K215 I216 L235	D151-R204 VanDerWaalsContact CG-NE 3.31Å; D151-R204 VanDerWaalsContact OD1-CD 3.28Å; D151-R204 WeakPolarHBondContact OD1-CD 3.44Å; D151-R204 IonicContact OD1-CZ 3.51Å; D151-R204 IonicContact OD1-NE 3.41Å; D151-R204 PolarHBondContact OD1-NE 3.03Å; D151-R204 IonicContact OD1-NH2 2.85Å; D151-R204 IonicContact OD2-CZ 3.54Å; D151-R204 IonicContact OD2-NE 3.59Å; D151-R204 PolarHBondContact OD2-NE 3.39Å; D151-R204 VanDerWaalsContact OD2-NE 3.1Å; D151-R204 IonicContact OD2-NH2 3.39Å; D151-R204 PolarHBondContact OD2-NH2 3.44Å; K200-R204 PolarHBondContact O-NH1 3.43Å; K200-R204 PolarHBondContact O-NH2 3.26Å; L201-R204 PolarHBondContact O-NH1 3.48Å; G202-R204 PolarHBondContact O-NH1 2.87Å; R204-K215 CarbonylContact O-C 3.54Å; R204-K215 WeakPolarHBondContact O-CA 3.31Å; R204-I216 PolarHBondContact N-O 2.95Å; R204-I216 PolarHBondContact O-N 3.16Å; R204-L235 HydrophobicContact CG-CD1 4.1Å
205	E	84.7	Confident	80.3	Confident	86 Å²	86	53.5 Å²	53.5	40%	0.402	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	127.5	174.9	-54.9	-165.3	165.1	0	0	109.5	F207 V213 V214 K215	E205-F207 HydrophobicContact CB-CE2 4.3Å; E205-F207 HydrophobicContact CB-CZ 4.48Å; E205-V213 HydrophobicContact CB-CG1 3.98Å; E205-V214 WeakPolarHBondContact CA-O 3.29Å; E205-K215 HydrophobicContact CG-CD 4.26Å; E205-K215 HydrophobicContact CG-CG 4.14Å; E205-K215 WeakPolarHBondContact OE1-CD 3.43Å; E205-K215 WeakPolarHBondContact OE1-CE 3.49Å; E205-K215 IonicContact OE1-NZ 2.78Å; E205-K215 PolarHBondContact OE1-NZ 2.93Å
206	I	81.4	Confident	80.7	Confident	12 Å²	12	53 Å²	53	6%	0.062	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	115.3	-176.4	-60.5	179.1	0	0	0	109.1	I147 K150 D151 L208 V213 V214 I216	I147-I206 HydrophobicContact CG2-CD1 4.23Å; K150-I206 HydrophobicContact CD-CG2 3.85Å; K150-I206 HydrophobicContact CG-CG2 4.21Å; D151-I206 HydrophobicContact CB-CD1 3.66Å; I206-L208 HydrophobicContact CG2-CD2 4.45Å; I206-V213 WeakPolarHBondContact O-CA 3.09Å; I206-V214 PolarHBondContact N-O 2.7Å; I206-V214 PolarHBondContact O-N 2.78Å; I206-I216 HydrophobicContact CD1-CD1 3.53Å; I206-I216 HydrophobicContact CD1-CG1 4.18Å
207	F	82.4	Confident	81.2	Confident	130 Å²	130	54.8 Å²	54.8	57%	0.57	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85	117.8	175.8	-58.2	-91.3	0	0	0	109.5	K150 E205 V213	K150-F207 PolarHBondContact NZ-O 3.44Å; E205-F207 HydrophobicContact CB-CE2 4.3Å; E205-F207 HydrophobicContact CB-CZ 4.48Å; F207-V213 HydrophobicContact CD1-CG1 4.4Å; F207-V213 HydrophobicContact CD1-CG2 3.62Å; F207-V213 HydrophobicContact CE1-CG1 4.07Å; F207-V213 HydrophobicContact CE1-CG2 3.61Å; F207-V213 HydrophobicContact CZ-CG1 4.3Å
208	L	78.5	Confident	81.7	Confident	29 Å²	29	52 Å²	52	15%	0.152	29%	0.289	C	S	.	.			trans	-86	157.7	171.9	-62.6	177	0	0	0	110.4	F139 I206 S210 G211 L212 V214	F139-L208 HydrophobicContact CE2-CD1 3.92Å; F139-L208 HydrophobicContact CZ-CD1 3.93Å; I206-L208 HydrophobicContact CG2-CD2 4.45Å; L208-S210 PolarHBondContact O-N 2.97Å; L208-S210 VanDerWaalsContact O-N 3.14Å; L208-G211 PolarHBondContact O-N 2.86Å; L208-L212 HydrophobicContact CB-CB 4.36Å; L208-L212 HydrophobicContact CD1-CB 4.22Å; L208-L212 PolarHBondContact N-O 2.78Å; L208-V214 HydrophobicContact CD1-CG2 4.19Å
209	T	76.6	Confident	81.9	Confident	155 Å²	155	53.9 Å²	53.9	95%	0.951	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-16.9	179	42.2	0	0	0	0	113.5	G211	T209-G211 VanDerWaalsContact C-N 3.27Å
210	S	73	Confident	82.1	Confident	83 Å²	83	55.2 Å²	55.2	58%	0.58	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-0.2	170.8	52.8	0	0	0	0	114.5	L208 L212	L208-S210 PolarHBondContact O-N 2.97Å; L208-S210 VanDerWaalsContact O-N 3.14Å; S210-L212 VanDerWaalsContact C-N 3.25Å; S210-L212 PolarHBondContact O-N 3.09Å
211	G	75.4	Confident	82.1	Confident	62 Å²	62	58.2 Å²	58.2	64%	0.639	32%	0.317	S	S	*	.	S	Bend	trans	80.1	-1.7	-175	0	0	0	0	0	114.7	L208 T209	L208-G211 PolarHBondContact O-N 2.86Å; T209-G211 VanDerWaalsContact C-N 3.27Å
212	L	79.2	Confident	81.8	Confident	72 Å²	72	59.8 Å²	59.8	38%	0.377	33%	0.331	S	S	.	.			trans	-68.9	139.9	173.5	-67.8	173	0	0	0	111.2	P136 F139 L208 S210	P136-L212 HydrophobicContact CG-CD1 4.01Å; F139-L212 HydrophobicContact CE1-CD1 4.15Å; F139-L212 HydrophobicContact CZ-CD1 3.83Å; L208-L212 HydrophobicContact CB-CB 4.36Å; L208-L212 HydrophobicContact CD1-CB 4.22Å; L208-L212 PolarHBondContact N-O 2.78Å; S210-L212 VanDerWaalsContact C-N 3.25Å; S210-L212 PolarHBondContact O-N 3.09Å
213	V	82.8	Confident	81.6	Confident	46 Å²	46	60.7 Å²	60.7	28%	0.279	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	112.2	177.2	-171.9	0	0	0	0	109.2	E205 I206 F207	E205-V213 HydrophobicContact CB-CG1 3.98Å; I206-V213 WeakPolarHBondContact O-CA 3.09Å; F207-V213 HydrophobicContact CD1-CG1 4.4Å; F207-V213 HydrophobicContact CD1-CG2 3.62Å; F207-V213 HydrophobicContact CE1-CG1 4.07Å; F207-V213 HydrophobicContact CE1-CG2 3.61Å; F207-V213 HydrophobicContact CZ-CG1 4.3Å
214	V	84.5	Confident	81.2	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.006	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	133.7	177.7	178	0	0	0	0	108.6	I132 V135 I147 E205 I206 L208	I132-V214 HydrophobicContact CG2-CG1 3.32Å; V135-V214 HydrophobicContact CG2-CG1 4.25Å; I147-V214 HydrophobicContact CD1-CG2 4.36Å; I147-V214 HydrophobicContact CG2-CG1 4.38Å; E205-V214 WeakPolarHBondContact CA-O 3.29Å; I206-V214 PolarHBondContact N-O 2.7Å; I206-V214 PolarHBondContact O-N 2.78Å; L208-V214 HydrophobicContact CD1-CG2 4.19Å
215	K	85	Confident	80.7	Confident	67 Å²	67	64 Å²	64	29%	0.291	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	132.7	-179.3	-53.2	-161.3	-175	-153	0	110.7	I132 F133 L134 L203 R204 E205	I132-K215 CarbonylContact C-O 3.58Å; I132-K215 WeakPolarHBondContact CA-O 3.42Å; F133-K215 HydrophobicContact CB-CB 4.5Å; F133-K215 PolarHBondContact N-O 3.09Å; F133-K215 PolarHBondContact O-N 3.21Å; L134-K215 HydrophobicContact CD1-CD 4.45Å; L134-K215 HydrophobicContact CD1-CG 4.12Å; L203-K215 HydrophobicContact CD1-CB 4.43Å; R204-K215 CarbonylContact O-C 3.54Å; R204-K215 WeakPolarHBondContact O-CA 3.31Å; E205-K215 HydrophobicContact CG-CD 4.26Å; E205-K215 HydrophobicContact CG-CG 4.14Å; E205-K215 WeakPolarHBondContact OE1-CD 3.43Å; E205-K215 WeakPolarHBondContact OE1-CE 3.49Å; E205-K215 IonicContact OE1-NZ 2.78Å; E205-K215 PolarHBondContact OE1-NZ 2.93Å
216	I	86.6	Confident	80.1	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	131.2	178.8	-56.4	-166	0	0	0	109.7	L130 E131 I132 I147 D151 L203 R204 I206	L130-I216 HydrophobicContact CB-CG2 4.2Å; L130-I216 HydrophobicContact CD2-CG2 4.1Å; E131-I216 CarbonylContact O-C 3.59Å; E131-I216 WeakPolarHBondContact O-CA 3.46Å; I132-I216 HydrophobicContact CB-CG1 4.5Å; I132-I216 HydrophobicContact CD1-CD1 4.05Å; I132-I216 HydrophobicContact CG1-CD1 4.13Å; I132-I216 HydrophobicContact CG1-CG1 4.06Å; I132-I216 HydrophobicContact CG1-CG2 4.43Å; I132-I216 HydrophobicContact CG2-CG1 4.14Å; I147-I216 HydrophobicContact CG2-CD1 3.97Å; D151-I216 HydrophobicContact CB-CD1 4.12Å; L203-I216 CarbonylContact C-O 3.59Å; L203-I216 WeakPolarHBondContact CA-O 3.35Å; R204-I216 PolarHBondContact N-O 2.95Å; R204-I216 PolarHBondContact O-N 3.16Å; I206-I216 HydrophobicContact CD1-CD1 3.53Å; I206-I216 HydrophobicContact CD1-CG1 4.18Å
217	I	86.5	Confident	79.6	Confident	41 Å²	41	67.6 Å²	67.6	21%	0.21	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	108.4	170.9	-54.8	-178.2	0	0	0	109.1	E131 F133 L203 R219	E131-I217 HydrophobicContact CB-CB 4.38Å; E131-I217 PolarHBondContact N-O 2.86Å; E131-I217 PolarHBondContact O-N 3.33Å; F133-I217 HydrophobicContact CD2-CD1 4.43Å; F133-I217 HydrophobicContact CD2-CG1 4.45Å; F133-I217 HydrophobicContact CE2-CB 4.43Å; F133-I217 HydrophobicContact CE2-CD1 3.72Å; F133-I217 HydrophobicContact CE2-CG1 3.95Å; F133-I217 HydrophobicContact CZ-CD1 4.44Å; L203-I217 HydrophobicContact CD1-CD1 4.3Å; L203-I217 HydrophobicContact CD1-CG1 3.71Å; I217-R219 HydrophobicContact CG2-CG 4.07Å
218	G	85.5	Confident	79	Confident	4 Å²	4	66.3 Å²	66.3	4%	0.041	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	120.2	173.4	0	0	0	0	0	112.2	S129 L201 G202	S129-G218 WeakPolarHBondContact O-CA 3.37Å; L201-G218 WeakPolarHBondContact CA-O 3.38Å; G202-G218 PolarHBondContact N-O 3.09Å; G202-G218 PolarHBondContact O-N 3.36Å
219	R	84.8	Confident	78.7	Confident	118 Å²	118	65 Å²	65	45%	0.445	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	143.5	175.9	-58.5	-169.5	-170.8	122.9	18.4	111.6	V128 S129 E131 I217	V128-R219 WeakPolarHBondContact CA-O 3.44Å; S129-R219 PolarHBondContact N-O 2.85Å; S129-R219 PolarHBondContact O-N 2.77Å; E131-R219 IonicContact OE1-CZ 3.34Å; E131-R219 IonicContact OE1-NH1 3.6Å; E131-R219 PolarHBondContact OE1-NH1 3.15Å; E131-R219 IonicContact OE1-NH2 3.37Å; E131-R219 IonicContact OE2-CZ 2.78Å; E131-R219 IonicContact OE2-NH1 2.76Å; E131-R219 PolarHBondContact OE2-NH1 3.44Å; E131-R219 IonicContact OE2-NH2 3.5Å; E131-R219 PolarHBondContact OE2-NH2 2.78Å; I217-R219 HydrophobicContact CG2-CG 4.07Å
220	K	85.2	Confident	78.5	Confident	35 Å²	35	60.3 Å²	60.3	15%	0.152	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	127.2	168.8	-167.2	70.5	160.6	179.2	0	109	C126 V128 L201 A222 S229 N232 W253	C126-K220 PolarHBondContact O-NZ 2.71Å; V128-K220 HydrophobicContact CG2-CD 3.98Å; L201-K220 HydrophobicContact CD1-CB 4.3Å; K220-A222 WeakPolarHBondContact CE-O 3.27Å; K220-S229 WeakPolarHBondContact CE-O 3.5Å; K220-S229 PolarHBondContact NZ-O 3.28Å; K220-N232 WeakPolarHBondContact CD-OD1 3.45Å; K220-N232 WeakPolarHBondContact CE-OD1 3.38Å; K220-N232 PolarHBondContact NZ-OD1 3.04Å; K220-W253 HydrophobicContact CB-CH2 3.94Å; K220-W253 HydrophobicContact CB-CZ2 3.56Å; K220-W253 HydrophobicContact CG-CD2 4.32Å; K220-W253 HydrophobicContact CG-CH2 4.16Å; K220-W253 HydrophobicContact CG-CZ2 3.69Å
221	I	81.5	Confident	78.6	Confident	125 Å²	125	59.6 Å²	59.6	64%	0.641	31%	0.313	S	S	*	.			trans	-105.6	-40.6	175.7	-62.9	-170.7	0	0	0	110.8	G127 S129	G127-I221 PolarHBondContact O-N 2.8Å; S129-I221 VanDerWaalsContact CB-CD1 3.45Å
222	A	78.1	Confident	78.7	Confident	40 Å²	40	56.9 Å²	56.9	33%	0.331	28%	0.284	S	S	.	.			trans	-141.9	155.4	-177.4	0	0	0	0	0	112.3	G127 K220	G127-A222 PolarHBondContact O-N 3.27Å; K220-A222 WeakPolarHBondContact CE-O 3.27Å
223	V	77.4	Confident	78.7	Confident	35 Å²	35	54.8 Å²	54.8	21%	0.212	27%	0.273	C	S	.	.			trans	-115.1	124.9	166	178.5	0	0	0	0	106.3	Q230 W253	V223-Q230 HydrophobicContact CG1-CG 4.09Å; V223-W253 HydrophobicContact CG2-CB 3.79Å; V223-W253 HydrophobicContact CG2-CD2 4.32Å; V223-W253 HydrophobicContact CG2-CG 3.96Å
224	N	74.1	Confident	78.7	Confident	54 Å²	54	55.9 Å²	55.9	29%	0.289	28%	0.276	S	S	.	.			trans	-95.7	-173	-176.6	-67.5	-4.9	0	0	0	110.2	E125 D226 S229	E125-N224 PolarHBondContact O-ND2 2.88Å; N224-D226 VanDerWaalsContact C-N 3.26Å; N224-D226 WeakPolarHBondContact CB-OD2 3.23Å; N224-S229 WeakPolarHBondContact CA-OG 3.43Å; N224-S229 PolarHBondContact N-OG 2.88Å; N224-S229 PolarHBondContact O-OG 3.45Å
225	K	72.6	Confident	78.3	Confident	150 Å²	150	56.8 Å²	56.8	65%	0.652	28%	0.281	S	S	*	.	S	Bend	trans	-72.8	-20.9	172.9	-71	-176.2	172.4	-176.6	0	112.8	Y256	K225-Y256 HydrophobicContact CD-CE1 4.13Å; K225-Y256 VanDerWaalsContact CE-OH 3.27Å; K225-Y256 WeakPolarHBondContact CE-OH 3.2Å; K225-Y256 HydrophobicContact CG-CD1 3.77Å; K225-Y256 HydrophobicContact CG-CE1 3.72Å; K225-Y256 HydrophobicContact CG-CG 4.36Å; K225-Y256 PolarHBondContact NZ-OH 2.78Å
226	D	71.4	Confident	77.8	Confident	89 Å²	89	55.8 Å²	55.8	48%	0.476	28%	0.28	S	S	.	.	S	Bend	trans	-68.9	132.6	-177.2	-47.2	-69.5	0	0	0	111.1	N224 Y228 S229	N224-D226 VanDerWaalsContact C-N 3.26Å; N224-D226 WeakPolarHBondContact CB-OD2 3.23Å; D226-Y228 VanDerWaalsContact C-N 3.26Å; D226-Y228 PolarHBondContact O-N 3.02Å; D226-S229 WeakPolarHBondContact O-CB 3.21Å; D226-S229 PolarHBondContact O-N 3.07Å; D226-S229 PolarHBondContact O-OG 3.24Å
227	P	69.7	Low	76.9	Confident	83 Å²	83	59.7 Å²	59.7	54%	0.539	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-61.4	-36.1	-176.4	24.5	-33.9	0	0	0	111.9	S229 Q230	P227-S229 PolarHBondContact O-N 3.37Å; P227-Q230 WeakPolarHBondContact O-CB 3.47Å; P227-Q230 PolarHBondContact O-N 3.25Å
228	Y	70.7	Confident	76.1	Confident	103 Å²	103	62 Å²	62	40%	0.404	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-61.9	-21.7	175.3	-53.5	-60.8	0	0	0	113.7	A193 F197 D226 Q230	A193-Y228 HydrophobicContact CB-CD2 3.91Å; A193-Y228 HydrophobicContact CB-CE2 3.92Å; F197-Y228 HydrophobicContact CD2-CD1 4.47Å; F197-Y228 AromaticContact CE2-CD1 3.47Å; F197-Y228 HydrophobicContact CE2-CD1 3.47Å; F197-Y228 VanDerWaalsContact CE2-CD1 3.47Å; F197-Y228 AromaticContact CE2-CE1 3.89Å; F197-Y228 HydrophobicContact CE2-CE1 3.89Å; F197-Y228 AromaticContact CZ-CD1 3.68Å; F197-Y228 HydrophobicContact CZ-CD1 3.68Å; F197-Y228 HydrophobicContact CZ-CE1 4.26Å; D226-Y228 VanDerWaalsContact C-N 3.26Å; D226-Y228 PolarHBondContact O-N 3.02Å; Y228-Q230 VanDerWaalsContact C-N 3.28Å
229	S	72.8	Confident	74.7	Confident	1 Å²	1	70.4 Å²	70.4	1%	0.007	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-79.9	-10	174.3	79.5	0	0	0	0	113.2	K220 N224 D226 P227	K220-S229 WeakPolarHBondContact CE-O 3.5Å; K220-S229 PolarHBondContact NZ-O 3.28Å; N224-S229 WeakPolarHBondContact CA-OG 3.43Å; N224-S229 PolarHBondContact N-OG 2.88Å; N224-S229 PolarHBondContact O-OG 3.45Å; D226-S229 WeakPolarHBondContact O-CB 3.21Å; D226-S229 PolarHBondContact O-N 3.07Å; D226-S229 PolarHBondContact O-OG 3.24Å; P227-S229 PolarHBondContact O-N 3.37Å
230	Q	71.1	Confident	73.1	Confident	57 Å²	57	70.8 Å²	70.8	27%	0.266	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-86.3	-7.4	178.3	-56.3	179.5	14.9	0	0	112.5	V223 P227 Y228 H252 W253	V223-Q230 HydrophobicContact CG1-CG 4.09Å; P227-Q230 WeakPolarHBondContact O-CB 3.47Å; P227-Q230 PolarHBondContact O-N 3.25Å; Y228-Q230 VanDerWaalsContact C-N 3.28Å; Q230-H252 CarbonylContact O-C 3.58Å; Q230-H252 WeakPolarHBondContact O-CA 3.35Å; Q230-W253 PolarHBondContact O-N 2.98Å
231	E	74.9	Confident	71.5	Confident	68 Å²	68	72.2 Å²	72.2	32%	0.318	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	133.1	-177.9	-65	-169.4	-179.6	0	0	111.6	F197 I251 H252	F197-E231 HydrophobicContact CD1-CB 4.39Å; F197-E231 HydrophobicContact CE1-CB 3.78Å; E231-I251 WeakPolarHBondContact CA-O 3.35Å; E231-H252 VanDerWaalsContact CD-CE1 3.43Å; E231-H252 VanDerWaalsContact CD-ND1 3.32Å; E231-H252 WeakPolarHBondContact CG-ND1 3.42Å; E231-H252 IonicContact OE1-CE1 3.13Å; E231-H252 PolarHBondContact OE1-CE1 2.98Å; E231-H252 IonicContact OE1-ND1 3.32Å; E231-H252 PolarHBondContact OE1-ND1 3.32Å; E231-H252 IonicContact OE2-CE1 3.66Å
232	N	79.3	Confident	70.2	Confident	5 Å²	5	71.3 Å²	71.3	3%	0.027	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	145.7	173.1	-75.4	111.2	0	0	0	111.1	L201 K220 I251 W253	L201-N232 HydrophobicContact CD1-CB 3.69Å; L201-N232 HydrophobicContact CG-CB 4.07Å; K220-N232 WeakPolarHBondContact CD-OD1 3.45Å; K220-N232 WeakPolarHBondContact CE-OD1 3.38Å; K220-N232 PolarHBondContact NZ-OD1 3.04Å; N232-I251 PolarHBondContact N-O 2.99Å; N232-I251 PolarHBondContact O-N 3.43Å; N232-W253 PolarHBondContact OD1-NE1 3.19Å
233	I	79.2	Confident	68.8	Low	28 Å²	28	75.1 Å²	75.1	14%	0.144	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	123.3	172.3	-58.3	174.3	0	0	0	108.4	K200 L201 N248 I249	K200-I233 CarbonylContact C-O 3.59Å; K200-I233 WeakPolarHBondContact CA-O 3.37Å; K200-I233 HydrophobicContact CG-CB 4.39Å; K200-I233 HydrophobicContact CG-CG2 4.41Å; L201-I233 PolarHBondContact N-O 2.88Å; I233-N248 HydrophobicContact CG2-CB 3.79Å; I233-I249 WeakPolarHBondContact CA-O 3.49Å
234	M	81.6	Confident	68	Low	70 Å²	70	79.5 Å²	79.5	35%	0.345	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	130.1	171.6	177.3	161.5	156.4	0	0	109.9	L201 V236 I249 I251	L201-M234 HydrophobicContact CB-CB 4.05Å; L201-M234 HydrophobicContact CB-CG 4.24Å; M234-V236 HydrophobicContact CE-CG2 3.87Å; M234-V236 HydrophobicContact CG-CG2 4.12Å; M234-I249 PolarHBondContact N-O 2.81Å; M234-I249 PolarHBondContact O-N 2.81Å; M234-I251 HydrophobicContact CB-CD1 3.58Å; M234-I251 HydrophobicContact CB-CG1 4.24Å; M234-I251 HydrophobicContact CG-CD1 4.32Å; M234-I251 HydrophobicContact SD-CD1 3.83Å
235	L	75.6	Confident	67.5	Low	20 Å²	20	82.1 Å²	82.1	11%	0.105	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	127.6	169.6	-82.3	160.5	0	0	0	109.6	K200 L201 R204 N248	K200-L235 HydrophobicContact CB-CD1 4.24Å; K200-L235 HydrophobicContact CD-CD1 3.41Å; K200-L235 VanDerWaalsContact CD-CD1 3.41Å; K200-L235 HydrophobicContact CD-CG 3.94Å; K200-L235 HydrophobicContact CG-CD1 4.44Å; L201-L235 PolarHBondContact O-N 3.36Å; R204-L235 HydrophobicContact CG-CD1 4.1Å; L235-N248 WeakPolarHBondContact CD2-OD1 3.45Å
236	V	75	Confident	67.3	Low	46 Å²	46	79.2 Å²	79.2	28%	0.279	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	125	174.3	-178	0	0	0	0	109.3	M234 K238 E247 I249	M234-V236 HydrophobicContact CE-CG2 3.87Å; M234-V236 HydrophobicContact CG-CG2 4.12Å; V236-K238 PolarHBondContact O-N 3.15Å; V236-E247 PolarHBondContact N-O 3.34Å; V236-E247 PolarHBondContact O-N 2.86Å; V236-I249 HydrophobicContact CB-CD1 4.23Å; V236-I249 HydrophobicContact CG2-CD1 3.57Å; V236-I249 HydrophobicContact CG2-CG1 4.09Å
237	P	68.8	Low	67.6	Low	82 Å²	82	79.7 Å²	79.7	53%	0.532	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	119.4	173.1	29.7	-32.5	0	0	0	109.7	I244	P237-I244 HydrophobicContact CB-CG2 3.99Å
238	K	69.4	Low	68.1	Low	88 Å²	88	79.8 Å²	79.8	38%	0.383	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	119.2	178.6	-161	176.3	-161.9	156.1	0	108.9	V236 D240 D245 E247	V236-K238 PolarHBondContact O-N 3.15Å; K238-D240 WeakPolarHBondContact CD-OD2 3.06Å; K238-D240 WeakPolarHBondContact CE-OD2 3.47Å; K238-D240 WeakPolarHBondContact CG-OD2 3.47Å; K238-D240 PolarHBondContact O-N 3.02Å; K238-D245 PolarHBondContact N-O 2.84Å; K238-E247 WeakPolarHBondContact CD-OE2 2.96Å; K238-E247 WeakPolarHBondContact CE-OE2 3.47Å; K238-E247 IonicContact NZ-OE2 3.47Å; K238-E247 PolarHBondContact NZ-OE2 2.91Å
239	K	56.2	Low	68.5	Low	181 Å²	181	78.7 Å²	78.7	79%	0.787	44%	0.436	S	S	*	.			trans	-96.1	57.5	-177.9	-78.1	-165.5	170.5	-172.2	0	112.4	G241	K239-G241 PolarHBondContact O-N 3.34Å
240	D	51.4	Low	68.9	Low	127 Å²	127	84.1 Å²	84.1	68%	0.679	46%	0.461	S	S	*	.	S	Bend	trans	-92.9	69.8	174.1	-67.6	-24.6	0	0	0	110.2	K238	K238-D240 WeakPolarHBondContact CD-OD2 3.06Å; K238-D240 WeakPolarHBondContact CE-OD2 3.47Å; K238-D240 WeakPolarHBondContact CG-OD2 3.47Å; K238-D240 PolarHBondContact O-N 3.02Å
241	G	50.4	Low	69.4	Low	65 Å²	65	83.6 Å²	83.6	67%	0.67	46%	0.46	S	S	*	.	S	Bend	trans	93.7	-146.8	178.9	0	0	0	0	0	114.5	K239	K239-G241 PolarHBondContact O-N 3.34Å
242	A	53.7	Low	69.6	Low	106 Å²	106	86.4 Å²	86.4	88%	0.876	47%	0.473	S	S	*	.	S	Bend	trans	-84.4	-13.8	-169.1	0	0	0	0	0	115
243	N	50.3	Low	69.7	Low	119 Å²	119	90.7 Å²	90.7	64%	0.636	49%	0.489	S	S	*	.	S	Bend	trans	-91.5	141.3	172.3	-76.3	-5	0	0	0	110.1
244	I	58.9	Low	69.6	Low	127 Å²	127	94.3 Å²	94.3	65%	0.651	51%	0.508	S	S	*	.			trans	-101.2	79.5	174.9	-52.8	175.8	0	0	0	108	P237	P237-I244 HydrophobicContact CB-CG2 3.99Å
245	D	64.1	Low	69.2	Low	110 Å²	110	93.9 Å²	93.9	59%	0.588	51%	0.51	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.6	147.8	171.2	-71.6	-23.2	0	0	0	109.9	K238	K238-D245 PolarHBondContact N-O 2.84Å
246	T	68.6	Low	68.9	Low	89 Å²	89	98.1 Å²	98.1	55%	0.546	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	125.1	-178	59	0	0	0	0	111.1
247	E	77.7	Confident	68.8	Low	99 Å²	99	101 Å²	101	46%	0.463	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	134.8	-176.8	-159.9	165.6	159.9	0	0	110.1	V236 K238	V236-E247 PolarHBondContact N-O 3.34Å; V236-E247 PolarHBondContact O-N 2.86Å; K238-E247 WeakPolarHBondContact CD-OE2 2.96Å; K238-E247 WeakPolarHBondContact CE-OE2 3.47Å; K238-E247 IonicContact NZ-OE2 3.47Å; K238-E247 PolarHBondContact NZ-OE2 2.91Å
248	N	79.7	Confident	68.8	Low	84 Å²	84	102.9 Å²	102.9	45%	0.449	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	108	178.4	-68.8	-63.8	0	0	0	109.6	I233 L235	I233-N248 HydrophobicContact CG2-CB 3.79Å; L235-N248 WeakPolarHBondContact CD2-OD1 3.45Å
249	I	79.5	Confident	68.6	Low	81 Å²	81	106.5 Å²	106.5	42%	0.415	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.5	120.7	174.6	-55.4	-172.3	0	0	0	109.3	I233 M234 V236 I251	I233-I249 WeakPolarHBondContact CA-O 3.49Å; M234-I249 PolarHBondContact N-O 2.81Å; M234-I249 PolarHBondContact O-N 2.81Å; V236-I249 HydrophobicContact CB-CD1 4.23Å; V236-I249 HydrophobicContact CG2-CD1 3.57Å; V236-I249 HydrophobicContact CG2-CG1 4.09Å; I249-I251 HydrophobicContact CG2-CG1 4.35Å; I249-I251 PolarHBondContact O-N 2.86Å
250	H	82.2	Confident	68.9	Low	114 Å²	114	104.6 Å²	104.6	53%	0.528	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	118.4	169.8	-76.2	-110.2	0	0	0	109.9
251	I	80	Confident	69.5	Low	46 Å²	46	102.3 Å²	102.3	24%	0.236	54%	0.539	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	110.3	176.5	-58.6	-178.5	0	0	0	108.3	E231 N232 M234 I249 W253	E231-I251 WeakPolarHBondContact CA-O 3.35Å; N232-I251 PolarHBondContact N-O 2.99Å; N232-I251 PolarHBondContact O-N 3.43Å; M234-I251 HydrophobicContact CB-CD1 3.58Å; M234-I251 HydrophobicContact CB-CG1 4.24Å; M234-I251 HydrophobicContact CG-CD1 4.32Å; M234-I251 HydrophobicContact SD-CD1 3.83Å; I249-I251 HydrophobicContact CG2-CG1 4.35Å; I249-I251 PolarHBondContact O-N 2.86Å; I251-W253 HydrophobicContact CG2-CD2 4.19Å; I251-W253 HydrophobicContact CG2-CG 4.46Å; I251-W253 HydrophobicContact CG2-CZ2 4.06Å
252	H	80.9	Confident	70.3	Confident	128 Å²	128	105.2 Å²	105.2	59%	0.593	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	112.6	165.3	-57.7	-92	0	0	0	108.6	Q230 E231	Q230-H252 CarbonylContact O-C 3.58Å; Q230-H252 WeakPolarHBondContact O-CA 3.35Å; E231-H252 VanDerWaalsContact CD-CE1 3.43Å; E231-H252 VanDerWaalsContact CD-ND1 3.32Å; E231-H252 WeakPolarHBondContact CG-ND1 3.42Å; E231-H252 IonicContact OE1-CE1 3.13Å; E231-H252 PolarHBondContact OE1-CE1 2.98Å; E231-H252 IonicContact OE1-ND1 3.32Å; E231-H252 PolarHBondContact OE1-ND1 3.32Å; E231-H252 IonicContact OE2-CE1 3.66Å
253	W	79.9	Confident	71	Confident	94 Å²	94	104.8 Å²	104.8	36%	0.356	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-76.2	152.9	171.7	-60.9	92.7	0	0	0	110.5	L201 K220 V223 Q230 N232 I251	L201-W253 HydrophobicContact CD1-CZ2 4.07Å; K220-W253 HydrophobicContact CB-CH2 3.94Å; K220-W253 HydrophobicContact CB-CZ2 3.56Å; K220-W253 HydrophobicContact CG-CD2 4.32Å; K220-W253 HydrophobicContact CG-CH2 4.16Å; K220-W253 HydrophobicContact CG-CZ2 3.69Å; V223-W253 HydrophobicContact CG2-CB 3.79Å; V223-W253 HydrophobicContact CG2-CD2 4.32Å; V223-W253 HydrophobicContact CG2-CG 3.96Å; Q230-W253 PolarHBondContact O-N 2.98Å; N232-W253 PolarHBondContact OD1-NE1 3.19Å; I251-W253 HydrophobicContact CG2-CD2 4.19Å; I251-W253 HydrophobicContact CG2-CG 4.46Å; I251-W253 HydrophobicContact CG2-CZ2 4.06Å
254	L	77.6	Confident	71.6	Confident	104 Å²	104	100 Å²	100	55%	0.545	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-70.2	146.5	174.5	-68.4	156.3	0	0	0	109.9	Y258	L254-Y258 HydrophobicContact CB-CD1 4.03Å; L254-Y258 HydrophobicContact CB-CG 4.01Å; L254-Y258 HydrophobicContact CD1-CD1 3.72Å; L254-Y258 HydrophobicContact CD1-CE1 3.77Å; L254-Y258 HydrophobicContact CD1-CG 4.43Å; L254-Y258 HydrophobicContact CD2-CD1 4.08Å; L254-Y258 HydrophobicContact CD2-CD2 4.09Å; L254-Y258 HydrophobicContact CD2-CE1 4.15Å; L254-Y258 HydrophobicContact CD2-CE2 4.14Å; L254-Y258 HydrophobicContact CD2-CG 4.06Å; L254-Y258 HydrophobicContact CG-CD1 4.15Å; L254-Y258 HydrophobicContact CG-CE1 4.45Å; L254-Y258 HydrophobicContact CG-CG 4.39Å
255	P	73.2	Confident	72.3	Confident	61 Å²	61	95 Å²	95	40%	0.396	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-55.1	150.6	177.3	-26.3	34.7	0	0	0	112.3	D257 Y258	P255-D257 PolarHBondContact O-N 3.03Å; P255-D257 VanDerWaalsContact O-N 3.13Å; P255-Y258 WeakPolarHBondContact O-CB 3.43Å; P255-Y258 PolarHBondContact O-N 3.49Å
256	Y	68.8	Low	72.8	Confident	109 Å²	109	98 Å²	98	43%	0.427	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-25.3	-174.3	104.4	-71.1	0	0	0	113.6	K225 Y258	K225-Y256 HydrophobicContact CD-CE1 4.13Å; K225-Y256 VanDerWaalsContact CE-OH 3.27Å; K225-Y256 WeakPolarHBondContact CE-OH 3.2Å; K225-Y256 HydrophobicContact CG-CD1 3.77Å; K225-Y256 HydrophobicContact CG-CE1 3.72Å; K225-Y256 HydrophobicContact CG-CG 4.36Å; K225-Y256 PolarHBondContact NZ-OH 2.78Å; Y256-Y258 VanDerWaalsContact C-N 3.27Å; Y256-Y258 PolarHBondContact O-N 3.48Å
257	D	72.8	Confident	73.1	Confident	106 Å²	106	99.4 Å²	99.4	57%	0.567	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-3.4	172.3	-57.1	-71.4	0	0	0	113.8	P255 H259	P255-D257 PolarHBondContact O-N 3.03Å; P255-D257 VanDerWaalsContact O-N 3.13Å; D257-H259 PolarHBondContact O-N 3.03Å
258	Y	69.6	Low	73.1	Confident	122 Å²	122	97.5 Å²	97.5	48%	0.478	47%	0.47	S	S	.	.			trans	-79.6	109.3	-174	-172.8	-85.1	0	0	0	112.3	L254 P255 Y256	L254-Y258 HydrophobicContact CB-CD1 4.03Å; L254-Y258 HydrophobicContact CB-CG 4.01Å; L254-Y258 HydrophobicContact CD1-CD1 3.72Å; L254-Y258 HydrophobicContact CD1-CE1 3.77Å; L254-Y258 HydrophobicContact CD1-CG 4.43Å; L254-Y258 HydrophobicContact CD2-CD1 4.08Å; L254-Y258 HydrophobicContact CD2-CD2 4.09Å; L254-Y258 HydrophobicContact CD2-CE1 4.15Å; L254-Y258 HydrophobicContact CD2-CE2 4.14Å; L254-Y258 HydrophobicContact CD2-CG 4.06Å; L254-Y258 HydrophobicContact CG-CD1 4.15Å; L254-Y258 HydrophobicContact CG-CE1 4.45Å; L254-Y258 HydrophobicContact CG-CG 4.39Å; P255-Y258 WeakPolarHBondContact O-CB 3.43Å; P255-Y258 PolarHBondContact O-N 3.49Å; Y256-Y258 VanDerWaalsContact C-N 3.27Å; Y256-Y258 PolarHBondContact O-N 3.48Å
259	H	64.2	Low	72.7	Confident	164 Å²	164	99.3 Å²	99.3	76%	0.759	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-93.6	118.5	173.2	-59.8	-25.4	0	0	0	111.6	D257	D257-H259 PolarHBondContact O-N 3.03Å
260	K	63.8	Low	72.5	Confident	142 Å²	142	102.7 Å²	102.7	62%	0.617	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-64.6	126.6	174.1	-172.4	179	-176.9	178.9	0	109.8	F262	K260-F262 PolarHBondContact O-N 2.74Å
261	P	64.3	Low	72.4	Confident	79 Å²	79	100.9 Å²	100.9	51%	0.513	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-64.9	133.3	-178.8	25.6	-33.9	0	0	0	111.3	L263	P261-L263 PolarHBondContact O-N 2.79Å; P261-L263 VanDerWaalsContact O-N 3.13Å
262	F	67.3	Low	72.1	Confident	125 Å²	125	103.6 Å²	103.6	55%	0.548	51%	0.514	S	S	.	.			trans	-77.5	98.1	177.4	-175.7	-94.5	0	0	0	110.4	K260 G264 G265 I274 H276	K260-F262 PolarHBondContact O-N 2.74Å; F262-G264 VanDerWaalsContact C-N 3.35Å; F262-G265 VanDerWaalsContact CZ-N 3.28Å; F262-G265 WeakPolarHBondContact CZ-O 3.34Å; F262-I274 HydrophobicContact CD2-CG2 3.86Å; F262-I274 HydrophobicContact CE2-CG2 3.73Å; F262-H276 AromaticContact CD2-CE1 3.78Å; F262-H276 AromaticContact CD2-ND1 3.81Å
263	L	66.8	Low	71.7	Confident	97 Å²	97	100.3 Å²	100.3	51%	0.508	50%	0.504	S	S	.	.	S	Bend	trans	-86.7	-5.2	176.5	-61.7	176.9	0	0	0	113.6	P261 A278 A280	P261-L263 PolarHBondContact O-N 2.79Å; P261-L263 VanDerWaalsContact O-N 3.13Å; L263-A278 HydrophobicContact CB-CB 4.19Å; L263-A280 HydrophobicContact CD1-CB 4.08Å
264	G	64.6	Low	71.3	Confident	18 Å²	18	100.2 Å²	100.2	19%	0.186	51%	0.51	C	S	.	.	S	Bend	trans	144.5	147	-170.3	0	0	0	0	0	110.6	F262 H276 N277	F262-G264 VanDerWaalsContact C-N 3.35Å; G264-H276 WeakPolarHBondContact O-CA 3.43Å; G264-N277 PolarHBondContact O-N 3.44Å; G264-N277 PolarHBondContact O-OD1 3.18Å
265	G	73.9	Confident	71.2	Confident	24 Å²	24	101.5 Å²	101.5	25%	0.247	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.7	178.1	178.1	0	0	0	0	0	114.1	F262 Y275 N277	F262-G265 VanDerWaalsContact CZ-N 3.28Å; F262-G265 WeakPolarHBondContact CZ-O 3.34Å; G265-Y275 CarbonylContact C-O 3.59Å; G265-Y275 WeakPolarHBondContact CA-O 3.32Å; G265-N277 VanDerWaalsContact CA-OD1 3.28Å; G265-N277 WeakPolarHBondContact CA-OD1 3.42Å; G265-N277 PolarHBondContact N-OD1 2.76Å
266	Y	72.6	Confident	71	Confident	171 Å²	171	102.2 Å²	102.2	67%	0.671	51%	0.507	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113	141.3	174.2	-59.5	-74.9	0	0	0	110	Y275	Y266-Y275 PolarHBondContact N-O 3.45Å; Y266-Y275 PolarHBondContact O-N 2.79Å
267	K	76.1	Confident	71.1	Confident	120 Å²	120	102.1 Å²	102.1	52%	0.522	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	122.1	171.7	-175.7	179.8	177.6	-172	0	109.6	T269 N272 C273 I274	K267-T269 PolarHBondContact O-N 3.06Å; K267-N272 WeakPolarHBondContact CE-O 3.31Å; K267-N272 WeakPolarHBondContact CE-OD1 3.27Å; K267-N272 PolarHBondContact NZ-OD1 3.5Å; K267-C273 WeakPolarHBondContact CA-O 3.23Å; K267-I274 HydrophobicContact CB-CG1 4.44Å; K267-I274 HydrophobicContact CD-CG1 4.32Å; K267-I274 HydrophobicContact CG-CG1 4.08Å
268	N	76.4	Confident	70.6	Confident	59 Å²	59	99 Å²	99	32%	0.316	50%	0.502	S	S	.	.			trans	-71.8	121.1	168.4	-179.1	-30.1	0	0	0	108.4	I270 T271 N272 C273 Y275	N268-I270 VanDerWaalsContact C-N 3.32Å; N268-I270 PolarHBondContact O-N 2.87Å; N268-I270 PolarHBondContact OD1-N 3.23Å; N268-T271 WeakPolarHBondContact CB-OG1 3.42Å; N268-T271 PolarHBondContact ND2-OG1 2.91Å; N268-T271 PolarHBondContact OD1-N 3.3Å; N268-T271 VanDerWaalsContact OD1-N 3.16Å; N268-N272 CarbonylContact O-C 3.42Å; N268-N272 WeakPolarHBondContact O-CA 3.43Å; N268-N272 PolarHBondContact O-N 3.4Å; N268-C273 PolarHBondContact N-O 2.84Å; N268-Y275 HydrophobicContact CB-CE2 3.91Å
269	T	72.4	Confident	70.4	Confident	122 Å²	122	98.8 Å²	98.8	75%	0.748	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-25.9	-176	48	0	0	0	0	113.3	K267	K267-T269 PolarHBondContact O-N 3.06Å
270	I	75.9	Confident	70.3	Confident	152 Å²	152	94 Å²	94	78%	0.779	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-45.7	-177.1	-56.1	175.4	0	0	0	110.4	N268	N268-I270 VanDerWaalsContact C-N 3.32Å; N268-I270 PolarHBondContact O-N 2.87Å; N268-I270 PolarHBondContact OD1-N 3.23Å
271	T	79	Confident	70.2	Confident	75 Å²	75	97 Å²	97	46%	0.46	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-4.7	-177.8	65.7	0	0	0	0	114	N268 C273	N268-T271 WeakPolarHBondContact CB-OG1 3.42Å; N268-T271 PolarHBondContact ND2-OG1 2.91Å; N268-T271 PolarHBondContact OD1-N 3.3Å; N268-T271 VanDerWaalsContact OD1-N 3.16Å; T271-C273 PolarHBondContact O-N 3.19Å; T271-C273 WeakPolarHBondContact OG1-CB 2.87Å; T271-C273 PolarHBondContact OG1-N 3.32Å; T271-C273 PolarHBondContact OG1-SG 2.66Å
272	N	73.3	Confident	69.5	Low	103 Å²	103	98.9 Å²	98.9	55%	0.551	53%	0.534	S	S	*	.			trans	57.9	-2.4	-168.4	-87.5	-61.3	0	0	0	116.1	K267 N268 I274	K267-N272 WeakPolarHBondContact CE-O 3.31Å; K267-N272 WeakPolarHBondContact CE-OD1 3.27Å; K267-N272 PolarHBondContact NZ-OD1 3.5Å; N268-N272 CarbonylContact O-C 3.42Å; N268-N272 WeakPolarHBondContact O-CA 3.43Å; N268-N272 PolarHBondContact O-N 3.4Å; N272-I274 PolarHBondContact O-N 3.4Å
273	C	74.1	Confident	68.8	Low	59 Å²	59	102.6 Å²	102.6	40%	0.399	55%	0.55	S	S	.	.			trans	-60.7	134	-178.4	-59.3	0	0	0	0	112.2	K267 N268 T271 Y275	K267-C273 WeakPolarHBondContact CA-O 3.23Å; N268-C273 PolarHBondContact N-O 2.84Å; T271-C273 PolarHBondContact O-N 3.19Å; T271-C273 WeakPolarHBondContact OG1-CB 2.87Å; T271-C273 PolarHBondContact OG1-N 3.32Å; T271-C273 PolarHBondContact OG1-SG 2.66Å; C273-Y275 HydrophobicContact CB-CD2 4.42Å; C273-Y275 HydrophobicContact CB-CE2 3.68Å
274	I	70.9	Confident	68.3	Low	92 Å²	92	103.5 Å²	103.5	47%	0.472	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.8	111.7	177.8	-58.3	174.6	0	0	0	108.8	F262 K267 N272	F262-I274 HydrophobicContact CD2-CG2 3.86Å; F262-I274 HydrophobicContact CE2-CG2 3.73Å; K267-I274 HydrophobicContact CB-CG1 4.44Å; K267-I274 HydrophobicContact CD-CG1 4.32Å; K267-I274 HydrophobicContact CG-CG1 4.08Å; N272-I274 PolarHBondContact O-N 3.4Å
275	Y	74.6	Confident	67.9	Low	132 Å²	132	110.3 Å²	110.3	52%	0.518	59%	0.592	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.5	99.2	178.7	-60.7	-93.5	0	0	0	109.1	G265 Y266 N268 C273 N277	G265-Y275 CarbonylContact C-O 3.59Å; G265-Y275 WeakPolarHBondContact CA-O 3.32Å; Y266-Y275 PolarHBondContact N-O 3.45Å; Y266-Y275 PolarHBondContact O-N 2.79Å; N268-Y275 HydrophobicContact CB-CE2 3.91Å; C273-Y275 HydrophobicContact CB-CD2 4.42Å; C273-Y275 HydrophobicContact CB-CE2 3.68Å; Y275-N277 PolarHBondContact O-N 3.5Å
276	H	68.7	Low	66.9	Low	76 Å²	76	120.8 Å²	120.8	35%	0.352	62%	0.624	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-70.4	122	174.9	-64.7	-88.8	0	0	0	110.7	F262 G264	F262-H276 AromaticContact CD2-CE1 3.78Å; F262-H276 AromaticContact CD2-ND1 3.81Å; G264-H276 WeakPolarHBondContact O-CA 3.43Å
277	N	71.8	Confident	66	Low	106 Å²	106	123.9 Å²	123.9	57%	0.567	64%	0.635	S	S	*	*			trans	-104.6	-8.3	176.6	72.3	-22.8	0	0	0	113.7	G264 G265 Y275	G264-N277 PolarHBondContact O-N 3.44Å; G264-N277 PolarHBondContact O-OD1 3.18Å; G265-N277 VanDerWaalsContact CA-OD1 3.28Å; G265-N277 WeakPolarHBondContact CA-OD1 3.42Å; G265-N277 PolarHBondContact N-OD1 2.76Å; Y275-N277 PolarHBondContact O-N 3.5Å
278	A	62.5	Low	65.1	Low	41 Å²	41	127.7 Å²	127.7	34%	0.339	65%	0.651	S	S	.	*			trans	-117.7	137.1	-178.6	0	0	0	0	0	111.7	L263	L263-A278 HydrophobicContact CB-CB 4.19Å
279	S	65.2	Low	64.1	Low	118 Å²	118	136.8 Å²	136.8	83%	0.825	68%	0.681	S	S	*	*			trans	-134.1	145.7	171.2	58.3	0	0	0	0	109.7
280	A	61.7	Low	63.3	Low	64 Å²	64	136.8 Å²	136.8	53%	0.529	68%	0.676	S	S	.	*			trans	-135.6	127.8	176.6	0	0	0	0	0	109.5	L263 T282	L263-A280 HydrophobicContact CD1-CB 4.08Å; A280-T282 VanDerWaalsContact C-N 3.33Å
281	Q	61.6	Low	62.9	Low	204 Å²	204	134.1 Å²	134.1	95%	0.953	69%	0.686	S	S	*	*	S	Bend	trans	-81.3	-15.2	179.2	-167.8	172	-3.9	0	0	112.5
282	T	49.4	Very low	62.4	Low	118 Å²	118	134 Å²	134	72%	0.724	69%	0.692	S	S	*	*	S	Bend	trans	-110.3	146.8	-178.9	49.9	0	0	0	0	111.8	A280	A280-T282 VanDerWaalsContact C-N 3.33Å
283	K	52.9	Low	61.9	Low	203 Å²	203	134.4 Å²	134.4	88%	0.883	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-76.9	135.4	175.2	-65.9	176.5	-177.9	173.3	0	109.4
284	P	56.6	Low	61.5	Low	116 Å²	116	139.3 Å²	139.3	75%	0.753	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-64.9	143.7	-178.9	26.3	-34.6	0	0	0	112	R286	P284-R286 PolarHBondContact O-N 3.25Å
285	I	55.4	Low	61.6	Low	162 Å²	162	140.9 Å²	140.9	83%	0.831	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-62.1	127	178.5	-58.9	175	0	0	0	109.3	R287	I285-R287 PolarHBondContact O-N 2.88Å
286	R	53.1	Low	61.5	Low	243 Å²	243	139.4 Å²	139.4	92%	0.917	74%	0.744	S	S	*	*			trans	-65.6	101.9	176.6	-74.6	-176	171.8	-174.1	-2.2	110.4	P284 K288	P284-R286 PolarHBondContact O-N 3.25Å; R286-K288 PolarHBondContact O-N 3.42Å
287	R	54.3	Low	61.3	Low	237 Å²	237	146 Å²	146	89%	0.894	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-56.6	135.2	168.4	-66.3	-176.9	178	-179	-1.1	109.6	I285	I285-R287 PolarHBondContact O-N 2.88Å
288	K	58.2	Low	61.2	Low	199 Å²	199	148 Å²	148	87%	0.865	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-61.2	136.4	173.4	-68.2	179.6	179.8	175.8	0	108.9	R286 L290	R286-K288 PolarHBondContact O-N 3.42Å; K288-L290 PolarHBondContact O-N 3.07Å
289	R	54.3	Low	61.7	Low	251 Å²	251	150.2 Å²	150.2	95%	0.947	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-69.1	116.7	170.5	-71.4	-173	178.9	-171.7	-0.1	108.5
290	L	56.8	Low	62.2	Low	122 Å²	122	153.2 Å²	153.2	64%	0.639	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-69.5	144.2	167.3	-66.7	169.9	0	0	0	109	K288 A292	K288-L290 PolarHBondContact O-N 3.07Å; L290-A292 PolarHBondContact O-N 3.17Å
291	G	67.4	Low	62.8	Low	95 Å²	95	157 Å²	157	98%	0.979	80%	0.803	S	S	*	*	S	Bend	trans	-72.6	-6.1	-172	0	0	0	0	0	115.6
292	A	66.8	Low	63.7	Low	73 Å²	73	155.2 Å²	155.2	60%	0.603	79%	0.789	S	S	*	*	S	Bend	trans	-129.8	147.5	177.4	0	0	0	0	0	110	L290 Q294	L290-A292 PolarHBondContact O-N 3.17Å; A292-Q294 PolarHBondContact O-N 3.42Å
293	S	64.2	Low	65	Low	112 Å²	112	159.5 Å²	159.5	78%	0.783	79%	0.792	S	S	*	*			trans	-71.5	107.2	174.5	-170	0	0	0	0	109.7
294	Q	64.8	Low	66.3	Low	162 Å²	162	155.1 Å²	155.1	76%	0.757	78%	0.776	S	S	*	*			trans	-86.4	115.5	168.3	-71.7	-176.1	-35.3	0	0	109	A292	A292-Q294 PolarHBondContact O-N 3.42Å
295	T	72.7	Confident	67.5	Low	124 Å²	124	156 Å²	156	76%	0.761	77%	0.769	S	S	*	*			trans	-107.5	118.6	174	44.2	0	0	0	0	110.1
296	S	72.8	Confident	68.9	Low	102 Å²	102	156.3 Å²	156.3	71%	0.713	77%	0.767	S	S	*	*			trans	-85.9	154.7	158.8	56.4	0	0	0	0	109.6
297	R	64.4	Low	70.4	Confident	214 Å²	214	153.6 Å²	153.6	81%	0.808	76%	0.762	S	S	*	*			trans	-135.8	86.3	169.3	-166	-168.4	86.8	153.9	2.8	109.9	T299	R297-T299 PolarHBondContact O-N 3.03Å
298	D	70.5	Confident	71.7	Confident	147 Å²	147	146.3 Å²	146.3	79%	0.786	76%	0.761	S	S	*	*			trans	-65.7	130.7	177.7	-53.8	-28.4	0	0	0	109.7
299	T	71.7	Confident	73	Confident	89 Å²	89	142.3 Å²	142.3	55%	0.546	76%	0.758	S	S	.	*			trans	-124	116	174.1	52.6	0	0	0	0	109.1	R297 T301	R297-T299 PolarHBondContact O-N 3.03Å; T299-T301 PolarHBondContact O-N 3.24Å; T299-T301 VanDerWaalsContact O-N 3.07Å
300	Q	76.1	Confident	74.5	Confident	180 Å²	180	138.9 Å²	138.9	84%	0.841	76%	0.755	S	S	*	*			trans	-66.4	107.7	176	-173.3	178.6	9.9	0	0	110.2	Y302	Q300-Y302 PolarHBondContact O-N 3.13Å
301	T	75.9	Confident	75.8	Confident	144 Å²	144	138.7 Å²	138.7	88%	0.883	76%	0.759	S	S	*	*			trans	-69.7	98	176	-40	0	0	0	0	109.5	T299	T299-T301 PolarHBondContact O-N 3.24Å; T299-T301 VanDerWaalsContact O-N 3.07Å
302	Y	79.9	Confident	76.8	Confident	166 Å²	166	140 Å²	140	65%	0.651	75%	0.747	S	S	*	*			trans	-115.3	151.8	176.9	91.7	-81.1	0	0	0	111.4	Q300 M304	Q300-Y302 PolarHBondContact O-N 3.13Å; Y302-M304 HydrophobicContact CE1-CG 4.26Å; Y302-M304 HydrophobicContact CE2-CB 4.45Å; Y302-M304 HydrophobicContact CE2-CG 3.57Å; Y302-M304 VanDerWaalsContact CZ-CG 3.43Å; Y302-M304 WeakPolarHBondContact OH-CG 3.44Å
303	R	75.8	Confident	77.6	Confident	208 Å²	208	143.5 Å²	143.5	79%	0.785	76%	0.756	S	S	*	*			trans	-91.9	111.8	178.1	-169.6	175	-175.8	164.2	3.6	109.8	H305	R303-H305 WeakPolarHBondContact CD-NE2 3.2Å; R303-H305 PolarHBondContact O-CD2 3.27Å
304	M	80.9	Confident	78.6	Confident	111 Å²	111	146.5 Å²	146.5	55%	0.547	76%	0.758	S	S	.	*			trans	-66.6	132.3	170.7	-79.3	167.7	46.5	0	0	110.9	Y302 H306	Y302-M304 HydrophobicContact CE1-CG 4.26Å; Y302-M304 HydrophobicContact CE2-CB 4.45Å; Y302-M304 HydrophobicContact CE2-CG 3.57Å; Y302-M304 VanDerWaalsContact CZ-CG 3.43Å; Y302-M304 WeakPolarHBondContact OH-CG 3.44Å; M304-H306 WeakPolarHBondContact CE-NE2 3.27Å
305	H	82.6	Confident	79.6	Confident	134 Å²	134	147.1 Å²	147.1	62%	0.62	76%	0.763	S	S	*	*			trans	-124.6	123.8	169.1	-76.3	-98	0	0	0	108.4	R303	R303-H305 WeakPolarHBondContact CD-NE2 3.2Å; R303-H305 PolarHBondContact O-CD2 3.27Å
306	H	83.7	Confident	80.1	Confident	169 Å²	169	146.7 Å²	146.7	78%	0.782	77%	0.765	S	S	*	*			trans	-94.6	128.3	175.8	-62.2	-74.1	0	0	0	109.8	M304	M304-H306 WeakPolarHBondContact CE-NE2 3.27Å
307	F	83.9	Confident	80.6	Confident	187 Å²	187	148.2 Å²	148.2	82%	0.82	77%	0.77	S	S	*	*			trans	-120.4	134.1	173.2	51.6	-89.8	0	0	0	109.4
308	G	82.6	Confident	81.3	Confident	83 Å²	83	142.8 Å²	142.8	86%	0.856	75%	0.754	S	S	*	*			trans	-82	143.6	174	0	0	0	0	0	111
309	S	84.5	Confident	81.9	Confident	115 Å²	115	142.4 Å²	142.4	80%	0.804	75%	0.745	S	S	*	*			trans	-121.3	136.7	168.3	-174.9	0	0	0	0	109
310	M	85.8	Confident	82.4	Confident	179 Å²	179	141.2 Å²	141.2	88%	0.882	74%	0.741	S	S	*	*			trans	-113.3	132.9	175.4	-77.1	179.1	60.5	0	0	109.9
311	T	85.9	Confident	82.6	Confident	118 Å²	118	137.1 Å²	137.1	72%	0.724	72%	0.72	S	S	*	*			trans	-76.9	155.4	168.5	48.2	0	0	0	0	111	N313	T311-N313 PolarHBondContact O-N 2.84Å; T311-N313 VanDerWaalsContact O-N 3.16Å
312	V	86.3	Confident	82.7	Confident	122 Å²	122	136.9 Å²	136.9	74%	0.739	72%	0.721	S	S	*	*			trans	-76.2	102.5	175.7	-178.4	0	0	0	0	109.4	Q314	V312-Q314 PolarHBondContact O-N 2.94Å
313	N	83.7	Confident	82.8	Confident	147 Å²	147	133.3 Å²	133.3	79%	0.786	74%	0.735	S	S	*	*			trans	-72.6	110.5	168.8	-81.9	-10.4	0	0	0	110	T311	T311-N313 PolarHBondContact O-N 2.84Å; T311-N313 VanDerWaalsContact O-N 3.16Å
314	Q	85.3	Confident	82.5	Confident	175 Å²	175	128.8 Å²	128.8	82%	0.818	72%	0.721	S	S	*	*			trans	-77.5	133.6	169.1	-66.2	-84	-55.1	0	0	109.2	V312	V312-Q314 PolarHBondContact O-N 2.94Å
315	M	86	Confident	82.5	Confident	176 Å²	176	131.4 Å²	131.4	87%	0.867	73%	0.729	S	S	*	*			trans	-126.1	134.8	171.5	-176.1	69.2	91.8	0	0	108.4
316	S	83.8	Confident	82.3	Confident	114 Å²	114	127.2 Å²	127.2	80%	0.797	71%	0.713	S	S	*	*			trans	-120.2	141.7	177.1	57.4	0	0	0	0	110.9
317	T	83.3	Confident	82.1	Confident	134 Å²	134	122.5 Å²	122.5	82%	0.822	70%	0.7	S	S	*	*			trans	-122.4	118.7	-178.7	54.3	0	0	0	0	109.4
318	Q	79.9	Confident	82	Confident	101 Å²	101	118.3 Å²	118.3	47%	0.472	69%	0.685	S	S	.	*			trans	-110.6	121.4	177.8	177.2	71.1	-27.1	0	0	109.6	F324 V326	Q318-F324 HydrophobicContact CG-CD1 4.32Å; Q318-F324 HydrophobicContact CG-CE1 3.85Å; Q318-V326 HydrophobicContact CB-CG2 4.31Å; Q318-V326 HydrophobicContact CG-CG2 3.72Å
319	F	81.4	Confident	82	Confident	139 Å²	139	119 Å²	119	61%	0.61	68%	0.678	S	S	*	*			trans	-83.1	140.1	174.1	56.3	-77.7	0	0	0	110.6	K321	F319-K321 HydrophobicContact CD2-CD 4.09Å; F319-K321 HydrophobicContact CD2-CG 3.86Å; F319-K321 HydrophobicContact CE2-CD 3.78Å; F319-K321 HydrophobicContact CE2-CG 4.05Å; F319-K321 HydrophobicContact CZ-CD 4.37Å; F319-K321 VanDerWaalsContact CZ-CE 3.48Å; F319-K321 WeakPolarHBondContact O-CG 3.17Å
320	S	82.7	Confident	82	Confident	64 Å²	64	122.1 Å²	122.1	45%	0.448	68%	0.679	S	S	.	*			trans	-66.8	143.3	173.4	47.8	0	0	0	0	110.6
321	K	81	Confident	81.9	Confident	93 Å²	93	118.7 Å²	118.7	40%	0.404	66%	0.664	S	S	.	*	B	Isolated β-bridge	trans	-140.6	158.6	-176	-44.8	-172	-161.4	-167.8	0	109.8	F319 G323 F324	F319-K321 HydrophobicContact CD2-CD 4.09Å; F319-K321 HydrophobicContact CD2-CG 3.86Å; F319-K321 HydrophobicContact CE2-CD 3.78Å; F319-K321 HydrophobicContact CE2-CG 4.05Å; F319-K321 HydrophobicContact CZ-CD 4.37Å; F319-K321 VanDerWaalsContact CZ-CE 3.48Å; F319-K321 WeakPolarHBondContact O-CG 3.17Å; K321-G323 PolarHBondContact O-N 3.24Å; K321-G323 VanDerWaalsContact O-N 3.13Å; K321-F324 PolarHBondContact N-O 2.85Å; K321-F324 CarbonylContact O-C 3.55Å; K321-F324 PolarHBondContact O-N 3.43Å; K321-F324 VanDerWaalsContact O-O 3.04Å
322	P	78.1	Confident	81.9	Confident	140 Å²	140	123.6 Å²	123.6	91%	0.909	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.5	121.7	165.5	-24.5	35.1	0	0	0	110.1
323	G	80.9	Confident	81.9	Confident	91 Å²	91	124.9 Å²	124.9	94%	0.938	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	86.8	-6.3	-175.4	0	0	0	0	0	116.6	K321	K321-G323 PolarHBondContact O-N 3.24Å; K321-G323 VanDerWaalsContact O-N 3.13Å
324	F	71.1	Confident	81.9	Confident	113 Å²	113	125.8 Å²	125.8	50%	0.496	68%	0.677	S	S	.	*	B	Isolated β-bridge	trans	-144.4	103.2	174.1	-166.9	-90	0	0	0	112	Q318 K321 V326	Q318-F324 HydrophobicContact CG-CD1 4.32Å; Q318-F324 HydrophobicContact CG-CE1 3.85Å; K321-F324 PolarHBondContact N-O 2.85Å; K321-F324 CarbonylContact O-C 3.55Å; K321-F324 PolarHBondContact O-N 3.43Å; K321-F324 VanDerWaalsContact O-O 3.04Å; F324-V326 HydrophobicContact CD1-CG2 4.04Å; F324-V326 HydrophobicContact CE1-CG2 3.7Å
325	F	80.9	Confident	82.1	Confident	165 Å²	165	123.7 Å²	123.7	72%	0.724	68%	0.676	S	S	*	*			trans	-90.7	142.9	-179.7	-178.1	-101.7	0	0	0	112
326	V	77.2	Confident	82.1	Confident	47 Å²	47	121.5 Å²	121.5	29%	0.285	68%	0.675	S	S	.	*			trans	-129.2	139.3	171.8	179.9	0	0	0	0	107	Q318 F324 N328	Q318-V326 HydrophobicContact CB-CG2 4.31Å; Q318-V326 HydrophobicContact CG-CG2 3.72Å; F324-V326 HydrophobicContact CD1-CG2 4.04Å; F324-V326 HydrophobicContact CE1-CG2 3.7Å; V326-N328 PolarHBondContact O-OD1 3.07Å
327	S	80.4	Confident	82.3	Confident	70 Å²	70	118.9 Å²	118.9	49%	0.49	67%	0.666	S	S	.	*			trans	-86.3	114.4	-177.2	-173	0	0	0	0	112.2	S329	S327-S329 PolarHBondContact O-N 2.73Å; S327-S329 VanDerWaalsContact O-N 3.16Å; S327-S329 VanDerWaalsContact OG-CB 3.27Å; S327-S329 WeakPolarHBondContact OG-CB 3.37Å; S327-S329 PolarHBondContact OG-N 3.35Å; S327-S329 PolarHBondContact OG-OG 2.65Å
328	N	80.9	Confident	82.6	Confident	98 Å²	98	119 Å²	119	52%	0.524	67%	0.669	S	S	.	*			trans	-74.2	11.2	171.7	-65	73.5	0	0	0	113.8	V326 Q330 D331	V326-N328 PolarHBondContact O-OD1 3.07Å; N328-Q330 PolarHBondContact O-N 2.86Å; N328-D331 VanDerWaalsContact CA-OD2 3.31Å; N328-D331 WeakPolarHBondContact CA-OD2 3.29Å; N328-D331 WeakPolarHBondContact CB-OD2 3.31Å; N328-D331 VanDerWaalsContact CG-OD2 3.3Å; N328-D331 PolarHBondContact ND2-OD2 2.86Å; N328-D331 WeakPolarHBondContact O-CB 3.46Å; N328-D331 PolarHBondContact O-N 2.93Å
329	S	82.4	Confident	82.9	Confident	99 Å²	99	123.3 Å²	123.3	69%	0.692	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-5.8	-168.8	58.9	0	0	0	0	116.1	S327	S327-S329 PolarHBondContact O-N 2.73Å; S327-S329 VanDerWaalsContact O-N 3.16Å; S327-S329 VanDerWaalsContact OG-CB 3.27Å; S327-S329 WeakPolarHBondContact OG-CB 3.37Å; S327-S329 PolarHBondContact OG-N 3.35Å; S327-S329 PolarHBondContact OG-OG 2.65Å
330	Q	84.4	Confident	83.3	Confident	179 Å²	179	120.2 Å²	120.2	84%	0.836	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.7	-2	172.5	-63.6	-171.5	-3.2	0	0	112.9	N328	N328-Q330 PolarHBondContact O-N 2.86Å
331	D	85	Confident	83.8	Confident	107 Å²	107	119.8 Å²	119.8	57%	0.572	67%	0.665	S	S	*	*			trans	-71.2	147.5	-176.4	-63.4	-13.8	0	0	0	111.1	N328	N328-D331 VanDerWaalsContact CA-OD2 3.31Å; N328-D331 WeakPolarHBondContact CA-OD2 3.29Å; N328-D331 WeakPolarHBondContact CB-OD2 3.31Å; N328-D331 VanDerWaalsContact CG-OD2 3.3Å; N328-D331 PolarHBondContact ND2-OD2 2.86Å; N328-D331 WeakPolarHBondContact O-CB 3.46Å; N328-D331 PolarHBondContact O-N 2.93Å
332	R	85.7	Confident	84.3	Confident	222 Å²	222	118.3 Å²	118.3	84%	0.838	67%	0.67	S	S	*	*			trans	-116.6	117.3	175.4	-62.2	-171.7	-174.9	-158.9	2.1	110.1	Q334	R332-Q334 PolarHBondContact O-N 2.93Å
333	V	85.4	Confident	85.1	Confident	149 Å²	149	117.7 Å²	117.7	90%	0.903	66%	0.659	S	S	*	*			trans	-66	125.1	168.8	-177.3	0	0	0	0	108.5
334	Q	85.5	Confident	85.8	Confident	166 Å²	166	118.4 Å²	118.4	78%	0.776	64%	0.638	S	S	*	*			trans	-117.5	136.7	171	-65.7	-169.4	7.8	0	0	109.6	R332	R332-Q334 PolarHBondContact O-N 2.93Å
335	T	89	Confident	86.8	Confident	131 Å²	131	118.7 Å²	118.7	80%	0.804	64%	0.636	S	S	*	*			trans	-79.8	132	167.7	44.1	0	0	0	0	109.3	G337	T335-G337 PolarHBondContact O-N 3.33Å
336	P	85.7	Confident	87.5	Confident	130 Å²	130	115.7 Å²	115.7	84%	0.844	63%	0.627	S	S	*	*			trans	-65.4	132.3	175.4	27	-33.4	0	0	0	110.2
337	G	88.1	Confident	88.3	Confident	58 Å²	58	115.9 Å²	115.9	60%	0.598	63%	0.634	S	S	*	*			trans	-75	-179.7	167.5	0	0	0	0	0	112.1	T335 Y339	T335-G337 PolarHBondContact O-N 3.33Å; G337-Y339 PolarHBondContact O-N 2.85Å
338	P	88.7	Confident	89	Confident	137 Å²	137	118 Å²	118	89%	0.89	63%	0.631	S	S	*	*			trans	-58.6	124.1	170.5	26.3	-33.8	0	0	0	109.9	E340	P338-E340 PolarHBondContact O-N 3.2Å
339	Y	87.6	Confident	89.7	Confident	191 Å²	191	115.4 Å²	115.4	75%	0.749	62%	0.619	S	S	*	*			trans	-78.2	114.6	175.6	177.1	-101.1	0	0	0	109.5	G337 T341	G337-Y339 PolarHBondContact O-N 2.85Å; Y339-T341 HydrophobicContact CD1-CG2 4.41Å; Y339-T341 HydrophobicContact CE1-CG2 4.32Å
340	E	89.6	Confident	90.3	Very high	74 Å²	74	115.5 Å²	115.5	35%	0.346	61%	0.611	S	S	.	*			trans	-76.2	122.3	170	-174.9	177.5	-142.4	0	0	109	P338 E344 R348	P338-E340 PolarHBondContact O-N 3.2Å; E340-E344 HydrophobicContact CG-CB 3.85Å; E340-R348 IonicContact OE1-CZ 2.71Å; E340-R348 IonicContact OE1-NE 2.76Å; E340-R348 PolarHBondContact OE1-NE 3.35Å; E340-R348 IonicContact OE1-NH2 3.1Å; E340-R348 PolarHBondContact OE1-NH2 2.74Å; E340-R348 IonicContact OE2-CZ 3.17Å; E340-R348 IonicContact OE2-NE 3.96Å; E340-R348 IonicContact OE2-NH2 2.68Å; E340-R348 PolarHBondContact OE2-NH2 3.33Å
341	T	93.1	Very high	90.9	Very high	56 Å²	56	110.7 Å²	110.7	34%	0.344	59%	0.594	S	S	.	*			trans	-68.6	158.6	176.7	63	0	0	0	0	111.3	Y339 D343 E344 Y345	Y339-T341 HydrophobicContact CD1-CG2 4.41Å; Y339-T341 HydrophobicContact CE1-CG2 4.32Å; T341-D343 PolarHBondContact O-N 3.04Å; T341-E344 WeakPolarHBondContact CB-OE2 3.46Å; T341-E344 WeakPolarHBondContact CG2-OE2 3.47Å; T341-E344 PolarHBondContact N-OE2 3.41Å; T341-E344 PolarHBondContact O-N 2.89Å; T341-E344 VanDerWaalsContact OG1-CD 3.26Å; T341-E344 VanDerWaalsContact OG1-CG 3.24Å; T341-E344 WeakPolarHBondContact OG1-CG 3.41Å; T341-E344 PolarHBondContact OG1-N 3.32Å; T341-E344 PolarHBondContact OG1-OE2 3.31Å; T341-Y345 PolarHBondContact O-N 3.1Å
342	A	92	Very high	91.5	Very high	62 Å²	62	111.4 Å²	111.4	51%	0.512	59%	0.592	S	S	.	*	H	α-helix	trans	-56	-38.4	179.1	0	0	0	0	0	112.3	L346	A342-L346 WeakPolarHBondContact O-CB 3.5Å; A342-L346 WeakPolarHBondContact O-CG 3.36Å; A342-L346 PolarHBondContact O-N 3.42Å
343	D	94.2	Very high	92	Very high	127 Å²	127	104.3 Å²	104.3	68%	0.679	57%	0.57	S	S	*	*	H	α-helix	trans	-71.8	-39.3	179.9	-62	-37.7	0	0	0	112.3	T341 L346 A347	T341-D343 PolarHBondContact O-N 3.04Å; D343-L346 PolarHBondContact O-N 3.45Å; D343-A347 VanDerWaalsContact O-CB 3.26Å; D343-A347 WeakPolarHBondContact O-CB 3.45Å; D343-A347 PolarHBondContact O-N 2.85Å
344	E	94.1	Very high	92.5	Very high	105 Å²	105	101.5 Å²	101.5	49%	0.491	55%	0.549	S	S	.	.	H	α-helix	trans	-64.1	-44.8	173.5	-72.1	166.7	128.6	0	0	111.5	E340 T341 L346 A347 R348	E340-E344 HydrophobicContact CG-CB 3.85Å; T341-E344 WeakPolarHBondContact CB-OE2 3.46Å; T341-E344 WeakPolarHBondContact CG2-OE2 3.47Å; T341-E344 PolarHBondContact N-OE2 3.41Å; T341-E344 PolarHBondContact O-N 2.89Å; T341-E344 VanDerWaalsContact OG1-CD 3.26Å; T341-E344 VanDerWaalsContact OG1-CG 3.24Å; T341-E344 WeakPolarHBondContact OG1-CG 3.41Å; T341-E344 PolarHBondContact OG1-N 3.32Å; T341-E344 PolarHBondContact OG1-OE2 3.31Å; E344-L346 PolarHBondContact O-N 2.93Å; E344-A347 PolarHBondContact O-N 3.35Å; E344-R348 WeakPolarHBondContact O-CB 3.48Å; E344-R348 PolarHBondContact O-N 3.44Å
345	Y	93.3	Very high	93	Very high	119 Å²	119	97.2 Å²	97.2	47%	0.467	53%	0.53	S	S	.	.	H	α-helix	trans	-57.6	-48.4	174.5	175.4	-89.7	0	0	0	110.9	T341 R348 V349	T341-Y345 PolarHBondContact O-N 3.1Å; Y345-R348 PolarHBondContact O-N 3.06Å; Y345-V349 HydrophobicContact CD1-CG2 4.15Å; Y345-V349 HydrophobicContact CE1-CG2 3.73Å; Y345-V349 HydrophobicContact CE2-CG2 4.27Å; Y345-V349 WeakPolarHBondContact O-CB 3.26Å; Y345-V349 VanDerWaalsContact O-CG2 3.28Å; Y345-V349 WeakPolarHBondContact O-CG2 3.38Å; Y345-V349 PolarHBondContact O-N 3.13Å
346	L	95.4	Very high	93.4	Very high	102 Å²	102	96.2 Å²	96.2	53%	0.534	52%	0.519	S	S	.	.	H	α-helix	trans	-65.5	-40.1	178.9	-72.6	171.2	0	0	0	112.2	A342 D343 E344 V349 L350	A342-L346 WeakPolarHBondContact O-CB 3.5Å; A342-L346 WeakPolarHBondContact O-CG 3.36Å; A342-L346 PolarHBondContact O-N 3.42Å; D343-L346 PolarHBondContact O-N 3.45Å; E344-L346 PolarHBondContact O-N 2.93Å; L346-V349 PolarHBondContact O-N 3.34Å; L346-L350 VanDerWaalsContact O-CB 3.28Å; L346-L350 WeakPolarHBondContact O-CB 3.32Å; L346-L350 PolarHBondContact O-N 2.86Å
347	A	94.8	Very high	93.9	Very high	51 Å²	51	93.6 Å²	93.6	42%	0.421	50%	0.496	S	S	.	.	H	α-helix	trans	-65	-40.5	175.3	0	0	0	0	0	112.1	D343 E344 T351	D343-A347 VanDerWaalsContact O-CB 3.26Å; D343-A347 WeakPolarHBondContact O-CB 3.45Å; D343-A347 PolarHBondContact O-N 2.85Å; E344-A347 PolarHBondContact O-N 3.35Å; A347-T351 WeakPolarHBondContact O-CB 3.4Å; A347-T351 PolarHBondContact O-N 2.89Å; A347-T351 PolarHBondContact O-OG1 3.16Å
348	R	94.4	Very high	94.3	Very high	114 Å²	114	98 Å²	98	43%	0.43	50%	0.499	S	S	.	.	H	α-helix	trans	-64.5	-46.3	173.9	-179.3	170.9	59.7	81.5	-5.7	111	E340 E344 Y345 T351 K352	E340-R348 IonicContact OE1-CZ 2.71Å; E340-R348 IonicContact OE1-NE 2.76Å; E340-R348 PolarHBondContact OE1-NE 3.35Å; E340-R348 IonicContact OE1-NH2 3.1Å; E340-R348 PolarHBondContact OE1-NH2 2.74Å; E340-R348 IonicContact OE2-CZ 3.17Å; E340-R348 IonicContact OE2-NE 3.96Å; E340-R348 IonicContact OE2-NH2 2.68Å; E340-R348 PolarHBondContact OE2-NH2 3.33Å; E344-R348 WeakPolarHBondContact O-CB 3.48Å; E344-R348 PolarHBondContact O-N 3.44Å; Y345-R348 PolarHBondContact O-N 3.06Å; R348-T351 PolarHBondContact O-N 2.97Å; R348-K352 WeakPolarHBondContact O-CG 3.46Å; R348-K352 PolarHBondContact O-N 3.22Å
349	V	95	Very high	94.7	Very high	44 Å²	44	98.7 Å²	98.7	27%	0.267	48%	0.484	S	S	.	.	H	α-helix	trans	-60.1	-48.5	176.1	165	0	0	0	0	110.8	Y345 L346 T351 K352 I353	Y345-V349 HydrophobicContact CD1-CG2 4.15Å; Y345-V349 HydrophobicContact CE1-CG2 3.73Å; Y345-V349 HydrophobicContact CE2-CG2 4.27Å; Y345-V349 WeakPolarHBondContact O-CB 3.26Å; Y345-V349 VanDerWaalsContact O-CG2 3.28Å; Y345-V349 WeakPolarHBondContact O-CG2 3.38Å; Y345-V349 PolarHBondContact O-N 3.13Å; L346-V349 PolarHBondContact O-N 3.34Å; V349-T351 VanDerWaalsContact C-N 3.32Å; V349-T351 PolarHBondContact O-N 3.19Å; V349-K352 PolarHBondContact O-N 2.97Å; V349-K352 VanDerWaalsContact O-N 3.14Å; V349-I353 HydrophobicContact CG1-CD1 3.62Å; V349-I353 HydrophobicContact CG1-CG1 4.29Å; V349-I353 VanDerWaalsContact O-CG1 3.32Å; V349-I353 WeakPolarHBondContact O-CG1 3.36Å; V349-I353 PolarHBondContact O-N 3.33Å
350	L	95.6	Very high	95.2	Very high	101 Å²	101	93.8 Å²	93.8	53%	0.529	47%	0.47	S	S	.	.	H	α-helix	trans	-56.2	-45.2	175.4	178.1	60.8	0	0	0	111.8	L346 K352 I353 I354	L346-L350 VanDerWaalsContact O-CB 3.28Å; L346-L350 WeakPolarHBondContact O-CB 3.32Å; L346-L350 PolarHBondContact O-N 2.86Å; L350-K352 PolarHBondContact O-N 2.97Å; L350-I353 PolarHBondContact O-N 2.9Å; L350-I354 HydrophobicContact CD1-CD1 4.11Å; L350-I354 HydrophobicContact CD1-CG1 4.34Å; L350-I354 HydrophobicContact CG-CD1 4.02Å; L350-I354 WeakPolarHBondContact O-CG1 3.49Å; L350-I354 PolarHBondContact O-N 3.44Å
351	T	96.7	Very high	95.6	Very high	79 Å²	79	97.7 Å²	97.7	49%	0.485	48%	0.482	S	S	.	.	H	α-helix	trans	-60.4	-43.3	176.9	-58.7	0	0	0	0	111.8	A347 R348 V349 I354 I355	A347-T351 WeakPolarHBondContact O-CB 3.4Å; A347-T351 PolarHBondContact O-N 2.89Å; A347-T351 PolarHBondContact O-OG1 3.16Å; R348-T351 PolarHBondContact O-N 2.97Å; V349-T351 VanDerWaalsContact C-N 3.32Å; V349-T351 PolarHBondContact O-N 3.19Å; T351-I354 PolarHBondContact O-N 3.45Å; T351-I355 HydrophobicContact CG2-CD1 4.41Å; T351-I355 WeakPolarHBondContact O-CG1 3.42Å; T351-I355 PolarHBondContact O-N 2.69Å
352	K	97	Very high	95.8	Very high	122 Å²	122	102.7 Å²	102.7	53%	0.53	50%	0.495	S	S	.	.	H	α-helix	trans	-68.1	-38.5	175.2	-60.9	-59.3	179.7	-179.3	0	112.1	R348 V349 L350 I355 I356	R348-K352 WeakPolarHBondContact O-CG 3.46Å; R348-K352 PolarHBondContact O-N 3.22Å; V349-K352 PolarHBondContact O-N 2.97Å; V349-K352 VanDerWaalsContact O-N 3.14Å; L350-K352 PolarHBondContact O-N 2.97Å; K352-I355 PolarHBondContact O-N 2.84Å; K352-I356 WeakPolarHBondContact O-CG1 3.38Å; K352-I356 PolarHBondContact O-N 3.41Å
353	I	96.2	Very high	96	Very high	72 Å²	72	106.2 Å²	106.2	37%	0.369	50%	0.495	S	S	.	.	H	α-helix	trans	-59.9	-45.5	174.4	-72.1	168.6	0	0	0	110.8	V349 L350 I355 I356 Q357	V349-I353 HydrophobicContact CG1-CD1 3.62Å; V349-I353 HydrophobicContact CG1-CG1 4.29Å; V349-I353 VanDerWaalsContact O-CG1 3.32Å; V349-I353 WeakPolarHBondContact O-CG1 3.36Å; V349-I353 PolarHBondContact O-N 3.33Å; L350-I353 PolarHBondContact O-N 2.9Å; I353-I355 VanDerWaalsContact C-N 3.3Å; I353-I355 PolarHBondContact O-N 2.93Å; I353-I356 PolarHBondContact O-N 3.46Å; I353-Q357 HydrophobicContact CG2-CG 4.23Å; I353-Q357 WeakPolarHBondContact O-CB 3.44Å; I353-Q357 WeakPolarHBondContact O-CG 3.25Å; I353-Q357 PolarHBondContact O-N 2.84Å
354	I	96.3	Very high	96.1	Very high	91 Å²	91	104.4 Å²	104.4	47%	0.467	49%	0.485	S	S	.	.	H	α-helix	trans	-60.3	-41	177.5	-69.7	164.3	0	0	0	111	L350 T351 Q357 K358	L350-I354 HydrophobicContact CD1-CD1 4.11Å; L350-I354 HydrophobicContact CD1-CG1 4.34Å; L350-I354 HydrophobicContact CG-CD1 4.02Å; L350-I354 WeakPolarHBondContact O-CG1 3.49Å; L350-I354 PolarHBondContact O-N 3.44Å; T351-I354 PolarHBondContact O-N 3.45Å; I354-Q357 PolarHBondContact O-N 3.28Å; I354-K358 WeakPolarHBondContact O-CB 3.44Å; I354-K358 PolarHBondContact O-N 3.38Å
355	I	96.8	Very high	96.3	Very high	75 Å²	75	102 Å²	102	39%	0.385	48%	0.483	S	S	.	.	H	α-helix	trans	-63.8	-47.4	175.3	-67	165.5	0	0	0	110.9	T351 K352 I353 Q357 K358 Y359	T351-I355 HydrophobicContact CG2-CD1 4.41Å; T351-I355 WeakPolarHBondContact O-CG1 3.42Å; T351-I355 PolarHBondContact O-N 2.69Å; K352-I355 PolarHBondContact O-N 2.84Å; I353-I355 VanDerWaalsContact C-N 3.3Å; I353-I355 PolarHBondContact O-N 2.93Å; I355-Q357 PolarHBondContact O-N 3.19Å; I355-K358 WeakPolarHBondContact O-CB 3.35Å; I355-K358 PolarHBondContact O-N 3.08Å; I355-Y359 HydrophobicContact CG2-CD2 3.88Å; I355-Y359 HydrophobicContact CG2-CE2 3.75Å; I355-Y359 VanDerWaalsContact O-CD2 3.28Å; I355-Y359 WeakPolarHBondContact O-CD2 3.44Å; I355-Y359 PolarHBondContact O-N 3.46Å; I355-Y359 VanDerWaalsContact O-N 3.08Å
356	I	96.5	Very high	96.4	Very high	110 Å²	110	102.9 Å²	102.9	56%	0.564	49%	0.489	S	S	*	.	H	α-helix	trans	-60.5	-46.2	177.3	-68.1	163.9	0	0	0	110.6	K352 I353 K358 Y359 L360	K352-I356 WeakPolarHBondContact O-CG1 3.38Å; K352-I356 PolarHBondContact O-N 3.41Å; I353-I356 PolarHBondContact O-N 3.46Å; I356-K358 VanDerWaalsContact C-N 3.33Å; I356-K358 PolarHBondContact O-N 2.62Å; I356-Y359 PolarHBondContact O-N 3.29Å; I356-L360 WeakPolarHBondContact O-CB 3.42Å; I356-L360 PolarHBondContact O-N 2.95Å
357	Q	96	Very high	96.5	Very high	75 Å²	75	104.9 Å²	104.9	35%	0.35	49%	0.489	S	S	.	.	H	α-helix	trans	-60	-39.9	175.7	-73.2	-177.3	11.7	0	0	112.3	I353 I354 I355 L360 R361	I353-Q357 HydrophobicContact CG2-CG 4.23Å; I353-Q357 WeakPolarHBondContact O-CB 3.44Å; I353-Q357 WeakPolarHBondContact O-CG 3.25Å; I353-Q357 PolarHBondContact O-N 2.84Å; I354-Q357 PolarHBondContact O-N 3.28Å; I355-Q357 PolarHBondContact O-N 3.19Å; Q357-L360 PolarHBondContact O-N 2.87Å; Q357-R361 WeakPolarHBondContact O-CB 3.39Å; Q357-R361 VanDerWaalsContact O-CG 3.24Å; Q357-R361 WeakPolarHBondContact O-CG 3.43Å; Q357-R361 PolarHBondContact O-N 2.96Å
358	K	97.1	Very high	96.6	Very high	152 Å²	152	111.2 Å²	111.2	66%	0.661	50%	0.502	S	S	*	.	H	α-helix	trans	-61.2	-45.7	176.1	-178.4	179.1	179.1	178	0	111.5	I354 I355 I356 R362	I354-K358 WeakPolarHBondContact O-CB 3.44Å; I354-K358 PolarHBondContact O-N 3.38Å; I355-K358 WeakPolarHBondContact O-CB 3.35Å; I355-K358 PolarHBondContact O-N 3.08Å; I356-K358 VanDerWaalsContact C-N 3.33Å; I356-K358 PolarHBondContact O-N 2.62Å; K358-R362 PolarHBondContact O-N 3.11Å; K358-R362 VanDerWaalsContact O-N 3.17Å
359	Y	97.6	Very high	96.8	Very high	150 Å²	150	110.4 Å²	110.4	59%	0.588	51%	0.51	S	S	*	.	H	α-helix	trans	-69	-40.5	176	-76.9	-68.9	0	0	0	112.7	I355 I356 R362 W363	I355-Y359 HydrophobicContact CG2-CD2 3.88Å; I355-Y359 HydrophobicContact CG2-CE2 3.75Å; I355-Y359 VanDerWaalsContact O-CD2 3.28Å; I355-Y359 WeakPolarHBondContact O-CD2 3.44Å; I355-Y359 PolarHBondContact O-N 3.46Å; I355-Y359 VanDerWaalsContact O-N 3.08Å; I356-Y359 PolarHBondContact O-N 3.29Å; Y359-R362 WeakPolarHBondContact O-CB 3.38Å; Y359-R362 PolarHBondContact O-N 3.21Å; Y359-W363 WeakPolarHBondContact O-CB 3.37Å; Y359-W363 PolarHBondContact O-N 3.24Å
360	L	96.9	Very high	96.9	Very high	88 Å²	88	111.2 Å²	111.2	46%	0.461	52%	0.521	S	S	.	.	H	α-helix	trans	-61.7	-46	176.7	-177.3	64.6	0	0	0	111.7	I356 Q357 R362 W363 L364	I356-L360 WeakPolarHBondContact O-CB 3.42Å; I356-L360 PolarHBondContact O-N 2.95Å; Q357-L360 PolarHBondContact O-N 2.87Å; L360-R362 VanDerWaalsContact C-N 3.33Å; L360-R362 PolarHBondContact O-N 3.12Å; L360-W363 HydrophobicContact CD1-CE3 4.03Å; L360-W363 HydrophobicContact CD1-CZ3 4.39Å; L360-W363 PolarHBondContact O-N 2.84Å; L360-L364 HydrophobicContact CD1-CD1 4.48Å; L360-L364 HydrophobicContact CD1-CG 4.44Å; L360-L364 HydrophobicContact CG-CD1 4.16Å; L360-L364 WeakPolarHBondContact O-CB 3.21Å; L360-L364 WeakPolarHBondContact O-CG 3.37Å; L360-L364 PolarHBondContact O-N 3.05Å
361	R	97.7	Very high	96.9	Very high	157 Å²	157	114.2 Å²	114.2	59%	0.592	53%	0.526	S	S	*	.	H	α-helix	trans	-58.2	-43.6	173.6	-72.1	171.1	-170.8	142.4	12	111.5	Q357 A365	Q357-R361 WeakPolarHBondContact O-CB 3.39Å; Q357-R361 VanDerWaalsContact O-CG 3.24Å; Q357-R361 WeakPolarHBondContact O-CG 3.43Å; Q357-R361 PolarHBondContact O-N 2.96Å; R361-A365 WeakPolarHBondContact O-CB 3.43Å; R361-A365 PolarHBondContact O-N 3.46Å
362	R	97.4	Very high	97	Very high	160 Å²	160	115 Å²	115	60%	0.604	53%	0.526	S	S	*	.	H	α-helix	trans	-63.5	-40.1	176	-169.4	-175.8	-172.8	-159.1	4.5	112.4	K358 Y359 L360 K366	K358-R362 PolarHBondContact O-N 3.11Å; K358-R362 VanDerWaalsContact O-N 3.17Å; Y359-R362 WeakPolarHBondContact O-CB 3.38Å; Y359-R362 PolarHBondContact O-N 3.21Å; L360-R362 VanDerWaalsContact C-N 3.33Å; L360-R362 PolarHBondContact O-N 3.12Å; R362-K366 PolarHBondContact O-N 2.92Å
363	W	97	Very high	97	Very high	136 Å²	136	114.8 Å²	114.8	52%	0.515	53%	0.525	S	S	.	.	H	α-helix	trans	-69	-45.7	177.8	176.2	84.8	0	0	0	112.1	Y359 L360 A365 K366 R367	Y359-W363 WeakPolarHBondContact O-CB 3.37Å; Y359-W363 PolarHBondContact O-N 3.24Å; L360-W363 HydrophobicContact CD1-CE3 4.03Å; L360-W363 HydrophobicContact CD1-CZ3 4.39Å; L360-W363 PolarHBondContact O-N 2.84Å; W363-A365 VanDerWaalsContact C-N 3.33Å; W363-A365 PolarHBondContact O-N 2.85Å; W363-K366 PolarHBondContact O-N 2.84Å; W363-R367 WeakPolarHBondContact O-CB 3.41Å; W363-R367 PolarHBondContact O-N 3.44Å
364	L	97.1	Very high	97	Very high	89 Å²	89	117.6 Å²	117.6	47%	0.466	54%	0.535	S	S	.	.	H	α-helix	trans	-59	-43.5	173.9	-71.2	172	0	0	0	111.5	L360 R367 R368	L360-L364 HydrophobicContact CD1-CD1 4.48Å; L360-L364 HydrophobicContact CD1-CG 4.44Å; L360-L364 HydrophobicContact CG-CD1 4.16Å; L360-L364 WeakPolarHBondContact O-CB 3.21Å; L360-L364 WeakPolarHBondContact O-CG 3.37Å; L360-L364 PolarHBondContact O-N 3.05Å; L364-R367 PolarHBondContact O-N 2.9Å; L364-R368 PolarHBondContact O-N 2.94Å
365	A	96.7	Very high	97	Very high	55 Å²	55	118 Å²	118	46%	0.455	54%	0.537	S	S	.	.	H	α-helix	trans	-61.5	-48	174.8	0	0	0	0	0	111.9	R361 W363 R367 R368 V369	R361-A365 WeakPolarHBondContact O-CB 3.43Å; R361-A365 PolarHBondContact O-N 3.46Å; W363-A365 VanDerWaalsContact C-N 3.33Å; W363-A365 PolarHBondContact O-N 2.85Å; A365-R367 VanDerWaalsContact C-N 3.35Å; A365-R367 PolarHBondContact O-N 2.96Å; A365-R368 PolarHBondContact O-N 3.05Å; A365-V369 WeakPolarHBondContact O-CG2 3.41Å; A365-V369 PolarHBondContact O-N 3.12Å
366	K	97.4	Very high	97.1	Very high	137 Å²	137	121.1 Å²	121.1	60%	0.596	54%	0.544	S	S	*	.	H	α-helix	trans	-56.8	-45.3	173.8	-82.4	-169.4	170.1	-164.3	0	112.2	R362 W363 V369 A370	R362-K366 PolarHBondContact O-N 2.92Å; W363-K366 PolarHBondContact O-N 2.84Å; K366-V369 PolarHBondContact O-N 2.82Å; K366-A370 WeakPolarHBondContact O-CB 2.9Å; K366-A370 PolarHBondContact O-N 2.98Å
367	R	96.7	Very high	97.1	Very high	144 Å²	144	118.6 Å²	118.6	54%	0.543	53%	0.531	S	S	.	.	H	α-helix	trans	-63.4	-39.1	178	177.5	173.2	161.7	163.2	-4.7	112.2	W363 L364 A365 R371	W363-R367 WeakPolarHBondContact O-CB 3.41Å; W363-R367 PolarHBondContact O-N 3.44Å; L364-R367 PolarHBondContact O-N 2.9Å; A365-R367 VanDerWaalsContact C-N 3.35Å; A365-R367 PolarHBondContact O-N 2.96Å; R367-R371 PolarHBondContact O-N 2.97Å; R367-R371 VanDerWaalsContact O-N 3.1Å
368	R	96.6	Very high	97.2	Very high	184 Å²	184	119.1 Å²	119.1	69%	0.694	54%	0.537	S	S	*	.	H	α-helix	trans	-65.6	-46.4	173.3	-175.1	176.2	179.2	173.8	0.2	111.7	L364 A365 R371 L372	L364-R368 PolarHBondContact O-N 2.94Å; A365-R368 PolarHBondContact O-N 3.05Å; R368-R371 PolarHBondContact O-N 3.37Å; R368-L372 HydrophobicContact CG-CD1 4.04Å; R368-L372 WeakPolarHBondContact O-CG 3.26Å; R368-L372 PolarHBondContact O-N 3.37Å
369	V	97.7	Very high	97.1	Very high	98 Å²	98	118.3 Å²	118.3	59%	0.594	53%	0.53	S	S	*	.	H	α-helix	trans	-63.9	-40.8	177.8	172.1	0	0	0	0	111.5	A365 K366 L372 K373	A365-V369 WeakPolarHBondContact O-CG2 3.41Å; A365-V369 PolarHBondContact O-N 3.12Å; K366-V369 PolarHBondContact O-N 2.82Å; V369-L372 PolarHBondContact O-N 3.05Å; V369-K373 WeakPolarHBondContact O-CB 3.45Å; V369-K373 PolarHBondContact O-N 3.42Å
370	A	97.2	Very high	97	Very high	60 Å²	60	115.2 Å²	115.2	50%	0.496	52%	0.523	S	S	.	.	H	α-helix	trans	-62.4	-42.6	175.4	0	0	0	0	0	112.3	K366 K373 K374	K366-A370 WeakPolarHBondContact O-CB 2.9Å; K366-A370 PolarHBondContact O-N 2.98Å; A370-K373 PolarHBondContact O-N 3.44Å; A370-K374 PolarHBondContact O-N 3.25Å
371	R	97.1	Very high	97	Very high	165 Å²	165	113.9 Å²	113.9	62%	0.623	53%	0.525	S	S	*	.	H	α-helix	trans	-61	-47.9	173.7	-176.6	-170.6	-76.4	-178	-9.5	111.6	R367 R368 K374 I375	R367-R371 PolarHBondContact O-N 2.97Å; R367-R371 VanDerWaalsContact O-N 3.1Å; R368-R371 PolarHBondContact O-N 3.37Å; R371-K374 PolarHBondContact O-N 3.49Å; R371-I375 HydrophobicContact CG-CD1 4.01Å; R371-I375 WeakPolarHBondContact O-CG1 3.47Å; R371-I375 PolarHBondContact O-N 3.06Å
372	L	97.2	Very high	96.9	Very high	94 Å²	94	113.3 Å²	113.3	49%	0.492	52%	0.523	S	S	.	.	H	α-helix	trans	-65.6	-39	179.6	-70.4	170.4	0	0	0	112.3	R368 V369 I375 R376	R368-L372 HydrophobicContact CG-CD1 4.04Å; R368-L372 WeakPolarHBondContact O-CG 3.26Å; R368-L372 PolarHBondContact O-N 3.37Å; V369-L372 PolarHBondContact O-N 3.05Å; L372-I375 PolarHBondContact O-N 3.34Å; L372-R376 WeakPolarHBondContact O-CB 3.44Å; L372-R376 PolarHBondContact O-N 3.4Å
373	K	97.4	Very high	96.6	Very high	118 Å²	118	110.5 Å²	110.5	51%	0.513	52%	0.517	S	S	.	.	H	α-helix	trans	-60.3	-47.2	172.3	179.1	177	172.7	-176.7	0	110.6	V369 A370 I375 R376 D377	V369-K373 WeakPolarHBondContact O-CB 3.45Å; V369-K373 PolarHBondContact O-N 3.42Å; A370-K373 PolarHBondContact O-N 3.44Å; K373-I375 PolarHBondContact O-N 2.55Å; K373-R376 PolarHBondContact O-N 3.45Å; K373-D377 WeakPolarHBondContact CE-OD2 3.26Å; K373-D377 VanDerWaalsContact CG-OD2 3.3Å; K373-D377 WeakPolarHBondContact CG-OD2 3.46Å; K373-D377 IonicContact NZ-OD2 3.99Å; K373-D377 WeakPolarHBondContact O-CB 3.49Å; K373-D377 PolarHBondContact O-N 3.29Å
374	K	97.2	Very high	96.5	Very high	131 Å²	131	110.9 Å²	110.9	57%	0.57	52%	0.522	S	S	*	.	H	α-helix	trans	-57.4	-50	176.3	177.7	170	177.9	177.6	0	111.5	A370 R371 R376 D377 D378	A370-K374 PolarHBondContact O-N 3.25Å; R371-K374 PolarHBondContact O-N 3.49Å; K374-R376 VanDerWaalsContact C-N 3.28Å; K374-R376 PolarHBondContact O-N 2.9Å; K374-D377 PolarHBondContact O-N 3.28Å; K374-D377 VanDerWaalsContact O-N 3.12Å; K374-D378 WeakPolarHBondContact CE-OD1 3.48Å; K374-D378 WeakPolarHBondContact CE-OD2 3.45Å; K374-D378 VanDerWaalsContact CG-OD2 3.28Å; K374-D378 WeakPolarHBondContact CG-OD2 3.38Å; K374-D378 WeakPolarHBondContact O-CB 3.39Å; K374-D378 PolarHBondContact O-N 2.98Å
375	I	96.4	Very high	96.4	Very high	100 Å²	100	108.7 Å²	108.7	51%	0.513	51%	0.514	S	S	.	.	H	α-helix	trans	-57.1	-41.4	179.5	-67.4	163.8	0	0	0	111.7	R371 L372 K373 Y379	R371-I375 HydrophobicContact CG-CD1 4.01Å; R371-I375 WeakPolarHBondContact O-CG1 3.47Å; R371-I375 PolarHBondContact O-N 3.06Å; L372-I375 PolarHBondContact O-N 3.34Å; K373-I375 PolarHBondContact O-N 2.55Å; I375-Y379 WeakPolarHBondContact O-CB 3.48Å; I375-Y379 PolarHBondContact O-N 3.28Å
376	R	97.5	Very high	95.9	Very high	140 Å²	140	109.5 Å²	109.5	53%	0.528	51%	0.509	S	S	.	.	H	α-helix	trans	-64.9	-46.8	175	-177.3	-159.7	69.5	162.5	5.2	112.2	L372 K373 K374 Y379 I380	L372-R376 WeakPolarHBondContact O-CB 3.44Å; L372-R376 PolarHBondContact O-N 3.4Å; K373-R376 PolarHBondContact O-N 3.45Å; K374-R376 VanDerWaalsContact C-N 3.28Å; K374-R376 PolarHBondContact O-N 2.9Å; R376-Y379 PolarHBondContact O-N 3.47Å; R376-I380 HydrophobicContact CG-CD1 3.91Å; R376-I380 WeakPolarHBondContact O-CG1 3.36Å; R376-I380 PolarHBondContact O-N 2.73Å
377	D	97.5	Very high	95.4	Very high	57 Å²	57	107 Å²	107	31%	0.305	51%	0.508	S	S	.	.	H	α-helix	trans	-70.2	-37.4	-175.6	-64.3	-2.6	0	0	0	110.7	K373 K374 A381	K373-D377 WeakPolarHBondContact CE-OD2 3.26Å; K373-D377 VanDerWaalsContact CG-OD2 3.3Å; K373-D377 WeakPolarHBondContact CG-OD2 3.46Å; K373-D377 IonicContact NZ-OD2 3.99Å; K373-D377 WeakPolarHBondContact O-CB 3.49Å; K373-D377 PolarHBondContact O-N 3.29Å; K374-D377 PolarHBondContact O-N 3.28Å; K374-D377 VanDerWaalsContact O-N 3.12Å; D377-A381 WeakPolarHBondContact O-CB 3.23Å; D377-A381 PolarHBondContact O-N 3.15Å
378	D	97.3	Very high	95.2	Very high	86 Å²	86	105.1 Å²	105.1	46%	0.46	51%	0.506	S	S	.	.	H	α-helix	trans	-61.3	-41.6	170.1	-67	-16.2	0	0	0	111.1	K374 W382	K374-D378 WeakPolarHBondContact CE-OD1 3.48Å; K374-D378 WeakPolarHBondContact CE-OD2 3.45Å; K374-D378 VanDerWaalsContact CG-OD2 3.28Å; K374-D378 WeakPolarHBondContact CG-OD2 3.38Å; K374-D378 WeakPolarHBondContact O-CB 3.39Å; K374-D378 PolarHBondContact O-N 2.98Å; D378-W382 WeakPolarHBondContact O-CB 3.45Å; D378-W382 PolarHBondContact O-N 3.4Å
379	Y	95.1	Very high	94.8	Very high	135 Å²	135	101.7 Å²	101.7	53%	0.529	50%	0.496	S	S	.	.	H	α-helix	trans	-66.8	-45.6	177.3	178.2	-94.9	0	0	0	112.8	I375 R376 A381 W382 E383	I375-Y379 WeakPolarHBondContact O-CB 3.48Å; I375-Y379 PolarHBondContact O-N 3.28Å; R376-Y379 PolarHBondContact O-N 3.47Å; Y379-A381 VanDerWaalsContact C-N 3.3Å; Y379-A381 PolarHBondContact O-N 3.15Å; Y379-W382 HydrophobicContact CE2-CE3 4.4Å; Y379-W382 HydrophobicContact CE2-CZ3 4.49Å; Y379-W382 WeakPolarHBondContact O-CB 3.31Å; Y379-W382 PolarHBondContact O-N 2.91Å; Y379-W382 VanDerWaalsContact O-N 3.16Å; Y379-E383 WeakPolarHBondContact O-CB 3.44Å; Y379-E383 PolarHBondContact O-N 3.38Å
380	I	96.8	Very high	94.1	Very high	85 Å²	85	100.9 Å²	100.9	44%	0.436	49%	0.485	S	S	.	.	H	α-helix	trans	-63.8	-37.5	177.1	-67	166.5	0	0	0	110.7	R376 K384	R376-I380 HydrophobicContact CG-CD1 3.91Å; R376-I380 WeakPolarHBondContact O-CG1 3.36Å; R376-I380 PolarHBondContact O-N 2.73Å; I380-K384 WeakPolarHBondContact O-CB 3.11Å; I380-K384 PolarHBondContact O-N 2.94Å
381	A	96.6	Very high	93.7	Very high	61 Å²	61	104.1 Å²	104.1	50%	0.504	49%	0.488	S	S	.	.	H	α-helix	trans	-65.6	-39.2	173.7	0	0	0	0	0	112.3	D377 Y379 S385	D377-A381 WeakPolarHBondContact O-CB 3.23Å; D377-A381 PolarHBondContact O-N 3.15Å; Y379-A381 VanDerWaalsContact C-N 3.3Å; Y379-A381 PolarHBondContact O-N 3.15Å; A381-S385 WeakPolarHBondContact O-CB 3.31Å; A381-S385 PolarHBondContact O-N 2.95Å
382	W	94.6	Very high	93.5	Very high	144 Å²	144	100.5 Å²	100.5	55%	0.545	48%	0.481	S	S	.	.	H	α-helix	trans	-63.9	-49.9	173.5	177.6	93.1	0	0	0	111.7	D378 Y379 K384 S385 Q386	D378-W382 WeakPolarHBondContact O-CB 3.45Å; D378-W382 PolarHBondContact O-N 3.4Å; Y379-W382 HydrophobicContact CE2-CE3 4.4Å; Y379-W382 HydrophobicContact CE2-CZ3 4.49Å; Y379-W382 WeakPolarHBondContact O-CB 3.31Å; Y379-W382 PolarHBondContact O-N 2.91Å; Y379-W382 VanDerWaalsContact O-N 3.16Å; W382-K384 PolarHBondContact O-N 3.17Å; W382-S385 CarbonylContact O-C 3.56Å; W382-S385 WeakPolarHBondContact O-CA 3.45Å; W382-S385 WeakPolarHBondContact O-CB 3.43Å; W382-S385 PolarHBondContact O-N 2.56Å; W382-Q386 HydrophobicContact CD2-CG 3.98Å; W382-Q386 VanDerWaalsContact CE2-NE2 3.3Å; W382-Q386 HydrophobicContact CE3-CG 4.22Å; W382-Q386 HydrophobicContact CH2-CG 4.02Å; W382-Q386 HydrophobicContact CZ2-CG 3.8Å; W382-Q386 VanDerWaalsContact CZ2-NE2 3.34Å; W382-Q386 HydrophobicContact CZ3-CG 4.23Å; W382-Q386 WeakPolarHBondContact O-CG 3.47Å; W382-Q386 PolarHBondContact O-N 3.46Å
383	E	92	Very high	93	Very high	101 Å²	101	98 Å²	98	47%	0.472	47%	0.467	S	S	.	.	H	α-helix	trans	-56.6	-50	178.9	179.8	-179.3	-150.1	0	0	111.3	Y379 S385 Q386 S387	Y379-E383 WeakPolarHBondContact O-CB 3.44Å; Y379-E383 PolarHBondContact O-N 3.38Å; E383-S385 VanDerWaalsContact C-N 3.3Å; E383-S385 PolarHBondContact O-N 2.88Å; E383-Q386 PolarHBondContact O-N 2.95Å; E383-S387 PolarHBondContact O-N 3.32Å
384	K	94.5	Very high	92.3	Very high	144 Å²	144	94.3 Å²	94.3	63%	0.626	45%	0.452	S	S	*	.	H	α-helix	trans	-57.3	-43.9	174	-174.6	-176.9	174.7	-172.1	0	111.6	I380 W382 Q386 S387 E388	I380-K384 WeakPolarHBondContact O-CB 3.11Å; I380-K384 PolarHBondContact O-N 2.94Å; W382-K384 PolarHBondContact O-N 3.17Å; K384-Q386 VanDerWaalsContact C-N 3.34Å; K384-Q386 PolarHBondContact O-N 3.45Å; K384-S387 PolarHBondContact O-N 2.95Å; K384-E388 VanDerWaalsContact O-CB 3.32Å; K384-E388 WeakPolarHBondContact O-CB 2.99Å; K384-E388 PolarHBondContact O-N 3.46Å
385	S	94.9	Very high	92	Very high	43 Å²	43	92 Å²	92	30%	0.301	45%	0.446	S	S	.	.	H	α-helix	trans	-64.2	-35.3	178.6	-173.5	0	0	0	0	112.8	A381 W382 E383 K389	A381-S385 WeakPolarHBondContact O-CB 3.31Å; A381-S385 PolarHBondContact O-N 2.95Å; W382-S385 CarbonylContact O-C 3.56Å; W382-S385 WeakPolarHBondContact O-CA 3.45Å; W382-S385 WeakPolarHBondContact O-CB 3.43Å; W382-S385 PolarHBondContact O-N 2.56Å; E383-S385 VanDerWaalsContact C-N 3.3Å; E383-S385 PolarHBondContact O-N 2.88Å; S385-K389 WeakPolarHBondContact O-CB 3.4Å; S385-K389 WeakPolarHBondContact O-CD 3.43Å; S385-K389 WeakPolarHBondContact O-CG 3.47Å; S385-K389 PolarHBondContact O-N 3.34Å; S385-K389 VanDerWaalsContact OG-CE 3.31Å; S385-K389 WeakPolarHBondContact OG-CE 3.38Å; S385-K389 PolarHBondContact OG-NZ 3.01Å
386	Q	85.5	Confident	91.8	Very high	73 Å²	73	95.1 Å²	95.1	34%	0.341	45%	0.451	S	S	.	.	H	α-helix	trans	-71.5	-43.4	174.8	-58.7	-59.8	23.9	0	0	111.9	W382 E383 K384 E388 K389 H390	W382-Q386 HydrophobicContact CD2-CG 3.98Å; W382-Q386 VanDerWaalsContact CE2-NE2 3.3Å; W382-Q386 HydrophobicContact CE3-CG 4.22Å; W382-Q386 HydrophobicContact CH2-CG 4.02Å; W382-Q386 HydrophobicContact CZ2-CG 3.8Å; W382-Q386 VanDerWaalsContact CZ2-NE2 3.34Å; W382-Q386 HydrophobicContact CZ3-CG 4.23Å; W382-Q386 WeakPolarHBondContact O-CG 3.47Å; W382-Q386 PolarHBondContact O-N 3.46Å; E383-Q386 PolarHBondContact O-N 2.95Å; K384-Q386 VanDerWaalsContact C-N 3.34Å; K384-Q386 PolarHBondContact O-N 3.45Å; Q386-E388 VanDerWaalsContact C-N 3.31Å; Q386-E388 PolarHBondContact O-N 2.85Å; Q386-K389 PolarHBondContact O-N 3.32Å; Q386-H390 WeakPolarHBondContact O-CB 3.37Å; Q386-H390 PolarHBondContact O-N 3.03Å
387	S	87.5	Confident	91.2	Very high	84 Å²	84	90.6 Å²	90.6	59%	0.587	43%	0.434	S	S	*	.	H	α-helix	trans	-59.1	-42.9	174.9	-174.4	0	0	0	0	111.8	E383 K384 H390 K391	E383-S387 PolarHBondContact O-N 3.32Å; K384-S387 PolarHBondContact O-N 2.95Å; S387-H390 PolarHBondContact O-N 2.91Å; S387-K391 WeakPolarHBondContact O-CB 3.28Å; S387-K391 PolarHBondContact O-N 2.73Å
388	E	92.9	Very high	90.6	Very high	105 Å²	105	92.8 Å²	92.8	49%	0.491	45%	0.449	S	S	.	.	H	α-helix	trans	-67.2	-40	176.8	-173.8	163.2	-158.3	0	0	112.5	K384 Q386 K391 N392	K384-E388 VanDerWaalsContact O-CB 3.32Å; K384-E388 WeakPolarHBondContact O-CB 2.99Å; K384-E388 PolarHBondContact O-N 3.46Å; Q386-E388 VanDerWaalsContact C-N 3.31Å; Q386-E388 PolarHBondContact O-N 2.85Å; E388-K391 PolarHBondContact O-N 3.01Å; E388-N392 VanDerWaalsContact O-CB 3.31Å; E388-N392 WeakPolarHBondContact O-CB 3.47Å; E388-N392 PolarHBondContact O-N 2.76Å; E388-N392 PolarHBondContact O-ND2 2.73Å
389	K	88.7	Confident	90.4	Very high	111 Å²	111	91.5 Å²	91.5	48%	0.483	45%	0.451	S	S	.	.	H	α-helix	trans	-63.9	-43.9	172	-74.2	162	-168.9	157.5	0	112.5	S385 Q386 N392 E393	S385-K389 WeakPolarHBondContact O-CB 3.4Å; S385-K389 WeakPolarHBondContact O-CD 3.43Å; S385-K389 WeakPolarHBondContact O-CG 3.47Å; S385-K389 PolarHBondContact O-N 3.34Å; S385-K389 VanDerWaalsContact OG-CE 3.31Å; S385-K389 WeakPolarHBondContact OG-CE 3.38Å; S385-K389 PolarHBondContact OG-NZ 3.01Å; Q386-K389 PolarHBondContact O-N 3.32Å; K389-N392 PolarHBondContact O-N 2.8Å; K389-E393 WeakPolarHBondContact O-CB 3.23Å; K389-E393 PolarHBondContact O-N 2.81Å
390	H	82.3	Confident	90.1	Very high	81 Å²	81	90.5 Å²	90.5	38%	0.375	45%	0.451	S	S	.	.	H	α-helix	trans	-59.4	-49.5	176.8	-176.8	121.3	0	0	0	109.8	Q386 S387 N392 E393 M394 E777	Q386-H390 WeakPolarHBondContact O-CB 3.37Å; Q386-H390 PolarHBondContact O-N 3.03Å; S387-H390 PolarHBondContact O-N 2.91Å; H390-N392 PolarHBondContact O-N 2.67Å; H390-E393 PolarHBondContact O-N 2.73Å; H390-M394 WeakPolarHBondContact NE2-CE 3.49Å; H390-M394 WeakPolarHBondContact O-CG 3.27Å; H390-M394 PolarHBondContact O-N 2.91Å; H390-E777 IonicContact ND1-OE1 2.75Å
391	K	88.5	Confident	89.7	Confident	128 Å²	128	87.6 Å²	87.6	56%	0.557	44%	0.436	S	S	*	.	H	α-helix	trans	-58.4	-50.7	176.8	-173.2	-170.2	171.6	-167.1	0	111.7	S387 E388 E393 M394 D395	S387-K391 WeakPolarHBondContact O-CB 3.28Å; S387-K391 PolarHBondContact O-N 2.73Å; E388-K391 PolarHBondContact O-N 3.01Å; K391-E393 VanDerWaalsContact C-N 3.25Å; K391-E393 PolarHBondContact O-N 3.45Å; K391-M394 PolarHBondContact O-N 3.32Å; K391-D395 VanDerWaalsContact CE-OD2 3.26Å; K391-D395 WeakPolarHBondContact CE-OD2 3.48Å; K391-D395 PolarHBondContact O-N 3.17Å
392	N	93	Very high	89.3	Confident	89 Å²	89	91 Å²	91	48%	0.476	44%	0.44	S	S	.	.	H	α-helix	trans	-62	-32.8	-179.4	-70.1	-20.8	0	0	0	112.3	E388 K389 H390 R396	E388-N392 VanDerWaalsContact O-CB 3.31Å; E388-N392 WeakPolarHBondContact O-CB 3.47Å; E388-N392 PolarHBondContact O-N 2.76Å; E388-N392 PolarHBondContact O-ND2 2.73Å; K389-N392 PolarHBondContact O-N 2.8Å; H390-N392 PolarHBondContact O-N 2.67Å; N392-R396 WeakPolarHBondContact O-CB 3.45Å; N392-R396 PolarHBondContact O-N 3.41Å
393	E	86.8	Confident	89.2	Confident	42 Å²	42	87.5 Å²	87.5	20%	0.196	43%	0.429	C	S	.	.	H	α-helix	trans	-68.4	-40	171.8	172.6	59	-177	0	0	112.3	K389 H390 K391 R396 R397	K389-E393 WeakPolarHBondContact O-CB 3.23Å; K389-E393 PolarHBondContact O-N 2.81Å; H390-E393 PolarHBondContact O-N 2.73Å; K391-E393 VanDerWaalsContact C-N 3.25Å; K391-E393 PolarHBondContact O-N 3.45Å; E393-R396 PolarHBondContact O-N 3.47Å; E393-R396 IonicContact OE1-NH2 3.95Å; E393-R396 PolarHBondContact OE1-NH2 2.98Å; E393-R396 IonicContact OE2-CZ 2.69Å; E393-R396 IonicContact OE2-NE 3.56Å; E393-R396 PolarHBondContact OE2-NE 2.89Å; E393-R396 IonicContact OE2-NH2 3.51Å; E393-R396 PolarHBondContact OE2-NH2 3.43Å; E393-R397 WeakPolarHBondContact O-CB 3.4Å; E393-R397 WeakPolarHBondContact O-CD 3.4Å; E393-R397 WeakPolarHBondContact O-CG 3.49Å; E393-R397 PolarHBondContact O-N 3.11Å; E393-R397 IonicContact OE1-CZ 3.61Å; E393-R397 IonicContact OE1-NE 2.66Å; E393-R397 PolarHBondContact OE1-NE 3.47Å; E393-R397 IonicContact OE1-NH2 2.71Å; E393-R397 PolarHBondContact OE1-NH2 2.77Å
394	M	82.9	Confident	89.1	Confident	41 Å²	41	83.9 Å²	83.9	20%	0.202	41%	0.411	C	S	.	.	H	α-helix	trans	-68.3	-45	175.6	-65.7	-54.4	164.3	0	0	112.2	H390 K391 R396 R397 V398 D754	H390-M394 WeakPolarHBondContact NE2-CE 3.49Å; H390-M394 WeakPolarHBondContact O-CG 3.27Å; H390-M394 PolarHBondContact O-N 2.91Å; K391-M394 PolarHBondContact O-N 3.32Å; M394-R396 VanDerWaalsContact C-N 3.28Å; M394-R396 PolarHBondContact O-N 2.78Å; M394-R397 WeakPolarHBondContact O-CB 3.42Å; M394-R397 PolarHBondContact O-N 2.92Å; M394-R397 VanDerWaalsContact O-N 3.12Å; M394-V398 WeakPolarHBondContact O-CG2 3.41Å; M394-V398 PolarHBondContact O-N 3.38Å; M394-D754 WeakPolarHBondContact CE-OD1 3.46Å
395	D	90.4	Very high	88.9	Confident	83 Å²	83	83 Å²	83	44%	0.444	40%	0.404	S	S	.	.	H	α-helix	trans	-59.8	-40.6	174.8	-70	-21.6	0	0	0	110.6	K391 V398 A399	K391-D395 VanDerWaalsContact CE-OD2 3.26Å; K391-D395 WeakPolarHBondContact CE-OD2 3.48Å; K391-D395 PolarHBondContact O-N 3.17Å; D395-V398 PolarHBondContact O-N 3.46Å; D395-A399 WeakPolarHBondContact O-CB 3.42Å; D395-A399 PolarHBondContact O-N 3.38Å
396	R	91.8	Very high	88.6	Confident	165 Å²	165	85.1 Å²	85.1	62%	0.623	41%	0.412	S	S	*	.	H	α-helix	trans	-62.6	-42.8	172.9	-173.9	178.1	78.3	126.9	3.5	112.6	N392 E393 M394 H400	N392-R396 WeakPolarHBondContact O-CB 3.45Å; N392-R396 PolarHBondContact O-N 3.41Å; E393-R396 PolarHBondContact O-N 3.47Å; E393-R396 IonicContact OE1-NH2 3.95Å; E393-R396 PolarHBondContact OE1-NH2 2.98Å; E393-R396 IonicContact OE2-CZ 2.69Å; E393-R396 IonicContact OE2-NE 3.56Å; E393-R396 PolarHBondContact OE2-NE 2.89Å; E393-R396 IonicContact OE2-NH2 3.51Å; E393-R396 PolarHBondContact OE2-NH2 3.43Å; M394-R396 VanDerWaalsContact C-N 3.28Å; M394-R396 PolarHBondContact O-N 2.78Å; R396-H400 VanDerWaalsContact O-CB 3.25Å; R396-H400 WeakPolarHBondContact O-CB 3.41Å; R396-H400 PolarHBondContact O-N 2.9Å
397	R	85.2	Confident	88.8	Confident	45 Å²	45	86.6 Å²	86.6	17%	0.17	42%	0.418	C	S	.	.	H	α-helix	trans	-63	-44.7	176.4	-75.2	163.3	175.8	-147.6	-7.4	111.7	E393 M394 H400 D401 Y664 F753 D754	E393-R397 WeakPolarHBondContact O-CB 3.4Å; E393-R397 WeakPolarHBondContact O-CD 3.4Å; E393-R397 WeakPolarHBondContact O-CG 3.49Å; E393-R397 PolarHBondContact O-N 3.11Å; E393-R397 IonicContact OE1-CZ 3.61Å; E393-R397 IonicContact OE1-NE 2.66Å; E393-R397 PolarHBondContact OE1-NE 3.47Å; E393-R397 IonicContact OE1-NH2 2.71Å; E393-R397 PolarHBondContact OE1-NH2 2.77Å; M394-R397 WeakPolarHBondContact O-CB 3.42Å; M394-R397 PolarHBondContact O-N 2.92Å; M394-R397 VanDerWaalsContact O-N 3.12Å; R397-H400 PolarHBondContact O-N 2.92Å; R397-D401 PolarHBondContact O-N 3.44Å; R397-Y664 PolarHBondContact NH2-OH 2.89Å; R397-Y664 VanDerWaalsContact NH2-OH 3.07Å; R397-F753 PolarHBondContact NH1-O 3.38Å; R397-D754 IonicContact NH1-OD1 2.67Å
398	V	86.4	Confident	89.1	Confident	102 Å²	102	83.1 Å²	83.1	62%	0.618	39%	0.394	S	S	*	.	H	α-helix	trans	-64.5	-46.7	178.5	172.1	0	0	0	0	111.1	M394 D395 H400 D401 F402	M394-V398 WeakPolarHBondContact O-CG2 3.41Å; M394-V398 PolarHBondContact O-N 3.38Å; D395-V398 PolarHBondContact O-N 3.46Å; V398-H400 VanDerWaalsContact C-N 3.32Å; V398-H400 PolarHBondContact O-N 3.03Å; V398-D401 PolarHBondContact O-N 2.92Å; V398-F402 WeakPolarHBondContact O-CB 3.33Å; V398-F402 PolarHBondContact O-N 3.08Å
399	A	92	Very high	88.9	Confident	60 Å²	60	82.4 Å²	82.4	50%	0.496	39%	0.389	S	S	.	.	H	α-helix	trans	-61.4	-39.6	175.9	0	0	0	0	0	112.4	D395 F402 E403	D395-A399 WeakPolarHBondContact O-CB 3.42Å; D395-A399 PolarHBondContact O-N 3.38Å; A399-F402 PolarHBondContact O-N 2.77Å; A399-E403 PolarHBondContact O-N 3.3Å
400	H	89.6	Confident	89	Confident	114 Å²	114	80 Å²	80	53%	0.528	38%	0.384	S	S	.	.	H	α-helix	trans	-68.9	-37.8	177.7	-175.3	62.6	0	0	0	113.2	R396 R397 V398 R404	R396-H400 VanDerWaalsContact O-CB 3.25Å; R396-H400 WeakPolarHBondContact O-CB 3.41Å; R396-H400 PolarHBondContact O-N 2.9Å; R397-H400 PolarHBondContact O-N 2.92Å; V398-H400 VanDerWaalsContact C-N 3.32Å; V398-H400 PolarHBondContact O-N 3.03Å; H400-R404 VanDerWaalsContact NE2-CD 3.33Å; H400-R404 WeakPolarHBondContact NE2-CD 3.48Å; H400-R404 WeakPolarHBondContact O-CB 3.23Å; H400-R404 VanDerWaalsContact O-CG 3.26Å; H400-R404 WeakPolarHBondContact O-CG 3.33Å; H400-R404 PolarHBondContact O-N 3.32Å; H400-R404 VanDerWaalsContact O-N 3.15Å
401	D	87.1	Confident	89.4	Confident	23 Å²	23	79.6 Å²	79.6	12%	0.123	39%	0.387	C	S	.	.	H	α-helix	trans	-62.3	-47.9	171.4	-172.6	1.7	0	0	0	110.9	R397 V398 E403 R404 R405 R416	R397-D401 PolarHBondContact O-N 3.44Å; V398-D401 PolarHBondContact O-N 2.92Å; D401-E403 PolarHBondContact O-N 3.07Å; D401-R404 PolarHBondContact O-N 3.29Å; D401-R405 WeakPolarHBondContact O-CG 3.39Å; D401-R405 PolarHBondContact O-N 2.95Å; D401-R405 IonicContact OD1-CZ 3.15Å; D401-R405 IonicContact OD1-NE 2.78Å; D401-R405 PolarHBondContact OD1-NE 3.11Å; D401-R405 IonicContact OD1-NH2 3.2Å; D401-R405 IonicContact OD2-CZ 2.81Å; D401-R405 IonicContact OD2-NE 2.78Å; D401-R405 IonicContact OD2-NH2 3.09Å; D401-R405 PolarHBondContact OD2-NH2 2.83Å; D401-R416 VanDerWaalsContact CG-NE 3.34Å; D401-R416 IonicContact OD1-CZ 2.7Å; D401-R416 IonicContact OD1-NE 3.25Å; D401-R416 PolarHBondContact OD1-NE 2.92Å; D401-R416 IonicContact OD1-NH2 3.78Å; D401-R416 PolarHBondContact OD1-NH2 3.26Å; D401-R416 IonicContact OD2-CZ 2.62Å; D401-R416 IonicContact OD2-NE 3.63Å; D401-R416 IonicContact OD2-NH2 3.99Å; D401-R416 PolarHBondContact OD2-NH2 3.46Å
402	F	89.5	Confident	89.5	Confident	134 Å²	134	74.6 Å²	74.6	59%	0.588	37%	0.369	S	S	*	.	H	α-helix	trans	-56.8	-49.7	179.1	-175.4	-107.5	0	0	0	112.5	V398 A399 R404 R405 L406	V398-F402 WeakPolarHBondContact O-CB 3.33Å; V398-F402 PolarHBondContact O-N 3.08Å; A399-F402 PolarHBondContact O-N 2.77Å; F402-R404 VanDerWaalsContact C-N 3.28Å; F402-R404 PolarHBondContact O-N 2.55Å; F402-R405 PolarHBondContact O-N 2.76Å; F402-L406 HydrophobicContact CD1-CD1 3.91Å; F402-L406 HydrophobicContact CE1-CD1 3.47Å; F402-L406 VanDerWaalsContact CE1-CD1 3.47Å; F402-L406 HydrophobicContact CE1-CG 4.27Å; F402-L406 HydrophobicContact CZ-CD1 3.86Å; F402-L406 HydrophobicContact CZ-CD2 4.5Å; F402-L406 HydrophobicContact CZ-CG 4.32Å; F402-L406 WeakPolarHBondContact O-CG 3.17Å; F402-L406 PolarHBondContact O-N 3.09Å
403	E	91.3	Very high	89.5	Confident	69 Å²	69	70.5 Å²	70.5	32%	0.322	35%	0.348	S	S	.	.	H	α-helix	trans	-57.7	-37.9	174	168.2	57.7	-165.7	0	0	112.5	A399 D401 H407 K409	A399-E403 PolarHBondContact O-N 3.3Å; D401-E403 PolarHBondContact O-N 3.07Å; E403-H407 WeakPolarHBondContact O-CB 3.4Å; E403-H407 PolarHBondContact O-N 3.4Å; E403-H407 IonicContact OE1-CD2 2.78Å; E403-H407 IonicContact OE2-CD2 3.21Å; E403-K409 IonicContact OE1-NZ 2.69Å; E403-K409 PolarHBondContact OE1-NZ 2.89Å
404	R	91.1	Very high	89.8	Confident	25 Å²	25	68.9 Å²	68.9	9%	0.094	34%	0.34	C	S	.	.	H	α-helix	trans	-74.6	-28.7	178.8	-73.3	174.5	61.4	-148.2	-3.1	113.5	H400 D401 F402 P408 D413 E660	H400-R404 VanDerWaalsContact NE2-CD 3.33Å; H400-R404 WeakPolarHBondContact NE2-CD 3.48Å; H400-R404 WeakPolarHBondContact O-CB 3.23Å; H400-R404 VanDerWaalsContact O-CG 3.26Å; H400-R404 WeakPolarHBondContact O-CG 3.33Å; H400-R404 PolarHBondContact O-N 3.32Å; H400-R404 VanDerWaalsContact O-N 3.15Å; D401-R404 PolarHBondContact O-N 3.29Å; F402-R404 VanDerWaalsContact C-N 3.28Å; F402-R404 PolarHBondContact O-N 2.55Å; R404-P408 WeakPolarHBondContact O-CA 3.39Å; R404-D413 IonicContact CZ-OD1 3.77Å; R404-D413 IonicContact NE-OD1 3.17Å; R404-D413 PolarHBondContact NE-OD1 2.99Å; R404-D413 IonicContact NH2-OD1 2.72Å; R404-D413 PolarHBondContact NH2-OD1 3.45Å; R404-E660 IonicContact CZ-OE1 2.74Å; R404-E660 VanDerWaalsContact CZ-OE1 3.28Å; R404-E660 IonicContact CZ-OE2 2.68Å; R404-E660 VanDerWaalsContact CZ-OE2 3.31Å; R404-E660 VanDerWaalsContact NH1-CD 3.3Å; R404-E660 IonicContact NH1-OE1 3.73Å; R404-E660 PolarHBondContact NH1-OE1 2.98Å; R404-E660 IonicContact NH1-OE2 3.68Å; R404-E660 PolarHBondContact NH1-OE2 3.39Å; R404-E660 IonicContact NH2-OE1 3.5Å; R404-E660 PolarHBondContact NH2-OE1 3.32Å; R404-E660 IonicContact NH2-OE2 2.62Å; R404-E660 PolarHBondContact NH2-OE2 3.13Å
405	R	89.8	Confident	90.3	Very high	125 Å²	125	67.8 Å²	67.8	47%	0.472	34%	0.335	S	S	.	.	H	α-helix	trans	-72.2	-41.9	171.1	-66.2	178.9	-163.8	-156	9.3	111.5	D401 F402 L417	D401-R405 WeakPolarHBondContact O-CG 3.39Å; D401-R405 PolarHBondContact O-N 2.95Å; D401-R405 IonicContact OD1-CZ 3.15Å; D401-R405 IonicContact OD1-NE 2.78Å; D401-R405 PolarHBondContact OD1-NE 3.11Å; D401-R405 IonicContact OD1-NH2 3.2Å; D401-R405 IonicContact OD2-CZ 2.81Å; D401-R405 IonicContact OD2-NE 2.78Å; D401-R405 IonicContact OD2-NH2 3.09Å; D401-R405 PolarHBondContact OD2-NH2 2.83Å; F402-R405 PolarHBondContact O-N 2.76Å; R405-L417 HydrophobicContact CB-CD2 4.28Å; R405-L417 HydrophobicContact CG-CD2 4.42Å
406	L	88.5	Confident	90.3	Very high	88 Å²	88	65.2 Å²	65.2	46%	0.461	32%	0.319	S	S	.	.	H	α-helix	trans	-66.3	-43.2	175.2	-70.7	-180	0	0	0	112.3	F402 P408	F402-L406 HydrophobicContact CD1-CD1 3.91Å; F402-L406 HydrophobicContact CE1-CD1 3.47Å; F402-L406 VanDerWaalsContact CE1-CD1 3.47Å; F402-L406 HydrophobicContact CE1-CG 4.27Å; F402-L406 HydrophobicContact CZ-CD1 3.86Å; F402-L406 HydrophobicContact CZ-CD2 4.5Å; F402-L406 HydrophobicContact CZ-CG 4.32Å; F402-L406 WeakPolarHBondContact O-CG 3.17Å; F402-L406 PolarHBondContact O-N 3.09Å; L406-P408 WeakPolarHBondContact O-CD 3.35Å
407	H	89.8	Confident	90.5	Very high	104 Å²	104	59 Å²	59	48%	0.481	30%	0.298	S	S	.	.	S	Bend	trans	-130.2	69.3	-169.4	-63	-21.9	0	0	0	111.6	E403 K409	E403-H407 WeakPolarHBondContact O-CB 3.4Å; E403-H407 PolarHBondContact O-N 3.4Å; E403-H407 IonicContact OE1-CD2 2.78Å; E403-H407 IonicContact OE2-CD2 3.21Å; H407-K409 WeakPolarHBondContact O-CD 3.45Å; H407-K409 VanDerWaalsContact O-CE 3.31Å; H407-K409 WeakPolarHBondContact O-CE 3.35Å; H407-K409 VanDerWaalsContact O-CG 3.31Å; H407-K409 WeakPolarHBondContact O-CG 3.4Å; H407-K409 PolarHBondContact O-N 3.48Å; H407-K409 VanDerWaalsContact O-N 3.15Å
408	P	93.6	Very high	90.9	Very high	12 Å²	12	57.4 Å²	57.4	8%	0.078	29%	0.292	C	S	.	.			trans	-64.8	113.6	-179	27.3	-36.6	0	0	0	111.5	R404 L406 D413 F414 L417	R404-P408 WeakPolarHBondContact O-CA 3.39Å; L406-P408 WeakPolarHBondContact O-CD 3.35Å; P408-D413 HydrophobicContact CB-CB 3.72Å; P408-F414 HydrophobicContact CB-CD1 4.12Å; P408-F414 HydrophobicContact CB-CE1 3.82Å; P408-F414 HydrophobicContact CB-CE2 4.37Å; P408-F414 HydrophobicContact CB-CZ 3.95Å; P408-F414 HydrophobicContact CG-CD1 4.4Å; P408-F414 HydrophobicContact CG-CE1 3.8Å; P408-F414 HydrophobicContact CG-CZ 4.12Å; P408-L417 HydrophobicContact CB-CD1 3.89Å; P408-L417 HydrophobicContact CG-CD1 3.81Å
409	K	89.2	Confident	91.3	Very high	90 Å²	90	54.2 Å²	54.2	39%	0.391	27%	0.272	S	S	.	.			trans	-110.4	-35.1	-174.1	-71.2	145.1	-167.2	167.2	0	112.7	E403 H407 D413 R467	E403-K409 IonicContact OE1-NZ 2.69Å; E403-K409 PolarHBondContact OE1-NZ 2.89Å; H407-K409 WeakPolarHBondContact O-CD 3.45Å; H407-K409 VanDerWaalsContact O-CE 3.31Å; H407-K409 WeakPolarHBondContact O-CE 3.35Å; H407-K409 VanDerWaalsContact O-CG 3.31Å; H407-K409 WeakPolarHBondContact O-CG 3.4Å; H407-K409 PolarHBondContact O-N 3.48Å; H407-K409 VanDerWaalsContact O-N 3.15Å; K409-D413 PolarHBondContact N-OD2 3.03Å; K409-R467 PolarHBondContact O-NE 2.89Å
410	T	90.8	Very high	91.4	Very high	59 Å²	59	52.9 Å²	52.9	36%	0.362	26%	0.261	S	S	.	.	S	Bend	trans	-102.2	172.1	-173	86	0	0	0	0	112.8	A412 D413 F414	T410-A412 PolarHBondContact OG1-N 2.96Å; T410-D413 PolarHBondContact N-OD2 3.3Å; T410-D413 PolarHBondContact OG1-N 3.26Å; T410-D413 PolarHBondContact OG1-OD1 3.21Å; T410-D413 PolarHBondContact OG1-OD2 3.22Å; T410-F414 WeakPolarHBondContact O-CD2 3.28Å
411	V	89.5	Confident	91.6	Very high	73 Å²	73	48 Å²	48	44%	0.442	24%	0.238	S	C	.	.	H	α-helix	trans	-61.1	-42.1	168.8	146.8	0	0	0	0	112.3	R648	V411-R648 PolarHBondContact O-NH2 3.06Å
412	A	90.8	Very high	92	Very high	23 Å²	23	47.5 Å²	47.5	19%	0.19	24%	0.235	C	C	.	.	H	α-helix	trans	-66.4	-39.6	-178.7	0	0	0	0	0	111.8	T410 F414 D415 R416 E660	T410-A412 PolarHBondContact OG1-N 2.96Å; A412-F414 VanDerWaalsContact C-N 3.3Å; A412-F414 PolarHBondContact O-N 3.16Å; A412-D415 WeakPolarHBondContact O-CA 3.31Å; A412-D415 PolarHBondContact O-N 3.12Å; A412-R416 PolarHBondContact O-N 2.96Å; A412-E660 HydrophobicContact CB-CB 4.46Å; A412-E660 WeakPolarHBondContact CB-OE1 3.29Å
413	D	92.6	Very high	92.2	Very high	3 Å²	3	45.2 Å²	45.2	2%	0.016	23%	0.229	C	C	.	.	H	α-helix	trans	-57.4	-42.4	-176.4	-49.6	-8.1	0	0	0	112	R404 P408 K409 T410 D415 R416 L417	R404-D413 IonicContact CZ-OD1 3.77Å; R404-D413 IonicContact NE-OD1 3.17Å; R404-D413 PolarHBondContact NE-OD1 2.99Å; R404-D413 IonicContact NH2-OD1 2.72Å; R404-D413 PolarHBondContact NH2-OD1 3.45Å; P408-D413 HydrophobicContact CB-CB 3.72Å; K409-D413 PolarHBondContact N-OD2 3.03Å; T410-D413 PolarHBondContact N-OD2 3.3Å; T410-D413 PolarHBondContact OG1-N 3.26Å; T410-D413 PolarHBondContact OG1-OD1 3.21Å; T410-D413 PolarHBondContact OG1-OD2 3.22Å; D413-D415 VanDerWaalsContact C-N 3.35Å; D413-D415 PolarHBondContact O-N 3.4Å; D413-R416 PolarHBondContact O-N 3.2Å; D413-L417 WeakPolarHBondContact O-CG 3.12Å; D413-L417 PolarHBondContact O-N 3.29Å
414	F	93.9	Very high	92.5	Very high	9 Å²	9	45 Å²	45	4%	0.039	23%	0.225	C	C	.	.	H	α-helix	trans	-68.1	-33.2	176	-68.4	-71	0	0	0	112.9	P408 T410 A412 L417 Y418 I460 H463 Q464 R467 R652	P408-F414 HydrophobicContact CB-CD1 4.12Å; P408-F414 HydrophobicContact CB-CE1 3.82Å; P408-F414 HydrophobicContact CB-CE2 4.37Å; P408-F414 HydrophobicContact CB-CZ 3.95Å; P408-F414 HydrophobicContact CG-CD1 4.4Å; P408-F414 HydrophobicContact CG-CE1 3.8Å; P408-F414 HydrophobicContact CG-CZ 4.12Å; T410-F414 WeakPolarHBondContact O-CD2 3.28Å; A412-F414 VanDerWaalsContact C-N 3.3Å; A412-F414 PolarHBondContact O-N 3.16Å; F414-L417 PolarHBondContact O-N 2.88Å; F414-Y418 WeakPolarHBondContact O-CD2 3.41Å; F414-Y418 PolarHBondContact O-N 3.27Å; F414-Y418 VanDerWaalsContact O-N 3.08Å; F414-I460 HydrophobicContact CD1-CG2 4.16Å; F414-H463 HydrophobicContact CE1-CB 3.95Å; F414-Q464 HydrophobicContact CD1-CB 4.11Å; F414-Q464 HydrophobicContact CD1-CG 4.45Å; F414-Q464 HydrophobicContact CD2-CG 4.31Å; F414-Q464 HydrophobicContact CE1-CB 3.85Å; F414-Q464 HydrophobicContact CE1-CG 4.39Å; F414-Q464 HydrophobicContact CE2-CG 4.26Å; F414-Q464 HydrophobicContact CG-CG 4.42Å; F414-Q464 HydrophobicContact CZ-CB 4.09Å; F414-Q464 HydrophobicContact CZ-CG 4.31Å; F414-R467 HydrophobicContact CE2-CB 4.26Å; F414-R467 HydrophobicContact CE2-CG 4.13Å; F414-R467 HydrophobicContact CZ-CB 3.92Å; F414-R467 HydrophobicContact CZ-CG 4.21Å; F414-R652 VanDerWaalsContact CB-NH2 3.26Å
415	D	92.6	Very high	92.7	Very high	18 Å²	18	46.3 Å²	46.3	10%	0.096	23%	0.23	C	C	.	.	H	α-helix	trans	-74.2	-35.8	178.3	-61.6	-13	0	0	0	110.6	A412 D413 L417 Y418 N419 R648 R652	A412-D415 WeakPolarHBondContact O-CA 3.31Å; A412-D415 PolarHBondContact O-N 3.12Å; D413-D415 VanDerWaalsContact C-N 3.35Å; D413-D415 PolarHBondContact O-N 3.4Å; D415-L417 VanDerWaalsContact C-N 3.34Å; D415-L417 PolarHBondContact O-N 3.38Å; D415-Y418 PolarHBondContact O-N 3.44Å; D415-N419 PolarHBondContact O-N 3.43Å; D415-R648 VanDerWaalsContact CG-NE 3.34Å; D415-R648 IonicContact OD1-CZ 2.73Å; D415-R648 VanDerWaalsContact OD1-CZ 3.31Å; D415-R648 IonicContact OD1-NE 3.37Å; D415-R648 PolarHBondContact OD1-NE 2.71Å; D415-R648 VanDerWaalsContact OD1-NE 3.09Å; D415-R648 IonicContact OD1-NH2 2.79Å; D415-R648 PolarHBondContact OD1-NH2 2.76Å; D415-R648 IonicContact OD2-CZ 2.7Å; D415-R648 IonicContact OD2-NE 2.68Å; D415-R648 PolarHBondContact OD2-NE 2.88Å; D415-R648 IonicContact OD2-NH2 2.77Å; D415-R648 PolarHBondContact OD2-NH2 3.33Å; D415-R652 IonicContact OD1-CZ 3.6Å; D415-R652 IonicContact OD1-NE 3.63Å; D415-R652 PolarHBondContact OD1-NE 3.19Å; D415-R652 IonicContact OD1-NH2 2.89Å; D415-R652 PolarHBondContact OD1-NH2 3.32Å
416	R	91.8	Very high	93	Very high	28 Å²	28	45.1 Å²	45.1	11%	0.106	23%	0.228	C	C	.	.	H	α-helix	trans	-60.8	-38.3	169.4	-165.3	176.1	-173.4	101.3	6.7	112.2	D401 A412 D413 N419 A420 D658 E660	D401-R416 VanDerWaalsContact CG-NE 3.34Å; D401-R416 IonicContact OD1-CZ 2.7Å; D401-R416 IonicContact OD1-NE 3.25Å; D401-R416 PolarHBondContact OD1-NE 2.92Å; D401-R416 IonicContact OD1-NH2 3.78Å; D401-R416 PolarHBondContact OD1-NH2 3.26Å; D401-R416 IonicContact OD2-CZ 2.62Å; D401-R416 IonicContact OD2-NE 3.63Å; D401-R416 IonicContact OD2-NH2 3.99Å; D401-R416 PolarHBondContact OD2-NH2 3.46Å; A412-R416 PolarHBondContact O-N 2.96Å; D413-R416 PolarHBondContact O-N 3.2Å; R416-N419 PolarHBondContact O-N 2.84Å; R416-A420 PolarHBondContact O-N 2.84Å; R416-D658 IonicContact NH1-OD2 3.94Å; R416-E660 IonicContact CZ-OE2 3.21Å; R416-E660 IonicContact NH1-OE2 3.89Å; R416-E660 PolarHBondContact NH1-OE2 2.99Å
417	L	94.5	Very high	93.4	Very high	34 Å²	34	45.9 Å²	45.9	18%	0.178	23%	0.229	C	C	.	.	H	α-helix	trans	-66.4	-40.8	171.2	-73.3	174	0	0	0	112.9	R405 P408 D413 F414 D415 N419 A420 L421 I460	R405-L417 HydrophobicContact CB-CD2 4.28Å; R405-L417 HydrophobicContact CG-CD2 4.42Å; P408-L417 HydrophobicContact CB-CD1 3.89Å; P408-L417 HydrophobicContact CG-CD1 3.81Å; D413-L417 WeakPolarHBondContact O-CG 3.12Å; D413-L417 PolarHBondContact O-N 3.29Å; F414-L417 PolarHBondContact O-N 2.88Å; D415-L417 VanDerWaalsContact C-N 3.34Å; D415-L417 PolarHBondContact O-N 3.38Å; L417-N419 VanDerWaalsContact C-N 3.31Å; L417-N419 PolarHBondContact O-N 3.46Å; L417-A420 PolarHBondContact O-N 3.12Å; L417-L421 WeakPolarHBondContact O-CB 3.26Å; L417-L421 PolarHBondContact O-N 3.27Å; L417-I460 HydrophobicContact CB-CD1 4.25Å; L417-I460 HydrophobicContact CB-CG1 4.46Å
418	Y	95.4	Very high	93.7	Very high	13 Å²	13	43.3 Å²	43.3	5%	0.051	22%	0.218	C	C	.	.	H	α-helix	trans	-63.9	-35.7	172.4	-80.4	-69.6	0	0	0	112.2	F414 D415 L421 E422 I457 I460 N461 R652	F414-Y418 WeakPolarHBondContact O-CD2 3.41Å; F414-Y418 PolarHBondContact O-N 3.27Å; F414-Y418 VanDerWaalsContact O-N 3.08Å; D415-Y418 PolarHBondContact O-N 3.44Å; Y418-L421 PolarHBondContact O-N 2.89Å; Y418-E422 WeakPolarHBondContact O-CB 3.19Å; Y418-E422 PolarHBondContact O-N 2.86Å; Y418-I457 HydrophobicContact CE1-CG1 4.29Å; Y418-I457 HydrophobicContact CE1-CG2 4.44Å; Y418-I460 HydrophobicContact CD1-CD1 4.44Å; Y418-I460 HydrophobicContact CD2-CG2 4.31Å; Y418-I460 HydrophobicContact CE1-CD1 4.41Å; Y418-I460 HydrophobicContact CE1-CG2 4.45Å; Y418-I460 HydrophobicContact CE2-CG2 3.63Å; Y418-N461 PolarHBondContact OH-OD1 2.68Å; Y418-R652 HydrophobicContact CD2-CG 3.96Å; Y418-R652 HydrophobicContact CE2-CG 4.36Å; Y418-R652 VanDerWaalsContact CE2-CZ 3.48Å; Y418-R652 HydrophobicContact CG-CG 4.33Å
419	N	94.2	Very high	93.8	Very high	35 Å²	35	44.6 Å²	44.6	19%	0.187	23%	0.225	C	C	.	.	H	α-helix	trans	-67.9	-40.9	174.7	-171.3	93.5	0	0	0	112.1	D415 R416 L417 E422 L423 R656 L657 D658	D415-N419 PolarHBondContact O-N 3.43Å; R416-N419 PolarHBondContact O-N 2.84Å; L417-N419 VanDerWaalsContact C-N 3.31Å; L417-N419 PolarHBondContact O-N 3.46Å; N419-E422 WeakPolarHBondContact O-CB 3.32Å; N419-E422 PolarHBondContact O-N 2.95Å; N419-L423 WeakPolarHBondContact O-CG 3.41Å; N419-L423 PolarHBondContact O-N 3.15Å; N419-R656 WeakPolarHBondContact CA-O 3.47Å; N419-R656 VanDerWaalsContact CB-O 3.31Å; N419-R656 WeakPolarHBondContact CB-O 3.39Å; N419-R656 PolarHBondContact N-O 3.39Å; N419-L657 WeakPolarHBondContact OD1-CA 3.28Å; N419-D658 HydrophobicContact CB-CB 3.91Å; N419-D658 PolarHBondContact OD1-N 2.88Å
420	A	93.4	Very high	94.1	Very high	32 Å²	32	43 Å²	43	26%	0.264	23%	0.225	S	C	.	.	H	α-helix	trans	-63.2	-41.8	174	0	0	0	0	0	112	R416 L417 E422 L423 W424	R416-A420 PolarHBondContact O-N 2.84Å; L417-A420 PolarHBondContact O-N 3.12Å; A420-E422 VanDerWaalsContact C-N 3.32Å; A420-E422 PolarHBondContact O-N 2.97Å; A420-L423 PolarHBondContact O-N 2.83Å; A420-W424 WeakPolarHBondContact O-CB 3.43Å; A420-W424 PolarHBondContact O-N 3.15Å
421	L	95.1	Very high	94.4	Very high	12 Å²	12	44.1 Å²	44.1	6%	0.063	23%	0.225	C	C	.	.	H	α-helix	trans	-62.3	-38.2	173.5	-178.3	69.4	0	0	0	112.3	L417 Y418 W424 R425 E453 L456 I457 I460	L417-L421 WeakPolarHBondContact O-CB 3.26Å; L417-L421 PolarHBondContact O-N 3.27Å; Y418-L421 PolarHBondContact O-N 2.89Å; L421-W424 HydrophobicContact CD1-CE3 3.7Å; L421-W424 HydrophobicContact CD1-CZ3 3.98Å; L421-R425 WeakPolarHBondContact O-CB 3.31Å; L421-R425 PolarHBondContact O-N 3.04Å; L421-E453 HydrophobicContact CD2-CG 4.45Å; L421-L456 HydrophobicContact CD1-CB 3.71Å; L421-L456 HydrophobicContact CD1-CD1 3.54Å; L421-L456 HydrophobicContact CD1-CG 4.27Å; L421-I457 HydrophobicContact CD2-CD1 4.29Å; L421-I457 HydrophobicContact CD2-CG1 3.56Å; L421-I460 HydrophobicContact CD2-CD1 4.28Å
422	E	95.2	Very high	94.6	Very high	11 Å²	11	41.2 Å²	41.2	5%	0.051	21%	0.207	C	C	.	.	H	α-helix	trans	-67.6	-35.9	177	-179.3	62.8	-156.3	0	0	113	Y418 N419 A420 R425 K426 R656	Y418-E422 WeakPolarHBondContact O-CB 3.19Å; Y418-E422 PolarHBondContact O-N 2.86Å; N419-E422 WeakPolarHBondContact O-CB 3.32Å; N419-E422 PolarHBondContact O-N 2.95Å; A420-E422 VanDerWaalsContact C-N 3.32Å; A420-E422 PolarHBondContact O-N 2.97Å; E422-R425 IonicContact OE1-CZ 3.87Å; E422-R425 IonicContact OE1-NH2 2.85Å; E422-R425 PolarHBondContact OE1-NH2 3.44Å; E422-R425 IonicContact OE2-CZ 3.22Å; E422-R425 VanDerWaalsContact OE2-CZ 3.22Å; E422-R425 IonicContact OE2-NH1 2.74Å; E422-R425 PolarHBondContact OE2-NH1 3.48Å; E422-R425 IonicContact OE2-NH2 2.92Å; E422-R425 PolarHBondContact OE2-NH2 2.68Å; E422-K426 VanDerWaalsContact CG-NZ 3.34Å; E422-K426 WeakPolarHBondContact O-CD 3.36Å; E422-K426 WeakPolarHBondContact O-CG 3.46Å; E422-K426 PolarHBondContact O-N 3.11Å; E422-K426 WeakPolarHBondContact OE1-CE 3.42Å; E422-K426 IonicContact OE1-NZ 2.8Å; E422-K426 PolarHBondContact OE1-NZ 2.83Å; E422-R656 HydrophobicContact CB-CB 3.71Å; E422-R656 HydrophobicContact CB-CG 4.48Å; E422-R656 HydrophobicContact CG-CB 3.94Å; E422-R656 IonicContact OE2-NH1 3.16Å
423	L	94.2	Very high	94.7	Very high	87 Å²	87	45.7 Å²	45.7	46%	0.455	22%	0.224	S	C	.	.	H	α-helix	trans	-69.2	-51	173.1	-69.8	169.1	0	0	0	110.8	N419 A420 R425 K426 E427	N419-L423 WeakPolarHBondContact O-CG 3.41Å; N419-L423 PolarHBondContact O-N 3.15Å; A420-L423 PolarHBondContact O-N 2.83Å; L423-R425 VanDerWaalsContact C-N 3.32Å; L423-R425 PolarHBondContact O-N 2.81Å; L423-K426 WeakPolarHBondContact O-CB 3.27Å; L423-K426 PolarHBondContact O-N 3.01Å; L423-E427 PolarHBondContact O-N 2.8Å
424	W	95.7	Very high	94.8	Very high	64 Å²	64	52.7 Å²	52.7	24%	0.242	26%	0.256	C	S	.	.	H	α-helix	trans	-53.5	-46.4	175.1	168.6	78.6	0	0	0	112.2	A420 L421 K426 E427 E428 E452 E453 L456	A420-W424 WeakPolarHBondContact O-CB 3.43Å; A420-W424 PolarHBondContact O-N 3.15Å; L421-W424 HydrophobicContact CD1-CE3 3.7Å; L421-W424 HydrophobicContact CD1-CZ3 3.98Å; W424-K426 VanDerWaalsContact C-N 3.29Å; W424-K426 PolarHBondContact O-N 3.32Å; W424-E427 PolarHBondContact O-N 3.03Å; W424-E428 HydrophobicContact CD2-CG 4.4Å; W424-E428 HydrophobicContact CZ2-CG 4.1Å; W424-E428 PolarHBondContact O-N 3.29Å; W424-E452 HydrophobicContact CH2-CB 3.96Å; W424-E453 HydrophobicContact CZ3-CB 4.39Å; W424-L456 HydrophobicContact CE3-CD1 4.2Å; W424-L456 HydrophobicContact CH2-CD1 4.02Å; W424-L456 HydrophobicContact CZ2-CD1 4.42Å; W424-L456 HydrophobicContact CZ3-CD1 3.9Å
425	R	95.7	Very high	94.7	Very high	53 Å²	53	57.6 Å²	57.6	20%	0.2	28%	0.278	C	S	.	.	H	α-helix	trans	-62.4	-36.7	178.4	-162.2	-167.6	68.5	-114	-16	111.9	L421 E422 L423 V429 L449 E453	L421-R425 WeakPolarHBondContact O-CB 3.31Å; L421-R425 PolarHBondContact O-N 3.04Å; E422-R425 IonicContact OE1-CZ 3.87Å; E422-R425 IonicContact OE1-NH2 2.85Å; E422-R425 PolarHBondContact OE1-NH2 3.44Å; E422-R425 IonicContact OE2-CZ 3.22Å; E422-R425 VanDerWaalsContact OE2-CZ 3.22Å; E422-R425 IonicContact OE2-NH1 2.74Å; E422-R425 PolarHBondContact OE2-NH1 3.48Å; E422-R425 IonicContact OE2-NH2 2.92Å; E422-R425 PolarHBondContact OE2-NH2 2.68Å; L423-R425 VanDerWaalsContact C-N 3.32Å; L423-R425 PolarHBondContact O-N 2.81Å; R425-V429 HydrophobicContact CG-CG2 4.37Å; R425-V429 VanDerWaalsContact O-CB 3.24Å; R425-V429 WeakPolarHBondContact O-CB 3.28Å; R425-V429 WeakPolarHBondContact O-CG2 3.31Å; R425-V429 PolarHBondContact O-N 3.28Å; R425-L449 HydrophobicContact CG-CD2 3.75Å; R425-E453 VanDerWaalsContact CD-CD 3.4Å; R425-E453 WeakPolarHBondContact CD-OE1 3.44Å; R425-E453 WeakPolarHBondContact CD-OE2 3.45Å; R425-E453 IonicContact CZ-OE1 3.87Å; R425-E453 IonicContact NE-OE1 3.99Å; R425-E453 IonicContact NH1-OE1 2.95Å; R425-E453 PolarHBondContact NH1-OE1 2.84Å
426	K	95.6	Very high	94.5	Very high	100 Å²	100	65.2 Å²	65.2	44%	0.435	32%	0.318	S	S	.	.	H	α-helix	trans	-66.2	-44.4	175.2	-75.7	165.2	-178.7	149.4	0	111.3	E422 L423 W424 V429 S430	E422-K426 VanDerWaalsContact CG-NZ 3.34Å; E422-K426 WeakPolarHBondContact O-CD 3.36Å; E422-K426 WeakPolarHBondContact O-CG 3.46Å; E422-K426 PolarHBondContact O-N 3.11Å; E422-K426 WeakPolarHBondContact OE1-CE 3.42Å; E422-K426 IonicContact OE1-NZ 2.8Å; E422-K426 PolarHBondContact OE1-NZ 2.83Å; L423-K426 WeakPolarHBondContact O-CB 3.27Å; L423-K426 PolarHBondContact O-N 3.01Å; W424-K426 VanDerWaalsContact C-N 3.29Å; W424-K426 PolarHBondContact O-N 3.32Å; K426-V429 PolarHBondContact O-N 2.9Å; K426-S430 PolarHBondContact O-N 3.5Å; K426-S430 PolarHBondContact O-OG 3.4Å; K426-S430 VanDerWaalsContact O-OG 3.09Å
427	E	97	Very high	94.5	Very high	104 Å²	104	67 Å²	67	49%	0.486	33%	0.329	S	S	.	.	H	α-helix	trans	-62	-47.5	177.4	-69.2	171	-149.1	0	0	112.3	L423 W424 S430 K431	L423-E427 PolarHBondContact O-N 2.8Å; W424-E427 PolarHBondContact O-N 3.03Å; E427-S430 PolarHBondContact O-N 2.99Å; E427-K431 VanDerWaalsContact O-CG 3.28Å; E427-K431 WeakPolarHBondContact O-CG 3.37Å; E427-K431 PolarHBondContact O-N 2.9Å
428	E	96.2	Very high	94.5	Very high	50 Å²	50	69.2 Å²	69.2	23%	0.234	34%	0.344	C	S	.	.	H	α-helix	trans	-70.2	-35.4	178.4	-67.2	-52.5	139.3	0	0	112.9	W424 K431 I432 L449	W424-E428 HydrophobicContact CD2-CG 4.4Å; W424-E428 HydrophobicContact CZ2-CG 4.1Å; W424-E428 PolarHBondContact O-N 3.29Å; E428-K431 PolarHBondContact O-N 2.84Å; E428-K431 IonicContact OE1-NZ 2.65Å; E428-K431 PolarHBondContact OE1-NZ 2.93Å; E428-K431 WeakPolarHBondContact OE2-CD 3.26Å; E428-I432 WeakPolarHBondContact O-CG1 3.44Å; E428-I432 PolarHBondContact O-N 2.98Å; E428-L449 HydrophobicContact CB-CD1 3.55Å
429	V	96.2	Very high	94.4	Very high	39 Å²	39	78 Å²	78	24%	0.236	38%	0.383	C	S	.	.	H	α-helix	trans	-60.3	-47.1	170	167.1	0	0	0	0	110.3	R425 K426 K431 I432 E433 L446 L449	R425-V429 HydrophobicContact CG-CG2 4.37Å; R425-V429 VanDerWaalsContact O-CB 3.24Å; R425-V429 WeakPolarHBondContact O-CB 3.28Å; R425-V429 WeakPolarHBondContact O-CG2 3.31Å; R425-V429 PolarHBondContact O-N 3.28Å; K426-V429 PolarHBondContact O-N 2.9Å; V429-K431 PolarHBondContact O-N 3.48Å; V429-I432 CarbonylContact O-C 3.6Å; V429-I432 WeakPolarHBondContact O-CA 3.26Å; V429-I432 WeakPolarHBondContact O-CB 3.47Å; V429-I432 PolarHBondContact O-N 3.46Å; V429-E433 HydrophobicContact CG1-CG 4Å; V429-E433 WeakPolarHBondContact O-CG 3.25Å; V429-E433 PolarHBondContact O-N 3.32Å; V429-L446 HydrophobicContact CG1-CD2 4.47Å; V429-L446 HydrophobicContact CG2-CD2 3.92Å; V429-L449 HydrophobicContact CG2-CD1 3.97Å; V429-L449 HydrophobicContact CG2-CD2 4.14Å
430	S	96.5	Very high	94.5	Very high	55 Å²	55	79.8 Å²	79.8	39%	0.385	40%	0.402	S	S	.	.	H	α-helix	trans	-58.2	-45	175.2	-64	0	0	0	0	112.3	K426 E427 I432 E433 E434	K426-S430 PolarHBondContact O-N 3.5Å; K426-S430 PolarHBondContact O-OG 3.4Å; K426-S430 VanDerWaalsContact O-OG 3.09Å; E427-S430 PolarHBondContact O-N 2.99Å; S430-I432 PolarHBondContact O-N 3.26Å; S430-E433 WeakPolarHBondContact O-CA 3.16Å; S430-E433 WeakPolarHBondContact O-CB 3.24Å; S430-E433 PolarHBondContact O-N 2.91Å; S430-E434 WeakPolarHBondContact O-CG 3.3Å; S430-E434 PolarHBondContact O-N 3.36Å
431	K	95.8	Very high	94.5	Very high	83 Å²	83	83.1 Å²	83.1	36%	0.361	41%	0.412	S	S	.	.	H	α-helix	trans	-63.5	-19.3	174.6	-66.5	165.3	-160.3	170.3	0	113.4	E427 E428 V429 K435	E427-K431 VanDerWaalsContact O-CG 3.28Å; E427-K431 WeakPolarHBondContact O-CG 3.37Å; E427-K431 PolarHBondContact O-N 2.9Å; E428-K431 PolarHBondContact O-N 2.84Å; E428-K431 IonicContact OE1-NZ 2.65Å; E428-K431 PolarHBondContact OE1-NZ 2.93Å; E428-K431 WeakPolarHBondContact OE2-CD 3.26Å; V429-K431 PolarHBondContact O-N 3.48Å; K431-K435 WeakPolarHBondContact O-CD 3.33Å; K431-K435 WeakPolarHBondContact O-CE 3.49Å; K431-K435 VanDerWaalsContact O-CG 3.29Å; K431-K435 WeakPolarHBondContact O-CG 3.47Å; K431-K435 PolarHBondContact O-NZ 3.34Å
432	I	94.4	Very high	94.5	Very high	13 Å²	13	85 Å²	85	7%	0.067	42%	0.42	C	S	.	.	H	α-helix	trans	-90.4	-25.9	171.1	-69.8	165.9	0	0	0	111.2	E428 V429 S430 K442 A445 L446 L449	E428-I432 WeakPolarHBondContact O-CG1 3.44Å; E428-I432 PolarHBondContact O-N 2.98Å; V429-I432 CarbonylContact O-C 3.6Å; V429-I432 WeakPolarHBondContact O-CA 3.26Å; V429-I432 WeakPolarHBondContact O-CB 3.47Å; V429-I432 PolarHBondContact O-N 3.46Å; S430-I432 PolarHBondContact O-N 3.26Å; I432-K442 HydrophobicContact CG2-CG 3.82Å; I432-A445 HydrophobicContact CD1-CB 4.07Å; I432-A445 HydrophobicContact CG1-CB 4.28Å; I432-A445 HydrophobicContact CG2-CB 4.04Å; I432-L446 HydrophobicContact CD1-CD2 4.37Å; I432-L446 HydrophobicContact CG2-CD2 4.09Å; I432-L446 HydrophobicContact CG2-CG 4.05Å; I432-L449 HydrophobicContact CD1-CB 4.33Å; I432-L449 HydrophobicContact CD1-CD1 3.67Å
433	E	93	Very high	94.5	Very high	116 Å²	116	92.3 Å²	92.3	54%	0.542	45%	0.452	S	S	.	.	H	α-helix	trans	-75.5	-37.5	175.3	-56.3	-121.2	94.2	0	0	113	V429 S430 K435 K442	V429-E433 HydrophobicContact CG1-CG 4Å; V429-E433 WeakPolarHBondContact O-CG 3.25Å; V429-E433 PolarHBondContact O-N 3.32Å; S430-E433 WeakPolarHBondContact O-CA 3.16Å; S430-E433 WeakPolarHBondContact O-CB 3.24Å; S430-E433 PolarHBondContact O-N 2.91Å; E433-K435 VanDerWaalsContact C-N 3.3Å; E433-K435 PolarHBondContact O-N 2.78Å; E433-K442 WeakPolarHBondContact OE1-CE 3.47Å; E433-K442 IonicContact OE1-NZ 2.64Å; E433-K442 PolarHBondContact OE1-NZ 2.8Å
434	E	93.5	Very high	94.6	Very high	151 Å²	151	90.8 Å²	90.8	71%	0.706	45%	0.452	S	S	*	.	S	Bend	trans	-73	-17.4	179.3	-70.7	167.6	-174	0	0	113.7	S430	S430-E434 WeakPolarHBondContact O-CG 3.3Å; S430-E434 PolarHBondContact O-N 3.36Å
435	K	92.4	Very high	94.6	Very high	112 Å²	112	89.1 Å²	89.1	49%	0.487	45%	0.452	S	S	.	.	S	Bend	trans	-77.3	126.3	178.7	-74.8	166.9	-171.7	155.7	0	110.6	K431 E433 I437	K431-K435 WeakPolarHBondContact O-CD 3.33Å; K431-K435 WeakPolarHBondContact O-CE 3.49Å; K431-K435 VanDerWaalsContact O-CG 3.29Å; K431-K435 WeakPolarHBondContact O-CG 3.47Å; K431-K435 PolarHBondContact O-NZ 3.34Å; E433-K435 VanDerWaalsContact C-N 3.3Å; E433-K435 PolarHBondContact O-N 2.78Å; K435-I437 HydrophobicContact CB-CD1 4.29Å; K435-I437 HydrophobicContact CB-CG1 4.11Å; K435-I437 HydrophobicContact CB-CG2 4.24Å; K435-I437 PolarHBondContact O-N 2.9Å
436	N	89.2	Confident	94.6	Very high	177 Å²	177	89.5 Å²	89.5	95%	0.947	46%	0.457	S	S	*	.			trans	-74.5	62.8	172.8	-73.8	-42.3	0	0	0	112
437	I	91.7	Very high	94.7	Very high	66 Å²	66	87 Å²	87	34%	0.338	46%	0.455	S	S	.	.			trans	-107.1	160.6	177.5	54.9	175.4	0	0	0	111.3	K435 E441 K442	K435-I437 HydrophobicContact CB-CD1 4.29Å; K435-I437 HydrophobicContact CB-CG1 4.11Å; K435-I437 HydrophobicContact CB-CG2 4.24Å; K435-I437 PolarHBondContact O-N 2.9Å; I437-E441 HydrophobicContact CB-CB 4.1Å; I437-E441 HydrophobicContact CD1-CB 4.29Å; I437-K442 HydrophobicContact CD1-CB 3.97Å; I437-K442 HydrophobicContact CD1-CG 4.46Å; I437-K442 HydrophobicContact CG1-CB 4.12Å
438	T	94.6	Very high	94.6	Very high	80 Å²	80	87.3 Å²	87.3	49%	0.491	46%	0.46	S	S	.	.			trans	-66.4	159.5	178.3	68.8	0	0	0	0	111.9	A440 E441 K442	T438-A440 PolarHBondContact O-N 3.37Å; T438-A440 VanDerWaalsContact O-N 3.15Å; T438-E441 WeakPolarHBondContact CA-OE2 3.26Å; T438-E441 WeakPolarHBondContact CB-OE2 3.47Å; T438-E441 VanDerWaalsContact CG2-OE2 3.27Å; T438-E441 WeakPolarHBondContact CG2-OE2 3.46Å; T438-E441 PolarHBondContact N-OE2 3.47Å; T438-E441 PolarHBondContact O-N 2.95Å; T438-E441 VanDerWaalsContact OG1-CD 3.28Å; T438-E441 WeakPolarHBondContact OG1-CG 3.19Å; T438-E441 PolarHBondContact OG1-N 2.78Å; T438-E441 PolarHBondContact OG1-OE2 3.42Å; T438-K442 WeakPolarHBondContact O-CB 3.12Å; T438-K442 PolarHBondContact O-N 2.76Å
439	K	93.7	Very high	94.7	Very high	197 Å²	197	85.5 Å²	85.5	86%	0.857	45%	0.452	S	S	*	.	H	α-helix	trans	-59.2	-26.5	176.3	-66.6	-178.5	179.3	177.6	0	113.3	K443	K439-K443 WeakPolarHBondContact O-CB 3.33Å; K439-K443 PolarHBondContact O-N 3.39Å
440	A	95	Very high	94.7	Very high	73 Å²	73	88.4 Å²	88.4	60%	0.603	47%	0.465	S	S	*	.	H	α-helix	trans	-74	-49.6	176	0	0	0	0	0	111.2	T438 K442 K443 A444	T438-A440 PolarHBondContact O-N 3.37Å; T438-A440 VanDerWaalsContact O-N 3.15Å; A440-K442 PolarHBondContact O-N 2.85Å; A440-K443 PolarHBondContact O-N 2.89Å; A440-A444 PolarHBondContact O-N 2.92Å
441	E	94.2	Very high	94.7	Very high	102 Å²	102	90.8 Å²	90.8	48%	0.477	47%	0.474	S	S	.	.	H	α-helix	trans	-62.7	-41.7	176.7	-67.5	157.6	137.4	0	0	111.6	I437 T438 K443 A444 A445	I437-E441 HydrophobicContact CB-CB 4.1Å; I437-E441 HydrophobicContact CD1-CB 4.29Å; T438-E441 WeakPolarHBondContact CA-OE2 3.26Å; T438-E441 WeakPolarHBondContact CB-OE2 3.47Å; T438-E441 VanDerWaalsContact CG2-OE2 3.27Å; T438-E441 WeakPolarHBondContact CG2-OE2 3.46Å; T438-E441 PolarHBondContact N-OE2 3.47Å; T438-E441 PolarHBondContact O-N 2.95Å; T438-E441 VanDerWaalsContact OG1-CD 3.28Å; T438-E441 WeakPolarHBondContact OG1-CG 3.19Å; T438-E441 PolarHBondContact OG1-N 2.78Å; T438-E441 PolarHBondContact OG1-OE2 3.42Å; E441-K443 VanDerWaalsContact C-N 3.3Å; E441-K443 PolarHBondContact O-N 3.3Å; E441-A444 PolarHBondContact O-N 3.39Å; E441-A444 VanDerWaalsContact O-N 3.12Å; E441-A445 WeakPolarHBondContact O-CB 3.4Å; E441-A445 PolarHBondContact O-N 3.09Å
442	K	95.7	Very high	94.8	Very high	53 Å²	53	91.9 Å²	91.9	23%	0.23	48%	0.48	C	S	.	.	H	α-helix	trans	-60	-40.3	174.8	-168	172.1	179.6	179.1	0	111.8	I432 E433 I437 T438 A440 L446	I432-K442 HydrophobicContact CG2-CG 3.82Å; E433-K442 WeakPolarHBondContact OE1-CE 3.47Å; E433-K442 IonicContact OE1-NZ 2.64Å; E433-K442 PolarHBondContact OE1-NZ 2.8Å; I437-K442 HydrophobicContact CD1-CB 3.97Å; I437-K442 HydrophobicContact CD1-CG 4.46Å; I437-K442 HydrophobicContact CG1-CB 4.12Å; T438-K442 WeakPolarHBondContact O-CB 3.12Å; T438-K442 PolarHBondContact O-N 2.76Å; A440-K442 PolarHBondContact O-N 2.85Å; K442-L446 HydrophobicContact CG-CD1 4.26Å; K442-L446 WeakPolarHBondContact O-CB 3.17Å; K442-L446 VanDerWaalsContact O-CG 3.25Å; K442-L446 WeakPolarHBondContact O-CG 3.29Å; K442-L446 PolarHBondContact O-N 3.21Å
443	K	95.1	Very high	94.8	Very high	164 Å²	164	91.9 Å²	91.9	71%	0.713	48%	0.48	S	S	*	.	H	α-helix	trans	-67.3	-36.7	175	-173.7	178.7	176.8	-174.7	0	112.2	K439 A440 E441 A447	K439-K443 WeakPolarHBondContact O-CB 3.33Å; K439-K443 PolarHBondContact O-N 3.39Å; A440-K443 PolarHBondContact O-N 2.89Å; E441-K443 VanDerWaalsContact C-N 3.3Å; E441-K443 PolarHBondContact O-N 3.3Å; K443-A447 PolarHBondContact O-N 2.67Å; K443-A447 VanDerWaalsContact O-N 3.12Å
444	A	96.1	Very high	95	Very high	55 Å²	55	88.6 Å²	88.6	46%	0.455	47%	0.473	S	S	.	.	H	α-helix	trans	-68	-44.5	175.6	0	0	0	0	0	112	A440 E441 L446 A447 L448	A440-A444 PolarHBondContact O-N 2.92Å; E441-A444 PolarHBondContact O-N 3.39Å; E441-A444 VanDerWaalsContact O-N 3.12Å; A444-L446 PolarHBondContact O-N 2.85Å; A444-A447 WeakPolarHBondContact O-CB 3.32Å; A444-A447 PolarHBondContact O-N 3.07Å; A444-A447 VanDerWaalsContact O-N 3.09Å; A444-L448 PolarHBondContact O-N 2.61Å
445	A	95.5	Very high	95.1	Very high	29 Å²	29	88.3 Å²	88.3	24%	0.24	47%	0.471	C	S	.	.	H	α-helix	trans	-61.2	-42.1	175.7	0	0	0	0	0	112.2	I432 E441 A447 L448 L449	I432-A445 HydrophobicContact CD1-CB 4.07Å; I432-A445 HydrophobicContact CG1-CB 4.28Å; I432-A445 HydrophobicContact CG2-CB 4.04Å; E441-A445 WeakPolarHBondContact O-CB 3.4Å; E441-A445 PolarHBondContact O-N 3.09Å; A445-A447 VanDerWaalsContact C-N 3.27Å; A445-A447 PolarHBondContact O-N 2.83Å; A445-L448 PolarHBondContact O-N 3.16Å; A445-L449 WeakPolarHBondContact O-CB 3.45Å; A445-L449 PolarHBondContact O-N 3.01Å
446	L	96.1	Very high	95.3	Very high	61 Å²	61	86.5 Å²	86.5	32%	0.319	47%	0.467	S	S	.	.	H	α-helix	trans	-67.6	-23.3	174.4	-70.5	171.8	0	0	0	113.6	V429 I432 K442 A444 L450	V429-L446 HydrophobicContact CG1-CD2 4.47Å; V429-L446 HydrophobicContact CG2-CD2 3.92Å; I432-L446 HydrophobicContact CD1-CD2 4.37Å; I432-L446 HydrophobicContact CG2-CD2 4.09Å; I432-L446 HydrophobicContact CG2-CG 4.05Å; K442-L446 HydrophobicContact CG-CD1 4.26Å; K442-L446 WeakPolarHBondContact O-CB 3.17Å; K442-L446 VanDerWaalsContact O-CG 3.25Å; K442-L446 WeakPolarHBondContact O-CG 3.29Å; K442-L446 PolarHBondContact O-N 3.21Å; A444-L446 PolarHBondContact O-N 2.85Å; L446-L450 PolarHBondContact O-N 2.67Å
447	A	96.3	Very high	95.6	Very high	47 Å²	47	80.1 Å²	80.1	39%	0.388	43%	0.432	S	S	.	.	H	α-helix	trans	-75.9	-45.7	173.1	0	0	0	0	0	111.4	K443 A444 A445 L449 L450 D451	K443-A447 PolarHBondContact O-N 2.67Å; K443-A447 VanDerWaalsContact O-N 3.12Å; A444-A447 WeakPolarHBondContact O-CB 3.32Å; A444-A447 PolarHBondContact O-N 3.07Å; A444-A447 VanDerWaalsContact O-N 3.09Å; A445-A447 VanDerWaalsContact C-N 3.27Å; A445-A447 PolarHBondContact O-N 2.83Å; A447-L449 VanDerWaalsContact C-N 3.32Å; A447-L449 PolarHBondContact O-N 3.35Å; A447-L450 WeakPolarHBondContact O-CB 3.44Å; A447-L450 PolarHBondContact O-N 2.89Å; A447-D451 PolarHBondContact O-N 2.9Å
448	L	96.4	Very high	95.8	Very high	110 Å²	110	79.7 Å²	79.7	58%	0.576	44%	0.435	S	S	*	.	H	α-helix	trans	-59.6	-42.4	175.3	-65.6	172.1	0	0	0	111.9	A444 A445 L450 D451 E452	A444-L448 PolarHBondContact O-N 2.61Å; A445-L448 PolarHBondContact O-N 3.16Å; L448-L450 VanDerWaalsContact C-N 3.26Å; L448-L450 PolarHBondContact O-N 2.89Å; L448-D451 PolarHBondContact O-N 3.47Å; L448-D451 VanDerWaalsContact O-N 3.16Å; L448-E452 PolarHBondContact O-N 2.9Å
449	L	96.6	Very high	95.9	Very high	13 Å²	13	77 Å²	77	7%	0.068	42%	0.421	C	S	.	.	H	α-helix	trans	-61.5	-31.6	174.1	173.3	154.8	0	0	0	113	R425 E428 V429 I432 A445 A447 E453	R425-L449 HydrophobicContact CG-CD2 3.75Å; E428-L449 HydrophobicContact CB-CD1 3.55Å; V429-L449 HydrophobicContact CG2-CD1 3.97Å; V429-L449 HydrophobicContact CG2-CD2 4.14Å; I432-L449 HydrophobicContact CD1-CB 4.33Å; I432-L449 HydrophobicContact CD1-CD1 3.67Å; A445-L449 WeakPolarHBondContact O-CB 3.45Å; A445-L449 PolarHBondContact O-N 3.01Å; A447-L449 VanDerWaalsContact C-N 3.32Å; A447-L449 PolarHBondContact O-N 3.35Å; L449-E453 WeakPolarHBondContact O-CB 3.46Å; L449-E453 PolarHBondContact O-N 3.25Å
450	L	96.5	Very high	95.9	Very high	100 Å²	100	68.6 Å²	68.6	52%	0.524	39%	0.385	S	S	.	.	H	α-helix	trans	-73.7	-34.9	175.2	-179	64.7	0	0	0	111.9	L446 A447 L448 E453 A454	L446-L450 PolarHBondContact O-N 2.67Å; A447-L450 WeakPolarHBondContact O-CB 3.44Å; A447-L450 PolarHBondContact O-N 2.89Å; L448-L450 VanDerWaalsContact C-N 3.26Å; L448-L450 PolarHBondContact O-N 2.89Å; L450-E453 PolarHBondContact O-N 2.94Å; L450-A454 WeakPolarHBondContact O-CB 3.44Å; L450-A454 PolarHBondContact O-N 3.23Å
451	D	97.2	Very high	95.9	Very high	104 Å²	104	68 Å²	68	56%	0.556	37%	0.371	S	S	*	.	H	α-helix	trans	-67.2	-44.8	173.3	-66.9	-36.2	0	0	0	110.7	A447 L448 E453 A454 E455	A447-D451 PolarHBondContact O-N 2.9Å; L448-D451 PolarHBondContact O-N 3.47Å; L448-D451 VanDerWaalsContact O-N 3.16Å; D451-E453 PolarHBondContact O-N 2.83Å; D451-A454 WeakPolarHBondContact O-CB 3.48Å; D451-A454 PolarHBondContact O-N 3.07Å; D451-A454 VanDerWaalsContact O-N 3.13Å; D451-E455 PolarHBondContact O-N 3.41Å
452	E	97.4	Very high	95.9	Very high	106 Å²	106	70.6 Å²	70.6	50%	0.495	38%	0.377	S	S	.	.	H	α-helix	trans	-58	-44.8	171.7	-71.3	177.3	-169.5	0	0	112	W424 L448 A454 E455 L456	W424-E452 HydrophobicContact CH2-CB 3.96Å; L448-E452 PolarHBondContact O-N 2.9Å; E452-A454 VanDerWaalsContact C-N 3.31Å; E452-A454 PolarHBondContact O-N 3.43Å; E452-E455 PolarHBondContact O-N 3.18Å; E452-L456 WeakPolarHBondContact O-CG 3.43Å; E452-L456 PolarHBondContact O-N 3.09Å
453	E	95.6	Very high	95.8	Very high	13 Å²	13	72.9 Å²	72.9	6%	0.061	39%	0.388	C	S	.	.	H	α-helix	trans	-58.6	-42.3	173.8	178.1	176	-154.7	0	0	111.6	L421 W424 R425 L449 L450 D451 L456 I457 R656	L421-E453 HydrophobicContact CD2-CG 4.45Å; W424-E453 HydrophobicContact CZ3-CB 4.39Å; R425-E453 VanDerWaalsContact CD-CD 3.4Å; R425-E453 WeakPolarHBondContact CD-OE1 3.44Å; R425-E453 WeakPolarHBondContact CD-OE2 3.45Å; R425-E453 IonicContact CZ-OE1 3.87Å; R425-E453 IonicContact NE-OE1 3.99Å; R425-E453 IonicContact NH1-OE1 2.95Å; R425-E453 PolarHBondContact NH1-OE1 2.84Å; L449-E453 WeakPolarHBondContact O-CB 3.46Å; L449-E453 PolarHBondContact O-N 3.25Å; L450-E453 PolarHBondContact O-N 2.94Å; D451-E453 PolarHBondContact O-N 2.83Å; E453-L456 PolarHBondContact O-N 3.15Å; E453-I457 HydrophobicContact CG-CD1 3.83Å; E453-I457 HydrophobicContact CG-CG1 4.44Å; E453-I457 WeakPolarHBondContact O-CB 3.49Å; E453-I457 VanDerWaalsContact O-CG1 3.24Å; E453-I457 WeakPolarHBondContact O-CG1 3.13Å; E453-I457 PolarHBondContact O-N 3.24Å; E453-R656 IonicContact OE1-CZ 3.86Å; E453-R656 IonicContact OE1-NH1 2.7Å; E453-R656 PolarHBondContact OE1-NH1 2.67Å; E453-R656 IonicContact OE1-NH2 3.1Å; E453-R656 PolarHBondContact OE1-NH2 3.21Å
454	A	96	Very high	95.7	Very high	48 Å²	48	67.4 Å²	67.4	40%	0.397	37%	0.365	S	S	.	.	H	α-helix	trans	-66.9	-36.7	178.2	0	0	0	0	0	112.7	L450 D451 E452 S458	L450-A454 WeakPolarHBondContact O-CB 3.44Å; L450-A454 PolarHBondContact O-N 3.23Å; D451-A454 WeakPolarHBondContact O-CB 3.48Å; D451-A454 PolarHBondContact O-N 3.07Å; D451-A454 VanDerWaalsContact O-N 3.13Å; E452-A454 VanDerWaalsContact C-N 3.31Å; E452-A454 PolarHBondContact O-N 3.43Å; A454-S458 VanDerWaalsContact O-CB 3.28Å; A454-S458 WeakPolarHBondContact O-CB 3.44Å; A454-S458 PolarHBondContact O-N 2.84Å; A454-S458 PolarHBondContact O-OG 2.89Å
455	E	96.9	Very high	95.5	Very high	144 Å²	144	70.6 Å²	70.6	67%	0.673	37%	0.373	S	S	*	.	H	α-helix	trans	-65.4	-42.9	172.5	-70.6	-155.1	166.9	0	0	112.3	D451 E452 S458 A459	D451-E455 PolarHBondContact O-N 3.41Å; E452-E455 PolarHBondContact O-N 3.18Å; E455-S458 CarbonylContact O-C 3.47Å; E455-S458 WeakPolarHBondContact O-CB 3.34Å; E455-S458 PolarHBondContact O-N 3.37Å; E455-A459 PolarHBondContact O-N 2.78Å
456	L	95.9	Very high	95.4	Very high	75 Å²	75	75.7 Å²	75.7	39%	0.393	39%	0.39	S	S	.	.	H	α-helix	trans	-67	-42.3	178.1	-69.1	171.5	0	0	0	111.9	L421 W424 E452 E453 S458 A459 I460	L421-L456 HydrophobicContact CD1-CB 3.71Å; L421-L456 HydrophobicContact CD1-CD1 3.54Å; L421-L456 HydrophobicContact CD1-CG 4.27Å; W424-L456 HydrophobicContact CE3-CD1 4.2Å; W424-L456 HydrophobicContact CH2-CD1 4.02Å; W424-L456 HydrophobicContact CZ2-CD1 4.42Å; W424-L456 HydrophobicContact CZ3-CD1 3.9Å; E452-L456 WeakPolarHBondContact O-CG 3.43Å; E452-L456 PolarHBondContact O-N 3.09Å; E453-L456 PolarHBondContact O-N 3.15Å; L456-S458 VanDerWaalsContact C-N 3.27Å; L456-S458 PolarHBondContact O-N 3.17Å; L456-A459 WeakPolarHBondContact O-CB 3.45Å; L456-A459 PolarHBondContact O-N 3.41Å; L456-I460 WeakPolarHBondContact O-CG1 3.35Å; L456-I460 PolarHBondContact O-N 3.45Å
457	I	95.7	Very high	95.2	Very high	43 Å²	43	76.2 Å²	76.2	22%	0.221	39%	0.388	C	S	.	.	H	α-helix	trans	-59.6	-41.2	170.8	-69	169.3	0	0	0	110.4	Y418 L421 E453 A459 I460 N461	Y418-I457 HydrophobicContact CE1-CG1 4.29Å; Y418-I457 HydrophobicContact CE1-CG2 4.44Å; L421-I457 HydrophobicContact CD2-CD1 4.29Å; L421-I457 HydrophobicContact CD2-CG1 3.56Å; E453-I457 HydrophobicContact CG-CD1 3.83Å; E453-I457 HydrophobicContact CG-CG1 4.44Å; E453-I457 WeakPolarHBondContact O-CB 3.49Å; E453-I457 VanDerWaalsContact O-CG1 3.24Å; E453-I457 WeakPolarHBondContact O-CG1 3.13Å; E453-I457 PolarHBondContact O-N 3.24Å; I457-A459 VanDerWaalsContact C-N 3.35Å; I457-A459 PolarHBondContact O-N 2.91Å; I457-I460 PolarHBondContact O-N 3.46Å; I457-N461 WeakPolarHBondContact CG2-ND2 3.47Å; I457-N461 WeakPolarHBondContact O-CB 3.23Å; I457-N461 PolarHBondContact O-N 3.03Å; I457-N461 PolarHBondContact O-ND2 2.85Å
458	S	96	Very high	94.9	Very high	56 Å²	56	77.1 Å²	77.1	39%	0.392	39%	0.391	S	S	.	.	H	α-helix	trans	-64.8	-37.7	176.5	-62.7	0	0	0	0	112	A454 E455 L456 N461 R462	A454-S458 VanDerWaalsContact O-CB 3.28Å; A454-S458 WeakPolarHBondContact O-CB 3.44Å; A454-S458 PolarHBondContact O-N 2.84Å; A454-S458 PolarHBondContact O-OG 2.89Å; E455-S458 CarbonylContact O-C 3.47Å; E455-S458 WeakPolarHBondContact O-CB 3.34Å; E455-S458 PolarHBondContact O-N 3.37Å; L456-S458 VanDerWaalsContact C-N 3.27Å; L456-S458 PolarHBondContact O-N 3.17Å; S458-N461 PolarHBondContact O-N 3.16Å; S458-R462 WeakPolarHBondContact O-CG 3.38Å; S458-R462 PolarHBondContact O-N 2.97Å
459	A	95.7	Very high	94.6	Very high	25 Å²	25	78.1 Å²	78.1	21%	0.207	39%	0.391	C	S	.	.	H	α-helix	trans	-62.8	-52.1	172.5	0	0	0	0	0	111.8	E455 L456 I457 N461 R462 H463	E455-A459 PolarHBondContact O-N 2.78Å; L456-A459 WeakPolarHBondContact O-CB 3.45Å; L456-A459 PolarHBondContact O-N 3.41Å; I457-A459 VanDerWaalsContact C-N 3.35Å; I457-A459 PolarHBondContact O-N 2.91Å; A459-N461 PolarHBondContact O-N 3.33Å; A459-R462 WeakPolarHBondContact O-CB 3.42Å; A459-R462 PolarHBondContact O-N 3.18Å; A459-H463 PolarHBondContact O-CD2 2.87Å; A459-H463 VanDerWaalsContact O-CD2 3.29Å; A459-H463 PolarHBondContact O-N 3.4Å
460	I	94.7	Very high	94.2	Very high	19 Å²	19	80.1 Å²	80.1	10%	0.097	40%	0.4	C	S	.	.	H	α-helix	trans	-55.2	-42	177	-65.3	166.2	0	0	0	110.5	F414 L417 Y418 L421 L456 I457 H463 Q464	F414-I460 HydrophobicContact CD1-CG2 4.16Å; L417-I460 HydrophobicContact CB-CD1 4.25Å; L417-I460 HydrophobicContact CB-CG1 4.46Å; Y418-I460 HydrophobicContact CD1-CD1 4.44Å; Y418-I460 HydrophobicContact CD2-CG2 4.31Å; Y418-I460 HydrophobicContact CE1-CD1 4.41Å; Y418-I460 HydrophobicContact CE1-CG2 4.45Å; Y418-I460 HydrophobicContact CE2-CG2 3.63Å; L421-I460 HydrophobicContact CD2-CD1 4.28Å; L456-I460 WeakPolarHBondContact O-CG1 3.35Å; L456-I460 PolarHBondContact O-N 3.45Å; I457-I460 PolarHBondContact O-N 3.46Å; I460-H463 PolarHBondContact O-N 3.48Å; I460-Q464 WeakPolarHBondContact O-CB 3.49Å; I460-Q464 PolarHBondContact O-N 3.39Å
461	N	93.6	Very high	93.8	Very high	60 Å²	60	77.9 Å²	77.9	32%	0.321	39%	0.39	S	S	.	.	H	α-helix	trans	-66.4	-38.4	175.9	-75.7	-41.1	0	0	0	113.4	Y418 I457 S458 A459 H463 Q464 I465	Y418-N461 PolarHBondContact OH-OD1 2.68Å; I457-N461 WeakPolarHBondContact CG2-ND2 3.47Å; I457-N461 WeakPolarHBondContact O-CB 3.23Å; I457-N461 PolarHBondContact O-N 3.03Å; I457-N461 PolarHBondContact O-ND2 2.85Å; S458-N461 PolarHBondContact O-N 3.16Å; A459-N461 PolarHBondContact O-N 3.33Å; N461-H463 PolarHBondContact O-N 3.35Å; N461-Q464 PolarHBondContact O-N 2.96Å; N461-I465 WeakPolarHBondContact O-CB 3.47Å; N461-I465 VanDerWaalsContact O-CG1 3.27Å; N461-I465 WeakPolarHBondContact O-CG1 3.27Å; N461-I465 PolarHBondContact O-N 3.47Å
462	R	94.9	Very high	93.2	Very high	157 Å²	157	75.1 Å²	75.1	59%	0.592	38%	0.382	S	S	*	.	H	α-helix	trans	-58.8	-45.5	172.3	-72.8	-177.4	-63.3	-101.9	9.4	111.3	S458 A459 I465 K466	S458-R462 WeakPolarHBondContact O-CG 3.38Å; S458-R462 PolarHBondContact O-N 2.97Å; A459-R462 WeakPolarHBondContact O-CB 3.42Å; A459-R462 PolarHBondContact O-N 3.18Å; R462-I465 PolarHBondContact O-N 3.25Å; R462-K466 PolarHBondContact O-N 3.22Å
463	H	93.5	Very high	92.6	Very high	101 Å²	101	73.6 Å²	73.6	47%	0.468	38%	0.375	S	S	.	.	H	α-helix	trans	-63.4	-43.7	174.7	-76	-89.6	0	0	0	112	F414 A459 I460 N461 I465 K466 R467	F414-H463 HydrophobicContact CE1-CB 3.95Å; A459-H463 PolarHBondContact O-CD2 2.87Å; A459-H463 VanDerWaalsContact O-CD2 3.29Å; A459-H463 PolarHBondContact O-N 3.4Å; I460-H463 PolarHBondContact O-N 3.48Å; N461-H463 PolarHBondContact O-N 3.35Å; H463-I465 PolarHBondContact O-N 3.33Å; H463-K466 PolarHBondContact O-N 3.01Å; H463-R467 VanDerWaalsContact O-CB 3.31Å; H463-R467 WeakPolarHBondContact O-CB 3.43Å; H463-R467 PolarHBondContact O-N 3.1Å
464	Q	92.9	Very high	92.1	Very high	50 Å²	50	76.2 Å²	76.2	23%	0.234	39%	0.39	C	S	.	.	H	α-helix	trans	-64.1	-38	178.3	-164.3	-177.1	-65.1	0	0	112.4	F414 I460 N461 S468	F414-Q464 HydrophobicContact CD1-CB 4.11Å; F414-Q464 HydrophobicContact CD1-CG 4.45Å; F414-Q464 HydrophobicContact CD2-CG 4.31Å; F414-Q464 HydrophobicContact CE1-CB 3.85Å; F414-Q464 HydrophobicContact CE1-CG 4.39Å; F414-Q464 HydrophobicContact CE2-CG 4.26Å; F414-Q464 HydrophobicContact CG-CG 4.42Å; F414-Q464 HydrophobicContact CZ-CB 4.09Å; F414-Q464 HydrophobicContact CZ-CG 4.31Å; I460-Q464 WeakPolarHBondContact O-CB 3.49Å; I460-Q464 PolarHBondContact O-N 3.39Å; N461-Q464 PolarHBondContact O-N 2.96Å; Q464-S468 VanDerWaalsContact O-CB 3.29Å; Q464-S468 WeakPolarHBondContact O-CB 3.5Å; Q464-S468 PolarHBondContact O-N 3.15Å; Q464-S468 PolarHBondContact O-OG 3.13Å
465	I	92.6	Very high	91.5	Very high	121 Å²	121	78.4 Å²	78.4	62%	0.621	39%	0.394	S	S	*	.	H	α-helix	trans	-66.4	-48.7	175.7	-69.5	163.9	0	0	0	110.8	N461 R462 H463 R467 S468 K469	N461-I465 WeakPolarHBondContact O-CB 3.47Å; N461-I465 VanDerWaalsContact O-CG1 3.27Å; N461-I465 WeakPolarHBondContact O-CG1 3.27Å; N461-I465 PolarHBondContact O-N 3.47Å; R462-I465 PolarHBondContact O-N 3.25Å; H463-I465 PolarHBondContact O-N 3.33Å; I465-R467 VanDerWaalsContact C-N 3.33Å; I465-R467 PolarHBondContact O-N 2.97Å; I465-S468 PolarHBondContact O-N 2.87Å; I465-K469 PolarHBondContact O-N 3.26Å
466	K	92.7	Very high	90.7	Very high	137 Å²	137	74.2 Å²	74.2	60%	0.596	37%	0.374	S	S	*	.	H	α-helix	trans	-54.9	-50.7	175.1	-176.9	-172.8	175.5	-169.7	0	110.5	R462 H463 S468 K469 E470	R462-K466 PolarHBondContact O-N 3.22Å; H463-K466 PolarHBondContact O-N 3.01Å; K466-S468 PolarHBondContact O-N 3.39Å; K466-K469 WeakPolarHBondContact O-CB 3.24Å; K466-K469 PolarHBondContact O-N 3.35Å; K466-K469 VanDerWaalsContact O-N 3.17Å; K466-E470 WeakPolarHBondContact CE-OE1 3.42Å; K466-E470 PolarHBondContact O-N 2.99Å
467	R	91.3	Very high	90.2	Very high	71 Å²	71	71.6 Å²	71.6	27%	0.268	36%	0.362	S	S	.	.	H	α-helix	trans	-64	-37.3	-179.9	-171.8	57.9	-178.9	166.9	0.3	113	K409 F414 H463 I465 K469 E470 V471	K409-R467 PolarHBondContact O-NE 2.89Å; F414-R467 HydrophobicContact CE2-CB 4.26Å; F414-R467 HydrophobicContact CE2-CG 4.13Å; F414-R467 HydrophobicContact CZ-CB 3.92Å; F414-R467 HydrophobicContact CZ-CG 4.21Å; H463-R467 VanDerWaalsContact O-CB 3.31Å; H463-R467 WeakPolarHBondContact O-CB 3.43Å; H463-R467 PolarHBondContact O-N 3.1Å; I465-R467 VanDerWaalsContact C-N 3.33Å; I465-R467 PolarHBondContact O-N 2.97Å; R467-K469 VanDerWaalsContact C-N 3.32Å; R467-K469 PolarHBondContact O-N 3.36Å; R467-E470 VanDerWaalsContact CD-OE2 3.23Å; R467-E470 WeakPolarHBondContact CD-OE2 3.39Å; R467-E470 IonicContact CZ-OE2 3.51Å; R467-E470 IonicContact NE-OE2 3.58Å; R467-E470 IonicContact NH1-OE2 2.79Å; R467-E470 PolarHBondContact NH1-OE2 3.26Å; R467-E470 PolarHBondContact O-N 3.36Å; R467-V471 HydrophobicContact CG-CG2 4.44Å; R467-V471 WeakPolarHBondContact O-CB 3.35Å; R467-V471 VanDerWaalsContact O-CG2 3.27Å; R467-V471 WeakPolarHBondContact O-CG2 3.27Å; R467-V471 PolarHBondContact O-N 2.93Å
468	S	90.7	Very high	89.9	Confident	66 Å²	66	72.1 Å²	72.1	46%	0.462	37%	0.365	S	S	.	.	H	α-helix	trans	-64.6	-36.2	175.3	-58	0	0	0	0	112.1	Q464 I465 K466 A472	Q464-S468 VanDerWaalsContact O-CB 3.29Å; Q464-S468 WeakPolarHBondContact O-CB 3.5Å; Q464-S468 PolarHBondContact O-N 3.15Å; Q464-S468 PolarHBondContact O-OG 3.13Å; I465-S468 PolarHBondContact O-N 2.87Å; K466-S468 PolarHBondContact O-N 3.39Å; S468-A472 VanDerWaalsContact O-CB 3.31Å; S468-A472 WeakPolarHBondContact O-CB 3.41Å; S468-A472 PolarHBondContact O-N 2.88Å
469	K	89.7	Confident	89.4	Confident	131 Å²	131	70.3 Å²	70.3	57%	0.57	35%	0.352	S	S	*	.	H	α-helix	trans	-64.9	-52.2	173.6	-175.9	-170	165.8	-170.3	0	111	I465 K466 R467 V471 A472 E473	I465-K469 PolarHBondContact O-N 3.26Å; K466-K469 WeakPolarHBondContact O-CB 3.24Å; K466-K469 PolarHBondContact O-N 3.35Å; K466-K469 VanDerWaalsContact O-N 3.17Å; R467-K469 VanDerWaalsContact C-N 3.32Å; R467-K469 PolarHBondContact O-N 3.36Å; K469-V471 VanDerWaalsContact C-N 3.28Å; K469-V471 PolarHBondContact O-N 2.93Å; K469-A472 PolarHBondContact O-N 3.05Å; K469-A472 VanDerWaalsContact O-N 3.11Å; K469-E473 WeakPolarHBondContact CE-OE1 3.36Å; K469-E473 IonicContact NZ-OE1 3.25Å; K469-E473 WeakPolarHBondContact O-CG 3.29Å; K469-E473 PolarHBondContact O-N 3.34Å
470	E	89	Confident	89.2	Confident	55 Å²	55	69.1 Å²	69.1	26%	0.257	34%	0.343	S	S	.	.	H	α-helix	trans	-54	-45.3	176.2	-67.7	167.5	-167.2	0	0	111.6	K466 R467 E473 N474	K466-E470 WeakPolarHBondContact CE-OE1 3.42Å; K466-E470 PolarHBondContact O-N 2.99Å; R467-E470 VanDerWaalsContact CD-OE2 3.23Å; R467-E470 WeakPolarHBondContact CD-OE2 3.39Å; R467-E470 IonicContact CZ-OE2 3.51Å; R467-E470 IonicContact NE-OE2 3.58Å; R467-E470 IonicContact NH1-OE2 2.79Å; R467-E470 PolarHBondContact NH1-OE2 3.26Å; R467-E470 PolarHBondContact O-N 3.36Å; E470-E473 PolarHBondContact O-N 2.83Å; E470-N474 WeakPolarHBondContact O-CB 3.46Å; E470-N474 PolarHBondContact O-N 2.9Å; E470-N474 PolarHBondContact O-ND2 2.61Å
471	V	87.6	Confident	89.1	Confident	53 Å²	53	72.1 Å²	72.1	32%	0.321	36%	0.355	S	S	.	.	H	α-helix	trans	-67.4	-38.8	179	168.8	0	0	0	0	111.4	R467 K469 E473 N474 I475	R467-V471 HydrophobicContact CG-CG2 4.44Å; R467-V471 WeakPolarHBondContact O-CB 3.35Å; R467-V471 VanDerWaalsContact O-CG2 3.27Å; R467-V471 WeakPolarHBondContact O-CG2 3.27Å; R467-V471 PolarHBondContact O-N 2.93Å; K469-V471 VanDerWaalsContact C-N 3.28Å; K469-V471 PolarHBondContact O-N 2.93Å; V471-E473 VanDerWaalsContact C-N 3.34Å; V471-E473 PolarHBondContact O-N 2.86Å; V471-N474 PolarHBondContact O-N 3.31Å; V471-I475 HydrophobicContact CG1-CD1 3.64Å; V471-I475 HydrophobicContact CG1-CG1 4.28Å; V471-I475 WeakPolarHBondContact O-CB 2.96Å; V471-I475 VanDerWaalsContact O-CG1 3.23Å; V471-I475 WeakPolarHBondContact O-CG1 3.49Å; V471-I475 PolarHBondContact O-N 2.8Å
472	A	85.7	Confident	89	Confident	47 Å²	47	74.4 Å²	74.4	39%	0.388	36%	0.362	S	S	.	.	H	α-helix	trans	-65.9	-34.9	175.4	0	0	0	0	0	112.8	S468 K469 Q476	S468-A472 VanDerWaalsContact O-CB 3.31Å; S468-A472 WeakPolarHBondContact O-CB 3.41Å; S468-A472 PolarHBondContact O-N 2.88Å; K469-A472 PolarHBondContact O-N 3.05Å; K469-A472 VanDerWaalsContact O-N 3.11Å; A472-Q476 WeakPolarHBondContact O-CG 3.43Å; A472-Q476 PolarHBondContact O-N 2.79Å; A472-Q476 PolarHBondContact O-NE2 3.27Å
473	E	83.1	Confident	88.8	Confident	73 Å²	73	67 Å²	67	34%	0.341	33%	0.334	S	S	.	.	H	α-helix	trans	-71	-43.3	174.4	-71.5	167.9	168.1	0	0	111.1	K469 E470 V471 Q476 S477	K469-E473 WeakPolarHBondContact CE-OE1 3.36Å; K469-E473 IonicContact NZ-OE1 3.25Å; K469-E473 WeakPolarHBondContact O-CG 3.29Å; K469-E473 PolarHBondContact O-N 3.34Å; E470-E473 PolarHBondContact O-N 2.83Å; V471-E473 VanDerWaalsContact C-N 3.34Å; V471-E473 PolarHBondContact O-N 2.86Å; E473-Q476 WeakPolarHBondContact O-CB 3.3Å; E473-Q476 PolarHBondContact O-N 2.77Å; E473-S477 PolarHBondContact O-N 3.25Å
474	N	86.1	Confident	88.8	Confident	68 Å²	68	63 Å²	63	36%	0.364	32%	0.318	S	S	.	.	H	α-helix	trans	-65.1	-37.6	174.2	-78.6	-69.5	0	0	0	113.2	E470 V471 Q476 S477 L478	E470-N474 WeakPolarHBondContact O-CB 3.46Å; E470-N474 PolarHBondContact O-N 2.9Å; E470-N474 PolarHBondContact O-ND2 2.61Å; V471-N474 PolarHBondContact O-N 3.31Å; N474-Q476 VanDerWaalsContact C-N 3.28Å; N474-Q476 PolarHBondContact O-N 3Å; N474-S477 PolarHBondContact O-N 2.82Å; N474-S477 PolarHBondContact O-OG 3.16Å; N474-S477 VanDerWaalsContact O-OG 3.07Å; N474-L478 WeakPolarHBondContact O-CB 3.2Å; N474-L478 PolarHBondContact O-N 3.05Å
475	I	83.7	Confident	88.9	Confident	94 Å²	94	62.7 Å²	62.7	48%	0.482	32%	0.323	S	S	.	.	H	α-helix	trans	-65.8	-33.2	175.2	-73.3	167.6	0	0	0	111.2	V471 C479	V471-I475 HydrophobicContact CG1-CD1 3.64Å; V471-I475 HydrophobicContact CG1-CG1 4.28Å; V471-I475 WeakPolarHBondContact O-CB 2.96Å; V471-I475 VanDerWaalsContact O-CG1 3.23Å; V471-I475 WeakPolarHBondContact O-CG1 3.49Å; V471-I475 PolarHBondContact O-N 2.8Å; I475-C479 WeakPolarHBondContact O-CB 3.35Å; I475-C479 PolarHBondContact O-N 3.44Å; I475-C479 VanDerWaalsContact O-N 3.1Å
476	Q	79.8	Confident	88.9	Confident	56 Å²	56	59 Å²	59	26%	0.262	31%	0.307	S	S	.	.	H	α-helix	trans	-66.7	-46	175.4	-77	170.3	89.3	0	0	112	A472 E473 N474 V582	A472-Q476 WeakPolarHBondContact O-CG 3.43Å; A472-Q476 PolarHBondContact O-N 2.79Å; A472-Q476 PolarHBondContact O-NE2 3.27Å; E473-Q476 WeakPolarHBondContact O-CB 3.3Å; E473-Q476 PolarHBondContact O-N 2.77Å; N474-Q476 VanDerWaalsContact C-N 3.28Å; N474-Q476 PolarHBondContact O-N 3Å; Q476-V582 HydrophobicContact CB-CG1 4.11Å; Q476-V582 HydrophobicContact CG-CG1 4.09Å
477	S	84.1	Confident	88.7	Confident	20 Å²	20	55.4 Å²	55.4	14%	0.14	29%	0.292	C	S	.	.	H	α-helix	trans	-70.2	-38.8	175.7	64.5	0	0	0	0	112.5	E473 N474 C479 L480 K481	E473-S477 PolarHBondContact O-N 3.25Å; N474-S477 PolarHBondContact O-N 2.82Å; N474-S477 PolarHBondContact O-OG 3.16Å; N474-S477 VanDerWaalsContact O-OG 3.07Å; S477-C479 VanDerWaalsContact C-N 3.3Å; S477-C479 PolarHBondContact O-N 3.46Å; S477-L480 PolarHBondContact O-N 3.18Å; S477-L480 VanDerWaalsContact O-N 3.16Å; S477-K481 WeakPolarHBondContact O-CG 3.43Å; S477-K481 PolarHBondContact O-N 3.09Å
478	L	89.5	Confident	88.6	Confident	54 Å²	54	60.5 Å²	60.5	28%	0.283	31%	0.312	S	S	.	.	H	α-helix	trans	-62.4	-34.7	178.2	-176.5	62.5	0	0	0	112.6	Y52 N474 K481 K482	Y52-L478 HydrophobicContact CD1-CD2 4.48Å; Y52-L478 HydrophobicContact CE1-CD2 4.31Å; N474-L478 WeakPolarHBondContact O-CB 3.2Å; N474-L478 PolarHBondContact O-N 3.05Å; L478-K481 PolarHBondContact O-N 2.76Å; L478-K482 HydrophobicContact CD1-CG 4.48Å; L478-K482 WeakPolarHBondContact O-CB 3.35Å; L478-K482 WeakPolarHBondContact O-CG 3.32Å; L478-K482 PolarHBondContact O-N 2.94Å
479	C	87.1	Confident	88.5	Confident	19 Å²	19	63.5 Å²	63.5	13%	0.128	31%	0.313	C	S	.	.	H	α-helix	trans	-61.7	-44.5	173.8	177.8	0	0	0	0	111.8	I475 S477 A483	I475-C479 WeakPolarHBondContact O-CB 3.35Å; I475-C479 PolarHBondContact O-N 3.44Å; I475-C479 VanDerWaalsContact O-N 3.1Å; S477-C479 VanDerWaalsContact C-N 3.3Å; S477-C479 PolarHBondContact O-N 3.46Å; C479-A483 PolarHBondContact O-N 3.22Å
480	L	90.4	Very high	88.5	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-68.4	-44.4	175.3	-62.5	175.3	0	0	0	111.3	S477 K482 A483 S484 L512 H515 A585 V594	S477-L480 PolarHBondContact O-N 3.18Å; S477-L480 VanDerWaalsContact O-N 3.16Å; L480-K482 PolarHBondContact O-N 2.97Å; L480-A483 PolarHBondContact O-N 3.15Å; L480-S484 PolarHBondContact O-N 3.12Å; L480-S484 PolarHBondContact O-OG 3.48Å; L480-L512 HydrophobicContact CB-CD1 3.97Å; L480-H515 HydrophobicContact CD1-CB 4.03Å; L480-A585 HydrophobicContact CD2-CB 4.01Å; L480-V594 HydrophobicContact CD2-CG2 4.28Å
481	K	93.1	Very high	88.1	Confident	81 Å²	81	61.1 Å²	61.1	35%	0.352	31%	0.308	S	S	.	.	H	α-helix	trans	-61.4	-27.1	177.4	-72.5	178.1	-174.1	-72.5	0	113.9	S477 L478 S484 L512 E516	S477-K481 WeakPolarHBondContact O-CG 3.43Å; S477-K481 PolarHBondContact O-N 3.09Å; L478-K481 PolarHBondContact O-N 2.76Å; K481-S484 WeakPolarHBondContact CA-OG 3.23Å; K481-S484 PolarHBondContact O-OG 2.89Å; K481-L512 HydrophobicContact CB-CD2 4.49Å; K481-L512 HydrophobicContact CG-CD1 3.75Å; K481-L512 HydrophobicContact CG-CD2 3.66Å; K481-L512 HydrophobicContact CG-CG 4.39Å; K481-E516 WeakPolarHBondContact CE-OE1 3.39Å; K481-E516 IonicContact NZ-OE1 2.7Å; K481-E516 PolarHBondContact NZ-OE1 2.98Å; K481-E516 IonicContact NZ-OE2 3.6Å; K481-E516 PolarHBondContact NZ-OE2 3.23Å
482	K	91.6	Very high	87.8	Confident	109 Å²	109	64.6 Å²	64.6	47%	0.474	34%	0.335	S	S	.	.	H	α-helix	trans	-76.4	-36.4	172.3	-77.6	-175.9	176.5	-168.5	0	112.8	L478 L480 Y597	L478-K482 HydrophobicContact CD1-CG 4.48Å; L478-K482 WeakPolarHBondContact O-CB 3.35Å; L478-K482 WeakPolarHBondContact O-CG 3.32Å; L478-K482 PolarHBondContact O-N 2.94Å; L480-K482 PolarHBondContact O-N 2.97Å; K482-Y597 HydrophobicContact CB-CD1 4.22Å; K482-Y597 HydrophobicContact CB-CE1 4.02Å; K482-Y597 HydrophobicContact CB-CE2 4.33Å; K482-Y597 HydrophobicContact CB-CG 4.46Å; K482-Y597 HydrophobicContact CD-CD1 4.38Å; K482-Y597 HydrophobicContact CD-CE1 4.4Å; K482-Y597 PolarHBondContact O-OH 2.82Å
483	A	91.5	Very high	87.5	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-75	-29.7	176.3	0	0	0	0	0	113.1	C479 L480 A485 A508 E593 V594 Y597	C479-A483 PolarHBondContact O-N 3.22Å; L480-A483 PolarHBondContact O-N 3.15Å; A483-A485 VanDerWaalsContact C-N 3.33Å; A483-A508 VanDerWaalsContact C-CB 3.49Å; A483-A508 HydrophobicContact CB-CB 3.9Å; A483-A508 VanDerWaalsContact O-CB 3.27Å; A483-A508 WeakPolarHBondContact O-CB 3.28Å; A483-E593 HydrophobicContact CB-CB 3.92Å; A483-V594 HydrophobicContact CB-CB 4.44Å; A483-V594 HydrophobicContact CB-CG2 3.48Å; A483-V594 VanDerWaalsContact CB-CG2 3.48Å; A483-Y597 HydrophobicContact CB-CD2 4.21Å; A483-Y597 HydrophobicContact CB-CE2 4.26Å
484	S	93.5	Very high	87.3	Confident	19 Å²	19	71.1 Å²	71.1	13%	0.133	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-2.2	176	69.1	0	0	0	0	114.5	L480 K481 L512	L480-S484 PolarHBondContact O-N 3.12Å; L480-S484 PolarHBondContact O-OG 3.48Å; K481-S484 WeakPolarHBondContact CA-OG 3.23Å; K481-S484 PolarHBondContact O-OG 2.89Å; S484-L512 WeakPolarHBondContact OG-CD2 3.45Å
485	A	93.2	Very high	87.2	Confident	42 Å²	42	70.6 Å²	70.6	35%	0.347	38%	0.375	S	S	.	.	S	Bend	trans	-80.3	135.9	-178.2	0	0	0	0	0	110.3	A483	A483-A485 VanDerWaalsContact C-N 3.33Å
486	P	92.9	Very high	87.3	Confident	43 Å²	43	75 Å²	75	28%	0.279	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-64	148.5	173.3	29.1	-34.7	0	0	0	110.2	R488 E499 A501	P486-R488 PolarHBondContact O-N 3.25Å; P486-E499 HydrophobicContact CB-CB 4.22Å; P486-E499 HydrophobicContact CG-CB 4.27Å; P486-A501 HydrophobicContact CB-CB 4.49Å
487	H	89.8	Confident	87.6	Confident	63 Å²	63	78.1 Å²	78.1	29%	0.292	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	132.7	173.5	-66.9	-26.9	0	0	0	109.6	W489 E499 V500 E593	H487-W489 HydrophobicContact CB-CE3 4.35Å; H487-W489 HydrophobicContact CB-CZ3 4.04Å; H487-E499 CarbonylContact O-C 2.97Å; H487-E499 WeakPolarHBondContact O-CA 3.3Å; H487-V500 PolarHBondContact N-O 3.35Å; H487-V500 PolarHBondContact O-N 2.96Å; H487-E593 IonicContact CE1-OE2 3.29Å; H487-E593 IonicContact NE2-OE1 3.63Å
488	R	89.4	Confident	87.6	Confident	178 Å²	178	79.7 Å²	79.7	67%	0.672	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.7	132.2	-178.9	-69.1	-179.9	167.7	178.1	-5.6	109.9	P486 I497 T498 E499	P486-R488 PolarHBondContact O-N 3.25Å; R488-I497 HydrophobicContact CB-CG2 4.2Å; R488-I497 HydrophobicContact CG-CG2 4.41Å; R488-T498 WeakPolarHBondContact CA-O 3.43Å; R488-E499 HydrophobicContact CG-CG 4.2Å; R488-E499 IonicContact CZ-OE1 3.17Å; R488-E499 IonicContact NE-OE1 3.21Å; R488-E499 PolarHBondContact NE-OE1 3.14Å; R488-E499 IonicContact NH2-OE1 3.33Å; R488-E499 PolarHBondContact NH2-OE1 3.17Å
489	W	87.9	Confident	87.7	Confident	129 Å²	129	82 Å²	82	49%	0.489	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	159.7	168.3	62.4	87.5	0	0	0	111.1	H487 I497 T498 V500	H487-W489 HydrophobicContact CB-CE3 4.35Å; H487-W489 HydrophobicContact CB-CZ3 4.04Å; W489-I497 CarbonylContact O-C 3.54Å; W489-I497 WeakPolarHBondContact O-CA 3.43Å; W489-T498 HydrophobicContact CZ2-CG2 4.47Å; W489-T498 PolarHBondContact N-O 3.32Å; W489-T498 PolarHBondContact O-N 3.34Å; W489-V500 HydrophobicContact CH2-CB 3.62Å; W489-V500 HydrophobicContact CH2-CG1 4.39Å; W489-V500 HydrophobicContact CH2-CG2 3.34Å; W489-V500 HydrophobicContact CZ2-CG2 3.88Å; W489-V500 HydrophobicContact CZ3-CB 3.92Å; W489-V500 HydrophobicContact CZ3-CG2 4.05Å
490	I	89.5	Confident	87.7	Confident	118 Å²	118	83.9 Å²	83.9	61%	0.605	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.7	128.2	176.2	-58.7	176	0	0	0	108.4	S492 I497	I490-S492 PolarHBondContact O-N 3.2Å; I490-I497 HydrophobicContact CG1-CG1 4.45Å
491	S	81	Confident	87.8	Confident	17 Å²	17	86.6 Å²	86.6	12%	0.119	45%	0.454	C	S	.	.			trans	-64	119.4	170.9	172.8	0	0	0	0	109.2	I493 D494 G495 R496	S491-I493 PolarHBondContact O-N 2.73Å; S491-I493 VanDerWaalsContact O-N 3.17Å; S491-I493 PolarHBondContact OG-N 3.45Å; S491-D494 PolarHBondContact O-N 2.79Å; S491-D494 PolarHBondContact OG-N 2.92Å; S491-D494 PolarHBondContact OG-OD2 3.37Å; S491-G495 WeakPolarHBondContact O-CA 3.31Å; S491-G495 PolarHBondContact O-N 3.21Å; S491-R496 WeakPolarHBondContact CB-O 3.37Å; S491-R496 PolarHBondContact N-O 2.8Å
492	S	80.7	Confident	87.8	Confident	127 Å²	127	85 Å²	85	89%	0.888	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-9.3	175.4	53.7	0	0	0	0	113.8	I490	I490-S492 PolarHBondContact O-N 3.2Å
493	I	78.8	Confident	87.9	Confident	148 Å²	148	83.8 Å²	83.8	76%	0.759	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-39.1	179.4	-54.5	176.1	0	0	0	110.9	S491	S491-I493 PolarHBondContact O-N 2.73Å; S491-I493 VanDerWaalsContact O-N 3.17Å; S491-I493 PolarHBondContact OG-N 3.45Å
494	D	80.5	Confident	88	Confident	108 Å²	108	88.1 Å²	88.1	58%	0.578	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.8	-6.2	-167.9	-47	-72.8	0	0	0	114.6	S491 R496	S491-D494 PolarHBondContact O-N 2.79Å; S491-D494 PolarHBondContact OG-N 2.92Å; S491-D494 PolarHBondContact OG-OD2 3.37Å; D494-R496 HydrophobicContact CB-CB 4.46Å; D494-R496 HydrophobicContact CB-CG 4.16Å; D494-R496 PolarHBondContact O-N 2.62Å; D494-R496 VanDerWaalsContact O-N 3.11Å
495	G	84.1	Confident	88.1	Confident	58 Å²	58	87.3 Å²	87.3	60%	0.598	48%	0.476	S	S	*	.			trans	68.4	0.5	-173.4	0	0	0	0	0	115.2	S491	S491-G495 WeakPolarHBondContact O-CA 3.31Å; S491-G495 PolarHBondContact O-N 3.21Å
496	R	84.1	Confident	88.1	Confident	187 Å²	187	89.3 Å²	89.3	71%	0.706	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-85.1	138.3	-175.1	-64.3	178.7	-177.1	-166.8	-1.8	112.1	S491 D494 T498	S491-R496 WeakPolarHBondContact CB-O 3.37Å; S491-R496 PolarHBondContact N-O 2.8Å; D494-R496 HydrophobicContact CB-CB 4.46Å; D494-R496 HydrophobicContact CB-CG 4.16Å; D494-R496 PolarHBondContact O-N 2.62Å; D494-R496 VanDerWaalsContact O-N 3.11Å; R496-T498 PolarHBondContact O-N 3.37Å
497	I	87.4	Confident	88.2	Confident	120 Å²	120	89.9 Å²	89.9	62%	0.615	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.1	122	169.8	-54.3	172.7	0	0	0	108.3	R488 W489 I490	R488-I497 HydrophobicContact CB-CG2 4.2Å; R488-I497 HydrophobicContact CG-CG2 4.41Å; W489-I497 CarbonylContact O-C 3.54Å; W489-I497 WeakPolarHBondContact O-CA 3.43Å; I490-I497 HydrophobicContact CG1-CG1 4.45Å
498	T	84.3	Confident	88.5	Confident	53 Å²	53	86.9 Å²	86.9	33%	0.325	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	134.7	173.7	-53.6	0	0	0	0	109.1	R488 W489 R496 V500	R488-T498 WeakPolarHBondContact CA-O 3.43Å; W489-T498 HydrophobicContact CZ2-CG2 4.47Å; W489-T498 PolarHBondContact N-O 3.32Å; W489-T498 PolarHBondContact O-N 3.34Å; R496-T498 PolarHBondContact O-N 3.37Å; T498-V500 HydrophobicContact CG2-CG2 4.35Å
499	E	90.5	Very high	88.7	Confident	102 Å²	102	83.8 Å²	83.8	48%	0.477	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	133.5	173.2	-50.4	-156.2	147.5	0	0	110.8	P486 H487 R488	P486-E499 HydrophobicContact CB-CB 4.22Å; P486-E499 HydrophobicContact CG-CB 4.27Å; H487-E499 CarbonylContact O-C 2.97Å; H487-E499 WeakPolarHBondContact O-CA 3.3Å; R488-E499 HydrophobicContact CG-CG 4.2Å; R488-E499 IonicContact CZ-OE1 3.17Å; R488-E499 IonicContact NE-OE1 3.21Å; R488-E499 PolarHBondContact NE-OE1 3.14Å; R488-E499 IonicContact NH2-OE1 3.33Å; R488-E499 PolarHBondContact NH2-OE1 3.17Å
500	V	88.4	Confident	89.1	Confident	60 Å²	60	81.6 Å²	81.6	36%	0.364	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	126.2	173.4	176	0	0	0	0	110.9	H487 W489 T498	H487-V500 PolarHBondContact N-O 3.35Å; H487-V500 PolarHBondContact O-N 2.96Å; W489-V500 HydrophobicContact CH2-CB 3.62Å; W489-V500 HydrophobicContact CH2-CG1 4.39Å; W489-V500 HydrophobicContact CH2-CG2 3.34Å; W489-V500 HydrophobicContact CZ2-CG2 3.88Å; W489-V500 HydrophobicContact CZ3-CB 3.92Å; W489-V500 HydrophobicContact CZ3-CG2 4.05Å; T498-V500 HydrophobicContact CG2-CG2 4.35Å
501	A	92.2	Very high	89.3	Confident	56 Å²	56	76 Å²	76	46%	0.463	42%	0.421	S	S	.	.			trans	-93	120.2	169.9	0	0	0	0	0	110	P486 T505 I506	P486-A501 HydrophobicContact CB-CB 4.49Å; A501-T505 WeakPolarHBondContact CA-OG1 3.34Å; A501-I506 HydrophobicContact CB-CD1 4.38Å; A501-I506 HydrophobicContact CB-CG1 4.04Å
502	T	92.6	Very high	90	Very high	47 Å²	47	75.7 Å²	75.7	29%	0.288	42%	0.418	S	S	.	.			trans	-79.6	159.8	168.3	68.1	0	0	0	0	110.3	E504 T505 I506	T502-E504 PolarHBondContact O-N 2.98Å; T502-E504 VanDerWaalsContact O-N 3.13Å; T502-E504 PolarHBondContact OG1-N 3.4Å; T502-T505 PolarHBondContact N-OG1 3.41Å; T502-T505 PolarHBondContact O-N 3.27Å; T502-T505 PolarHBondContact O-OG1 3.1Å; T502-T505 WeakPolarHBondContact OG1-CG2 3.44Å; T502-T505 PolarHBondContact OG1-N 2.99Å; T502-T505 VanDerWaalsContact OG1-N 3.07Å; T502-T505 PolarHBondContact OG1-OG1 3.16Å; T502-I506 WeakPolarHBondContact O-CG1 3.23Å; T502-I506 PolarHBondContact O-N 3.39Å
503	A	94.6	Very high	90.7	Very high	85 Å²	85	73 Å²	73	70%	0.702	39%	0.394	S	S	*	.	H	α-helix	trans	-53.6	-32.9	172	0	0	0	0	0	112.7	R507	A503-R507 WeakPolarHBondContact O-CB 3.46Å; A503-R507 PolarHBondContact O-N 2.93Å
504	E	93.1	Very high	91.4	Very high	90 Å²	90	66.8 Å²	66.8	42%	0.421	36%	0.362	S	S	.	.	H	α-helix	trans	-69.7	-43.2	176	-56.5	-173.3	-157	0	0	112.5	T502 I506 R507 A508 P592 E593	T502-E504 PolarHBondContact O-N 2.98Å; T502-E504 VanDerWaalsContact O-N 3.13Å; T502-E504 PolarHBondContact OG1-N 3.4Å; E504-I506 VanDerWaalsContact C-N 3.35Å; E504-R507 PolarHBondContact O-N 2.85Å; E504-A508 WeakPolarHBondContact O-CB 3.42Å; E504-A508 PolarHBondContact O-N 2.67Å; E504-P592 HydrophobicContact CB-CG 3.98Å; E504-P592 HydrophobicContact CG-CG 3.8Å; E504-P592 WeakPolarHBondContact OE2-CB 3.41Å; E504-E593 HydrophobicContact CB-CG 3.69Å
505	T	94.2	Very high	92.1	Very high	2 Å²	2	62 Å²	62	1%	0.012	34%	0.336	C	S	.	.	H	α-helix	trans	-67	-33.6	173.8	59.8	0	0	0	0	112.6	A501 T502 A508 K509 E593	A501-T505 WeakPolarHBondContact CA-OG1 3.34Å; T502-T505 PolarHBondContact N-OG1 3.41Å; T502-T505 PolarHBondContact O-N 3.27Å; T502-T505 PolarHBondContact O-OG1 3.1Å; T502-T505 WeakPolarHBondContact OG1-CG2 3.44Å; T502-T505 PolarHBondContact OG1-N 2.99Å; T502-T505 VanDerWaalsContact OG1-N 3.07Å; T502-T505 PolarHBondContact OG1-OG1 3.16Å; T505-A508 PolarHBondContact O-N 2.79Å; T505-K509 WeakPolarHBondContact O-CB 3.28Å; T505-K509 PolarHBondContact O-N 3.38Å; T505-E593 HydrophobicContact CG2-CG 3.8Å
506	I	94.7	Very high	92.5	Very high	85 Å²	85	62.7 Å²	62.7	44%	0.436	32%	0.324	S	S	.	.	H	α-helix	trans	-63.6	-47.5	173.3	-66.5	167	0	0	0	109.6	A501 T502 E504 A508 K509 E510	A501-I506 HydrophobicContact CB-CD1 4.38Å; A501-I506 HydrophobicContact CB-CG1 4.04Å; T502-I506 WeakPolarHBondContact O-CG1 3.23Å; T502-I506 PolarHBondContact O-N 3.39Å; E504-I506 VanDerWaalsContact C-N 3.35Å; I506-A508 VanDerWaalsContact C-N 3.31Å; I506-A508 PolarHBondContact O-N 2.88Å; I506-K509 WeakPolarHBondContact O-CA 3.43Å; I506-K509 WeakPolarHBondContact O-CB 3.43Å; I506-K509 PolarHBondContact O-N 3.33Å; I506-E510 PolarHBondContact O-N 3.28Å
507	R	94.6	Very high	93	Very high	55 Å²	55	55.7 Å²	55.7	21%	0.208	30%	0.303	C	S	.	.	H	α-helix	trans	-61.2	-38.6	174.4	-177.8	53.3	168.6	-174.8	-6	112.6	A503 E504 K509 E510 L511 Y542	A503-R507 WeakPolarHBondContact O-CB 3.46Å; A503-R507 PolarHBondContact O-N 2.93Å; E504-R507 PolarHBondContact O-N 2.85Å; R507-K509 VanDerWaalsContact C-N 3.28Å; R507-K509 PolarHBondContact O-N 2.95Å; R507-E510 WeakPolarHBondContact CD-OE2 3.48Å; R507-E510 IonicContact CZ-OE2 2.86Å; R507-E510 IonicContact NE-OE2 3.06Å; R507-E510 IonicContact NH1-OE2 2.71Å; R507-E510 PolarHBondContact NH1-OE2 3.46Å; R507-E510 PolarHBondContact O-N 3.23Å; R507-L511 HydrophobicContact CG-CD1 4.5Å; R507-L511 WeakPolarHBondContact O-CG 3.37Å; R507-L511 PolarHBondContact O-N 3.02Å; R507-Y542 PolarHBondContact NH2-OH 3Å
508	A	94.9	Very high	93.3	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-65.8	-31.4	173.9	0	0	0	0	0	112.5	A483 E504 T505 I506 L512 E593	A483-A508 VanDerWaalsContact C-CB 3.49Å; A483-A508 HydrophobicContact CB-CB 3.9Å; A483-A508 VanDerWaalsContact O-CB 3.27Å; A483-A508 WeakPolarHBondContact O-CB 3.28Å; E504-A508 WeakPolarHBondContact O-CB 3.42Å; E504-A508 PolarHBondContact O-N 2.67Å; T505-A508 PolarHBondContact O-N 2.79Å; I506-A508 VanDerWaalsContact C-N 3.31Å; I506-A508 PolarHBondContact O-N 2.88Å; A508-L512 PolarHBondContact O-N 2.84Å; A508-E593 HydrophobicContact CB-CB 4.33Å
509	K	95.4	Very high	93.6	Very high	112 Å²	112	48.9 Å²	48.9	49%	0.487	27%	0.271	S	S	.	.	H	α-helix	trans	-70.2	-46.6	173.3	-170.4	-176.6	171.8	-174.6	0	112.5	T505 I506 R507 L511 L512 D513	T505-K509 WeakPolarHBondContact O-CB 3.28Å; T505-K509 PolarHBondContact O-N 3.38Å; I506-K509 WeakPolarHBondContact O-CA 3.43Å; I506-K509 WeakPolarHBondContact O-CB 3.43Å; I506-K509 PolarHBondContact O-N 3.33Å; R507-K509 VanDerWaalsContact C-N 3.28Å; R507-K509 PolarHBondContact O-N 2.95Å; K509-L511 PolarHBondContact O-N 3.45Å; K509-L512 CarbonylContact O-C 3.51Å; K509-L512 WeakPolarHBondContact O-CA 3.41Å; K509-L512 WeakPolarHBondContact O-CB 3.21Å; K509-L512 PolarHBondContact O-N 3.3Å; K509-D513 VanDerWaalsContact O-CG 3.26Å; K509-D513 PolarHBondContact O-N 3.43Å
510	E	94.8	Very high	93.6	Very high	83 Å²	83	48.4 Å²	48.4	39%	0.388	27%	0.272	S	S	.	.	H	α-helix	trans	-51	-44.2	173.1	-66.4	168.3	-173.1	0	0	111.7	I506 R507 D513 I514	I506-E510 PolarHBondContact O-N 3.28Å; R507-E510 WeakPolarHBondContact CD-OE2 3.48Å; R507-E510 IonicContact CZ-OE2 2.86Å; R507-E510 IonicContact NE-OE2 3.06Å; R507-E510 IonicContact NH1-OE2 2.71Å; R507-E510 PolarHBondContact NH1-OE2 3.46Å; R507-E510 PolarHBondContact O-N 3.23Å; E510-D513 PolarHBondContact O-N 2.95Å; E510-I514 WeakPolarHBondContact O-CG1 2.99Å; E510-I514 PolarHBondContact O-N 3.01Å; E510-I514 VanDerWaalsContact O-N 3.11Å
511	L	95.4	Very high	93.4	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-71.2	-30	178.6	-65.8	170	0	0	0	113	R507 K509 H515 F581 A585 V590 N591	R507-L511 HydrophobicContact CG-CD1 4.5Å; R507-L511 WeakPolarHBondContact O-CG 3.37Å; R507-L511 PolarHBondContact O-N 3.02Å; K509-L511 PolarHBondContact O-N 3.45Å; L511-H515 WeakPolarHBondContact O-CB 3.22Å; L511-H515 PolarHBondContact O-N 2.96Å; L511-F581 HydrophobicContact CD2-CE2 4.24Å; L511-F581 HydrophobicContact CD2-CZ 3.87Å; L511-F581 WeakPolarHBondContact O-CE1 3.23Å; L511-A585 HydrophobicContact CB-CB 4.37Å; L511-V590 HydrophobicContact CD1-CG1 3.99Å; L511-V590 HydrophobicContact CD2-CG1 4.37Å; L511-N591 HydrophobicContact CD1-CB 3.73Å
512	L	94.3	Very high	93	Very high	11 Å²	11	58.4 Å²	58.4	6%	0.058	31%	0.31	C	S	.	.	H	α-helix	trans	-68	-50.1	169.9	173.5	66.9	0	0	0	110.6	L480 K481 S484 A508 K509 I514 H515 E516	L480-L512 HydrophobicContact CB-CD1 3.97Å; K481-L512 HydrophobicContact CB-CD2 4.49Å; K481-L512 HydrophobicContact CG-CD1 3.75Å; K481-L512 HydrophobicContact CG-CD2 3.66Å; K481-L512 HydrophobicContact CG-CG 4.39Å; S484-L512 WeakPolarHBondContact OG-CD2 3.45Å; A508-L512 PolarHBondContact O-N 2.84Å; K509-L512 CarbonylContact O-C 3.51Å; K509-L512 WeakPolarHBondContact O-CA 3.41Å; K509-L512 WeakPolarHBondContact O-CB 3.21Å; K509-L512 PolarHBondContact O-N 3.3Å; L512-I514 VanDerWaalsContact C-N 3.27Å; L512-I514 PolarHBondContact O-N 3.02Å; L512-H515 CarbonylContact O-C 3.47Å; L512-H515 WeakPolarHBondContact O-CA 3.31Å; L512-H515 WeakPolarHBondContact O-CB 3.47Å; L512-H515 PolarHBondContact O-N 2.84Å; L512-E516 HydrophobicContact CD1-CG 3.78Å; L512-E516 HydrophobicContact CG-CG 4.1Å; L512-E516 VanDerWaalsContact O-CG 3.31Å; L512-E516 WeakPolarHBondContact O-CG 3.38Å; L512-E516 PolarHBondContact O-N 2.73Å
513	D	95.2	Very high	92.8	Very high	72 Å²	72	57.9 Å²	57.9	39%	0.385	31%	0.305	S	S	.	.	H	α-helix	trans	-61.1	-38	-174.5	-63.8	-16.1	0	0	0	110.7	K509 E510 S517	K509-D513 VanDerWaalsContact O-CG 3.26Å; K509-D513 PolarHBondContact O-N 3.43Å; E510-D513 PolarHBondContact O-N 2.95Å; D513-S517 VanDerWaalsContact O-CB 3.3Å; D513-S517 WeakPolarHBondContact O-CB 3.37Å; D513-S517 PolarHBondContact O-N 2.91Å; D513-S517 PolarHBondContact O-OG 2.89Å
514	I	94.9	Very high	92.6	Very high	17 Å²	17	57.6 Å²	57.6	9%	0.087	30%	0.295	C	S	.	.	H	α-helix	trans	-65.3	-42.2	169.8	-65.5	166.3	0	0	0	111.8	E510 L512 E516 S517 L518 T534 L535 T538 F581	E510-I514 WeakPolarHBondContact O-CG1 2.99Å; E510-I514 PolarHBondContact O-N 3.01Å; E510-I514 VanDerWaalsContact O-N 3.11Å; L512-I514 VanDerWaalsContact C-N 3.27Å; L512-I514 PolarHBondContact O-N 3.02Å; I514-E516 VanDerWaalsContact C-N 3.35Å; I514-E516 PolarHBondContact O-N 2.86Å; I514-S517 PolarHBondContact O-N 3Å; I514-L518 HydrophobicContact CG2-CD1 3.88Å; I514-L518 HydrophobicContact CG2-CG 4.32Å; I514-L518 WeakPolarHBondContact O-CB 3.42Å; I514-L518 WeakPolarHBondContact O-CG 3.39Å; I514-L518 PolarHBondContact O-N 3.35Å; I514-T534 HydrophobicContact CD1-CG2 4.3Å; I514-T534 HydrophobicContact CG1-CG2 4.44Å; I514-L535 HydrophobicContact CG2-CB 4.46Å; I514-L535 HydrophobicContact CG2-CD1 4.16Å; I514-T538 HydrophobicContact CD1-CG2 3.82Å; I514-F581 HydrophobicContact CB-CE1 3.96Å; I514-F581 HydrophobicContact CB-CZ 3.86Å; I514-F581 HydrophobicContact CG2-CD1 4.37Å; I514-F581 HydrophobicContact CG2-CE1 3.63Å; I514-F581 HydrophobicContact CG2-CE2 4.16Å; I514-F581 HydrophobicContact CG2-CZ 3.51Å
515	H	93.7	Very high	92.5	Very high	7 Å²	7	58.1 Å²	58.1	3%	0.032	30%	0.297	C	S	.	.	H	α-helix	trans	-64.8	-36.1	177.7	167	-100.1	0	0	0	112.9	L480 L511 L512 G519 R578 F581 V582	L480-H515 HydrophobicContact CD1-CB 4.03Å; L511-H515 WeakPolarHBondContact O-CB 3.22Å; L511-H515 PolarHBondContact O-N 2.96Å; L512-H515 CarbonylContact O-C 3.47Å; L512-H515 WeakPolarHBondContact O-CA 3.31Å; L512-H515 WeakPolarHBondContact O-CB 3.47Å; L512-H515 PolarHBondContact O-N 2.84Å; H515-G519 PolarHBondContact O-N 3.14Å; H515-R578 PolarHBondContact NE2-NE 3.2Å; H515-F581 HydrophobicContact CB-CD1 4.02Å; H515-F581 HydrophobicContact CB-CE1 3.87Å; H515-V582 VanDerWaalsContact CD2-CG2 3.45Å; H515-V582 WeakPolarHBondContact CD2-CG2 3.36Å
516	E	93.4	Very high	92.5	Very high	73 Å²	73	63.6 Å²	63.6	34%	0.341	33%	0.326	S	S	.	.	H	α-helix	trans	-73.5	-43.8	177.2	-50.6	-138.9	116.2	0	0	110.1	K481 L512 I514 L518 G519 L520	K481-E516 WeakPolarHBondContact CE-OE1 3.39Å; K481-E516 IonicContact NZ-OE1 2.7Å; K481-E516 PolarHBondContact NZ-OE1 2.98Å; K481-E516 IonicContact NZ-OE2 3.6Å; K481-E516 PolarHBondContact NZ-OE2 3.23Å; L512-E516 HydrophobicContact CD1-CG 3.78Å; L512-E516 HydrophobicContact CG-CG 4.1Å; L512-E516 VanDerWaalsContact O-CG 3.31Å; L512-E516 WeakPolarHBondContact O-CG 3.38Å; L512-E516 PolarHBondContact O-N 2.73Å; I514-E516 VanDerWaalsContact C-N 3.35Å; I514-E516 PolarHBondContact O-N 2.86Å; E516-L518 VanDerWaalsContact C-N 3.35Å; E516-L518 PolarHBondContact O-N 3.47Å; E516-G519 CarbonylContact O-C 3.59Å; E516-G519 WeakPolarHBondContact O-CA 3.43Å; E516-G519 PolarHBondContact O-N 2.9Å; E516-L520 PolarHBondContact O-N 3.45Å
517	S	94.4	Very high	92.4	Very high	40 Å²	40	64 Å²	64	28%	0.28	33%	0.326	S	S	.	.	H	α-helix	trans	-57.3	-42.3	174	-58.5	0	0	0	0	113.1	D513 I514 G519 L520	D513-S517 VanDerWaalsContact O-CB 3.3Å; D513-S517 WeakPolarHBondContact O-CB 3.37Å; D513-S517 PolarHBondContact O-N 2.91Å; D513-S517 PolarHBondContact O-OG 2.89Å; I514-S517 PolarHBondContact O-N 3Å; S517-G519 PolarHBondContact O-N 3.48Å; S517-L520 PolarHBondContact O-N 2.77Å
518	L	93.3	Very high	92.5	Very high	6 Å²	6	61.4 Å²	61.4	3%	0.031	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-22.3	175.1	-76.1	167.8	0	0	0	113.7	I514 E516 R528 I531 L535 I577 F581	I514-L518 HydrophobicContact CG2-CD1 3.88Å; I514-L518 HydrophobicContact CG2-CG 4.32Å; I514-L518 WeakPolarHBondContact O-CB 3.42Å; I514-L518 WeakPolarHBondContact O-CG 3.39Å; I514-L518 PolarHBondContact O-N 3.35Å; E516-L518 VanDerWaalsContact C-N 3.35Å; E516-L518 PolarHBondContact O-N 3.47Å; L518-R528 PolarHBondContact O-NH1 3.27Å; L518-I531 HydrophobicContact CD2-CG2 3.92Å; L518-I531 HydrophobicContact CG-CG2 4.21Å; L518-L535 HydrophobicContact CD1-CD1 4.21Å; L518-L535 HydrophobicContact CD1-CD2 3.93Å; L518-L535 HydrophobicContact CD2-CD2 3.8Å; L518-L535 HydrophobicContact CG-CD2 4.47Å; L518-I577 HydrophobicContact CD2-CG2 4.34Å; L518-F581 HydrophobicContact CD1-CB 4.15Å; L518-F581 HydrophobicContact CD1-CD1 3.72Å; L518-F581 HydrophobicContact CD1-CE1 4.31Å; L518-F581 HydrophobicContact CD1-CG 3.94Å
519	G	89.9	Confident	92.4	Very high	23 Å²	23	62.9 Å²	62.9	24%	0.237	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	0.7	179.8	0	0	0	0	0	115.4	H515 E516 S517	H515-G519 PolarHBondContact O-N 3.14Å; E516-G519 CarbonylContact O-C 3.59Å; E516-G519 WeakPolarHBondContact O-CA 3.43Å; E516-G519 PolarHBondContact O-N 2.9Å; S517-G519 PolarHBondContact O-N 3.48Å
520	L	90.9	Very high	92.5	Very high	92 Å²	92	62 Å²	62	48%	0.482	33%	0.325	S	S	.	.			trans	-72.2	135.3	175.6	-64.2	174.6	0	0	0	111.2	E516 S517 L523	E516-L520 PolarHBondContact O-N 3.45Å; S517-L520 PolarHBondContact O-N 2.77Å; L520-L523 HydrophobicContact CB-CD1 3.99Å; L520-L523 HydrophobicContact CB-CD2 4.33Å; L520-L523 HydrophobicContact CB-CG 4.04Å; L520-L523 HydrophobicContact CD1-CD2 4.26Å
521	E	84.3	Confident	92.5	Very high	166 Å²	166	59.5 Å²	59.5	78%	0.776	31%	0.314	S	S	*	.	S	Bend	trans	-98.3	159.9	172	-61	-170.9	172.9	0	0	110.2	L523	E521-L523 VanDerWaalsContact C-N 3.28Å; E521-L523 PolarHBondContact O-N 3.05Å
522	N	84.1	Confident	92.5	Very high	160 Å²	160	59.6 Å²	59.6	86%	0.856	31%	0.314	S	S	*	.	S	Bend	trans	63.9	15.5	179.1	-49.5	-41	0	0	0	117.4
523	L	87.9	Confident	92.6	Very high	37 Å²	37	63.4 Å²	63.4	19%	0.194	33%	0.334	C	S	.	.			trans	-56.3	145.9	165.5	-68.2	165.9	0	0	0	112.3	L520 E521 E527 R528 I531	L520-L523 HydrophobicContact CB-CD1 3.99Å; L520-L523 HydrophobicContact CB-CD2 4.33Å; L520-L523 HydrophobicContact CB-CG 4.04Å; L520-L523 HydrophobicContact CD1-CD2 4.26Å; E521-L523 VanDerWaalsContact C-N 3.28Å; E521-L523 PolarHBondContact O-N 3.05Å; L523-E527 HydrophobicContact CD2-CB 4.05Å; L523-R528 HydrophobicContact CB-CB 4.37Å; L523-R528 HydrophobicContact CD1-CB 4.45Å; L523-I531 HydrophobicContact CD1-CD1 3.67Å; L523-I531 HydrophobicContact CD2-CD1 4.05Å
524	T	91.7	Very high	92.6	Very high	78 Å²	78	63.1 Å²	63.1	48%	0.479	34%	0.335	S	S	.	.			trans	-67	165.1	165.7	67.4	0	0	0	0	111.5	N526 E527 R528	T524-N526 VanDerWaalsContact C-N 3.29Å; T524-N526 PolarHBondContact O-N 3.4Å; T524-E527 VanDerWaalsContact CB-OE2 3.23Å; T524-E527 WeakPolarHBondContact CB-OE2 3.34Å; T524-E527 VanDerWaalsContact CG2-OE2 3.28Å; T524-E527 WeakPolarHBondContact CG2-OE2 3.42Å; T524-E527 PolarHBondContact N-OE2 3.36Å; T524-E527 VanDerWaalsContact OG1-CD 3.22Å; T524-E527 VanDerWaalsContact OG1-CG 3.3Å; T524-E527 WeakPolarHBondContact OG1-CG 3.46Å; T524-E527 PolarHBondContact OG1-N 2.93Å; T524-E527 PolarHBondContact OG1-OE2 2.94Å; T524-R528 WeakPolarHBondContact O-CB 3.35Å; T524-R528 PolarHBondContact O-N 3.45Å; T524-R528 VanDerWaalsContact O-N 3.1Å
525	H	91	Very high	92.7	Very high	102 Å²	102	62.3 Å²	62.3	47%	0.472	33%	0.331	S	S	.	.	H	α-helix	trans	-60.8	-37.8	176.9	-62.2	121.7	0	0	0	112.4	L529 I561	H525-L529 WeakPolarHBondContact O-CB 3.34Å; H525-L529 WeakPolarHBondContact O-CD1 3.29Å; H525-L529 VanDerWaalsContact O-CG 3.23Å; H525-L529 WeakPolarHBondContact O-CG 3.16Å; H525-L529 PolarHBondContact O-N 2.89Å; H525-I561 HydrophobicContact CB-CG2 3.91Å
526	N	93.1	Very high	92.7	Very high	116 Å²	116	65.3 Å²	65.3	62%	0.62	34%	0.344	S	S	*	.	H	α-helix	trans	-69.9	-54.1	-178.6	-64.5	4.3	0	0	0	111.1	T524 R528 L529 D530	T524-N526 VanDerWaalsContact C-N 3.29Å; T524-N526 PolarHBondContact O-N 3.4Å; N526-R528 PolarHBondContact O-N 3.04Å; N526-R528 VanDerWaalsContact O-N 3.16Å; N526-L529 CarbonylContact O-C 3.56Å; N526-L529 WeakPolarHBondContact O-CA 3.21Å; N526-L529 WeakPolarHBondContact O-CB 3.21Å; N526-L529 PolarHBondContact O-N 2.87Å; N526-D530 PolarHBondContact O-N 2.85Å
527	E	94	Very high	92.7	Very high	93 Å²	93	67.3 Å²	67.3	44%	0.435	35%	0.353	S	S	.	.	H	α-helix	trans	-56.9	-36.7	177.8	-62.8	158.8	133.4	0	0	111.7	L523 T524 D530 I531	L523-E527 HydrophobicContact CD2-CB 4.05Å; T524-E527 VanDerWaalsContact CB-OE2 3.23Å; T524-E527 WeakPolarHBondContact CB-OE2 3.34Å; T524-E527 VanDerWaalsContact CG2-OE2 3.28Å; T524-E527 WeakPolarHBondContact CG2-OE2 3.42Å; T524-E527 PolarHBondContact N-OE2 3.36Å; T524-E527 VanDerWaalsContact OG1-CD 3.22Å; T524-E527 VanDerWaalsContact OG1-CG 3.3Å; T524-E527 WeakPolarHBondContact OG1-CG 3.46Å; T524-E527 PolarHBondContact OG1-N 2.93Å; T524-E527 PolarHBondContact OG1-OE2 2.94Å; E527-D530 PolarHBondContact O-N 2.86Å; E527-I531 WeakPolarHBondContact O-CD1 3.38Å; E527-I531 VanDerWaalsContact O-CG1 3.28Å; E527-I531 WeakPolarHBondContact O-CG1 3.48Å; E527-I531 PolarHBondContact O-N 3.16Å
528	R	94.8	Very high	92.7	Very high	2 Å²	2	66.6 Å²	66.6	1%	0.008	35%	0.347	C	S	.	.	H	α-helix	trans	-67.8	-40.3	175.2	-176.1	60.8	178.4	-176.2	10.2	112.2	L518 L523 T524 N526 D530 L532 E557 I561	L518-R528 PolarHBondContact O-NH1 3.27Å; L523-R528 HydrophobicContact CB-CB 4.37Å; L523-R528 HydrophobicContact CD1-CB 4.45Å; T524-R528 WeakPolarHBondContact O-CB 3.35Å; T524-R528 PolarHBondContact O-N 3.45Å; T524-R528 VanDerWaalsContact O-N 3.1Å; N526-R528 PolarHBondContact O-N 3.04Å; N526-R528 VanDerWaalsContact O-N 3.16Å; R528-D530 VanDerWaalsContact C-N 3.34Å; R528-L532 HydrophobicContact CG-CD1 4.13Å; R528-L532 WeakPolarHBondContact O-CB 3.4Å; R528-L532 WeakPolarHBondContact O-CD1 3.5Å; R528-L532 WeakPolarHBondContact O-CG 3.32Å; R528-L532 PolarHBondContact O-N 3.17Å; R528-E557 IonicContact CZ-OE1 3.36Å; R528-E557 IonicContact CZ-OE2 3.99Å; R528-E557 IonicContact NE-OE1 2.69Å; R528-E557 PolarHBondContact NE-OE1 2.93Å; R528-E557 IonicContact NE-OE2 3.6Å; R528-E557 IonicContact NH2-OE1 3.71Å; R528-E557 PolarHBondContact NH2-OE1 3.3Å; R528-E557 IonicContact NH2-OE2 2.73Å; R528-E557 PolarHBondContact NH2-OE2 3.16Å; R528-I561 HydrophobicContact CB-CD1 4.42Å; R528-I561 HydrophobicContact CG-CD1 3.75Å
529	L	94.6	Very high	92.7	Very high	30 Å²	30	66.3 Å²	66.3	16%	0.157	35%	0.345	C	S	.	.	H	α-helix	trans	-64.6	-38.6	174.7	-75.5	163.4	0	0	0	111.5	H525 N526 L532 L533 A558 I561 M562	H525-L529 WeakPolarHBondContact O-CB 3.34Å; H525-L529 WeakPolarHBondContact O-CD1 3.29Å; H525-L529 VanDerWaalsContact O-CG 3.23Å; H525-L529 WeakPolarHBondContact O-CG 3.16Å; H525-L529 PolarHBondContact O-N 2.89Å; N526-L529 CarbonylContact O-C 3.56Å; N526-L529 WeakPolarHBondContact O-CA 3.21Å; N526-L529 WeakPolarHBondContact O-CB 3.21Å; N526-L529 PolarHBondContact O-N 2.87Å; L529-L532 CarbonylContact O-C 3.48Å; L529-L532 WeakPolarHBondContact O-CB 3.37Å; L529-L532 PolarHBondContact O-N 2.86Å; L529-L533 WeakPolarHBondContact O-CB 3.48Å; L529-L533 PolarHBondContact O-N 2.98Å; L529-A558 HydrophobicContact CD2-CB 3.7Å; L529-I561 HydrophobicContact CD1-CG2 4.01Å; L529-I561 HydrophobicContact CD2-CG2 4.29Å; L529-I561 HydrophobicContact CG-CG2 4.06Å; L529-M562 HydrophobicContact CD1-CE 3.57Å; L529-M562 HydrophobicContact CD1-SD 4.14Å; L529-M562 HydrophobicContact CD2-CE 4.21Å
530	D	96.2	Very high	92.8	Very high	94 Å²	94	69.1 Å²	69.1	50%	0.503	36%	0.361	S	S	.	.	H	α-helix	trans	-65.2	-46.9	176.7	-64.8	-36.1	0	0	0	111.5	N526 E527 R528 L532 L533 T534	N526-D530 PolarHBondContact O-N 2.85Å; E527-D530 PolarHBondContact O-N 2.86Å; R528-D530 VanDerWaalsContact C-N 3.34Å; D530-L532 VanDerWaalsContact C-N 3.28Å; D530-L532 PolarHBondContact O-N 3.14Å; D530-L533 WeakPolarHBondContact O-CB 3.32Å; D530-L533 PolarHBondContact O-N 3.36Å; D530-T534 PolarHBondContact O-N 2.92Å; D530-T534 PolarHBondContact O-OG1 3.42Å
531	I	95.6	Very high	92.6	Very high	30 Å²	30	69 Å²	69	15%	0.154	37%	0.369	C	S	.	.	H	α-helix	trans	-59.5	-39.6	174	-68.6	162.4	0	0	0	111.2	L518 L523 E527 L535	L518-I531 HydrophobicContact CD2-CG2 3.92Å; L518-I531 HydrophobicContact CG-CG2 4.21Å; L523-I531 HydrophobicContact CD1-CD1 3.67Å; L523-I531 HydrophobicContact CD2-CD1 4.05Å; E527-I531 WeakPolarHBondContact O-CD1 3.38Å; E527-I531 VanDerWaalsContact O-CG1 3.28Å; E527-I531 WeakPolarHBondContact O-CG1 3.48Å; E527-I531 PolarHBondContact O-N 3.16Å; I531-L535 WeakPolarHBondContact O-CB 3.48Å; I531-L535 PolarHBondContact O-N 2.81Å
532	L	95.9	Very high	92.8	Very high	3 Å²	3	63.9 Å²	63.9	2%	0.016	34%	0.342	C	S	.	.	H	α-helix	trans	-67	-34.6	175.1	-74.6	170.5	0	0	0	112.1	R528 L529 D530 K536 V554 E557 I561	R528-L532 HydrophobicContact CG-CD1 4.13Å; R528-L532 WeakPolarHBondContact O-CB 3.4Å; R528-L532 WeakPolarHBondContact O-CD1 3.5Å; R528-L532 WeakPolarHBondContact O-CG 3.32Å; R528-L532 PolarHBondContact O-N 3.17Å; L529-L532 CarbonylContact O-C 3.48Å; L529-L532 WeakPolarHBondContact O-CB 3.37Å; L529-L532 PolarHBondContact O-N 2.86Å; D530-L532 VanDerWaalsContact C-N 3.28Å; D530-L532 PolarHBondContact O-N 3.14Å; L532-K536 WeakPolarHBondContact O-CB 3.49Å; L532-K536 PolarHBondContact O-N 3.5Å; L532-V554 HydrophobicContact CB-CG1 4.06Å; L532-V554 HydrophobicContact CD2-CB 4.4Å; L532-V554 HydrophobicContact CD2-CG1 4.08Å; L532-V554 HydrophobicContact CD2-CG2 4.01Å; L532-E557 HydrophobicContact CD1-CB 4.04Å; L532-E557 HydrophobicContact CD1-CG 4.12Å; L532-I561 HydrophobicContact CD1-CD1 4.06Å
533	L	95.5	Very high	92.8	Very high	91 Å²	91	62.8 Å²	62.8	48%	0.476	34%	0.337	S	S	.	.	H	α-helix	trans	-68.8	-45.9	175.2	-176.2	63.7	0	0	0	111.6	L529 D530 L535 K536 Q537	L529-L533 WeakPolarHBondContact O-CB 3.48Å; L529-L533 PolarHBondContact O-N 2.98Å; D530-L533 WeakPolarHBondContact O-CB 3.32Å; D530-L533 PolarHBondContact O-N 3.36Å; L533-L535 VanDerWaalsContact C-N 3.32Å; L533-L535 PolarHBondContact O-N 3.37Å; L533-K536 PolarHBondContact O-N 3.19Å; L533-K536 VanDerWaalsContact O-N 3.15Å; L533-Q537 WeakPolarHBondContact O-CG 3.39Å; L533-Q537 PolarHBondContact O-N 3.03Å
534	T	95.6	Very high	92.9	Very high	65 Å²	65	62.4 Å²	62.4	40%	0.399	34%	0.336	S	S	.	.	H	α-helix	trans	-60.6	-41	173.8	-51.6	0	0	0	0	111.6	I514 D530 Q537 T538	I514-T534 HydrophobicContact CD1-CG2 4.3Å; I514-T534 HydrophobicContact CG1-CG2 4.44Å; D530-T534 PolarHBondContact O-N 2.92Å; D530-T534 PolarHBondContact O-OG1 3.42Å; T534-Q537 PolarHBondContact O-N 3.47Å; T534-T538 WeakPolarHBondContact O-CG2 3.4Å; T534-T538 PolarHBondContact O-N 3.27Å; T534-T538 PolarHBondContact O-OG1 2.89Å
535	L	96	Very high	92.9	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-60.7	-47.2	172.2	173.9	63.4	0	0	0	111.2	I514 L518 I531 L533 Q537 T538 V539 I550 V554 I577 F581	I514-L535 HydrophobicContact CG2-CB 4.46Å; I514-L535 HydrophobicContact CG2-CD1 4.16Å; L518-L535 HydrophobicContact CD1-CD1 4.21Å; L518-L535 HydrophobicContact CD1-CD2 3.93Å; L518-L535 HydrophobicContact CD2-CD2 3.8Å; L518-L535 HydrophobicContact CG-CD2 4.47Å; I531-L535 WeakPolarHBondContact O-CB 3.48Å; I531-L535 PolarHBondContact O-N 2.81Å; L533-L535 VanDerWaalsContact C-N 3.32Å; L533-L535 PolarHBondContact O-N 3.37Å; L535-Q537 PolarHBondContact O-N 3.32Å; L535-T538 PolarHBondContact O-OG1 3.34Å; L535-V539 HydrophobicContact CD1-CG2 3.59Å; L535-V539 HydrophobicContact CG-CG2 4.34Å; L535-V539 WeakPolarHBondContact O-CB 3.46Å; L535-V539 WeakPolarHBondContact O-CG2 3.31Å; L535-V539 PolarHBondContact O-N 2.96Å; L535-I550 HydrophobicContact CD1-CG2 4.25Å; L535-I550 HydrophobicContact CD2-CG2 4.06Å; L535-I550 HydrophobicContact CG-CG2 4.16Å; L535-V554 HydrophobicContact CD2-CG2 3.42Å; L535-V554 VanDerWaalsContact CD2-CG2 3.42Å; L535-V554 HydrophobicContact CG-CG2 4.09Å; L535-I577 HydrophobicContact CD2-CG2 3.74Å; L535-F581 HydrophobicContact CD1-CD2 3.29Å; L535-F581 HydrophobicContact CD1-CE2 3.52Å; L535-F581 HydrophobicContact CD1-CG 3.96Å; L535-F581 HydrophobicContact CD1-CZ 4.34Å
536	K	95	Very high	93	Very high	70 Å²	70	63.5 Å²	63.5	30%	0.304	33%	0.334	S	S	.	.	H	α-helix	trans	-60.2	-44.9	179.1	-173.6	170.4	-176	166.7	0	111.7	L532 L533 S540 I551 V554 D555	L532-K536 WeakPolarHBondContact O-CB 3.49Å; L532-K536 PolarHBondContact O-N 3.5Å; L533-K536 PolarHBondContact O-N 3.19Å; L533-K536 VanDerWaalsContact O-N 3.15Å; K536-S540 WeakPolarHBondContact O-CB 3.47Å; K536-S540 PolarHBondContact O-N 3.08Å; K536-I551 HydrophobicContact CG-CG1 4.49Å; K536-V554 HydrophobicContact CB-CG1 4.25Å; K536-D555 WeakPolarHBondContact CD-OD1 3.24Å; K536-D555 WeakPolarHBondContact CE-OD1 3.47Å; K536-D555 IonicContact NZ-OD1 2.67Å; K536-D555 PolarHBondContact NZ-OD1 2.96Å; K536-D555 IonicContact NZ-OD2 3.19Å; K536-D555 PolarHBondContact NZ-OD2 3.04Å
537	Q	93.8	Very high	93	Very high	116 Å²	116	58 Å²	58	54%	0.542	31%	0.305	S	S	.	.	H	α-helix	trans	-61	-53.9	178.2	-71.5	170.3	-4.8	0	0	112	L533 T534 L535 V539 S540	L533-Q537 WeakPolarHBondContact O-CG 3.39Å; L533-Q537 PolarHBondContact O-N 3.03Å; T534-Q537 PolarHBondContact O-N 3.47Å; L535-Q537 PolarHBondContact O-N 3.32Å; Q537-V539 VanDerWaalsContact C-N 3.28Å; Q537-V539 PolarHBondContact O-N 2.82Å; Q537-S540 PolarHBondContact O-N 3.25Å
538	T	93.8	Very high	93	Very high	24 Å²	24	59.6 Å²	59.6	15%	0.147	31%	0.31	C	S	.	.	H	α-helix	trans	-65.6	-29.3	-177.6	51.5	0	0	0	0	113.8	I514 T534 L535	I514-T538 HydrophobicContact CD1-CG2 3.82Å; T534-T538 WeakPolarHBondContact O-CG2 3.4Å; T534-T538 PolarHBondContact O-N 3.27Å; T534-T538 PolarHBondContact O-OG1 2.89Å; L535-T538 PolarHBondContact O-OG1 3.34Å
539	V	93.9	Very high	93	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-81.7	-31.9	177.1	171.4	0	0	0	0	112.1	L535 Q537 S541 Y542 S547 I550 I551 F581 F584	L535-V539 HydrophobicContact CD1-CG2 3.59Å; L535-V539 HydrophobicContact CG-CG2 4.34Å; L535-V539 WeakPolarHBondContact O-CB 3.46Å; L535-V539 WeakPolarHBondContact O-CG2 3.31Å; L535-V539 PolarHBondContact O-N 2.96Å; Q537-V539 VanDerWaalsContact C-N 3.28Å; Q537-V539 PolarHBondContact O-N 2.82Å; V539-S541 PolarHBondContact O-N 2.89Å; V539-Y542 PolarHBondContact O-N 3.02Å; V539-S547 VanDerWaalsContact CG1-CA 3.45Å; V539-I550 HydrophobicContact CG1-CB 4.1Å; V539-I550 HydrophobicContact CG1-CD1 4.42Å; V539-I550 HydrophobicContact CG1-CG2 4.11Å; V539-I550 HydrophobicContact CG2-CD1 4.42Å; V539-I550 HydrophobicContact CG2-CG2 4.16Å; V539-I551 HydrophobicContact CG1-CD1 4.31Å; V539-I551 HydrophobicContact CG1-CG1 4.09Å; V539-F581 HydrophobicContact CG2-CD2 4.32Å; V539-F581 HydrophobicContact CG2-CE2 4.3Å; V539-F584 HydrophobicContact CB-CE1 4.45Å; V539-F584 HydrophobicContact CB-CZ 4.36Å; V539-F584 HydrophobicContact CG1-CZ 4.46Å; V539-F584 HydrophobicContact CG2-CD1 4.06Å; V539-F584 HydrophobicContact CG2-CE1 3.7Å; V539-F584 HydrophobicContact CG2-CZ 4.08Å
540	S	90.8	Very high	93.1	Very high	82 Å²	82	60.5 Å²	60.5	57%	0.573	31%	0.314	S	S	*	.	H	α-helix	trans	-67.4	-17.7	-178.7	-169.1	0	0	0	0	114	K536 Q537 Y542	K536-S540 WeakPolarHBondContact O-CB 3.47Å; K536-S540 PolarHBondContact O-N 3.08Å; Q537-S540 PolarHBondContact O-N 3.25Å; S540-Y542 PolarHBondContact O-N 3.06Å
541	S	87.8	Confident	93.1	Very high	90 Å²	90	57.9 Å²	57.9	63%	0.629	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-14.4	174.9	-46.6	0	0	0	0	113.8	V539	V539-S541 PolarHBondContact O-N 2.89Å
542	Y	86.9	Confident	93.1	Very high	58 Å²	58	58.7 Å²	58.7	23%	0.227	32%	0.315	C	S	.	.	S	Bend	trans	-123.9	120.8	-173.7	-54.8	-97	0	0	0	111	R507 V539 S540 T544 S547 F584 Q589 V590	R507-Y542 PolarHBondContact NH2-OH 3Å; V539-Y542 PolarHBondContact O-N 3.02Å; S540-Y542 PolarHBondContact O-N 3.06Å; Y542-T544 VanDerWaalsContact C-N 3.29Å; Y542-T544 PolarHBondContact O-N 2.9Å; Y542-S547 WeakPolarHBondContact O-CB 3.27Å; Y542-S547 PolarHBondContact O-OG 3.07Å; Y542-F584 HydrophobicContact CD2-CE2 4.15Å; Y542-F584 AromaticContact CD2-CZ 3.6Å; Y542-F584 HydrophobicContact CD2-CZ 3.6Å; Y542-F584 HydrophobicContact CE2-CZ 4.08Å; Y542-F584 HydrophobicContact CG-CE2 4.28Å; Y542-F584 HydrophobicContact CG-CZ 4.17Å; Y542-Q589 WeakPolarHBondContact CE1-O 3.38Å; Y542-V590 HydrophobicContact CD1-CG2 3.95Å; Y542-V590 HydrophobicContact CE1-CB 4.44Å; Y542-V590 HydrophobicContact CE1-CG2 4Å; Y542-V590 HydrophobicContact CE2-CG1 4.35Å; Y542-V590 HydrophobicContact CG-CG2 4.21Å
543	N	85.8	Confident	93.2	Very high	137 Å²	137	59.1 Å²	59.1	73%	0.733	32%	0.318	S	S	*	.			trans	-86.9	53.4	-176.8	-168.7	5.8	0	0	0	113	K548	N543-K548 WeakPolarHBondContact OD1-CE 3.27Å; N543-K548 PolarHBondContact OD1-NZ 3.05Å
544	T	88.3	Confident	93.2	Very high	30 Å²	30	54.9 Å²	54.9	18%	0.184	30%	0.296	C	S	.	.			trans	-94.5	168.6	179.7	76.5	0	0	0	0	112.4	Y542 I546 S547 K548	Y542-T544 VanDerWaalsContact C-N 3.29Å; Y542-T544 PolarHBondContact O-N 2.9Å; T544-I546 PolarHBondContact OG1-N 2.87Å; T544-S547 PolarHBondContact N-OG 3.04Å; T544-S547 PolarHBondContact O-OG 3.01Å; T544-S547 VanDerWaalsContact O-OG 3.05Å; T544-S547 PolarHBondContact OG1-N 2.88Å; T544-S547 PolarHBondContact OG1-OG 3.28Å; T544-K548 WeakPolarHBondContact O-CG 3.49Å; T544-K548 PolarHBondContact O-N 3.01Å
545	K	92.6	Very high	93.3	Very high	160 Å²	160	55 Å²	55	70%	0.696	29%	0.293	S	S	*	.	H	α-helix	trans	-63.8	-40.9	168.8	-176	177.9	177.4	-180	0	111.9	K548 E549	K545-K548 PolarHBondContact O-N 2.57Å; K545-E549 VanDerWaalsContact CE-OE1 3.26Å; K545-E549 WeakPolarHBondContact CE-OE1 3.48Å; K545-E549 PolarHBondContact O-N 2.77Å
546	I	92.5	Very high	93.3	Very high	42 Å²	42	62.3 Å²	62.3	22%	0.215	32%	0.321	C	S	.	.	H	α-helix	trans	-68.5	-40.3	-175.6	-56.9	-177.5	0	0	0	110.7	T544 E549 I550 Q583 F584 L587	T544-I546 PolarHBondContact OG1-N 2.87Å; I546-E549 PolarHBondContact O-N 3.11Å; I546-I550 HydrophobicContact CG2-CD1 4.02Å; I546-I550 HydrophobicContact CG2-CG1 4.49Å; I546-I550 WeakPolarHBondContact O-CG1 3.42Å; I546-I550 PolarHBondContact O-N 2.94Å; I546-Q583 HydrophobicContact CD1-CB 4.49Å; I546-F584 HydrophobicContact CG2-CB 3.9Å; I546-L587 HydrophobicContact CD1-CD1 4.43Å
547	S	93.7	Very high	93.3	Very high	1 Å²	1	59 Å²	59	1%	0.007	31%	0.307	C	S	.	.	H	α-helix	trans	-64.4	-40.2	175.9	46.4	0	0	0	0	112.5	V539 Y542 T544 I550 I551	V539-S547 VanDerWaalsContact CG1-CA 3.45Å; Y542-S547 WeakPolarHBondContact O-CB 3.27Å; Y542-S547 PolarHBondContact O-OG 3.07Å; T544-S547 PolarHBondContact N-OG 3.04Å; T544-S547 PolarHBondContact O-OG 3.01Å; T544-S547 VanDerWaalsContact O-OG 3.05Å; T544-S547 PolarHBondContact OG1-N 2.88Å; T544-S547 PolarHBondContact OG1-OG 3.28Å; S547-I550 PolarHBondContact O-N 2.88Å; S547-I551 VanDerWaalsContact O-CG1 3.29Å; S547-I551 WeakPolarHBondContact O-CG1 3.25Å; S547-I551 PolarHBondContact O-N 2.92Å
548	K	93.9	Very high	93.4	Very high	126 Å²	126	54.5 Å²	54.5	55%	0.548	29%	0.29	S	S	.	.	H	α-helix	trans	-61.9	-41.7	171.7	-70.1	174.7	-175.7	171.4	0	112.5	N543 T544 K545 G552	N543-K548 WeakPolarHBondContact OD1-CE 3.27Å; N543-K548 PolarHBondContact OD1-NZ 3.05Å; T544-K548 WeakPolarHBondContact O-CG 3.49Å; T544-K548 PolarHBondContact O-N 3.01Å; K545-K548 PolarHBondContact O-N 2.57Å; K548-G552 PolarHBondContact O-N 3.03Å; K548-G552 VanDerWaalsContact O-N 3.09Å
549	E	95.7	Very high	93.5	Very high	52 Å²	52	57.9 Å²	57.9	24%	0.243	30%	0.304	C	S	.	.	H	α-helix	trans	-63.4	-38.6	173.2	-76.2	-172.5	-138.2	0	0	112.4	K545 I546 L553 R580	K545-E549 VanDerWaalsContact CE-OE1 3.26Å; K545-E549 WeakPolarHBondContact CE-OE1 3.48Å; K545-E549 PolarHBondContact O-N 2.77Å; I546-E549 PolarHBondContact O-N 3.11Å; E549-L553 WeakPolarHBondContact O-CD1 3.31Å; E549-L553 WeakPolarHBondContact O-CG 3.5Å; E549-L553 PolarHBondContact O-N 3.19Å; E549-R580 IonicContact OE1-NH2 3.52Å; E549-R580 IonicContact OE2-CZ 2.76Å; E549-R580 IonicContact OE2-NE 3.45Å; E549-R580 PolarHBondContact OE2-NE 3.48Å; E549-R580 IonicContact OE2-NH2 3.54Å; E549-R580 PolarHBondContact OE2-NH2 2.68Å
550	I	96.3	Very high	93.6	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-66.3	-50.2	176	-69.4	164.2	0	0	0	110.7	L535 V539 I546 S547 G552 L553 V554 R580 F584	L535-I550 HydrophobicContact CD1-CG2 4.25Å; L535-I550 HydrophobicContact CD2-CG2 4.06Å; L535-I550 HydrophobicContact CG-CG2 4.16Å; V539-I550 HydrophobicContact CG1-CB 4.1Å; V539-I550 HydrophobicContact CG1-CD1 4.42Å; V539-I550 HydrophobicContact CG1-CG2 4.11Å; V539-I550 HydrophobicContact CG2-CD1 4.42Å; V539-I550 HydrophobicContact CG2-CG2 4.16Å; I546-I550 HydrophobicContact CG2-CD1 4.02Å; I546-I550 HydrophobicContact CG2-CG1 4.49Å; I546-I550 WeakPolarHBondContact O-CG1 3.42Å; I546-I550 PolarHBondContact O-N 2.94Å; S547-I550 PolarHBondContact O-N 2.88Å; I550-G552 VanDerWaalsContact C-N 3.34Å; I550-G552 PolarHBondContact O-N 2.92Å; I550-L553 PolarHBondContact O-N 3.47Å; I550-V554 HydrophobicContact CG2-CG2 3.94Å; I550-V554 WeakPolarHBondContact O-CB 3.43Å; I550-V554 VanDerWaalsContact O-CG2 3.32Å; I550-V554 WeakPolarHBondContact O-CG2 3.3Å; I550-V554 PolarHBondContact O-N 3.19Å; I550-R580 HydrophobicContact CD1-CB 4.4Å; I550-R580 HydrophobicContact CG1-CB 3.79Å; I550-F584 HydrophobicContact CD1-CB 3.6Å; I550-F584 HydrophobicContact CD1-CD1 4.49Å; I550-F584 HydrophobicContact CD1-CD2 4.5Å; I550-F584 HydrophobicContact CD1-CG 3.99Å
551	I	95.6	Very high	93.7	Very high	38 Å²	38	56 Å²	56	20%	0.195	29%	0.287	C	S	.	.	H	α-helix	trans	-57.9	-46.3	-178.5	-67.2	163.2	0	0	0	110.7	K536 V539 S547 L553 V554 D555	K536-I551 HydrophobicContact CG-CG1 4.49Å; V539-I551 HydrophobicContact CG1-CD1 4.31Å; V539-I551 HydrophobicContact CG1-CG1 4.09Å; S547-I551 VanDerWaalsContact O-CG1 3.29Å; S547-I551 WeakPolarHBondContact O-CG1 3.25Å; S547-I551 PolarHBondContact O-N 2.92Å; I551-L553 VanDerWaalsContact C-N 3.27Å; I551-L553 PolarHBondContact O-N 3.34Å; I551-V554 PolarHBondContact O-N 2.78Å; I551-D555 WeakPolarHBondContact O-CB 3.42Å; I551-D555 PolarHBondContact O-N 2.73Å
552	G	95.6	Very high	93.9	Very high	47 Å²	47	58.7 Å²	58.7	49%	0.485	29%	0.291	S	S	.	.	H	α-helix	trans	-66.8	-22	177	0	0	0	0	0	114.9	K548 I550 R556	K548-G552 PolarHBondContact O-N 3.03Å; K548-G552 VanDerWaalsContact O-N 3.09Å; I550-G552 VanDerWaalsContact C-N 3.34Å; I550-G552 PolarHBondContact O-N 2.92Å; G552-R556 WeakPolarHBondContact O-CB 3.4Å
553	L	97.3	Very high	94.3	Very high	13 Å²	13	64 Å²	64	7%	0.068	31%	0.311	C	S	.	.	H	α-helix	trans	-83.5	-36.7	171.4	-69.3	166.8	0	0	0	112.1	E549 I550 I551 R556 E557 L573 R576 I577 R580	E549-L553 WeakPolarHBondContact O-CD1 3.31Å; E549-L553 WeakPolarHBondContact O-CG 3.5Å; E549-L553 PolarHBondContact O-N 3.19Å; I550-L553 PolarHBondContact O-N 3.47Å; I551-L553 VanDerWaalsContact C-N 3.27Å; I551-L553 PolarHBondContact O-N 3.34Å; L553-R556 PolarHBondContact O-N 3.24Å; L553-E557 PolarHBondContact O-N 3.5Å; L553-L573 HydrophobicContact CB-CD1 4.37Å; L553-L573 HydrophobicContact CD2-CD1 3.68Å; L553-R576 HydrophobicContact CD1-CG 3.94Å; L553-R576 HydrophobicContact CD2-CG 4.44Å; L553-I577 HydrophobicContact CB-CD1 4.25Å; L553-I577 HydrophobicContact CB-CG1 3.63Å; L553-I577 HydrophobicContact CD1-CG1 4.49Å; L553-R580 HydrophobicContact CD1-CG 4.28Å
554	V	96.7	Very high	94.5	Very high	2 Å²	2	60.4 Å²	60.4	1%	0.012	31%	0.306	C	S	.	.	H	α-helix	trans	-65.6	-49.3	177.2	163.9	0	0	0	0	111	L532 L535 K536 I550 I551 R556 E557 A558 I577	L532-V554 HydrophobicContact CB-CG1 4.06Å; L532-V554 HydrophobicContact CD2-CB 4.4Å; L532-V554 HydrophobicContact CD2-CG1 4.08Å; L532-V554 HydrophobicContact CD2-CG2 4.01Å; L535-V554 HydrophobicContact CD2-CG2 3.42Å; L535-V554 VanDerWaalsContact CD2-CG2 3.42Å; L535-V554 HydrophobicContact CG-CG2 4.09Å; K536-V554 HydrophobicContact CB-CG1 4.25Å; I550-V554 HydrophobicContact CG2-CG2 3.94Å; I550-V554 WeakPolarHBondContact O-CB 3.43Å; I550-V554 VanDerWaalsContact O-CG2 3.32Å; I550-V554 WeakPolarHBondContact O-CG2 3.3Å; I550-V554 PolarHBondContact O-N 3.19Å; I551-V554 PolarHBondContact O-N 2.78Å; V554-R556 PolarHBondContact O-N 3.11Å; V554-E557 PolarHBondContact O-N 3.19Å; V554-A558 PolarHBondContact O-N 3.23Å; V554-I577 HydrophobicContact CG2-CG2 4.36Å
555	D	96.7	Very high	94.8	Very high	66 Å²	66	61.5 Å²	61.5	35%	0.353	31%	0.311	S	S	.	.	H	α-helix	trans	-62	-34.1	178.1	-70.3	-13.1	0	0	0	111	K536 I551 E559	K536-D555 WeakPolarHBondContact CD-OD1 3.24Å; K536-D555 WeakPolarHBondContact CE-OD1 3.47Å; K536-D555 IonicContact NZ-OD1 2.67Å; K536-D555 PolarHBondContact NZ-OD1 2.96Å; K536-D555 IonicContact NZ-OD2 3.19Å; K536-D555 PolarHBondContact NZ-OD2 3.04Å; I551-D555 WeakPolarHBondContact O-CB 3.42Å; I551-D555 PolarHBondContact O-N 2.73Å; D555-E559 WeakPolarHBondContact O-CB 3.36Å; D555-E559 PolarHBondContact O-N 3.28Å
556	R	96.4	Very high	94.6	Very high	155 Å²	155	56.8 Å²	56.8	59%	0.585	30%	0.298	S	S	*	.	H	α-helix	trans	-70.8	-36.6	171.9	-174.6	172.7	178.6	161.8	1.9	113.4	G552 L553 V554 L560 L573	G552-R556 WeakPolarHBondContact O-CB 3.4Å; L553-R556 PolarHBondContact O-N 3.24Å; V554-R556 PolarHBondContact O-N 3.11Å; R556-L560 HydrophobicContact CG-CD1 3.91Å; R556-L560 HydrophobicContact CG-CG 4.44Å; R556-L560 WeakPolarHBondContact O-CB 3.32Å; R556-L560 VanDerWaalsContact O-CD1 3.32Å; R556-L560 WeakPolarHBondContact O-CD1 3.42Å; R556-L560 WeakPolarHBondContact O-CG 3.46Å; R556-L560 PolarHBondContact O-N 3.21Å; R556-L573 HydrophobicContact CG-CD2 4.34Å
557	E	95.2	Very high	94.3	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-67.1	-43.7	173.1	-162.6	-171.8	155.4	0	0	110.3	R528 L532 L553 V554 L560 I561 L570 L573 R574 I577	R528-E557 IonicContact CZ-OE1 3.36Å; R528-E557 IonicContact CZ-OE2 3.99Å; R528-E557 IonicContact NE-OE1 2.69Å; R528-E557 PolarHBondContact NE-OE1 2.93Å; R528-E557 IonicContact NE-OE2 3.6Å; R528-E557 IonicContact NH2-OE1 3.71Å; R528-E557 PolarHBondContact NH2-OE1 3.3Å; R528-E557 IonicContact NH2-OE2 2.73Å; R528-E557 PolarHBondContact NH2-OE2 3.16Å; L532-E557 HydrophobicContact CD1-CB 4.04Å; L532-E557 HydrophobicContact CD1-CG 4.12Å; L553-E557 PolarHBondContact O-N 3.5Å; V554-E557 PolarHBondContact O-N 3.19Å; E557-L560 PolarHBondContact O-N 2.89Å; E557-I561 HydrophobicContact CG-CD1 3.96Å; E557-I561 HydrophobicContact CG-CG1 4.49Å; E557-I561 WeakPolarHBondContact O-CB 3.44Å; E557-I561 VanDerWaalsContact O-CG1 3.3Å; E557-I561 WeakPolarHBondContact O-CG1 3.38Å; E557-I561 PolarHBondContact O-N 3.31Å; E557-L570 HydrophobicContact CG-CD1 4.37Å; E557-L573 HydrophobicContact CB-CD2 3.9Å; E557-L573 HydrophobicContact CB-CG 4.42Å; E557-L573 HydrophobicContact CG-CD2 4.22Å; E557-R574 WeakPolarHBondContact OE1-CG 3.34Å; E557-R574 IonicContact OE1-CZ 2.79Å; E557-R574 IonicContact OE1-NE 3.92Å; E557-R574 PolarHBondContact OE1-NE 2.91Å; E557-R574 IonicContact OE1-NH2 3.21Å; E557-R574 PolarHBondContact OE1-NH2 3.15Å; E557-I577 HydrophobicContact CB-CD1 3.88Å; E557-I577 HydrophobicContact CG-CD1 4.49Å; E557-I577 VanDerWaalsContact OE2-CD1 3.26Å; E557-I577 WeakPolarHBondContact OE2-CD1 3.44Å
558	A	95.2	Very high	94.1	Very high	22 Å²	22	64.9 Å²	64.9	18%	0.182	34%	0.338	C	S	.	.	H	α-helix	trans	-60.3	-46.5	177.6	0	0	0	0	0	112.2	L529 V554 L560 I561 M562	L529-A558 HydrophobicContact CD2-CB 3.7Å; V554-A558 PolarHBondContact O-N 3.23Å; A558-L560 PolarHBondContact O-N 3.49Å; A558-I561 PolarHBondContact O-N 3.04Å; A558-M562 WeakPolarHBondContact O-CG 3.47Å; A558-M562 PolarHBondContact O-N 2.81Å
559	E	96	Very high	94	Very high	94 Å²	94	65 Å²	65	44%	0.439	34%	0.343	S	S	.	.	H	α-helix	trans	-61.9	-42.1	177.2	-165.3	-164.1	175.8	0	0	112.1	D555 M562 R563	D555-E559 WeakPolarHBondContact O-CB 3.36Å; D555-E559 PolarHBondContact O-N 3.28Å; E559-M562 PolarHBondContact O-N 2.72Å; E559-R563 WeakPolarHBondContact O-CB 3.46Å; E559-R563 WeakPolarHBondContact O-CD 3.41Å; E559-R563 VanDerWaalsContact O-CG 3.23Å; E559-R563 WeakPolarHBondContact O-CG 3.31Å; E559-R563 PolarHBondContact O-N 3.29Å; E559-R563 IonicContact OE1-CZ 2.7Å; E559-R563 IonicContact OE1-NE 2.71Å; E559-R563 PolarHBondContact OE1-NE 3.03Å; E559-R563 IonicContact OE1-NH2 3.97Å; E559-R563 PolarHBondContact OE1-NH2 3.02Å
560	L	95.7	Very high	93.8	Very high	35 Å²	35	62.9 Å²	62.9	18%	0.183	33%	0.334	C	S	.	.	H	α-helix	trans	-69.6	-32.7	178.7	-63.8	168.8	0	0	0	112.1	R556 E557 A558 R563 G564 I565 L570 L573	R556-L560 HydrophobicContact CG-CD1 3.91Å; R556-L560 HydrophobicContact CG-CG 4.44Å; R556-L560 WeakPolarHBondContact O-CB 3.32Å; R556-L560 VanDerWaalsContact O-CD1 3.32Å; R556-L560 WeakPolarHBondContact O-CD1 3.42Å; R556-L560 WeakPolarHBondContact O-CG 3.46Å; R556-L560 PolarHBondContact O-N 3.21Å; E557-L560 PolarHBondContact O-N 2.89Å; A558-L560 PolarHBondContact O-N 3.49Å; L560-R563 PolarHBondContact O-N 3.28Å; L560-G564 PolarHBondContact O-N 3.42Å; L560-I565 HydrophobicContact CB-CD1 4.06Å; L560-I565 HydrophobicContact CD2-CD1 3.44Å; L560-I565 VanDerWaalsContact CD2-CD1 3.44Å; L560-I565 HydrophobicContact CG-CD1 4.32Å; L560-I565 WeakPolarHBondContact O-CB 3.18Å; L560-I565 PolarHBondContact O-N 3.16Å; L560-L570 HydrophobicContact CB-CD2 3.9Å; L560-L570 HydrophobicContact CD1-CD2 3.8Å; L560-L570 HydrophobicContact CG-CD2 4.48Å; L560-L573 HydrophobicContact CD1-CD2 3.9Å
561	I	94.2	Very high	93.6	Very high	9 Å²	9	66.3 Å²	66.3	5%	0.046	36%	0.358	C	S	.	.	H	α-helix	trans	-64.8	-48.3	170.6	-74.1	167.4	0	0	0	110.7	H525 R528 L529 L532 E557 A558 R563 G564 L570	H525-I561 HydrophobicContact CB-CG2 3.91Å; R528-I561 HydrophobicContact CB-CD1 4.42Å; R528-I561 HydrophobicContact CG-CD1 3.75Å; L529-I561 HydrophobicContact CD1-CG2 4.01Å; L529-I561 HydrophobicContact CD2-CG2 4.29Å; L529-I561 HydrophobicContact CG-CG2 4.06Å; L532-I561 HydrophobicContact CD1-CD1 4.06Å; E557-I561 HydrophobicContact CG-CD1 3.96Å; E557-I561 HydrophobicContact CG-CG1 4.49Å; E557-I561 WeakPolarHBondContact O-CB 3.44Å; E557-I561 VanDerWaalsContact O-CG1 3.3Å; E557-I561 WeakPolarHBondContact O-CG1 3.38Å; E557-I561 PolarHBondContact O-N 3.31Å; A558-I561 PolarHBondContact O-N 3.04Å; I561-R563 PolarHBondContact O-N 2.95Å; I561-G564 WeakPolarHBondContact O-CA 3.32Å; I561-G564 PolarHBondContact O-N 3.01Å; I561-L570 HydrophobicContact CG1-CD1 3.98Å
562	M	92.5	Very high	93.5	Very high	145 Å²	145	67 Å²	67	71%	0.714	37%	0.374	S	S	*	.	H	α-helix	trans	-62.6	-29	177.5	-68.1	-63.9	-169.9	0	0	112.6	L529 A558 E559 G564	L529-M562 HydrophobicContact CD1-CE 3.57Å; L529-M562 HydrophobicContact CD1-SD 4.14Å; L529-M562 HydrophobicContact CD2-CE 4.21Å; A558-M562 WeakPolarHBondContact O-CG 3.47Å; A558-M562 PolarHBondContact O-N 2.81Å; E559-M562 PolarHBondContact O-N 2.72Å; M562-G564 PolarHBondContact O-N 2.85Å
563	R	94.6	Very high	93.5	Very high	169 Å²	169	66 Å²	66	64%	0.638	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	4.9	171.5	-68.9	165.9	176.4	-103.2	9	113.9	E559 L560 I561 I565	E559-R563 WeakPolarHBondContact O-CB 3.46Å; E559-R563 WeakPolarHBondContact O-CD 3.41Å; E559-R563 VanDerWaalsContact O-CG 3.23Å; E559-R563 WeakPolarHBondContact O-CG 3.31Å; E559-R563 PolarHBondContact O-N 3.29Å; E559-R563 IonicContact OE1-CZ 2.7Å; E559-R563 IonicContact OE1-NE 2.71Å; E559-R563 PolarHBondContact OE1-NE 3.03Å; E559-R563 IonicContact OE1-NH2 3.97Å; E559-R563 PolarHBondContact OE1-NH2 3.02Å; L560-R563 PolarHBondContact O-N 3.28Å; I561-R563 PolarHBondContact O-N 2.95Å; R563-I565 HydrophobicContact CB-CD1 4.32Å; R563-I565 HydrophobicContact CB-CG1 4.49Å
564	G	90.7	Very high	93.4	Very high	62 Å²	62	67.8 Å²	67.8	64%	0.639	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	18.9	174.9	0	0	0	0	0	115.8	L560 I561 M562	L560-G564 PolarHBondContact O-N 3.42Å; I561-G564 WeakPolarHBondContact O-CA 3.32Å; I561-G564 PolarHBondContact O-N 3.01Å; M562-G564 PolarHBondContact O-N 2.85Å
565	I	93	Very high	93.1	Very high	54 Å²	54	71.1 Å²	71.1	28%	0.277	38%	0.379	S	S	.	.			trans	-79.6	125.7	-174.2	-64.6	166.9	0	0	0	111	L560 R563 G567 I569 L570	L560-I565 HydrophobicContact CB-CD1 4.06Å; L560-I565 HydrophobicContact CD2-CD1 3.44Å; L560-I565 VanDerWaalsContact CD2-CD1 3.44Å; L560-I565 HydrophobicContact CG-CD1 4.32Å; L560-I565 WeakPolarHBondContact O-CB 3.18Å; L560-I565 PolarHBondContact O-N 3.16Å; R563-I565 HydrophobicContact CB-CD1 4.32Å; R563-I565 HydrophobicContact CB-CG1 4.49Å; I565-G567 PolarHBondContact O-N 3.45Å; I565-I569 HydrophobicContact CG2-CB 4.34Å; I565-I569 HydrophobicContact CG2-CD1 4.37Å; I565-I569 HydrophobicContact CG2-CG2 4.49Å; I565-L570 HydrophobicContact CG2-CD2 4.06Å; I565-L570 HydrophobicContact CG2-CG 4.32Å
566	S	89.3	Confident	93	Very high	60 Å²	60	74.5 Å²	74.5	42%	0.42	39%	0.387	S	S	.	.			trans	-59.7	137.1	-173.9	78.3	0	0	0	0	113.7	K568 I569	S566-K568 PolarHBondContact O-N 3.06Å; S566-I569 PolarHBondContact O-N 2.93Å
567	G	86.9	Confident	93	Very high	25 Å²	25	67.1 Å²	67.1	26%	0.258	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-21.7	-177.2	0	0	0	0	0	115.4	I565 I569 L570 S571	I565-G567 PolarHBondContact O-N 3.45Å; G567-I569 VanDerWaalsContact C-N 3.34Å; G567-I569 PolarHBondContact O-N 2.91Å; G567-L570 PolarHBondContact O-N 2.9Å; G567-S571 PolarHBondContact O-N 2.97Å
568	K	88.1	Confident	92.9	Very high	188 Å²	188	70.6 Å²	70.6	82%	0.817	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-41.7	174.5	-66.9	-177.6	178.3	179.5	0	111.7	S566 L570 S571	S566-K568 PolarHBondContact O-N 3.06Å; K568-L570 VanDerWaalsContact C-N 3.35Å; K568-S571 WeakPolarHBondContact O-CB 3.3Å; K568-S571 PolarHBondContact O-N 3.19Å; K568-S571 PolarHBondContact O-OG 2.89Å
569	I	92.4	Very high	92.7	Very high	128 Å²	128	72.7 Å²	72.7	66%	0.656	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-34.2	177.9	-57.3	170.6	0	0	0	110.3	I565 S566 G567 S571	I565-I569 HydrophobicContact CG2-CB 4.34Å; I565-I569 HydrophobicContact CG2-CD1 4.37Å; I565-I569 HydrophobicContact CG2-CG2 4.49Å; S566-I569 PolarHBondContact O-N 2.93Å; G567-I569 VanDerWaalsContact C-N 3.34Å; G567-I569 PolarHBondContact O-N 2.91Å; I569-S571 PolarHBondContact O-N 3.06Å
570	L	92.1	Very high	92.6	Very high	8 Å²	8	71.5 Å²	71.5	4%	0.042	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-5.3	-179.9	-56.6	179.9	0	0	0	114.1	E557 L560 I561 I565 G567 K568 G572 L573 R574	E557-L570 HydrophobicContact CG-CD1 4.37Å; L560-L570 HydrophobicContact CB-CD2 3.9Å; L560-L570 HydrophobicContact CD1-CD2 3.8Å; L560-L570 HydrophobicContact CG-CD2 4.48Å; I561-L570 HydrophobicContact CG1-CD1 3.98Å; I565-L570 HydrophobicContact CG2-CD2 4.06Å; I565-L570 HydrophobicContact CG2-CG 4.32Å; G567-L570 PolarHBondContact O-N 2.9Å; K568-L570 VanDerWaalsContact C-N 3.35Å; L570-G572 VanDerWaalsContact C-N 3.33Å; L570-G572 PolarHBondContact O-N 2.84Å; L570-L573 WeakPolarHBondContact O-CA 3.4Å; L570-L573 WeakPolarHBondContact O-CB 3.22Å; L570-L573 PolarHBondContact O-N 2.71Å; L570-R574 WeakPolarHBondContact O-CG 3.4Å; L570-R574 PolarHBondContact O-N 2.92Å
571	S	92.1	Very high	92.6	Very high	73 Å²	73	69.9 Å²	69.9	51%	0.51	36%	0.363	S	S	.	.	H	α-helix	trans	-48	-47.4	-179.3	52.4	0	0	0	0	114	G567 K568 I569 L573 R574 Q575	G567-S571 PolarHBondContact O-N 2.97Å; K568-S571 WeakPolarHBondContact O-CB 3.3Å; K568-S571 PolarHBondContact O-N 3.19Å; K568-S571 PolarHBondContact O-OG 2.89Å; I569-S571 PolarHBondContact O-N 3.06Å; S571-L573 PolarHBondContact O-N 3.34Å; S571-R574 PolarHBondContact O-N 3.19Å; S571-Q575 PolarHBondContact O-N 2.76Å
572	G	93.2	Very high	92.5	Very high	52 Å²	52	69.6 Å²	69.6	54%	0.536	36%	0.362	S	S	.	.	H	α-helix	trans	-65.7	-33.5	176.9	0	0	0	0	0	114.2	L570 R576	L570-G572 VanDerWaalsContact C-N 3.33Å; L570-G572 PolarHBondContact O-N 2.84Å; G572-R576 WeakPolarHBondContact O-CB 3.38Å; G572-R576 PolarHBondContact O-N 3.43Å; G572-R576 VanDerWaalsContact O-N 3.13Å
573	L	94.6	Very high	92.4	Very high	26 Å²	26	67 Å²	67	14%	0.136	35%	0.348	C	S	.	.	H	α-helix	trans	-71.8	-45.2	175.1	179.1	58.5	0	0	0	110.8	L553 R556 E557 L560 L570 S571 Q575 R576 I577	L553-L573 HydrophobicContact CB-CD1 4.37Å; L553-L573 HydrophobicContact CD2-CD1 3.68Å; R556-L573 HydrophobicContact CG-CD2 4.34Å; E557-L573 HydrophobicContact CB-CD2 3.9Å; E557-L573 HydrophobicContact CB-CG 4.42Å; E557-L573 HydrophobicContact CG-CD2 4.22Å; L560-L573 HydrophobicContact CD1-CD2 3.9Å; L570-L573 WeakPolarHBondContact O-CA 3.4Å; L570-L573 WeakPolarHBondContact O-CB 3.22Å; L570-L573 PolarHBondContact O-N 2.71Å; S571-L573 PolarHBondContact O-N 3.34Å; L573-Q575 PolarHBondContact O-N 3.41Å; L573-R576 WeakPolarHBondContact O-CB 3.32Å; L573-R576 PolarHBondContact O-N 2.96Å; L573-R576 VanDerWaalsContact O-N 3.11Å; L573-I577 HydrophobicContact CD1-CD1 4.22Å; L573-I577 HydrophobicContact CD1-CG1 4.46Å; L573-I577 HydrophobicContact CG-CD1 4.03Å; L573-I577 WeakPolarHBondContact O-CG1 3.45Å; L573-I577 PolarHBondContact O-N 3.31Å
574	R	94.8	Very high	92.3	Very high	51 Å²	51	59 Å²	59	19%	0.192	32%	0.318	C	S	.	.	H	α-helix	trans	-57.8	-46.7	175.7	-69.8	-175.8	170	177.9	0.6	111.8	E557 L570 S571 R576 I577 R578	E557-R574 WeakPolarHBondContact OE1-CG 3.34Å; E557-R574 IonicContact OE1-CZ 2.79Å; E557-R574 IonicContact OE1-NE 3.92Å; E557-R574 PolarHBondContact OE1-NE 2.91Å; E557-R574 IonicContact OE1-NH2 3.21Å; E557-R574 PolarHBondContact OE1-NH2 3.15Å; L570-R574 WeakPolarHBondContact O-CG 3.4Å; L570-R574 PolarHBondContact O-N 2.92Å; S571-R574 PolarHBondContact O-N 3.19Å; R574-R576 VanDerWaalsContact C-N 3.32Å; R574-R576 PolarHBondContact O-N 3.23Å; R574-I577 PolarHBondContact O-N 3.11Å; R574-R578 WeakPolarHBondContact O-CB 3.34Å; R574-R578 PolarHBondContact O-N 3.44Å
575	Q	91.8	Very high	92.4	Very high	71 Å²	71	56 Å²	56	33%	0.332	29%	0.287	S	S	.	.	H	α-helix	trans	-63.6	-37.6	175.8	-168.9	65.7	34.7	0	0	112	S571 L573 R578 N579	S571-Q575 PolarHBondContact O-N 2.76Å; L573-Q575 PolarHBondContact O-N 3.41Å; Q575-R578 PolarHBondContact O-N 3.26Å; Q575-N579 PolarHBondContact NE2-OD1 3.06Å; Q575-N579 VanDerWaalsContact O-CB 3.28Å; Q575-N579 WeakPolarHBondContact O-CB 3.39Å; Q575-N579 PolarHBondContact O-N 3.3Å; Q575-N579 PolarHBondContact O-OD1 3.45Å
576	R	94.8	Very high	92.2	Very high	137 Å²	137	56.2 Å²	56.2	52%	0.517	29%	0.286	S	S	.	.	H	α-helix	trans	-65.3	-41.8	175.8	-173.9	178.5	172.1	174	-3.8	112.1	L553 G572 L573 R574 R580	L553-R576 HydrophobicContact CD1-CG 3.94Å; L553-R576 HydrophobicContact CD2-CG 4.44Å; G572-R576 WeakPolarHBondContact O-CB 3.38Å; G572-R576 PolarHBondContact O-N 3.43Å; G572-R576 VanDerWaalsContact O-N 3.13Å; L573-R576 WeakPolarHBondContact O-CB 3.32Å; L573-R576 PolarHBondContact O-N 2.96Å; L573-R576 VanDerWaalsContact O-N 3.11Å; R574-R576 VanDerWaalsContact C-N 3.32Å; R574-R576 PolarHBondContact O-N 3.23Å; R576-R580 WeakPolarHBondContact O-CB 3.47Å; R576-R580 PolarHBondContact O-N 3.04Å
577	I	95.8	Very high	92.2	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.4	-51.2	174.3	-69.6	162.4	0	0	0	110	L518 L535 L553 V554 E557 L573 R574 N579 R580 F581	L518-I577 HydrophobicContact CD2-CG2 4.34Å; L535-I577 HydrophobicContact CD2-CG2 3.74Å; L553-I577 HydrophobicContact CB-CD1 4.25Å; L553-I577 HydrophobicContact CB-CG1 3.63Å; L553-I577 HydrophobicContact CD1-CG1 4.49Å; V554-I577 HydrophobicContact CG2-CG2 4.36Å; E557-I577 HydrophobicContact CB-CD1 3.88Å; E557-I577 HydrophobicContact CG-CD1 4.49Å; E557-I577 VanDerWaalsContact OE2-CD1 3.26Å; E557-I577 WeakPolarHBondContact OE2-CD1 3.44Å; L573-I577 HydrophobicContact CD1-CD1 4.22Å; L573-I577 HydrophobicContact CD1-CG1 4.46Å; L573-I577 HydrophobicContact CG-CD1 4.03Å; L573-I577 WeakPolarHBondContact O-CG1 3.45Å; L573-I577 PolarHBondContact O-N 3.31Å; R574-I577 PolarHBondContact O-N 3.11Å; I577-N579 PolarHBondContact O-N 2.88Å; I577-R580 PolarHBondContact O-N 3.32Å; I577-F581 WeakPolarHBondContact O-CB 3.16Å; I577-F581 PolarHBondContact O-N 3.24Å
578	R	93.1	Very high	92.3	Very high	73 Å²	73	56.1 Å²	56.1	28%	0.275	28%	0.277	S	S	.	.	H	α-helix	trans	-57.4	-49.3	178.2	-169.1	-178.8	-172.5	167.4	11.8	112.1	H515 R574 Q575 R580 F581 V582	H515-R578 PolarHBondContact NE2-NE 3.2Å; R574-R578 WeakPolarHBondContact O-CB 3.34Å; R574-R578 PolarHBondContact O-N 3.44Å; Q575-R578 PolarHBondContact O-N 3.26Å; R578-R580 VanDerWaalsContact C-N 3.33Å; R578-R580 PolarHBondContact O-N 3.25Å; R578-F581 PolarHBondContact O-N 2.62Å; R578-V582 WeakPolarHBondContact O-CG2 3.36Å; R578-V582 PolarHBondContact O-N 2.87Å
579	N	91.5	Very high	92.3	Very high	66 Å²	66	54.4 Å²	54.4	35%	0.353	27%	0.272	S	S	.	.	H	α-helix	trans	-61.5	-38.6	178.1	-72	-2.7	0	0	0	112.3	Q575 I577 Q583	Q575-N579 PolarHBondContact NE2-OD1 3.06Å; Q575-N579 VanDerWaalsContact O-CB 3.28Å; Q575-N579 WeakPolarHBondContact O-CB 3.39Å; Q575-N579 PolarHBondContact O-N 3.3Å; Q575-N579 PolarHBondContact O-OD1 3.45Å; I577-N579 PolarHBondContact O-N 2.88Å; N579-Q583 WeakPolarHBondContact O-CG 3.46Å; N579-Q583 PolarHBondContact O-N 3.44Å
580	R	94.5	Very high	92.2	Very high	70 Å²	70	48.4 Å²	48.4	26%	0.264	24%	0.241	S	C	.	.	H	α-helix	trans	-70.4	-38.8	175.1	-84.3	-71.1	-170.2	-99.9	0.6	112.4	E549 I550 L553 R576 I577 R578 Q583 F584	E549-R580 IonicContact OE1-NH2 3.52Å; E549-R580 IonicContact OE2-CZ 2.76Å; E549-R580 IonicContact OE2-NE 3.45Å; E549-R580 PolarHBondContact OE2-NE 3.48Å; E549-R580 IonicContact OE2-NH2 3.54Å; E549-R580 PolarHBondContact OE2-NH2 2.68Å; I550-R580 HydrophobicContact CD1-CB 4.4Å; I550-R580 HydrophobicContact CG1-CB 3.79Å; L553-R580 HydrophobicContact CD1-CG 4.28Å; R576-R580 WeakPolarHBondContact O-CB 3.47Å; R576-R580 PolarHBondContact O-N 3.04Å; I577-R580 PolarHBondContact O-N 3.32Å; R578-R580 VanDerWaalsContact C-N 3.33Å; R578-R580 PolarHBondContact O-N 3.25Å; R580-Q583 WeakPolarHBondContact O-CB 3.25Å; R580-Q583 PolarHBondContact O-N 3.49Å; R580-Q583 VanDerWaalsContact O-N 3.13Å; R580-F584 PolarHBondContact O-N 2.99Å
581	F	94.8	Very high	92.1	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-64.5	-39.3	175.1	-175.2	-112.4	0	0	0	112.1	L511 I514 H515 L518 L535 V539 I577 R578 Q583 F584 A585	L511-F581 HydrophobicContact CD2-CE2 4.24Å; L511-F581 HydrophobicContact CD2-CZ 3.87Å; L511-F581 WeakPolarHBondContact O-CE1 3.23Å; I514-F581 HydrophobicContact CB-CE1 3.96Å; I514-F581 HydrophobicContact CB-CZ 3.86Å; I514-F581 HydrophobicContact CG2-CD1 4.37Å; I514-F581 HydrophobicContact CG2-CE1 3.63Å; I514-F581 HydrophobicContact CG2-CE2 4.16Å; I514-F581 HydrophobicContact CG2-CZ 3.51Å; H515-F581 HydrophobicContact CB-CD1 4.02Å; H515-F581 HydrophobicContact CB-CE1 3.87Å; L518-F581 HydrophobicContact CD1-CB 4.15Å; L518-F581 HydrophobicContact CD1-CD1 3.72Å; L518-F581 HydrophobicContact CD1-CE1 4.31Å; L518-F581 HydrophobicContact CD1-CG 3.94Å; L535-F581 HydrophobicContact CD1-CD2 3.29Å; L535-F581 HydrophobicContact CD1-CE2 3.52Å; L535-F581 HydrophobicContact CD1-CG 3.96Å; L535-F581 HydrophobicContact CD1-CZ 4.34Å; V539-F581 HydrophobicContact CG2-CD2 4.32Å; V539-F581 HydrophobicContact CG2-CE2 4.3Å; I577-F581 WeakPolarHBondContact O-CB 3.16Å; I577-F581 PolarHBondContact O-N 3.24Å; R578-F581 PolarHBondContact O-N 2.62Å; F581-Q583 VanDerWaalsContact C-N 3.26Å; F581-Q583 PolarHBondContact O-N 3.33Å; F581-F584 AromaticContact CD2-CD1 3.93Å; F581-F584 HydrophobicContact CD2-CD1 3.93Å; F581-F584 AromaticContact CE2-CD1 3.85Å; F581-F584 HydrophobicContact CE2-CD1 3.85Å; F581-F584 HydrophobicContact CE2-CE1 4.25Å; F581-F584 WeakPolarHBondContact O-CB 3.29Å; F581-F584 PolarHBondContact O-N 2.9Å; F581-F584 VanDerWaalsContact O-N 3.15Å; F581-A585 WeakPolarHBondContact O-CB 3.47Å; F581-A585 PolarHBondContact O-N 3.13Å
582	V	91.7	Very high	92	Very high	4 Å²	4	47.1 Å²	47.1	2%	0.024	23%	0.231	C	C	.	.	H	α-helix	trans	-62	-32	171.6	172.7	0	0	0	0	112.3	Q476 H515 R578 K586	Q476-V582 HydrophobicContact CB-CG1 4.11Å; Q476-V582 HydrophobicContact CG-CG1 4.09Å; H515-V582 VanDerWaalsContact CD2-CG2 3.45Å; H515-V582 WeakPolarHBondContact CD2-CG2 3.36Å; R578-V582 WeakPolarHBondContact O-CG2 3.36Å; R578-V582 PolarHBondContact O-N 2.87Å; V582-K586 HydrophobicContact CG1-CD 4.24Å; V582-K586 WeakPolarHBondContact O-CB 3.48Å; V582-K586 WeakPolarHBondContact O-CD 3.38Å; V582-K586 VanDerWaalsContact O-CG 3.24Å; V582-K586 WeakPolarHBondContact O-CG 3.32Å; V582-K586 PolarHBondContact O-N 3.44Å
583	Q	90.1	Very high	91.8	Very high	91 Å²	91	44.8 Å²	44.8	43%	0.425	21%	0.207	S	C	.	.	H	α-helix	trans	-72.7	-37.9	173.8	-70.9	171.6	-11.5	0	0	112.1	I546 N579 R580 F581 K586	I546-Q583 HydrophobicContact CD1-CB 4.49Å; N579-Q583 WeakPolarHBondContact O-CG 3.46Å; N579-Q583 PolarHBondContact O-N 3.44Å; R580-Q583 WeakPolarHBondContact O-CB 3.25Å; R580-Q583 PolarHBondContact O-N 3.49Å; R580-Q583 VanDerWaalsContact O-N 3.13Å; F581-Q583 VanDerWaalsContact C-N 3.26Å; F581-Q583 PolarHBondContact O-N 3.33Å; Q583-K586 PolarHBondContact O-N 3.5Å
584	F	93.5	Very high	91.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-66.7	-49.3	174.8	173.7	-102.9	0	0	0	112.4	V539 Y542 I546 I550 R580 F581 K586 L587 V590	V539-F584 HydrophobicContact CB-CE1 4.45Å; V539-F584 HydrophobicContact CB-CZ 4.36Å; V539-F584 HydrophobicContact CG1-CZ 4.46Å; V539-F584 HydrophobicContact CG2-CD1 4.06Å; V539-F584 HydrophobicContact CG2-CE1 3.7Å; V539-F584 HydrophobicContact CG2-CZ 4.08Å; Y542-F584 HydrophobicContact CD2-CE2 4.15Å; Y542-F584 AromaticContact CD2-CZ 3.6Å; Y542-F584 HydrophobicContact CD2-CZ 3.6Å; Y542-F584 HydrophobicContact CE2-CZ 4.08Å; Y542-F584 HydrophobicContact CG-CE2 4.28Å; Y542-F584 HydrophobicContact CG-CZ 4.17Å; I546-F584 HydrophobicContact CG2-CB 3.9Å; I550-F584 HydrophobicContact CD1-CB 3.6Å; I550-F584 HydrophobicContact CD1-CD1 4.49Å; I550-F584 HydrophobicContact CD1-CD2 4.5Å; I550-F584 HydrophobicContact CD1-CG 3.99Å; R580-F584 PolarHBondContact O-N 2.99Å; F581-F584 AromaticContact CD2-CD1 3.93Å; F581-F584 HydrophobicContact CD2-CD1 3.93Å; F581-F584 AromaticContact CE2-CD1 3.85Å; F581-F584 HydrophobicContact CE2-CD1 3.85Å; F581-F584 HydrophobicContact CE2-CE1 4.25Å; F581-F584 WeakPolarHBondContact O-CB 3.29Å; F581-F584 PolarHBondContact O-N 2.9Å; F581-F584 VanDerWaalsContact O-N 3.15Å; F584-K586 PolarHBondContact O-N 3.06Å; F584-K586 VanDerWaalsContact O-N 3.08Å; F584-L587 HydrophobicContact CD2-CD1 4.39Å; F584-L587 WeakPolarHBondContact O-CB 3.33Å; F584-L587 WeakPolarHBondContact O-CG 3.34Å; F584-L587 PolarHBondContact O-N 3.39Å; F584-V590 HydrophobicContact CD1-CG1 3.99Å; F584-V590 HydrophobicContact CD2-CG2 4.09Å; F584-V590 HydrophobicContact CE1-CG1 3.52Å; F584-V590 HydrophobicContact CE1-CG2 4.42Å; F584-V590 HydrophobicContact CE2-CG1 4.28Å; F584-V590 HydrophobicContact CE2-CG2 3.67Å; F584-V590 HydrophobicContact CZ-CB 4.46Å; F584-V590 HydrophobicContact CZ-CG1 3.69Å; F584-V590 HydrophobicContact CZ-CG2 3.85Å
585	A	92.9	Very high	91	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-4.7	177.7	0	0	0	0	0	114.1	L480 L511 F581 N591	L480-A585 HydrophobicContact CD2-CB 4.01Å; L511-A585 HydrophobicContact CB-CB 4.37Å; F581-A585 WeakPolarHBondContact O-CB 3.47Å; F581-A585 PolarHBondContact O-N 3.13Å; A585-N591 VanDerWaalsContact O-CB 3.32Å; A585-N591 WeakPolarHBondContact O-CB 3.45Å
586	K	88.8	Confident	90.5	Very high	57 Å²	57	44.1 Å²	44.1	25%	0.248	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-0.3	171.9	-78.4	179.8	176	-173.7	0	114.5	V582 Q583 F584 P588 V594	V582-K586 HydrophobicContact CG1-CD 4.24Å; V582-K586 WeakPolarHBondContact O-CB 3.48Å; V582-K586 WeakPolarHBondContact O-CD 3.38Å; V582-K586 VanDerWaalsContact O-CG 3.24Å; V582-K586 WeakPolarHBondContact O-CG 3.32Å; V582-K586 PolarHBondContact O-N 3.44Å; Q583-K586 PolarHBondContact O-N 3.5Å; F584-K586 PolarHBondContact O-N 3.06Å; F584-K586 VanDerWaalsContact O-N 3.08Å; K586-P588 WeakPolarHBondContact O-CD 3.5Å; K586-V594 HydrophobicContact CB-CG1 4.47Å; K586-V594 HydrophobicContact CG-CG1 4.25Å
587	L	89.4	Confident	90	Very high	44 Å²	44	42.1 Å²	42.1	23%	0.23	20%	0.199	C	C	.	.	S	Bend	trans	-75.9	124.9	170.7	-62.3	175.4	0	0	0	109.3	I546 F584 Q589 V590 N591	I546-L587 HydrophobicContact CD1-CD1 4.43Å; F584-L587 HydrophobicContact CD2-CD1 4.39Å; F584-L587 WeakPolarHBondContact O-CB 3.33Å; F584-L587 WeakPolarHBondContact O-CG 3.34Å; F584-L587 PolarHBondContact O-N 3.39Å; L587-Q589 PolarHBondContact O-N 3.25Å; L587-V590 HydrophobicContact CB-CB 4.27Å; L587-V590 HydrophobicContact CB-CG2 3.98Å; L587-V590 HydrophobicContact CD1-CG2 4.19Å; L587-V590 PolarHBondContact O-N 2.92Å; L587-N591 PolarHBondContact O-N 3.01Å
588	P	88.2	Confident	89.2	Confident	39 Å²	39	44.1 Å²	44.1	25%	0.253	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-22.7	176	-27	36.3	0	0	0	114.1	K586 V590 N591 P592 L598	K586-P588 WeakPolarHBondContact O-CD 3.5Å; P588-V590 VanDerWaalsContact C-N 3.27Å; P588-V590 PolarHBondContact O-N 3.24Å; P588-N591 WeakPolarHBondContact CA-O 3.43Å; P588-P592 WeakPolarHBondContact O-CA 3.22Å; P588-L598 HydrophobicContact CG-CD1 3.92Å
589	Q	88	Confident	88	Confident	152 Å²	152	47.1 Å²	47.1	71%	0.71	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-21.4	173.8	-64.3	170.1	-12.3	0	0	113.6	Y542 L587	Y542-Q589 WeakPolarHBondContact CE1-O 3.38Å; L587-Q589 PolarHBondContact O-N 3.25Å
590	V	90.1	Very high	86.6	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.012	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-39	-177.8	177.7	0	0	0	0	110.5	L511 Y542 F584 L587 P588	L511-V590 HydrophobicContact CD1-CG1 3.99Å; L511-V590 HydrophobicContact CD2-CG1 4.37Å; Y542-V590 HydrophobicContact CD1-CG2 3.95Å; Y542-V590 HydrophobicContact CE1-CB 4.44Å; Y542-V590 HydrophobicContact CE1-CG2 4Å; Y542-V590 HydrophobicContact CE2-CG1 4.35Å; Y542-V590 HydrophobicContact CG-CG2 4.21Å; F584-V590 HydrophobicContact CD1-CG1 3.99Å; F584-V590 HydrophobicContact CD2-CG2 4.09Å; F584-V590 HydrophobicContact CE1-CG1 3.52Å; F584-V590 HydrophobicContact CE1-CG2 4.42Å; F584-V590 HydrophobicContact CE2-CG1 4.28Å; F584-V590 HydrophobicContact CE2-CG2 3.67Å; F584-V590 HydrophobicContact CZ-CB 4.46Å; F584-V590 HydrophobicContact CZ-CG1 3.69Å; F584-V590 HydrophobicContact CZ-CG2 3.85Å; L587-V590 HydrophobicContact CB-CB 4.27Å; L587-V590 HydrophobicContact CB-CG2 3.98Å; L587-V590 HydrophobicContact CD1-CG2 4.19Å; L587-V590 PolarHBondContact O-N 2.92Å; P588-V590 VanDerWaalsContact C-N 3.27Å; P588-V590 PolarHBondContact O-N 3.24Å
591	N	91.1	Very high	84.7	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.254	C	S	.	.			trans	-133.4	93.6	179.2	-171.6	-29.6	0	0	0	109.7	L511 A585 L587 P588 V594	L511-N591 HydrophobicContact CD1-CB 3.73Å; A585-N591 VanDerWaalsContact O-CB 3.32Å; A585-N591 WeakPolarHBondContact O-CB 3.45Å; L587-N591 PolarHBondContact O-N 3.01Å; P588-N591 WeakPolarHBondContact CA-O 3.43Å; N591-V594 HydrophobicContact CB-CB 4.22Å; N591-V594 HydrophobicContact CB-CG2 4.15Å; N591-V594 VanDerWaalsContact CG-CG2 3.4Å; N591-V594 VanDerWaalsContact ND2-CG2 3.32Å; N591-V594 WeakPolarHBondContact ND2-CG2 3.24Å; N591-V594 PolarHBondContact O-N 2.92Å; N591-V594 PolarHBondContact OD1-N 3.14Å
592	P	90	Very high	82.7	Confident	54 Å²	54	52.9 Å²	52.9	35%	0.351	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-37.6	-175.9	23.3	-31.5	0	0	0	113.3	E504 P588 V594 G595	E504-P592 HydrophobicContact CB-CG 3.98Å; E504-P592 HydrophobicContact CG-CG 3.8Å; E504-P592 WeakPolarHBondContact OE2-CB 3.41Å; P588-P592 WeakPolarHBondContact O-CA 3.22Å; P592-V594 VanDerWaalsContact C-N 3.29Å; P592-V594 PolarHBondContact O-N 3.38Å; P592-G595 PolarHBondContact O-N 3.01Å
593	E	89	Confident	80.3	Confident	3 Å²	3	56.6 Å²	56.6	1%	0.014	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-57	-38.7	175.7	-82.1	-62	150	0	0	113	A483 H487 E504 T505 A508 G595 K596 Y597	A483-E593 HydrophobicContact CB-CB 3.92Å; H487-E593 IonicContact CE1-OE2 3.29Å; H487-E593 IonicContact NE2-OE1 3.63Å; E504-E593 HydrophobicContact CB-CG 3.69Å; T505-E593 HydrophobicContact CG2-CG 3.8Å; A508-E593 HydrophobicContact CB-CB 4.33Å; E593-G595 PolarHBondContact O-N 2.76Å; E593-G595 VanDerWaalsContact O-N 3.09Å; E593-K596 WeakPolarHBondContact O-CB 3.42Å; E593-K596 PolarHBondContact O-N 3.39Å; E593-K596 VanDerWaalsContact O-N 3.1Å; E593-K596 IonicContact OE1-NZ 3.01Å; E593-K596 PolarHBondContact OE1-NZ 3.17Å; E593-K596 WeakPolarHBondContact OE2-CD 3.34Å; E593-K596 VanDerWaalsContact OE2-CE 3.26Å; E593-K596 WeakPolarHBondContact OE2-CE 3.29Å; E593-K596 IonicContact OE2-NZ 3.31Å; E593-K596 PolarHBondContact OE2-NZ 3.41Å; E593-Y597 WeakPolarHBondContact O-CD2 3.43Å
594	V	88.2	Confident	78.3	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-57.3	-27.5	177.4	164.1	0	0	0	0	112.2	L480 A483 K586 N591 P592 K596 Y597 L598	L480-V594 HydrophobicContact CD2-CG2 4.28Å; A483-V594 HydrophobicContact CB-CB 4.44Å; A483-V594 HydrophobicContact CB-CG2 3.48Å; A483-V594 VanDerWaalsContact CB-CG2 3.48Å; K586-V594 HydrophobicContact CB-CG1 4.47Å; K586-V594 HydrophobicContact CG-CG1 4.25Å; N591-V594 HydrophobicContact CB-CB 4.22Å; N591-V594 HydrophobicContact CB-CG2 4.15Å; N591-V594 VanDerWaalsContact CG-CG2 3.4Å; N591-V594 VanDerWaalsContact ND2-CG2 3.32Å; N591-V594 WeakPolarHBondContact ND2-CG2 3.24Å; N591-V594 PolarHBondContact O-N 2.92Å; N591-V594 PolarHBondContact OD1-N 3.14Å; P592-V594 VanDerWaalsContact C-N 3.29Å; P592-V594 PolarHBondContact O-N 3.38Å; V594-K596 PolarHBondContact O-N 3.1Å; V594-K596 VanDerWaalsContact O-N 3.11Å; V594-Y597 PolarHBondContact O-N 3.09Å; V594-L598 HydrophobicContact CG1-CD1 4.5Å; V594-L598 HydrophobicContact CG1-CD2 3.8Å; V594-L598 HydrophobicContact CG1-CG 4Å; V594-L598 PolarHBondContact O-N 3.46Å
595	G	83.4	Confident	76	Confident	10 Å²	10	64.4 Å²	64.4	10%	0.103	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-53	-33.1	176.6	0	0	0	0	0	113.9	P592 E593 Y597	P592-G595 PolarHBondContact O-N 3.01Å; E593-G595 PolarHBondContact O-N 2.76Å; E593-G595 VanDerWaalsContact O-N 3.09Å; G595-Y597 VanDerWaalsContact C-N 3.26Å; G595-Y597 PolarHBondContact O-N 3.29Å
596	K	82.7	Confident	73.9	Confident	124 Å²	124	72.9 Å²	72.9	54%	0.539	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-69.1	-21.5	177	-57.3	175.2	-168.4	166.1	0	113.2	E593 V594	E593-K596 WeakPolarHBondContact O-CB 3.42Å; E593-K596 PolarHBondContact O-N 3.39Å; E593-K596 VanDerWaalsContact O-N 3.1Å; E593-K596 IonicContact OE1-NZ 3.01Å; E593-K596 PolarHBondContact OE1-NZ 3.17Å; E593-K596 WeakPolarHBondContact OE2-CD 3.34Å; E593-K596 VanDerWaalsContact OE2-CE 3.26Å; E593-K596 WeakPolarHBondContact OE2-CE 3.29Å; E593-K596 IonicContact OE2-NZ 3.31Å; E593-K596 PolarHBondContact OE2-NZ 3.41Å; V594-K596 PolarHBondContact O-N 3.1Å; V594-K596 VanDerWaalsContact O-N 3.11Å
597	Y	83.2	Confident	72.1	Confident	96 Å²	96	76 Å²	76	38%	0.376	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-111.5	0.9	-173	-56.7	-73.3	0	0	0	114.1	K482 A483 E593 V594 G595	K482-Y597 HydrophobicContact CB-CD1 4.22Å; K482-Y597 HydrophobicContact CB-CE1 4.02Å; K482-Y597 HydrophobicContact CB-CE2 4.33Å; K482-Y597 HydrophobicContact CB-CG 4.46Å; K482-Y597 HydrophobicContact CD-CD1 4.38Å; K482-Y597 HydrophobicContact CD-CE1 4.4Å; K482-Y597 PolarHBondContact O-OH 2.82Å; A483-Y597 HydrophobicContact CB-CD2 4.21Å; A483-Y597 HydrophobicContact CB-CE2 4.26Å; E593-Y597 WeakPolarHBondContact O-CD2 3.43Å; V594-Y597 PolarHBondContact O-N 3.09Å; G595-Y597 VanDerWaalsContact C-N 3.26Å; G595-Y597 PolarHBondContact O-N 3.29Å
598	L	79.8	Confident	70.2	Confident	41 Å²	41	76.2 Å²	76.2	22%	0.215	41%	0.414	C	S	.	.			trans	-76.1	138.7	176.2	-67	178.6	0	0	0	111.6	P588 V594 V600	P588-L598 HydrophobicContact CG-CD1 3.92Å; V594-L598 HydrophobicContact CG1-CD1 4.5Å; V594-L598 HydrophobicContact CG1-CD2 3.8Å; V594-L598 HydrophobicContact CG1-CG 4Å; V594-L598 PolarHBondContact O-N 3.46Å; L598-V600 PolarHBondContact O-N 3.28Å
599	T	66.7	Low	68.5	Low	136 Å²	136	78.4 Å²	78.4	83%	0.834	43%	0.426	S	S	*	.	S	Bend	trans	-68	-18.7	-178.2	51.8	0	0	0	0	114.2
600	V	62.7	Low	66.8	Low	103 Å²	103	74.9 Å²	74.9	62%	0.624	42%	0.416	S	S	*	.	S	Bend	trans	-120.3	108.8	170.6	179.4	0	0	0	0	106.4	L598 T602	L598-V600 PolarHBondContact O-N 3.28Å; V600-T602 PolarHBondContact O-N 2.81Å; V600-T602 PolarHBondContact O-OG1 2.97Å; V600-T602 VanDerWaalsContact O-OG1 3.09Å
601	P	54.5	Low	65.1	Low	56 Å²	56	80.5 Å²	80.5	36%	0.364	45%	0.446	S	S	.	.			trans	-57.4	107	177	-25.9	35.8	0	0	0	110.1	V604	P601-V604 HydrophobicContact CB-CG1 3.99Å; P601-V604 HydrophobicContact CB-CG2 3.92Å; P601-V604 WeakPolarHBondContact O-CG2 2.88Å
602	T	52.8	Low	63.5	Low	98 Å²	98	84.1 Å²	84.1	60%	0.601	47%	0.465	S	S	*	.	S	Bend	trans	-88.4	-14.4	-175.8	-31	0	0	0	0	111.9	V600	V600-T602 PolarHBondContact O-N 2.81Å; V600-T602 PolarHBondContact O-OG1 2.97Å; V600-T602 VanDerWaalsContact O-OG1 3.09Å
603	S	42.2	Very low	62.1	Low	82 Å²	82	86 Å²	86	57%	0.573	48%	0.475	S	S	*	.	S	Bend	trans	-124.5	81.5	-179.5	55.6	0	0	0	0	109.6
604	V	46.7	Very low	60.7	Low	76 Å²	76	91.3 Å²	91.3	46%	0.461	50%	0.504	S	S	.	.			trans	-137	137.9	175.7	-92.5	0	0	0	0	111.7	P601 T608	P601-V604 HydrophobicContact CB-CG1 3.99Å; P601-V604 HydrophobicContact CB-CG2 3.92Å; P601-V604 WeakPolarHBondContact O-CG2 2.88Å; V604-T608 VanDerWaalsContact CB-OG1 3.3Å; V604-T608 WeakPolarHBondContact CB-OG1 3.49Å; V604-T608 HydrophobicContact CG1-CG2 4.09Å; V604-T608 WeakPolarHBondContact CG1-OG1 3.3Å
605	K	45.5	Very low	60.1	Low	180 Å²	180	95.4 Å²	95.4	78%	0.783	53%	0.525	S	S	*	.			trans	-62.9	146	164	-59.6	170	-177.8	177.4	0	108.1	T607 T608	K605-T607 PolarHBondContact O-N 3.38Å; K605-T608 PolarHBondContact O-N 3.49Å; K605-T608 PolarHBondContact O-OG1 2.87Å
606	E	50	Low	59.9	Low	178 Å²	178	98.4 Å²	98.4	83%	0.832	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-53.5	-26.5	-168.6	-61.5	165.4	136.4	0	0	114	T608 V609	E606-T608 PolarHBondContact O-N 2.9Å; E606-V609 WeakPolarHBondContact O-CG2 3.4Å; E606-V609 PolarHBondContact O-N 2.98Å
607	T	50.4	Low	59.9	Low	122 Å²	122	95 Å²	95	75%	0.748	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-51.8	-25.2	179.9	-26.8	0	0	0	0	115.4	K605	K605-T607 PolarHBondContact O-N 3.38Å
608	T	49	Very low	60.1	Low	48 Å²	48	94.6 Å²	94.6	29%	0.294	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-89.6	-14.5	-176.4	60.6	0	0	0	0	114.8	V604 K605 E606 P610 L611 L612	V604-T608 VanDerWaalsContact CB-OG1 3.3Å; V604-T608 WeakPolarHBondContact CB-OG1 3.49Å; V604-T608 HydrophobicContact CG1-CG2 4.09Å; V604-T608 WeakPolarHBondContact CG1-OG1 3.3Å; K605-T608 PolarHBondContact O-N 3.49Å; K605-T608 PolarHBondContact O-OG1 2.87Å; E606-T608 PolarHBondContact O-N 2.9Å; T608-P610 VanDerWaalsContact C-CD 3.45Å; T608-L611 PolarHBondContact O-N 3.47Å; T608-L612 WeakPolarHBondContact O-CD1 3.36Å
609	V	52	Low	60.6	Low	86 Å²	86	92.6 Å²	92.6	52%	0.521	51%	0.513	S	S	.	.	H	α-helix	trans	-56.2	-42	-173.3	179.2	0	0	0	0	113.6	E606 L611 L612	E606-V609 WeakPolarHBondContact O-CG2 3.4Å; E606-V609 PolarHBondContact O-N 2.98Å; V609-L611 VanDerWaalsContact C-N 3.34Å; V609-L611 PolarHBondContact O-N 3.21Å; V609-L612 PolarHBondContact O-N 3.04Å
610	P	53.1	Low	61.6	Low	77 Å²	77	91 Å²	91	50%	0.5	50%	0.498	S	S	.	.	H	α-helix	trans	-58.5	-40.7	-179.8	-25.9	35.8	0	0	0	113.8	T608 L612 V613 D614	T608-P610 VanDerWaalsContact C-CD 3.45Å; P610-L612 PolarHBondContact O-N 3.27Å; P610-L612 VanDerWaalsContact O-N 3.14Å; P610-V613 PolarHBondContact O-N 3.02Å; P610-D614 PolarHBondContact O-N 3.47Å
611	L	54.4	Low	62.8	Low	121 Å²	121	90 Å²	90	63%	0.634	50%	0.496	S	S	*	.	H	α-helix	trans	-64.3	-21	-176.6	-68.9	168.3	0	0	0	113.6	T608 V609 N615	T608-L611 PolarHBondContact O-N 3.47Å; V609-L611 VanDerWaalsContact C-N 3.34Å; V609-L611 PolarHBondContact O-N 3.21Å; L611-N615 PolarHBondContact O-ND2 2.87Å
612	L	56.9	Low	64.5	Low	76 Å²	76	89.3 Å²	89.3	40%	0.398	49%	0.492	S	S	.	.	H	α-helix	trans	-79.4	-32.5	172.2	-77	96.9	0	0	0	112.6	T608 V609 P610 I616	T608-L612 WeakPolarHBondContact O-CD1 3.36Å; V609-L612 PolarHBondContact O-N 3.04Å; P610-L612 PolarHBondContact O-N 3.27Å; P610-L612 VanDerWaalsContact O-N 3.14Å; L612-I616 VanDerWaalsContact O-CD1 3.26Å; L612-I616 WeakPolarHBondContact O-CD1 3.5Å; L612-I616 WeakPolarHBondContact O-CG1 3.36Å
613	V	60.3	Low	66.4	Low	94 Å²	94	91.7 Å²	91.7	57%	0.57	50%	0.496	S	S	*	.	H	α-helix	trans	-73.9	-50.9	-174.3	-178.2	0	0	0	0	111	P610 N615 I616	P610-V613 PolarHBondContact O-N 3.02Å; V613-N615 PolarHBondContact O-N 3.28Å; V613-I616 PolarHBondContact O-N 3.4Å; V613-I616 VanDerWaalsContact O-N 3.11Å
614	D	61.2	Low	68.5	Low	114 Å²	114	95.9 Å²	95.9	61%	0.61	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-15.7	-177.1	-71.7	-29.8	0	0	0	113.9	P610 K628	P610-D614 PolarHBondContact O-N 3.47Å; D614-K628 VanDerWaalsContact O-CE 3.24Å; D614-K628 WeakPolarHBondContact O-CE 3.26Å; D614-K628 PolarHBondContact O-NZ 3.47Å
615	N	74.3	Confident	70.4	Confident	85 Å²	85	100.7 Å²	100.7	46%	0.455	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	4.6	-180	-83.2	-63.7	0	0	0	114.3	L611 V613 K627 K628	L611-N615 PolarHBondContact O-ND2 2.87Å; V613-N615 PolarHBondContact O-N 3.28Å; N615-K627 CarbonylContact O-C 3.43Å; N615-K627 VanDerWaalsContact O-CA 3.27Å; N615-K627 WeakPolarHBondContact O-CA 3.47Å; N615-K628 PolarHBondContact O-N 2.95Å
616	I	80.5	Confident	72.3	Confident	74 Å²	74	94 Å²	94	38%	0.379	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	146.4	-175.5	-67.3	169.2	0	0	0	111.9	L612 V613 Y625 L626	L612-I616 VanDerWaalsContact O-CD1 3.26Å; L612-I616 WeakPolarHBondContact O-CD1 3.5Å; L612-I616 WeakPolarHBondContact O-CG1 3.36Å; V613-I616 PolarHBondContact O-N 3.4Å; V613-I616 VanDerWaalsContact O-N 3.11Å; I616-Y625 HydrophobicContact CG2-CD1 4Å; I616-Y625 HydrophobicContact CG2-CG 4.35Å; I616-L626 CarbonylContact C-O 3.57Å; I616-L626 WeakPolarHBondContact CA-O 3.48Å
617	Q	82.8	Confident	73.9	Confident	52 Å²	52	91 Å²	91	24%	0.243	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	138.6	179.7	-166.4	87.3	21.3	0	0	109.5	L626 K628 F631 L640 F641	Q617-L626 PolarHBondContact N-O 2.7Å; Q617-L626 PolarHBondContact O-N 3.03Å; Q617-L626 VanDerWaalsContact O-O 3.13Å; Q617-K628 HydrophobicContact CB-CG 4.17Å; Q617-F631 HydrophobicContact CB-CD2 4.21Å; Q617-F631 HydrophobicContact CB-CE2 3.63Å; Q617-F631 HydrophobicContact CB-CZ 3.95Å; Q617-F631 HydrophobicContact CG-CE2 4.18Å; Q617-F631 HydrophobicContact CG-CZ 4.15Å; Q617-F631 WeakPolarHBondContact O-CZ 3.39Å; Q617-L640 HydrophobicContact CG-CB 4.43Å; Q617-L640 HydrophobicContact CG-CD1 4.47Å; Q617-F641 HydrophobicContact CG-CE1 4.08Å
618	Y	86.7	Confident	75.5	Confident	87 Å²	87	89.3 Å²	89.3	34%	0.341	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	114.7	-178	175.6	-96.7	0	0	0	112.6	I620 Q623 Y625 F641	Y618-I620 HydrophobicContact CD1-CG1 4.48Å; Y618-I620 HydrophobicContact CE1-CG1 4.5Å; Y618-I620 PolarHBondContact O-N 3.12Å; Y618-Q623 HydrophobicContact CE2-CB 4.43Å; Y618-Q623 WeakPolarHBondContact CE2-O 3.27Å; Y618-Q623 WeakPolarHBondContact OH-CA 3.07Å; Y618-Q623 WeakPolarHBondContact OH-CB 3.48Å; Y618-Y625 HydrophobicContact CD2-CD1 4.14Å; Y618-Y625 HydrophobicContact CD2-CD2 4.21Å; Y618-Y625 AromaticContact CD2-CE1 3.84Å; Y618-Y625 HydrophobicContact CD2-CE1 3.84Å; Y618-Y625 AromaticContact CD2-CE2 3.92Å; Y618-Y625 HydrophobicContact CD2-CE2 3.92Å; Y618-Y625 HydrophobicContact CD2-CG 4.31Å; Y618-Y625 AromaticContact CD2-CZ 3.73Å; Y618-Y625 HydrophobicContact CE2-CE2 4.38Å; Y618-Y625 HydrophobicContact CG-CE1 4.25Å; Y618-F641 WeakPolarHBondContact O-CE1 3.39Å
619	C	90.3	Very high	77	Confident	0 Å²	0	91.7 Å²	91.7	0%	0	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	107.8	177.6	-176.2	0	0	0	0	112.1	S621 C622 Q623 R624 L626 F631 C643	C619-S621 VanDerWaalsContact C-N 3.29Å; C619-S621 PolarHBondContact O-N 3.25Å; C619-C622 PolarHBondContact O-N 3.05Å; C619-C622 VanDerWaalsContact SG-SG 3.7Å; C619-Q623 WeakPolarHBondContact O-CA 3.34Å; C619-Q623 PolarHBondContact O-N 3.45Å; C619-R624 PolarHBondContact N-O 2.81Å; C619-L626 HydrophobicContact CB-CD1 4.02Å; C619-F631 HydrophobicContact CB-CE1 3.64Å; C619-F631 HydrophobicContact CB-CZ 3.73Å; C619-C643 HydrophobicContact CB-CB 4.08Å; C619-C643 PolarHBondContact SG-N 3.28Å
620	I	86.6	Confident	78.7	Confident	102 Å²	102	91.5 Å²	91.5	52%	0.523	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-46.5	178.7	-56	173.4	0	0	0	112.2	Y618 C622 F641	Y618-I620 HydrophobicContact CD1-CG1 4.48Å; Y618-I620 HydrophobicContact CE1-CG1 4.5Å; Y618-I620 PolarHBondContact O-N 3.12Å; I620-C622 PolarHBondContact O-N 2.79Å; I620-F641 HydrophobicContact CD1-CD2 3.68Å; I620-F641 HydrophobicContact CD1-CE2 3.97Å; I620-F641 HydrophobicContact CD1-CG 4Å; I620-F641 HydrophobicContact CG1-CD1 4.36Å; I620-F641 HydrophobicContact CG1-CD2 4.37Å; I620-F641 HydrophobicContact CG1-CG 4.31Å
621	S	89	Confident	80.2	Confident	83 Å²	83	87.9 Å²	87.9	58%	0.58	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-18.9	-171.9	-53.3	0	0	0	0	116	C619 P642	C619-S621 VanDerWaalsContact C-N 3.29Å; C619-S621 PolarHBondContact O-N 3.25Å; S621-P642 WeakPolarHBondContact OG-CB 3.33Å
622	C	91	Very high	81.4	Confident	41 Å²	41	82.8 Å²	82.8	28%	0.277	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.1	5.1	175.1	63.9	0	0	0	0	113.6	C619 I620 R624 C646	C619-C622 PolarHBondContact O-N 3.05Å; C619-C622 VanDerWaalsContact SG-SG 3.7Å; I620-C622 PolarHBondContact O-N 2.79Å; C622-R624 WeakPolarHBondContact O-CG 3.44Å; C622-R624 PolarHBondContact O-N 2.9Å; C622-R624 VanDerWaalsContact O-N 3.15Å; C622-C646 WeakPolarHBondContact CB-SG 3.33Å
623	Q	90.9	Very high	82.2	Confident	148 Å²	148	84.6 Å²	84.6	69%	0.692	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	27.1	178.3	-54.1	179.5	-1.2	0	0	114.4	Y618 C619	Y618-Q623 HydrophobicContact CE2-CB 4.43Å; Y618-Q623 WeakPolarHBondContact CE2-O 3.27Å; Y618-Q623 WeakPolarHBondContact OH-CA 3.07Å; Y618-Q623 WeakPolarHBondContact OH-CB 3.48Å; C619-Q623 WeakPolarHBondContact O-CA 3.34Å; C619-Q623 PolarHBondContact O-N 3.45Å
624	R	86.8	Confident	82.9	Confident	169 Å²	169	81 Å²	81	64%	0.638	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.8	137.3	-178.3	-69.1	170.8	-162.2	-167.4	2.6	111.9	C619 C622 L626	C619-R624 PolarHBondContact N-O 2.81Å; C622-R624 WeakPolarHBondContact O-CG 3.44Å; C622-R624 PolarHBondContact O-N 2.9Å; C622-R624 VanDerWaalsContact O-N 3.15Å; R624-L626 HydrophobicContact CB-CD2 4.26Å; R624-L626 HydrophobicContact CB-CG 4.11Å
625	Y	86.7	Confident	83.6	Confident	177 Å²	177	76.3 Å²	76.3	69%	0.694	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	123.8	161.5	-66.1	-80.8	0	0	0	109.4	I616 Y618	I616-Y625 HydrophobicContact CG2-CD1 4Å; I616-Y625 HydrophobicContact CG2-CG 4.35Å; Y618-Y625 HydrophobicContact CD2-CD1 4.14Å; Y618-Y625 HydrophobicContact CD2-CD2 4.21Å; Y618-Y625 AromaticContact CD2-CE1 3.84Å; Y618-Y625 HydrophobicContact CD2-CE1 3.84Å; Y618-Y625 AromaticContact CD2-CE2 3.92Å; Y618-Y625 HydrophobicContact CD2-CE2 3.92Å; Y618-Y625 HydrophobicContact CD2-CG 4.31Å; Y618-Y625 AromaticContact CD2-CZ 3.73Å; Y618-Y625 HydrophobicContact CE2-CE2 4.38Å; Y618-Y625 HydrophobicContact CG-CE1 4.25Å
626	L	86.1	Confident	83.8	Confident	39 Å²	39	76.4 Å²	76.4	20%	0.204	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	153.5	-174.3	-66.4	175.4	0	0	0	109.9	I616 Q617 C619 R624 L630 F631 C643	I616-L626 CarbonylContact C-O 3.57Å; I616-L626 WeakPolarHBondContact CA-O 3.48Å; Q617-L626 PolarHBondContact N-O 2.7Å; Q617-L626 PolarHBondContact O-N 3.03Å; Q617-L626 VanDerWaalsContact O-O 3.13Å; C619-L626 HydrophobicContact CB-CD1 4.02Å; R624-L626 HydrophobicContact CB-CD2 4.26Å; R624-L626 HydrophobicContact CB-CG 4.11Å; L626-L630 HydrophobicContact CB-CB 4.43Å; L626-L630 HydrophobicContact CB-CD1 4.16Å; L626-L630 HydrophobicContact CD2-CD1 4.1Å; L626-F631 HydrophobicContact CB-CE2 3.72Å; L626-F631 HydrophobicContact CB-CZ 4Å; L626-F631 HydrophobicContact CD1-CZ 4.43Å; L626-C643 HydrophobicContact CD1-CB 3.76Å; L626-C643 VanDerWaalsContact CD1-SG 3.59Å
627	K	83.8	Confident	83.4	Confident	116 Å²	116	74.5 Å²	74.5	50%	0.504	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	144.8	175.6	-64.2	-172.2	179.8	-173.8	0	111.2	N615 N629 L630 F631	N615-K627 CarbonylContact O-C 3.43Å; N615-K627 VanDerWaalsContact O-CA 3.27Å; N615-K627 WeakPolarHBondContact O-CA 3.47Å; K627-N629 WeakPolarHBondContact CB-OD1 3.49Å; K627-N629 PolarHBondContact O-N 3.39Å; K627-N629 VanDerWaalsContact O-N 3.15Å; K627-L630 HydrophobicContact CB-CG 4.49Å; K627-L630 VanDerWaalsContact O-CB 3.31Å; K627-L630 WeakPolarHBondContact O-CB 3.46Å; K627-L630 PolarHBondContact O-N 2.87Å; K627-F631 WeakPolarHBondContact O-CD2 3.35Å
628	K	83.2	Confident	82.7	Confident	87 Å²	87	78.5 Å²	78.5	38%	0.378	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-53.7	-35.4	-176.8	-77.6	172.5	176.8	171.2	0	113.7	D614 N615 Q617 L630 F631	D614-K628 VanDerWaalsContact O-CE 3.24Å; D614-K628 WeakPolarHBondContact O-CE 3.26Å; D614-K628 PolarHBondContact O-NZ 3.47Å; N615-K628 PolarHBondContact O-N 2.95Å; Q617-K628 HydrophobicContact CB-CG 4.17Å; K628-L630 PolarHBondContact O-N 3.39Å; K628-F631 PolarHBondContact O-N 3.25Å; K628-F631 VanDerWaalsContact O-N 3.12Å
629	N	81.3	Confident	81.9	Confident	98 Å²	98	82.1 Å²	82.1	52%	0.524	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-69.6	-11	175.9	61.5	-10.9	0	0	0	115.1	K627 F631 K644	K627-N629 WeakPolarHBondContact CB-OD1 3.49Å; K627-N629 PolarHBondContact O-N 3.39Å; K627-N629 VanDerWaalsContact O-N 3.15Å; N629-F631 VanDerWaalsContact C-N 3.26Å; N629-K644 WeakPolarHBondContact O-CE 2.98Å; N629-K644 PolarHBondContact O-NZ 2.92Å
630	L	86.1	Confident	80.8	Confident	82 Å²	82	84.7 Å²	84.7	43%	0.429	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-83.4	2	170	-59.7	177.7	0	0	0	113.2	L626 K627 K628 K644	L626-L630 HydrophobicContact CB-CB 4.43Å; L626-L630 HydrophobicContact CB-CD1 4.16Å; L626-L630 HydrophobicContact CD2-CD1 4.1Å; K627-L630 HydrophobicContact CB-CG 4.49Å; K627-L630 VanDerWaalsContact O-CB 3.31Å; K627-L630 WeakPolarHBondContact O-CB 3.46Å; K627-L630 PolarHBondContact O-N 2.87Å; K628-L630 PolarHBondContact O-N 3.39Å; L630-K644 WeakPolarHBondContact O-CB 3.37Å; L630-K644 WeakPolarHBondContact O-CG 3.45Å; L630-K644 PolarHBondContact O-N 3.45Å
631	F	86.3	Confident	80.1	Confident	0 Å²	0	83.4 Å²	83.4	0%	0	41%	0.405	C	S	.	.	S	Bend	trans	-105.8	146.9	172.2	-61.2	-96.1	0	0	0	110.2	Q617 C619 L626 K627 K628 N629 L633 L640 F641 C643 K644	Q617-F631 HydrophobicContact CB-CD2 4.21Å; Q617-F631 HydrophobicContact CB-CE2 3.63Å; Q617-F631 HydrophobicContact CB-CZ 3.95Å; Q617-F631 HydrophobicContact CG-CE2 4.18Å; Q617-F631 HydrophobicContact CG-CZ 4.15Å; Q617-F631 WeakPolarHBondContact O-CZ 3.39Å; C619-F631 HydrophobicContact CB-CE1 3.64Å; C619-F631 HydrophobicContact CB-CZ 3.73Å; L626-F631 HydrophobicContact CB-CE2 3.72Å; L626-F631 HydrophobicContact CB-CZ 4Å; L626-F631 HydrophobicContact CD1-CZ 4.43Å; K627-F631 WeakPolarHBondContact O-CD2 3.35Å; K628-F631 PolarHBondContact O-N 3.25Å; K628-F631 VanDerWaalsContact O-N 3.12Å; N629-F631 VanDerWaalsContact C-N 3.26Å; F631-L633 PolarHBondContact O-N 2.89Å; F631-L640 WeakPolarHBondContact CD1-O 3.48Å; F631-L640 WeakPolarHBondContact CE1-O 3.39Å; F631-F641 HydrophobicContact CE1-CD1 4.11Å; F631-F641 HydrophobicContact CE1-CE1 4.4Å; F631-C643 VanDerWaalsContact CD1-CA 3.46Å; F631-C643 HydrophobicContact CD1-CB 3.61Å; F631-C643 HydrophobicContact CE1-CB 3.55Å; F631-C643 HydrophobicContact CG-CB 4.21Å; F631-C643 HydrophobicContact CZ-CB 4.05Å; F631-K644 WeakPolarHBondContact O-CE 3.28Å
632	P	78.4	Confident	80	Confident	14 Å²	14	81.3 Å²	81.3	9%	0.091	39%	0.39	C	S	.	.			trans	-77.9	115.7	-179.9	30.2	-31.6	0	0	0	110.4	S634 P642 K644	P632-S634 PolarHBondContact O-N 3.33Å; P632-P642 WeakPolarHBondContact CD-O 3.37Å; P632-K644 HydrophobicContact CB-CG 4.33Å
633	L	74.4	Confident	79.9	Confident	115 Å²	115	79.4 Å²	79.4	60%	0.602	38%	0.377	S	S	*	.			trans	-79.7	53.9	176.6	-65.9	175.1	0	0	0	111.5	F631 S635 L640 N728	F631-L633 PolarHBondContact O-N 2.89Å; L633-S635 PolarHBondContact O-N 3.05Å; L633-L640 HydrophobicContact CD2-CD2 3.7Å; L633-N728 PolarHBondContact O-ND2 2.96Å
634	S	74.6	Confident	79.8	Confident	17 Å²	17	76.8 Å²	76.8	12%	0.119	36%	0.363	C	S	.	.			trans	-63.1	133.2	178.1	156.7	0	0	0	0	110.9	P632 R636 A637 N728 D731	P632-S634 PolarHBondContact O-N 3.33Å; S634-R636 PolarHBondContact O-N 2.99Å; S634-R636 PolarHBondContact OG-N 3.07Å; S634-A637 VanDerWaalsContact O-CB 3.26Å; S634-A637 WeakPolarHBondContact O-CB 3.42Å; S634-A637 PolarHBondContact O-N 3.08Å; S634-N728 WeakPolarHBondContact CA-ND2 3.49Å; S634-N728 PolarHBondContact N-ND2 3Å; S634-D731 WeakPolarHBondContact CA-OD2 3.28Å; S634-D731 WeakPolarHBondContact CB-OD2 3.26Å; S634-D731 PolarHBondContact OG-OD1 3.37Å; S634-D731 PolarHBondContact OG-OD2 3.34Å
635	S	76	Confident	80	Confident	17 Å²	17	72.8 Å²	72.8	12%	0.119	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-13.4	-179.5	-9.1	0	0	0	0	112.6	L633 L726 I727 D731	L633-S635 PolarHBondContact O-N 3.05Å; S635-L726 PolarHBondContact OG-O 2.99Å; S635-I727 WeakPolarHBondContact OG-CG1 3.47Å; S635-D731 PolarHBondContact N-OD2 3.22Å
636	R	77.8	Confident	80.2	Confident	86 Å²	86	65.2 Å²	65.2	33%	0.325	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-8.4	176	-62.3	169.3	57.6	-137	3.3	113.3	S634 D731 F734 F813	S634-R636 PolarHBondContact O-N 2.99Å; S634-R636 PolarHBondContact OG-N 3.07Å; R636-D731 WeakPolarHBondContact CD-OD1 3.35Å; R636-F734 VanDerWaalsContact CZ-CD2 3.48Å; R636-F734 VanDerWaalsContact NH1-CB 3.3Å; R636-F734 VanDerWaalsContact NH2-CE2 3.25Å; R636-F813 HydrophobicContact CG-CD1 3.74Å; R636-F813 HydrophobicContact CG-CE1 3.56Å; R636-F813 HydrophobicContact CG-CG 4.49Å; R636-F813 HydrophobicContact CG-CZ 4.18Å
637	A	72.2	Confident	80.4	Confident	35 Å²	35	67 Å²	67	29%	0.289	34%	0.338	S	S	.	.			trans	-69.5	139.5	-173.1	0	0	0	0	0	113.1	S634 K815	S634-A637 VanDerWaalsContact O-CB 3.26Å; S634-A637 WeakPolarHBondContact O-CB 3.42Å; S634-A637 PolarHBondContact O-N 3.08Å; A637-K815 PolarHBondContact O-NZ 3.26Å
638	N	67.7	Low	80.7	Confident	135 Å²	135	64.4 Å²	64.4	72%	0.722	33%	0.325	S	S	*	.	S	Bend	trans	-97.7	-21.9	173.2	-85.5	-23.6	0	0	0	114.1	K815	N638-K815 WeakPolarHBondContact OD1-CE 3.09Å; N638-K815 PolarHBondContact OD1-NZ 3.3Å
639	K	69.7	Low	81.1	Confident	163 Å²	163	63.8 Å²	63.8	71%	0.709	33%	0.331	S	S	*	.	S	Bend	trans	-146.5	154.2	177.3	-61.1	-176.6	-179.8	-179.8	0	108.4	F641	K639-F641 HydrophobicContact CB-CD2 4Å; K639-F641 PolarHBondContact O-N 2.95Å
640	L	68.8	Low	81.5	Confident	54 Å²	54	62.8 Å²	62.8	28%	0.283	33%	0.326	S	S	.	.	S	Bend	trans	-76.4	44.7	179.2	-69.7	172.4	0	0	0	112.9	Q617 F631 L633	Q617-L640 HydrophobicContact CG-CB 4.43Å; Q617-L640 HydrophobicContact CG-CD1 4.47Å; F631-L640 WeakPolarHBondContact CD1-O 3.48Å; F631-L640 WeakPolarHBondContact CE1-O 3.39Å; L633-L640 HydrophobicContact CD2-CD2 3.7Å
641	F	71.5	Confident	81.8	Confident	75 Å²	75	59.5 Å²	59.5	33%	0.329	31%	0.309	S	S	.	.			trans	-139.9	145.3	-177	-52.4	-54.1	0	0	0	112	Q617 Y618 I620 F631 K639	Q617-F641 HydrophobicContact CG-CE1 4.08Å; Y618-F641 WeakPolarHBondContact O-CE1 3.39Å; I620-F641 HydrophobicContact CD1-CD2 3.68Å; I620-F641 HydrophobicContact CD1-CE2 3.97Å; I620-F641 HydrophobicContact CD1-CG 4Å; I620-F641 HydrophobicContact CG1-CD1 4.36Å; I620-F641 HydrophobicContact CG1-CD2 4.37Å; I620-F641 HydrophobicContact CG1-CG 4.31Å; F631-F641 HydrophobicContact CE1-CD1 4.11Å; F631-F641 HydrophobicContact CE1-CE1 4.4Å; K639-F641 HydrophobicContact CB-CD2 4Å; K639-F641 PolarHBondContact O-N 2.95Å
642	P	85.6	Confident	82	Confident	39 Å²	39	61.1 Å²	61.1	25%	0.253	32%	0.315	S	S	.	.	S	Bend	cis	-83.5	175.1	-5.7	37	-37.1	0	0	0	112.6	S621 P632 C646 R647	S621-P642 WeakPolarHBondContact OG-CB 3.33Å; P632-P642 WeakPolarHBondContact CD-O 3.37Å; P642-C646 HydrophobicContact CB-CB 3.85Å; P642-C646 HydrophobicContact CG-CB 4.5Å; P642-R647 HydrophobicContact CG-CB 4.17Å
643	C	90.6	Very high	82.5	Confident	2 Å²	2	63.5 Å²	63.5	1%	0.014	34%	0.342	C	S	.	.			trans	-69.7	161.5	176.8	78.2	0	0	0	0	112.5	C619 L626 F631 S645 C646 R647	C619-C643 HydrophobicContact CB-CB 4.08Å; C619-C643 PolarHBondContact SG-N 3.28Å; L626-C643 HydrophobicContact CD1-CB 3.76Å; L626-C643 VanDerWaalsContact CD1-SG 3.59Å; F631-C643 VanDerWaalsContact CD1-CA 3.46Å; F631-C643 HydrophobicContact CD1-CB 3.61Å; F631-C643 HydrophobicContact CE1-CB 3.55Å; F631-C643 HydrophobicContact CG-CB 4.21Å; F631-C643 HydrophobicContact CZ-CB 4.05Å; C643-S645 PolarHBondContact O-N 3.35Å; C643-S645 VanDerWaalsContact O-N 3.16Å; C643-C646 PolarHBondContact O-N 2.88Å; C643-R647 PolarHBondContact O-N 3.32Å
644	K	88.7	Confident	83.1	Confident	93 Å²	93	66.3 Å²	66.3	40%	0.404	35%	0.345	S	S	.	.	H	α-helix	trans	-51	-42.4	-177.6	-72	172.9	175.3	171.8	0	112.3	N629 L630 F631 P632 R648	N629-K644 WeakPolarHBondContact O-CE 2.98Å; N629-K644 PolarHBondContact O-NZ 2.92Å; L630-K644 WeakPolarHBondContact O-CB 3.37Å; L630-K644 WeakPolarHBondContact O-CG 3.45Å; L630-K644 PolarHBondContact O-N 3.45Å; F631-K644 WeakPolarHBondContact O-CE 3.28Å; P632-K644 HydrophobicContact CB-CG 4.33Å; K644-R648 WeakPolarHBondContact O-CB 3.37Å; K644-R648 PolarHBondContact O-N 2.7Å; K644-R648 VanDerWaalsContact O-N 3.07Å
645	S	90.4	Very high	83.8	Confident	84 Å²	84	69.6 Å²	69.6	59%	0.587	36%	0.358	S	S	*	.	H	α-helix	trans	-65.7	-47.3	177.4	-177	0	0	0	0	112.6	C643 R648 S649	C643-S645 PolarHBondContact O-N 3.35Å; C643-S645 VanDerWaalsContact O-N 3.16Å; S645-R648 PolarHBondContact O-N 2.68Å; S645-S649 PolarHBondContact O-N 3.15Å; S645-S649 PolarHBondContact O-OG 3.37Å
646	C	91.8	Very high	84.6	Confident	18 Å²	18	70 Å²	70	12%	0.122	36%	0.357	C	S	.	.	H	α-helix	trans	-64.1	-43.2	177.3	-68.9	0	0	0	0	112.2	C622 P642 C643 R648 S649 D650	C622-C646 WeakPolarHBondContact CB-SG 3.33Å; P642-C646 HydrophobicContact CB-CB 3.85Å; P642-C646 HydrophobicContact CG-CB 4.5Å; C643-C646 PolarHBondContact O-N 2.88Å; C646-R648 VanDerWaalsContact C-N 3.26Å; C646-R648 PolarHBondContact O-N 2.71Å; C646-S649 PolarHBondContact O-N 3.32Å; C646-D650 WeakPolarHBondContact O-CB 3.39Å; C646-D650 PolarHBondContact O-N 3.4Å
647	R	88.9	Confident	85.2	Confident	76 Å²	76	68.3 Å²	68.3	29%	0.287	35%	0.354	S	S	.	.	H	α-helix	trans	-59.2	-39.1	176.4	-167	-177.4	-171.1	-179.6	9.5	111.7	P642 C643 D650 N651 E730	P642-R647 HydrophobicContact CG-CB 4.17Å; C643-R647 PolarHBondContact O-N 3.32Å; R647-D650 PolarHBondContact O-N 3.35Å; R647-N651 WeakPolarHBondContact O-CB 3.36Å; R647-N651 PolarHBondContact O-N 3.02Å; R647-E730 IonicContact CZ-OE1 3.69Å; R647-E730 IonicContact NE-OE1 3.31Å; R647-E730 IonicContact NH1-OE1 3.07Å; R647-E730 PolarHBondContact NH1-OE1 3.31Å; R647-E730 IonicContact NH1-OE2 3.86Å
648	R	90.3	Very high	86.1	Confident	62 Å²	62	67.3 Å²	67.3	23%	0.234	34%	0.344	C	S	.	.	H	α-helix	trans	-69.3	-41.6	176.8	-175.2	-177.2	178.7	-133.5	1.1	112.5	V411 D415 K644 S645 C646 D650 N651 R652	V411-R648 PolarHBondContact O-NH2 3.06Å; D415-R648 VanDerWaalsContact CG-NE 3.34Å; D415-R648 IonicContact OD1-CZ 2.73Å; D415-R648 VanDerWaalsContact OD1-CZ 3.31Å; D415-R648 IonicContact OD1-NE 3.37Å; D415-R648 PolarHBondContact OD1-NE 2.71Å; D415-R648 VanDerWaalsContact OD1-NE 3.09Å; D415-R648 IonicContact OD1-NH2 2.79Å; D415-R648 PolarHBondContact OD1-NH2 2.76Å; D415-R648 IonicContact OD2-CZ 2.7Å; D415-R648 IonicContact OD2-NE 2.68Å; D415-R648 PolarHBondContact OD2-NE 2.88Å; D415-R648 IonicContact OD2-NH2 2.77Å; D415-R648 PolarHBondContact OD2-NH2 3.33Å; K644-R648 WeakPolarHBondContact O-CB 3.37Å; K644-R648 PolarHBondContact O-N 2.7Å; K644-R648 VanDerWaalsContact O-N 3.07Å; S645-R648 PolarHBondContact O-N 2.68Å; C646-R648 VanDerWaalsContact C-N 3.26Å; C646-R648 PolarHBondContact O-N 2.71Å; R648-D650 VanDerWaalsContact C-N 3.34Å; R648-N651 PolarHBondContact O-N 2.97Å; R648-R652 WeakPolarHBondContact O-CD 3.4Å; R648-R652 VanDerWaalsContact O-CG 3.31Å; R648-R652 WeakPolarHBondContact O-CG 3.38Å; R648-R652 PolarHBondContact O-N 2.7Å
649	S	91.2	Very high	87.2	Confident	74 Å²	74	62.1 Å²	62.1	52%	0.517	32%	0.316	S	S	.	.	H	α-helix	trans	-64	-39.8	173.3	-61.1	0	0	0	0	112.1	S645 C646 R652 G653	S645-S649 PolarHBondContact O-N 3.15Å; S645-S649 PolarHBondContact O-OG 3.37Å; C646-S649 PolarHBondContact O-N 3.32Å; S649-R652 PolarHBondContact O-N 3.47Å; S649-G653 PolarHBondContact O-N 3.11Å
650	D	91	Very high	88.2	Confident	77 Å²	77	56.6 Å²	56.6	41%	0.412	29%	0.293	S	S	.	.	H	α-helix	trans	-66.4	-41.3	176.2	-164.3	67.4	0	0	0	111.7	C646 R647 R648 G653 R654	C646-D650 WeakPolarHBondContact O-CB 3.39Å; C646-D650 PolarHBondContact O-N 3.4Å; R647-D650 PolarHBondContact O-N 3.35Å; R648-D650 VanDerWaalsContact C-N 3.34Å; D650-G653 PolarHBondContact O-N 3.34Å; D650-R654 VanDerWaalsContact CG-NE 3.25Å; D650-R654 WeakPolarHBondContact O-CB 3.32Å; D650-R654 WeakPolarHBondContact O-CG 3.35Å; D650-R654 PolarHBondContact O-N 2.82Å; D650-R654 IonicContact OD1-CZ 3.71Å; D650-R654 IonicContact OD1-NE 3.15Å; D650-R654 PolarHBondContact OD1-NE 3.33Å; D650-R654 IonicContact OD1-NH2 2.67Å; D650-R654 PolarHBondContact OD1-NH2 3.43Å; D650-R654 IonicContact OD2-CZ 2.65Å; D650-R654 IonicContact OD2-NE 3.21Å; D650-R654 PolarHBondContact OD2-NE 3.01Å; D650-R654 VanDerWaalsContact OD2-NE 3.15Å; D650-R654 IonicContact OD2-NH2 3.11Å
651	N	91.6	Very high	89.2	Confident	14 Å²	14	54.6 Å²	54.6	8%	0.075	28%	0.283	C	S	.	.	H	α-helix	trans	-55.7	-54.6	169.6	179.8	46.9	0	0	0	111.1	R647 R648 G653 R654 E655 R656 L657	R647-N651 WeakPolarHBondContact O-CB 3.36Å; R647-N651 PolarHBondContact O-N 3.02Å; R648-N651 PolarHBondContact O-N 2.97Å; N651-G653 PolarHBondContact O-N 2.97Å; N651-R654 PolarHBondContact O-N 2.92Å; N651-E655 PolarHBondContact O-N 3.28Å; N651-R656 WeakPolarHBondContact O-CA 3.47Å; N651-R656 PolarHBondContact O-N 3.18Å; N651-L657 PolarHBondContact ND2-O 2.91Å; N651-L657 PolarHBondContact OD1-N 3.49Å; N651-L657 VanDerWaalsContact OD1-N 3.15Å
652	R	90.8	Very high	90.3	Very high	33 Å²	33	52.1 Å²	52.1	13%	0.125	27%	0.272	C	S	.	.	H	α-helix	trans	-58	-30.9	178.2	-72.4	163.9	160.8	-130.5	-11.6	113.9	F414 D415 Y418 R648 S649 R656	F414-R652 VanDerWaalsContact CB-NH2 3.26Å; D415-R652 IonicContact OD1-CZ 3.6Å; D415-R652 IonicContact OD1-NE 3.63Å; D415-R652 PolarHBondContact OD1-NE 3.19Å; D415-R652 IonicContact OD1-NH2 2.89Å; D415-R652 PolarHBondContact OD1-NH2 3.32Å; Y418-R652 HydrophobicContact CD2-CG 3.96Å; Y418-R652 HydrophobicContact CE2-CG 4.36Å; Y418-R652 VanDerWaalsContact CE2-CZ 3.48Å; Y418-R652 HydrophobicContact CG-CG 4.33Å; R648-R652 WeakPolarHBondContact O-CD 3.4Å; R648-R652 VanDerWaalsContact O-CG 3.31Å; R648-R652 WeakPolarHBondContact O-CG 3.38Å; R648-R652 PolarHBondContact O-N 2.7Å; S649-R652 PolarHBondContact O-N 3.47Å; R652-R656 WeakPolarHBondContact O-CG 3.49Å; R652-R656 PolarHBondContact O-NE 2.69Å
653	G	88.4	Confident	90.5	Very high	64 Å²	64	53.3 Å²	53.3	66%	0.66	27%	0.274	S	S	*	.	H	α-helix	trans	-83.1	-14.6	176.8	0	0	0	0	0	115.2	S649 D650 N651	S649-G653 PolarHBondContact O-N 3.11Å; D650-G653 PolarHBondContact O-N 3.34Å; N651-G653 PolarHBondContact O-N 2.97Å
654	R	88.4	Confident	90.5	Very high	174 Å²	174	56.9 Å²	56.9	66%	0.657	29%	0.288	S	S	*	.	H	α-helix	trans	-129.5	-68.1	-173.1	-58.8	-175.2	-155.6	-131.5	6.6	114.6	D650 N651	D650-R654 VanDerWaalsContact CG-NE 3.25Å; D650-R654 WeakPolarHBondContact O-CB 3.32Å; D650-R654 WeakPolarHBondContact O-CG 3.35Å; D650-R654 PolarHBondContact O-N 2.82Å; D650-R654 IonicContact OD1-CZ 3.71Å; D650-R654 IonicContact OD1-NE 3.15Å; D650-R654 PolarHBondContact OD1-NE 3.33Å; D650-R654 IonicContact OD1-NH2 2.67Å; D650-R654 PolarHBondContact OD1-NH2 3.43Å; D650-R654 IonicContact OD2-CZ 2.65Å; D650-R654 IonicContact OD2-NE 3.21Å; D650-R654 PolarHBondContact OD2-NE 3.01Å; D650-R654 VanDerWaalsContact OD2-NE 3.15Å; D650-R654 IonicContact OD2-NH2 3.11Å; N651-R654 PolarHBondContact O-N 2.92Å
655	E	88.3	Confident	90.8	Very high	87 Å²	87	52.5 Å²	52.5	41%	0.407	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-28.2	-170.5	-45.1	-175.6	134.1	0	0	112.3	N651 L657 R733	N651-E655 PolarHBondContact O-N 3.28Å; E655-L657 HydrophobicContact CB-CD1 3.85Å; E655-L657 HydrophobicContact CB-CG 3.85Å; E655-L657 PolarHBondContact O-N 2.98Å; E655-L657 VanDerWaalsContact O-N 3.07Å; E655-R733 VanDerWaalsContact CD-NH2 3.33Å; E655-R733 IonicContact OE1-NH2 3.59Å; E655-R733 PolarHBondContact OE1-NH2 3.48Å; E655-R733 VanDerWaalsContact OE1-NH2 3.15Å; E655-R733 IonicContact OE2-CZ 3.53Å; E655-R733 VanDerWaalsContact OE2-CZ 3.25Å; E655-R733 IonicContact OE2-NH1 3.58Å; E655-R733 PolarHBondContact OE2-NH1 3.35Å; E655-R733 IonicContact OE2-NH2 2.73Å; E655-R733 PolarHBondContact OE2-NH2 2.85Å
656	R	93.3	Very high	90.9	Very high	26 Å²	26	48.6 Å²	48.6	10%	0.098	24%	0.241	C	C	.	.			trans	51.6	20	-174.3	-68.6	-173.9	-170.9	159.5	13.5	115.9	N419 E422 E453 N651 R652	N419-R656 WeakPolarHBondContact CA-O 3.47Å; N419-R656 VanDerWaalsContact CB-O 3.31Å; N419-R656 WeakPolarHBondContact CB-O 3.39Å; N419-R656 PolarHBondContact N-O 3.39Å; E422-R656 HydrophobicContact CB-CB 3.71Å; E422-R656 HydrophobicContact CB-CG 4.48Å; E422-R656 HydrophobicContact CG-CB 3.94Å; E422-R656 IonicContact OE2-NH1 3.16Å; E453-R656 IonicContact OE1-CZ 3.86Å; E453-R656 IonicContact OE1-NH1 2.7Å; E453-R656 PolarHBondContact OE1-NH1 2.67Å; E453-R656 IonicContact OE1-NH2 3.1Å; E453-R656 PolarHBondContact OE1-NH2 3.21Å; N651-R656 WeakPolarHBondContact O-CA 3.47Å; N651-R656 PolarHBondContact O-N 3.18Å; R652-R656 WeakPolarHBondContact O-CG 3.49Å; R652-R656 PolarHBondContact O-NE 2.69Å
657	L	90.8	Very high	90.9	Very high	50 Å²	50	50.3 Å²	50.3	26%	0.262	25%	0.251	S	S	.	.			trans	-69.2	134.7	-172.5	-67.5	170.1	0	0	0	111.9	N419 N651 E655	N419-L657 WeakPolarHBondContact OD1-CA 3.28Å; N651-L657 PolarHBondContact ND2-O 2.91Å; N651-L657 PolarHBondContact OD1-N 3.49Å; N651-L657 VanDerWaalsContact OD1-N 3.15Å; E655-L657 HydrophobicContact CB-CD1 3.85Å; E655-L657 HydrophobicContact CB-CG 3.85Å; E655-L657 PolarHBondContact O-N 2.98Å; E655-L657 VanDerWaalsContact O-N 3.07Å
658	D	90.7	Very high	91	Very high	14 Å²	14	48.1 Å²	48.1	8%	0.075	24%	0.244	C	C	.	.			trans	-69.3	136	164.6	-168.4	1.2	0	0	0	109.6	R416 N419 E660	R416-D658 IonicContact NH1-OD2 3.94Å; N419-D658 HydrophobicContact CB-CB 3.91Å; N419-D658 PolarHBondContact OD1-N 2.88Å; D658-E660 VanDerWaalsContact OD1-CB 3.27Å; D658-E660 WeakPolarHBondContact OD1-CB 3.4Å; D658-E660 PolarHBondContact OD1-N 2.8Å
659	L	90.6	Very high	91.1	Very high	26 Å²	26	45.4 Å²	45.4	14%	0.136	23%	0.234	C	C	.	.			trans	-109.2	-1.9	178	-66.7	173.9	0	0	0	112.2	Q663 K729 E730	L659-Q663 PolarHBondContact O-N 2.93Å; L659-K729 HydrophobicContact CB-CD 3.89Å; L659-K729 HydrophobicContact CB-CG 4.28Å; L659-E730 HydrophobicContact CD1-CG 3.79Å; L659-E730 HydrophobicContact CD2-CG 4.14Å
660	E	90	Very high	91.2	Very high	47 Å²	47	45 Å²	45	22%	0.22	22%	0.221	C	C	.	.	H	α-helix	trans	-66.7	-44.3	-179.6	-179.9	176.4	-109.9	0	0	114.2	R404 A412 R416 D658 Y662 Q663 Y664	R404-E660 IonicContact CZ-OE1 2.74Å; R404-E660 VanDerWaalsContact CZ-OE1 3.28Å; R404-E660 IonicContact CZ-OE2 2.68Å; R404-E660 VanDerWaalsContact CZ-OE2 3.31Å; R404-E660 VanDerWaalsContact NH1-CD 3.3Å; R404-E660 IonicContact NH1-OE1 3.73Å; R404-E660 PolarHBondContact NH1-OE1 2.98Å; R404-E660 IonicContact NH1-OE2 3.68Å; R404-E660 PolarHBondContact NH1-OE2 3.39Å; R404-E660 IonicContact NH2-OE1 3.5Å; R404-E660 PolarHBondContact NH2-OE1 3.32Å; R404-E660 IonicContact NH2-OE2 2.62Å; R404-E660 PolarHBondContact NH2-OE2 3.13Å; A412-E660 HydrophobicContact CB-CB 4.46Å; A412-E660 WeakPolarHBondContact CB-OE1 3.29Å; R416-E660 IonicContact CZ-OE2 3.21Å; R416-E660 IonicContact NH1-OE2 3.89Å; R416-E660 PolarHBondContact NH1-OE2 2.99Å; D658-E660 VanDerWaalsContact OD1-CB 3.27Å; D658-E660 WeakPolarHBondContact OD1-CB 3.4Å; D658-E660 PolarHBondContact OD1-N 2.8Å; E660-Y662 VanDerWaalsContact C-N 3.31Å; E660-Y662 PolarHBondContact O-N 2.92Å; E660-Q663 CarbonylContact O-C 3.57Å; E660-Q663 WeakPolarHBondContact O-CA 3.42Å; E660-Q663 WeakPolarHBondContact O-CB 3.42Å; E660-Q663 PolarHBondContact O-N 2.86Å; E660-Y664 PolarHBondContact O-N 3.41Å
661	P	90.8	Very high	91.1	Very high	11 Å²	11	45.3 Å²	45.3	7%	0.071	22%	0.221	C	C	.	.	H	α-helix	trans	-59	-43.1	179.1	-24.7	35.1	0	0	0	111.9	Q663 Y664 I665 L752 F753	P661-Q663 VanDerWaalsContact C-N 3.26Å; P661-Q663 PolarHBondContact O-N 3.27Å; P661-Y664 WeakPolarHBondContact O-CB 3.33Å; P661-Y664 PolarHBondContact O-N 3.45Å; P661-Y664 VanDerWaalsContact O-N 3.07Å; P661-I665 WeakPolarHBondContact O-CG1 3.22Å; P661-I665 PolarHBondContact O-N 3.37Å; P661-L752 HydrophobicContact CB-CD2 3.55Å; P661-L752 HydrophobicContact CB-CG 3.83Å; P661-L752 HydrophobicContact CG-CD2 4.17Å; P661-F753 HydrophobicContact CB-CE1 4.08Å; P661-F753 HydrophobicContact CB-CZ 4.38Å; P661-F753 HydrophobicContact CG-CE1 3.93Å; P661-F753 HydrophobicContact CG-CZ 3.87Å
662	Y	93.6	Very high	91	Very high	23 Å²	23	47.7 Å²	47.7	9%	0.09	23%	0.233	C	C	.	.	H	α-helix	trans	-66.4	-25.3	174.8	-49	-75.6	0	0	0	113.4	E660 L666 K729 I732 R733 I736 D737 L752	E660-Y662 VanDerWaalsContact C-N 3.31Å; E660-Y662 PolarHBondContact O-N 2.92Å; Y662-L666 WeakPolarHBondContact O-CB 3.4Å; Y662-L666 PolarHBondContact O-N 3.33Å; Y662-L666 VanDerWaalsContact O-N 3.12Å; Y662-K729 WeakPolarHBondContact CB-O 3.37Å; Y662-I732 HydrophobicContact CD1-CG2 4.49Å; Y662-R733 VanDerWaalsContact CD1-CA 3.43Å; Y662-R733 HydrophobicContact CD1-CB 3.89Å; Y662-R733 HydrophobicContact CD1-CG 4.37Å; Y662-R733 HydrophobicContact CD2-CB 3.87Å; Y662-R733 HydrophobicContact CD2-CG 4.05Å; Y662-R733 HydrophobicContact CE1-CB 4.14Å; Y662-R733 HydrophobicContact CE1-CG 4.13Å; Y662-R733 HydrophobicContact CE2-CB 4.14Å; Y662-R733 HydrophobicContact CE2-CG 3.81Å; Y662-R733 HydrophobicContact CG-CB 3.73Å; Y662-R733 HydrophobicContact CG-CG 4.32Å; Y662-I736 HydrophobicContact CD1-CD1 4.21Å; Y662-I736 HydrophobicContact CE1-CB 4.3Å; Y662-I736 HydrophobicContact CE1-CG2 4.28Å; Y662-D737 PolarHBondContact OH-OD1 3.4Å; Y662-D737 VanDerWaalsContact OH-OD1 3.09Å; Y662-D737 PolarHBondContact OH-OD2 2.96Å; Y662-L752 HydrophobicContact CD1-CD1 4.21Å; Y662-L752 HydrophobicContact CD1-CD2 4.36Å; Y662-L752 HydrophobicContact CE1-CD1 3.74Å; Y662-L752 HydrophobicContact CE1-CD2 3.67Å; Y662-L752 HydrophobicContact CE1-CG 4.32Å; Y662-L752 HydrophobicContact CE2-CD2 4.03Å; Y662-L752 VanDerWaalsContact CZ-CD2 3.47Å; Y662-L752 WeakPolarHBondContact OH-CD2 3.36Å
663	Q	91.3	Very high	90.9	Very high	64 Å²	64	46.7 Å²	46.7	30%	0.299	23%	0.23	S	C	.	.	H	α-helix	trans	-75.2	-35	170.5	-177.5	57.5	71	0	0	111.8	L659 E660 P661 L666 T667 K729	L659-Q663 PolarHBondContact O-N 2.93Å; E660-Q663 CarbonylContact O-C 3.57Å; E660-Q663 WeakPolarHBondContact O-CA 3.42Å; E660-Q663 WeakPolarHBondContact O-CB 3.42Å; E660-Q663 PolarHBondContact O-N 2.86Å; P661-Q663 VanDerWaalsContact C-N 3.26Å; P661-Q663 PolarHBondContact O-N 3.27Å; Q663-L666 PolarHBondContact O-N 3.44Å; Q663-T667 PolarHBondContact NE2-OG1 2.78Å; Q663-T667 PolarHBondContact O-N 3.03Å; Q663-T667 PolarHBondContact O-OG1 2.88Å; Q663-K729 HydrophobicContact CB-CB 4Å; Q663-K729 HydrophobicContact CB-CD 3.85Å; Q663-K729 HydrophobicContact CG-CD 4.36Å
664	Y	90.7	Very high	90.7	Very high	77 Å²	77	46.6 Å²	46.6	30%	0.302	22%	0.217	S	C	.	.	H	α-helix	trans	-65.2	-48.2	174.1	-178.4	-121.2	0	0	0	110.9	R397 E660 P661 L666 T667 E668 R776	R397-Y664 PolarHBondContact NH2-OH 2.89Å; R397-Y664 VanDerWaalsContact NH2-OH 3.07Å; E660-Y664 PolarHBondContact O-N 3.41Å; P661-Y664 WeakPolarHBondContact O-CB 3.33Å; P661-Y664 PolarHBondContact O-N 3.45Å; P661-Y664 VanDerWaalsContact O-N 3.07Å; Y664-L666 VanDerWaalsContact C-N 3.3Å; Y664-L666 PolarHBondContact O-N 2.84Å; Y664-T667 WeakPolarHBondContact O-CA 3.46Å; Y664-T667 WeakPolarHBondContact O-CB 3.49Å; Y664-T667 PolarHBondContact O-N 3.11Å; Y664-E668 HydrophobicContact CD2-CG 4.44Å; Y664-E668 HydrophobicContact CE1-CG 4.44Å; Y664-E668 HydrophobicContact CE2-CG 4.01Å; Y664-E668 VanDerWaalsContact CZ-CD 3.49Å; Y664-E668 PolarHBondContact O-N 3.48Å; Y664-E668 PolarHBondContact OH-OE1 2.95Å; Y664-R776 PolarHBondContact OH-NH2 2.84Å
665	I	93.6	Very high	90.7	Very high	2 Å²	2	45 Å²	45	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-60.1	-39.2	175.5	-59.3	169.5	0	0	0	111.4	P661 T667 E668 L669 I732 I736 L752 L755 L757	P661-I665 WeakPolarHBondContact O-CG1 3.22Å; P661-I665 PolarHBondContact O-N 3.37Å; I665-T667 VanDerWaalsContact C-N 3.32Å; I665-T667 PolarHBondContact O-N 2.96Å; I665-E668 PolarHBondContact O-N 3.28Å; I665-L669 VanDerWaalsContact O-CB 3.23Å; I665-L669 WeakPolarHBondContact O-CB 3.33Å; I665-L669 PolarHBondContact O-N 3.19Å; I665-I732 HydrophobicContact CB-CG2 4.46Å; I665-I732 HydrophobicContact CG2-CG2 4.38Å; I665-I736 HydrophobicContact CD1-CD1 3.47Å; I665-I736 VanDerWaalsContact CD1-CD1 3.47Å; I665-I736 HydrophobicContact CG2-CD1 4.15Å; I665-L752 HydrophobicContact CD1-CD1 3.66Å; I665-L752 HydrophobicContact CD1-CG 4.27Å; I665-L755 WeakPolarHBondContact CG1-O 3.22Å; I665-L757 HydrophobicContact CG2-CD1 4.1Å; I665-L757 HydrophobicContact CG2-CG 3.83Å
666	L	93.2	Very high	90.4	Very high	2 Å²	2	42 Å²	42	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-62.5	-37.7	173.5	-178	54.5	0	0	0	112.7	Y662 Q663 Y664 L669 R670 I727 I732	Y662-L666 WeakPolarHBondContact O-CB 3.4Å; Y662-L666 PolarHBondContact O-N 3.33Å; Y662-L666 VanDerWaalsContact O-N 3.12Å; Q663-L666 PolarHBondContact O-N 3.44Å; Y664-L666 VanDerWaalsContact C-N 3.3Å; Y664-L666 PolarHBondContact O-N 2.84Å; L666-L669 HydrophobicContact CD1-CD2 4.49Å; L666-R670 WeakPolarHBondContact O-CD 3.39Å; L666-R670 VanDerWaalsContact O-CG 3.27Å; L666-R670 WeakPolarHBondContact O-CG 3.5Å; L666-R670 PolarHBondContact O-N 3.44Å; L666-R670 VanDerWaalsContact O-N 3.16Å; L666-I727 HydrophobicContact CD1-CG2 4.22Å; L666-I732 HydrophobicContact CB-CG1 4.03Å; L666-I732 HydrophobicContact CD1-CD1 4.18Å; L666-I732 HydrophobicContact CD1-CG1 3.91Å; L666-I732 HydrophobicContact CD2-CG1 4.42Å; L666-I732 HydrophobicContact CG-CG1 4.34Å
667	T	92.4	Very high	89.8	Confident	54 Å²	54	41.3 Å²	41.3	33%	0.331	20%	0.196	S	C	.	.	H	α-helix	trans	-70.7	-43.9	177.6	-60.2	0	0	0	0	111.1	Q663 Y664 I665 R670 Q671	Q663-T667 PolarHBondContact NE2-OG1 2.78Å; Q663-T667 PolarHBondContact O-N 3.03Å; Q663-T667 PolarHBondContact O-OG1 2.88Å; Y664-T667 WeakPolarHBondContact O-CA 3.46Å; Y664-T667 WeakPolarHBondContact O-CB 3.49Å; Y664-T667 PolarHBondContact O-N 3.11Å; I665-T667 VanDerWaalsContact C-N 3.32Å; I665-T667 PolarHBondContact O-N 2.96Å; T667-R670 PolarHBondContact O-N 3.18Å; T667-Q671 WeakPolarHBondContact O-CG 3.38Å; T667-Q671 PolarHBondContact O-N 3.09Å
668	E	90.9	Very high	89.4	Confident	30 Å²	30	43 Å²	43	14%	0.14	20%	0.203	C	C	.	.	H	α-helix	trans	-67.4	-40.4	176.6	-66.6	-156.4	144.4	0	0	112.4	Y664 I665 R670 Q671 N672 R776	Y664-E668 HydrophobicContact CD2-CG 4.44Å; Y664-E668 HydrophobicContact CE1-CG 4.44Å; Y664-E668 HydrophobicContact CE2-CG 4.01Å; Y664-E668 VanDerWaalsContact CZ-CD 3.49Å; Y664-E668 PolarHBondContact O-N 3.48Å; Y664-E668 PolarHBondContact OH-OE1 2.95Å; I665-E668 PolarHBondContact O-N 3.28Å; E668-R670 VanDerWaalsContact C-N 3.31Å; E668-R670 PolarHBondContact O-N 2.68Å; E668-Q671 PolarHBondContact O-N 3.06Å; E668-N672 WeakPolarHBondContact O-CB 3.49Å; E668-N672 VanDerWaalsContact O-CG 3.27Å; E668-N672 PolarHBondContact O-N 3.49Å; E668-R776 IonicContact OE1-CZ 2.84Å; E668-R776 IonicContact OE1-NH2 3.77Å; E668-R776 PolarHBondContact OE1-NH2 2.75Å; E668-R776 IonicContact OE2-CZ 3.67Å; E668-R776 IonicContact OE2-NE 3.48Å; E668-R776 IonicContact OE2-NH2 3.35Å; E668-R776 PolarHBondContact OE2-NH2 2.68Å
669	L	92.2	Very high	89	Confident	5 Å²	5	47.5 Å²	47.5	3%	0.026	22%	0.222	C	C	.	.	H	α-helix	trans	-53.5	-48	170.9	167.5	62.4	0	0	0	111.5	I665 L666 Q671 N672 E673 P724 I732 L757 W766	I665-L669 VanDerWaalsContact O-CB 3.23Å; I665-L669 WeakPolarHBondContact O-CB 3.33Å; I665-L669 PolarHBondContact O-N 3.19Å; L666-L669 HydrophobicContact CD1-CD2 4.49Å; L669-Q671 PolarHBondContact O-N 3.26Å; L669-N672 PolarHBondContact O-N 2.96Å; L669-E673 WeakPolarHBondContact O-CB 3.46Å; L669-E673 PolarHBondContact O-N 3.42Å; L669-P724 HydrophobicContact CD2-CB 4.45Å; L669-P724 HydrophobicContact CG-CB 4.42Å; L669-I732 HydrophobicContact CD2-CD1 4.36Å; L669-L757 HydrophobicContact CD1-CB 4.21Å; L669-L757 HydrophobicContact CD2-CB 4.43Å; L669-L757 HydrophobicContact CD2-CD1 4.11Å; L669-W766 HydrophobicContact CD1-CD2 3.7Å; L669-W766 HydrophobicContact CD1-CE3 4.45Å; L669-W766 HydrophobicContact CD1-CG 3.74Å; L669-W766 HydrophobicContact CD1-CZ2 4.3Å; L669-W766 HydrophobicContact CD2-CD2 4.01Å; L669-W766 HydrophobicContact CD2-CE3 4.18Å; L669-W766 HydrophobicContact CD2-CH2 3.61Å; L669-W766 HydrophobicContact CD2-CZ2 3.41Å; L669-W766 VanDerWaalsContact CD2-CZ2 3.41Å; L669-W766 HydrophobicContact CD2-CZ3 4Å; L669-W766 HydrophobicContact CG-CD2 4.39Å; L669-W766 HydrophobicContact CG-CZ2 4.5Å
670	R	91.8	Very high	88.5	Confident	64 Å²	64	50.3 Å²	50.3	24%	0.242	24%	0.236	C	C	.	.	H	α-helix	trans	-62.9	-42.4	178.7	-74.4	167.9	-178.9	-171.1	0.1	111.9	L666 T667 E668 T674 P724 F725 I727	L666-R670 WeakPolarHBondContact O-CD 3.39Å; L666-R670 VanDerWaalsContact O-CG 3.27Å; L666-R670 WeakPolarHBondContact O-CG 3.5Å; L666-R670 PolarHBondContact O-N 3.44Å; L666-R670 VanDerWaalsContact O-N 3.16Å; T667-R670 PolarHBondContact O-N 3.18Å; E668-R670 VanDerWaalsContact C-N 3.31Å; E668-R670 PolarHBondContact O-N 2.68Å; R670-T674 WeakPolarHBondContact O-CG2 3.39Å; R670-T674 PolarHBondContact O-N 2.62Å; R670-T674 PolarHBondContact O-OG1 3.17Å; R670-T674 VanDerWaalsContact O-OG1 3.13Å; R670-P724 HydrophobicContact CG-CB 3.77Å; R670-P724 VanDerWaalsContact CZ-O 3.31Å; R670-P724 PolarHBondContact NE-O 2.99Å; R670-P724 PolarHBondContact NH2-O 3.17Å; R670-F725 HydrophobicContact CG-CE1 4.24Å; R670-F725 HydrophobicContact CG-CZ 4.4Å; R670-I727 PolarHBondContact NH2-O 2.8Å
671	Q	90.4	Very high	87.8	Confident	85 Å²	85	51.3 Å²	51.3	40%	0.397	24%	0.239	S	C	.	.	H	α-helix	trans	-67.8	-39.4	177.8	-71.1	178.6	11.8	0	0	112.9	T667 E668 L669 T674 R675	T667-Q671 WeakPolarHBondContact O-CG 3.38Å; T667-Q671 PolarHBondContact O-N 3.09Å; E668-Q671 PolarHBondContact O-N 3.06Å; L669-Q671 PolarHBondContact O-N 3.26Å; Q671-T674 WeakPolarHBondContact CA-OG1 3.24Å; Q671-T674 PolarHBondContact O-N 2.84Å; Q671-T674 PolarHBondContact O-OG1 3.25Å; Q671-R675 WeakPolarHBondContact O-CB 3.41Å; Q671-R675 VanDerWaalsContact O-CG 3.23Å; Q671-R675 WeakPolarHBondContact O-CG 3.39Å; Q671-R675 PolarHBondContact O-N 2.9Å
672	N	89.1	Confident	87.4	Confident	63 Å²	63	57.4 Å²	57.4	34%	0.337	26%	0.261	S	S	.	.	H	α-helix	trans	-71.1	-41.2	179.1	-70.6	-7.9	0	0	0	111	E668 L669 T674 R675 L676	E668-N672 WeakPolarHBondContact O-CB 3.49Å; E668-N672 VanDerWaalsContact O-CG 3.27Å; E668-N672 PolarHBondContact O-N 3.49Å; L669-N672 PolarHBondContact O-N 2.96Å; N672-T674 PolarHBondContact O-N 2.98Å; N672-R675 PolarHBondContact O-N 3.25Å; N672-R675 PolarHBondContact OD1-NH1 2.86Å; N672-L676 VanDerWaalsContact O-CB 3.29Å; N672-L676 WeakPolarHBondContact O-CB 3.34Å; N672-L676 PolarHBondContact O-N 3Å
673	E	87.7	Confident	86.8	Confident	12 Å²	12	59.5 Å²	59.5	6%	0.056	28%	0.276	C	S	.	.	H	α-helix	trans	-62.8	-40.9	173.4	-173.3	75.7	162.6	0	0	111.5	L669 L676 V677 N721 P724 R759 W766	L669-E673 WeakPolarHBondContact O-CB 3.46Å; L669-E673 PolarHBondContact O-N 3.42Å; E673-L676 PolarHBondContact O-N 3.26Å; E673-V677 WeakPolarHBondContact O-CB 3.5Å; E673-V677 VanDerWaalsContact O-CG2 3.25Å; E673-V677 WeakPolarHBondContact O-CG2 3.47Å; E673-V677 PolarHBondContact O-N 3.43Å; E673-N721 HydrophobicContact CG-CB 4.25Å; E673-N721 VanDerWaalsContact OE1-CB 3.27Å; E673-N721 WeakPolarHBondContact OE1-CB 3.49Å; E673-N721 PolarHBondContact OE1-ND2 3.34Å; E673-P724 HydrophobicContact CB-CG 4.4Å; E673-P724 HydrophobicContact CG-CG 4.14Å; E673-R759 IonicContact OE1-CZ 2.95Å; E673-R759 IonicContact OE1-NE 2.73Å; E673-R759 IonicContact OE1-NH2 3.89Å; E673-R759 PolarHBondContact OE1-NH2 2.86Å; E673-R759 IonicContact OE2-CZ 2.55Å; E673-R759 IonicContact OE2-NE 3.94Å; E673-R759 PolarHBondContact OE2-NE 3.37Å; E673-R759 IonicContact OE2-NH2 2.89Å; E673-R759 PolarHBondContact OE2-NH2 3.34Å; E673-W766 PolarHBondContact OE1-N 3.44Å
674	T	85.5	Confident	86.3	Confident	63 Å²	63	58.6 Å²	58.6	39%	0.387	28%	0.279	S	S	.	.	H	α-helix	trans	-64.7	-43.9	174.5	49.1	0	0	0	0	112.3	R670 Q671 N672 L676 V677 E678	R670-T674 WeakPolarHBondContact O-CG2 3.39Å; R670-T674 PolarHBondContact O-N 2.62Å; R670-T674 PolarHBondContact O-OG1 3.17Å; R670-T674 VanDerWaalsContact O-OG1 3.13Å; Q671-T674 WeakPolarHBondContact CA-OG1 3.24Å; Q671-T674 PolarHBondContact O-N 2.84Å; Q671-T674 PolarHBondContact O-OG1 3.25Å; N672-T674 PolarHBondContact O-N 2.98Å; T674-L676 VanDerWaalsContact C-N 3.34Å; T674-L676 PolarHBondContact O-N 3.02Å; T674-V677 PolarHBondContact O-N 3.08Å; T674-E678 WeakPolarHBondContact O-CB 3.47Å; T674-E678 WeakPolarHBondContact O-CG 3.28Å; T674-E678 PolarHBondContact O-N 2.81Å
675	R	87.4	Confident	85.8	Confident	141 Å²	141	56.8 Å²	56.8	53%	0.532	27%	0.274	S	S	.	.	H	α-helix	trans	-59.9	-42.8	175.5	-73.8	166.8	-176.6	151.2	0.8	112.2	Q671 N672 E678 K679	Q671-R675 WeakPolarHBondContact O-CB 3.41Å; Q671-R675 VanDerWaalsContact O-CG 3.23Å; Q671-R675 WeakPolarHBondContact O-CG 3.39Å; Q671-R675 PolarHBondContact O-N 2.9Å; N672-R675 PolarHBondContact O-N 3.25Å; N672-R675 PolarHBondContact OD1-NH1 2.86Å; R675-E678 PolarHBondContact O-N 3.1Å; R675-K679 WeakPolarHBondContact O-CB 3.43Å; R675-K679 PolarHBondContact O-N 3.34Å
676	L	83.1	Confident	85.3	Confident	22 Å²	22	61.6 Å²	61.6	12%	0.115	30%	0.297	C	S	.	.	H	α-helix	trans	-71.9	-38.1	-178.5	-171.4	131.4	0	0	0	111.3	N672 E673 T674 K679 I680 I762 E783	N672-L676 VanDerWaalsContact O-CB 3.29Å; N672-L676 WeakPolarHBondContact O-CB 3.34Å; N672-L676 PolarHBondContact O-N 3Å; E673-L676 PolarHBondContact O-N 3.26Å; T674-L676 VanDerWaalsContact C-N 3.34Å; T674-L676 PolarHBondContact O-N 3.02Å; L676-K679 PolarHBondContact O-N 3.17Å; L676-I680 HydrophobicContact CD2-CD1 3.65Å; L676-I680 HydrophobicContact CG-CD1 4.32Å; L676-I680 WeakPolarHBondContact O-CB 3.2Å; L676-I680 VanDerWaalsContact O-CG1 3.26Å; L676-I680 WeakPolarHBondContact O-CG1 3.49Å; L676-I680 PolarHBondContact O-N 2.95Å; L676-I762 HydrophobicContact CD1-CG2 4.42Å; L676-E783 HydrophobicContact CD1-CG 4.21Å
677	V	79.6	Confident	84.8	Confident	13 Å²	13	65.4 Å²	65.4	8%	0.079	32%	0.317	C	S	.	.	H	α-helix	trans	-62.7	-42.8	169.8	167	0	0	0	0	111.6	E673 T674 I680 K681 C719	E673-V677 WeakPolarHBondContact O-CB 3.5Å; E673-V677 VanDerWaalsContact O-CG2 3.25Å; E673-V677 WeakPolarHBondContact O-CG2 3.47Å; E673-V677 PolarHBondContact O-N 3.43Å; T674-V677 PolarHBondContact O-N 3.08Å; V677-I680 PolarHBondContact O-N 3.3Å; V677-K681 HydrophobicContact CG1-CD 4.34Å; V677-K681 WeakPolarHBondContact O-CG 3.31Å; V677-K681 PolarHBondContact O-N 3.43Å; V677-C719 WeakPolarHBondContact CG1-O 3.41Å; V677-C719 WeakPolarHBondContact CG2-O 3.25Å
678	E	82.1	Confident	84.3	Confident	85 Å²	85	63.2 Å²	63.2	40%	0.397	30%	0.304	S	S	.	.	H	α-helix	trans	-62.1	-43	173.4	-77	174.4	-138.7	0	0	112.5	T674 R675 K681 R682	T674-E678 WeakPolarHBondContact O-CB 3.47Å; T674-E678 WeakPolarHBondContact O-CG 3.28Å; T674-E678 PolarHBondContact O-N 2.81Å; R675-E678 PolarHBondContact O-N 3.1Å; E678-K681 PolarHBondContact O-N 3.42Å; E678-R682 WeakPolarHBondContact O-CG 3.33Å; E678-R682 PolarHBondContact O-N 3.02Å; E678-R682 IonicContact OE2-NH2 2.65Å; E678-R682 PolarHBondContact OE2-NH2 3.32Å
679	K	84	Confident	83.9	Confident	109 Å²	109	67.8 Å²	67.8	47%	0.474	32%	0.32	S	S	.	.	H	α-helix	trans	-61	-45.5	176.8	-177.6	177.8	175.5	-179.4	0	111.2	R675 L676 R682 V683 E783	R675-K679 WeakPolarHBondContact O-CB 3.43Å; R675-K679 PolarHBondContact O-N 3.34Å; L676-K679 PolarHBondContact O-N 3.17Å; K679-R682 PolarHBondContact O-N 3.12Å; K679-V683 WeakPolarHBondContact O-CG2 3.33Å; K679-V683 PolarHBondContact O-N 3.37Å; K679-V683 VanDerWaalsContact O-N 3.08Å; K679-E783 IonicContact NZ-OE1 2.68Å; K679-E783 PolarHBondContact NZ-OE1 2.71Å
680	I	78.9	Confident	83.6	Confident	85 Å²	85	73 Å²	73	44%	0.436	35%	0.345	S	S	.	.	H	α-helix	trans	-61.6	-43.3	174.9	-69.6	166	0	0	0	111.1	L676 V677 R682 V683 A684	L676-I680 HydrophobicContact CD2-CD1 3.65Å; L676-I680 HydrophobicContact CG-CD1 4.32Å; L676-I680 WeakPolarHBondContact O-CB 3.2Å; L676-I680 VanDerWaalsContact O-CG1 3.26Å; L676-I680 WeakPolarHBondContact O-CG1 3.49Å; L676-I680 PolarHBondContact O-N 2.95Å; V677-I680 PolarHBondContact O-N 3.3Å; I680-R682 PolarHBondContact O-N 2.86Å; I680-V683 PolarHBondContact O-N 3.06Å; I680-A684 WeakPolarHBondContact O-CB 3.46Å; I680-A684 PolarHBondContact O-N 3.3Å
681	K	76.4	Confident	83.2	Confident	67 Å²	67	74.9 Å²	74.9	29%	0.291	36%	0.356	S	S	.	.	H	α-helix	trans	-59.9	-43.9	175	-74.8	168.8	178.7	-101.4	0	112.4	V677 E678 A684 I685 T717	V677-K681 HydrophobicContact CG1-CD 4.34Å; V677-K681 WeakPolarHBondContact O-CG 3.31Å; V677-K681 PolarHBondContact O-N 3.43Å; E678-K681 PolarHBondContact O-N 3.42Å; K681-A684 PolarHBondContact O-N 2.72Å; K681-I685 WeakPolarHBondContact O-CD1 3.36Å; K681-I685 VanDerWaalsContact O-CG1 3.28Å; K681-I685 WeakPolarHBondContact O-CG1 3.5Å; K681-I685 PolarHBondContact O-N 2.98Å; K681-T717 WeakPolarHBondContact CE-O 2.99Å; K681-T717 PolarHBondContact NZ-O 3.49Å
682	R	80.7	Confident	82.9	Confident	140 Å²	140	71.4 Å²	71.4	53%	0.528	34%	0.34	S	S	.	.	H	α-helix	trans	-61.8	-49.1	178.6	-68.9	175.1	-150.8	-150.2	5.7	111.2	E678 K679 I680 A684 I685 E686	E678-R682 WeakPolarHBondContact O-CG 3.33Å; E678-R682 PolarHBondContact O-N 3.02Å; E678-R682 IonicContact OE2-NH2 2.65Å; E678-R682 PolarHBondContact OE2-NH2 3.32Å; K679-R682 PolarHBondContact O-N 3.12Å; I680-R682 PolarHBondContact O-N 2.86Å; R682-A684 VanDerWaalsContact C-N 3.3Å; R682-A684 PolarHBondContact O-N 3.22Å; R682-I685 PolarHBondContact O-N 3.19Å; R682-I685 VanDerWaalsContact O-N 3.11Å; R682-E686 WeakPolarHBondContact O-CB 3.44Å; R682-E686 WeakPolarHBondContact O-CG 3.28Å; R682-E686 PolarHBondContact O-N 2.91Å
683	V	82.7	Confident	82.6	Confident	66 Å²	66	73.5 Å²	73.5	40%	0.4	35%	0.35	S	S	.	.	H	α-helix	trans	-61	-38.6	176.4	174.7	0	0	0	0	111.6	K679 I680 E686 N687	K679-V683 WeakPolarHBondContact O-CG2 3.33Å; K679-V683 PolarHBondContact O-N 3.37Å; K679-V683 VanDerWaalsContact O-N 3.08Å; I680-V683 PolarHBondContact O-N 3.06Å; V683-E686 PolarHBondContact O-N 3.26Å; V683-N687 VanDerWaalsContact O-CB 3.32Å; V683-N687 WeakPolarHBondContact O-CB 3.43Å; V683-N687 PolarHBondContact O-N 3.48Å; V683-N687 PolarHBondContact O-OD1 3.48Å
684	A	80.1	Confident	82.5	Confident	45 Å²	45	77.3 Å²	77.3	37%	0.372	37%	0.369	S	S	.	.	H	α-helix	trans	-65.1	-38.4	174.9	0	0	0	0	0	112.9	I680 K681 R682 A688	I680-A684 WeakPolarHBondContact O-CB 3.46Å; I680-A684 PolarHBondContact O-N 3.3Å; K681-A684 PolarHBondContact O-N 2.72Å; R682-A684 VanDerWaalsContact C-N 3.3Å; R682-A684 PolarHBondContact O-N 3.22Å; A684-A688 WeakPolarHBondContact O-CB 3.27Å; A684-A688 PolarHBondContact O-N 3.41Å
685	I	80.8	Confident	82.4	Confident	39 Å²	39	75.3 Å²	75.3	20%	0.2	35%	0.354	C	S	.	.	H	α-helix	trans	-68.8	-41.4	174.9	-70	163.2	0	0	0	111.1	K681 R682 A688 R689 I709	K681-I685 WeakPolarHBondContact O-CD1 3.36Å; K681-I685 VanDerWaalsContact O-CG1 3.28Å; K681-I685 WeakPolarHBondContact O-CG1 3.5Å; K681-I685 PolarHBondContact O-N 2.98Å; R682-I685 PolarHBondContact O-N 3.19Å; R682-I685 VanDerWaalsContact O-N 3.11Å; I685-A688 PolarHBondContact O-N 2.93Å; I685-R689 VanDerWaalsContact O-CG 3.31Å; I685-R689 WeakPolarHBondContact O-CG 3.38Å; I685-R689 PolarHBondContact O-N 3.39Å; I685-I709 HydrophobicContact CG1-CG2 4.42Å
686	E	82.1	Confident	82.1	Confident	103 Å²	103	72.9 Å²	72.9	48%	0.481	35%	0.351	S	S	.	.	H	α-helix	trans	-64.2	-50.1	177.3	-73.5	159.9	-175	0	0	110.7	R682 V683 A688 R689 E690	R682-E686 WeakPolarHBondContact O-CB 3.44Å; R682-E686 WeakPolarHBondContact O-CG 3.28Å; R682-E686 PolarHBondContact O-N 2.91Å; V683-E686 PolarHBondContact O-N 3.26Å; E686-A688 VanDerWaalsContact C-N 3.33Å; E686-A688 PolarHBondContact O-N 3.05Å; E686-R689 WeakPolarHBondContact O-CB 3.32Å; E686-R689 PolarHBondContact O-N 2.88Å; E686-R689 VanDerWaalsContact O-N 3.12Å; E686-E690 PolarHBondContact O-N 3.23Å
687	N	83.2	Confident	82.3	Confident	83 Å²	83	79.8 Å²	79.8	44%	0.444	38%	0.382	S	S	.	.	H	α-helix	trans	-58.5	-42	174.1	-67.4	-1	0	0	0	112.1	V683 R689 E690 E691	V683-N687 VanDerWaalsContact O-CB 3.32Å; V683-N687 WeakPolarHBondContact O-CB 3.43Å; V683-N687 PolarHBondContact O-N 3.48Å; V683-N687 PolarHBondContact O-OD1 3.48Å; N687-R689 VanDerWaalsContact C-N 3.32Å; N687-R689 PolarHBondContact O-N 3.35Å; N687-E690 PolarHBondContact O-N 2.89Å; N687-E691 WeakPolarHBondContact O-CB 3.34Å; N687-E691 PolarHBondContact O-N 2.89Å
688	A	82.6	Confident	82.6	Confident	7 Å²	7	86.2 Å²	86.2	6%	0.058	41%	0.405	C	S	.	.	H	α-helix	trans	-63.1	-36.1	177	0	0	0	0	0	112.6	A684 I685 E686 E692 T706 I709 I710	A684-A688 WeakPolarHBondContact O-CB 3.27Å; A684-A688 PolarHBondContact O-N 3.41Å; I685-A688 PolarHBondContact O-N 2.93Å; E686-A688 VanDerWaalsContact C-N 3.33Å; E686-A688 PolarHBondContact O-N 3.05Å; A688-E692 WeakPolarHBondContact O-CB 3.46Å; A688-E692 PolarHBondContact O-N 3.21Å; A688-E692 VanDerWaalsContact O-N 3.08Å; A688-T706 HydrophobicContact CB-CG2 4.16Å; A688-I709 HydrophobicContact CB-CB 4.25Å; A688-I709 HydrophobicContact CB-CG2 3.73Å; A688-I710 HydrophobicContact CB-CG1 4.15Å
689	R	82.4	Confident	82.5	Confident	126 Å²	126	85.4 Å²	85.4	48%	0.475	42%	0.42	S	S	.	.	H	α-helix	trans	-68.2	-43.6	172.9	-70.4	171.4	-177.4	177.1	1.4	111.8	I685 E686 N687 E692 L693 I710	I685-R689 VanDerWaalsContact O-CG 3.31Å; I685-R689 WeakPolarHBondContact O-CG 3.38Å; I685-R689 PolarHBondContact O-N 3.39Å; E686-R689 WeakPolarHBondContact O-CB 3.32Å; E686-R689 PolarHBondContact O-N 2.88Å; E686-R689 VanDerWaalsContact O-N 3.12Å; N687-R689 VanDerWaalsContact C-N 3.32Å; N687-R689 PolarHBondContact O-N 3.35Å; R689-E692 PolarHBondContact O-N 2.84Å; R689-L693 WeakPolarHBondContact O-CB 3.4Å; R689-L693 VanDerWaalsContact O-CG 3.27Å; R689-L693 WeakPolarHBondContact O-CG 3.43Å; R689-L693 PolarHBondContact O-N 3.4Å; R689-I710 HydrophobicContact CG-CD1 3.85Å; R689-I710 HydrophobicContact CG-CG1 3.79Å; R689-I710 HydrophobicContact CG-CG2 4.28Å
690	E	85.2	Confident	82.4	Confident	116 Å²	116	84.1 Å²	84.1	54%	0.542	42%	0.416	S	S	.	.	H	α-helix	trans	-64.9	-42.1	177.5	-71	-171	-179.4	0	0	112	E686 N687 L693 Q694	E686-E690 PolarHBondContact O-N 3.23Å; N687-E690 PolarHBondContact O-N 2.89Å; E690-L693 PolarHBondContact O-N 3.41Å; E690-Q694 WeakPolarHBondContact O-CB 3.35Å; E690-Q694 VanDerWaalsContact O-CG 3.25Å; E690-Q694 WeakPolarHBondContact O-CG 3.26Å; E690-Q694 PolarHBondContact O-N 3.42Å
691	E	83.6	Confident	82.2	Confident	103 Å²	103	84.7 Å²	84.7	48%	0.481	43%	0.428	S	S	.	.	H	α-helix	trans	-60.5	-44.1	173.2	-82.6	-167	-144.6	0	0	112.4	N687 Q694 R695	N687-E691 WeakPolarHBondContact O-CB 3.34Å; N687-E691 PolarHBondContact O-N 2.89Å; E691-Q694 PolarHBondContact O-N 3.22Å; E691-R695 VanDerWaalsContact O-CG 3.28Å; E691-R695 WeakPolarHBondContact O-CG 3.34Å; E691-R695 PolarHBondContact O-N 3.17Å; E691-R695 IonicContact OE2-CZ 3.87Å; E691-R695 IonicContact OE2-NH2 3.1Å; E691-R695 PolarHBondContact OE2-NH2 2.86Å
692	E	82.9	Confident	81.8	Confident	12 Å²	12	85.3 Å²	85.3	6%	0.056	44%	0.438	C	S	.	.	H	α-helix	trans	-68.5	-41.4	-179.2	-167.5	55.8	-128.1	0	0	111.4	A688 R689 Q694 R695 L696 P702 T706 I710	A688-E692 WeakPolarHBondContact O-CB 3.46Å; A688-E692 PolarHBondContact O-N 3.21Å; A688-E692 VanDerWaalsContact O-N 3.08Å; R689-E692 PolarHBondContact O-N 2.84Å; E692-Q694 VanDerWaalsContact C-N 3.34Å; E692-Q694 PolarHBondContact O-N 3.14Å; E692-R695 WeakPolarHBondContact O-CB 3.49Å; E692-R695 PolarHBondContact O-N 2.87Å; E692-R695 VanDerWaalsContact O-N 3.17Å; E692-R695 IonicContact OE2-CZ 3.75Å; E692-R695 IonicContact OE2-NE 3.93Å; E692-R695 IonicContact OE2-NH1 2.77Å; E692-R695 PolarHBondContact OE2-NH1 2.82Å; E692-L696 WeakPolarHBondContact O-CG 3.28Å; E692-L696 PolarHBondContact O-N 3.25Å; E692-P702 WeakPolarHBondContact OE1-CA 3.24Å; E692-T706 WeakPolarHBondContact OE2-CB 3.33Å; E692-T706 PolarHBondContact OE2-OG1 2.91Å; E692-I710 HydrophobicContact CB-CD1 4.45Å
693	L	84.1	Confident	81.3	Confident	106 Å²	106	82.9 Å²	82.9	56%	0.555	43%	0.432	S	S	*	.	H	α-helix	trans	-56.9	-46.5	170.7	-73.8	168.4	0	0	0	111.5	R689 E690 R695 L696 E697	R689-L693 WeakPolarHBondContact O-CB 3.4Å; R689-L693 VanDerWaalsContact O-CG 3.27Å; R689-L693 WeakPolarHBondContact O-CG 3.43Å; R689-L693 PolarHBondContact O-N 3.4Å; E690-L693 PolarHBondContact O-N 3.41Å; L693-R695 VanDerWaalsContact C-N 3.3Å; L693-R695 PolarHBondContact O-N 3.44Å; L693-L696 PolarHBondContact O-N 3.3Å; L693-E697 WeakPolarHBondContact O-CG 3.32Å; L693-E697 PolarHBondContact O-N 2.89Å
694	Q	86.1	Confident	80.6	Confident	93 Å²	93	84.6 Å²	84.6	44%	0.435	44%	0.444	S	S	.	.	H	α-helix	trans	-65.3	-28.6	177.8	-71.6	174.4	34.9	0	0	113.5	E690 E691 E692 R698	E690-Q694 WeakPolarHBondContact O-CB 3.35Å; E690-Q694 VanDerWaalsContact O-CG 3.25Å; E690-Q694 WeakPolarHBondContact O-CG 3.26Å; E690-Q694 PolarHBondContact O-N 3.42Å; E691-Q694 PolarHBondContact O-N 3.22Å; E692-Q694 VanDerWaalsContact C-N 3.34Å; E692-Q694 PolarHBondContact O-N 3.14Å; Q694-R698 WeakPolarHBondContact O-CG 3.42Å; Q694-R698 VanDerWaalsContact O-CZ 3.26Å; Q694-R698 PolarHBondContact O-N 3.11Å; Q694-R698 PolarHBondContact O-NH1 2.87Å; Q694-R698 VanDerWaalsContact O-NH1 3.1Å
695	R	82.1	Confident	79.9	Confident	21 Å²	21	88.7 Å²	88.7	8%	0.079	46%	0.455	C	S	.	.	H	α-helix	trans	-70.4	-46.3	172.5	-71	167.7	-151.1	170.7	0.9	110.9	E691 E692 L693 E697 R698 G699 E700 T706	E691-R695 VanDerWaalsContact O-CG 3.28Å; E691-R695 WeakPolarHBondContact O-CG 3.34Å; E691-R695 PolarHBondContact O-N 3.17Å; E691-R695 IonicContact OE2-CZ 3.87Å; E691-R695 IonicContact OE2-NH2 3.1Å; E691-R695 PolarHBondContact OE2-NH2 2.86Å; E692-R695 WeakPolarHBondContact O-CB 3.49Å; E692-R695 PolarHBondContact O-N 2.87Å; E692-R695 VanDerWaalsContact O-N 3.17Å; E692-R695 IonicContact OE2-CZ 3.75Å; E692-R695 IonicContact OE2-NE 3.93Å; E692-R695 IonicContact OE2-NH1 2.77Å; E692-R695 PolarHBondContact OE2-NH1 2.82Å; L693-R695 VanDerWaalsContact C-N 3.3Å; L693-R695 PolarHBondContact O-N 3.44Å; R695-E697 VanDerWaalsContact C-N 3.34Å; R695-E697 PolarHBondContact O-N 3.27Å; R695-R698 CarbonylContact O-C 3.59Å; R695-R698 WeakPolarHBondContact O-CA 3.4Å; R695-R698 PolarHBondContact O-N 3.37Å; R695-G699 PolarHBondContact O-N 3.41Å; R695-E700 HydrophobicContact CB-CB 4.05Å; R695-E700 WeakPolarHBondContact O-CB 3.32Å; R695-E700 PolarHBondContact O-N 3.17Å; R695-T706 VanDerWaalsContact NH1-CG2 3.34Å; R695-T706 PolarHBondContact NH1-OG1 3Å
696	L	81.9	Confident	79.1	Confident	90 Å²	90	87.1 Å²	87.1	47%	0.471	45%	0.448	S	S	.	.	H	α-helix	trans	-62.4	-39.2	177	-67.4	170.8	0	0	0	112	E692 L693 R698 G699 P702	E692-L696 WeakPolarHBondContact O-CG 3.28Å; E692-L696 PolarHBondContact O-N 3.25Å; L693-L696 PolarHBondContact O-N 3.3Å; L696-R698 VanDerWaalsContact C-N 3.25Å; L696-R698 PolarHBondContact O-N 3.29Å; L696-G699 PolarHBondContact O-N 3.33Å; L696-P702 HydrophobicContact CD2-CG 4.18Å
697	E	86.5	Confident	78.2	Confident	166 Å²	166	85.7 Å²	85.7	78%	0.776	44%	0.443	S	S	*	.	H	α-helix	trans	-62.8	-28.5	172.7	-75.1	-177.9	162.7	0	0	113.3	L693 R695 G699	L693-E697 WeakPolarHBondContact O-CG 3.32Å; L693-E697 PolarHBondContact O-N 2.89Å; R695-E697 VanDerWaalsContact C-N 3.34Å; R695-E697 PolarHBondContact O-N 3.27Å; E697-G699 VanDerWaalsContact C-N 3.33Å
698	R	86.6	Confident	77.3	Confident	148 Å²	148	82.8 Å²	82.8	56%	0.558	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-2.1	172.4	-67.5	-173.7	-54.4	-95.3	0.5	113.7	Q694 R695 L696 E700	Q694-R698 WeakPolarHBondContact O-CG 3.42Å; Q694-R698 VanDerWaalsContact O-CZ 3.26Å; Q694-R698 PolarHBondContact O-N 3.11Å; Q694-R698 PolarHBondContact O-NH1 2.87Å; Q694-R698 VanDerWaalsContact O-NH1 3.1Å; R695-R698 CarbonylContact O-C 3.59Å; R695-R698 WeakPolarHBondContact O-CA 3.4Å; R695-R698 PolarHBondContact O-N 3.37Å; L696-R698 VanDerWaalsContact C-N 3.25Å; L696-R698 PolarHBondContact O-N 3.29Å; R698-E700 VanDerWaalsContact C-N 3.34Å; R698-E700 HydrophobicContact CB-CG 4.44Å; R698-E700 IonicContact CZ-OE1 2.8Å; R698-E700 IonicContact NE-OE1 2.74Å; R698-E700 PolarHBondContact NE-OE1 3.34Å; R698-E700 IonicContact NH2-OE1 3.28Å; R698-E700 PolarHBondContact NH2-OE1 3.08Å; R698-E700 IonicContact NH2-OE2 2.73Å
699	G	80	Confident	76.5	Confident	69 Å²	69	84.2 Å²	84.2	71%	0.711	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.7	18.8	-177.3	0	0	0	0	0	114.5	R695 L696 E697	R695-G699 PolarHBondContact O-N 3.41Å; L696-G699 PolarHBondContact O-N 3.33Å; E697-G699 VanDerWaalsContact C-N 3.33Å
700	E	80.6	Confident	75.7	Confident	81 Å²	81	79.9 Å²	79.9	38%	0.379	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-72.6	159.1	171.6	-65.1	173.4	-127.6	0	0	111.1	R695 R698	R695-E700 HydrophobicContact CB-CB 4.05Å; R695-E700 WeakPolarHBondContact O-CB 3.32Å; R695-E700 PolarHBondContact O-N 3.17Å; R698-E700 VanDerWaalsContact C-N 3.34Å; R698-E700 HydrophobicContact CB-CG 4.44Å; R698-E700 IonicContact CZ-OE1 2.8Å; R698-E700 IonicContact NE-OE1 2.74Å; R698-E700 PolarHBondContact NE-OE1 3.34Å; R698-E700 IonicContact NH2-OE1 3.28Å; R698-E700 PolarHBondContact NH2-OE1 3.08Å; R698-E700 IonicContact NH2-OE2 2.73Å
701	S	74.9	Confident	74.7	Confident	98 Å²	98	80.4 Å²	80.4	69%	0.685	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-82.8	147.6	174	-57.9	0	0	0	0	111.3
702	P	69.5	Low	73.5	Confident	79 Å²	79	77.6 Å²	77.6	51%	0.513	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-55.1	143.3	176.1	-24.5	31.9	0	0	0	113.4	E692 L696	E692-P702 WeakPolarHBondContact OE1-CA 3.24Å; L696-P702 HydrophobicContact CD2-CG 4.18Å
703	K	70.1	Confident	72.3	Confident	90 Å²	90	81.6 Å²	81.6	39%	0.391	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-101.8	128.9	172.9	-64	-172.3	-175.4	176.4	0	110.8	E705 T706 D707	K703-E705 PolarHBondContact O-N 3Å; K703-E705 VanDerWaalsContact O-N 3.12Å; K703-T706 PolarHBondContact O-N 3.49Å; K703-T706 VanDerWaalsContact O-N 3.16Å; K703-T706 PolarHBondContact O-OG1 2.91Å; K703-D707 PolarHBondContact O-N 2.98Å
704	P	67.7	Low	70.8	Confident	102 Å²	102	78.6 Å²	78.6	66%	0.662	44%	0.437	S	S	*	.	H	α-helix	trans	-64.6	-20.9	179.8	27.8	-35.6	0	0	0	113.1	A708	P704-A708 WeakPolarHBondContact O-CB 3.28Å; P704-A708 PolarHBondContact O-N 2.75Å
705	E	64.2	Low	69	Low	130 Å²	130	77.8 Å²	77.8	61%	0.607	43%	0.433	S	S	*	.	H	α-helix	trans	-65.1	-45.1	175.1	-65.1	165.3	179.1	0	0	111.8	K703 I709	K703-E705 PolarHBondContact O-N 3Å; K703-E705 VanDerWaalsContact O-N 3.12Å; E705-I709 WeakPolarHBondContact O-CG1 3.37Å; E705-I709 PolarHBondContact O-N 2.71Å
706	T	64.1	Low	67.5	Low	7 Å²	7	83.5 Å²	83.5	4%	0.043	46%	0.461	C	S	.	.	H	α-helix	trans	-72.1	-41.6	176.6	18.1	0	0	0	0	111.5	A688 E692 R695 K703 A708 I709 I710	A688-T706 HydrophobicContact CB-CG2 4.16Å; E692-T706 WeakPolarHBondContact OE2-CB 3.33Å; E692-T706 PolarHBondContact OE2-OG1 2.91Å; R695-T706 VanDerWaalsContact NH1-CG2 3.34Å; R695-T706 PolarHBondContact NH1-OG1 3Å; K703-T706 PolarHBondContact O-N 3.49Å; K703-T706 VanDerWaalsContact O-N 3.16Å; K703-T706 PolarHBondContact O-OG1 2.91Å; T706-A708 VanDerWaalsContact C-N 3.27Å; T706-A708 PolarHBondContact O-N 2.76Å; T706-I709 PolarHBondContact O-N 3.01Å; T706-I710 WeakPolarHBondContact O-CB 3.2Å; T706-I710 WeakPolarHBondContact O-CG1 3.37Å; T706-I710 PolarHBondContact O-N 3.12Å
707	D	64.8	Low	65.9	Low	72 Å²	72	80.6 Å²	80.6	39%	0.385	45%	0.446	S	S	.	.	H	α-helix	trans	-54.9	-45	174.1	-66.9	-32.6	0	0	0	111	K703 I709 I710 D711	K703-D707 PolarHBondContact O-N 2.98Å; D707-I709 VanDerWaalsContact C-N 3.34Å; D707-I709 PolarHBondContact O-N 2.66Å; D707-I710 PolarHBondContact O-N 3.27Å; D707-D711 WeakPolarHBondContact O-CB 3.36Å; D707-D711 PolarHBondContact O-N 3.34Å
708	A	63.7	Low	64.1	Low	23 Å²	23	77.1 Å²	77.1	19%	0.19	44%	0.437	C	S	.	.	H	α-helix	trans	-63.1	-35.7	176.6	0	0	0	0	0	113.2	P704 T706 G712 T713 H714	P704-A708 WeakPolarHBondContact O-CB 3.28Å; P704-A708 PolarHBondContact O-N 2.75Å; T706-A708 VanDerWaalsContact C-N 3.27Å; T706-A708 PolarHBondContact O-N 2.76Å; A708-G712 PolarHBondContact O-N 3.48Å; A708-T713 WeakPolarHBondContact CA-OG1 3.4Å; A708-T713 PolarHBondContact O-N 3.49Å; A708-T713 PolarHBondContact O-OG1 3.08Å; A708-H714 HydrophobicContact CB-CB 3.91Å; A708-H714 WeakPolarHBondContact O-CB 3.33Å; A708-H714 PolarHBondContact O-N 3.25Å
709	I	65.9	Low	62.5	Low	36 Å²	36	73.7 Å²	73.7	19%	0.185	43%	0.434	C	S	.	.	H	α-helix	trans	-67.3	-44.2	174.9	-67.1	166	0	0	0	109.6	I685 A688 E705 T706 D707 G712 H714	I685-I709 HydrophobicContact CG1-CG2 4.42Å; A688-I709 HydrophobicContact CB-CB 4.25Å; A688-I709 HydrophobicContact CB-CG2 3.73Å; E705-I709 WeakPolarHBondContact O-CG1 3.37Å; E705-I709 PolarHBondContact O-N 2.71Å; T706-I709 PolarHBondContact O-N 3.01Å; D707-I709 VanDerWaalsContact C-N 3.34Å; D707-I709 PolarHBondContact O-N 2.66Å; I709-G712 PolarHBondContact O-N 3.16Å; I709-H714 HydrophobicContact CB-CB 4.29Å; I709-H714 HydrophobicContact CG1-CB 3.58Å; I709-H714 VanDerWaalsContact CG1-CG 3.46Å
710	I	65.2	Low	61.6	Low	35 Å²	35	74.4 Å²	74.4	18%	0.179	43%	0.425	C	S	.	.	H	α-helix	trans	-64.4	-39.9	-177.4	-69.6	168.4	0	0	0	112.1	A688 R689 E692 T706 D707 G712	A688-I710 HydrophobicContact CB-CG1 4.15Å; R689-I710 HydrophobicContact CG-CD1 3.85Å; R689-I710 HydrophobicContact CG-CG1 3.79Å; R689-I710 HydrophobicContact CG-CG2 4.28Å; E692-I710 HydrophobicContact CB-CD1 4.45Å; T706-I710 WeakPolarHBondContact O-CB 3.2Å; T706-I710 WeakPolarHBondContact O-CG1 3.37Å; T706-I710 PolarHBondContact O-N 3.12Å; D707-I710 PolarHBondContact O-N 3.27Å; I710-G712 VanDerWaalsContact C-N 3.25Å; I710-G712 PolarHBondContact O-N 3.22Å
711	D	63.9	Low	61.2	Low	128 Å²	128	71 Å²	71	68%	0.684	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-2.8	174.6	-81.1	-5.6	0	0	0	113.3	D707 T713	D707-D711 WeakPolarHBondContact O-CB 3.36Å; D707-D711 PolarHBondContact O-N 3.34Å; D711-T713 HydrophobicContact CB-CG2 4.32Å; D711-T713 PolarHBondContact O-N 3.02Å
712	G	58.9	Low	61.3	Low	44 Å²	44	67.5 Å²	67.5	45%	0.454	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.5	16.9	-178.8	0	0	0	0	0	114.6	A708 I709 I710	A708-G712 PolarHBondContact O-N 3.48Å; I709-G712 PolarHBondContact O-N 3.16Å; I710-G712 VanDerWaalsContact C-N 3.25Å; I710-G712 PolarHBondContact O-N 3.22Å
713	T	57.9	Low	61.9	Low	95 Å²	95	64.3 Å²	64.3	58%	0.583	36%	0.363	S	S	*	.			trans	-93.9	-17.2	-179.9	56.1	0	0	0	0	113.3	A708 D711 E715	A708-T713 WeakPolarHBondContact CA-OG1 3.4Å; A708-T713 PolarHBondContact O-N 3.49Å; A708-T713 PolarHBondContact O-OG1 3.08Å; D711-T713 HydrophobicContact CB-CG2 4.32Å; D711-T713 PolarHBondContact O-N 3.02Å; T713-E715 PolarHBondContact O-N 3.22Å
714	H	52.9	Low	62.6	Low	44 Å²	44	60 Å²	60	20%	0.204	34%	0.344	C	S	.	.			trans	-62.5	123.1	178.6	-170.6	-100.4	0	0	0	112.1	A708 I709 E716 T717	A708-H714 HydrophobicContact CB-CB 3.91Å; A708-H714 WeakPolarHBondContact O-CB 3.33Å; A708-H714 PolarHBondContact O-N 3.25Å; I709-H714 HydrophobicContact CB-CB 4.29Å; I709-H714 HydrophobicContact CG1-CB 3.58Å; I709-H714 VanDerWaalsContact CG1-CG 3.46Å; H714-E716 VanDerWaalsContact C-N 3.27Å; H714-E716 IonicContact CE1-OE2 3.74Å; H714-E716 PolarHBondContact O-N 3.39Å; H714-T717 HydrophobicContact CB-CG2 4.12Å; H714-T717 WeakPolarHBondContact O-CB 3.5Å; H714-T717 WeakPolarHBondContact O-CG2 3.28Å; H714-T717 PolarHBondContact O-N 3.22Å; H714-T717 PolarHBondContact O-OG1 3.36Å
715	E	47.2	Very low	63.3	Low	75 Å²	75	60.3 Å²	60.3	35%	0.35	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-69.6	-20.8	-164.1	-53.5	-151	156.2	0	0	114.3	T713 T717 N831 K834	T713-E715 PolarHBondContact O-N 3.22Å; E715-T717 VanDerWaalsContact C-N 3.27Å; E715-T717 PolarHBondContact O-N 2.94Å; E715-N831 HydrophobicContact CB-CB 4.44Å; E715-N831 PolarHBondContact O-ND2 2.9Å; E715-K834 VanDerWaalsContact OE1-CD 3.29Å; E715-K834 WeakPolarHBondContact OE1-CD 3.46Å; E715-K834 IonicContact OE1-NZ 2.76Å; E715-K834 PolarHBondContact OE1-NZ 2.84Å; E715-K834 WeakPolarHBondContact OE2-CD 3.21Å; E715-K834 IonicContact OE2-NZ 2.72Å; E715-K834 PolarHBondContact OE2-NZ 3.49Å
716	E	50.5	Low	64.1	Low	142 Å²	142	57 Å²	57	66%	0.664	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-72.5	-17.7	174.2	-58.7	-160.7	131.8	0	0	113.4	H714 V718	H714-E716 VanDerWaalsContact C-N 3.27Å; H714-E716 IonicContact CE1-OE2 3.74Å; H714-E716 PolarHBondContact O-N 3.39Å; E716-V718 PolarHBondContact O-N 2.81Å
717	T	48.1	Very low	65.2	Low	28 Å²	28	56.8 Å²	56.8	17%	0.172	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-67.5	-8.8	178.9	67	0	0	0	0	112.8	K681 H714 E715 C719	K681-T717 WeakPolarHBondContact CE-O 2.99Å; K681-T717 PolarHBondContact NZ-O 3.49Å; H714-T717 HydrophobicContact CB-CG2 4.12Å; H714-T717 WeakPolarHBondContact O-CB 3.5Å; H714-T717 WeakPolarHBondContact O-CG2 3.28Å; H714-T717 PolarHBondContact O-N 3.22Å; H714-T717 PolarHBondContact O-OG1 3.36Å; E715-T717 VanDerWaalsContact C-N 3.27Å; E715-T717 PolarHBondContact O-N 2.94Å; T717-C719 PolarHBondContact O-N 3Å
718	V	48.9	Very low	66.3	Low	94 Å²	94	55.4 Å²	55.4	57%	0.57	31%	0.312	S	S	*	.			trans	-81.5	52.4	177.9	-162.6	0	0	0	0	111.5	E716 V720	E716-V718 PolarHBondContact O-N 2.81Å; V718-V720 HydrophobicContact CG1-CG2 3.94Å; V718-V720 PolarHBondContact O-N 3.1Å
719	C	52.8	Low	67.5	Low	75 Å²	75	57.2 Å²	57.2	51%	0.507	32%	0.316	S	S	.	.			trans	-74	50.3	171.9	-159	0	0	0	0	112.1	V677 T717 N721	V677-C719 WeakPolarHBondContact CG1-O 3.41Å; V677-C719 WeakPolarHBondContact CG2-O 3.25Å; T717-C719 PolarHBondContact O-N 3Å; C719-N721 PolarHBondContact O-N 3.43Å
720	V	61.6	Low	68.6	Low	85 Å²	85	56.8 Å²	56.8	52%	0.515	31%	0.313	S	S	.	.			trans	-81.4	100.8	174.8	-179.7	0	0	0	0	108.1	V718 P722	V718-V720 HydrophobicContact CG1-CG2 3.94Å; V718-V720 PolarHBondContact O-N 3.1Å; V720-P722 VanDerWaalsContact O-CD 3.25Å; V720-P722 WeakPolarHBondContact O-CD 3.44Å
721	N	72.3	Confident	69.8	Low	10 Å²	10	55.1 Å²	55.1	5%	0.053	31%	0.305	C	S	.	.			trans	-63.9	116.6	174.3	179.4	7.1	0	0	0	110.8	E673 C719 L723 P765 W766	E673-N721 HydrophobicContact CG-CB 4.25Å; E673-N721 VanDerWaalsContact OE1-CB 3.27Å; E673-N721 WeakPolarHBondContact OE1-CB 3.49Å; E673-N721 PolarHBondContact OE1-ND2 3.34Å; C719-N721 PolarHBondContact O-N 3.43Å; N721-L723 VanDerWaalsContact C-N 3.34Å; N721-L723 VanDerWaalsContact OD1-CB 3.29Å; N721-L723 WeakPolarHBondContact OD1-CB 3.38Å; N721-L723 VanDerWaalsContact OD1-CG 3.27Å; N721-L723 WeakPolarHBondContact OD1-CG 3.45Å; N721-L723 PolarHBondContact OD1-N 3.24Å; N721-P765 HydrophobicContact CB-CB 4.16Å; N721-W766 PolarHBondContact ND2-N 2.98Å; N721-W766 VanDerWaalsContact ND2-N 3.19Å; N721-W766 PolarHBondContact ND2-O 3.02Å
722	P	76.3	Confident	71.2	Confident	23 Å²	23	49.1 Å²	49.1	15%	0.149	27%	0.272	C	S	.	.			trans	-79.9	-15.2	-179.4	33.5	-35.6	0	0	0	113	V720 F725 L726 M823	V720-P722 VanDerWaalsContact O-CD 3.25Å; V720-P722 WeakPolarHBondContact O-CD 3.44Å; P722-F725 WeakPolarHBondContact O-CB 3.36Å; P722-F725 PolarHBondContact O-N 2.73Å; P722-L726 HydrophobicContact CB-CD1 4.18Å; P722-L726 WeakPolarHBondContact O-CG 3.08Å; P722-L726 PolarHBondContact O-N 3.06Å; P722-M823 HydrophobicContact CB-CE 4.33Å
723	L	82.3	Confident	72.9	Confident	13 Å²	13	49.3 Å²	49.3	7%	0.068	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-39.6	-168.3	-59.1	176.2	0	0	0	114.4	N721 F725 L726 W766 W769 L816	N721-L723 VanDerWaalsContact C-N 3.34Å; N721-L723 VanDerWaalsContact OD1-CB 3.29Å; N721-L723 WeakPolarHBondContact OD1-CB 3.38Å; N721-L723 VanDerWaalsContact OD1-CG 3.27Å; N721-L723 WeakPolarHBondContact OD1-CG 3.45Å; N721-L723 PolarHBondContact OD1-N 3.24Å; L723-F725 PolarHBondContact O-N 2.9Å; L723-L726 HydrophobicContact CD2-CD1 4.44Å; L723-L726 PolarHBondContact O-N 3.35Å; L723-W766 HydrophobicContact CB-CE3 4.4Å; L723-W766 HydrophobicContact CB-CZ3 4.39Å; L723-W769 HydrophobicContact CD1-CH2 3.96Å; L723-W769 HydrophobicContact CD1-CZ2 3.96Å; L723-L816 HydrophobicContact CD2-CD1 3.82Å; L723-L816 HydrophobicContact CD2-CD2 4.35Å; L723-L816 HydrophobicContact CD2-CG 3.93Å
724	P	84.5	Confident	74.5	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-27.5	172.7	-23.3	33	0	0	0	114	L669 R670 E673 W766	L669-P724 HydrophobicContact CD2-CB 4.45Å; L669-P724 HydrophobicContact CG-CB 4.42Å; R670-P724 HydrophobicContact CG-CB 3.77Å; R670-P724 VanDerWaalsContact CZ-O 3.31Å; R670-P724 PolarHBondContact NE-O 2.99Å; R670-P724 PolarHBondContact NH2-O 3.17Å; E673-P724 HydrophobicContact CB-CG 4.4Å; E673-P724 HydrophobicContact CG-CG 4.14Å; P724-W766 HydrophobicContact CB-CE3 4.39Å; P724-W766 HydrophobicContact CB-CZ3 4.47Å; P724-W766 HydrophobicContact CG-CD2 4.43Å; P724-W766 HydrophobicContact CG-CE3 3.65Å; P724-W766 HydrophobicContact CG-CZ3 4.17Å
725	F	82.7	Confident	76.4	Confident	107 Å²	107	44.1 Å²	44.1	47%	0.469	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-24.5	-179.3	-59.9	-84	0	0	0	112.4	R670 P722 L723 I727	R670-F725 HydrophobicContact CG-CE1 4.24Å; R670-F725 HydrophobicContact CG-CZ 4.4Å; P722-F725 WeakPolarHBondContact O-CB 3.36Å; P722-F725 PolarHBondContact O-N 2.73Å; L723-F725 PolarHBondContact O-N 2.9Å; F725-I727 VanDerWaalsContact C-N 3.29Å; F725-I727 PolarHBondContact O-N 3.19Å
726	L	81.3	Confident	78.7	Confident	62 Å²	62	40.5 Å²	40.5	33%	0.325	21%	0.212	S	C	.	.	S	Bend	trans	-85.9	7.5	177	-63.8	171	0	0	0	114	S635 P722 L723 L816 M823	S635-L726 PolarHBondContact OG-O 2.99Å; P722-L726 HydrophobicContact CB-CD1 4.18Å; P722-L726 WeakPolarHBondContact O-CG 3.08Å; P722-L726 PolarHBondContact O-N 3.06Å; L723-L726 HydrophobicContact CD2-CD1 4.44Å; L723-L726 PolarHBondContact O-N 3.35Å; L726-L816 HydrophobicContact CB-CD1 3.64Å; L726-L816 HydrophobicContact CD1-CD1 3.95Å; L726-L816 HydrophobicContact CG-CD1 4.46Å; L726-M823 HydrophobicContact CD1-CE 4.08Å; L726-M823 HydrophobicContact CD1-SD 3.8Å
727	I	86.9	Confident	80.7	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.005	19%	0.188	C	C	.	.			trans	-121.7	142.9	-177.4	-78.6	176.2	0	0	0	110.2	S635 L666 R670 F725 D731 I732 W766 P768 L816	S635-I727 WeakPolarHBondContact OG-CG1 3.47Å; L666-I727 HydrophobicContact CD1-CG2 4.22Å; R670-I727 PolarHBondContact NH2-O 2.8Å; F725-I727 VanDerWaalsContact C-N 3.29Å; F725-I727 PolarHBondContact O-N 3.19Å; I727-D731 HydrophobicContact CG2-CB 3.97Å; I727-I732 HydrophobicContact CG2-CD1 3.47Å; I727-I732 VanDerWaalsContact CG2-CD1 3.47Å; I727-I732 HydrophobicContact CG2-CG1 3.75Å; I727-W766 HydrophobicContact CD1-CH2 3.56Å; I727-W766 HydrophobicContact CD1-CZ3 3.7Å; I727-P768 HydrophobicContact CD1-CG 3.58Å; I727-L816 HydrophobicContact CD1-CD2 3.54Å; I727-L816 HydrophobicContact CG1-CD2 3.66Å
728	N	88.2	Confident	82.8	Confident	44 Å²	44	40.3 Å²	40.3	24%	0.235	21%	0.21	C	C	.	.			trans	-112.9	168.9	178.2	-54.9	-85.8	0	0	0	112.2	L633 S634 E730 D731 I732	L633-N728 PolarHBondContact O-ND2 2.96Å; S634-N728 WeakPolarHBondContact CA-ND2 3.49Å; S634-N728 PolarHBondContact N-ND2 3Å; N728-E730 VanDerWaalsContact C-N 3.26Å; N728-E730 PolarHBondContact O-N 3.14Å; N728-D731 PolarHBondContact N-OD2 2.82Å; N728-D731 PolarHBondContact ND2-OD2 2.82Å; N728-D731 WeakPolarHBondContact O-CA 3Å; N728-D731 WeakPolarHBondContact O-CB 3.41Å; N728-D731 PolarHBondContact O-N 2.92Å; N728-I732 PolarHBondContact O-N 3.46Å
729	K	90.1	Very high	84.9	Confident	60 Å²	60	36 Å²	36	26%	0.261	18%	0.183	S	C	.	.	H	α-helix	trans	-56	-32.6	178.7	64.5	-172.7	-172.6	173.3	0	114.7	L659 Y662 Q663 D731 I732 R733	L659-K729 HydrophobicContact CB-CD 3.89Å; L659-K729 HydrophobicContact CB-CG 4.28Å; Y662-K729 WeakPolarHBondContact CB-O 3.37Å; Q663-K729 HydrophobicContact CB-CB 4Å; Q663-K729 HydrophobicContact CB-CD 3.85Å; Q663-K729 HydrophobicContact CG-CD 4.36Å; K729-D731 VanDerWaalsContact C-N 3.32Å; K729-I732 PolarHBondContact O-N 3.44Å; K729-R733 WeakPolarHBondContact O-CB 3.47Å; K729-R733 PolarHBondContact O-N 3Å
730	E	88.9	Confident	86.8	Confident	27 Å²	27	32.9 Å²	32.9	13%	0.126	16%	0.161	C	C	.	.	H	α-helix	trans	-76.5	-19.6	175.4	-51.7	100.4	126.2	0	0	113.4	R647 L659 N728 F734	R647-E730 IonicContact CZ-OE1 3.69Å; R647-E730 IonicContact NE-OE1 3.31Å; R647-E730 IonicContact NH1-OE1 3.07Å; R647-E730 PolarHBondContact NH1-OE1 3.31Å; R647-E730 IonicContact NH1-OE2 3.86Å; L659-E730 HydrophobicContact CD1-CG 3.79Å; L659-E730 HydrophobicContact CD2-CG 4.14Å; N728-E730 VanDerWaalsContact C-N 3.26Å; N728-E730 PolarHBondContact O-N 3.14Å; E730-F734 PolarHBondContact O-N 3.4Å
731	D	90.3	Very high	88.3	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-80.9	-38	171.4	-63.7	-54.3	0	0	0	110.2	S634 S635 R636 I727 N728 K729 F734 L735 F813	S634-D731 WeakPolarHBondContact CA-OD2 3.28Å; S634-D731 WeakPolarHBondContact CB-OD2 3.26Å; S634-D731 PolarHBondContact OG-OD1 3.37Å; S634-D731 PolarHBondContact OG-OD2 3.34Å; S635-D731 PolarHBondContact N-OD2 3.22Å; R636-D731 WeakPolarHBondContact CD-OD1 3.35Å; I727-D731 HydrophobicContact CG2-CB 3.97Å; N728-D731 PolarHBondContact N-OD2 2.82Å; N728-D731 PolarHBondContact ND2-OD2 2.82Å; N728-D731 WeakPolarHBondContact O-CA 3Å; N728-D731 WeakPolarHBondContact O-CB 3.41Å; N728-D731 PolarHBondContact O-N 2.92Å; K729-D731 VanDerWaalsContact C-N 3.32Å; D731-F734 PolarHBondContact O-N 3.2Å; D731-L735 PolarHBondContact O-N 2.85Å; D731-F813 HydrophobicContact CB-CE1 3.92Å; D731-F813 HydrophobicContact CB-CZ 4.14Å
732	I	93.6	Very high	89.2	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-64.1	-45.1	170.2	-63.3	-56.1	0	0	0	111.9	Y662 I665 L666 L669 I727 N728 K729 F734 L735 I736 L757	Y662-I732 HydrophobicContact CD1-CG2 4.49Å; I665-I732 HydrophobicContact CB-CG2 4.46Å; I665-I732 HydrophobicContact CG2-CG2 4.38Å; L666-I732 HydrophobicContact CB-CG1 4.03Å; L666-I732 HydrophobicContact CD1-CD1 4.18Å; L666-I732 HydrophobicContact CD1-CG1 3.91Å; L666-I732 HydrophobicContact CD2-CG1 4.42Å; L666-I732 HydrophobicContact CG-CG1 4.34Å; L669-I732 HydrophobicContact CD2-CD1 4.36Å; I727-I732 HydrophobicContact CG2-CD1 3.47Å; I727-I732 VanDerWaalsContact CG2-CD1 3.47Å; I727-I732 HydrophobicContact CG2-CG1 3.75Å; N728-I732 PolarHBondContact O-N 3.46Å; K729-I732 PolarHBondContact O-N 3.44Å; I732-F734 VanDerWaalsContact C-N 3.28Å; I732-F734 PolarHBondContact O-N 3.37Å; I732-L735 PolarHBondContact O-N 2.85Å; I732-I736 HydrophobicContact CG2-CD1 3.85Å; I732-I736 HydrophobicContact CG2-CG1 4.46Å; I732-I736 PolarHBondContact O-N 3.47Å; I732-L757 HydrophobicContact CD1-CD1 3.68Å; I732-L757 HydrophobicContact CG2-CD1 4.19Å
733	R	92.6	Very high	89.9	Confident	49 Å²	49	38.3 Å²	38.3	19%	0.185	18%	0.178	C	C	.	.	H	α-helix	trans	-51.1	-49.1	170.9	179.3	-174.1	134.7	-165.4	-8.1	111.1	E655 Y662 K729 L735 I736 D737	E655-R733 VanDerWaalsContact CD-NH2 3.33Å; E655-R733 IonicContact OE1-NH2 3.59Å; E655-R733 PolarHBondContact OE1-NH2 3.48Å; E655-R733 VanDerWaalsContact OE1-NH2 3.15Å; E655-R733 IonicContact OE2-CZ 3.53Å; E655-R733 VanDerWaalsContact OE2-CZ 3.25Å; E655-R733 IonicContact OE2-NH1 3.58Å; E655-R733 PolarHBondContact OE2-NH1 3.35Å; E655-R733 IonicContact OE2-NH2 2.73Å; E655-R733 PolarHBondContact OE2-NH2 2.85Å; Y662-R733 VanDerWaalsContact CD1-CA 3.43Å; Y662-R733 HydrophobicContact CD1-CB 3.89Å; Y662-R733 HydrophobicContact CD1-CG 4.37Å; Y662-R733 HydrophobicContact CD2-CB 3.87Å; Y662-R733 HydrophobicContact CD2-CG 4.05Å; Y662-R733 HydrophobicContact CE1-CB 4.14Å; Y662-R733 HydrophobicContact CE1-CG 4.13Å; Y662-R733 HydrophobicContact CE2-CB 4.14Å; Y662-R733 HydrophobicContact CE2-CG 3.81Å; Y662-R733 HydrophobicContact CG-CB 3.73Å; Y662-R733 HydrophobicContact CG-CG 4.32Å; K729-R733 WeakPolarHBondContact O-CB 3.47Å; K729-R733 PolarHBondContact O-N 3Å; R733-L735 VanDerWaalsContact C-N 3.34Å; R733-L735 PolarHBondContact O-N 3.32Å; R733-I736 PolarHBondContact O-N 3.39Å; R733-D737 WeakPolarHBondContact CG-OD2 3.48Å; R733-D737 IonicContact NE-OD2 2.76Å; R733-D737 VanDerWaalsContact O-CB 3.29Å; R733-D737 WeakPolarHBondContact O-CB 3.2Å; R733-D737 VanDerWaalsContact O-CG 3.25Å; R733-D737 PolarHBondContact O-N 2.83Å
734	F	91.9	Very high	90.5	Very high	27 Å²	27	37.8 Å²	37.8	12%	0.118	18%	0.176	C	C	.	.	H	α-helix	trans	-64.7	-37	178.2	-178.3	-93.4	0	0	0	112.9	R636 E730 D731 I732 Q738 I739 K812 F813	R636-F734 VanDerWaalsContact CZ-CD2 3.48Å; R636-F734 VanDerWaalsContact NH1-CB 3.3Å; R636-F734 VanDerWaalsContact NH2-CE2 3.25Å; E730-F734 PolarHBondContact O-N 3.4Å; D731-F734 PolarHBondContact O-N 3.2Å; I732-F734 VanDerWaalsContact C-N 3.28Å; I732-F734 PolarHBondContact O-N 3.37Å; F734-Q738 HydrophobicContact CD2-CB 3.67Å; F734-Q738 HydrophobicContact CD2-CG 3.62Å; F734-Q738 HydrophobicContact CE1-CB 4.46Å; F734-Q738 HydrophobicContact CE2-CB 3.48Å; F734-Q738 VanDerWaalsContact CE2-CB 3.48Å; F734-Q738 HydrophobicContact CE2-CG 3.72Å; F734-Q738 HydrophobicContact CG-CB 4.25Å; F734-Q738 HydrophobicContact CG-CG 4.45Å; F734-Q738 HydrophobicContact CZ-CB 3.9Å; F734-Q738 WeakPolarHBondContact O-CA 3.15Å; F734-Q738 VanDerWaalsContact O-CB 3.27Å; F734-Q738 WeakPolarHBondContact O-CB 3.46Å; F734-Q738 PolarHBondContact O-N 2.64Å; F734-I739 HydrophobicContact CD1-CD1 4.34Å; F734-I739 HydrophobicContact CE1-CD1 4.04Å; F734-I739 HydrophobicContact CE1-CG1 4.2Å; F734-I739 PolarHBondContact O-N 2.87Å; F734-K812 HydrophobicContact CE1-CB 3.71Å; F734-K812 HydrophobicContact CE1-CD 4.23Å; F734-K812 HydrophobicContact CE1-CG 3.76Å; F734-K812 HydrophobicContact CZ-CB 4.3Å; F734-K812 HydrophobicContact CZ-CD 3.92Å; F734-K812 HydrophobicContact CZ-CG 3.93Å; F734-F813 HydrophobicContact CD1-CE2 4.25Å; F734-F813 HydrophobicContact CD1-CZ 4.42Å
735	L	93.4	Very high	90.8	Very high	2 Å²	2	39 Å²	39	1%	0.01	18%	0.183	C	C	.	.	H	α-helix	trans	-65.3	-47.3	176.6	-174.1	141.7	0	0	0	111.3	D731 I732 R733 I739 W740 L757 P768 T771 V773 F813	D731-L735 PolarHBondContact O-N 2.85Å; I732-L735 PolarHBondContact O-N 2.85Å; R733-L735 VanDerWaalsContact C-N 3.34Å; R733-L735 PolarHBondContact O-N 3.32Å; L735-I739 HydrophobicContact CG-CD1 4.47Å; L735-I739 WeakPolarHBondContact O-CB 3.44Å; L735-I739 PolarHBondContact O-N 2.94Å; L735-W740 VanDerWaalsContact O-CD1 3.27Å; L735-W740 PolarHBondContact O-N 3.23Å; L735-W740 VanDerWaalsContact O-N 3.13Å; L735-L757 HydrophobicContact CD2-CD1 4.05Å; L735-L757 HydrophobicContact CD2-CD2 3.55Å; L735-L757 HydrophobicContact CD2-CG 4.48Å; L735-P768 HydrophobicContact CD1-CB 4Å; L735-P768 HydrophobicContact CD1-CG 4.46Å; L735-T771 HydrophobicContact CD2-CG2 4Å; L735-V773 HydrophobicContact CD2-CG2 4.34Å; L735-F813 HydrophobicContact CD1-CE2 4.37Å
736	I	94.5	Very high	91.2	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-69.5	-51.3	-179.8	-67.3	175.5	0	0	0	111.1	Y662 I665 I732 R733 W740 E741 S742 L752 L757 V773	Y662-I736 HydrophobicContact CD1-CD1 4.21Å; Y662-I736 HydrophobicContact CE1-CB 4.3Å; Y662-I736 HydrophobicContact CE1-CG2 4.28Å; I665-I736 HydrophobicContact CD1-CD1 3.47Å; I665-I736 VanDerWaalsContact CD1-CD1 3.47Å; I665-I736 HydrophobicContact CG2-CD1 4.15Å; I732-I736 HydrophobicContact CG2-CD1 3.85Å; I732-I736 HydrophobicContact CG2-CG1 4.46Å; I732-I736 PolarHBondContact O-N 3.47Å; R733-I736 PolarHBondContact O-N 3.39Å; I736-W740 CarbonylContact O-C 3.58Å; I736-W740 WeakPolarHBondContact O-CA 3.48Å; I736-W740 PolarHBondContact O-N 2.69Å; I736-E741 PolarHBondContact O-N 2.67Å; I736-S742 PolarHBondContact O-N 3.45Å; I736-L752 HydrophobicContact CD1-CD1 4.3Å; I736-L752 HydrophobicContact CG2-CD1 3.93Å; I736-L757 HydrophobicContact CD1-CD2 4.41Å; I736-L757 HydrophobicContact CG1-CD2 4.2Å; I736-V773 HydrophobicContact CG1-CG2 4.11Å
737	D	93	Very high	91.7	Very high	31 Å²	31	37.4 Å²	37.4	17%	0.166	19%	0.185	C	C	.	.	H	α-helix	trans	-79	-31.9	-171.7	-58.7	-17.8	0	0	0	114.3	Y662 R733 S742	Y662-D737 PolarHBondContact OH-OD1 3.4Å; Y662-D737 VanDerWaalsContact OH-OD1 3.09Å; Y662-D737 PolarHBondContact OH-OD2 2.96Å; R733-D737 WeakPolarHBondContact CG-OD2 3.48Å; R733-D737 IonicContact NE-OD2 2.76Å; R733-D737 VanDerWaalsContact O-CB 3.29Å; R733-D737 WeakPolarHBondContact O-CB 3.2Å; R733-D737 VanDerWaalsContact O-CG 3.25Å; R733-D737 PolarHBondContact O-N 2.83Å; D737-S742 WeakPolarHBondContact CA-OG 3.36Å; D737-S742 PolarHBondContact OD1-OG 3.07Å
738	Q	92.2	Very high	91.8	Very high	134 Å²	134	39.1 Å²	39.1	63%	0.626	20%	0.203	S	C	*	.	H	α-helix	trans	-117.1	-9.3	-167.6	-56	-74.6	-83.1	0	0	113.8	F734	F734-Q738 HydrophobicContact CD2-CB 3.67Å; F734-Q738 HydrophobicContact CD2-CG 3.62Å; F734-Q738 HydrophobicContact CE1-CB 4.46Å; F734-Q738 HydrophobicContact CE2-CB 3.48Å; F734-Q738 VanDerWaalsContact CE2-CB 3.48Å; F734-Q738 HydrophobicContact CE2-CG 3.72Å; F734-Q738 HydrophobicContact CG-CB 4.25Å; F734-Q738 HydrophobicContact CG-CG 4.45Å; F734-Q738 HydrophobicContact CZ-CB 3.9Å; F734-Q738 WeakPolarHBondContact O-CA 3.15Å; F734-Q738 VanDerWaalsContact O-CB 3.27Å; F734-Q738 WeakPolarHBondContact O-CB 3.46Å; F734-Q738 PolarHBondContact O-N 2.64Å
739	I	92.7	Very high	91.9	Very high	3 Å²	3	43.2 Å²	43.2	2%	0.015	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.9	-39.4	169.4	-61.2	166.4	0	0	0	110.3	F734 L735 R805 F813	F734-I739 HydrophobicContact CD1-CD1 4.34Å; F734-I739 HydrophobicContact CE1-CD1 4.04Å; F734-I739 HydrophobicContact CE1-CG1 4.2Å; F734-I739 PolarHBondContact O-N 2.87Å; L735-I739 HydrophobicContact CG-CD1 4.47Å; L735-I739 WeakPolarHBondContact O-CB 3.44Å; L735-I739 PolarHBondContact O-N 2.94Å; I739-R805 HydrophobicContact CG2-CB 3.88Å; I739-R805 WeakPolarHBondContact CG2-O 3.49Å; I739-R805 WeakPolarHBondContact O-CD 3.38Å; I739-R805 PolarHBondContact O-NH1 3.19Å; I739-F813 HydrophobicContact CD1-CE2 4.14Å
740	W	93.2	Very high	91.9	Very high	11 Å²	11	45.2 Å²	45.2	4%	0.042	23%	0.233	C	C	.	.	S	Bend	trans	-111.9	6	-175.2	-63.3	109.4	0	0	0	115.7	L735 I736 S742 R743 V745 T771 I772 V773 V802 R805 L806	L735-W740 VanDerWaalsContact O-CD1 3.27Å; L735-W740 PolarHBondContact O-N 3.23Å; L735-W740 VanDerWaalsContact O-N 3.13Å; I736-W740 CarbonylContact O-C 3.58Å; I736-W740 WeakPolarHBondContact O-CA 3.48Å; I736-W740 PolarHBondContact O-N 2.69Å; W740-S742 PolarHBondContact O-N 3.02Å; W740-S742 VanDerWaalsContact O-N 3.16Å; W740-R743 WeakPolarHBondContact O-CG 3.19Å; W740-R743 PolarHBondContact O-N 3.44Å; W740-V745 HydrophobicContact CD2-CG2 4.22Å; W740-V745 HydrophobicContact CE3-CG2 3.27Å; W740-V745 HydrophobicContact CH2-CG2 4.15Å; W740-V745 HydrophobicContact CZ3-CB 4.47Å; W740-V745 HydrophobicContact CZ3-CG1 4.39Å; W740-V745 HydrophobicContact CZ3-CG2 3.23Å; W740-T771 WeakPolarHBondContact CZ2-O 3.48Å; W740-I772 HydrophobicContact CH2-CG2 4.38Å; W740-V773 HydrophobicContact CB-CB 3.98Å; W740-V773 HydrophobicContact CB-CG2 3.58Å; W740-V773 VanDerWaalsContact CD1-CG2 3.41Å; W740-V773 HydrophobicContact CD2-CB 4.46Å; W740-V773 HydrophobicContact CD2-CG2 4.23Å; W740-V773 HydrophobicContact CG-CB 4.01Å; W740-V773 HydrophobicContact CG-CG2 3.45Å; W740-V773 VanDerWaalsContact CG-CG2 3.45Å; W740-V802 HydrophobicContact CH2-CB 4.33Å; W740-V802 HydrophobicContact CH2-CG1 4.11Å; W740-V802 HydrophobicContact CH2-CG2 4.15Å; W740-V802 HydrophobicContact CZ3-CG2 4.34Å; W740-R805 HydrophobicContact CD2-CB 4.22Å; W740-R805 HydrophobicContact CD2-CG 4.33Å; W740-R805 HydrophobicContact CE3-CB 3.99Å; W740-R805 HydrophobicContact CE3-CG 3.71Å; W740-R805 HydrophobicContact CH2-CB 3.37Å; W740-R805 HydrophobicContact CH2-CG 3.8Å; W740-R805 HydrophobicContact CZ2-CB 3.59Å; W740-R805 HydrophobicContact CZ2-CG 4.36Å; W740-R805 HydrophobicContact CZ3-CB 3.57Å; W740-R805 HydrophobicContact CZ3-CG 3.41Å; W740-R805 VanDerWaalsContact CZ3-CG 3.41Å; W740-L806 HydrophobicContact CZ2-CD2 4.16Å
741	E	92.5	Very high	91.9	Very high	79 Å²	79	46.7 Å²	46.7	37%	0.369	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	31.8	172.2	-65.1	156.9	-168.8	0	0	114.4	I736 R743 R805	I736-E741 PolarHBondContact O-N 2.67Å; E741-R743 VanDerWaalsContact C-N 3.26Å; E741-R743 HydrophobicContact CB-CG 4.4Å; E741-R743 PolarHBondContact O-N 3.17Å; E741-R743 IonicContact OE2-CZ 2.83Å; E741-R743 IonicContact OE2-NE 3.66Å; E741-R743 IonicContact OE2-NH2 2.74Å; E741-R743 PolarHBondContact OE2-NH2 3.21Å; E741-R805 VanDerWaalsContact CD-NH1 3.3Å; E741-R805 VanDerWaalsContact CD-NH2 3.28Å; E741-R805 IonicContact OE1-CZ 3.5Å; E741-R805 IonicContact OE1-NH1 2.86Å; E741-R805 PolarHBondContact OE1-NH1 2.88Å; E741-R805 IonicContact OE1-NH2 3.51Å; E741-R805 PolarHBondContact OE1-NH2 2.91Å; E741-R805 IonicContact OE2-CZ 3.02Å; E741-R805 IonicContact OE2-NH1 2.72Å; E741-R805 IonicContact OE2-NH2 2.78Å; E741-R805 PolarHBondContact OE2-NH2 3.19Å
742	S	91.1	Very high	91.7	Very high	44 Å²	44	48.2 Å²	48.2	31%	0.308	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	31.5	176.7	-44.3	0	0	0	0	114.9	I736 D737 W740	I736-S742 PolarHBondContact O-N 3.45Å; D737-S742 WeakPolarHBondContact CA-OG 3.36Å; D737-S742 PolarHBondContact OD1-OG 3.07Å; W740-S742 PolarHBondContact O-N 3.02Å; W740-S742 VanDerWaalsContact O-N 3.16Å
743	R	93	Very high	91.3	Very high	108 Å²	108	51.5 Å²	51.5	41%	0.408	26%	0.263	S	S	.	.	S	Bend	trans	-135.4	156.4	179.9	54.2	170.1	141	-106.1	1.5	113.2	W740 E741 W749 T750 V773	W740-R743 WeakPolarHBondContact O-CG 3.19Å; W740-R743 PolarHBondContact O-N 3.44Å; E741-R743 VanDerWaalsContact C-N 3.26Å; E741-R743 HydrophobicContact CB-CG 4.4Å; E741-R743 PolarHBondContact O-N 3.17Å; E741-R743 IonicContact OE2-CZ 2.83Å; E741-R743 IonicContact OE2-NE 3.66Å; E741-R743 IonicContact OE2-NH2 2.74Å; E741-R743 PolarHBondContact OE2-NH2 3.21Å; R743-W749 CarbonylContact C-O 3.55Å; R743-W749 VanDerWaalsContact CA-O 3.27Å; R743-W749 WeakPolarHBondContact CA-O 3.17Å; R743-T750 HydrophobicContact CB-CG2 4.26Å; R743-V773 WeakPolarHBondContact O-CG1 3.06Å
744	S	94.4	Very high	90.9	Very high	2 Å²	2	50 Å²	50	1%	0.014	26%	0.259	C	S	.	.			trans	-61.4	143.2	162.7	169.6	0	0	0	0	110.5	L746 S747 G748 W749 V773 E778	S744-L746 VanDerWaalsContact C-N 3.33Å; S744-L746 PolarHBondContact OG-N 3.48Å; S744-L746 VanDerWaalsContact OG-N 3.08Å; S744-S747 PolarHBondContact OG-N 2.99Å; S744-S747 PolarHBondContact OG-OG 3.22Å; S744-G748 VanDerWaalsContact O-CA 3.23Å; S744-G748 WeakPolarHBondContact O-CA 3.49Å; S744-G748 PolarHBondContact O-N 3.38Å; S744-W749 PolarHBondContact N-O 2.9Å; S744-V773 WeakPolarHBondContact CA-O 3.38Å; S744-E778 WeakPolarHBondContact CB-OE2 3.28Å; S744-E778 VanDerWaalsContact OG-CD 3.29Å; S744-E778 PolarHBondContact OG-OE1 2.93Å; S744-E778 PolarHBondContact OG-OE2 2.95Å
745	V	91.4	Very high	91	Very high	25 Å²	25	48.8 Å²	48.8	15%	0.152	25%	0.254	C	S	.	.	S	Bend	trans	-73.6	-24	174.9	176.4	0	0	0	0	112.6	W740 V773 L798 V802	W740-V745 HydrophobicContact CD2-CG2 4.22Å; W740-V745 HydrophobicContact CE3-CG2 3.27Å; W740-V745 HydrophobicContact CH2-CG2 4.15Å; W740-V745 HydrophobicContact CZ3-CB 4.47Å; W740-V745 HydrophobicContact CZ3-CG1 4.39Å; W740-V745 HydrophobicContact CZ3-CG2 3.23Å; V745-V773 WeakPolarHBondContact CG2-O 3.33Å; V745-V773 PolarHBondContact N-O 3.27Å; V745-L798 HydrophobicContact CG1-CD1 3.68Å; V745-V802 HydrophobicContact CG1-CG2 3.75Å
746	L	90.7	Very high	91	Very high	66 Å²	66	49 Å²	49	35%	0.346	26%	0.255	S	S	.	.	S	Bend	trans	-99.7	-63.2	-173.1	-58.2	-179.4	0	0	0	111.7	S744 V774 E778 Y794 L798	S744-L746 VanDerWaalsContact C-N 3.33Å; S744-L746 PolarHBondContact OG-N 3.48Å; S744-L746 VanDerWaalsContact OG-N 3.08Å; L746-V774 HydrophobicContact CD1-CG1 3.9Å; L746-V774 HydrophobicContact CG-CG1 3.94Å; L746-E778 HydrophobicContact CB-CG 4.44Å; L746-E778 WeakPolarHBondContact CB-OE1 3.48Å; L746-E778 HydrophobicContact CD1-CB 4.2Å; L746-E778 HydrophobicContact CD1-CG 4.27Å; L746-Y794 HydrophobicContact CD1-CE1 4.36Å; L746-Y794 HydrophobicContact CD2-CD1 4.31Å; L746-Y794 HydrophobicContact CD2-CE1 3.81Å; L746-L798 HydrophobicContact CD2-CD2 3.63Å
747	S	91	Very high	91	Very high	71 Å²	71	49.2 Å²	49.2	50%	0.497	26%	0.257	S	S	.	.	S	Bend	trans	-83	-15.4	177.2	52.1	0	0	0	0	115.1	S744 W749 E778	S744-S747 PolarHBondContact OG-N 2.99Å; S744-S747 PolarHBondContact OG-OG 3.22Å; S747-W749 PolarHBondContact O-N 3.35Å; S747-W749 WeakPolarHBondContact OG-CB 3.19Å; S747-W749 PolarHBondContact OG-N 2.79Å; S747-E778 WeakPolarHBondContact CB-OE1 3.36Å; S747-E778 PolarHBondContact N-OE1 3.46Å; S747-E778 PolarHBondContact OG-OE1 3.41Å
748	G	89.9	Confident	90.9	Very high	36 Å²	36	48.6 Å²	48.6	37%	0.371	26%	0.256	S	S	.	.			trans	73.9	6.6	-169.3	0	0	0	0	0	114.7	S744 T750	S744-G748 VanDerWaalsContact O-CA 3.23Å; S744-G748 WeakPolarHBondContact O-CA 3.49Å; S744-G748 PolarHBondContact O-N 3.38Å; G748-T750 PolarHBondContact O-N 3.41Å
749	W	89.7	Confident	90.9	Very high	131 Å²	131	43 Å²	43	50%	0.496	23%	0.229	S	C	.	.			trans	-55.8	133.1	-177.2	-166.8	-114.3	0	0	0	113.1	R743 S744 S747 D754 T775	R743-W749 CarbonylContact C-O 3.55Å; R743-W749 VanDerWaalsContact CA-O 3.27Å; R743-W749 WeakPolarHBondContact CA-O 3.17Å; S744-W749 PolarHBondContact N-O 2.9Å; S747-W749 PolarHBondContact O-N 3.35Å; S747-W749 WeakPolarHBondContact OG-CB 3.19Å; S747-W749 PolarHBondContact OG-N 2.79Å; W749-D754 PolarHBondContact NE1-OD2 3.38Å; W749-T775 HydrophobicContact CB-CG2 3.86Å; W749-T775 HydrophobicContact CG-CG2 4Å
750	T	90.7	Very high	90.8	Very high	102 Å²	102	43.7 Å²	43.7	63%	0.626	23%	0.231	S	C	*	.			trans	-108.5	-0.2	-171	55.7	0	0	0	0	114.7	R743 G748 L752	R743-T750 HydrophobicContact CB-CG2 4.26Å; G748-T750 PolarHBondContact O-N 3.41Å; T750-L752 PolarHBondContact O-N 2.97Å
751	N	87.3	Confident	90.5	Very high	57 Å²	57	46.1 Å²	46.1	31%	0.305	25%	0.245	S	C	.	.			trans	-77.2	107.7	179.7	-176.1	15.5	0	0	0	111.2	F753 D754 L755	N751-F753 PolarHBondContact O-N 3.41Å; N751-F753 PolarHBondContact OD1-N 2.7Å; N751-D754 WeakPolarHBondContact CB-OD2 3.42Å; N751-D754 VanDerWaalsContact ND2-CG 3.26Å; N751-D754 PolarHBondContact ND2-OD1 3.42Å; N751-D754 PolarHBondContact ND2-OD2 3.29Å; N751-D754 PolarHBondContact O-N 3.3Å; N751-L755 PolarHBondContact O-N 3.13Å
752	L	87.8	Confident	90.1	Very high	33 Å²	33	43.7 Å²	43.7	17%	0.173	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-18.2	-177.6	-171.5	60.8	0	0	0	114.4	P661 Y662 I665 I736 T750	P661-L752 HydrophobicContact CB-CD2 3.55Å; P661-L752 HydrophobicContact CB-CG 3.83Å; P661-L752 HydrophobicContact CG-CD2 4.17Å; Y662-L752 HydrophobicContact CD1-CD1 4.21Å; Y662-L752 HydrophobicContact CD1-CD2 4.36Å; Y662-L752 HydrophobicContact CE1-CD1 3.74Å; Y662-L752 HydrophobicContact CE1-CD2 3.67Å; Y662-L752 HydrophobicContact CE1-CG 4.32Å; Y662-L752 HydrophobicContact CE2-CD2 4.03Å; Y662-L752 VanDerWaalsContact CZ-CD2 3.47Å; Y662-L752 WeakPolarHBondContact OH-CD2 3.36Å; I665-L752 HydrophobicContact CD1-CD1 3.66Å; I665-L752 HydrophobicContact CD1-CG 4.27Å; I736-L752 HydrophobicContact CD1-CD1 4.3Å; I736-L752 HydrophobicContact CG2-CD1 3.93Å; T750-L752 PolarHBondContact O-N 2.97Å
753	F	83.5	Confident	89.5	Confident	70 Å²	70	47.8 Å²	47.8	31%	0.307	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-10.5	176.6	-65.4	-73.8	0	0	0	114.7	R397 P661 N751	R397-F753 PolarHBondContact NH1-O 3.38Å; P661-F753 HydrophobicContact CB-CE1 4.08Å; P661-F753 HydrophobicContact CB-CZ 4.38Å; P661-F753 HydrophobicContact CG-CE1 3.93Å; P661-F753 HydrophobicContact CG-CZ 3.87Å; N751-F753 PolarHBondContact O-N 3.41Å; N751-F753 PolarHBondContact OD1-N 2.7Å
754	D	86.2	Confident	88.9	Confident	18 Å²	18	46.4 Å²	46.4	10%	0.096	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-21.5	179.7	-49.2	-29.3	0	0	0	111.8	M394 R397 W749 N751 T775 R776	M394-D754 WeakPolarHBondContact CE-OD1 3.46Å; R397-D754 IonicContact NH1-OD1 2.67Å; W749-D754 PolarHBondContact NE1-OD2 3.38Å; N751-D754 WeakPolarHBondContact CB-OD2 3.42Å; N751-D754 VanDerWaalsContact ND2-CG 3.26Å; N751-D754 PolarHBondContact ND2-OD1 3.42Å; N751-D754 PolarHBondContact ND2-OD2 3.29Å; N751-D754 PolarHBondContact O-N 3.3Å; D754-T775 WeakPolarHBondContact O-CA 3.33Å; D754-R776 PolarHBondContact O-N 3.16Å
755	L	93	Very high	88.3	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	138.1	175.3	-66.3	-179	0	0	0	111.6	I665 N751 V773 T775	I665-L755 WeakPolarHBondContact CG1-O 3.22Å; N751-L755 PolarHBondContact O-N 3.13Å; L755-V773 HydrophobicContact CB-CG1 4.27Å; L755-V773 HydrophobicContact CD1-CG1 3.96Å; L755-V773 HydrophobicContact CD2-CG1 3.98Å; L755-V773 HydrophobicContact CG-CG1 4.29Å; L755-T775 HydrophobicContact CD2-CG2 4.47Å
756	T	93.1	Very high	88.3	Confident	6 Å²	6	47.6 Å²	47.6	4%	0.037	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	167.9	178.7	61.5	0	0	0	0	110.3	V774 R776	T756-V774 PolarHBondContact N-O 3.06Å; T756-V774 PolarHBondContact O-N 3.02Å; T756-V774 PolarHBondContact OG1-O 2.76Å; T756-V774 VanDerWaalsContact OG1-O 3.09Å; T756-R776 HydrophobicContact CG2-CG 3.58Å
757	L	94.2	Very high	88.2	Confident	5 Å²	5	44.5 Å²	44.5	3%	0.026	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	110.8	175.3	-60.7	178.8	0	0	0	108.7	I665 L669 I732 L735 I736 W766 T771 I772 V773	I665-L757 HydrophobicContact CG2-CD1 4.1Å; I665-L757 HydrophobicContact CG2-CG 3.83Å; L669-L757 HydrophobicContact CD1-CB 4.21Å; L669-L757 HydrophobicContact CD2-CB 4.43Å; L669-L757 HydrophobicContact CD2-CD1 4.11Å; I732-L757 HydrophobicContact CD1-CD1 3.68Å; I732-L757 HydrophobicContact CG2-CD1 4.19Å; L735-L757 HydrophobicContact CD2-CD1 4.05Å; L735-L757 HydrophobicContact CD2-CD2 3.55Å; L735-L757 HydrophobicContact CD2-CG 4.48Å; I736-L757 HydrophobicContact CD1-CD2 4.41Å; I736-L757 HydrophobicContact CG1-CD2 4.2Å; L757-W766 HydrophobicContact CD1-CZ2 4.25Å; L757-T771 HydrophobicContact CB-CG2 4.14Å; L757-T771 HydrophobicContact CD2-CG2 3.78Å; L757-T771 HydrophobicContact CG-CG2 4.41Å; L757-I772 WeakPolarHBondContact CA-O 3.38Å; L757-V773 HydrophobicContact CD2-CB 4.48Å; L757-V773 HydrophobicContact CD2-CG2 3.44Å; L757-V773 VanDerWaalsContact CD2-CG2 3.44Å
758	A	91.5	Very high	88.1	Confident	18 Å²	18	41.3 Å²	41.3	15%	0.149	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	164	173.3	0	0	0	0	0	110.5	T771 I772 V774 A779	A758-T771 CarbonylContact O-C 3.53Å; A758-T771 VanDerWaalsContact O-CA 3.27Å; A758-T771 WeakPolarHBondContact O-CA 3.46Å; A758-I772 HydrophobicContact CB-CD1 4.43Å; A758-I772 HydrophobicContact CB-CG1 4.05Å; A758-I772 PolarHBondContact N-O 2.97Å; A758-I772 VanDerWaalsContact N-O 3.16Å; A758-I772 PolarHBondContact O-N 2.85Å; A758-V774 HydrophobicContact CB-CG2 4.09Å; A758-A779 HydrophobicContact CB-CB 4.13Å
759	R	91.6	Very high	88.1	Confident	17 Å²	17	41.1 Å²	41.1	6%	0.064	21%	0.209	C	C	.	.			trans	-63.8	159.4	163.9	-64.7	178.9	178	-160	0	109.5	E673 I762 E764 W766 H782	E673-R759 IonicContact OE1-CZ 2.95Å; E673-R759 IonicContact OE1-NE 2.73Å; E673-R759 IonicContact OE1-NH2 3.89Å; E673-R759 PolarHBondContact OE1-NH2 2.86Å; E673-R759 IonicContact OE2-CZ 2.55Å; E673-R759 IonicContact OE2-NE 3.94Å; E673-R759 PolarHBondContact OE2-NE 3.37Å; E673-R759 IonicContact OE2-NH2 2.89Å; E673-R759 PolarHBondContact OE2-NH2 3.34Å; R759-I762 HydrophobicContact CB-CG1 4.47Å; R759-I762 WeakPolarHBondContact CD-O 3.31Å; R759-I762 PolarHBondContact NH1-O 3.26Å; R759-E764 WeakPolarHBondContact CD-O 3.27Å; R759-E764 PolarHBondContact NH1-O 2.73Å; R759-W766 HydrophobicContact CG-CB 3.93Å; R759-H782 PolarHBondContact O-NE2 3.01Å
760	W	90.5	Very high	88.2	Confident	16 Å²	16	35 Å²	35	6%	0.061	19%	0.186	C	C	.	.	S	Bend	trans	-105.1	-47.4	173.9	173.2	-119.8	0	0	0	111.7	N770 I772 H782 V790 Y794 I799 V802 L806	W760-N770 WeakPolarHBondContact CA-OD1 3.44Å; W760-N770 WeakPolarHBondContact CB-OD1 3.27Å; W760-N770 PolarHBondContact N-OD1 2.92Å; W760-I772 HydrophobicContact CB-CG2 4.17Å; W760-I772 HydrophobicContact CD2-CG2 3.98Å; W760-I772 HydrophobicContact CE3-CD1 4.15Å; W760-I772 HydrophobicContact CE3-CG2 3.44Å; W760-I772 VanDerWaalsContact CE3-CG2 3.44Å; W760-I772 HydrophobicContact CG-CG2 4.32Å; W760-I772 HydrophobicContact CZ3-CG2 4.08Å; W760-H782 PolarHBondContact O-CE1 3.28Å; W760-H782 PolarHBondContact O-NE2 2.94Å; W760-V790 HydrophobicContact CD2-CG1 4.25Å; W760-V790 VanDerWaalsContact CE2-CG1 3.48Å; W760-V790 HydrophobicContact CH2-CG1 3.78Å; W760-V790 HydrophobicContact CZ2-CG1 3.24Å; W760-V790 HydrophobicContact CZ3-CG1 4.43Å; W760-Y794 AromaticContact CH2-CD2 3.58Å; W760-Y794 HydrophobicContact CH2-CD2 3.58Å; W760-Y794 HydrophobicContact CH2-CE2 4.04Å; W760-Y794 HydrophobicContact CH2-CG 4.04Å; W760-Y794 AromaticContact CZ3-CD2 3.76Å; W760-Y794 HydrophobicContact CZ3-CD2 3.76Å; W760-Y794 AromaticContact CZ3-CE2 3.7Å; W760-Y794 HydrophobicContact CZ3-CE2 3.7Å; W760-Y794 HydrophobicContact CZ3-CG 4.43Å; W760-I799 HydrophobicContact CZ2-CG1 4.25Å; W760-V802 HydrophobicContact CD2-CG1 3.6Å; W760-V802 HydrophobicContact CE3-CG1 4.18Å; W760-V802 HydrophobicContact CG-CG1 3.89Å; W760-V802 HydrophobicContact CH2-CB 4.28Å; W760-V802 HydrophobicContact CH2-CG1 4.29Å; W760-V802 HydrophobicContact CH2-CG2 4.02Å; W760-V802 HydrophobicContact CZ2-CB 3.9Å; W760-V802 HydrophobicContact CZ2-CG1 3.73Å; W760-V802 HydrophobicContact CZ2-CG2 4.16Å; W760-V802 HydrophobicContact CZ3-CG1 4.49Å; W760-V802 HydrophobicContact CZ3-CG2 4.29Å; W760-L806 HydrophobicContact CB-CD1 4.48Å; W760-L806 HydrophobicContact CG-CD1 4.15Å
761	D	86.7	Confident	88.3	Confident	62 Å²	62	30.1 Å²	30.1	33%	0.332	16%	0.156	S	C	.	.	S	Bend	trans	-96.8	118.8	152.8	-176	-5.4	0	0	0	107.4	N763 E764 N770	D761-N763 PolarHBondContact O-N 2.9Å; D761-N763 VanDerWaalsContact OD1-CB 3.31Å; D761-N763 WeakPolarHBondContact OD1-CB 3.49Å; D761-N763 PolarHBondContact OD1-N 2.84Å; D761-N763 PolarHBondContact OD1-ND2 3.39Å; D761-E764 PolarHBondContact O-N 3.49Å; D761-N770 PolarHBondContact N-OD1 3.34Å; D761-N770 PolarHBondContact O-ND2 2.75Å; D761-N770 PolarHBondContact O-OD1 2.83Å
762	I	84	Confident	88.6	Confident	28 Å²	28	27.5 Å²	27.5	14%	0.144	14%	0.142	C	C	.	.	S	Bend	trans	-68.2	-22.5	-179	-66.4	163.3	0	0	0	111	L676 R759 H782	L676-I762 HydrophobicContact CD1-CG2 4.42Å; R759-I762 HydrophobicContact CB-CG1 4.47Å; R759-I762 WeakPolarHBondContact CD-O 3.31Å; R759-I762 PolarHBondContact NH1-O 3.26Å; I762-H782 WeakPolarHBondContact CD1-O 3.38Å
763	N	78.4	Confident	89	Confident	130 Å²	130	26 Å²	26	70%	0.695	13%	0.133	S	C	*	.	S	Bend	trans	-79.1	-36	179.8	-53.7	-79.1	0	0	0	112.5	D761	D761-N763 PolarHBondContact O-N 2.9Å; D761-N763 VanDerWaalsContact OD1-CB 3.31Å; D761-N763 WeakPolarHBondContact OD1-CB 3.49Å; D761-N763 PolarHBondContact OD1-N 2.84Å; D761-N763 PolarHBondContact OD1-ND2 3.39Å
764	E	81.3	Confident	89.5	Confident	79 Å²	79	22.6 Å²	22.6	37%	0.369	12%	0.119	S	C	.	.	S	Bend	trans	-73.8	140.8	170	-171.5	-172.8	168.3	0	0	109.6	R759 D761 W769 N770	R759-E764 WeakPolarHBondContact CD-O 3.27Å; R759-E764 PolarHBondContact NH1-O 2.73Å; D761-E764 PolarHBondContact O-N 3.49Å; E764-W769 PolarHBondContact OE1-NE1 3.16Å; E764-W769 VanDerWaalsContact OE1-NE1 3.12Å; E764-N770 WeakPolarHBondContact CB-ND2 3.48Å; E764-N770 HydrophobicContact CG-CB 4.5Å; E764-N770 PolarHBondContact O-ND2 3.01Å
765	P	82.7	Confident	89.8	Confident	52 Å²	52	22.6 Å²	22.6	34%	0.338	12%	0.12	S	C	.	.	P	Polyproline II helix	trans	-54.2	149.7	168.9	21.3	-34.2	0	0	0	112.9	N721 S767 N770	N721-P765 HydrophobicContact CB-CB 4.16Å; P765-S767 PolarHBondContact O-N 3.25Å; P765-N770 PolarHBondContact O-ND2 2.89Å
766	W	89.9	Confident	89.6	Confident	1 Å²	1	26.1 Å²	26.1	0%	0.004	13%	0.133	C	C	.	.	P	Polyproline II helix	trans	-58.9	135.7	178.3	178.4	89.8	0	0	0	111.9	L669 E673 N721 L723 P724 I727 L757 R759 P768 T771	L669-W766 HydrophobicContact CD1-CD2 3.7Å; L669-W766 HydrophobicContact CD1-CE3 4.45Å; L669-W766 HydrophobicContact CD1-CG 3.74Å; L669-W766 HydrophobicContact CD1-CZ2 4.3Å; L669-W766 HydrophobicContact CD2-CD2 4.01Å; L669-W766 HydrophobicContact CD2-CE3 4.18Å; L669-W766 HydrophobicContact CD2-CH2 3.61Å; L669-W766 HydrophobicContact CD2-CZ2 3.41Å; L669-W766 VanDerWaalsContact CD2-CZ2 3.41Å; L669-W766 HydrophobicContact CD2-CZ3 4Å; L669-W766 HydrophobicContact CG-CD2 4.39Å; L669-W766 HydrophobicContact CG-CZ2 4.5Å; E673-W766 PolarHBondContact OE1-N 3.44Å; N721-W766 PolarHBondContact ND2-N 2.98Å; N721-W766 VanDerWaalsContact ND2-N 3.19Å; N721-W766 PolarHBondContact ND2-O 3.02Å; L723-W766 HydrophobicContact CB-CE3 4.4Å; L723-W766 HydrophobicContact CB-CZ3 4.39Å; P724-W766 HydrophobicContact CB-CE3 4.39Å; P724-W766 HydrophobicContact CB-CZ3 4.47Å; P724-W766 HydrophobicContact CG-CD2 4.43Å; P724-W766 HydrophobicContact CG-CE3 3.65Å; P724-W766 HydrophobicContact CG-CZ3 4.17Å; I727-W766 HydrophobicContact CD1-CH2 3.56Å; I727-W766 HydrophobicContact CD1-CZ3 3.7Å; L757-W766 HydrophobicContact CD1-CZ2 4.25Å; R759-W766 HydrophobicContact CG-CB 3.93Å; W766-P768 HydrophobicContact CH2-CG 4.36Å; W766-T771 HydrophobicContact CZ2-CG2 4.44Å; W766-T771 WeakPolarHBondContact CZ2-OG1 3.49Å; W766-T771 PolarHBondContact NE1-OG1 2.83Å
767	S	89	Confident	89.3	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.157	C	C	.	.	B	Isolated β-bridge	trans	-159.6	163.6	176	74	0	0	0	0	112.2	P765 W769 N770 T771	P765-S767 PolarHBondContact O-N 3.25Å; S767-W769 VanDerWaalsContact CB-CE2 3.47Å; S767-W769 PolarHBondContact O-N 3.28Å; S767-W769 VanDerWaalsContact OG-CD2 3.28Å; S767-W769 PolarHBondContact OG-N 3.13Å; S767-W769 PolarHBondContact OG-NE1 3.48Å; S767-N770 PolarHBondContact N-O 3.24Å; S767-N770 VanDerWaalsContact N-O 3.16Å; S767-N770 CarbonylContact O-C 3.56Å; S767-N770 WeakPolarHBondContact O-CA 3.39Å; S767-N770 PolarHBondContact O-N 2.85Å; S767-N770 WeakPolarHBondContact OG-CB 3.46Å; S767-N770 PolarHBondContact OG-N 3.46Å; S767-T771 WeakPolarHBondContact O-CB 3.46Å; S767-T771 PolarHBondContact O-N 3.47Å; S767-T771 PolarHBondContact O-OG1 3.02Å
768	P	90.1	Very high	89.2	Confident	4 Å²	4	32.3 Å²	32.3	3%	0.026	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-2.2	173.1	-26.9	37.2	0	0	0	116.4	I727 L735 W766 G809 F813 L816	I727-P768 HydrophobicContact CD1-CG 3.58Å; L735-P768 HydrophobicContact CD1-CB 4Å; L735-P768 HydrophobicContact CD1-CG 4.46Å; W766-P768 HydrophobicContact CH2-CG 4.36Å; P768-G809 WeakPolarHBondContact O-CA 3.47Å; P768-F813 HydrophobicContact CB-CB 4.03Å; P768-F813 HydrophobicContact CB-CD2 3.48Å; P768-F813 VanDerWaalsContact CB-CD2 3.48Å; P768-F813 HydrophobicContact CB-CE2 4.04Å; P768-F813 HydrophobicContact CB-CG 3.77Å; P768-F813 HydrophobicContact CG-CB 4.26Å; P768-F813 HydrophobicContact CG-CD1 4.23Å; P768-F813 HydrophobicContact CG-CD2 4.02Å; P768-F813 HydrophobicContact CG-CE2 4.41Å; P768-F813 HydrophobicContact CG-CG 3.91Å; P768-L816 HydrophobicContact CG-CD2 4.01Å
769	W	89.6	Confident	89.2	Confident	33 Å²	33	32.3 Å²	32.3	13%	0.125	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.4	5.2	170.8	59.2	80.6	0	0	0	113	L723 E764 S767 K810 Y817	L723-W769 HydrophobicContact CD1-CH2 3.96Å; L723-W769 HydrophobicContact CD1-CZ2 3.96Å; E764-W769 PolarHBondContact OE1-NE1 3.16Å; E764-W769 VanDerWaalsContact OE1-NE1 3.12Å; S767-W769 VanDerWaalsContact CB-CE2 3.47Å; S767-W769 PolarHBondContact O-N 3.28Å; S767-W769 VanDerWaalsContact OG-CD2 3.28Å; S767-W769 PolarHBondContact OG-N 3.13Å; S767-W769 PolarHBondContact OG-NE1 3.48Å; W769-K810 HydrophobicContact CB-CB 3.81Å; W769-K810 HydrophobicContact CB-CD 4.24Å; W769-K810 HydrophobicContact CB-CG 4.17Å; W769-K810 HydrophobicContact CG-CD 4.41Å; W769-K810 HydrophobicContact CG-CG 4.39Å; W769-Y817 AromaticContact CD2-CD2 3.83Å; W769-Y817 HydrophobicContact CD2-CD2 3.83Å; W769-Y817 HydrophobicContact CD2-CE2 4.42Å; W769-Y817 AromaticContact CE2-CD2 3.66Å; W769-Y817 AromaticContact CE3-CD2 3.95Å; W769-Y817 HydrophobicContact CE3-CD2 3.95Å; W769-Y817 AromaticContact CH2-CD2 3.83Å; W769-Y817 HydrophobicContact CH2-CD2 3.83Å; W769-Y817 HydrophobicContact CH2-CG 4.48Å; W769-Y817 AromaticContact CZ2-CD2 3.68Å; W769-Y817 HydrophobicContact CZ2-CD2 3.68Å; W769-Y817 HydrophobicContact CZ2-CE2 4.32Å; W769-Y817 AromaticContact CZ3-CD2 3.96Å; W769-Y817 HydrophobicContact CZ3-CD2 3.96Å; W769-Y817 HydrophobicContact CZ3-CG 4.41Å
770	N	91	Very high	89.1	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.011	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-137.5	72.7	165.4	178.1	28.4	0	0	0	108.3	W760 D761 E764 P765 S767	W760-N770 WeakPolarHBondContact CA-OD1 3.44Å; W760-N770 WeakPolarHBondContact CB-OD1 3.27Å; W760-N770 PolarHBondContact N-OD1 2.92Å; D761-N770 PolarHBondContact N-OD1 3.34Å; D761-N770 PolarHBondContact O-ND2 2.75Å; D761-N770 PolarHBondContact O-OD1 2.83Å; E764-N770 WeakPolarHBondContact CB-ND2 3.48Å; E764-N770 HydrophobicContact CG-CB 4.5Å; E764-N770 PolarHBondContact O-ND2 3.01Å; P765-N770 PolarHBondContact O-ND2 2.89Å; S767-N770 PolarHBondContact N-O 3.24Å; S767-N770 VanDerWaalsContact N-O 3.16Å; S767-N770 CarbonylContact O-C 3.56Å; S767-N770 WeakPolarHBondContact O-CA 3.39Å; S767-N770 PolarHBondContact O-N 2.85Å; S767-N770 WeakPolarHBondContact OG-CB 3.46Å; S767-N770 PolarHBondContact OG-N 3.46Å
771	T	92.7	Very high	89	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.21	C	C	.	.			trans	-149.3	137.2	-178.8	-68.5	0	0	0	0	110.4	L735 W740 L757 A758 W766 S767 L806	L735-T771 HydrophobicContact CD2-CG2 4Å; W740-T771 WeakPolarHBondContact CZ2-O 3.48Å; L757-T771 HydrophobicContact CB-CG2 4.14Å; L757-T771 HydrophobicContact CD2-CG2 3.78Å; L757-T771 HydrophobicContact CG-CG2 4.41Å; A758-T771 CarbonylContact O-C 3.53Å; A758-T771 VanDerWaalsContact O-CA 3.27Å; A758-T771 WeakPolarHBondContact O-CA 3.46Å; W766-T771 HydrophobicContact CZ2-CG2 4.44Å; W766-T771 WeakPolarHBondContact CZ2-OG1 3.49Å; W766-T771 PolarHBondContact NE1-OG1 2.83Å; S767-T771 WeakPolarHBondContact O-CB 3.46Å; S767-T771 PolarHBondContact O-N 3.47Å; S767-T771 PolarHBondContact O-OG1 3.02Å; T771-L806 WeakPolarHBondContact O-CD2 3.36Å
772	I	93.9	Very high	89.2	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.01	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	151.8	159.7	49.3	171.7	0	0	0	111.3	W740 L757 A758 W760 V774 V802	W740-I772 HydrophobicContact CH2-CG2 4.38Å; L757-I772 WeakPolarHBondContact CA-O 3.38Å; A758-I772 HydrophobicContact CB-CD1 4.43Å; A758-I772 HydrophobicContact CB-CG1 4.05Å; A758-I772 PolarHBondContact N-O 2.97Å; A758-I772 VanDerWaalsContact N-O 3.16Å; A758-I772 PolarHBondContact O-N 2.85Å; W760-I772 HydrophobicContact CB-CG2 4.17Å; W760-I772 HydrophobicContact CD2-CG2 3.98Å; W760-I772 HydrophobicContact CE3-CD1 4.15Å; W760-I772 HydrophobicContact CE3-CG2 3.44Å; W760-I772 VanDerWaalsContact CE3-CG2 3.44Å; W760-I772 HydrophobicContact CG-CG2 4.32Å; W760-I772 HydrophobicContact CZ3-CG2 4.08Å; I772-V774 HydrophobicContact CD1-CG1 3.88Å; I772-V774 HydrophobicContact CD1-CG2 4.04Å; I772-V774 HydrophobicContact CG1-CG1 4.38Å; I772-V774 HydrophobicContact CG1-CG2 4.16Å; I772-V802 HydrophobicContact CG2-CG1 4.11Å; I772-V802 HydrophobicContact CG2-CG2 4.27Å
773	V	95.3	Very high	89.3	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	119.1	166.6	173.1	0	0	0	0	108.2	L735 I736 W740 R743 S744 V745 L755 L757	L735-V773 HydrophobicContact CD2-CG2 4.34Å; I736-V773 HydrophobicContact CG1-CG2 4.11Å; W740-V773 HydrophobicContact CB-CB 3.98Å; W740-V773 HydrophobicContact CB-CG2 3.58Å; W740-V773 VanDerWaalsContact CD1-CG2 3.41Å; W740-V773 HydrophobicContact CD2-CB 4.46Å; W740-V773 HydrophobicContact CD2-CG2 4.23Å; W740-V773 HydrophobicContact CG-CB 4.01Å; W740-V773 HydrophobicContact CG-CG2 3.45Å; W740-V773 VanDerWaalsContact CG-CG2 3.45Å; R743-V773 WeakPolarHBondContact O-CG1 3.06Å; S744-V773 WeakPolarHBondContact CA-O 3.38Å; V745-V773 WeakPolarHBondContact CG2-O 3.33Å; V745-V773 PolarHBondContact N-O 3.27Å; L755-V773 HydrophobicContact CB-CG1 4.27Å; L755-V773 HydrophobicContact CD1-CG1 3.96Å; L755-V773 HydrophobicContact CD2-CG1 3.98Å; L755-V773 HydrophobicContact CG-CG1 4.29Å; L757-V773 HydrophobicContact CD2-CB 4.48Å; L757-V773 HydrophobicContact CD2-CG2 3.44Å; L757-V773 VanDerWaalsContact CD2-CG2 3.44Å
774	V	94.6	Very high	89.7	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	160.5	-176.7	-79.2	0	0	0	0	110.3	L746 T756 A758 I772 E778 A779	L746-V774 HydrophobicContact CD1-CG1 3.9Å; L746-V774 HydrophobicContact CG-CG1 3.94Å; T756-V774 PolarHBondContact N-O 3.06Å; T756-V774 PolarHBondContact O-N 3.02Å; T756-V774 PolarHBondContact OG1-O 2.76Å; T756-V774 VanDerWaalsContact OG1-O 3.09Å; A758-V774 HydrophobicContact CB-CG2 4.09Å; I772-V774 HydrophobicContact CD1-CG1 3.88Å; I772-V774 HydrophobicContact CD1-CG2 4.04Å; I772-V774 HydrophobicContact CG1-CG1 4.38Å; I772-V774 HydrophobicContact CG1-CG2 4.16Å; V774-E778 WeakPolarHBondContact CA-OE2 3.45Å; V774-E778 HydrophobicContact CB-CB 3.78Å; V774-E778 WeakPolarHBondContact CB-OE2 3.44Å; V774-E778 HydrophobicContact CG1-CB 4.19Å; V774-A779 HydrophobicContact CG2-CB 3.9Å
775	T	93.4	Very high	89.9	Confident	18 Å²	18	40.2 Å²	40.2	11%	0.11	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	166.4	168.7	73.8	0	0	0	0	110.7	W749 D754 L755 E777 E778 A779	W749-T775 HydrophobicContact CB-CG2 3.86Å; W749-T775 HydrophobicContact CG-CG2 4Å; D754-T775 WeakPolarHBondContact O-CA 3.33Å; L755-T775 HydrophobicContact CD2-CG2 4.47Å; T775-E777 PolarHBondContact O-N 2.86Å; T775-E778 PolarHBondContact N-OE2 3.29Å; T775-E778 PolarHBondContact O-N 3.31Å; T775-E778 WeakPolarHBondContact OG1-CB 3.48Å; T775-E778 VanDerWaalsContact OG1-CG 3.29Å; T775-E778 WeakPolarHBondContact OG1-CG 3.28Å; T775-E778 PolarHBondContact OG1-N 2.81Å; T775-E778 PolarHBondContact OG1-OE2 3.43Å; T775-A779 WeakPolarHBondContact O-CB 3.28Å; T775-A779 PolarHBondContact O-N 3.06Å
776	R	88.1	Confident	89.6	Confident	75 Å²	75	40.4 Å²	40.4	28%	0.283	20%	0.203	S	C	.	.	H	α-helix	trans	-57.9	-46.4	176.6	-67.9	172.3	178.9	-166.7	-4.8	113	Y664 E668 D754 T756 E778 A779 E780	Y664-R776 PolarHBondContact OH-NH2 2.84Å; E668-R776 IonicContact OE1-CZ 2.84Å; E668-R776 IonicContact OE1-NH2 3.77Å; E668-R776 PolarHBondContact OE1-NH2 2.75Å; E668-R776 IonicContact OE2-CZ 3.67Å; E668-R776 IonicContact OE2-NE 3.48Å; E668-R776 IonicContact OE2-NH2 3.35Å; E668-R776 PolarHBondContact OE2-NH2 2.68Å; D754-R776 PolarHBondContact O-N 3.16Å; T756-R776 HydrophobicContact CG2-CG 3.58Å; R776-E778 VanDerWaalsContact C-N 3.34Å; R776-A779 WeakPolarHBondContact O-CB 3.37Å; R776-A779 PolarHBondContact O-N 2.82Å; R776-A779 VanDerWaalsContact O-N 3.16Å; R776-E780 PolarHBondContact O-N 2.81Å
777	E	86.6	Confident	88.9	Confident	118 Å²	118	49.8 Å²	49.8	55%	0.551	24%	0.244	S	C	*	.	H	α-helix	trans	-65.7	-40.8	-178.4	-65.5	165.4	-161	0	0	110.4	H390 T775 E780 I781	H390-E777 IonicContact ND1-OE1 2.75Å; T775-E777 PolarHBondContact O-N 2.86Å; E777-E780 PolarHBondContact O-N 2.71Å; E777-I781 WeakPolarHBondContact O-CB 3.47Å; E777-I781 WeakPolarHBondContact O-CD1 3.46Å; E777-I781 WeakPolarHBondContact O-CG1 3.24Å; E777-I781 PolarHBondContact O-N 2.85Å
778	E	92.4	Very high	88.4	Confident	24 Å²	24	54.3 Å²	54.3	11%	0.112	27%	0.268	C	S	.	.	H	α-helix	trans	-62.8	-38.3	171.3	-74	171.3	163.1	0	0	113	S744 L746 S747 V774 T775 R776 I781 H782	S744-E778 WeakPolarHBondContact CB-OE2 3.28Å; S744-E778 VanDerWaalsContact OG-CD 3.29Å; S744-E778 PolarHBondContact OG-OE1 2.93Å; S744-E778 PolarHBondContact OG-OE2 2.95Å; L746-E778 HydrophobicContact CB-CG 4.44Å; L746-E778 WeakPolarHBondContact CB-OE1 3.48Å; L746-E778 HydrophobicContact CD1-CB 4.2Å; L746-E778 HydrophobicContact CD1-CG 4.27Å; S747-E778 WeakPolarHBondContact CB-OE1 3.36Å; S747-E778 PolarHBondContact N-OE1 3.46Å; S747-E778 PolarHBondContact OG-OE1 3.41Å; V774-E778 WeakPolarHBondContact CA-OE2 3.45Å; V774-E778 HydrophobicContact CB-CB 3.78Å; V774-E778 WeakPolarHBondContact CB-OE2 3.44Å; V774-E778 HydrophobicContact CG1-CB 4.19Å; T775-E778 PolarHBondContact N-OE2 3.29Å; T775-E778 PolarHBondContact O-N 3.31Å; T775-E778 WeakPolarHBondContact OG1-CB 3.48Å; T775-E778 VanDerWaalsContact OG1-CG 3.29Å; T775-E778 WeakPolarHBondContact OG1-CG 3.28Å; T775-E778 PolarHBondContact OG1-N 2.81Å; T775-E778 PolarHBondContact OG1-OE2 3.43Å; R776-E778 VanDerWaalsContact C-N 3.34Å; E778-I781 PolarHBondContact O-N 2.95Å; E778-H782 WeakPolarHBondContact O-CB 3.21Å; E778-H782 PolarHBondContact O-N 3.06Å
779	A	91.5	Very high	87.9	Confident	18 Å²	18	59.8 Å²	59.8	15%	0.149	29%	0.291	C	S	.	.	H	α-helix	trans	-67.4	-42.1	176.6	0	0	0	0	0	112.1	A758 V774 T775 R776 H782 E783	A758-A779 HydrophobicContact CB-CB 4.13Å; V774-A779 HydrophobicContact CG2-CB 3.9Å; T775-A779 WeakPolarHBondContact O-CB 3.28Å; T775-A779 PolarHBondContact O-N 3.06Å; R776-A779 WeakPolarHBondContact O-CB 3.37Å; R776-A779 PolarHBondContact O-N 2.82Å; R776-A779 VanDerWaalsContact O-N 3.16Å; A779-H782 PolarHBondContact O-N 3.18Å; A779-E783 PolarHBondContact O-N 2.65Å
780	E	88.9	Confident	87.6	Confident	127 Å²	127	59.9 Å²	59.9	59%	0.593	30%	0.295	S	S	*	.	H	α-helix	trans	-65.2	-40.1	174.4	-71.9	178.6	-158.2	0	0	111.4	R776 E777 E783 N784	R776-E780 PolarHBondContact O-N 2.81Å; E777-E780 PolarHBondContact O-N 2.71Å; E780-E783 PolarHBondContact O-N 3.44Å; E780-N784 PolarHBondContact O-N 3.42Å; E780-N784 PolarHBondContact O-ND2 3.16Å
781	I	89.5	Confident	87.2	Confident	107 Å²	107	66.7 Å²	66.7	55%	0.549	33%	0.327	S	S	.	.	H	α-helix	trans	-62.7	-45.4	173.3	-69.5	163.3	0	0	0	110.7	E777 E778 E783 N784 L785	E777-I781 WeakPolarHBondContact O-CB 3.47Å; E777-I781 WeakPolarHBondContact O-CD1 3.46Å; E777-I781 WeakPolarHBondContact O-CG1 3.24Å; E777-I781 PolarHBondContact O-N 2.85Å; E778-I781 PolarHBondContact O-N 2.95Å; I781-E783 PolarHBondContact O-N 2.8Å; I781-N784 PolarHBondContact O-N 3.47Å; I781-L785 HydrophobicContact CG2-CD1 4.15Å; I781-L785 WeakPolarHBondContact O-CG 3.31Å; I781-L785 PolarHBondContact O-N 3.22Å; I781-L785 VanDerWaalsContact O-N 3.14Å
782	H	90.9	Very high	86.8	Confident	10 Å²	10	72.2 Å²	72.2	5%	0.046	35%	0.353	C	S	.	.	H	α-helix	trans	-60.3	-43.3	176.1	-178.7	74.8	0	0	0	111.9	R759 W760 I762 E778 A779 N784 L785 Y794	R759-H782 PolarHBondContact O-NE2 3.01Å; W760-H782 PolarHBondContact O-CE1 3.28Å; W760-H782 PolarHBondContact O-NE2 2.94Å; I762-H782 WeakPolarHBondContact CD1-O 3.38Å; E778-H782 WeakPolarHBondContact O-CB 3.21Å; E778-H782 PolarHBondContact O-N 3.06Å; A779-H782 PolarHBondContact O-N 3.18Å; H782-N784 VanDerWaalsContact C-N 3.33Å; H782-N784 PolarHBondContact O-N 3.27Å; H782-L785 PolarHBondContact O-N 2.95Å; H782-L785 VanDerWaalsContact O-N 3.14Å; H782-Y794 AromaticContact CE1-CE2 3.97Å; H782-Y794 AromaticContact ND1-CE2 3.64Å; H782-Y794 AromaticContact ND1-CZ 3.71Å; H782-Y794 PolarHBondContact ND1-OH 3.2Å
783	E	86.7	Confident	86.4	Confident	62 Å²	62	74 Å²	74	29%	0.29	36%	0.363	S	S	.	.	H	α-helix	trans	-62.7	-39.3	176.7	-159.9	-168.9	139	0	0	112.3	L676 K679 A779 E780 I781 L785 S786	L676-E783 HydrophobicContact CD1-CG 4.21Å; K679-E783 IonicContact NZ-OE1 2.68Å; K679-E783 PolarHBondContact NZ-OE1 2.71Å; A779-E783 PolarHBondContact O-N 2.65Å; E780-E783 PolarHBondContact O-N 3.44Å; I781-E783 PolarHBondContact O-N 2.8Å; E783-L785 VanDerWaalsContact C-N 3.25Å; E783-L785 PolarHBondContact O-N 3.29Å; E783-S786 WeakPolarHBondContact O-CB 3.29Å; E783-S786 PolarHBondContact O-N 2.95Å; E783-S786 PolarHBondContact O-OG 3.26Å
784	N	85.8	Confident	86.1	Confident	126 Å²	126	75.4 Å²	75.4	67%	0.674	37%	0.369	S	S	*	.	H	α-helix	trans	-68.5	-22	176.9	-75.2	-58.6	0	0	0	113.5	E780 I781 H782 S786	E780-N784 PolarHBondContact O-N 3.42Å; E780-N784 PolarHBondContact O-ND2 3.16Å; I781-N784 PolarHBondContact O-N 3.47Å; H782-N784 VanDerWaalsContact C-N 3.33Å; H782-N784 PolarHBondContact O-N 3.27Å; N784-S786 VanDerWaalsContact C-N 3.34Å
785	L	84.8	Confident	85.9	Confident	66 Å²	66	78.7 Å²	78.7	35%	0.346	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-2.9	175.6	-69.2	171.7	0	0	0	114	I781 H782 E783 K787 L788 T793	I781-L785 HydrophobicContact CG2-CD1 4.15Å; I781-L785 WeakPolarHBondContact O-CG 3.31Å; I781-L785 PolarHBondContact O-N 3.22Å; I781-L785 VanDerWaalsContact O-N 3.14Å; H782-L785 PolarHBondContact O-N 2.95Å; H782-L785 VanDerWaalsContact O-N 3.14Å; E783-L785 VanDerWaalsContact C-N 3.25Å; E783-L785 PolarHBondContact O-N 3.29Å; L785-K787 PolarHBondContact O-N 2.86Å; L785-L788 PolarHBondContact O-N 2.83Å; L785-T793 HydrophobicContact CB-CG2 4.16Å
786	S	76.4	Confident	85.8	Confident	55 Å²	55	84 Å²	84	39%	0.385	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.8	-18.5	-179.7	49.5	0	0	0	0	117.7	E783 N784 L788	E783-S786 WeakPolarHBondContact O-CB 3.29Å; E783-S786 PolarHBondContact O-N 2.95Å; E783-S786 PolarHBondContact O-OG 3.26Å; N784-S786 VanDerWaalsContact C-N 3.34Å; S786-L788 VanDerWaalsContact C-N 3.34Å
787	K	75.4	Confident	86	Confident	198 Å²	198	85.3 Å²	85.3	86%	0.861	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-15	178	-63.3	-174.9	177.8	-175.3	0	114	L785	L785-K787 PolarHBondContact O-N 2.86Å
788	L	79.9	Confident	86.2	Confident	95 Å²	95	81.6 Å²	81.6	50%	0.497	43%	0.426	S	S	.	.	S	Bend	trans	-106.8	156.5	177.3	-63.2	174.2	0	0	0	109.4	L785 S786 T793	L785-L788 PolarHBondContact O-N 2.83Å; S786-L788 VanDerWaalsContact C-N 3.34Å; L788-T793 HydrophobicContact CB-CG2 3.53Å; L788-T793 HydrophobicContact CD1-CG2 3.88Å; L788-T793 HydrophobicContact CG-CG2 4.35Å
789	K	79	Confident	86.2	Confident	120 Å²	120	81.4 Å²	81.4	52%	0.522	43%	0.425	S	S	.	.			trans	-70	155.4	173.6	-65.7	-179.6	179.5	175.1	0	111.2	E791 E792 T793	K789-E791 HydrophobicContact CB-CB 4.37Å; K789-E791 PolarHBondContact O-N 3.17Å; K789-E792 HydrophobicContact CB-CB 4.32Å; K789-E792 HydrophobicContact CB-CG 4Å; K789-E792 PolarHBondContact N-OE2 2.91Å; K789-E792 PolarHBondContact O-N 2.83Å; K789-T793 PolarHBondContact O-N 2.79Å; K789-T793 VanDerWaalsContact O-N 3.15Å; K789-T793 PolarHBondContact O-OG1 3.22Å
790	V	82.6	Confident	86.3	Confident	35 Å²	35	84.4 Å²	84.4	21%	0.212	45%	0.445	C	S	.	.	H	α-helix	trans	-55.1	-38	169.3	-179.2	0	0	0	0	111	W760 E792 T793 Y794 I799	W760-V790 HydrophobicContact CD2-CG1 4.25Å; W760-V790 VanDerWaalsContact CE2-CG1 3.48Å; W760-V790 HydrophobicContact CH2-CG1 3.78Å; W760-V790 HydrophobicContact CZ2-CG1 3.24Å; W760-V790 HydrophobicContact CZ3-CG1 4.43Å; V790-E792 VanDerWaalsContact C-N 3.26Å; V790-E792 PolarHBondContact O-N 2.84Å; V790-T793 WeakPolarHBondContact CA-OG1 3.42Å; V790-T793 PolarHBondContact O-N 3.06Å; V790-T793 PolarHBondContact O-OG1 3.08Å; V790-Y794 HydrophobicContact CG1-CD2 4.31Å; V790-Y794 PolarHBondContact O-N 3.39Å; V790-I799 HydrophobicContact CG1-CG1 4.49Å
791	E	82.9	Confident	86.5	Confident	145 Å²	145	81.4 Å²	81.4	68%	0.678	43%	0.433	S	S	*	.	H	α-helix	trans	-66.1	-21.5	176.1	-58.9	169.9	151.7	0	0	113.9	K789	K789-E791 HydrophobicContact CB-CB 4.37Å; K789-E791 PolarHBondContact O-N 3.17Å
792	E	83.8	Confident	86.7	Confident	116 Å²	116	76.3 Å²	76.3	54%	0.542	41%	0.407	S	S	.	.	H	α-helix	trans	-101	-13.4	-177.8	-66	160.6	179	0	0	112.2	K789 V790	K789-E792 HydrophobicContact CB-CB 4.32Å; K789-E792 HydrophobicContact CB-CG 4Å; K789-E792 PolarHBondContact N-OE2 2.91Å; K789-E792 PolarHBondContact O-N 2.83Å; V790-E792 VanDerWaalsContact C-N 3.26Å; V790-E792 PolarHBondContact O-N 2.84Å
793	T	85.1	Confident	86.8	Confident	38 Å²	38	79.2 Å²	79.2	23%	0.233	42%	0.423	C	S	.	.	H	α-helix	trans	-106.9	-25.4	-173.4	43.5	0	0	0	0	113.9	L785 L788 K789 V790	L785-T793 HydrophobicContact CB-CG2 4.16Å; L788-T793 HydrophobicContact CB-CG2 3.53Å; L788-T793 HydrophobicContact CD1-CG2 3.88Å; L788-T793 HydrophobicContact CG-CG2 4.35Å; K789-T793 PolarHBondContact O-N 2.79Å; K789-T793 VanDerWaalsContact O-N 3.15Å; K789-T793 PolarHBondContact O-OG1 3.22Å; V790-T793 WeakPolarHBondContact CA-OG1 3.42Å; V790-T793 PolarHBondContact O-N 3.06Å; V790-T793 PolarHBondContact O-OG1 3.08Å
794	Y	90	Very high	87.2	Confident	31 Å²	31	81.9 Å²	81.9	12%	0.122	44%	0.435	C	S	.	.	S	Bend	trans	-128.4	148.6	-177.5	-63.5	-68.9	0	0	0	111.8	L746 W760 H782 V790 L798 I799	L746-Y794 HydrophobicContact CD1-CE1 4.36Å; L746-Y794 HydrophobicContact CD2-CD1 4.31Å; L746-Y794 HydrophobicContact CD2-CE1 3.81Å; W760-Y794 AromaticContact CH2-CD2 3.58Å; W760-Y794 HydrophobicContact CH2-CD2 3.58Å; W760-Y794 HydrophobicContact CH2-CE2 4.04Å; W760-Y794 HydrophobicContact CH2-CG 4.04Å; W760-Y794 AromaticContact CZ3-CD2 3.76Å; W760-Y794 HydrophobicContact CZ3-CD2 3.76Å; W760-Y794 AromaticContact CZ3-CE2 3.7Å; W760-Y794 HydrophobicContact CZ3-CE2 3.7Å; W760-Y794 HydrophobicContact CZ3-CG 4.43Å; H782-Y794 AromaticContact CE1-CE2 3.97Å; H782-Y794 AromaticContact ND1-CE2 3.64Å; H782-Y794 AromaticContact ND1-CZ 3.71Å; H782-Y794 PolarHBondContact ND1-OH 3.2Å; V790-Y794 HydrophobicContact CG1-CD2 4.31Å; V790-Y794 PolarHBondContact O-N 3.39Å; Y794-L798 HydrophobicContact CD1-CD2 3.56Å; Y794-L798 HydrophobicContact CE1-CD2 4.33Å; Y794-L798 HydrophobicContact CG-CD2 4.12Å; Y794-I799 VanDerWaalsContact O-CD1 3.28Å; Y794-I799 WeakPolarHBondContact O-CD1 3.45Å
795	A	90.7	Very high	87.5	Confident	68 Å²	68	77.8 Å²	77.8	56%	0.562	41%	0.41	S	S	*	.			trans	-75.8	147.6	177.8	0	0	0	0	0	112.2	P797 L798 I799	A795-P797 VanDerWaalsContact C-N 3.34Å; A795-P797 WeakPolarHBondContact O-CD 3.44Å; A795-P797 VanDerWaalsContact O-N 3.1Å; A795-L798 WeakPolarHBondContact O-CB 3.43Å; A795-L798 PolarHBondContact O-N 2.88Å; A795-I799 PolarHBondContact O-N 3.33Å
796	D	90.9	Very high	87.9	Confident	131 Å²	131	75.3 Å²	75.3	70%	0.701	40%	0.397	S	S	*	.	H	α-helix	trans	-46.4	-41.3	-177.3	-57.5	-51.9	0	0	0	115.8	L798 I799 S800	D796-L798 VanDerWaalsContact C-N 3.26Å; D796-L798 PolarHBondContact O-N 3.18Å; D796-I799 PolarHBondContact O-N 3.42Å; D796-S800 VanDerWaalsContact O-CB 3.26Å; D796-S800 WeakPolarHBondContact O-CB 3.36Å; D796-S800 PolarHBondContact O-N 2.74Å
797	P	91.9	Very high	88.6	Confident	102 Å²	102	77.6 Å²	77.6	66%	0.662	40%	0.404	S	S	*	.	H	α-helix	trans	-62.6	-34.4	179.6	-22.7	35.1	0	0	0	112.8	A795 L801	A795-P797 VanDerWaalsContact C-N 3.34Å; A795-P797 WeakPolarHBondContact O-CD 3.44Å; A795-P797 VanDerWaalsContact O-N 3.1Å; P797-L801 WeakPolarHBondContact O-CB 3.46Å; P797-L801 PolarHBondContact O-N 3.13Å
798	L	92	Very high	89.4	Confident	39 Å²	39	71.5 Å²	71.5	20%	0.204	38%	0.38	C	S	.	.	H	α-helix	trans	-76.2	-42.7	178.8	-174.8	63.7	0	0	0	111.1	V745 L746 Y794 A795 D796 S800 L801 V802	V745-L798 HydrophobicContact CG1-CD1 3.68Å; L746-L798 HydrophobicContact CD2-CD2 3.63Å; Y794-L798 HydrophobicContact CD1-CD2 3.56Å; Y794-L798 HydrophobicContact CE1-CD2 4.33Å; Y794-L798 HydrophobicContact CG-CD2 4.12Å; A795-L798 WeakPolarHBondContact O-CB 3.43Å; A795-L798 PolarHBondContact O-N 2.88Å; D796-L798 VanDerWaalsContact C-N 3.26Å; D796-L798 PolarHBondContact O-N 3.18Å; L798-S800 VanDerWaalsContact C-N 3.31Å; L798-S800 PolarHBondContact O-N 2.98Å; L798-L801 PolarHBondContact O-N 2.91Å; L798-V802 WeakPolarHBondContact O-CB 3.42Å; L798-V802 WeakPolarHBondContact O-CG2 3.38Å; L798-V802 PolarHBondContact O-N 2.8Å
799	I	92.1	Very high	89.7	Confident	21 Å²	21	67 Å²	67	11%	0.108	36%	0.357	C	S	.	.	H	α-helix	trans	-59.9	-43.8	173.7	-63	175.7	0	0	0	110.3	W760 V790 Y794 A795 D796 V802 N803	W760-I799 HydrophobicContact CZ2-CG1 4.25Å; V790-I799 HydrophobicContact CG1-CG1 4.49Å; Y794-I799 VanDerWaalsContact O-CD1 3.28Å; Y794-I799 WeakPolarHBondContact O-CD1 3.45Å; A795-I799 PolarHBondContact O-N 3.33Å; D796-I799 PolarHBondContact O-N 3.42Å; I799-V802 PolarHBondContact O-N 2.9Å; I799-N803 VanDerWaalsContact O-CB 3.31Å; I799-N803 WeakPolarHBondContact O-CB 3.49Å; I799-N803 VanDerWaalsContact O-CG 3.23Å; I799-N803 PolarHBondContact O-N 2.72Å; I799-N803 PolarHBondContact O-ND2 3.1Å
800	S	92.9	Very high	90.1	Very high	80 Å²	80	64.9 Å²	64.9	56%	0.559	35%	0.348	S	S	*	.	H	α-helix	trans	-63	-45.7	177.3	-164.7	0	0	0	0	112.1	D796 L798 N803 Q804	D796-S800 VanDerWaalsContact O-CB 3.26Å; D796-S800 WeakPolarHBondContact O-CB 3.36Å; D796-S800 PolarHBondContact O-N 2.74Å; L798-S800 VanDerWaalsContact C-N 3.31Å; L798-S800 PolarHBondContact O-N 2.98Å; S800-N803 PolarHBondContact O-N 3.03Å; S800-Q804 WeakPolarHBondContact O-CB 3.03Å; S800-Q804 PolarHBondContact O-N 2.85Å
801	L	93.2	Very high	90.4	Very high	65 Å²	65	67.9 Å²	67.9	34%	0.34	36%	0.363	S	S	.	.	H	α-helix	trans	-58.9	-49	174.5	175.3	63.1	0	0	0	111.7	P797 L798 Q804 R805	P797-L801 WeakPolarHBondContact O-CB 3.46Å; P797-L801 PolarHBondContact O-N 3.13Å; L798-L801 PolarHBondContact O-N 2.91Å; L801-Q804 WeakPolarHBondContact O-CB 3.49Å; L801-Q804 PolarHBondContact O-N 2.91Å; L801-R805 WeakPolarHBondContact O-CG 3.18Å; L801-R805 PolarHBondContact O-N 2.66Å; L801-R805 VanDerWaalsContact O-N 3.1Å
802	V	93.6	Very high	90.6	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-60.5	-51.3	178.2	168	0	0	0	0	110.4	W740 V745 W760 I772 L798 I799 Q804 R805 L806	W740-V802 HydrophobicContact CH2-CB 4.33Å; W740-V802 HydrophobicContact CH2-CG1 4.11Å; W740-V802 HydrophobicContact CH2-CG2 4.15Å; W740-V802 HydrophobicContact CZ3-CG2 4.34Å; V745-V802 HydrophobicContact CG1-CG2 3.75Å; W760-V802 HydrophobicContact CD2-CG1 3.6Å; W760-V802 HydrophobicContact CE3-CG1 4.18Å; W760-V802 HydrophobicContact CG-CG1 3.89Å; W760-V802 HydrophobicContact CH2-CB 4.28Å; W760-V802 HydrophobicContact CH2-CG1 4.29Å; W760-V802 HydrophobicContact CH2-CG2 4.02Å; W760-V802 HydrophobicContact CZ2-CB 3.9Å; W760-V802 HydrophobicContact CZ2-CG1 3.73Å; W760-V802 HydrophobicContact CZ2-CG2 4.16Å; W760-V802 HydrophobicContact CZ3-CG1 4.49Å; W760-V802 HydrophobicContact CZ3-CG2 4.29Å; I772-V802 HydrophobicContact CG2-CG1 4.11Å; I772-V802 HydrophobicContact CG2-CG2 4.27Å; L798-V802 WeakPolarHBondContact O-CB 3.42Å; L798-V802 WeakPolarHBondContact O-CG2 3.38Å; L798-V802 PolarHBondContact O-N 2.8Å; I799-V802 PolarHBondContact O-N 2.9Å; V802-Q804 VanDerWaalsContact C-N 3.26Å; V802-Q804 PolarHBondContact O-N 2.88Å; V802-R805 CarbonylContact O-C 3.19Å; V802-R805 WeakPolarHBondContact O-CA 3.41Å; V802-R805 WeakPolarHBondContact O-CB 3.4Å; V802-R805 PolarHBondContact O-N 3.11Å; V802-L806 HydrophobicContact CG1-CD1 3.78Å; V802-L806 HydrophobicContact CG1-CG 3.97Å; V802-L806 WeakPolarHBondContact O-CG 3.31Å; V802-L806 PolarHBondContact O-N 3.17Å
803	N	93.4	Very high	90.8	Very high	71 Å²	71	61.2 Å²	61.2	38%	0.38	33%	0.329	S	S	.	.	H	α-helix	trans	-56.5	-38.7	178.4	-74.6	-22.1	0	0	0	112.4	I799 S800 L806 I807	I799-N803 VanDerWaalsContact O-CB 3.31Å; I799-N803 WeakPolarHBondContact O-CB 3.49Å; I799-N803 VanDerWaalsContact O-CG 3.23Å; I799-N803 PolarHBondContact O-N 2.72Å; I799-N803 PolarHBondContact O-ND2 3.1Å; S800-N803 PolarHBondContact O-N 3.03Å; N803-L806 PolarHBondContact O-N 2.97Å; N803-I807 WeakPolarHBondContact O-CB 3.43Å; N803-I807 WeakPolarHBondContact O-CD1 3.25Å; N803-I807 VanDerWaalsContact O-CG1 3.25Å; N803-I807 WeakPolarHBondContact O-CG1 3.35Å; N803-I807 PolarHBondContact O-N 2.84Å
804	Q	94.2	Very high	90.7	Very high	118 Å²	118	62.8 Å²	62.8	55%	0.551	34%	0.336	S	S	*	.	H	α-helix	trans	-60.9	-44.3	172.7	-169.5	-174.7	13.9	0	0	112	S800 L801 V802 I807 L808	S800-Q804 WeakPolarHBondContact O-CB 3.03Å; S800-Q804 PolarHBondContact O-N 2.85Å; L801-Q804 WeakPolarHBondContact O-CB 3.49Å; L801-Q804 PolarHBondContact O-N 2.91Å; V802-Q804 VanDerWaalsContact C-N 3.26Å; V802-Q804 PolarHBondContact O-N 2.88Å; Q804-I807 PolarHBondContact O-N 3.25Å; Q804-L808 WeakPolarHBondContact O-CG 3.49Å; Q804-L808 PolarHBondContact O-N 2.83Å; Q804-L808 VanDerWaalsContact O-N 3.08Å
805	R	93.4	Very high	90.1	Very high	39 Å²	39	65 Å²	65	15%	0.147	35%	0.346	C	S	.	.	H	α-helix	trans	-67.2	-40	176.9	-59	-35.9	-179.7	126.2	-8.2	112.3	I739 W740 E741 L801 V802 I807 L808 G809	I739-R805 HydrophobicContact CG2-CB 3.88Å; I739-R805 WeakPolarHBondContact CG2-O 3.49Å; I739-R805 WeakPolarHBondContact O-CD 3.38Å; I739-R805 PolarHBondContact O-NH1 3.19Å; W740-R805 HydrophobicContact CD2-CB 4.22Å; W740-R805 HydrophobicContact CD2-CG 4.33Å; W740-R805 HydrophobicContact CE3-CB 3.99Å; W740-R805 HydrophobicContact CE3-CG 3.71Å; W740-R805 HydrophobicContact CH2-CB 3.37Å; W740-R805 HydrophobicContact CH2-CG 3.8Å; W740-R805 HydrophobicContact CZ2-CB 3.59Å; W740-R805 HydrophobicContact CZ2-CG 4.36Å; W740-R805 HydrophobicContact CZ3-CB 3.57Å; W740-R805 HydrophobicContact CZ3-CG 3.41Å; W740-R805 VanDerWaalsContact CZ3-CG 3.41Å; E741-R805 VanDerWaalsContact CD-NH1 3.3Å; E741-R805 VanDerWaalsContact CD-NH2 3.28Å; E741-R805 IonicContact OE1-CZ 3.5Å; E741-R805 IonicContact OE1-NH1 2.86Å; E741-R805 PolarHBondContact OE1-NH1 2.88Å; E741-R805 IonicContact OE1-NH2 3.51Å; E741-R805 PolarHBondContact OE1-NH2 2.91Å; E741-R805 IonicContact OE2-CZ 3.02Å; E741-R805 IonicContact OE2-NH1 2.72Å; E741-R805 IonicContact OE2-NH2 2.78Å; E741-R805 PolarHBondContact OE2-NH2 3.19Å; L801-R805 WeakPolarHBondContact O-CG 3.18Å; L801-R805 PolarHBondContact O-N 2.66Å; L801-R805 VanDerWaalsContact O-N 3.1Å; V802-R805 CarbonylContact O-C 3.19Å; V802-R805 WeakPolarHBondContact O-CA 3.41Å; V802-R805 WeakPolarHBondContact O-CB 3.4Å; V802-R805 PolarHBondContact O-N 3.11Å; R805-I807 VanDerWaalsContact C-N 3.35Å; R805-I807 PolarHBondContact O-N 3.49Å; R805-L808 WeakPolarHBondContact O-CB 3.43Å; R805-L808 PolarHBondContact O-N 2.64Å; R805-G809 PolarHBondContact O-N 2.83Å
806	L	92.8	Very high	89.7	Confident	15 Å²	15	62.1 Å²	62.1	8%	0.079	32%	0.321	C	S	.	.	H	α-helix	trans	-62.5	-39.6	175.4	-62.7	-180	0	0	0	112	W740 W760 T771 V802 N803 G809 K810	W740-L806 HydrophobicContact CZ2-CD2 4.16Å; W760-L806 HydrophobicContact CB-CD1 4.48Å; W760-L806 HydrophobicContact CG-CD1 4.15Å; T771-L806 WeakPolarHBondContact O-CD2 3.36Å; V802-L806 HydrophobicContact CG1-CD1 3.78Å; V802-L806 HydrophobicContact CG1-CG 3.97Å; V802-L806 WeakPolarHBondContact O-CG 3.31Å; V802-L806 PolarHBondContact O-N 3.17Å; N803-L806 PolarHBondContact O-N 2.97Å; L806-G809 PolarHBondContact O-N 2.73Å; L806-K810 WeakPolarHBondContact O-CB 3.25Å; L806-K810 PolarHBondContact O-N 2.78Å
807	I	91.9	Very high	89	Confident	102 Å²	102	59.2 Å²	59.2	52%	0.523	30%	0.301	S	S	.	.	H	α-helix	trans	-64.8	-41.1	173.6	-70.1	164.5	0	0	0	111.2	N803 Q804 R805 G809 K810 N811	N803-I807 WeakPolarHBondContact O-CB 3.43Å; N803-I807 WeakPolarHBondContact O-CD1 3.25Å; N803-I807 VanDerWaalsContact O-CG1 3.25Å; N803-I807 WeakPolarHBondContact O-CG1 3.35Å; N803-I807 PolarHBondContact O-N 2.84Å; Q804-I807 PolarHBondContact O-N 3.25Å; R805-I807 VanDerWaalsContact C-N 3.35Å; R805-I807 PolarHBondContact O-N 3.49Å; I807-G809 VanDerWaalsContact C-N 3.35Å; I807-K810 PolarHBondContact O-N 2.83Å; I807-N811 WeakPolarHBondContact O-CB 3.34Å; I807-N811 PolarHBondContact O-N 2.87Å; I807-N811 PolarHBondContact O-ND2 3.14Å
808	L	90.8	Very high	88.2	Confident	70 Å²	70	62.5 Å²	62.5	37%	0.366	30%	0.3	S	S	.	.	H	α-helix	trans	-61.2	-43.8	172.8	-70	169.7	0	0	0	111	Q804 R805 N811 K812	Q804-L808 WeakPolarHBondContact O-CG 3.49Å; Q804-L808 PolarHBondContact O-N 2.83Å; Q804-L808 VanDerWaalsContact O-N 3.08Å; R805-L808 WeakPolarHBondContact O-CB 3.43Å; R805-L808 PolarHBondContact O-N 2.64Å; L808-N811 PolarHBondContact O-N 3.31Å; L808-K812 VanDerWaalsContact O-CG 3.23Å; L808-K812 WeakPolarHBondContact O-CG 3.32Å; L808-K812 PolarHBondContact O-N 3.33Å
809	G	87.4	Confident	87.1	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-57.2	-54.6	173	0	0	0	0	0	113.1	P768 R805 L806 I807 N811 K812 F813	P768-G809 WeakPolarHBondContact O-CA 3.47Å; R805-G809 PolarHBondContact O-N 2.83Å; L806-G809 PolarHBondContact O-N 2.73Å; I807-G809 VanDerWaalsContact C-N 3.35Å; G809-N811 VanDerWaalsContact C-N 3.25Å; G809-N811 PolarHBondContact O-N 3Å; G809-K812 PolarHBondContact O-N 2.89Å; G809-K812 VanDerWaalsContact O-N 3.11Å; G809-F813 WeakPolarHBondContact O-CB 3.31Å; G809-F813 WeakPolarHBondContact O-CD2 3.48Å; G809-F813 PolarHBondContact O-N 3.1Å
810	K	87	Confident	85.8	Confident	76 Å²	76	64.4 Å²	64.4	33%	0.33	31%	0.312	S	S	.	.	H	α-helix	trans	-50.8	-43.7	176.5	-163.4	164.5	-175.6	156.1	0	112.6	W769 L806 I807 F813 I814 Y817	W769-K810 HydrophobicContact CB-CB 3.81Å; W769-K810 HydrophobicContact CB-CD 4.24Å; W769-K810 HydrophobicContact CB-CG 4.17Å; W769-K810 HydrophobicContact CG-CD 4.41Å; W769-K810 HydrophobicContact CG-CG 4.39Å; L806-K810 WeakPolarHBondContact O-CB 3.25Å; L806-K810 PolarHBondContact O-N 2.78Å; I807-K810 PolarHBondContact O-N 2.83Å; K810-F813 CarbonylContact O-C 3.48Å; K810-I814 WeakPolarHBondContact O-CA 3.15Å; K810-I814 PolarHBondContact O-N 3.42Å; K810-I814 VanDerWaalsContact O-N 3.12Å; K810-Y817 HydrophobicContact CD-CE2 4.44Å; K810-Y817 WeakPolarHBondContact CE-OH 3.46Å; K810-Y817 HydrophobicContact CG-CD2 4.37Å; K810-Y817 PolarHBondContact NZ-OH 3Å; K810-Y817 VanDerWaalsContact NZ-OH 3.15Å
811	N	88	Confident	84.4	Confident	99 Å²	99	64.5 Å²	64.5	53%	0.529	31%	0.306	S	S	.	.	H	α-helix	trans	-71.5	-40.7	179.2	-75	-39.8	0	0	0	113.2	I807 L808 G809	I807-N811 WeakPolarHBondContact O-CB 3.34Å; I807-N811 PolarHBondContact O-N 2.87Å; I807-N811 PolarHBondContact O-ND2 3.14Å; L808-N811 PolarHBondContact O-N 3.31Å; G809-N811 VanDerWaalsContact C-N 3.25Å; G809-N811 PolarHBondContact O-N 3Å
812	K	86.9	Confident	83	Confident	118 Å²	118	69 Å²	69	51%	0.513	32%	0.318	S	S	.	.	H	α-helix	trans	-74.9	-26	178.7	-61.9	-68.9	-177.4	-177.3	0	112.7	F734 L808 G809	F734-K812 HydrophobicContact CE1-CB 3.71Å; F734-K812 HydrophobicContact CE1-CD 4.23Å; F734-K812 HydrophobicContact CE1-CG 3.76Å; F734-K812 HydrophobicContact CZ-CB 4.3Å; F734-K812 HydrophobicContact CZ-CD 3.92Å; F734-K812 HydrophobicContact CZ-CG 3.93Å; L808-K812 VanDerWaalsContact O-CG 3.23Å; L808-K812 WeakPolarHBondContact O-CG 3.32Å; L808-K812 PolarHBondContact O-N 3.33Å; G809-K812 PolarHBondContact O-N 2.89Å; G809-K812 VanDerWaalsContact O-N 3.11Å
813	F	87.8	Confident	81.3	Confident	2 Å²	2	72.2 Å²	72.2	1%	0.009	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	22.1	178.2	-72	-81	0	0	0	113.6	R636 D731 F734 L735 I739 P768 G809 K810 K815 L816 Y817	R636-F813 HydrophobicContact CG-CD1 3.74Å; R636-F813 HydrophobicContact CG-CE1 3.56Å; R636-F813 HydrophobicContact CG-CG 4.49Å; R636-F813 HydrophobicContact CG-CZ 4.18Å; D731-F813 HydrophobicContact CB-CE1 3.92Å; D731-F813 HydrophobicContact CB-CZ 4.14Å; F734-F813 HydrophobicContact CD1-CE2 4.25Å; F734-F813 HydrophobicContact CD1-CZ 4.42Å; L735-F813 HydrophobicContact CD1-CE2 4.37Å; I739-F813 HydrophobicContact CD1-CE2 4.14Å; P768-F813 HydrophobicContact CB-CB 4.03Å; P768-F813 HydrophobicContact CB-CD2 3.48Å; P768-F813 VanDerWaalsContact CB-CD2 3.48Å; P768-F813 HydrophobicContact CB-CE2 4.04Å; P768-F813 HydrophobicContact CB-CG 3.77Å; P768-F813 HydrophobicContact CG-CB 4.26Å; P768-F813 HydrophobicContact CG-CD1 4.23Å; P768-F813 HydrophobicContact CG-CD2 4.02Å; P768-F813 HydrophobicContact CG-CE2 4.41Å; P768-F813 HydrophobicContact CG-CG 3.91Å; G809-F813 WeakPolarHBondContact O-CB 3.31Å; G809-F813 WeakPolarHBondContact O-CD2 3.48Å; G809-F813 PolarHBondContact O-N 3.1Å; K810-F813 CarbonylContact O-C 3.48Å; F813-K815 PolarHBondContact O-N 3.48Å; F813-L816 HydrophobicContact CB-CB 4.42Å; F813-L816 HydrophobicContact CD1-CD2 4.48Å; F813-L816 WeakPolarHBondContact O-CA 3.39Å; F813-L816 WeakPolarHBondContact O-CB 3.49Å; F813-L816 PolarHBondContact O-N 3.35Å; F813-Y817 PolarHBondContact O-N 2.99Å
814	I	83.8	Confident	79.5	Confident	71 Å²	71	71.7 Å²	71.7	36%	0.364	33%	0.333	S	S	.	.	H	α-helix	trans	-55	-26.1	-173.2	-165.7	168.8	0	0	0	115.1	K810 R818	K810-I814 WeakPolarHBondContact O-CA 3.15Å; K810-I814 PolarHBondContact O-N 3.42Å; K810-I814 VanDerWaalsContact O-N 3.12Å; I814-R818 VanDerWaalsContact O-CG 3.31Å; I814-R818 WeakPolarHBondContact O-CG 3.17Å; I814-R818 PolarHBondContact O-N 3.5Å
815	K	78.1	Confident	77.7	Confident	79 Å²	79	72.2 Å²	72.2	34%	0.343	33%	0.334	S	S	.	.	H	α-helix	trans	-70.6	-45.9	171	-77.5	-166.5	178.8	-174.8	0	112.9	A637 N638 F813 Y817 R818 N819	A637-K815 PolarHBondContact O-NZ 3.26Å; N638-K815 WeakPolarHBondContact OD1-CE 3.09Å; N638-K815 PolarHBondContact OD1-NZ 3.3Å; F813-K815 PolarHBondContact O-N 3.48Å; K815-Y817 VanDerWaalsContact C-N 3.26Å; K815-Y817 PolarHBondContact O-N 3.29Å; K815-R818 PolarHBondContact O-N 2.68Å; K815-N819 VanDerWaalsContact O-CB 3.28Å; K815-N819 WeakPolarHBondContact O-CB 3.43Å; K815-N819 VanDerWaalsContact O-CG 3.27Å; K815-N819 PolarHBondContact O-N 3.19Å; K815-N819 PolarHBondContact O-OD1 3.02Å
816	L	81.9	Confident	75.8	Confident	7 Å²	7	74 Å²	74	4%	0.037	34%	0.344	C	S	.	.	H	α-helix	trans	-64.2	-36.2	174.9	-175.8	66.8	0	0	0	110.7	L723 L726 I727 P768 F813 G820	L723-L816 HydrophobicContact CD2-CD1 3.82Å; L723-L816 HydrophobicContact CD2-CD2 4.35Å; L723-L816 HydrophobicContact CD2-CG 3.93Å; L726-L816 HydrophobicContact CB-CD1 3.64Å; L726-L816 HydrophobicContact CD1-CD1 3.95Å; L726-L816 HydrophobicContact CG-CD1 4.46Å; I727-L816 HydrophobicContact CD1-CD2 3.54Å; I727-L816 HydrophobicContact CG1-CD2 3.66Å; P768-L816 HydrophobicContact CG-CD2 4.01Å; F813-L816 HydrophobicContact CB-CB 4.42Å; F813-L816 HydrophobicContact CD1-CD2 4.48Å; F813-L816 WeakPolarHBondContact O-CA 3.39Å; F813-L816 WeakPolarHBondContact O-CB 3.49Å; F813-L816 PolarHBondContact O-N 3.35Å; L816-G820 WeakPolarHBondContact O-CA 3.37Å; L816-G820 PolarHBondContact O-N 2.68Å
817	Y	75.3	Confident	73.9	Confident	69 Å²	69	77.7 Å²	77.7	27%	0.271	36%	0.363	S	S	.	.	H	α-helix	trans	-58.5	-54.6	171.1	-176.5	-107.3	0	0	0	111.6	W769 K810 F813 K815 N819 L821	W769-Y817 AromaticContact CD2-CD2 3.83Å; W769-Y817 HydrophobicContact CD2-CD2 3.83Å; W769-Y817 HydrophobicContact CD2-CE2 4.42Å; W769-Y817 AromaticContact CE2-CD2 3.66Å; W769-Y817 AromaticContact CE3-CD2 3.95Å; W769-Y817 HydrophobicContact CE3-CD2 3.95Å; W769-Y817 AromaticContact CH2-CD2 3.83Å; W769-Y817 HydrophobicContact CH2-CD2 3.83Å; W769-Y817 HydrophobicContact CH2-CG 4.48Å; W769-Y817 AromaticContact CZ2-CD2 3.68Å; W769-Y817 HydrophobicContact CZ2-CD2 3.68Å; W769-Y817 HydrophobicContact CZ2-CE2 4.32Å; W769-Y817 AromaticContact CZ3-CD2 3.96Å; W769-Y817 HydrophobicContact CZ3-CD2 3.96Å; W769-Y817 HydrophobicContact CZ3-CG 4.41Å; K810-Y817 HydrophobicContact CD-CE2 4.44Å; K810-Y817 WeakPolarHBondContact CE-OH 3.46Å; K810-Y817 HydrophobicContact CG-CD2 4.37Å; K810-Y817 PolarHBondContact NZ-OH 3Å; K810-Y817 VanDerWaalsContact NZ-OH 3.15Å; F813-Y817 PolarHBondContact O-N 2.99Å; K815-Y817 VanDerWaalsContact C-N 3.26Å; K815-Y817 PolarHBondContact O-N 3.29Å; Y817-N819 PolarHBondContact O-N 2.98Å; Y817-L821 VanDerWaalsContact O-CB 3.3Å; Y817-L821 WeakPolarHBondContact O-CB 3.36Å; Y817-L821 PolarHBondContact O-N 2.94Å
818	R	75.4	Confident	71.9	Confident	172 Å²	172	77.8 Å²	77.8	65%	0.649	36%	0.364	S	S	*	.	H	α-helix	trans	-62.9	-42.7	179.7	-72	173.4	-176.8	-172	0.9	113.3	I814 K815 R822	I814-R818 VanDerWaalsContact O-CG 3.31Å; I814-R818 WeakPolarHBondContact O-CG 3.17Å; I814-R818 PolarHBondContact O-N 3.5Å; K815-R818 PolarHBondContact O-N 2.68Å; R818-R822 PolarHBondContact O-N 2.87Å
819	N	70.1	Confident	70	Confident	96 Å²	96	79 Å²	79	51%	0.513	37%	0.374	S	S	.	.	H	α-helix	trans	-74.7	-39.5	-178.9	-69	6.1	0	0	0	111.5	K815 Y817 R822 M823	K815-N819 VanDerWaalsContact O-CB 3.28Å; K815-N819 WeakPolarHBondContact O-CB 3.43Å; K815-N819 VanDerWaalsContact O-CG 3.27Å; K815-N819 PolarHBondContact O-N 3.19Å; K815-N819 PolarHBondContact O-OD1 3.02Å; Y817-N819 PolarHBondContact O-N 2.98Å; N819-R822 CarbonylContact O-C 3.56Å; N819-R822 WeakPolarHBondContact O-CB 3.24Å; N819-R822 PolarHBondContact O-N 2.97Å; N819-R822 VanDerWaalsContact O-N 3.15Å; N819-M823 WeakPolarHBondContact O-CG 3.34Å; N819-M823 PolarHBondContact O-N 2.87Å
820	G	64.5	Low	68.2	Low	4 Å²	4	83.6 Å²	83.6	4%	0.041	40%	0.399	C	S	.	.	H	α-helix	trans	-61.9	-46.6	174.8	0	0	0	0	0	111.6	L816 R822 M823 T824	L816-G820 WeakPolarHBondContact O-CA 3.37Å; L816-G820 PolarHBondContact O-N 2.68Å; G820-R822 PolarHBondContact O-N 3.41Å; G820-M823 PolarHBondContact O-N 2.89Å; G820-M823 VanDerWaalsContact O-N 3.16Å; G820-T824 PolarHBondContact O-N 2.93Å; G820-T824 PolarHBondContact O-OG1 2.98Å; G820-T824 VanDerWaalsContact O-OG1 3.11Å
821	L	62.3	Low	66.1	Low	82 Å²	82	82.2 Å²	82.2	43%	0.429	40%	0.395	S	S	.	.	H	α-helix	trans	-64.3	-21.6	174.9	-148.7	86.2	0	0	0	113.3	Y817 K825	Y817-L821 VanDerWaalsContact O-CB 3.3Å; Y817-L821 WeakPolarHBondContact O-CB 3.36Å; Y817-L821 PolarHBondContact O-N 2.94Å; L821-K825 WeakPolarHBondContact O-CD 3.49Å; L821-K825 VanDerWaalsContact O-CG 3.24Å; L821-K825 WeakPolarHBondContact O-CG 3.41Å
822	R	63.6	Low	63.9	Low	159 Å²	159	84.2 Å²	84.2	60%	0.6	40%	0.399	S	S	*	.	H	α-helix	trans	-81.2	-46.7	171	177.5	179.1	167.9	154.5	7	111	R818 N819 G820 K825 E826	R818-R822 PolarHBondContact O-N 2.87Å; N819-R822 CarbonylContact O-C 3.56Å; N819-R822 WeakPolarHBondContact O-CB 3.24Å; N819-R822 PolarHBondContact O-N 2.97Å; N819-R822 VanDerWaalsContact O-N 3.15Å; G820-R822 PolarHBondContact O-N 3.41Å; R822-K825 CarbonylContact O-C 3.59Å; R822-K825 WeakPolarHBondContact O-CB 3.39Å; R822-K825 PolarHBondContact O-N 3.15Å; R822-E826 HydrophobicContact CG-CG 4.32Å; R822-E826 IonicContact CZ-OE1 2.74Å; R822-E826 IonicContact NE-OE1 3.39Å; R822-E826 PolarHBondContact NE-OE1 2.71Å; R822-E826 IonicContact NE-OE2 3.76Å; R822-E826 IonicContact NH2-OE1 3.02Å; R822-E826 PolarHBondContact NH2-OE1 2.75Å; R822-E826 WeakPolarHBondContact O-CG 3.34Å; R822-E826 PolarHBondContact O-N 3.14Å
823	M	59.4	Low	61.6	Low	68 Å²	68	82.1 Å²	82.1	34%	0.335	40%	0.399	S	S	.	.	H	α-helix	trans	-64.4	-40.4	-179.7	-72.2	176.5	64.4	0	0	112.3	P722 L726 N819 G820 K825 E826 L827	P722-M823 HydrophobicContact CB-CE 4.33Å; L726-M823 HydrophobicContact CD1-CE 4.08Å; L726-M823 HydrophobicContact CD1-SD 3.8Å; N819-M823 WeakPolarHBondContact O-CG 3.34Å; N819-M823 PolarHBondContact O-N 2.87Å; G820-M823 PolarHBondContact O-N 2.89Å; G820-M823 VanDerWaalsContact O-N 3.16Å; M823-K825 VanDerWaalsContact C-N 3.33Å; M823-K825 PolarHBondContact O-N 3.04Å; M823-E826 PolarHBondContact O-N 3.42Å; M823-L827 VanDerWaalsContact O-CG 3.31Å; M823-L827 WeakPolarHBondContact O-CG 3.3Å; M823-L827 PolarHBondContact O-N 2.85Å
824	T	55	Low	59.5	Low	59 Å²	59	87.5 Å²	87.5	36%	0.362	42%	0.423	S	S	.	.	H	α-helix	trans	-64.4	-38.7	173.5	53.8	0	0	0	0	111.6	G820 L827 L828	G820-T824 PolarHBondContact O-N 2.93Å; G820-T824 PolarHBondContact O-OG1 2.98Å; G820-T824 VanDerWaalsContact O-OG1 3.11Å; T824-L827 PolarHBondContact O-N 2.72Å; T824-L828 WeakPolarHBondContact O-CB 3.15Å; T824-L828 WeakPolarHBondContact O-CD1 3.45Å; T824-L828 VanDerWaalsContact O-CG 3.22Å; T824-L828 WeakPolarHBondContact O-CG 3.36Å; T824-L828 PolarHBondContact O-N 3.09Å
825	K	55.3	Low	57.5	Low	130 Å²	130	91.2 Å²	91.2	57%	0.565	44%	0.438	S	S	*	.	H	α-helix	trans	-65.4	-40.6	172.1	-75.9	-179.1	178.8	-167.4	0	113	L821 R822 M823 L828 V829	L821-K825 WeakPolarHBondContact O-CD 3.49Å; L821-K825 VanDerWaalsContact O-CG 3.24Å; L821-K825 WeakPolarHBondContact O-CG 3.41Å; R822-K825 CarbonylContact O-C 3.59Å; R822-K825 WeakPolarHBondContact O-CB 3.39Å; R822-K825 PolarHBondContact O-N 3.15Å; M823-K825 VanDerWaalsContact C-N 3.33Å; M823-K825 PolarHBondContact O-N 3.04Å; K825-L828 PolarHBondContact O-N 3.01Å; K825-V829 WeakPolarHBondContact O-CB 3.38Å; K825-V829 VanDerWaalsContact O-CG2 3.24Å; K825-V829 WeakPolarHBondContact O-CG2 3.34Å; K825-V829 PolarHBondContact O-N 2.99Å
826	E	54.7	Low	55.5	Low	76 Å²	76	92.3 Å²	92.3	36%	0.355	45%	0.448	S	S	.	.	H	α-helix	trans	-66.2	-37.5	177.6	-75.1	170.6	155.8	0	0	111.6	R822 M823 N830	R822-E826 HydrophobicContact CG-CG 4.32Å; R822-E826 IonicContact CZ-OE1 2.74Å; R822-E826 IonicContact NE-OE1 3.39Å; R822-E826 PolarHBondContact NE-OE1 2.71Å; R822-E826 IonicContact NE-OE2 3.76Å; R822-E826 IonicContact NH2-OE1 3.02Å; R822-E826 PolarHBondContact NH2-OE1 2.75Å; R822-E826 WeakPolarHBondContact O-CG 3.34Å; R822-E826 PolarHBondContact O-N 3.14Å; M823-E826 PolarHBondContact O-N 3.42Å; E826-N830 VanDerWaalsContact O-CB 3.29Å; E826-N830 WeakPolarHBondContact O-CB 3.34Å; E826-N830 PolarHBondContact O-N 2.79Å; E826-N830 PolarHBondContact O-ND2 3.13Å
827	L	51.9	Low	53.3	Low	93 Å²	93	102.5 Å²	102.5	49%	0.487	49%	0.486	S	S	.	.	H	α-helix	trans	-63.6	-50.5	170.8	-69.7	166.6	0	0	0	111.7	M823 T824 V829 N830 N831	M823-L827 VanDerWaalsContact O-CG 3.31Å; M823-L827 WeakPolarHBondContact O-CG 3.3Å; M823-L827 PolarHBondContact O-N 2.85Å; T824-L827 PolarHBondContact O-N 2.72Å; L827-V829 VanDerWaalsContact C-N 3.33Å; L827-V829 PolarHBondContact O-N 3.2Å; L827-N830 PolarHBondContact O-N 2.85Å; L827-N831 PolarHBondContact O-N 2.95Å; L827-N831 VanDerWaalsContact O-N 3.15Å; L827-N831 PolarHBondContact O-OD1 3.25Å
828	L	49.7	Very low	51.4	Low	103 Å²	103	108.1 Å²	108.1	54%	0.539	52%	0.515	S	S	.	.	H	α-helix	trans	-60.4	-38.1	178.4	-72.7	165	0	0	0	113	T824 K825 K832	T824-L828 WeakPolarHBondContact O-CB 3.15Å; T824-L828 WeakPolarHBondContact O-CD1 3.45Å; T824-L828 VanDerWaalsContact O-CG 3.22Å; T824-L828 WeakPolarHBondContact O-CG 3.36Å; T824-L828 PolarHBondContact O-N 3.09Å; K825-L828 PolarHBondContact O-N 3.01Å; L828-K832 PolarHBondContact O-N 3.01Å
829	V	52.4	Low	49.6	Very low	95 Å²	95	103.8 Å²	103.8	58%	0.576	50%	0.504	S	S	*	.	H	α-helix	trans	-73.4	-40.9	178.2	168.2	0	0	0	0	111.6	K825 L827 N831 K832 S833	K825-V829 WeakPolarHBondContact O-CB 3.38Å; K825-V829 VanDerWaalsContact O-CG2 3.24Å; K825-V829 WeakPolarHBondContact O-CG2 3.34Å; K825-V829 PolarHBondContact O-N 2.99Å; L827-V829 VanDerWaalsContact C-N 3.33Å; L827-V829 PolarHBondContact O-N 3.2Å; V829-N831 VanDerWaalsContact C-N 3.32Å; V829-N831 PolarHBondContact O-N 3.47Å; V829-K832 PolarHBondContact O-N 3.25Å; V829-S833 WeakPolarHBondContact O-CB 3.34Å; V829-S833 PolarHBondContact O-N 3.28Å
830	N	49.2	Very low	47.9	Very low	98 Å²	98	104.4 Å²	104.4	52%	0.524	51%	0.511	S	S	.	.	H	α-helix	trans	-63.2	-38.3	178.8	-75.7	-18.5	0	0	0	112.1	E826 L827 S833	E826-N830 VanDerWaalsContact O-CB 3.29Å; E826-N830 WeakPolarHBondContact O-CB 3.34Å; E826-N830 PolarHBondContact O-N 2.79Å; E826-N830 PolarHBondContact O-ND2 3.13Å; L827-N830 PolarHBondContact O-N 2.85Å; N830-S833 PolarHBondContact O-N 3.34Å; N830-S833 PolarHBondContact O-OG 2.86Å
831	N	43.7	Very low	46.8	Very low	47 Å²	47	108.2 Å²	108.2	25%	0.251	54%	0.538	S	S	.	.	H	α-helix	trans	-63.5	-54.6	174.9	-67.7	10.2	0	0	0	110.8	E715 L827 V829 S833 K834	E715-N831 HydrophobicContact CB-CB 4.44Å; E715-N831 PolarHBondContact O-ND2 2.9Å; L827-N831 PolarHBondContact O-N 2.95Å; L827-N831 VanDerWaalsContact O-N 3.15Å; L827-N831 PolarHBondContact O-OD1 3.25Å; V829-N831 VanDerWaalsContact C-N 3.32Å; V829-N831 PolarHBondContact O-N 3.47Å; N831-S833 PolarHBondContact O-N 3.23Å; N831-K834 PolarHBondContact O-N 2.9Å; N831-K834 VanDerWaalsContact O-N 3.09Å
832	K	40.9	Very low	45.8	Very low	140 Å²	140	109.5 Å²	109.5	61%	0.609	54%	0.541	S	S	*	.	H	α-helix	trans	-59.3	-23.2	178.8	-70.4	-166.6	174	-158.3	0	114.5	L828 V829 K834	L828-K832 PolarHBondContact O-N 3.01Å; V829-K832 PolarHBondContact O-N 3.25Å; K832-K834 PolarHBondContact O-N 3.34Å
833	S	38.4	Very low	44.7	Very low	74 Å²	74	107.3 Å²	107.3	52%	0.517	54%	0.54	S	S	.	.	H	α-helix	trans	-70	-9.7	177.8	78.1	0	0	0	0	115	V829 N830 N831	V829-S833 WeakPolarHBondContact O-CB 3.34Å; V829-S833 PolarHBondContact O-N 3.28Å; N830-S833 PolarHBondContact O-N 3.34Å; N830-S833 PolarHBondContact O-OG 2.86Å; N831-S833 PolarHBondContact O-N 3.23Å
834	K	43.2	Very low	43.8	Very low	116 Å²	116	113.4 Å²	113.4	50%	0.504	56%	0.561	S	S	.	*	H	α-helix	trans	-89.6	-33.9	177.7	-64.5	175.8	-169.7	155	0	113.7	E715 N831 K832 N836	E715-K834 VanDerWaalsContact OE1-CD 3.29Å; E715-K834 WeakPolarHBondContact OE1-CD 3.46Å; E715-K834 IonicContact OE1-NZ 2.76Å; E715-K834 PolarHBondContact OE1-NZ 2.84Å; E715-K834 WeakPolarHBondContact OE2-CD 3.21Å; E715-K834 IonicContact OE2-NZ 2.72Å; E715-K834 PolarHBondContact OE2-NZ 3.49Å; N831-K834 PolarHBondContact O-N 2.9Å; N831-K834 VanDerWaalsContact O-N 3.09Å; K832-K834 PolarHBondContact O-N 3.34Å; K834-N836 PolarHBondContact O-N 2.89Å
835	E	43.5	Very low	43	Very low	148 Å²	148	118.5 Å²	118.5	69%	0.692	58%	0.581	S	S	*	*	H	α-helix	trans	-71.8	-29.4	-171	-61.6	172.9	133.2	0	0	112.5
836	N	35.1	Very low	42	Very low	102 Å²	102	119.2 Å²	119.2	55%	0.545	59%	0.591	S	S	.	*			trans	-121.7	85.3	-177	-78.5	-77.8	0	0	0	111.8	K834	K834-N836 PolarHBondContact O-N 2.89Å
837	R	35.8	Very low	40.8	Very low	222 Å²	222	120.9 Å²	120.9	84%	0.838	60%	0.602	S	S	*	*	S	Bend	trans	-86.9	-8	173.1	-88	-172.2	169.3	-174.9	-2	115.2
838	E	36.1	Very low	39.7	Very low	187 Å²	187	122.1 Å²	122.1	87%	0.874	62%	0.615	S	S	*	*	S	Bend	trans	-101.7	-22	-173.4	-59.2	-164	146.8	0	0	114.8
839	N	37.8	Very low	38.8	Very low	80 Å²	80	125.8 Å²	125.8	43%	0.428	63%	0.629	S	S	.	*			trans	-119.9	71.3	177.4	-93.6	8.6	0	0	0	113.3	S841 E842	N839-S841 VanDerWaalsContact C-N 3.32Å; N839-E842 PolarHBondContact ND2-OE2 3.34Å
840	T	34	Very low	37.6	Very low	109 Å²	109	128.8 Å²	128.8	67%	0.669	64%	0.641	S	S	*	*			trans	-83.3	-2	175.2	48.9	0	0	0	0	114.6
841	S	41.6	Very low	36.5	Very low	85 Å²	85	130.8 Å²	130.8	59%	0.594	65%	0.651	S	S	*	*	S	Bend	trans	-90.7	-34.1	-177.9	42.7	0	0	0	0	114.7	N839	N839-S841 VanDerWaalsContact C-N 3.32Å
842	E	40.2	Very low	35.7	Very low	108 Å²	108	135 Å²	135	51%	0.505	68%	0.679	S	S	.	*	S	Bend	trans	-88.2	-24	-167.7	-61	-175.1	138.6	0	0	114.2	N839 Y844 Q845	N839-E842 PolarHBondContact ND2-OE2 3.34Å; E842-Y844 PolarHBondContact O-N 2.95Å; E842-Y844 VanDerWaalsContact O-N 3.11Å; E842-Q845 PolarHBondContact O-N 3Å
843	I	41.3	Very low	35.2	Very low	113 Å²	113	134.3 Å²	134.3	58%	0.579	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-21.9	-174.5	-65.1	174.8	0	0	0	112.5	Q845 L847	I843-Q845 VanDerWaalsContact C-N 3.33Å; I843-Q845 PolarHBondContact O-N 2.83Å; I843-L847 WeakPolarHBondContact O-CD1 3.35Å
844	Y	39.3	Very low	34.6	Very low	196 Å²	196	135 Å²	135	77%	0.769	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-11.5	176.1	-75.6	-78.5	0	0	0	114.9	E842	E842-Y844 PolarHBondContact O-N 2.95Å; E842-Y844 VanDerWaalsContact O-N 3.11Å
845	Q	39.5	Very low	33.9	Very low	166 Å²	166	135.6 Å²	135.6	78%	0.776	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	-22.6	-178	-65.6	-173.7	-8.5	0	0	113.6	E842 I843	E842-Q845 PolarHBondContact O-N 3Å; I843-Q845 VanDerWaalsContact C-N 3.33Å; I843-Q845 PolarHBondContact O-N 2.83Å
846	N	33.7	Very low	33.1	Very low	145 Å²	145	134.5 Å²	134.5	78%	0.775	70%	0.696	S	S	*	*			trans	-103.5	31.4	-177.9	-73.7	-43.3	0	0	0	114.1
847	L	29.8	Very low	32.7	Very low	111 Å²	111	136.8 Å²	136.8	58%	0.581	70%	0.703	S	S	*	*	S	Bend	trans	-73.9	133.7	158.9	-84.8	80.5	0	0	0	108.7	I843 H849	I843-L847 WeakPolarHBondContact O-CD1 3.35Å; L847-H849 PolarHBondContact O-N 3.02Å
848	P	28.2	Very low	32.3	Very low	120 Å²	120	131.4 Å²	131.4	78%	0.779	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-58.4	131.5	161.1	27.3	-32.9	0	0	0	107.6	L850	P848-L850 PolarHBondContact O-N 3.2Å
849	H	30.8	Very low	31.9	Very low	180 Å²	180	129 Å²	129	83%	0.833	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-46.9	133.9	-178.4	-78.5	-85	0	0	0	110.7	L847 L851	L847-H849 PolarHBondContact O-N 3.02Å; H849-L851 VanDerWaalsContact C-N 3.31Å; H849-L851 PolarHBondContact O-N 2.94Å
850	L	26.6	Very low	31.5	Very low	158 Å²	158	132.3 Å²	132.3	83%	0.827	71%	0.707	S	S	*	*			trans	-55.8	100.1	166.3	-79.2	169.1	0	0	0	107.8	P848 T852	P848-L850 PolarHBondContact O-N 3.2Å; L850-T852 VanDerWaalsContact C-N 3.3Å; L850-T852 PolarHBondContact O-N 3.42Å
851	L	27.4	Very low	31.1	Very low	140 Å²	140	131.6 Å²	131.6	73%	0.733	71%	0.707	S	S	*	*			trans	-64.9	96	177.5	-93.3	166.8	0	0	0	108.1	H849 H853	H849-L851 VanDerWaalsContact C-N 3.31Å; H849-L851 PolarHBondContact O-N 2.94Å; L851-H853 PolarHBondContact O-N 3.17Å
852	T	26.5	Very low	30.5	Very low	134 Å²	134	137.4 Å²	137.4	82%	0.822	72%	0.717	S	S	*	*			trans	-68.6	33	167.5	42.6	0	0	0	0	111.8	L850 A854	L850-T852 VanDerWaalsContact C-N 3.3Å; L850-T852 PolarHBondContact O-N 3.42Å; T852-A854 PolarHBondContact O-N 3.12Å
853	H	29.6	Very low	29.9	Very low	127 Å²	127	140.8 Å²	140.8	59%	0.588	73%	0.73	S	S	*	*			trans	-76.6	76.5	156.2	-76.2	-6.8	0	0	0	109	L851 Q855	L851-H853 PolarHBondContact O-N 3.17Å; H853-Q855 HydrophobicContact CB-CG 4.14Å; H853-Q855 PolarHBondContact O-N 3.13Å
854	A	27.3	Very low	29.3	Very low	88 Å²	88	139.7 Å²	139.7	73%	0.727	73%	0.733	S	S	*	*			trans	-61.9	61	139.8	0	0	0	0	0	109.4	T852 T856	T852-A854 PolarHBondContact O-N 3.12Å; A854-T856 PolarHBondContact O-N 2.87Å
855	Q	27.6	Very low	28.7	Very low	129 Å²	129	136.8 Å²	136.8	60%	0.603	74%	0.735	S	S	*	*			trans	-70.9	83.7	158.9	-78.2	-172.1	8.1	0	0	106.5	H853 H857	H853-Q855 HydrophobicContact CB-CG 4.14Å; H853-Q855 PolarHBondContact O-N 3.13Å; Q855-H857 PolarHBondContact O-N 2.74Å
856	T	26.6	Very low	28.2	Very low	125 Å²	125	134 Å²	134	77%	0.767	73%	0.733	S	S	*	*			trans	-58.6	83.3	153.9	51.3	0	0	0	0	107.6	A854 P858	A854-T856 PolarHBondContact O-N 2.87Å; T856-P858 WeakPolarHBondContact O-CD 3.42Å; T856-P858 VanDerWaalsContact O-N 3.12Å
857	H	26.6	Very low	28	Very low	150 Å²	150	136.7 Å²	136.7	69%	0.694	74%	0.738	S	S	*	*			trans	-50	120.7	148.4	-75.2	-77.1	0	0	0	105.4	Q855 V859	Q855-H857 PolarHBondContact O-N 2.74Å; H857-V859 PolarHBondContact O-N 3.37Å; H857-V859 VanDerWaalsContact O-N 3.16Å
858	P	27.6	Very low	28	Very low	108 Å²	108	136.2 Å²	136.2	70%	0.701	74%	0.744	S	S	*	*			trans	-57.7	130	177.3	24.1	-32.4	0	0	0	106.6	T856 Q860	T856-P858 WeakPolarHBondContact O-CD 3.42Å; T856-P858 VanDerWaalsContact O-N 3.12Å; P858-Q860 PolarHBondContact O-N 2.82Å
859	V	28.4	Very low	28.2	Very low	137 Å²	137	136 Å²	136	83%	0.83	74%	0.742	S	S	*	*			trans	-58.8	101.6	162.9	174.6	0	0	0	0	104.8	H857 S861	H857-V859 PolarHBondContact O-N 3.37Å; H857-V859 VanDerWaalsContact O-N 3.16Å; V859-S861 VanDerWaalsContact C-N 3.34Å; V859-S861 PolarHBondContact O-N 3.16Å
860	Q	28	Very low	28.1	Very low	149 Å²	149	136 Å²	136	70%	0.696	74%	0.74	S	S	*	*			trans	-56.8	109.4	169.3	-83.9	-170.1	-14.8	0	0	105.3	P858 Y862	P858-Q860 PolarHBondContact O-N 2.82Å; Q860-Y862 PolarHBondContact O-N 2.93Å
861	S	26.8	Very low	28.4	Very low	94 Å²	94	134.3 Å²	134.3	66%	0.657	74%	0.736	S	S	*	*			trans	-70.1	87.4	176.2	43.8	0	0	0	0	106.7	V859 K863	V859-S861 VanDerWaalsContact C-N 3.34Å; V859-S861 PolarHBondContact O-N 3.16Å; S861-K863 PolarHBondContact O-N 3.27Å
862	Y	28.3	Very low	28.4	Very low	207 Å²	207	133.7 Å²	133.7	81%	0.812	73%	0.733	S	S	*	*			trans	-54.6	92.8	151.7	-86.9	-85.6	0	0	0	106.1	Q860 S864	Q860-Y862 PolarHBondContact O-N 2.93Å; Y862-S864 PolarHBondContact O-N 3.42Å
863	K	28.1	Very low	28.8	Very low	179 Å²	179	134 Å²	134	78%	0.778	73%	0.728	S	S	*	*			trans	-64.2	78.9	169.6	-75	179.9	176.7	176	0	106.5	S861 T865	S861-K863 PolarHBondContact O-N 3.27Å; K863-T865 PolarHBondContact O-N 2.88Å
864	S	29.1	Very low	28.9	Very low	91 Å²	91	132.7 Å²	132.7	64%	0.636	73%	0.734	S	S	*	*			trans	-56	110.9	168.9	178.6	0	0	0	0	106.9	Y862 C866	Y862-S864 PolarHBondContact O-N 3.42Å; S864-C866 PolarHBondContact O-N 3.08Å; S864-C866 PolarHBondContact OG-SG 3.2Å; S864-C866 VanDerWaalsContact OG-SG 3.34Å
865	T	26.1	Very low	29.3	Very low	134 Å²	134	134 Å²	134	82%	0.822	73%	0.733	S	S	*	*			trans	-75.9	37.3	-178.8	41.9	0	0	0	0	112	K863 K867	K863-T865 PolarHBondContact O-N 2.88Å; T865-K867 VanDerWaalsContact C-N 3.29Å; T865-K867 PolarHBondContact O-N 3.29Å
866	C	29.6	Very low	29.5	Very low	107 Å²	107	135.2 Å²	135.2	72%	0.723	74%	0.739	S	S	*	*			trans	-66.4	88.1	167.3	-76.7	0	0	0	0	109.5	S864 S868	S864-C866 PolarHBondContact O-N 3.08Å; S864-C866 PolarHBondContact OG-SG 3.2Å; S864-C866 VanDerWaalsContact OG-SG 3.34Å; C866-S868 PolarHBondContact O-N 3.47Å
867	K	28.3	Very low	29.9	Very low	202 Å²	202	136.7 Å²	136.7	88%	0.878	74%	0.742	S	S	*	*			trans	-59.3	98.1	161.6	-67.7	179.1	180	177.3	0	108.2	T865	T865-K867 VanDerWaalsContact C-N 3.29Å; T865-K867 PolarHBondContact O-N 3.29Å
868	S	30.8	Very low	30.3	Very low	102 Å²	102	138.1 Å²	138.1	71%	0.713	75%	0.746	S	S	*	*			trans	-65.4	131.4	161.5	43.9	0	0	0	0	108.4	C866 K870	C866-S868 PolarHBondContact O-N 3.47Å; S868-K870 PolarHBondContact O-N 3.06Å
869	P	31.9	Very low	30.8	Very low	115 Å²	115	137.5 Å²	137.5	75%	0.747	75%	0.75	S	S	*	*			trans	-65.1	128.1	169.9	27.5	-32.3	0	0	0	108.2	V871	P869-V871 PolarHBondContact O-N 2.68Å; P869-V871 VanDerWaalsContact O-N 3.17Å
870	K	29.4	Very low	31.2	Very low	179 Å²	179	137.8 Å²	137.8	78%	0.778	75%	0.746	S	S	*	*			trans	-65.8	114.9	166.9	-75.1	-173.6	175.2	-174.5	0	108.1	S868 D872	S868-K870 PolarHBondContact O-N 3.06Å; K870-D872 PolarHBondContact O-N 3.36Å
871	V	32.3	Very low	32.1	Very low	124 Å²	124	136.8 Å²	136.8	75%	0.752	75%	0.752	S	S	*	*			trans	-82.9	94.4	158.8	179.9	0	0	0	0	105.8	P869 I873	P869-V871 PolarHBondContact O-N 2.68Å; P869-V871 VanDerWaalsContact O-N 3.17Å; V871-I873 VanDerWaalsContact C-N 3.33Å; V871-I873 HydrophobicContact CG1-CG1 4.19Å; V871-I873 PolarHBondContact O-N 2.93Å
872	D	28.1	Very low	32.7	Very low	126 Å²	126	141.8 Å²	141.8	67%	0.674	78%	0.779	S	S	*	*			trans	-71.6	88.8	178.7	-72.5	-39.9	0	0	0	110	K870 S874	K870-D872 PolarHBondContact O-N 3.36Å; D872-S874 VanDerWaalsContact C-N 3.3Å; D872-S874 PolarHBondContact O-N 3.07Å
873	I	34.8	Very low	32.9	Very low	140 Å²	140	138.5 Å²	138.5	72%	0.718	78%	0.777	S	S	*	*			trans	-71.4	90.4	168.6	-58.1	-179.5	0	0	0	107.6	V871 T875	V871-I873 VanDerWaalsContact C-N 3.33Å; V871-I873 HydrophobicContact CG1-CG1 4.19Å; V871-I873 PolarHBondContact O-N 2.93Å; I873-T875 PolarHBondContact O-N 3.1Å
874	S	30.9	Very low	33.2	Very low	100 Å²	100	136.4 Å²	136.4	70%	0.699	78%	0.777	S	S	*	*			trans	-76.1	78.9	-177.6	49.2	0	0	0	0	112.3	D872 Q876	D872-S874 VanDerWaalsContact C-N 3.3Å; D872-S874 PolarHBondContact O-N 3.07Å; S874-Q876 PolarHBondContact O-N 3.09Å
875	T	36.2	Very low	33.4	Very low	115 Å²	115	138.9 Å²	138.9	71%	0.706	79%	0.785	S	S	*	*			trans	-68.1	90.4	167.8	36.6	0	0	0	0	110.7	I873 N877	I873-T875 PolarHBondContact O-N 3.1Å; T875-N877 PolarHBondContact O-N 3.34Å
876	Q	31.9	Very low	33.8	Very low	156 Å²	156	139.2 Å²	139.2	73%	0.729	78%	0.783	S	S	*	*			trans	-70	71.3	175.8	-67.3	-168.1	6.3	0	0	112.8	S874 K878	S874-Q876 PolarHBondContact O-N 3.09Å; Q876-K878 VanDerWaalsContact C-N 3.33Å; Q876-K878 PolarHBondContact O-N 3.12Å
877	N	34.8	Very low	34.1	Very low	156 Å²	156	141.2 Å²	141.2	83%	0.834	79%	0.787	S	S	*	*			trans	-76.1	87	164.1	-81.5	-0.6	0	0	0	109.6	T875 A879	T875-N877 PolarHBondContact O-N 3.34Å; N877-A879 PolarHBondContact O-N 3.46Å
878	K	35.1	Very low	34.5	Very low	180 Å²	180	137.1 Å²	137.1	78%	0.783	78%	0.781	S	S	*	*			trans	-68.2	105.6	166.2	-75.6	-178.7	175.6	178.5	0	109.7	Q876	Q876-K878 VanDerWaalsContact C-N 3.33Å; Q876-K878 PolarHBondContact O-N 3.12Å
879	A	38.7	Very low	34.7	Very low	95 Å²	95	139.6 Å²	139.6	79%	0.785	79%	0.786	S	S	*	*			trans	-97.5	130.1	155.9	0	0	0	0	0	108.4	N877	N877-A879 PolarHBondContact O-N 3.46Å
880	L	35.4	Very low	34.9	Very low	143 Å²	143	141.5 Å²	141.5	75%	0.749	79%	0.789	S	S	*	*			trans	-84.3	148.4	171.5	-79.8	79.3	0	0	0	110
881	P	47.5	Very low	35.4	Very low	127 Å²	127	138.4 Å²	138.4	83%	0.825	79%	0.789	S	S	*	*			trans	-98.3	90.9	163.9	35	-27.5	0	0	0	111.1
882	T	39	Very low	35.7	Very low	199 Å²	199	139.7 Å²	139.7	100%	1.221	79%	0.793	S	S	*	*			trans	-152.6	0	161.6	49.3	0	0	0	0	108.6

Retrieved 882 of 882 residues in 1105.1 ms (Link to these results)

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