A0A087YSU1_POEFO Loading...

SLIT and NTRK like family member 4

AlphaFold DB , UniProt , Accession A0A087YSU1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 853 aa.

						>A0A087YSU1_POEFO|A0A087YSU1
MLLIPLLAAFFSSISGSLSSSLSSMSDGPPMMDPTASDLMAETCIACSCMSVENVLYVNCEKITVYRPTQLIPPASSLYHLNFQNNFLIVLYPNSFLNFTHAVSLQLGNNKLQNIEGGAFMGMSALKQLHLNNNELKVLRADTFQGIENLEYLQADYNLIKYIEKGAFNKLHKLKVLILNDNLIQALPENIFRFASLTHLDIRGNRIQNLPYLGVLEHIGRIVELQLDDNPWNCTCDLAPLKAWLENMPYNIFIGEAICETPSDLYGRLLKETNRQELCPMGTGSEFDIKMPPAQPENGQGPSKMTPTTAAPKSPKTTDSSKFYGNGIVAGLPPFGKNRDIVPRTPLMLCPPPCSCKAHPSDFGVSVSCQERSIRNLADLNSKPPNAKKLHLSGNYIRDISPTDFQGFEGLDLLHLGSNQIAVVQKGVFANLTNLRRLYLNGNQLEQLHPEMFLGLTNLQYLYLEYNAIKEILASTFDSMPNLQLLYLNNNVLRSLPAYIFAGIPLARLNLKNNHFMTLPVSGVLDNLRSLTQIDLEGNPWECSCDLVALKLWLQRLSDGVAAKEVKCASPVQFANIELRLIKNEILCPKLTTPPPISSSTAIVTSVSPAGVGKAPPGGPVPLSIMILSILVVLILTVFVAFCLLVFVLRRNKKPVGRQEGLGNQECGSLSLQLRRHGHKSGKKGSIPGDDLGGETFIPQTIEHIGKSHTCGIGRSSDMDAGFKFADSQRQKIILRNCPDKDKDLLSTLERNKRLSTIDELEEFLPNREPSLFIHNFLDSKRDFNSIGMGGYEIRYPEKTLDKKMKKSSLIGGNHSKIVVEQRKSEYYELKAKLQGTPDYLQVLEEQTALSKM
					

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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	40.1	Very low	38.4	Very low	229 Å²	229	145.5 Å²	145.5	100%	1.128	78%	0.775	S	S	*	*				0	132.6	0	-176.7	172.3	176.2	0	0	107.7
2	L	43.6	Very low	38	Very low	138 Å²	138	140.8 Å²	140.8	72%	0.723	76%	0.763	S	S	*	*			trans	41.8	82.3	167.6	-67.9	165.7	0	0	0	118.7
3	L	36.5	Very low	37.6	Very low	170 Å²	170	137.4 Å²	137.4	89%	0.89	76%	0.756	S	S	*	*	S	Bend	trans	-165.5	18.8	130.2	-135.4	79.3	0	0	0	116.1
4	I	41.2	Very low	37.3	Very low	156 Å²	156	139.8 Å²	139.8	80%	0.8	77%	0.765	S	S	*	*	S	Bend	trans	-100.2	-29.8	-177.1	-64.1	176.9	0	0	0	115.6	L6	I4-L6 VanDerWaalsContact C-N 3.35Å; I4-L6 PolarHBondContact O-N 3.07Å
5	P	39.5	Very low	36.9	Very low	88 Å²	88	137.6 Å²	137.6	57%	0.571	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-9.5	-169.5	31	-35.7	0	0	0	115.6
6	L	39.4	Very low	36.2	Very low	152 Å²	152	133.8 Å²	133.8	80%	0.796	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-21.9	-172.8	-110.4	101.8	0	0	0	115.3	I4	I4-L6 VanDerWaalsContact C-N 3.35Å; I4-L6 PolarHBondContact O-N 3.07Å
7	L	38.5	Very low	35.8	Very low	147 Å²	147	132.7 Å²	132.7	77%	0.77	77%	0.768	S	S	*	*	S	Bend	trans	-85.4	-20.2	-179.9	-88	161.6	0	0	0	113.4	A9	L7-A9 VanDerWaalsContact C-N 3.28Å; L7-A9 PolarHBondContact O-N 3.31Å
8	A	36	Very low	35.3	Very low	78 Å²	78	135.3 Å²	135.3	65%	0.645	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-19.7	177.9	0	0	0	0	0	113.4
9	A	39.5	Very low	34.7	Very low	69 Å²	69	133.8 Å²	133.8	57%	0.57	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-9.7	-175.1	0	0	0	0	0	114.7	L7	L7-A9 VanDerWaalsContact C-N 3.28Å; L7-A9 PolarHBondContact O-N 3.31Å
10	F	35.7	Very low	34.4	Very low	178 Å²	178	132.9 Å²	132.9	78%	0.781	78%	0.777	S	S	*	*	S	Bend	trans	-97.6	-16	-174.5	-107.2	-84.9	0	0	0	115
11	F	32.5	Very low	34	Very low	195 Å²	195	131.6 Å²	131.6	86%	0.855	78%	0.775	S	S	*	*	S	Bend	trans	-99.8	-2.1	-177.5	-90	-81.8	0	0	0	114.8
12	S	33	Very low	33.4	Very low	89 Å²	89	129 Å²	129	62%	0.622	77%	0.765	S	S	*	*	S	Bend	trans	-98.9	12.4	-178.2	52.2	0	0	0	0	114.2
13	S	33.3	Very low	32.6	Very low	97 Å²	97	127.4 Å²	127.4	68%	0.678	77%	0.766	S	S	*	*	S	Bend	trans	-112.6	7.6	-167.5	-165.9	0	0	0	0	115.8
14	I	34.1	Very low	32.2	Very low	171 Å²	171	124.5 Å²	124.5	88%	0.877	76%	0.76	S	S	*	*	S	Bend	trans	-131.8	45.3	-178	-39.6	-177.8	0	0	0	110.9
15	S	30.6	Very low	31.5	Very low	107 Å²	107	125 Å²	125	75%	0.748	76%	0.76	S	S	*	*	S	Bend	trans	-150.4	96.1	172.6	59	0	0	0	0	111.2
16	G	26.3	Very low	31	Very low	76 Å²	76	126.1 Å²	126.1	78%	0.784	77%	0.771	S	S	*	*			trans	116.8	91.9	167.1	0	0	0	0	0	115.9
17	S	28.2	Very low	30.5	Very low	116 Å²	116	127.2 Å²	127.2	81%	0.811	78%	0.777	S	S	*	*			trans	177.4	97.1	139.9	32.4	0	0	0	0	111.2
18	L	27.2	Very low	30	Very low	179 Å²	179	123.3 Å²	123.3	94%	0.937	77%	0.773	S	S	*	*			trans	-171.2	96.8	155.8	-109.7	159.6	0	0	0	109.4
19	S	24.9	Very low	29.8	Very low	108 Å²	108	125.4 Å²	125.4	76%	0.755	78%	0.779	S	S	*	*			trans	-153.2	150	170.2	59.7	0	0	0	0	109.4
20	S	27.5	Very low	29.4	Very low	115 Å²	115	128.4 Å²	128.4	80%	0.804	79%	0.793	S	S	*	*			trans	66.8	140.5	-166.6	84.2	0	0	0	0	113.8
21	S	26.8	Very low	29.1	Very low	105 Å²	105	128.5 Å²	128.5	73%	0.734	80%	0.798	S	S	*	*			cis	-153.6	146.3	-2.9	52.2	0	0	0	0	112.6
22	L	27.1	Very low	29	Very low	174 Å²	174	128 Å²	128	91%	0.911	80%	0.801	S	S	*	*				-161.8	169.7	128.8	-128	74.3	0	0	0	108.6
23	S	26.8	Very low	28.9	Very low	106 Å²	106	131 Å²	131	74%	0.741	81%	0.81	S	S	*	*			trans	-143.5	163.7	-160.1	54.4	0	0	0	0	115.6
24	S	27.3	Very low	28.8	Very low	109 Å²	109	131.6 Å²	131.6	76%	0.762	81%	0.811	S	S	*	*			trans	72.9	153.4	176.2	80	0	0	0	0	115.5
25	M	26.5	Very low	28.7	Very low	165 Å²	165	127.9 Å²	127.9	81%	0.813	80%	0.797	S	S	*	*			cis	-154.9	165.8	14.6	-157	149.6	58.8	0	0	114.2
26	S	28.9	Very low	29	Very low	113 Å²	113	127.5 Å²	127.5	79%	0.79	80%	0.8	S	S	*	*			trans	71	131.7	163	54.9	0	0	0	0	121.2
27	D	29.4	Very low	29.6	Very low	175 Å²	175	127.1 Å²	127.1	94%	0.936	79%	0.786	S	S	*	*			trans	-84.2	155.8	172.2	-65.1	-81.8	0	0	0	113.8
28	G	29.4	Very low	30	Very low	65 Å²	65	127 Å²	127	67%	0.67	78%	0.776	S	S	*	*			trans	-159.8	153.3	168.3	0	0	0	0	0	110.8
29	P	30.4	Very low	30.7	Very low	121 Å²	121	125.2 Å²	125.2	79%	0.786	77%	0.767	S	S	*	*			trans	-72.1	152.7	-171.1	29.7	-35.7	0	0	0	113	M31	P29-M31 PolarHBondContact O-N 2.87Å
30	P	32	Very low	31.7	Very low	133 Å²	133	126.7 Å²	126.7	86%	0.864	76%	0.763	S	S	*	*			trans	-72.9	103.2	-175.6	29.6	-35	0	0	0	111.9
31	M	28.3	Very low	32.9	Very low	180 Å²	180	124.2 Å²	124.2	89%	0.887	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-69.4	142.5	150.2	-79.5	-69	-170.7	0	0	108.6	P29 D33	P29-M31 PolarHBondContact O-N 2.87Å; M31-D33 PolarHBondContact O-N 3.14Å
32	M	31.4	Very low	34.2	Very low	185 Å²	185	124.8 Å²	124.8	91%	0.911	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-66.1	121.6	173	-73.4	166	127.1	0	0	109.7	P34	M32-P34 WeakPolarHBondContact O-CD 3.37Å
33	D	29.9	Very low	35.6	Very low	152 Å²	152	116.9 Å²	116.9	81%	0.813	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-60.2	121.2	155.4	-84.7	-43.8	0	0	0	107.9	M31 T35	M31-D33 PolarHBondContact O-N 3.14Å; D33-T35 PolarHBondContact O-N 3.14Å
34	P	31.6	Very low	37.2	Very low	108 Å²	108	114.2 Å²	114.2	70%	0.701	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-67.1	119.9	168.6	28.2	-31.5	0	0	0	108	M32	M32-P34 WeakPolarHBondContact O-CD 3.37Å
35	T	31.8	Very low	38.9	Very low	94 Å²	94	115.3 Å²	115.3	58%	0.577	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-59.4	145.2	-179.8	40.4	0	0	0	0	111.1	D33 S37 D38	D33-T35 PolarHBondContact O-N 3.14Å; T35-S37 PolarHBondContact O-N 3.24Å; T35-S37 PolarHBondContact O-OG 3.05Å; T35-S37 PolarHBondContact OG1-OG 3.3Å; T35-S37 VanDerWaalsContact OG1-OG 3.08Å; T35-D38 PolarHBondContact O-N 3.02Å
36	A	37.5	Very low	40.6	Very low	99 Å²	99	108.3 Å²	108.3	82%	0.818	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	12	-176.3	0	0	0	0	0	115.3
37	S	38.9	Very low	42.7	Very low	68 Å²	68	103.3 Å²	103.3	48%	0.476	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.9	-33.5	164.4	45.8	0	0	0	0	113.1	T35 L39	T35-S37 PolarHBondContact O-N 3.24Å; T35-S37 PolarHBondContact O-OG 3.05Å; T35-S37 PolarHBondContact OG1-OG 3.3Å; T35-S37 VanDerWaalsContact OG1-OG 3.08Å; S37-L39 PolarHBondContact O-N 3.38Å
38	D	37.2	Very low	45	Very low	114 Å²	114	98.4 Å²	98.4	61%	0.61	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	-5	-157.5	-68.9	20.5	0	0	0	113.5	T35	T35-D38 PolarHBondContact O-N 3.02Å
39	L	40.2	Very low	47.4	Very low	141 Å²	141	97.2 Å²	97.2	74%	0.738	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	29.9	173.5	-152	72.6	0	0	0	112.9	S37 A75	S37-L39 PolarHBondContact O-N 3.38Å; L39-A75 HydrophobicContact CD2-CB 4.01Å
40	M	46.7	Very low	49.5	Very low	138 Å²	138	97.2 Å²	97.2	68%	0.68	56%	0.561	S	S	*	*			trans	-101.6	5.3	179.4	-77.4	-72.8	-169.1	0	0	113.9
41	A	53.4	Low	51.5	Low	63 Å²	63	95 Å²	95	52%	0.521	55%	0.549	S	S	.	.			trans	-121.2	49.1	-144.6	0	0	0	0	0	116.4	I45	A41-I45 HydrophobicContact CB-CD1 4.43Å; A41-I45 VanDerWaalsContact O-CD1 3.23Å; A41-I45 WeakPolarHBondContact O-CD1 3.38Å
42	E	53.6	Low	53.4	Low	118 Å²	118	90 Å²	90	55%	0.551	53%	0.528	S	S	*	.	S	Bend	trans	-148	-58.9	162.9	-125.1	170.7	-135.6	0	0	114.9	C44 I45 A46 I72	E42-C44 VanDerWaalsContact C-N 3.26Å; E42-C44 PolarHBondContact O-N 3.33Å; E42-I45 WeakPolarHBondContact O-CA 3.29Å; E42-I45 WeakPolarHBondContact O-CB 3.48Å; E42-I45 PolarHBondContact O-N 3.25Å; E42-A46 PolarHBondContact O-N 3.4Å; E42-I72 WeakPolarHBondContact OE2-CD1 3.16Å
43	T	56.1	Low	54.8	Low	7 Å²	7	89.9 Å²	89.9	4%	0.043	53%	0.525	C	S	.	.	H	α-helix	trans	-62.5	-31.9	178.1	-71.8	0	0	0	0	113	I45 A46 C47 V58 L71 I72	T43-I45 PolarHBondContact O-N 2.89Å; T43-A46 PolarHBondContact O-N 2.91Å; T43-C47 WeakPolarHBondContact O-CB 3.37Å; T43-C47 PolarHBondContact O-N 3.22Å; T43-V58 HydrophobicContact CG2-CG1 3.82Å; T43-L71 HydrophobicContact CG2-CD2 4.44Å; T43-I72 VanDerWaalsContact CB-O 3.24Å; T43-I72 WeakPolarHBondContact CB-O 3.4Å; T43-I72 PolarHBondContact OG1-N 3.08Å; T43-I72 PolarHBondContact OG1-O 3.08Å
44	C	61.3	Low	56.5	Low	50 Å²	50	89.8 Å²	89.8	34%	0.338	53%	0.525	S	S	.	.	H	α-helix	trans	-80.9	1.9	173.2	-62.9	0	0	0	0	114.4	E42 C47 C49	E42-C44 VanDerWaalsContact C-N 3.26Å; E42-C44 PolarHBondContact O-N 3.33Å; C44-C47 CarbonylContact C-O 3.04Å; C44-C47 WeakPolarHBondContact CA-O 3.45Å; C44-C49 WeakPolarHBondContact CA-SG 3.32Å; C44-C49 HydrophobicContact CB-CB 3.66Å; C44-C49 WeakPolarHBondContact CB-SG 3.44Å; C44-C49 WeakPolarHBondContact SG-CB 3.23Å; C44-C49 CovalentContact SG-SG 2.04Å; C44-C49 PolarHBondContact SG-SG 3.18Å
45	I	61.6	Low	58.3	Low	132 Å²	132	86.8 Å²	86.8	68%	0.677	50%	0.504	S	S	*	.	H	α-helix	trans	-96.3	-37.6	166.8	-51	-178.2	0	0	0	109.2	A41 E42 T43	A41-I45 HydrophobicContact CB-CD1 4.43Å; A41-I45 VanDerWaalsContact O-CD1 3.23Å; A41-I45 WeakPolarHBondContact O-CD1 3.38Å; E42-I45 WeakPolarHBondContact O-CA 3.29Å; E42-I45 WeakPolarHBondContact O-CB 3.48Å; E42-I45 PolarHBondContact O-N 3.25Å; T43-I45 PolarHBondContact O-N 2.89Å
46	A	62.9	Low	60.6	Low	19 Å²	19	83.3 Å²	83.3	16%	0.157	48%	0.482	C	S	.	.	H	α-helix	trans	-74.4	-35.3	175.3	0	0	0	0	0	113.8	E42 T43 I63 Y66 L71	E42-A46 PolarHBondContact O-N 3.4Å; T43-A46 PolarHBondContact O-N 2.91Å; A46-I63 WeakPolarHBondContact O-CD1 3.26Å; A46-Y66 HydrophobicContact CB-CD2 4.49Å; A46-Y66 HydrophobicContact CB-CE1 4.24Å; A46-Y66 HydrophobicContact CB-CE2 3.76Å; A46-Y66 WeakPolarHBondContact O-CE2 3.36Å; A46-L71 HydrophobicContact CB-CD2 3.73Å
47	C	73.4	Confident	62.7	Low	7 Å²	7	83.4 Å²	83.4	5%	0.047	46%	0.462	C	S	.	.	S	Bend	trans	-130.4	157.6	-176.1	-60.6	0	0	0	0	111.7	T43 C44 C49 V58 N59 C60	T43-C47 WeakPolarHBondContact O-CB 3.37Å; T43-C47 PolarHBondContact O-N 3.22Å; C44-C47 CarbonylContact C-O 3.04Å; C44-C47 WeakPolarHBondContact CA-O 3.45Å; C47-C49 PolarHBondContact O-N 2.63Å; C47-V58 HydrophobicContact CB-CG1 3.97Å; C47-N59 WeakPolarHBondContact CB-O 3.32Å; C47-C60 HydrophobicContact CB-CB 4.02Å; C47-C60 WeakPolarHBondContact CB-SG 3.03Å; C47-C60 WeakPolarHBondContact SG-CB 3.45Å; C47-C60 CovalentContact SG-SG 2.04Å; C47-C60 PolarHBondContact SG-SG 3.07Å
48	S	77.9	Confident	64.7	Low	72 Å²	72	80.2 Å²	80.2	50%	0.503	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	113.9	179.1	-173.3	0	0	0	0	110.9	N59	S48-N59 PolarHBondContact N-O 3.24Å; S48-N59 PolarHBondContact O-N 3Å
49	C	79.1	Confident	66.9	Low	40 Å²	40	77.6 Å²	77.6	27%	0.27	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	133.4	177.2	-73	0	0	0	0	112.1	C44 C47 L56 Y57	C44-C49 WeakPolarHBondContact CA-SG 3.32Å; C44-C49 HydrophobicContact CB-CB 3.66Å; C44-C49 WeakPolarHBondContact CB-SG 3.44Å; C44-C49 WeakPolarHBondContact SG-CB 3.23Å; C44-C49 CovalentContact SG-SG 2.04Å; C44-C49 PolarHBondContact SG-SG 3.18Å; C47-C49 PolarHBondContact O-N 2.63Å; C49-L56 HydrophobicContact CB-CD1 4.04Å; C49-Y57 WeakPolarHBondContact CA-O 3.3Å
50	M	75.6	Confident	68.7	Low	121 Å²	121	71 Å²	71	60%	0.596	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.1	132.2	173.5	-66.6	179	63.4	0	0	109.9	Y57	M50-Y57 PolarHBondContact N-O 3.17Å; M50-Y57 PolarHBondContact O-N 2.76Å
51	S	72.3	Confident	70.1	Confident	88 Å²	88	67.1 Å²	67.1	62%	0.615	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.3	125.8	173.7	-175.3	0	0	0	0	109.9
52	V	68.9	Low	70.5	Confident	73 Å²	73	71.3 Å²	71.3	44%	0.442	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	118.8	178.4	-177.9	0	0	0	0	107.5	N54 V55 Y57	V52-N54 PolarHBondContact O-N 2.58Å; V52-N54 VanDerWaalsContact O-N 3.16Å; V52-V55 PolarHBondContact N-O 2.87Å; V52-V55 WeakPolarHBondContact O-CA 3.45Å; V52-V55 WeakPolarHBondContact O-CB 3.42Å; V52-V55 PolarHBondContact O-N 3.03Å; V52-Y57 HydrophobicContact CB-CD2 4.43Å; V52-Y57 HydrophobicContact CB-CE2 4.11Å; V52-Y57 HydrophobicContact CG2-CD2 4.43Å; V52-Y57 HydrophobicContact CG2-CE2 4.49Å
53	E	61	Low	70.9	Confident	183 Å²	183	68.4 Å²	68.4	86%	0.855	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	39.3	178	-58	-172	167.6	0	0	114.2	V55	E53-V55 PolarHBondContact O-N 3.5Å
54	N	65.9	Low	70.7	Confident	150 Å²	150	74 Å²	74	80%	0.802	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	3.4	-174.3	-52.8	-40.6	0	0	0	115.9	V52	V52-N54 PolarHBondContact O-N 2.58Å; V52-N54 VanDerWaalsContact O-N 3.16Å
55	V	69.3	Low	70.4	Confident	45 Å²	45	75.2 Å²	75.2	27%	0.273	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	128.6	166.9	-176.6	0	0	0	0	109	V52 E53 Y57	V52-V55 PolarHBondContact N-O 2.87Å; V52-V55 WeakPolarHBondContact O-CA 3.45Å; V52-V55 WeakPolarHBondContact O-CB 3.42Å; V52-V55 PolarHBondContact O-N 3.03Å; E53-V55 PolarHBondContact O-N 3.5Å; V55-Y57 HydrophobicContact CB-CE2 3.91Å; V55-Y57 HydrophobicContact CG1-CD2 4.29Å; V55-Y57 HydrophobicContact CG1-CE2 3.63Å
56	L	79.9	Confident	70.1	Confident	22 Å²	22	72.9 Å²	72.9	12%	0.115	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	129.9	179.7	173.3	65.8	0	0	0	110.5	C49 V58 P74 L78 Y79 H80	C49-L56 HydrophobicContact CB-CD1 4.04Å; L56-V58 HydrophobicContact CD2-CG2 4.33Å; L56-V58 HydrophobicContact CG-CG2 4.1Å; L56-P74 HydrophobicContact CD2-CB 3.68Å; L56-P74 HydrophobicContact CD2-CG 3.53Å; L56-L78 PolarHBondContact N-O 3.47Å; L56-Y79 CarbonylContact O-C 3.11Å; L56-Y79 WeakPolarHBondContact O-CA 3.37Å; L56-Y79 WeakPolarHBondContact O-CB 3.33Å; L56-H80 PolarHBondContact O-N 3.08Å
57	Y	80.8	Confident	70	Confident	100 Å²	100	78.8 Å²	78.8	39%	0.392	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	120.6	175.7	-66.3	-97.7	0	0	0	108.4	C49 M50 V52 V55 H80	C49-Y57 WeakPolarHBondContact CA-O 3.3Å; M50-Y57 PolarHBondContact N-O 3.17Å; M50-Y57 PolarHBondContact O-N 2.76Å; V52-Y57 HydrophobicContact CB-CD2 4.43Å; V52-Y57 HydrophobicContact CB-CE2 4.11Å; V52-Y57 HydrophobicContact CG2-CD2 4.43Å; V52-Y57 HydrophobicContact CG2-CE2 4.49Å; V55-Y57 HydrophobicContact CB-CE2 3.91Å; V55-Y57 HydrophobicContact CG1-CD2 4.29Å; V55-Y57 HydrophobicContact CG1-CE2 3.63Å; Y57-H80 HydrophobicContact CD1-CB 3.66Å; Y57-H80 HydrophobicContact CE1-CB 3.9Å; Y57-H80 AromaticContact CE1-CD2 3.94Å; Y57-H80 AromaticContact CE1-CG 3.7Å; Y57-H80 HydrophobicContact CG-CB 4.44Å
58	V	82.4	Confident	69.6	Low	2 Å²	2	78.8 Å²	78.8	1%	0.012	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	112.9	-179.4	-174.2	0	0	0	0	108.4	T43 C47 L56 P74 H80 L81 N82	T43-V58 HydrophobicContact CG2-CG1 3.82Å; C47-V58 HydrophobicContact CB-CG1 3.97Å; L56-V58 HydrophobicContact CD2-CG2 4.33Å; L56-V58 HydrophobicContact CG-CG2 4.1Å; V58-P74 HydrophobicContact CG2-CG 4.45Å; V58-H80 PolarHBondContact N-O 3.41Å; V58-L81 HydrophobicContact CB-CD2 3.99Å; V58-L81 HydrophobicContact CG2-CD2 4.24Å; V58-N82 PolarHBondContact O-N 2.76Å
59	N	81.6	Confident	68.8	Low	58 Å²	58	79.7 Å²	79.7	31%	0.31	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	110.6	-177.3	-171.4	11.8	0	0	0	111.9	C47 S48 E61 N82	C47-N59 WeakPolarHBondContact CB-O 3.32Å; S48-N59 PolarHBondContact N-O 3.24Å; S48-N59 PolarHBondContact O-N 3Å; N59-E61 WeakPolarHBondContact OD1-CB 3.12Å; N59-E61 PolarHBondContact OD1-N 3.25Å; N59-N82 PolarHBondContact OD1-ND2 3.36Å
60	C	78.8	Confident	68	Low	3 Å²	3	83.4 Å²	83.4	2%	0.02	42%	0.423	C	S	.	.			trans	-107.8	29.7	-179.9	-59.5	0	0	0	0	112.3	C47 N82 F83 N86	C47-C60 HydrophobicContact CB-CB 4.02Å; C47-C60 WeakPolarHBondContact CB-SG 3.03Å; C47-C60 WeakPolarHBondContact SG-CB 3.45Å; C47-C60 CovalentContact SG-SG 2.04Å; C47-C60 PolarHBondContact SG-SG 3.07Å; C60-N82 WeakPolarHBondContact CA-O 3.34Å; C60-N82 WeakPolarHBondContact CB-O 3.24Å; C60-N82 PolarHBondContact N-O 3.15Å; C60-F83 HydrophobicContact CB-CD1 3.62Å; C60-F83 HydrophobicContact CB-CE1 3.69Å; C60-F83 HydrophobicContact CB-CG 4.41Å; C60-F83 VanDerWaalsContact SG-CE1 3.56Å; C60-N86 PolarHBondContact O-ND2 2.73Å
61	E	75.9	Confident	67.7	Low	56 Å²	56	78 Å²	78	26%	0.262	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	140.8	-179.7	-154.4	-152.4	149.3	0	0	113.1	N59 I63 Q84 N85	N59-E61 WeakPolarHBondContact OD1-CB 3.12Å; N59-E61 PolarHBondContact OD1-N 3.25Å; E61-I63 VanDerWaalsContact C-N 3.3Å; E61-I63 PolarHBondContact O-N 2.99Å; E61-Q84 WeakPolarHBondContact CG-O 3.28Å; E61-N85 HydrophobicContact CG-CB 3.89Å; E61-N85 PolarHBondContact OE1-ND2 3.27Å
62	K	63	Low	67.4	Low	151 Å²	151	78.8 Å²	78.8	66%	0.657	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	19.3	172.8	-56.7	-173.7	179.1	84.9	0	116.8	N86	K62-N86 PolarHBondContact N-OD1 3.03Å
63	I	61	Low	67.3	Low	58 Å²	58	76.7 Å²	76.7	30%	0.297	38%	0.381	S	S	.	.			trans	-98.1	135	177.3	-48.7	-178.2	0	0	0	109.9	A46 E61 V65 Y66 N86	A46-I63 WeakPolarHBondContact O-CD1 3.26Å; E61-I63 VanDerWaalsContact C-N 3.3Å; E61-I63 PolarHBondContact O-N 2.99Å; I63-V65 VanDerWaalsContact C-N 3.33Å; I63-V65 PolarHBondContact O-N 3.17Å; I63-Y66 HydrophobicContact CB-CD2 4.43Å; I63-Y66 HydrophobicContact CB-CE2 4.18Å; I63-Y66 HydrophobicContact CD1-CE2 4.15Å; I63-Y66 HydrophobicContact CG2-CD2 4.11Å; I63-Y66 HydrophobicContact CG2-CE2 3.53Å; I63-N86 PolarHBondContact N-OD1 3.35Å; I63-N86 PolarHBondContact O-OD1 3.42Å
64	T	52.5	Low	67.5	Low	124 Å²	124	68.9 Å²	68.9	76%	0.761	35%	0.346	S	S	*	.	S	Bend	trans	-71.7	82.9	-172.2	51.2	0	0	0	0	113
65	V	54.4	Low	67.3	Low	75 Å²	75	64.6 Å²	64.6	46%	0.455	33%	0.331	S	S	.	.			trans	62.5	75	165.1	-164.3	0	0	0	0	114.6	I63	I63-V65 VanDerWaalsContact C-N 3.33Å; I63-V65 PolarHBondContact O-N 3.17Å
66	Y	55.6	Low	66.9	Low	84 Å²	84	67.9 Å²	67.9	33%	0.329	36%	0.356	S	S	.	.			trans	-75.9	125.7	144.9	-63.8	-59.3	0	0	0	108.9	A46 I63 L71	A46-Y66 HydrophobicContact CB-CD2 4.49Å; A46-Y66 HydrophobicContact CB-CE1 4.24Å; A46-Y66 HydrophobicContact CB-CE2 3.76Å; A46-Y66 WeakPolarHBondContact O-CE2 3.36Å; I63-Y66 HydrophobicContact CB-CD2 4.43Å; I63-Y66 HydrophobicContact CB-CE2 4.18Å; I63-Y66 HydrophobicContact CD1-CE2 4.15Å; I63-Y66 HydrophobicContact CG2-CD2 4.11Å; I63-Y66 HydrophobicContact CG2-CE2 3.53Å; Y66-L71 HydrophobicContact CD1-CD2 4.4Å; Y66-L71 HydrophobicContact CD2-CD2 4.39Å; Y66-L71 HydrophobicContact CG-CD2 4.18Å; Y66-L71 HydrophobicContact CG-CG 4.49Å
67	R	61.2	Low	66.4	Low	143 Å²	143	68.8 Å²	68.8	54%	0.54	37%	0.365	S	S	.	.			trans	-72.9	139.5	159.7	-60.7	-178.8	178.9	-172.8	-0.8	107.4	T69 Q70	R67-T69 PolarHBondContact O-N 3.47Å; R67-Q70 HydrophobicContact CB-CG 4.19Å; R67-Q70 WeakPolarHBondContact O-CB 3.39Å; R67-Q70 PolarHBondContact O-N 3.42Å
68	P	65.2	Low	66.1	Low	6 Å²	6	68.8 Å²	68.8	4%	0.039	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-53.3	-30.2	179.1	-30.5	37.2	0	0	0	114.2	Q70 L71 S95 F96	P68-Q70 PolarHBondContact O-N 3.32Å; P68-Q70 VanDerWaalsContact O-N 3.14Å; P68-L71 PolarHBondContact O-N 3.09Å; P68-S95 CarbonylContact C-O 3.52Å; P68-S95 WeakPolarHBondContact CB-O 3.42Å; P68-F96 HydrophobicContact CB-CD1 3.93Å; P68-F96 HydrophobicContact CB-CE1 3.63Å; P68-F96 HydrophobicContact CB-CE2 4.5Å; P68-F96 HydrophobicContact CB-CG 4.5Å; P68-F96 HydrophobicContact CB-CZ 3.94Å; P68-F96 HydrophobicContact CG-CD1 4.48Å; P68-F96 HydrophobicContact CG-CE1 3.72Å; P68-F96 HydrophobicContact CG-CE2 4.27Å; P68-F96 HydrophobicContact CG-CZ 3.59Å
69	T	60.7	Low	66.2	Low	91 Å²	91	68.7 Å²	68.7	56%	0.558	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-64.2	-9.6	174.1	61.1	0	0	0	0	115.4	R67	R67-T69 PolarHBondContact O-N 3.47Å
70	Q	62.6	Low	66.3	Low	118 Å²	118	68 Å²	68	55%	0.551	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-103.2	2.2	-177.7	-61.7	174.1	-70.8	0	0	113	R67 P68	R67-Q70 HydrophobicContact CB-CG 4.19Å; R67-Q70 WeakPolarHBondContact O-CB 3.39Å; R67-Q70 PolarHBondContact O-N 3.42Å; P68-Q70 PolarHBondContact O-N 3.32Å; P68-Q70 VanDerWaalsContact O-N 3.14Å
71	L	68.1	Low	66.7	Low	9 Å²	9	68 Å²	68	5%	0.047	37%	0.365	C	S	.	.			trans	-112.5	124.6	-176.4	-69.4	171.2	0	0	0	110	T43 A46 Y66 P68 F83 F99	T43-L71 HydrophobicContact CG2-CD2 4.44Å; A46-L71 HydrophobicContact CB-CD2 3.73Å; Y66-L71 HydrophobicContact CD1-CD2 4.4Å; Y66-L71 HydrophobicContact CD2-CD2 4.39Å; Y66-L71 HydrophobicContact CG-CD2 4.18Å; Y66-L71 HydrophobicContact CG-CG 4.49Å; P68-L71 PolarHBondContact O-N 3.09Å; L71-F83 HydrophobicContact CD1-CE1 3.68Å; L71-F83 HydrophobicContact CD1-CZ 3.72Å; L71-F99 HydrophobicContact CB-CZ 3.86Å; L71-F99 WeakPolarHBondContact O-CZ 3.47Å
72	I	66.7	Low	67.1	Low	104 Å²	104	66.6 Å²	66.6	53%	0.533	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-83.8	118.4	177	-56.8	-168.9	0	0	0	109.3	E42 T43	E42-I72 WeakPolarHBondContact OE2-CD1 3.16Å; T43-I72 VanDerWaalsContact CB-O 3.24Å; T43-I72 WeakPolarHBondContact CB-O 3.4Å; T43-I72 PolarHBondContact OG1-N 3.08Å; T43-I72 PolarHBondContact OG1-O 3.08Å
73	P	66.4	Low	68.2	Low	28 Å²	28	59.7 Å²	59.7	18%	0.182	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-70.4	155.8	-171.2	30.5	-38.9	0	0	0	113.3	A75 N98 F99	P73-A75 PolarHBondContact O-N 2.95Å; P73-N98 HydrophobicContact CG-CB 3.68Å; P73-N98 WeakPolarHBondContact CG-O 3.02Å; P73-F99 HydrophobicContact CB-CD1 3.79Å; P73-F99 HydrophobicContact CB-CE1 3.8Å; P73-F99 HydrophobicContact CB-CG 4.28Å; P73-F99 HydrophobicContact CB-CZ 4.29Å
74	P	66.4	Low	69.2	Low	19 Å²	19	59 Å²	59	12%	0.123	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-57.2	133.8	167.3	-21.5	32.3	0	0	0	111.8	L56 V58 S76 Y79	L56-P74 HydrophobicContact CD2-CB 3.68Å; L56-P74 HydrophobicContact CD2-CG 3.53Å; V58-P74 HydrophobicContact CG2-CG 4.45Å; P74-S76 PolarHBondContact O-N 2.98Å; P74-Y79 HydrophobicContact CB-CD1 3.89Å; P74-Y79 HydrophobicContact CB-CE1 3.85Å; P74-Y79 HydrophobicContact CG-CD1 3.87Å; P74-Y79 HydrophobicContact CG-CE1 3.89Å; P74-Y79 HydrophobicContact CG-CG 4.45Å
75	A	59.9	Low	70.6	Confident	61 Å²	61	56 Å²	56	50%	0.504	30%	0.304	S	S	.	.	S	Bend	trans	-72.6	-31.7	-161.8	0	0	0	0	0	116	L39 P73	L39-A75 HydrophobicContact CD2-CB 4.01Å; P73-A75 PolarHBondContact O-N 2.95Å
76	S	61.4	Low	71.8	Confident	113 Å²	113	53.1 Å²	53.1	79%	0.79	29%	0.286	S	S	*	.	S	Bend	trans	-156.4	22.2	-164.2	57.2	0	0	0	0	117.2	P74	P74-S76 PolarHBondContact O-N 2.98Å
77	S	68.9	Low	73	Confident	42 Å²	42	55.7 Å²	55.7	29%	0.294	30%	0.299	S	S	.	.	S	Bend	trans	-123.5	158.1	172.5	60.5	0	0	0	0	112.1	Y79 H101	S77-Y79 WeakPolarHBondContact O-CD1 3.3Å; S77-H101 VanDerWaalsContact O-CB 3.31Å; S77-H101 WeakPolarHBondContact O-CB 3.43Å
78	L	76.4	Confident	74.1	Confident	99 Å²	99	49.6 Å²	49.6	52%	0.518	28%	0.277	S	S	.	.			trans	-75.5	135.2	168.6	-67.1	180	0	0	0	109.6	L56 H101 V103	L56-L78 PolarHBondContact N-O 3.47Å; L78-H101 HydrophobicContact CD2-CB 4.35Å; L78-V103 HydrophobicContact CB-CG2 3.86Å; L78-V103 HydrophobicContact CD1-CG2 4.25Å; L78-V103 HydrophobicContact CD2-CG2 3.88Å; L78-V103 HydrophobicContact CG-CG2 4.21Å
79	Y	83.3	Confident	75.1	Confident	1 Å²	1	53.7 Å²	53.7	0%	0.004	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	159.9	-176.2	52.5	-105.6	0	0	0	115.1	L56 P74 S77 L81 F99 H101 A102 V103	L56-Y79 CarbonylContact O-C 3.11Å; L56-Y79 WeakPolarHBondContact O-CA 3.37Å; L56-Y79 WeakPolarHBondContact O-CB 3.33Å; P74-Y79 HydrophobicContact CB-CD1 3.89Å; P74-Y79 HydrophobicContact CB-CE1 3.85Å; P74-Y79 HydrophobicContact CG-CD1 3.87Å; P74-Y79 HydrophobicContact CG-CE1 3.89Å; P74-Y79 HydrophobicContact CG-CG 4.45Å; S77-Y79 WeakPolarHBondContact O-CD1 3.3Å; Y79-L81 HydrophobicContact CD2-CD2 3.63Å; Y79-L81 HydrophobicContact CD2-CG 3.89Å; Y79-L81 HydrophobicContact CE2-CD1 4.12Å; Y79-L81 HydrophobicContact CE2-CD2 3.72Å; Y79-L81 HydrophobicContact CE2-CG 3.94Å; Y79-F99 AromaticContact CE2-CD1 3.96Å; Y79-F99 HydrophobicContact CE2-CD1 3.96Å; Y79-F99 WeakPolarHBondContact OH-CA 3.39Å; Y79-H101 HydrophobicContact CD1-CB 4.5Å; Y79-H101 HydrophobicContact CE1-CB 3.96Å; Y79-H101 PolarHBondContact N-O 2.78Å; Y79-A102 HydrophobicContact CD2-CB 4.19Å; Y79-A102 HydrophobicContact CE2-CB 3.73Å; Y79-A102 WeakPolarHBondContact O-CA 3.43Å; Y79-V103 PolarHBondContact O-N 3.14Å
80	H	84.6	Confident	76.4	Confident	44 Å²	44	51.5 Å²	51.5	20%	0.204	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	129.8	175.4	-65.3	-119.1	0	0	0	108.9	L56 Y57 V58 S104	L56-H80 PolarHBondContact O-N 3.08Å; Y57-H80 HydrophobicContact CD1-CB 3.66Å; Y57-H80 HydrophobicContact CE1-CB 3.9Å; Y57-H80 AromaticContact CE1-CD2 3.94Å; Y57-H80 AromaticContact CE1-CG 3.7Å; Y57-H80 HydrophobicContact CG-CB 4.44Å; V58-H80 PolarHBondContact N-O 3.41Å; H80-S104 WeakPolarHBondContact ND1-CB 3.3Å
81	L	86.2	Confident	77.6	Confident	2 Å²	2	46 Å²	46	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	123	-178.5	-61.7	178.5	0	0	0	110.5	V58 Y79 F83 F99 A102 S104 L105 Q106	V58-L81 HydrophobicContact CB-CD2 3.99Å; V58-L81 HydrophobicContact CG2-CD2 4.24Å; Y79-L81 HydrophobicContact CD2-CD2 3.63Å; Y79-L81 HydrophobicContact CD2-CG 3.89Å; Y79-L81 HydrophobicContact CE2-CD1 4.12Å; Y79-L81 HydrophobicContact CE2-CD2 3.72Å; Y79-L81 HydrophobicContact CE2-CG 3.94Å; L81-F83 HydrophobicContact CB-CD2 4.31Å; L81-F83 HydrophobicContact CB-CE2 4.07Å; L81-F83 HydrophobicContact CD1-CE2 4.31Å; L81-F99 HydrophobicContact CD1-CB 4.31Å; L81-F99 HydrophobicContact CD1-CD1 3.69Å; L81-F99 HydrophobicContact CD1-CE1 4.33Å; L81-F99 HydrophobicContact CD1-CG 4.16Å; L81-F99 HydrophobicContact CD2-CD1 4.23Å; L81-F99 HydrophobicContact CD2-CE1 4.32Å; L81-A102 HydrophobicContact CD1-CB 3.89Å; L81-A102 HydrophobicContact CG-CB 4.29Å; L81-S104 PolarHBondContact N-O 3.36Å; L81-L105 HydrophobicContact CB-CD1 3.79Å; L81-L105 HydrophobicContact CD1-CD1 4.24Å; L81-L105 WeakPolarHBondContact O-CA 3.49Å; L81-Q106 PolarHBondContact O-N 3.31Å
82	N	84.9	Confident	78.4	Confident	27 Å²	27	51 Å²	51	14%	0.144	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	116.7	171.7	-174.8	4.7	0	0	0	111.5	V58 N59 C60 Q84 Q106	V58-N82 PolarHBondContact O-N 2.76Å; N59-N82 PolarHBondContact OD1-ND2 3.36Å; C60-N82 WeakPolarHBondContact CA-O 3.34Å; C60-N82 WeakPolarHBondContact CB-O 3.24Å; C60-N82 PolarHBondContact N-O 3.15Å; N82-Q84 VanDerWaalsContact OD1-CB 3.22Å; N82-Q84 WeakPolarHBondContact OD1-CB 3.27Å; N82-Q84 VanDerWaalsContact OD1-CG 3.23Å; N82-Q84 WeakPolarHBondContact OD1-CG 3.05Å; N82-Q84 PolarHBondContact OD1-N 2.79Å; N82-Q106 VanDerWaalsContact CG-OE1 3.28Å; N82-Q106 PolarHBondContact ND2-OE1 3.22Å
83	F	84.7	Confident	79.3	Confident	6 Å²	6	48.8 Å²	48.8	3%	0.026	27%	0.27	C	S	.	.			trans	-120	21.8	174.1	-71.2	-80.8	0	0	0	112	C60 L71 L81 N86 F96 L105 Q106 L107 N110	C60-F83 HydrophobicContact CB-CD1 3.62Å; C60-F83 HydrophobicContact CB-CE1 3.69Å; C60-F83 HydrophobicContact CB-CG 4.41Å; C60-F83 VanDerWaalsContact SG-CE1 3.56Å; L71-F83 HydrophobicContact CD1-CE1 3.68Å; L71-F83 HydrophobicContact CD1-CZ 3.72Å; L81-F83 HydrophobicContact CB-CD2 4.31Å; L81-F83 HydrophobicContact CB-CE2 4.07Å; L81-F83 HydrophobicContact CD1-CE2 4.31Å; F83-N86 VanDerWaalsContact C-ND2 3.34Å; F83-N86 PolarHBondContact O-ND2 3.14Å; F83-F96 HydrophobicContact CE2-CE1 4.26Å; F83-L105 HydrophobicContact CD2-CD1 3.82Å; F83-L105 HydrophobicContact CE2-CD1 4.29Å; F83-Q106 CarbonylContact C-O 3Å; F83-Q106 WeakPolarHBondContact CA-O 3.27Å; F83-Q106 PolarHBondContact N-O 3.24Å; F83-L107 HydrophobicContact CB-CD2 3.96Å; F83-N110 PolarHBondContact O-ND2 3.06Å
84	Q	83.6	Confident	80.2	Confident	43 Å²	43	50.7 Å²	50.7	20%	0.201	28%	0.278	C	S	.	.			trans	-63	160	178	-70.2	-178.5	-7	0	0	113.3	E61 N82 N86 Q106 G108	E61-Q84 WeakPolarHBondContact CG-O 3.28Å; N82-Q84 VanDerWaalsContact OD1-CB 3.22Å; N82-Q84 WeakPolarHBondContact OD1-CB 3.27Å; N82-Q84 VanDerWaalsContact OD1-CG 3.23Å; N82-Q84 WeakPolarHBondContact OD1-CG 3.05Å; N82-Q84 PolarHBondContact OD1-N 2.79Å; Q84-N86 VanDerWaalsContact C-N 3.27Å; Q84-N86 PolarHBondContact O-N 3.32Å; Q84-N86 PolarHBondContact O-ND2 2.94Å; Q84-Q106 HydrophobicContact CG-CB 3.93Å; Q84-G108 VanDerWaalsContact CA-O 3.26Å; Q84-G108 WeakPolarHBondContact CA-O 3.26Å
85	N	80.9	Confident	80.9	Confident	61 Å²	61	50.1 Å²	50.1	33%	0.326	28%	0.275	S	S	.	.	S	Bend	trans	56.8	38.4	175.3	-53.4	-27.8	0	0	0	113.1	E61 G108 N109	E61-N85 HydrophobicContact CG-CB 3.89Å; E61-N85 PolarHBondContact OE1-ND2 3.27Å; N85-G108 PolarHBondContact N-O 2.84Å; N85-N109 VanDerWaalsContact CA-O 3.32Å; N85-N109 WeakPolarHBondContact CA-O 3.42Å; N85-N109 PolarHBondContact N-O 2.84Å; N85-N109 WeakPolarHBondContact OD1-CB 3.24Å; N85-N109 PolarHBondContact OD1-ND2 3.37Å
86	N	80	Confident	82.1	Confident	15 Å²	15	47.2 Å²	47.2	8%	0.08	25%	0.251	C	S	.	.	S	Bend	trans	-116	173.9	178.3	-75.9	-49.4	0	0	0	111.1	C60 K62 I63 F83 Q84 N110	C60-N86 PolarHBondContact O-ND2 2.73Å; K62-N86 PolarHBondContact N-OD1 3.03Å; I63-N86 PolarHBondContact N-OD1 3.35Å; I63-N86 PolarHBondContact O-OD1 3.42Å; F83-N86 VanDerWaalsContact C-ND2 3.34Å; F83-N86 PolarHBondContact O-ND2 3.14Å; Q84-N86 VanDerWaalsContact C-N 3.27Å; Q84-N86 PolarHBondContact O-N 3.32Å; Q84-N86 PolarHBondContact O-ND2 2.94Å; N86-N110 VanDerWaalsContact CB-OD1 3.28Å; N86-N110 WeakPolarHBondContact CB-OD1 3.44Å; N86-N110 WeakPolarHBondContact O-CA 3.38Å; N86-N110 PolarHBondContact O-OD1 3.28Å
87	F	81.4	Confident	83	Confident	137 Å²	137	45.8 Å²	45.8	60%	0.601	23%	0.234	S	C	*	.			trans	-103.8	38.9	-178	-60.1	-71.9	0	0	0	113.1
88	L	83.9	Confident	83.4	Confident	15 Å²	15	48.6 Å²	48.6	8%	0.079	25%	0.246	C	C	.	.			trans	-71	132.6	174.4	-58.1	174	0	0	0	110.1	L107 N110 K111 L112	L88-L107 HydrophobicContact CD1-CD2 3.75Å; L88-N110 HydrophobicContact CB-CB 4.43Å; L88-N110 VanDerWaalsContact CB-OD1 3.27Å; L88-N110 WeakPolarHBondContact CB-OD1 3.17Å; L88-N110 VanDerWaalsContact CG-OD1 3.3Å; L88-N110 WeakPolarHBondContact CG-OD1 3.34Å; L88-N110 PolarHBondContact N-OD1 3.48Å; L88-N110 VanDerWaalsContact N-OD1 3.13Å; L88-K111 CarbonylContact O-C 3.42Å; L88-K111 VanDerWaalsContact O-CA 3.3Å; L88-K111 WeakPolarHBondContact O-CA 3.12Å; L88-K111 PolarHBondContact O-N 3.06Å; L88-L112 HydrophobicContact CB-CD2 3.68Å; L88-L112 HydrophobicContact CB-CG 4.31Å; L88-L112 PolarHBondContact O-N 3.43Å; L88-L112 VanDerWaalsContact O-N 3.14Å
89	I	85.3	Confident	83.6	Confident	92 Å²	92	44 Å²	44	47%	0.472	22%	0.222	S	C	.	.			trans	-114.9	-37.6	-177.2	-52	175.5	0	0	0	112.4	K111 L112 Q113	I89-K111 WeakPolarHBondContact CA-O 3.43Å; I89-K111 HydrophobicContact CG1-CB 4.32Å; I89-L112 WeakPolarHBondContact O-CA 3.32Å; I89-Q113 PolarHBondContact O-N 3.24Å
90	V	87.9	Confident	83.5	Confident	45 Å²	45	46.4 Å²	46.4	27%	0.273	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	138.4	178.3	-177.9	0	0	0	0	109.1	Y92 N114 E116	V90-Y92 HydrophobicContact CG1-CD1 4.4Å; V90-Y92 HydrophobicContact CG1-CE1 4.12Å; V90-N114 WeakPolarHBondContact CA-O 3.49Å; V90-E116 HydrophobicContact CG1-CG 4.26Å
91	L	88.6	Confident	83.5	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.01	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	122	166.7	-64.8	175.8	0	0	0	109.5	F96 L107 L112 N114 I115 E116 A119 F120	L91-F96 HydrophobicContact CD1-CE2 4.23Å; L91-F96 HydrophobicContact CD2-CE2 4.17Å; L91-F96 HydrophobicContact CD2-CZ 4.43Å; L91-L107 HydrophobicContact CD1-CD1 3.9Å; L91-L112 HydrophobicContact CD1-CD1 4.1Å; L91-L112 HydrophobicContact CD1-CD2 4.4Å; L91-L112 HydrophobicContact CD2-CD2 4.32Å; L91-L112 HydrophobicContact CG-CD1 4.43Å; L91-L112 HydrophobicContact CG-CD2 3.83Å; L91-N114 PolarHBondContact N-O 2.97Å; L91-I115 HydrophobicContact CB-CG2 4.3Å; L91-I115 HydrophobicContact CD1-CD1 4.47Å; L91-I115 HydrophobicContact CD1-CG1 4.25Å; L91-E116 WeakPolarHBondContact O-CB 3.36Å; L91-E116 PolarHBondContact O-N 3.03Å; L91-A119 HydrophobicContact CB-CB 3.95Å; L91-F120 HydrophobicContact CD1-CE1 3.89Å; L91-F120 HydrophobicContact CD1-CZ 4.14Å
92	Y	85.9	Confident	83.5	Confident	114 Å²	114	47.8 Å²	47.8	45%	0.447	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-86.9	159.7	-179.3	-64.8	-74.1	0	0	0	111.8	V90 S95 A119	V90-Y92 HydrophobicContact CG1-CD1 4.4Å; V90-Y92 HydrophobicContact CG1-CE1 4.12Å; Y92-S95 PolarHBondContact N-OG 3.13Å; Y92-S95 WeakPolarHBondContact O-CB 3.47Å; Y92-S95 PolarHBondContact O-N 3.03Å; Y92-S95 PolarHBondContact O-OG 3.31Å; Y92-A119 VanDerWaalsContact O-CA 3.3Å; Y92-A119 WeakPolarHBondContact O-CA 3.29Å; Y92-A119 WeakPolarHBondContact O-CB 3.48Å
93	P	85.5	Confident	83.6	Confident	58 Å²	58	47.7 Å²	47.7	38%	0.377	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	143.8	176.6	-25	36.4	0	0	0	111.6	S95 E116 G117	P93-S95 PolarHBondContact O-N 2.93Å; P93-S95 VanDerWaalsContact O-N 3.14Å; P93-E116 VanDerWaalsContact CD-OE2 3.29Å; P93-E116 WeakPolarHBondContact CD-OE2 3.38Å; P93-E116 HydrophobicContact CG-CB 3.99Å; P93-G117 WeakPolarHBondContact CB-O 3.42Å; P93-G117 WeakPolarHBondContact CG-O 3.02Å
94	N	84.3	Confident	83.8	Confident	68 Å²	68	47.4 Å²	47.4	36%	0.364	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	15.9	-179.4	-54.8	-63.3	0	0	0	115.2	F96 L97 G118	N94-F96 PolarHBondContact O-N 2.88Å; N94-F96 VanDerWaalsContact O-N 3.09Å; N94-L97 HydrophobicContact CB-CB 4.11Å; N94-L97 HydrophobicContact CB-CD2 4.4Å; N94-L97 WeakPolarHBondContact O-CB 3.05Å; N94-L97 PolarHBondContact O-N 2.87Å; N94-L97 VanDerWaalsContact O-N 3.08Å; N94-G118 PolarHBondContact N-O 3.03Å
95	S	81.6	Confident	84.1	Confident	7 Å²	7	45.4 Å²	45.4	5%	0.049	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-34	178.4	-73.4	0	0	0	0	113.1	P68 Y92 P93 A119	P68-S95 CarbonylContact C-O 3.52Å; P68-S95 WeakPolarHBondContact CB-O 3.42Å; Y92-S95 PolarHBondContact N-OG 3.13Å; Y92-S95 WeakPolarHBondContact O-CB 3.47Å; Y92-S95 PolarHBondContact O-N 3.03Å; Y92-S95 PolarHBondContact O-OG 3.31Å; P93-S95 PolarHBondContact O-N 2.93Å; P93-S95 VanDerWaalsContact O-N 3.14Å; S95-A119 PolarHBondContact N-O 2.96Å
96	F	84.5	Confident	84.4	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	21.3	-178.8	-60.8	-83.9	0	0	0	114.1	P68 F83 L91 N94 N98 F99 L105 L107 A119 F120 M123	P68-F96 HydrophobicContact CB-CD1 3.93Å; P68-F96 HydrophobicContact CB-CE1 3.63Å; P68-F96 HydrophobicContact CB-CE2 4.5Å; P68-F96 HydrophobicContact CB-CG 4.5Å; P68-F96 HydrophobicContact CB-CZ 3.94Å; P68-F96 HydrophobicContact CG-CD1 4.48Å; P68-F96 HydrophobicContact CG-CE1 3.72Å; P68-F96 HydrophobicContact CG-CE2 4.27Å; P68-F96 HydrophobicContact CG-CZ 3.59Å; F83-F96 HydrophobicContact CE2-CE1 4.26Å; L91-F96 HydrophobicContact CD1-CE2 4.23Å; L91-F96 HydrophobicContact CD2-CE2 4.17Å; L91-F96 HydrophobicContact CD2-CZ 4.43Å; N94-F96 PolarHBondContact O-N 2.88Å; N94-F96 VanDerWaalsContact O-N 3.09Å; F96-N98 PolarHBondContact O-N 2.89Å; F96-N98 VanDerWaalsContact O-N 3.08Å; F96-F99 HydrophobicContact CB-CB 4.46Å; F96-F99 HydrophobicContact CB-CD2 4.43Å; F96-F99 HydrophobicContact CD1-CD2 4.27Å; F96-F99 PolarHBondContact O-N 2.82Å; F96-L105 HydrophobicContact CD1-CD2 4.43Å; F96-L105 HydrophobicContact CE1-CD1 4.14Å; F96-L105 HydrophobicContact CE1-CD2 4.06Å; F96-L105 HydrophobicContact CE2-CD2 4.24Å; F96-L105 HydrophobicContact CZ-CD1 4.44Å; F96-L105 HydrophobicContact CZ-CD2 3.96Å; F96-L107 HydrophobicContact CZ-CD1 4.34Å; F96-L107 HydrophobicContact CZ-CD2 4.41Å; F96-A119 PolarHBondContact N-O 2.97Å; F96-F120 AromaticContact CD2-CD1 3.87Å; F96-F120 HydrophobicContact CD2-CD1 3.87Å; F96-F120 HydrophobicContact CD2-CE1 4.37Å; F96-F120 HydrophobicContact CE2-CD1 4.03Å; F96-F120 HydrophobicContact CE2-CE1 4.06Å; F96-M123 HydrophobicContact CB-CE 3.88Å; F96-M123 HydrophobicContact CB-CG 3.61Å; F96-M123 HydrophobicContact CB-SD 3.55Å; F96-M123 VanDerWaalsContact CB-SD 3.55Å; F96-M123 HydrophobicContact CD1-SD 4.02Å; F96-M123 HydrophobicContact CD2-CE 4.04Å; F96-M123 HydrophobicContact CD2-SD 4.47Å; F96-M123 HydrophobicContact CG-CE 3.92Å; F96-M123 HydrophobicContact CG-CG 4.49Å; F96-M123 HydrophobicContact CG-SD 3.78Å
97	L	80.9	Confident	84.8	Confident	83 Å²	83	44.5 Å²	44.5	44%	0.435	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-39.6	-171.4	-174.2	64	0	0	0	114.5	N94 M121	N94-L97 HydrophobicContact CB-CB 4.11Å; N94-L97 HydrophobicContact CB-CD2 4.4Å; N94-L97 WeakPolarHBondContact O-CB 3.05Å; N94-L97 PolarHBondContact O-N 2.87Å; N94-L97 VanDerWaalsContact O-N 3.08Å; L97-M121 VanDerWaalsContact CA-O 3.26Å; L97-M121 WeakPolarHBondContact CA-O 3.49Å; L97-M121 PolarHBondContact N-O 2.83Å
98	N	76.8	Confident	85	Confident	101 Å²	101	38 Å²	38	54%	0.54	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-13.2	-175.8	-53.5	-18.7	0	0	0	112.6	P73 F96 T100	P73-N98 HydrophobicContact CG-CB 3.68Å; P73-N98 WeakPolarHBondContact CG-O 3.02Å; F96-N98 PolarHBondContact O-N 2.89Å; F96-N98 VanDerWaalsContact O-N 3.08Å; N98-T100 PolarHBondContact O-N 2.04Å
99	F	80.1	Confident	85	Confident	4 Å²	4	40 Å²	40	2%	0.018	21%	0.208	C	C	.	.			trans	-84.9	46.6	-173.2	-68.8	-89.7	0	0	0	112.9	L71 P73 Y79 L81 F96 H101 A102 M123	L71-F99 HydrophobicContact CB-CZ 3.86Å; L71-F99 WeakPolarHBondContact O-CZ 3.47Å; P73-F99 HydrophobicContact CB-CD1 3.79Å; P73-F99 HydrophobicContact CB-CE1 3.8Å; P73-F99 HydrophobicContact CB-CG 4.28Å; P73-F99 HydrophobicContact CB-CZ 4.29Å; Y79-F99 AromaticContact CE2-CD1 3.96Å; Y79-F99 HydrophobicContact CE2-CD1 3.96Å; Y79-F99 WeakPolarHBondContact OH-CA 3.39Å; L81-F99 HydrophobicContact CD1-CB 4.31Å; L81-F99 HydrophobicContact CD1-CD1 3.69Å; L81-F99 HydrophobicContact CD1-CE1 4.33Å; L81-F99 HydrophobicContact CD1-CG 4.16Å; L81-F99 HydrophobicContact CD2-CD1 4.23Å; L81-F99 HydrophobicContact CD2-CE1 4.32Å; F96-F99 HydrophobicContact CB-CB 4.46Å; F96-F99 HydrophobicContact CB-CD2 4.43Å; F96-F99 HydrophobicContact CD1-CD2 4.27Å; F96-F99 PolarHBondContact O-N 2.82Å; F99-H101 VanDerWaalsContact C-N 3.27Å; F99-H101 PolarHBondContact O-N 2.04Å; F99-A102 HydrophobicContact CB-CB 4.48Å; F99-A102 WeakPolarHBondContact O-CB 3.44Å; F99-A102 PolarHBondContact O-N 3.33Å; F99-M123 HydrophobicContact CB-CG 4.24Å
100	T	82.5	Confident	85.1	Confident	51 Å²	51	36 Å²	36	31%	0.313	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-31.5	-171.1	56.8	0	0	0	0	114.3	N98 G122 A125	N98-T100 PolarHBondContact O-N 2.04Å; T100-G122 WeakPolarHBondContact CA-O 3.25Å; T100-A125 WeakPolarHBondContact O-CB 3.02Å; T100-A125 PolarHBondContact O-N 2.86Å
101	H	84.6	Confident	85	Confident	75 Å²	75	38.7 Å²	38.7	35%	0.347	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	8.7	-176.1	-56.7	121.8	0	0	0	114.4	S77 L78 Y79 F99 V103	S77-H101 VanDerWaalsContact O-CB 3.31Å; S77-H101 WeakPolarHBondContact O-CB 3.43Å; L78-H101 HydrophobicContact CD2-CB 4.35Å; Y79-H101 HydrophobicContact CD1-CB 4.5Å; Y79-H101 HydrophobicContact CE1-CB 3.96Å; Y79-H101 PolarHBondContact N-O 2.78Å; F99-H101 VanDerWaalsContact C-N 3.27Å; F99-H101 PolarHBondContact O-N 2.04Å; H101-V103 PolarHBondContact O-N 3.09Å
102	A	85.4	Confident	85	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	124.7	175.4	0	0	0	0	0	111.3	Y79 L81 F99 M123 A125 L126	Y79-A102 HydrophobicContact CD2-CB 4.19Å; Y79-A102 HydrophobicContact CE2-CB 3.73Å; Y79-A102 WeakPolarHBondContact O-CA 3.43Å; L81-A102 HydrophobicContact CD1-CB 3.89Å; L81-A102 HydrophobicContact CG-CB 4.29Å; F99-A102 HydrophobicContact CB-CB 4.48Å; F99-A102 WeakPolarHBondContact O-CB 3.44Å; F99-A102 PolarHBondContact O-N 3.33Å; A102-M123 HydrophobicContact CB-SD 4.39Å; A102-A125 CarbonylContact O-C 3.53Å; A102-A125 VanDerWaalsContact O-C 3.24Å; A102-L126 HydrophobicContact CB-CD1 4.31Å; A102-L126 VanDerWaalsContact O-CA 3.24Å; A102-L126 WeakPolarHBondContact O-CA 3.29Å; A102-L126 PolarHBondContact O-N 3.05Å; A102-L126 VanDerWaalsContact O-N 3.16Å
103	V	87.4	Confident	85.2	Confident	24 Å²	24	36.9 Å²	36.9	15%	0.145	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-34.7	178.7	-179.8	0	0	0	0	111.9	L78 Y79 H101 K127 Q128	L78-V103 HydrophobicContact CB-CG2 3.86Å; L78-V103 HydrophobicContact CD1-CG2 4.25Å; L78-V103 HydrophobicContact CD2-CG2 3.88Å; L78-V103 HydrophobicContact CG-CG2 4.21Å; Y79-V103 PolarHBondContact O-N 3.14Å; H101-V103 PolarHBondContact O-N 3.09Å; V103-K127 HydrophobicContact CG1-CB 4.37Å; V103-K127 HydrophobicContact CG1-CD 4.14Å; V103-K127 HydrophobicContact CG1-CG 4.46Å; V103-K127 PolarHBondContact O-N 3.21Å; V103-Q128 PolarHBondContact O-N 2.87Å
104	S	87.9	Confident	85.3	Confident	1 Å²	1	37 Å²	37	1%	0.007	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	138.6	179.7	-170	0	0	0	0	110.2	H80 L81 Q128	H80-S104 WeakPolarHBondContact ND1-CB 3.3Å; L81-S104 PolarHBondContact N-O 3.36Å; S104-Q128 WeakPolarHBondContact CA-O 3.33Å; S104-Q128 VanDerWaalsContact CB-OE1 3.3Å; S104-Q128 WeakPolarHBondContact OG-CB 3.48Å; S104-Q128 PolarHBondContact OG-OE1 3.13Å
105	L	90.5	Very high	85.6	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	118.7	178	176.3	60	0	0	0	110.3	L81 F83 F96 L107 F120 M123 L126 Q128 L129 H130	L81-L105 HydrophobicContact CB-CD1 3.79Å; L81-L105 HydrophobicContact CD1-CD1 4.24Å; L81-L105 WeakPolarHBondContact O-CA 3.49Å; F83-L105 HydrophobicContact CD2-CD1 3.82Å; F83-L105 HydrophobicContact CE2-CD1 4.29Å; F96-L105 HydrophobicContact CD1-CD2 4.43Å; F96-L105 HydrophobicContact CE1-CD1 4.14Å; F96-L105 HydrophobicContact CE1-CD2 4.06Å; F96-L105 HydrophobicContact CE2-CD2 4.24Å; F96-L105 HydrophobicContact CZ-CD1 4.44Å; F96-L105 HydrophobicContact CZ-CD2 3.96Å; L105-L107 HydrophobicContact CD1-CD1 4.41Å; L105-L107 HydrophobicContact CD1-CG 4.13Å; L105-L107 HydrophobicContact CD2-CD1 3.7Å; L105-L107 HydrophobicContact CD2-CG 4.31Å; L105-L107 HydrophobicContact CG-CD1 3.92Å; L105-L107 HydrophobicContact CG-CG 4.01Å; L105-F120 HydrophobicContact CD2-CD1 4.43Å; L105-F120 HydrophobicContact CD2-CE1 4.27Å; L105-M123 HydrophobicContact CD2-CE 3.62Å; L105-M123 HydrophobicContact CD2-SD 3.89Å; L105-L126 HydrophobicContact CB-CD1 3.79Å; L105-L126 HydrophobicContact CB-CD2 4.4Å; L105-Q128 PolarHBondContact N-O 3.36Å; L105-L129 HydrophobicContact CB-CD1 4.17Å; L105-L129 HydrophobicContact CD2-CD1 4.05Å; L105-L129 HydrophobicContact CG-CD1 4.13Å; L105-H130 PolarHBondContact O-N 2.89Å
106	Q	87.9	Confident	86	Confident	57 Å²	57	36.7 Å²	36.7	27%	0.266	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	112.6	178	-55.6	176.3	-10.4	0	0	110	L81 N82 F83 Q84	L81-Q106 PolarHBondContact O-N 3.31Å; N82-Q106 VanDerWaalsContact CG-OE1 3.28Å; N82-Q106 PolarHBondContact ND2-OE1 3.22Å; F83-Q106 CarbonylContact C-O 3Å; F83-Q106 WeakPolarHBondContact CA-O 3.27Å; F83-Q106 PolarHBondContact N-O 3.24Å; Q84-Q106 HydrophobicContact CG-CB 3.93Å
107	L	88.8	Confident	86.1	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.196	C	C	.	.			trans	-120	12.3	179.5	-76.4	164.3	0	0	0	112.1	F83 L88 L91 F96 L105 N110 L112 F120 L129 H130 L131 N134	F83-L107 HydrophobicContact CB-CD2 3.96Å; L88-L107 HydrophobicContact CD1-CD2 3.75Å; L91-L107 HydrophobicContact CD1-CD1 3.9Å; F96-L107 HydrophobicContact CZ-CD1 4.34Å; F96-L107 HydrophobicContact CZ-CD2 4.41Å; L105-L107 HydrophobicContact CD1-CD1 4.41Å; L105-L107 HydrophobicContact CD1-CG 4.13Å; L105-L107 HydrophobicContact CD2-CD1 3.7Å; L105-L107 HydrophobicContact CD2-CG 4.31Å; L105-L107 HydrophobicContact CG-CD1 3.92Å; L105-L107 HydrophobicContact CG-CG 4.01Å; L107-N110 PolarHBondContact O-ND2 3.22Å; L107-L112 HydrophobicContact CB-CD1 4.26Å; L107-F120 HydrophobicContact CD1-CE1 4.01Å; L107-F120 HydrophobicContact CD1-CZ 4.47Å; L107-L129 HydrophobicContact CD1-CD1 4.35Å; L107-H130 CarbonylContact C-O 3.6Å; L107-H130 WeakPolarHBondContact CA-O 3.32Å; L107-H130 PolarHBondContact N-O 3.48Å; L107-L131 HydrophobicContact CB-CD2 3.99Å; L107-L131 HydrophobicContact CD1-CD2 3.98Å; L107-N134 PolarHBondContact O-ND2 3.16Å
108	G	85.6	Confident	86.2	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.178	C	C	.	.			trans	-66.4	165.3	-179.7	0	0	0	0	0	114.2	Q84 N85 N110 H130 N132	Q84-G108 VanDerWaalsContact CA-O 3.26Å; Q84-G108 WeakPolarHBondContact CA-O 3.26Å; N85-G108 PolarHBondContact N-O 2.84Å; G108-N110 VanDerWaalsContact C-N 3.25Å; G108-N110 PolarHBondContact O-N 2.98Å; G108-N110 PolarHBondContact O-ND2 2.92Å; G108-H130 PolarHBondContact N-O 3.33Å; G108-N132 CarbonylContact C-O 3.59Å; G108-N132 WeakPolarHBondContact CA-O 3.42Å; G108-N132 WeakPolarHBondContact CA-OD1 3.43Å
109	N	84.1	Confident	86.7	Confident	57 Å²	57	29.3 Å²	29.3	31%	0.305	15%	0.152	S	C	.	.	S	Bend	trans	50.7	44.3	-176.9	-57.5	-31.1	0	0	0	112.7	N85 N132 N133	N85-N109 VanDerWaalsContact CA-O 3.32Å; N85-N109 WeakPolarHBondContact CA-O 3.42Å; N85-N109 PolarHBondContact N-O 2.84Å; N85-N109 WeakPolarHBondContact OD1-CB 3.24Å; N85-N109 PolarHBondContact OD1-ND2 3.37Å; N109-N132 PolarHBondContact N-O 3.35Å; N109-N133 VanDerWaalsContact CA-O 3.27Å; N109-N133 WeakPolarHBondContact CA-O 3.39Å; N109-N133 PolarHBondContact N-O 2.91Å; N109-N133 WeakPolarHBondContact OD1-CB 3.39Å; N109-N133 PolarHBondContact OD1-ND2 2.79Å
110	N	85.4	Confident	87.3	Confident	10 Å²	10	29.1 Å²	29.1	5%	0.053	15%	0.151	C	C	.	.	S	Bend	trans	-114.1	-169.7	173.1	-88.2	-99.2	0	0	0	109.1	F83 N86 L88 L107 G108 L112 N133 N134	F83-N110 PolarHBondContact O-ND2 3.06Å; N86-N110 VanDerWaalsContact CB-OD1 3.28Å; N86-N110 WeakPolarHBondContact CB-OD1 3.44Å; N86-N110 WeakPolarHBondContact O-CA 3.38Å; N86-N110 PolarHBondContact O-OD1 3.28Å; L88-N110 HydrophobicContact CB-CB 4.43Å; L88-N110 VanDerWaalsContact CB-OD1 3.27Å; L88-N110 WeakPolarHBondContact CB-OD1 3.17Å; L88-N110 VanDerWaalsContact CG-OD1 3.3Å; L88-N110 WeakPolarHBondContact CG-OD1 3.34Å; L88-N110 PolarHBondContact N-OD1 3.48Å; L88-N110 VanDerWaalsContact N-OD1 3.13Å; L107-N110 PolarHBondContact O-ND2 3.22Å; G108-N110 VanDerWaalsContact C-N 3.25Å; G108-N110 PolarHBondContact O-N 2.98Å; G108-N110 PolarHBondContact O-ND2 2.92Å; N110-L112 HydrophobicContact CB-CG 4.17Å; N110-N133 PolarHBondContact N-O 3.36Å; N110-N134 VanDerWaalsContact CA-OD1 3.32Å; N110-N134 WeakPolarHBondContact CA-OD1 3.16Å; N110-N134 WeakPolarHBondContact CB-OD1 3.31Å; N110-N134 PolarHBondContact N-OD1 3.47Å; N110-N134 PolarHBondContact O-OD1 3.23Å
111	K	86.4	Confident	87.4	Confident	100 Å²	100	30.9 Å²	30.9	44%	0.435	16%	0.157	S	C	.	.			trans	-113.6	31.1	175.2	-63.8	-159.3	171	-152.1	0	112.4	L88 I89 Q113 N134	L88-K111 CarbonylContact O-C 3.42Å; L88-K111 VanDerWaalsContact O-CA 3.3Å; L88-K111 WeakPolarHBondContact O-CA 3.12Å; L88-K111 PolarHBondContact O-N 3.06Å; I89-K111 WeakPolarHBondContact CA-O 3.43Å; I89-K111 HydrophobicContact CG1-CB 4.32Å; K111-Q113 PolarHBondContact O-N 3.34Å; K111-N134 PolarHBondContact N-OD1 3.47Å
112	L	89.7	Confident	87.2	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.151	C	C	.	.			trans	-65.2	112.2	-173.3	-67.1	173.5	0	0	0	110	L88 I89 L91 L107 N110 L131 N134 E135 L136	L88-L112 HydrophobicContact CB-CD2 3.68Å; L88-L112 HydrophobicContact CB-CG 4.31Å; L88-L112 PolarHBondContact O-N 3.43Å; L88-L112 VanDerWaalsContact O-N 3.14Å; I89-L112 WeakPolarHBondContact O-CA 3.32Å; L91-L112 HydrophobicContact CD1-CD1 4.1Å; L91-L112 HydrophobicContact CD1-CD2 4.4Å; L91-L112 HydrophobicContact CD2-CD2 4.32Å; L91-L112 HydrophobicContact CG-CD1 4.43Å; L91-L112 HydrophobicContact CG-CD2 3.83Å; L107-L112 HydrophobicContact CB-CD1 4.26Å; N110-L112 HydrophobicContact CB-CG 4.17Å; L112-L131 HydrophobicContact CD1-CD2 4.35Å; L112-N134 HydrophobicContact CB-CB 4.31Å; L112-N134 VanDerWaalsContact CB-OD1 3.29Å; L112-N134 WeakPolarHBondContact CB-OD1 3.32Å; L112-N134 WeakPolarHBondContact CG-OD1 3.26Å; L112-N134 PolarHBondContact N-OD1 3.31Å; L112-E135 CarbonylContact O-C 3.55Å; L112-E135 WeakPolarHBondContact O-CA 3.49Å; L112-E135 PolarHBondContact O-N 3.33Å; L112-L136 HydrophobicContact CB-CD2 3.96Å; L112-L136 HydrophobicContact CB-CG 4.46Å; L112-L136 WeakPolarHBondContact O-CD2 3.48Å; L112-L136 WeakPolarHBondContact O-CG 3.24Å; L112-L136 PolarHBondContact O-N 2.6Å
113	Q	89.3	Confident	87.3	Confident	78 Å²	78	28.3 Å²	28.3	36%	0.364	15%	0.151	S	C	.	.			trans	-96.2	-29.4	176.2	-69.7	-172.1	17.8	0	0	112.4	I89 K111 E135	I89-Q113 PolarHBondContact O-N 3.24Å; K111-Q113 PolarHBondContact O-N 3.34Å; Q113-E135 HydrophobicContact CG-CB 3.64Å; Q113-E135 WeakPolarHBondContact CG-OE2 3.08Å; Q113-E135 PolarHBondContact NE2-OE2 3.41Å
114	N	87.2	Confident	87.2	Confident	62 Å²	62	30.3 Å²	30.3	33%	0.332	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	147.3	-179.5	-170.9	29	0	0	0	111.8	V90 L91	V90-N114 WeakPolarHBondContact CA-O 3.49Å; L91-N114 PolarHBondContact N-O 2.97Å
115	I	91.6	Very high	87.1	Confident	4 Å²	4	31.6 Å²	31.6	2%	0.021	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	114.6	171.9	-58.5	174.3	0	0	0	106.5	L91 A119 F120 L131 L136 R140 T143	L91-I115 HydrophobicContact CB-CG2 4.3Å; L91-I115 HydrophobicContact CD1-CD1 4.47Å; L91-I115 HydrophobicContact CD1-CG1 4.25Å; I115-A119 HydrophobicContact CG2-CB 3.75Å; I115-F120 HydrophobicContact CD1-CE2 4.43Å; I115-F120 HydrophobicContact CD1-CZ 4.11Å; I115-F120 HydrophobicContact CG2-CE2 4.06Å; I115-F120 HydrophobicContact CG2-CZ 4.16Å; I115-L131 HydrophobicContact CD1-CD1 4.13Å; I115-L131 HydrophobicContact CD1-CD2 4.03Å; I115-L136 HydrophobicContact CD1-CD1 3.99Å; I115-L136 HydrophobicContact CD1-CD2 3.91Å; I115-L136 HydrophobicContact CG1-CD2 3.81Å; I115-R140 PolarHBondContact O-NH2 3.35Å; I115-T143 HydrophobicContact CB-CG2 4.03Å; I115-T143 HydrophobicContact CD1-CG2 4.34Å; I115-T143 HydrophobicContact CG2-CG2 3.92Å
116	E	89.1	Confident	87.2	Confident	64 Å²	64	31.6 Å²	31.6	30%	0.299	18%	0.177	S	C	.	.			trans	-76.1	158.1	-178.3	-64.6	-173	-174.4	0	0	111.6	V90 L91 P93 G118 A119	V90-E116 HydrophobicContact CG1-CG 4.26Å; L91-E116 WeakPolarHBondContact O-CB 3.36Å; L91-E116 PolarHBondContact O-N 3.03Å; P93-E116 VanDerWaalsContact CD-OE2 3.29Å; P93-E116 WeakPolarHBondContact CD-OE2 3.38Å; P93-E116 HydrophobicContact CG-CB 3.99Å; E116-G118 PolarHBondContact O-N 2.96Å; E116-A119 WeakPolarHBondContact O-CB 3.25Å; E116-A119 PolarHBondContact O-N 3Å; E116-A119 VanDerWaalsContact O-N 3.07Å
117	G	86.1	Confident	87.2	Confident	23 Å²	23	32.6 Å²	32.6	24%	0.237	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	128.6	-172.1	0	0	0	0	0	112.5	P93 A119 R140 D142	P93-G117 WeakPolarHBondContact CB-O 3.42Å; P93-G117 WeakPolarHBondContact CG-O 3.02Å; G117-A119 VanDerWaalsContact C-N 3.27Å; G117-A119 PolarHBondContact O-N 3.41Å; G117-R140 VanDerWaalsContact N-NH2 3.14Å; G117-D142 VanDerWaalsContact CA-CG 3.42Å; G117-D142 WeakPolarHBondContact CA-OD2 3.47Å
118	G	84	Confident	87.3	Confident	5 Å²	5	34.4 Å²	34.4	5%	0.052	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.3	24.7	-177.2	0	0	0	0	0	114.6	N94 E116 F120 M121 D142	N94-G118 PolarHBondContact N-O 3.03Å; E116-G118 PolarHBondContact O-N 2.96Å; G118-F120 PolarHBondContact O-N 2.93Å; G118-M121 WeakPolarHBondContact O-CB 3.45Å; G118-M121 PolarHBondContact O-N 3.11Å; G118-D142 PolarHBondContact N-O 3.42Å
119	A	88.1	Confident	87.7	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-35	170.5	0	0	0	0	0	112.7	L91 Y92 S95 F96 I115 E116 G117	L91-A119 HydrophobicContact CB-CB 3.95Å; Y92-A119 VanDerWaalsContact O-CA 3.3Å; Y92-A119 WeakPolarHBondContact O-CA 3.29Å; Y92-A119 WeakPolarHBondContact O-CB 3.48Å; S95-A119 PolarHBondContact N-O 2.96Å; F96-A119 PolarHBondContact N-O 2.97Å; I115-A119 HydrophobicContact CG2-CB 3.75Å; E116-A119 WeakPolarHBondContact O-CB 3.25Å; E116-A119 PolarHBondContact O-N 3Å; E116-A119 VanDerWaalsContact O-N 3.07Å; G117-A119 VanDerWaalsContact C-N 3.27Å; G117-A119 PolarHBondContact O-N 3.41Å
120	F	90.8	Very high	87.9	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	8.3	177.2	-52.4	-51.7	0	0	0	114.3	L91 F96 L105 L107 I115 G118 G122 M123 L129 L131 T143 F144 I147	L91-F120 HydrophobicContact CD1-CE1 3.89Å; L91-F120 HydrophobicContact CD1-CZ 4.14Å; F96-F120 AromaticContact CD2-CD1 3.87Å; F96-F120 HydrophobicContact CD2-CD1 3.87Å; F96-F120 HydrophobicContact CD2-CE1 4.37Å; F96-F120 HydrophobicContact CE2-CD1 4.03Å; F96-F120 HydrophobicContact CE2-CE1 4.06Å; L105-F120 HydrophobicContact CD2-CD1 4.43Å; L105-F120 HydrophobicContact CD2-CE1 4.27Å; L107-F120 HydrophobicContact CD1-CE1 4.01Å; L107-F120 HydrophobicContact CD1-CZ 4.47Å; I115-F120 HydrophobicContact CD1-CE2 4.43Å; I115-F120 HydrophobicContact CD1-CZ 4.11Å; I115-F120 HydrophobicContact CG2-CE2 4.06Å; I115-F120 HydrophobicContact CG2-CZ 4.16Å; G118-F120 PolarHBondContact O-N 2.93Å; F120-G122 PolarHBondContact O-N 2.81Å; F120-M123 HydrophobicContact CB-CE 3.61Å; F120-M123 HydrophobicContact CD1-CE 3.43Å; F120-M123 VanDerWaalsContact CD1-CE 3.43Å; F120-M123 HydrophobicContact CE1-CE 4.42Å; F120-M123 HydrophobicContact CG-CE 3.86Å; F120-M123 PolarHBondContact O-N 2.83Å; F120-L129 HydrophobicContact CD2-CD2 4.39Å; F120-L129 HydrophobicContact CE2-CD2 3.89Å; F120-L129 HydrophobicContact CZ-CD1 4.4Å; F120-L129 HydrophobicContact CZ-CD2 4.03Å; F120-L131 HydrophobicContact CZ-CD2 4.43Å; F120-T143 VanDerWaalsContact CD2-O 3.24Å; F120-T143 WeakPolarHBondContact CD2-O 3.41Å; F120-F144 HydrophobicContact CD2-CD1 4.39Å; F120-F144 HydrophobicContact CE2-CD1 4.13Å; F120-F144 HydrophobicContact CE2-CE1 4.41Å; F120-I147 HydrophobicContact CB-CG2 3.78Å; F120-I147 HydrophobicContact CD2-CD1 4.11Å
121	M	86.6	Confident	88.2	Confident	89 Å²	89	32.4 Å²	32.4	44%	0.438	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	130.5	175.3	-174.7	159.7	173.6	0	0	109.9	L97 G118 Q145	L97-M121 VanDerWaalsContact CA-O 3.26Å; L97-M121 WeakPolarHBondContact CA-O 3.49Å; L97-M121 PolarHBondContact N-O 2.83Å; G118-M121 WeakPolarHBondContact O-CB 3.45Å; G118-M121 PolarHBondContact O-N 3.11Å; M121-Q145 PolarHBondContact N-O 2.87Å
122	G	79.3	Confident	88.3	Confident	20 Å²	20	28.8 Å²	28.8	21%	0.206	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	110.3	-35.3	-174.6	0	0	0	0	0	114.4	T100 F120 S124	T100-G122 WeakPolarHBondContact CA-O 3.25Å; F120-G122 PolarHBondContact O-N 2.81Å; G122-S124 PolarHBondContact O-N 2.87Å
123	M	87.3	Confident	88.1	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.174	C	C	.	.			trans	-79.3	57.1	-174.1	-63.7	-167	-64.2	0	0	114	F96 F99 A102 L105 F120 A125 L126 I147	F96-M123 HydrophobicContact CB-CE 3.88Å; F96-M123 HydrophobicContact CB-CG 3.61Å; F96-M123 HydrophobicContact CB-SD 3.55Å; F96-M123 VanDerWaalsContact CB-SD 3.55Å; F96-M123 HydrophobicContact CD1-SD 4.02Å; F96-M123 HydrophobicContact CD2-CE 4.04Å; F96-M123 HydrophobicContact CD2-SD 4.47Å; F96-M123 HydrophobicContact CG-CE 3.92Å; F96-M123 HydrophobicContact CG-CG 4.49Å; F96-M123 HydrophobicContact CG-SD 3.78Å; F99-M123 HydrophobicContact CB-CG 4.24Å; A102-M123 HydrophobicContact CB-SD 4.39Å; L105-M123 HydrophobicContact CD2-CE 3.62Å; L105-M123 HydrophobicContact CD2-SD 3.89Å; F120-M123 HydrophobicContact CB-CE 3.61Å; F120-M123 HydrophobicContact CD1-CE 3.43Å; F120-M123 VanDerWaalsContact CD1-CE 3.43Å; F120-M123 HydrophobicContact CE1-CE 4.42Å; F120-M123 HydrophobicContact CG-CE 3.86Å; F120-M123 PolarHBondContact O-N 2.83Å; M123-A125 PolarHBondContact O-N 2.8Å; M123-L126 HydrophobicContact CB-CB 4.21Å; M123-L126 HydrophobicContact CE-CD2 4.04Å; M123-L126 WeakPolarHBondContact O-CB 3.2Å; M123-L126 PolarHBondContact O-N 3.09Å; M123-I147 HydrophobicContact CB-CG2 4.04Å; M123-I147 HydrophobicContact CE-CG2 4.27Å
124	S	85.1	Confident	88.1	Confident	67 Å²	67	27.8 Å²	27.8	47%	0.469	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-21.9	-175.1	61.6	0	0	0	0	114.2	G122 N149	G122-S124 PolarHBondContact O-N 2.87Å; S124-N149 PolarHBondContact O-ND2 3.26Å
125	A	86.4	Confident	88.4	Confident	28 Å²	28	27.5 Å²	27.5	23%	0.231	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-6.6	176	0	0	0	0	0	114.9	T100 A102 M123 K127	T100-A125 WeakPolarHBondContact O-CB 3.02Å; T100-A125 PolarHBondContact O-N 2.86Å; A102-A125 CarbonylContact O-C 3.53Å; A102-A125 VanDerWaalsContact O-C 3.24Å; M123-A125 PolarHBondContact O-N 2.8Å; A125-K127 PolarHBondContact O-N 2.88Å
126	L	91.6	Very high	88.4	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.156	C	C	.	.			trans	-68	126.8	-169.1	-163.3	76.9	0	0	0	112.5	A102 L105 M123 L129 I147 N149 L150	A102-L126 HydrophobicContact CB-CD1 4.31Å; A102-L126 VanDerWaalsContact O-CA 3.24Å; A102-L126 WeakPolarHBondContact O-CA 3.29Å; A102-L126 PolarHBondContact O-N 3.05Å; A102-L126 VanDerWaalsContact O-N 3.16Å; L105-L126 HydrophobicContact CB-CD1 3.79Å; L105-L126 HydrophobicContact CB-CD2 4.4Å; M123-L126 HydrophobicContact CB-CB 4.21Å; M123-L126 HydrophobicContact CE-CD2 4.04Å; M123-L126 WeakPolarHBondContact O-CB 3.2Å; M123-L126 PolarHBondContact O-N 3.09Å; L126-L129 HydrophobicContact CD2-CB 4.22Å; L126-I147 HydrophobicContact CB-CG2 4.08Å; L126-I147 HydrophobicContact CD2-CB 4.4Å; L126-I147 HydrophobicContact CD2-CD1 4.35Å; L126-I147 HydrophobicContact CD2-CG2 3.81Å; L126-N149 CarbonylContact O-C 3.53Å; L126-N149 VanDerWaalsContact O-C 3.22Å; L126-L150 HydrophobicContact CD2-CD1 4.02Å; L126-L150 HydrophobicContact CG-CD1 4.17Å; L126-L150 WeakPolarHBondContact O-CA 3.1Å; L126-L150 PolarHBondContact O-N 2.89Å
127	K	89.4	Confident	88.5	Confident	78 Å²	78	29 Å²	29	34%	0.339	16%	0.162	S	C	.	.			trans	-109.9	-31.1	176.6	-70.7	178.8	172.5	-107.9	0	113.4	V103 A125 L150 E151 Y152	V103-K127 HydrophobicContact CG1-CB 4.37Å; V103-K127 HydrophobicContact CG1-CD 4.14Å; V103-K127 HydrophobicContact CG1-CG 4.46Å; V103-K127 PolarHBondContact O-N 3.21Å; A125-K127 PolarHBondContact O-N 2.88Å; K127-L150 WeakPolarHBondContact O-CD1 3.03Å; K127-E151 HydrophobicContact CG-CG 4.46Å; K127-E151 IonicContact NZ-OE1 3.99Å; K127-E151 PolarHBondContact NZ-OE1 2.94Å; K127-E151 PolarHBondContact O-N 3.19Å; K127-Y152 PolarHBondContact O-N 3Å
128	Q	89.8	Confident	88.8	Confident	38 Å²	38	30.8 Å²	30.8	18%	0.178	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	131.2	-175.1	-66.7	173.2	-16.9	0	0	110.8	V103 S104 L105	V103-Q128 PolarHBondContact O-N 2.87Å; S104-Q128 WeakPolarHBondContact CA-O 3.33Å; S104-Q128 VanDerWaalsContact CB-OE1 3.3Å; S104-Q128 WeakPolarHBondContact OG-CB 3.48Å; S104-Q128 PolarHBondContact OG-OE1 3.13Å; L105-Q128 PolarHBondContact N-O 3.36Å
129	L	93.8	Very high	89.2	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	121.1	176	178.8	57	0	0	0	110.2	L105 L107 F120 L126 L131 F144 I147 L150 Y152 L153 Q154	L105-L129 HydrophobicContact CB-CD1 4.17Å; L105-L129 HydrophobicContact CD2-CD1 4.05Å; L105-L129 HydrophobicContact CG-CD1 4.13Å; L107-L129 HydrophobicContact CD1-CD1 4.35Å; F120-L129 HydrophobicContact CD2-CD2 4.39Å; F120-L129 HydrophobicContact CE2-CD2 3.89Å; F120-L129 HydrophobicContact CZ-CD1 4.4Å; F120-L129 HydrophobicContact CZ-CD2 4.03Å; L126-L129 HydrophobicContact CD2-CB 4.22Å; L129-L131 HydrophobicContact CD1-CD2 4.36Å; L129-L131 HydrophobicContact CD1-CG 4.28Å; L129-L131 HydrophobicContact CD2-CD1 4.18Å; L129-L131 HydrophobicContact CG-CD1 4.29Å; L129-L131 HydrophobicContact CG-CG 4.14Å; L129-F144 HydrophobicContact CD2-CD1 4.12Å; L129-F144 HydrophobicContact CD2-CE1 4.08Å; L129-I147 HydrophobicContact CD2-CD1 3.73Å; L129-L150 HydrophobicContact CB-CD1 3.7Å; L129-L150 HydrophobicContact CB-CD2 4.26Å; L129-Y152 PolarHBondContact N-O 3.32Å; L129-L153 HydrophobicContact CB-CD1 4.12Å; L129-L153 HydrophobicContact CD2-CD1 3.98Å; L129-L153 HydrophobicContact CG-CD1 4.04Å; L129-Q154 PolarHBondContact O-N 2.97Å
130	H	89.3	Confident	89.4	Confident	25 Å²	25	33.2 Å²	33.2	12%	0.116	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	113	178.4	-50.5	-106.6	0	0	0	110	L105 L107 G108 Y152 Q154	L105-H130 PolarHBondContact O-N 2.89Å; L107-H130 CarbonylContact C-O 3.6Å; L107-H130 WeakPolarHBondContact CA-O 3.32Å; L107-H130 PolarHBondContact N-O 3.48Å; G108-H130 PolarHBondContact N-O 3.33Å; H130-Y152 AromaticContact CE1-CE1 3.36Å; H130-Y152 WeakPolarHBondContact CE1-CE1 3.3Å; H130-Y152 AromaticContact ND1-CE1 3.61Å; H130-Q154 PolarHBondContact ND1-OE1 3.07Å
131	L	92	Very high	89.4	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.196	C	C	.	.			trans	-112.8	14.3	178.1	-65.7	168.4	0	0	0	111.8	L107 L112 I115 F120 L129 N134 L136 F144 L153 Q154 A155 N158	L107-L131 HydrophobicContact CB-CD2 3.99Å; L107-L131 HydrophobicContact CD1-CD2 3.98Å; L112-L131 HydrophobicContact CD1-CD2 4.35Å; I115-L131 HydrophobicContact CD1-CD1 4.13Å; I115-L131 HydrophobicContact CD1-CD2 4.03Å; F120-L131 HydrophobicContact CZ-CD2 4.43Å; L129-L131 HydrophobicContact CD1-CD2 4.36Å; L129-L131 HydrophobicContact CD1-CG 4.28Å; L129-L131 HydrophobicContact CD2-CD1 4.18Å; L129-L131 HydrophobicContact CG-CD1 4.29Å; L129-L131 HydrophobicContact CG-CG 4.14Å; L131-N134 PolarHBondContact O-ND2 3.43Å; L131-L136 HydrophobicContact CB-CD1 4.3Å; L131-L136 HydrophobicContact CD1-CD1 4.33Å; L131-F144 HydrophobicContact CD1-CE1 4.07Å; L131-L153 HydrophobicContact CD1-CD1 4.41Å; L131-Q154 PolarHBondContact N-O 3.05Å; L131-A155 HydrophobicContact CB-CB 4.23Å; L131-N158 PolarHBondContact O-ND2 2.88Å
132	N	88.9	Confident	89.5	Confident	23 Å²	23	33.5 Å²	33.5	12%	0.123	19%	0.186	C	C	.	.			trans	-59.3	144.5	-171.9	65.8	-73.4	0	0	0	114.1	G108 N109 N134 Q154 D156	G108-N132 CarbonylContact C-O 3.59Å; G108-N132 WeakPolarHBondContact CA-O 3.42Å; G108-N132 WeakPolarHBondContact CA-OD1 3.43Å; N109-N132 PolarHBondContact N-O 3.35Å; N132-N134 PolarHBondContact O-ND2 2.85Å; N132-Q154 HydrophobicContact CB-CG 4.18Å; N132-D156 WeakPolarHBondContact CA-O 3.37Å; N132-D156 WeakPolarHBondContact CB-OD1 3.45Å
133	N	84.5	Confident	90.1	Very high	47 Å²	47	32.6 Å²	32.6	25%	0.251	18%	0.177	S	C	.	.	S	Bend	trans	54.7	67.7	178	-166	45.4	0	0	0	112.2	N109 N110 D156 Y157	N109-N133 VanDerWaalsContact CA-O 3.27Å; N109-N133 WeakPolarHBondContact CA-O 3.39Å; N109-N133 PolarHBondContact N-O 2.91Å; N109-N133 WeakPolarHBondContact OD1-CB 3.39Å; N109-N133 PolarHBondContact OD1-ND2 2.79Å; N110-N133 PolarHBondContact N-O 3.36Å; N133-D156 PolarHBondContact N-O 2.91Å; N133-Y157 CarbonylContact C-O 3.49Å; N133-Y157 WeakPolarHBondContact CA-O 3.25Å; N133-Y157 PolarHBondContact N-O 3.4Å
134	N	89.8	Confident	90.3	Very high	10 Å²	10	32.8 Å²	32.8	5%	0.053	18%	0.177	C	C	.	.	S	Bend	trans	-139.2	-177.4	179.5	-90.5	-75.7	0	0	0	109.9	L107 N110 K111 L112 L131 N132 L136 Y157 N158	L107-N134 PolarHBondContact O-ND2 3.16Å; N110-N134 VanDerWaalsContact CA-OD1 3.32Å; N110-N134 WeakPolarHBondContact CA-OD1 3.16Å; N110-N134 WeakPolarHBondContact CB-OD1 3.31Å; N110-N134 PolarHBondContact N-OD1 3.47Å; N110-N134 PolarHBondContact O-OD1 3.23Å; K111-N134 PolarHBondContact N-OD1 3.47Å; L112-N134 HydrophobicContact CB-CB 4.31Å; L112-N134 VanDerWaalsContact CB-OD1 3.29Å; L112-N134 WeakPolarHBondContact CB-OD1 3.32Å; L112-N134 WeakPolarHBondContact CG-OD1 3.26Å; L112-N134 PolarHBondContact N-OD1 3.31Å; L131-N134 PolarHBondContact O-ND2 3.43Å; N132-N134 PolarHBondContact O-ND2 2.85Å; N134-L136 HydrophobicContact CB-CG 4.41Å; N134-Y157 PolarHBondContact N-O 3.01Å; N134-N158 VanDerWaalsContact C-OD1 3.23Å; N134-N158 WeakPolarHBondContact CB-OD1 3.2Å; N134-N158 PolarHBondContact O-OD1 2.9Å
135	E	92	Very high	90.4	Very high	56 Å²	56	34.5 Å²	34.5	26%	0.262	18%	0.178	S	C	.	.			trans	-107.4	21.1	-174.4	-62.1	-179.9	-159.1	0	0	112.9	L112 Q113 K137	L112-E135 CarbonylContact O-C 3.55Å; L112-E135 WeakPolarHBondContact O-CA 3.49Å; L112-E135 PolarHBondContact O-N 3.33Å; Q113-E135 HydrophobicContact CG-CB 3.64Å; Q113-E135 WeakPolarHBondContact CG-OE2 3.08Å; Q113-E135 PolarHBondContact NE2-OE2 3.41Å; E135-K137 PolarHBondContact O-N 3.05Å
136	L	92.9	Very high	90.4	Very high	3 Å²	3	34.4 Å²	34.4	2%	0.016	18%	0.179	C	C	.	.			trans	-66.6	128.2	-171.4	-62	172.1	0	0	0	111.4	L112 I115 L131 N134 N158 L159 I160	L112-L136 HydrophobicContact CB-CD2 3.96Å; L112-L136 HydrophobicContact CB-CG 4.46Å; L112-L136 WeakPolarHBondContact O-CD2 3.48Å; L112-L136 WeakPolarHBondContact O-CG 3.24Å; L112-L136 PolarHBondContact O-N 2.6Å; I115-L136 HydrophobicContact CD1-CD1 3.99Å; I115-L136 HydrophobicContact CD1-CD2 3.91Å; I115-L136 HydrophobicContact CG1-CD2 3.81Å; L131-L136 HydrophobicContact CB-CD1 4.3Å; L131-L136 HydrophobicContact CD1-CD1 4.33Å; N134-L136 HydrophobicContact CB-CG 4.41Å; L136-N158 HydrophobicContact CB-CB 4.35Å; L136-N158 WeakPolarHBondContact CB-OD1 3.33Å; L136-N158 VanDerWaalsContact CG-OD1 3.25Å; L136-N158 WeakPolarHBondContact CG-OD1 2.98Å; L136-N158 PolarHBondContact N-OD1 2.99Å; L136-N158 VanDerWaalsContact N-OD1 3.11Å; L136-L159 CarbonylContact O-C 3.4Å; L136-L159 VanDerWaalsContact O-CA 3.25Å; L136-L159 WeakPolarHBondContact O-CA 3.06Å; L136-L159 PolarHBondContact O-N 3.14Å; L136-I160 HydrophobicContact CB-CG1 4.31Å; L136-I160 WeakPolarHBondContact O-CG1 3.45Å; L136-I160 PolarHBondContact O-N 2.93Å
137	K	91.4	Very high	90.4	Very high	98 Å²	98	34.4 Å²	34.4	43%	0.426	18%	0.179	S	C	.	.			trans	-99.4	-26.4	-173.7	-66.7	164.2	-171.6	164	0	114.5	E135 L159 I160 K161	E135-K137 PolarHBondContact O-N 3.05Å; K137-L159 HydrophobicContact CG-CB 4.3Å; K137-I160 WeakPolarHBondContact O-CA 3.31Å; K137-K161 PolarHBondContact O-N 2.9Å
138	V	92.1	Very high	90.3	Very high	59 Å²	59	34.8 Å²	34.8	36%	0.358	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	140.4	-176	-178.9	0	0	0	0	109.5	R140 Y162	V138-R140 HydrophobicContact CG1-CG 3.88Å; V138-Y162 WeakPolarHBondContact CA-O 3.41Å; V138-Y162 HydrophobicContact CG1-CD1 4.24Å
139	L	93.1	Very high	90.3	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	115.9	164.5	-62.8	-177.3	0	0	0	109.4	F144 I160 Y162 I163 E164 F168 L179	L139-F144 HydrophobicContact CD1-CE2 4.28Å; L139-F144 HydrophobicContact CD1-CZ 4.32Å; L139-F144 HydrophobicContact CD2-CE2 4.32Å; L139-F144 HydrophobicContact CD2-CZ 3.98Å; L139-I160 HydrophobicContact CD1-CD1 3.96Å; L139-I160 HydrophobicContact CD2-CD1 4.03Å; L139-I160 HydrophobicContact CG-CD1 3.86Å; L139-I160 HydrophobicContact CG-CG1 4.33Å; L139-I160 HydrophobicContact CG-CG2 4.15Å; L139-Y162 PolarHBondContact N-O 3.17Å; L139-Y162 VanDerWaalsContact N-O 3.09Å; L139-I163 HydrophobicContact CB-CG1 4.32Å; L139-I163 HydrophobicContact CB-CG2 4.35Å; L139-I163 HydrophobicContact CD1-CD1 4.36Å; L139-I163 HydrophobicContact CD1-CG1 4.33Å; L139-E164 PolarHBondContact O-N 2.84Å; L139-F168 HydrophobicContact CD1-CE1 4.26Å; L139-F168 HydrophobicContact CD1-CZ 4.18Å; L139-L179 HydrophobicContact CD1-CD2 4.34Å
140	R	92.1	Very high	90.3	Very high	55 Å²	55	35.7 Å²	35.7	21%	0.208	19%	0.188	C	C	.	.			trans	-96.7	158.2	-173.7	-56.1	-174.7	-57.8	95.3	18.8	111.5	I115 G117 V138 D142 T143 E164	I115-R140 PolarHBondContact O-NH2 3.35Å; G117-R140 VanDerWaalsContact N-NH2 3.14Å; V138-R140 HydrophobicContact CG1-CG 3.88Å; R140-D142 VanDerWaalsContact CB-OD1 3.27Å; R140-D142 WeakPolarHBondContact CB-OD1 3.48Å; R140-D142 IonicContact CZ-OD1 3.4Å; R140-D142 IonicContact CZ-OD2 2.67Å; R140-D142 IonicContact NE-OD1 3.06Å; R140-D142 IonicContact NH1-OD1 2.87Å; R140-D142 PolarHBondContact NH1-OD1 3.23Å; R140-D142 IonicContact NH1-OD2 2.76Å; R140-D142 PolarHBondContact NH1-OD2 3.17Å; R140-D142 IonicContact NH2-OD1 3.17Å; R140-D142 PolarHBondContact NH2-OD1 3.39Å; R140-D142 IonicContact NH2-OD2 2.67Å; R140-D142 PolarHBondContact NH2-OD2 2.97Å; R140-D142 VanDerWaalsContact NH2-OD2 3.17Å; R140-D142 PolarHBondContact O-N 3.06Å; R140-D142 VanDerWaalsContact O-N 3.13Å; R140-T143 WeakPolarHBondContact CB-OG1 3.28Å; R140-T143 PolarHBondContact N-OG1 3.09Å; R140-T143 WeakPolarHBondContact O-CB 3.37Å; R140-T143 PolarHBondContact O-N 2.96Å; R140-T143 VanDerWaalsContact O-N 3.09Å; R140-T143 PolarHBondContact O-OG1 3.07Å; R140-T143 VanDerWaalsContact O-OG1 3.14Å; R140-E164 VanDerWaalsContact CA-OE2 3.29Å; R140-E164 WeakPolarHBondContact CA-OE2 3.4Å; R140-E164 WeakPolarHBondContact CB-OE2 3.23Å; R140-E164 WeakPolarHBondContact CG-OE1 3.29Å
141	A	89.3	Confident	90.4	Very high	53 Å²	53	35.3 Å²	35.3	44%	0.438	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-23.2	-173.2	0	0	0	0	0	114.2	E164	A141-E164 HydrophobicContact CB-CB 4.33Å; A141-E164 PolarHBondContact N-OE2 3.28Å
142	D	89.9	Confident	90.2	Very high	42 Å²	42	35.6 Å²	35.6	23%	0.225	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-6.1	-179.8	63.7	-12.3	0	0	0	113.8	G117 G118 R140 F144 Q145	G117-D142 VanDerWaalsContact CA-CG 3.42Å; G117-D142 WeakPolarHBondContact CA-OD2 3.47Å; G118-D142 PolarHBondContact N-O 3.42Å; R140-D142 VanDerWaalsContact CB-OD1 3.27Å; R140-D142 WeakPolarHBondContact CB-OD1 3.48Å; R140-D142 IonicContact CZ-OD1 3.4Å; R140-D142 IonicContact CZ-OD2 2.67Å; R140-D142 IonicContact NE-OD1 3.06Å; R140-D142 IonicContact NH1-OD1 2.87Å; R140-D142 PolarHBondContact NH1-OD1 3.23Å; R140-D142 IonicContact NH1-OD2 2.76Å; R140-D142 PolarHBondContact NH1-OD2 3.17Å; R140-D142 IonicContact NH2-OD1 3.17Å; R140-D142 PolarHBondContact NH2-OD1 3.39Å; R140-D142 IonicContact NH2-OD2 2.67Å; R140-D142 PolarHBondContact NH2-OD2 2.97Å; R140-D142 VanDerWaalsContact NH2-OD2 3.17Å; R140-D142 PolarHBondContact O-N 3.06Å; R140-D142 VanDerWaalsContact O-N 3.13Å; D142-F144 VanDerWaalsContact C-N 3.34Å; D142-F144 PolarHBondContact O-N 3.23Å; D142-Q145 VanDerWaalsContact O-CB 3.26Å; D142-Q145 WeakPolarHBondContact O-CB 3.25Å; D142-Q145 PolarHBondContact O-N 3Å
143	T	90.4	Very high	90.5	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.012	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-43.5	-173	-64.2	0	0	0	0	111.8	I115 F120 R140	I115-T143 HydrophobicContact CB-CG2 4.03Å; I115-T143 HydrophobicContact CD1-CG2 4.34Å; I115-T143 HydrophobicContact CG2-CG2 3.92Å; F120-T143 VanDerWaalsContact CD2-O 3.24Å; F120-T143 WeakPolarHBondContact CD2-O 3.41Å; R140-T143 WeakPolarHBondContact CB-OG1 3.28Å; R140-T143 PolarHBondContact N-OG1 3.09Å; R140-T143 WeakPolarHBondContact O-CB 3.37Å; R140-T143 PolarHBondContact O-N 2.96Å; R140-T143 VanDerWaalsContact O-N 3.09Å; R140-T143 PolarHBondContact O-OG1 3.07Å; R140-T143 VanDerWaalsContact O-OG1 3.14Å
144	F	91.4	Very high	90.8	Very high	3 Å²	3	32.9 Å²	32.9	1%	0.013	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	22.5	-178	-51.8	-69.4	0	0	0	113	F120 L129 L131 L139 D142 G146 I147 L153 F168 L171	F120-F144 HydrophobicContact CD2-CD1 4.39Å; F120-F144 HydrophobicContact CE2-CD1 4.13Å; F120-F144 HydrophobicContact CE2-CE1 4.41Å; L129-F144 HydrophobicContact CD2-CD1 4.12Å; L129-F144 HydrophobicContact CD2-CE1 4.08Å; L131-F144 HydrophobicContact CD1-CE1 4.07Å; L139-F144 HydrophobicContact CD1-CE2 4.28Å; L139-F144 HydrophobicContact CD1-CZ 4.32Å; L139-F144 HydrophobicContact CD2-CE2 4.32Å; L139-F144 HydrophobicContact CD2-CZ 3.98Å; D142-F144 VanDerWaalsContact C-N 3.34Å; D142-F144 PolarHBondContact O-N 3.23Å; F144-G146 PolarHBondContact O-N 2.71Å; F144-I147 HydrophobicContact CB-CD1 4.09Å; F144-I147 HydrophobicContact CB-CG1 4.12Å; F144-I147 HydrophobicContact CD1-CD1 3.98Å; F144-I147 VanDerWaalsContact O-CG1 3.31Å; F144-I147 WeakPolarHBondContact O-CG1 3.36Å; F144-L153 HydrophobicContact CE1-CD1 3.95Å; F144-L153 HydrophobicContact CE1-CD2 4.01Å; F144-L153 HydrophobicContact CE2-CD2 4.17Å; F144-L153 HydrophobicContact CZ-CD1 4.33Å; F144-L153 HydrophobicContact CZ-CD2 3.77Å; F144-F168 HydrophobicContact CD2-CD1 4.21Å; F144-F168 HydrophobicContact CD2-CE1 4.29Å; F144-F168 HydrophobicContact CE2-CD1 4.14Å; F144-F168 AromaticContact CE2-CE1 3.76Å; F144-F168 HydrophobicContact CE2-CE1 3.76Å; F144-L171 HydrophobicContact CB-CD1 4.16Å; F144-L171 HydrophobicContact CB-CD2 4Å; F144-L171 HydrophobicContact CB-CG 4.42Å; F144-L171 HydrophobicContact CD2-CD1 4.34Å; F144-L171 HydrophobicContact CG-CD1 4.23Å
145	Q	89.1	Confident	90.9	Very high	104 Å²	104	32.5 Å²	32.5	49%	0.486	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	120.9	176.4	-177.3	170.9	-19.8	0	0	110.9	M121 D142	M121-Q145 PolarHBondContact N-O 2.87Å; D142-Q145 VanDerWaalsContact O-CB 3.26Å; D142-Q145 WeakPolarHBondContact O-CB 3.25Å; D142-Q145 PolarHBondContact O-N 3Å
146	G	85	Confident	90.6	Very high	25 Å²	25	30.5 Å²	30.5	26%	0.258	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	115.3	-18.2	178.4	0	0	0	0	0	115.2	F144	F144-G146 PolarHBondContact O-N 2.71Å
147	I	91.1	Very high	90.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.166	C	C	.	.			trans	-108.7	49.3	-174.8	57.2	172.1	0	0	0	112.5	F120 M123 L126 L129 F144 N149 L150 L171	F120-I147 HydrophobicContact CB-CG2 3.78Å; F120-I147 HydrophobicContact CD2-CD1 4.11Å; M123-I147 HydrophobicContact CB-CG2 4.04Å; M123-I147 HydrophobicContact CE-CG2 4.27Å; L126-I147 HydrophobicContact CB-CG2 4.08Å; L126-I147 HydrophobicContact CD2-CB 4.4Å; L126-I147 HydrophobicContact CD2-CD1 4.35Å; L126-I147 HydrophobicContact CD2-CG2 3.81Å; L129-I147 HydrophobicContact CD2-CD1 3.73Å; F144-I147 HydrophobicContact CB-CD1 4.09Å; F144-I147 HydrophobicContact CB-CG1 4.12Å; F144-I147 HydrophobicContact CD1-CD1 3.98Å; F144-I147 VanDerWaalsContact O-CG1 3.31Å; F144-I147 WeakPolarHBondContact O-CG1 3.36Å; I147-N149 PolarHBondContact O-N 2.76Å; I147-L150 HydrophobicContact CD1-CD1 4.38Å; I147-L150 HydrophobicContact CD1-CD2 4.02Å; I147-L150 WeakPolarHBondContact O-CB 3.35Å; I147-L150 PolarHBondContact O-N 2.72Å; I147-L150 VanDerWaalsContact O-N 3.09Å; I147-L171 HydrophobicContact CG1-CD2 4.15Å; I147-L171 WeakPolarHBondContact O-CD2 3.49Å
148	E	88.8	Confident	90.1	Very high	87 Å²	87	27.2 Å²	27.2	41%	0.407	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-13.1	-174.8	-57.1	-170	154.1	0	0	114.1	K170	E148-K170 IonicContact OE1-NZ 3Å; E148-K170 PolarHBondContact OE1-NZ 3.23Å
149	N	90.2	Very high	90.1	Very high	56 Å²	56	28 Å²	28	30%	0.299	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	1.9	176.1	-78.3	-55.1	0	0	0	114.8	S124 L126 I147 E151 K173	S124-N149 PolarHBondContact O-ND2 3.26Å; L126-N149 CarbonylContact O-C 3.53Å; L126-N149 VanDerWaalsContact O-C 3.22Å; I147-N149 PolarHBondContact O-N 2.76Å; N149-E151 WeakPolarHBondContact O-CG 3.12Å; N149-E151 PolarHBondContact O-N 2.86Å; N149-K173 WeakPolarHBondContact OD1-CE 3.27Å; N149-K173 PolarHBondContact OD1-NZ 3.03Å
150	L	93.1	Very high	90.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.149	C	C	.	.			trans	-61	129.2	-176.3	-163	76.4	0	0	0	111.9	L126 K127 L129 I147 L153 L171 K173 L174	L126-L150 HydrophobicContact CD2-CD1 4.02Å; L126-L150 HydrophobicContact CG-CD1 4.17Å; L126-L150 WeakPolarHBondContact O-CA 3.1Å; L126-L150 PolarHBondContact O-N 2.89Å; K127-L150 WeakPolarHBondContact O-CD1 3.03Å; L129-L150 HydrophobicContact CB-CD1 3.7Å; L129-L150 HydrophobicContact CB-CD2 4.26Å; I147-L150 HydrophobicContact CD1-CD1 4.38Å; I147-L150 HydrophobicContact CD1-CD2 4.02Å; I147-L150 WeakPolarHBondContact O-CB 3.35Å; I147-L150 PolarHBondContact O-N 2.72Å; I147-L150 VanDerWaalsContact O-N 3.09Å; L150-L153 HydrophobicContact CD2-CB 3.86Å; L150-L153 HydrophobicContact CD2-CD1 4.22Å; L150-L153 HydrophobicContact CD2-CG 4.42Å; L150-L171 HydrophobicContact CB-CD2 4.22Å; L150-L171 HydrophobicContact CD2-CD1 4.26Å; L150-K173 CarbonylContact O-C 3.24Å; L150-L174 HydrophobicContact CD2-CD1 4.32Å; L150-L174 WeakPolarHBondContact O-CA 3.38Å; L150-L174 PolarHBondContact O-N 2.82Å; L150-L174 VanDerWaalsContact O-N 3.09Å
151	E	90.4	Very high	90.1	Very high	17 Å²	17	31.1 Å²	31.1	8%	0.079	16%	0.164	C	C	.	.			trans	-110.9	-26.8	179.6	-54.3	-164.2	-134.5	0	0	112.5	K127 N149 K173 K175 V176 Y840	K127-E151 HydrophobicContact CG-CG 4.46Å; K127-E151 IonicContact NZ-OE1 3.99Å; K127-E151 PolarHBondContact NZ-OE1 2.94Å; K127-E151 PolarHBondContact O-N 3.19Å; N149-E151 WeakPolarHBondContact O-CG 3.12Å; N149-E151 PolarHBondContact O-N 2.86Å; E151-K173 WeakPolarHBondContact CA-O 3.22Å; E151-K173 HydrophobicContact CG-CB 4.07Å; E151-K175 PolarHBondContact O-N 3.02Å; E151-K175 VanDerWaalsContact OE2-CE 3.28Å; E151-K175 WeakPolarHBondContact OE2-CE 3.25Å; E151-K175 IonicContact OE2-NZ 2.6Å; E151-K175 PolarHBondContact OE2-NZ 3.19Å; E151-V176 PolarHBondContact O-N 3.34Å; E151-V176 VanDerWaalsContact O-N 3.14Å; E151-Y840 HydrophobicContact CB-CE2 3.6Å; E151-Y840 VanDerWaalsContact CD-OH 3.25Å; E151-Y840 PolarHBondContact OE1-OH 2.93Å; E151-Y840 PolarHBondContact OE2-OH 3.45Å
152	Y	89.4	Confident	90.1	Very high	7 Å²	7	34.4 Å²	34.4	3%	0.027	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	123.2	-179.9	178.8	-78.3	0	0	0	110.6	K127 L129 H130 Q154 V176 I178	K127-Y152 PolarHBondContact O-N 3Å; L129-Y152 PolarHBondContact N-O 3.32Å; H130-Y152 AromaticContact CE1-CE1 3.36Å; H130-Y152 WeakPolarHBondContact CE1-CE1 3.3Å; H130-Y152 AromaticContact ND1-CE1 3.61Å; Y152-Q154 HydrophobicContact CD1-CB 4.38Å; Y152-Q154 HydrophobicContact CE1-CB 3.52Å; Y152-Q154 PolarHBondContact OH-OE1 3.14Å; Y152-V176 HydrophobicContact CD2-CB 3.62Å; Y152-V176 HydrophobicContact CD2-CG1 3.59Å; Y152-V176 HydrophobicContact CD2-CG2 4.02Å; Y152-V176 HydrophobicContact CE2-CB 4.29Å; Y152-V176 HydrophobicContact CE2-CG1 3.73Å; Y152-V176 HydrophobicContact CG-CB 4.26Å; Y152-V176 HydrophobicContact CG-CG1 4.48Å; Y152-I178 HydrophobicContact CE2-CD1 4.04Å; Y152-I178 WeakPolarHBondContact OH-CD1 3.45Å
153	L	94.4	Very high	90.3	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	122.1	173.5	179.8	56.4	0	0	0	110.4	L129 L131 F144 L150 F168 L171 L174 V176 L177 I178	L129-L153 HydrophobicContact CB-CD1 4.12Å; L129-L153 HydrophobicContact CD2-CD1 3.98Å; L129-L153 HydrophobicContact CG-CD1 4.04Å; L131-L153 HydrophobicContact CD1-CD1 4.41Å; F144-L153 HydrophobicContact CE1-CD1 3.95Å; F144-L153 HydrophobicContact CE1-CD2 4.01Å; F144-L153 HydrophobicContact CE2-CD2 4.17Å; F144-L153 HydrophobicContact CZ-CD1 4.33Å; F144-L153 HydrophobicContact CZ-CD2 3.77Å; L150-L153 HydrophobicContact CD2-CB 3.86Å; L150-L153 HydrophobicContact CD2-CD1 4.22Å; L150-L153 HydrophobicContact CD2-CG 4.42Å; L153-F168 HydrophobicContact CD2-CD1 4.39Å; L153-F168 HydrophobicContact CD2-CE1 3.93Å; L153-L171 HydrophobicContact CD2-CD1 4.36Å; L153-L174 HydrophobicContact CB-CD1 3.75Å; L153-V176 PolarHBondContact N-O 3Å; L153-L177 HydrophobicContact CB-CD1 4.09Å; L153-L177 HydrophobicContact CD2-CD1 3.9Å; L153-L177 HydrophobicContact CG-CD1 4.03Å; L153-L177 WeakPolarHBondContact O-CA 3.36Å; L153-I178 PolarHBondContact O-N 3.28Å
154	Q	90.3	Very high	90.4	Very high	13 Å²	13	35.3 Å²	35.3	6%	0.061	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	121.8	176.5	175.4	-176	-8.1	0	0	110.1	L129 H130 L131 N132 Y152 D156 I178	L129-Q154 PolarHBondContact O-N 2.97Å; H130-Q154 PolarHBondContact ND1-OE1 3.07Å; L131-Q154 PolarHBondContact N-O 3.05Å; N132-Q154 HydrophobicContact CB-CG 4.18Å; Y152-Q154 HydrophobicContact CD1-CB 4.38Å; Y152-Q154 HydrophobicContact CE1-CB 3.52Å; Y152-Q154 PolarHBondContact OH-OE1 3.14Å; Q154-D156 VanDerWaalsContact CD-OD1 3.3Å; Q154-D156 WeakPolarHBondContact CG-OD1 3.39Å; Q154-D156 PolarHBondContact NE2-OD1 2.95Å; Q154-I178 HydrophobicContact CB-CB 4.39Å; Q154-I178 HydrophobicContact CB-CD1 4.36Å; Q154-I178 HydrophobicContact CG-CB 4.29Å; Q154-I178 HydrophobicContact CG-CD1 4.34Å; Q154-I178 HydrophobicContact CG-CG2 4.38Å
155	A	92.1	Very high	90.3	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.008	20%	0.195	C	C	.	.			trans	-142.5	37.3	177.4	0	0	0	0	0	111.9	L131 N158 I160 I178 L179 N182	L131-A155 HydrophobicContact CB-CB 4.23Å; A155-N158 PolarHBondContact O-ND2 2.78Å; A155-I160 HydrophobicContact CB-CD1 4.33Å; A155-I178 PolarHBondContact N-O 3.47Å; A155-L179 HydrophobicContact CB-CD2 4.17Å; A155-N182 PolarHBondContact O-ND2 3.32Å
156	D	85.8	Confident	90.2	Very high	14 Å²	14	36.9 Å²	36.9	8%	0.075	18%	0.177	C	C	.	.			trans	-60.4	162.5	169	62.1	-75.2	0	0	0	112.3	N132 N133 Q154 N158 I178 N180	N132-D156 WeakPolarHBondContact CA-O 3.37Å; N132-D156 WeakPolarHBondContact CB-OD1 3.45Å; N133-D156 PolarHBondContact N-O 2.91Å; Q154-D156 VanDerWaalsContact CD-OD1 3.3Å; Q154-D156 WeakPolarHBondContact CG-OD1 3.39Å; Q154-D156 PolarHBondContact NE2-OD1 2.95Å; D156-N158 PolarHBondContact O-N 3.47Å; D156-N158 PolarHBondContact O-ND2 2.97Å; D156-I178 HydrophobicContact CB-CG2 4.19Å; D156-N180 VanDerWaalsContact CA-O 3.3Å; D156-N180 WeakPolarHBondContact CA-O 3.43Å; D156-N180 VanDerWaalsContact CB-OD1 3.23Å; D156-N180 WeakPolarHBondContact CB-OD1 3.12Å
157	Y	84.1	Confident	90.5	Very high	27 Å²	27	35.9 Å²	35.9	11%	0.106	17%	0.166	C	C	.	.	S	Bend	trans	48.6	59.6	178.8	-81.2	-62.2	0	0	0	112.6	N133 N134 N180 D181 Y828 E829 A832 K833	N133-Y157 CarbonylContact C-O 3.49Å; N133-Y157 WeakPolarHBondContact CA-O 3.25Å; N133-Y157 PolarHBondContact N-O 3.4Å; N134-Y157 PolarHBondContact N-O 3.01Å; Y157-N180 PolarHBondContact N-O 3.44Å; Y157-D181 HydrophobicContact CD1-CB 4.09Å; Y157-D181 HydrophobicContact CE1-CB 4.14Å; Y157-Y828 PolarHBondContact OH-O 2.97Å; Y157-E829 PolarHBondContact OH-O 2.89Å; Y157-A832 HydrophobicContact CE1-CB 4.35Å; Y157-A832 VanDerWaalsContact CE2-C 3.45Å; Y157-A832 HydrophobicContact CE2-CB 3.72Å; Y157-A832 VanDerWaalsContact OH-C 3.27Å; Y157-A832 VanDerWaalsContact OH-CA 3.22Å; Y157-A832 WeakPolarHBondContact OH-CA 3.42Å; Y157-A832 WeakPolarHBondContact OH-CB 3.48Å; Y157-A832 PolarHBondContact OH-N 2.94Å; Y157-K833 HydrophobicContact CD2-CG 4.47Å; Y157-K833 HydrophobicContact CE2-CB 4.46Å; Y157-K833 HydrophobicContact CE2-CG 3.6Å; Y157-K833 PolarHBondContact OH-N 3.33Å
158	N	90.1	Very high	90.5	Very high	6 Å²	6	35.9 Å²	35.9	3%	0.032	17%	0.166	C	C	.	.	S	Bend	trans	-130.7	179.5	172.9	-86.6	-94.1	0	0	0	109.3	L131 N134 L136 A155 D156 I160 N182	L131-N158 PolarHBondContact O-ND2 2.88Å; N134-N158 VanDerWaalsContact C-OD1 3.23Å; N134-N158 WeakPolarHBondContact CB-OD1 3.2Å; N134-N158 PolarHBondContact O-OD1 2.9Å; L136-N158 HydrophobicContact CB-CB 4.35Å; L136-N158 WeakPolarHBondContact CB-OD1 3.33Å; L136-N158 VanDerWaalsContact CG-OD1 3.25Å; L136-N158 WeakPolarHBondContact CG-OD1 2.98Å; L136-N158 PolarHBondContact N-OD1 2.99Å; L136-N158 VanDerWaalsContact N-OD1 3.11Å; A155-N158 PolarHBondContact O-ND2 2.78Å; D156-N158 PolarHBondContact O-N 3.47Å; D156-N158 PolarHBondContact O-ND2 2.97Å; N158-I160 HydrophobicContact CB-CD1 4.01Å; N158-I160 HydrophobicContact CB-CG1 3.96Å; N158-N182 WeakPolarHBondContact CA-OD1 3.41Å; N158-N182 WeakPolarHBondContact CB-OD1 3.16Å; N158-N182 PolarHBondContact O-OD1 3.04Å
159	L	91.1	Very high	90.4	Very high	74 Å²	74	34.5 Å²	34.5	39%	0.387	16%	0.161	S	C	.	.			trans	-104.1	26.4	-178.9	-59.1	177.5	0	0	0	111.4	L136 K137 K161 L183	L136-L159 CarbonylContact O-C 3.4Å; L136-L159 VanDerWaalsContact O-CA 3.25Å; L136-L159 WeakPolarHBondContact O-CA 3.06Å; L136-L159 PolarHBondContact O-N 3.14Å; K137-L159 HydrophobicContact CG-CB 4.3Å; L159-K161 PolarHBondContact O-N 2.86Å; L159-L183 HydrophobicContact CD2-CD1 4.35Å
160	I	94	Very high	90.2	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.169	C	C	.	.			trans	-67.3	108.9	-169.3	-60.1	163	0	0	0	108.8	L136 K137 L139 A155 N158 I163 N182 L183 I184	L136-I160 HydrophobicContact CB-CG1 4.31Å; L136-I160 WeakPolarHBondContact O-CG1 3.45Å; L136-I160 PolarHBondContact O-N 2.93Å; K137-I160 WeakPolarHBondContact O-CA 3.31Å; L139-I160 HydrophobicContact CD1-CD1 3.96Å; L139-I160 HydrophobicContact CD2-CD1 4.03Å; L139-I160 HydrophobicContact CG-CD1 3.86Å; L139-I160 HydrophobicContact CG-CG1 4.33Å; L139-I160 HydrophobicContact CG-CG2 4.15Å; A155-I160 HydrophobicContact CB-CD1 4.33Å; N158-I160 HydrophobicContact CB-CD1 4.01Å; N158-I160 HydrophobicContact CB-CG1 3.96Å; I160-I163 HydrophobicContact CG2-CG1 4.07Å; I160-N182 HydrophobicContact CB-CB 4.38Å; I160-N182 WeakPolarHBondContact CB-OD1 3.3Å; I160-N182 WeakPolarHBondContact CD1-OD1 2.94Å; I160-N182 VanDerWaalsContact CG1-OD1 3.25Å; I160-N182 WeakPolarHBondContact CG1-OD1 3.17Å; I160-N182 PolarHBondContact N-OD1 2.92Å; I160-N182 VanDerWaalsContact N-OD1 3.07Å; I160-L183 CarbonylContact O-C 3.56Å; I160-L183 VanDerWaalsContact O-CA 3.3Å; I160-L183 WeakPolarHBondContact O-CA 3.23Å; I160-L183 PolarHBondContact O-N 2.92Å; I160-I184 HydrophobicContact CB-CG1 4.44Å; I160-I184 HydrophobicContact CG2-CG1 4.11Å; I160-I184 WeakPolarHBondContact O-CG1 3.06Å; I160-I184 PolarHBondContact O-N 3.06Å
161	K	91.3	Very high	90.1	Very high	123 Å²	123	36.9 Å²	36.9	54%	0.535	17%	0.169	S	C	.	.			trans	-92.1	-29.4	176.6	-69.6	175.9	-176.9	-177.2	0	112.4	K137 L159 L183	K137-K161 PolarHBondContact O-N 2.9Å; L159-K161 PolarHBondContact O-N 2.86Å; K161-L183 HydrophobicContact CG-CB 3.73Å; K161-L183 HydrophobicContact CG-CD1 4.1Å
162	Y	91.1	Very high	90	Very high	122 Å²	122	40.8 Å²	40.8	48%	0.478	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	143.5	-172.4	-171	-110.2	0	0	0	111.5	V138 L139 E164	V138-Y162 WeakPolarHBondContact CA-O 3.41Å; V138-Y162 HydrophobicContact CG1-CD1 4.24Å; L139-Y162 PolarHBondContact N-O 3.17Å; L139-Y162 VanDerWaalsContact N-O 3.09Å; Y162-E164 HydrophobicContact CD1-CG 4.19Å; Y162-E164 HydrophobicContact CE1-CB 4.42Å; Y162-E164 HydrophobicContact CE1-CG 3.78Å
163	I	93.7	Very high	90	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	125.4	171.5	-58.5	-179.9	0	0	0	106	L139 I160 A167 F168 L179 I184 L187 P188 I191	L139-I163 HydrophobicContact CB-CG1 4.32Å; L139-I163 HydrophobicContact CB-CG2 4.35Å; L139-I163 HydrophobicContact CD1-CD1 4.36Å; L139-I163 HydrophobicContact CD1-CG1 4.33Å; I160-I163 HydrophobicContact CG2-CG1 4.07Å; I163-A167 HydrophobicContact CG2-CB 3.73Å; I163-F168 HydrophobicContact CD1-CZ 4.4Å; I163-F168 HydrophobicContact CG2-CZ 4.48Å; I163-L179 HydrophobicContact CD1-CD1 4.19Å; I163-I184 HydrophobicContact CD1-CD1 3.93Å; I163-I184 HydrophobicContact CD1-CG1 4.49Å; I163-L187 HydrophobicContact CD1-CD2 4.31Å; I163-P188 HydrophobicContact CB-CG 4.29Å; I163-P188 HydrophobicContact CG2-CG 4.2Å; I163-P188 WeakPolarHBondContact O-CG 3.23Å; I163-I191 HydrophobicContact CG2-CD1 4.05Å
164	E	92	Very high	89.9	Confident	63 Å²	63	45.3 Å²	45.3	29%	0.294	21%	0.207	S	C	.	.			trans	-69.1	148.9	178.6	-77.6	177.1	-170.8	0	0	111.9	L139 R140 A141 Y162 G166 A167	L139-E164 PolarHBondContact O-N 2.84Å; R140-E164 VanDerWaalsContact CA-OE2 3.29Å; R140-E164 WeakPolarHBondContact CA-OE2 3.4Å; R140-E164 WeakPolarHBondContact CB-OE2 3.23Å; R140-E164 WeakPolarHBondContact CG-OE1 3.29Å; A141-E164 HydrophobicContact CB-CB 4.33Å; A141-E164 PolarHBondContact N-OE2 3.28Å; Y162-E164 HydrophobicContact CD1-CG 4.19Å; Y162-E164 HydrophobicContact CE1-CB 4.42Å; Y162-E164 HydrophobicContact CE1-CG 3.78Å; E164-G166 PolarHBondContact O-N 3.16Å; E164-A167 PolarHBondContact O-N 3.39Å; E164-A167 VanDerWaalsContact O-N 3.14Å
165	K	88.6	Confident	89.7	Confident	131 Å²	131	46.1 Å²	46.1	57%	0.57	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	108.2	177.3	-67.8	-158.3	178.8	-172.7	0	109.9	P188 E189	K165-P188 HydrophobicContact CG-CB 3.9Å; K165-E189 IonicContact NZ-OE2 3.96Å; K165-E189 PolarHBondContact NZ-OE2 2.87Å
166	G	87.5	Confident	89.4	Confident	9 Å²	9	46.1 Å²	46.1	9%	0.093	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	98.9	12.7	176.7	0	0	0	0	0	116.6	E164 F168 N169	E164-G166 PolarHBondContact O-N 3.16Å; G166-F168 PolarHBondContact O-N 2.83Å; G166-N169 VanDerWaalsContact CA-ND2 3.28Å; G166-N169 WeakPolarHBondContact CA-ND2 3.49Å; G166-N169 WeakPolarHBondContact CA-OD1 3.44Å; G166-N169 VanDerWaalsContact O-CB 3.25Å; G166-N169 WeakPolarHBondContact O-CB 3.45Å; G166-N169 PolarHBondContact O-N 3.39Å
167	A	90.5	Very high	89.8	Confident	3 Å²	3	45.4 Å²	45.4	3%	0.025	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.3	-30.9	175.6	0	0	0	0	0	114.6	I163 E164 I191	I163-A167 HydrophobicContact CG2-CB 3.73Å; E164-A167 PolarHBondContact O-N 3.39Å; E164-A167 VanDerWaalsContact O-N 3.14Å; A167-I191 HydrophobicContact CB-CD1 4.35Å
168	F	91.5	Very high	89.9	Confident	1 Å²	1	44.2 Å²	44.2	0%	0.004	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	6.4	176.9	-45.7	-44.5	0	0	0	114.2	L139 F144 L153 I163 G166 K170 L171 L177 L179 I191 F192	L139-F168 HydrophobicContact CD1-CE1 4.26Å; L139-F168 HydrophobicContact CD1-CZ 4.18Å; F144-F168 HydrophobicContact CD2-CD1 4.21Å; F144-F168 HydrophobicContact CD2-CE1 4.29Å; F144-F168 HydrophobicContact CE2-CD1 4.14Å; F144-F168 AromaticContact CE2-CE1 3.76Å; F144-F168 HydrophobicContact CE2-CE1 3.76Å; L153-F168 HydrophobicContact CD2-CD1 4.39Å; L153-F168 HydrophobicContact CD2-CE1 3.93Å; I163-F168 HydrophobicContact CD1-CZ 4.4Å; I163-F168 HydrophobicContact CG2-CZ 4.48Å; G166-F168 PolarHBondContact O-N 2.83Å; F168-K170 PolarHBondContact O-N 2.95Å; F168-L171 HydrophobicContact CB-CD1 4.27Å; F168-L171 HydrophobicContact CD1-CD1 3.88Å; F168-L171 HydrophobicContact CG-CD1 4.48Å; F168-L171 PolarHBondContact O-N 3.04Å; F168-L177 HydrophobicContact CD2-CD2 4.12Å; F168-L177 HydrophobicContact CE2-CD2 3.65Å; F168-L177 HydrophobicContact CZ-CD1 4.23Å; F168-L177 HydrophobicContact CZ-CD2 4.08Å; F168-L179 HydrophobicContact CZ-CD1 4.44Å; F168-I191 HydrophobicContact CB-CD1 4.44Å; F168-I191 HydrophobicContact CD2-CD1 3.61Å; F168-I191 HydrophobicContact CD2-CG1 3.61Å; F168-I191 HydrophobicContact CE2-CD1 4.05Å; F168-I191 HydrophobicContact CE2-CG1 3.88Å; F168-I191 HydrophobicContact CG-CD1 4.16Å; F168-F192 HydrophobicContact CD2-CD1 4.38Å; F168-F192 HydrophobicContact CD2-CE1 4.11Å; F168-F192 HydrophobicContact CE2-CE1 4.22Å
169	N	87.8	Confident	90.1	Very high	58 Å²	58	44 Å²	44	31%	0.31	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-20.9	-175.7	-80.8	-5.4	0	0	0	114.1	G166 H172 F194	G166-N169 VanDerWaalsContact CA-ND2 3.28Å; G166-N169 WeakPolarHBondContact CA-ND2 3.49Å; G166-N169 WeakPolarHBondContact CA-OD1 3.44Å; G166-N169 VanDerWaalsContact O-CB 3.25Å; G166-N169 WeakPolarHBondContact O-CB 3.45Å; G166-N169 PolarHBondContact O-N 3.39Å; N169-H172 PolarHBondContact O-CE1 3.09Å; N169-F194 HydrophobicContact CB-CD2 4.1Å
170	K	85.9	Confident	89.8	Confident	106 Å²	106	40.8 Å²	40.8	46%	0.461	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-10.2	179	-70.2	-55.8	-151	142.1	0	114.3	E148 F168 H172	E148-K170 IonicContact OE1-NZ 3Å; E148-K170 PolarHBondContact OE1-NZ 3.23Å; F168-K170 PolarHBondContact O-N 2.95Å; K170-H172 VanDerWaalsContact C-N 3.26Å; K170-H172 PolarHBondContact O-N 2.75Å
171	L	90.2	Very high	89.3	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	19%	0.19	C	C	.	.			trans	-92	60.7	-171.5	-53.6	-176.8	0	0	0	110.4	F144 I147 L150 L153 F168 K173 L174	F144-L171 HydrophobicContact CB-CD1 4.16Å; F144-L171 HydrophobicContact CB-CD2 4Å; F144-L171 HydrophobicContact CB-CG 4.42Å; F144-L171 HydrophobicContact CD2-CD1 4.34Å; F144-L171 HydrophobicContact CG-CD1 4.23Å; I147-L171 HydrophobicContact CG1-CD2 4.15Å; I147-L171 WeakPolarHBondContact O-CD2 3.49Å; L150-L171 HydrophobicContact CB-CD2 4.22Å; L150-L171 HydrophobicContact CD2-CD1 4.26Å; L153-L171 HydrophobicContact CD2-CD1 4.36Å; F168-L171 HydrophobicContact CB-CD1 4.27Å; F168-L171 HydrophobicContact CD1-CD1 3.88Å; F168-L171 HydrophobicContact CG-CD1 4.48Å; F168-L171 PolarHBondContact O-N 3.04Å; L171-K173 PolarHBondContact O-N 2.95Å; L171-L174 HydrophobicContact CB-CB 3.94Å; L171-L174 HydrophobicContact CB-CD2 4.33Å; L171-L174 HydrophobicContact CD1-CD2 4.17Å; L171-L174 VanDerWaalsContact O-CB 3.31Å; L171-L174 WeakPolarHBondContact O-CB 3.19Å; L171-L174 PolarHBondContact O-N 3.17Å
172	H	89.3	Confident	89.3	Confident	98 Å²	98	36.4 Å²	36.4	45%	0.454	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-14.7	-170.5	-62.8	-50.8	0	0	0	115	N169 K170 F194	N169-H172 PolarHBondContact O-CE1 3.09Å; K170-H172 VanDerWaalsContact C-N 3.26Å; K170-H172 PolarHBondContact O-N 2.75Å; H172-F194 WeakPolarHBondContact CA-O 3.36Å
173	K	88.9	Confident	89.4	Confident	103 Å²	103	33.3 Å²	33.3	45%	0.448	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	4	178.4	-60	-171.6	-179.4	172.9	0	114	N149 L150 E151 L171 K175	N149-K173 WeakPolarHBondContact OD1-CE 3.27Å; N149-K173 PolarHBondContact OD1-NZ 3.03Å; L150-K173 CarbonylContact O-C 3.24Å; E151-K173 WeakPolarHBondContact CA-O 3.22Å; E151-K173 HydrophobicContact CG-CB 4.07Å; L171-K173 PolarHBondContact O-N 2.95Å; K173-K175 PolarHBondContact O-N 3.03Å
174	L	91.5	Very high	89.4	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.157	C	C	.	.			trans	-65.5	123.2	-175.7	-171	67.9	0	0	0	111.1	L150 L153 L171 V176 L177 A195 S196 L197	L150-L174 HydrophobicContact CD2-CD1 4.32Å; L150-L174 WeakPolarHBondContact O-CA 3.38Å; L150-L174 PolarHBondContact O-N 2.82Å; L150-L174 VanDerWaalsContact O-N 3.09Å; L153-L174 HydrophobicContact CB-CD1 3.75Å; L171-L174 HydrophobicContact CB-CB 3.94Å; L171-L174 HydrophobicContact CB-CD2 4.33Å; L171-L174 HydrophobicContact CD1-CD2 4.17Å; L171-L174 VanDerWaalsContact O-CB 3.31Å; L171-L174 WeakPolarHBondContact O-CB 3.19Å; L171-L174 PolarHBondContact O-N 3.17Å; L174-V176 WeakPolarHBondContact CD1-O 3.31Å; L174-L177 HydrophobicContact CD2-CB 4.45Å; L174-A195 HydrophobicContact CB-CB 4.23Å; L174-S196 CarbonylContact O-C 3.22Å; L174-S196 PolarHBondContact O-N 2.82Å; L174-L197 HydrophobicContact CB-CD2 4.47Å; L174-L197 HydrophobicContact CD2-CD2 4.06Å; L174-L197 HydrophobicContact CG-CD2 3.85Å
175	K	86.3	Confident	89.3	Confident	30 Å²	30	36.1 Å²	36.1	13%	0.13	17%	0.171	C	C	.	.			trans	-114.2	-36.1	-179.3	-68.8	166.9	-179.8	170.2	0	112.5	E151 K173 T198 H199 V843 L844	E151-K175 PolarHBondContact O-N 3.02Å; E151-K175 VanDerWaalsContact OE2-CE 3.28Å; E151-K175 WeakPolarHBondContact OE2-CE 3.25Å; E151-K175 IonicContact OE2-NZ 2.6Å; E151-K175 PolarHBondContact OE2-NZ 3.19Å; K173-K175 PolarHBondContact O-N 3.03Å; K175-T198 PolarHBondContact O-N 3.08Å; K175-T198 PolarHBondContact O-OG1 2.97Å; K175-H199 PolarHBondContact O-N 3.04Å; K175-H199 VanDerWaalsContact O-N 3.1Å; K175-V843 HydrophobicContact CB-CG1 4.42Å; K175-L844 VanDerWaalsContact NZ-CD1 3.3Å
176	V	86.9	Confident	89.4	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	123.7	-175.8	-173.3	0	0	0	0	108.9	E151 Y152 L153 L174 I178 H199 P838 V843	E151-V176 PolarHBondContact O-N 3.34Å; E151-V176 VanDerWaalsContact O-N 3.14Å; Y152-V176 HydrophobicContact CD2-CB 3.62Å; Y152-V176 HydrophobicContact CD2-CG1 3.59Å; Y152-V176 HydrophobicContact CD2-CG2 4.02Å; Y152-V176 HydrophobicContact CE2-CB 4.29Å; Y152-V176 HydrophobicContact CE2-CG1 3.73Å; Y152-V176 HydrophobicContact CG-CB 4.26Å; Y152-V176 HydrophobicContact CG-CG1 4.48Å; L153-V176 PolarHBondContact N-O 3Å; L174-V176 WeakPolarHBondContact CD1-O 3.31Å; V176-I178 HydrophobicContact CG1-CD1 4.13Å; V176-I178 HydrophobicContact CG1-CG1 4.06Å; V176-H199 HydrophobicContact CB-CB 4.45Å; V176-H199 HydrophobicContact CG1-CB 4.07Å; V176-H199 HydrophobicContact CG2-CB 4.25Å; V176-P838 HydrophobicContact CG1-CG 4.2Å; V176-V843 HydrophobicContact CG2-CB 4.09Å; V176-V843 HydrophobicContact CG2-CG1 3.82Å; V176-V843 HydrophobicContact CG2-CG2 3.68Å
177	L	93.3	Very high	89.6	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	114.6	176.8	179.1	58.5	0	0	0	109.9	L153 F168 L174 L179 F192 L197 H199 L200 D201	L153-L177 HydrophobicContact CB-CD1 4.09Å; L153-L177 HydrophobicContact CD2-CD1 3.9Å; L153-L177 HydrophobicContact CG-CD1 4.03Å; L153-L177 WeakPolarHBondContact O-CA 3.36Å; F168-L177 HydrophobicContact CD2-CD2 4.12Å; F168-L177 HydrophobicContact CE2-CD2 3.65Å; F168-L177 HydrophobicContact CZ-CD1 4.23Å; F168-L177 HydrophobicContact CZ-CD2 4.08Å; L174-L177 HydrophobicContact CD2-CB 4.45Å; L177-L179 HydrophobicContact CD1-CD1 4.01Å; L177-L179 HydrophobicContact CD1-CD2 4.18Å; L177-L179 HydrophobicContact CD1-CG 3.85Å; L177-L179 HydrophobicContact CD2-CD1 3.89Å; L177-L179 HydrophobicContact CG-CD1 3.86Å; L177-L179 HydrophobicContact CG-CG 3.97Å; L177-F192 HydrophobicContact CD2-CE1 3.66Å; L177-F192 HydrophobicContact CD2-CZ 4.33Å; L177-L197 HydrophobicContact CB-CD1 4.23Å; L177-L197 HydrophobicContact CB-CD2 3.88Å; L177-L197 HydrophobicContact CD2-CD1 4.12Å; L177-H199 PolarHBondContact N-O 3.31Å; L177-L200 HydrophobicContact CB-CD1 4.01Å; L177-L200 HydrophobicContact CD2-CD1 3.95Å; L177-L200 HydrophobicContact CG-CD1 3.97Å; L177-L200 WeakPolarHBondContact O-CA 3.47Å; L177-D201 PolarHBondContact O-N 3.39Å; L177-D201 VanDerWaalsContact O-N 3.08Å
178	I	87.3	Confident	89.6	Confident	2 Å²	2	33 Å²	33	1%	0.01	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	115	-178.5	-57.4	166.7	0	0	0	107.9	Y152 L153 Q154 A155 D156 V176 N180 D201 T837 P838	Y152-I178 HydrophobicContact CE2-CD1 4.04Å; Y152-I178 WeakPolarHBondContact OH-CD1 3.45Å; L153-I178 PolarHBondContact O-N 3.28Å; Q154-I178 HydrophobicContact CB-CB 4.39Å; Q154-I178 HydrophobicContact CB-CD1 4.36Å; Q154-I178 HydrophobicContact CG-CB 4.29Å; Q154-I178 HydrophobicContact CG-CD1 4.34Å; Q154-I178 HydrophobicContact CG-CG2 4.38Å; A155-I178 PolarHBondContact N-O 3.47Å; D156-I178 HydrophobicContact CB-CG2 4.19Å; V176-I178 HydrophobicContact CG1-CD1 4.13Å; V176-I178 HydrophobicContact CG1-CG1 4.06Å; I178-N180 WeakPolarHBondContact CG2-OD1 3.33Å; I178-D201 HydrophobicContact CG2-CB 4.43Å; I178-T837 HydrophobicContact CD1-CG2 3.91Å; I178-P838 HydrophobicContact CD1-CG 4.11Å
179	L	92.6	Very high	89.4	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.189	C	C	.	.			trans	-131.9	17.6	-175	-68.7	174	0	0	0	112.3	L139 A155 I163 F168 L177 N182 I184 D201 I202 N205	L139-L179 HydrophobicContact CD1-CD2 4.34Å; A155-L179 HydrophobicContact CB-CD2 4.17Å; I163-L179 HydrophobicContact CD1-CD1 4.19Å; F168-L179 HydrophobicContact CZ-CD1 4.44Å; L177-L179 HydrophobicContact CD1-CD1 4.01Å; L177-L179 HydrophobicContact CD1-CD2 4.18Å; L177-L179 HydrophobicContact CD1-CG 3.85Å; L177-L179 HydrophobicContact CD2-CD1 3.89Å; L177-L179 HydrophobicContact CG-CD1 3.86Å; L177-L179 HydrophobicContact CG-CG 3.97Å; L179-N182 PolarHBondContact O-ND2 2.99Å; L179-I184 HydrophobicContact CB-CD1 4.19Å; L179-I184 HydrophobicContact CD1-CD1 4.27Å; L179-D201 PolarHBondContact N-O 3.16Å; L179-I202 HydrophobicContact CB-CG2 4.41Å; L179-N205 PolarHBondContact O-ND2 3.04Å
180	N	85.9	Confident	89.4	Confident	8 Å²	8	38.2 Å²	38.2	4%	0.043	19%	0.19	C	C	.	.			trans	-63.8	158.9	-177.2	66.5	-75.7	0	0	0	113	D156 Y157 I178 N182 D201 R203	D156-N180 VanDerWaalsContact CA-O 3.3Å; D156-N180 WeakPolarHBondContact CA-O 3.43Å; D156-N180 VanDerWaalsContact CB-OD1 3.23Å; D156-N180 WeakPolarHBondContact CB-OD1 3.12Å; Y157-N180 PolarHBondContact N-O 3.44Å; I178-N180 WeakPolarHBondContact CG2-OD1 3.33Å; N180-N182 VanDerWaalsContact C-N 3.32Å; N180-N182 PolarHBondContact O-N 2.91Å; N180-N182 PolarHBondContact O-ND2 3.28Å; N180-D201 WeakPolarHBondContact CB-OD2 3.17Å; N180-D201 PolarHBondContact OD1-OD2 2.61Å; N180-R203 CarbonylContact C-O 3.55Å; N180-R203 WeakPolarHBondContact CA-O 3.09Å; N180-R203 HydrophobicContact CB-CB 4.07Å
181	D	84.3	Confident	89.5	Confident	27 Å²	27	33.2 Å²	33.2	14%	0.144	17%	0.168	C	C	.	.	S	Bend	trans	52.7	51.3	174.6	-61.9	-97.5	0	0	0	112.4	Y157 R203 A832	Y157-D181 HydrophobicContact CD1-CB 4.09Å; Y157-D181 HydrophobicContact CE1-CB 4.14Å; D181-R203 PolarHBondContact N-O 3.22Å; D181-A832 HydrophobicContact CB-CB 4.18Å; D181-A832 WeakPolarHBondContact OD2-CB 3.4Å
182	N	91.3	Very high	89.5	Confident	3 Å²	3	33.3 Å²	33.3	2%	0.016	17%	0.168	C	C	.	.	S	Bend	trans	-121.5	-170.2	174.2	-89.2	-86.9	0	0	0	109.7	A155 N158 I160 L179 N180 I184 N205	A155-N182 PolarHBondContact O-ND2 3.32Å; N158-N182 WeakPolarHBondContact CA-OD1 3.41Å; N158-N182 WeakPolarHBondContact CB-OD1 3.16Å; N158-N182 PolarHBondContact O-OD1 3.04Å; I160-N182 HydrophobicContact CB-CB 4.38Å; I160-N182 WeakPolarHBondContact CB-OD1 3.3Å; I160-N182 WeakPolarHBondContact CD1-OD1 2.94Å; I160-N182 VanDerWaalsContact CG1-OD1 3.25Å; I160-N182 WeakPolarHBondContact CG1-OD1 3.17Å; I160-N182 PolarHBondContact N-OD1 2.92Å; I160-N182 VanDerWaalsContact N-OD1 3.07Å; L179-N182 PolarHBondContact O-ND2 2.99Å; N180-N182 VanDerWaalsContact C-N 3.32Å; N180-N182 PolarHBondContact O-N 2.91Å; N180-N182 PolarHBondContact O-ND2 3.28Å; N182-I184 HydrophobicContact CB-CD1 4.33Å; N182-I184 HydrophobicContact CB-CG1 4.24Å; N182-N205 WeakPolarHBondContact CB-OD1 3.25Å; N182-N205 PolarHBondContact O-OD1 3.43Å
183	L	91.5	Very high	89.3	Confident	57 Å²	57	35.8 Å²	35.8	30%	0.298	17%	0.174	S	C	.	.			trans	-116.7	24.2	-176	-60.5	176.4	0	0	0	112.6	L159 I160 K161 Q185	L159-L183 HydrophobicContact CD2-CD1 4.35Å; I160-L183 CarbonylContact O-C 3.56Å; I160-L183 VanDerWaalsContact O-CA 3.3Å; I160-L183 WeakPolarHBondContact O-CA 3.23Å; I160-L183 PolarHBondContact O-N 2.92Å; K161-L183 HydrophobicContact CG-CB 3.73Å; K161-L183 HydrophobicContact CG-CD1 4.1Å; L183-Q185 PolarHBondContact O-N 2.9Å
184	I	94.6	Very high	89.1	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.171	C	C	.	.			trans	-67.4	122.3	-173.6	-58.1	165.8	0	0	0	109.1	I160 I163 L179 N182 A186 L187 N205 R206 I207	I160-I184 HydrophobicContact CB-CG1 4.44Å; I160-I184 HydrophobicContact CG2-CG1 4.11Å; I160-I184 WeakPolarHBondContact O-CG1 3.06Å; I160-I184 PolarHBondContact O-N 3.06Å; I163-I184 HydrophobicContact CD1-CD1 3.93Å; I163-I184 HydrophobicContact CD1-CG1 4.49Å; L179-I184 HydrophobicContact CB-CD1 4.19Å; L179-I184 HydrophobicContact CD1-CD1 4.27Å; N182-I184 HydrophobicContact CB-CD1 4.33Å; N182-I184 HydrophobicContact CB-CG1 4.24Å; I184-A186 WeakPolarHBondContact CG2-O 3.47Å; I184-L187 HydrophobicContact CG2-CD2 4.09Å; I184-N205 HydrophobicContact CB-CB 4.48Å; I184-N205 VanDerWaalsContact CB-OD1 3.24Å; I184-N205 WeakPolarHBondContact CB-OD1 3.43Å; I184-N205 VanDerWaalsContact CG1-OD1 3.29Å; I184-N205 WeakPolarHBondContact CG1-OD1 3.49Å; I184-N205 PolarHBondContact N-OD1 3.27Å; I184-R206 CarbonylContact O-C 3.19Å; I184-R206 VanDerWaalsContact O-CA 3.25Å; I184-R206 WeakPolarHBondContact O-CA 3.31Å; I184-R206 PolarHBondContact O-N 2.68Å; I184-I207 HydrophobicContact CG2-CD1 4.36Å; I184-I207 HydrophobicContact CG2-CG1 4.24Å; I184-I207 WeakPolarHBondContact O-CG1 3.48Å; I184-I207 PolarHBondContact O-N 3.44Å
185	Q	90.3	Very high	88.9	Confident	123 Å²	123	35.5 Å²	35.5	58%	0.575	17%	0.174	S	C	*	.			trans	-90.9	-30.7	-178.4	-61.9	177.3	26	0	0	113.3	L183 R206 I207	L183-Q185 PolarHBondContact O-N 2.9Å; Q185-R206 WeakPolarHBondContact CA-O 3.39Å; Q185-R206 HydrophobicContact CG-CB 4.28Å; Q185-I207 WeakPolarHBondContact O-CA 3.4Å
186	A	89.9	Confident	88.8	Confident	51 Å²	51	36.8 Å²	36.8	42%	0.421	19%	0.186	S	C	.	.			trans	-158.5	151.7	177.2	0	0	0	0	0	109.8	I184	I184-A186 WeakPolarHBondContact CG2-O 3.47Å
187	L	91.4	Very high	88.9	Confident	13 Å²	13	37 Å²	37	7%	0.068	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-89.5	136.8	170.9	-64.8	179.5	0	0	0	110.3	I163 I184 I191 F192 I207 L210 V215	I163-L187 HydrophobicContact CD1-CD2 4.31Å; I184-L187 HydrophobicContact CG2-CD2 4.09Å; L187-I191 HydrophobicContact CB-CG2 4.44Å; L187-F192 HydrophobicContact CD1-CE2 3.95Å; L187-F192 HydrophobicContact CD1-CZ 3.99Å; L187-I207 HydrophobicContact CG-CD1 4.38Å; L187-L210 HydrophobicContact CD1-CD2 3.8Å; L187-L210 HydrophobicContact CG-CD2 4.31Å; L187-V215 HydrophobicContact CD1-CG1 4.24Å
188	P	90.4	Very high	88.5	Confident	14 Å²	14	37.8 Å²	37.8	9%	0.091	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-68.6	150.4	177.9	23	-28.7	0	0	0	112.7	I163 K165 I191	I163-P188 HydrophobicContact CB-CG 4.29Å; I163-P188 HydrophobicContact CG2-CG 4.2Å; I163-P188 WeakPolarHBondContact O-CG 3.23Å; K165-P188 HydrophobicContact CG-CB 3.9Å; P188-I191 HydrophobicContact CG-CB 3.97Å; P188-I191 HydrophobicContact CG-CD1 4.01Å; P188-I191 HydrophobicContact CG-CG1 3.93Å; P188-I191 VanDerWaalsContact O-CB 3.25Å; P188-I191 WeakPolarHBondContact O-CB 3.49Å; P188-I191 WeakPolarHBondContact O-CG2 3.24Å; P188-I191 PolarHBondContact O-N 2.76Å
189	E	87.3	Confident	88.2	Confident	109 Å²	109	38 Å²	38	51%	0.509	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	140.2	175.3	-57.2	163.5	137	0	0	112	K165 I191	K165-E189 IonicContact NZ-OE2 3.96Å; K165-E189 PolarHBondContact NZ-OE2 2.87Å; E189-I191 PolarHBondContact O-N 3.14Å
190	N	87.6	Confident	88.1	Confident	59 Å²	59	38.1 Å²	38.1	32%	0.316	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	15.8	178.3	-67	-79.9	0	0	0	115.3	F192 R193 G214 H218	N190-F192 PolarHBondContact O-N 3.18Å; N190-R193 HydrophobicContact CB-CB 4.04Å; N190-R193 WeakPolarHBondContact O-CB 3.36Å; N190-R193 PolarHBondContact O-N 3.09Å; N190-G214 WeakPolarHBondContact CA-O 3.17Å; N190-G214 PolarHBondContact N-O 3.39Å; N190-H218 PolarHBondContact OD1-NE2 3.22Å
191	I	89.8	Confident	88.1	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-28.4	-178	-168.6	51.8	0	0	0	114.5	I163 A167 F168 L187 P188 E189	I163-I191 HydrophobicContact CG2-CD1 4.05Å; A167-I191 HydrophobicContact CB-CD1 4.35Å; F168-I191 HydrophobicContact CB-CD1 4.44Å; F168-I191 HydrophobicContact CD2-CD1 3.61Å; F168-I191 HydrophobicContact CD2-CG1 3.61Å; F168-I191 HydrophobicContact CE2-CD1 4.05Å; F168-I191 HydrophobicContact CE2-CG1 3.88Å; F168-I191 HydrophobicContact CG-CD1 4.16Å; L187-I191 HydrophobicContact CB-CG2 4.44Å; P188-I191 HydrophobicContact CG-CB 3.97Å; P188-I191 HydrophobicContact CG-CD1 4.01Å; P188-I191 HydrophobicContact CG-CG1 3.93Å; P188-I191 VanDerWaalsContact O-CB 3.25Å; P188-I191 WeakPolarHBondContact O-CB 3.49Å; P188-I191 WeakPolarHBondContact O-CG2 3.24Å; P188-I191 PolarHBondContact O-N 2.76Å; E189-I191 PolarHBondContact O-N 3.14Å
192	F	89.1	Confident	88.4	Confident	3 Å²	3	36.9 Å²	36.9	1%	0.013	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	4.9	177.2	-53.1	-45.3	0	0	0	113.8	F168 L177 L187 N190 F194 A195 L197 L200 V215 H218 I219	F168-F192 HydrophobicContact CD2-CD1 4.38Å; F168-F192 HydrophobicContact CD2-CE1 4.11Å; F168-F192 HydrophobicContact CE2-CE1 4.22Å; L177-F192 HydrophobicContact CD2-CE1 3.66Å; L177-F192 HydrophobicContact CD2-CZ 4.33Å; L187-F192 HydrophobicContact CD1-CE2 3.95Å; L187-F192 HydrophobicContact CD1-CZ 3.99Å; N190-F192 PolarHBondContact O-N 3.18Å; F192-F194 PolarHBondContact O-N 2.84Å; F192-A195 PolarHBondContact O-N 2.88Å; F192-A195 VanDerWaalsContact O-O 3.13Å; F192-L197 HydrophobicContact CD1-CD1 3.6Å; F192-L197 HydrophobicContact CE1-CD1 3.67Å; F192-L197 HydrophobicContact CG-CD1 4.07Å; F192-L197 HydrophobicContact CZ-CD1 4.17Å; F192-L200 HydrophobicContact CE2-CD2 3.91Å; F192-L200 HydrophobicContact CZ-CD1 4.34Å; F192-L200 HydrophobicContact CZ-CD2 3.92Å; F192-V215 HydrophobicContact CD2-CG1 4.18Å; F192-V215 HydrophobicContact CE2-CG1 4.05Å; F192-H218 HydrophobicContact CB-CB 4.06Å; F192-I219 HydrophobicContact CD2-CD1 3.84Å; F192-I219 HydrophobicContact CD2-CG1 3.95Å; F192-I219 HydrophobicContact CE2-CD1 3.91Å
193	R	85.6	Confident	88.2	Confident	150 Å²	150	38 Å²	38	57%	0.566	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-26.4	-175.3	177.6	176	174.5	174.3	1.4	114.3	N190	N190-R193 HydrophobicContact CB-CB 4.04Å; N190-R193 WeakPolarHBondContact O-CB 3.36Å; N190-R193 PolarHBondContact O-N 3.09Å
194	F	85.2	Confident	87.8	Confident	91 Å²	91	36.1 Å²	36.1	40%	0.399	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.7	6.3	-177.7	-58.9	-72.6	0	0	0	114	N169 H172 F192	N169-F194 HydrophobicContact CB-CD2 4.1Å; H172-F194 WeakPolarHBondContact CA-O 3.36Å; F192-F194 PolarHBondContact O-N 2.84Å
195	A	86.2	Confident	87.7	Confident	6 Å²	6	36.2 Å²	36.2	5%	0.05	19%	0.186	C	C	.	.			trans	-121.7	121.4	-176.7	0	0	0	0	0	110.4	L174 F192 L197	L174-A195 HydrophobicContact CB-CB 4.23Å; F192-A195 PolarHBondContact O-N 2.88Å; F192-A195 VanDerWaalsContact O-O 3.13Å; A195-L197 PolarHBondContact O-N 2.86Å; A195-L197 VanDerWaalsContact O-N 3.16Å
196	S	85.1	Confident	87.8	Confident	56 Å²	56	36.2 Å²	36.2	39%	0.392	18%	0.181	S	C	.	.			trans	-93	70.6	-175.3	-149	0	0	0	0	110.8	L174	L174-S196 CarbonylContact O-C 3.22Å; L174-S196 PolarHBondContact O-N 2.82Å
197	L	87.8	Confident	87.9	Confident	5 Å²	5	33.8 Å²	33.8	3%	0.026	16%	0.161	C	C	.	.			trans	-64.4	138.3	-176.6	-63.7	-179	0	0	0	112.6	L174 L177 F192 A195 L200	L174-L197 HydrophobicContact CB-CD2 4.47Å; L174-L197 HydrophobicContact CD2-CD2 4.06Å; L174-L197 HydrophobicContact CG-CD2 3.85Å; L177-L197 HydrophobicContact CB-CD1 4.23Å; L177-L197 HydrophobicContact CB-CD2 3.88Å; L177-L197 HydrophobicContact CD2-CD1 4.12Å; F192-L197 HydrophobicContact CD1-CD1 3.6Å; F192-L197 HydrophobicContact CE1-CD1 3.67Å; F192-L197 HydrophobicContact CG-CD1 4.07Å; F192-L197 HydrophobicContact CZ-CD1 4.17Å; A195-L197 PolarHBondContact O-N 2.86Å; A195-L197 VanDerWaalsContact O-N 3.16Å; L197-L200 HydrophobicContact CD1-CB 4.49Å; L197-L200 HydrophobicContact CD1-CD1 4.26Å; L197-L200 HydrophobicContact CD1-CD2 4.38Å
198	T	84.6	Confident	87.8	Confident	17 Å²	17	37.8 Å²	37.8	10%	0.104	18%	0.179	C	C	.	.	S	Bend	trans	-114.8	-27.4	174.2	60.4	0	0	0	0	111.6	K175 I222 V223 E224 V843	K175-T198 PolarHBondContact O-N 3.08Å; K175-T198 PolarHBondContact O-OG1 2.97Å; T198-I222 WeakPolarHBondContact O-CG1 3.33Å; T198-V223 PolarHBondContact O-N 2.93Å; T198-E224 PolarHBondContact O-N 2.99Å; T198-V843 WeakPolarHBondContact OG1-CG1 3.43Å
199	H	82.3	Confident	87.8	Confident	5 Å²	5	39.7 Å²	39.7	2%	0.023	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	124.3	178.8	-72.9	65.5	0	0	0	108.6	K175 V176 L177 E224 V843 E846	K175-H199 PolarHBondContact O-N 3.04Å; K175-H199 VanDerWaalsContact O-N 3.1Å; V176-H199 HydrophobicContact CB-CB 4.45Å; V176-H199 HydrophobicContact CG1-CB 4.07Å; V176-H199 HydrophobicContact CG2-CB 4.25Å; L177-H199 PolarHBondContact N-O 3.31Å; H199-E224 WeakPolarHBondContact CA-O 3.44Å; H199-E224 IonicContact CD2-OE2 2.67Å; H199-V843 VanDerWaalsContact CE1-CG2 3.45Å; H199-V843 WeakPolarHBondContact CE1-CG2 3.29Å; H199-V843 WeakPolarHBondContact ND1-CG2 3.39Å; H199-E846 IonicContact CE1-OE2 2.65Å; H199-E846 PolarHBondContact CE1-OE2 2.97Å; H199-E846 VanDerWaalsContact CE1-OE2 3.23Å; H199-E846 IonicContact NE2-OE2 2.69Å
200	L	90.4	Very high	87.9	Confident	3 Å²	3	34.7 Å²	34.7	2%	0.016	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	115.7	176.2	178.4	60	0	0	0	110.1	L177 F192 L197 I202 I219 I222 E224 L225 Q226	L177-L200 HydrophobicContact CB-CD1 4.01Å; L177-L200 HydrophobicContact CD2-CD1 3.95Å; L177-L200 HydrophobicContact CG-CD1 3.97Å; L177-L200 WeakPolarHBondContact O-CA 3.47Å; F192-L200 HydrophobicContact CE2-CD2 3.91Å; F192-L200 HydrophobicContact CZ-CD1 4.34Å; F192-L200 HydrophobicContact CZ-CD2 3.92Å; L197-L200 HydrophobicContact CD1-CB 4.49Å; L197-L200 HydrophobicContact CD1-CD1 4.26Å; L197-L200 HydrophobicContact CD1-CD2 4.38Å; L200-I202 HydrophobicContact CD1-CG2 3.79Å; L200-I202 HydrophobicContact CG-CG2 4.05Å; L200-I219 HydrophobicContact CD2-CD1 4.21Å; L200-I222 HydrophobicContact CB-CD1 3.79Å; L200-E224 PolarHBondContact N-O 2.95Å; L200-L225 HydrophobicContact CB-CD1 3.9Å; L200-L225 HydrophobicContact CD2-CD1 3.86Å; L200-L225 HydrophobicContact CG-CD1 3.96Å; L200-L225 WeakPolarHBondContact O-CA 3.42Å; L200-Q226 PolarHBondContact O-N 3.14Å
201	D	84.6	Confident	87.8	Confident	8 Å²	8	34.3 Å²	34.3	4%	0.043	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	119	170.9	-175.4	6.1	0	0	0	110	L177 I178 L179 N180 R203 Q226	L177-D201 PolarHBondContact O-N 3.39Å; L177-D201 VanDerWaalsContact O-N 3.08Å; I178-D201 HydrophobicContact CG2-CB 4.43Å; L179-D201 PolarHBondContact N-O 3.16Å; N180-D201 WeakPolarHBondContact CB-OD2 3.17Å; N180-D201 PolarHBondContact OD1-OD2 2.61Å; D201-R203 WeakPolarHBondContact OD1-CB 3.46Å; D201-R203 WeakPolarHBondContact OD1-CG 3.47Å; D201-R203 IonicContact OD1-CZ 3.18Å; D201-R203 PolarHBondContact OD1-N 3.11Å; D201-R203 IonicContact OD1-NE 2.89Å; D201-R203 PolarHBondContact OD1-NE 3.29Å; D201-R203 IonicContact OD1-NH2 2.69Å; D201-R203 IonicContact OD2-CZ 2.61Å; D201-R203 VanDerWaalsContact OD2-CZ 3.31Å; D201-R203 IonicContact OD2-NE 3.62Å; D201-R203 PolarHBondContact OD2-NE 2.87Å; D201-R203 IonicContact OD2-NH2 2.94Å; D201-R203 PolarHBondContact OD2-NH2 3.36Å; D201-Q226 HydrophobicContact CB-CB 4.36Å; D201-Q226 PolarHBondContact OD2-OE1 3.24Å
202	I	91.9	Very high	87.5	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.005	19%	0.187	C	C	.	.			trans	-126.5	21.7	176.9	56.6	173.8	0	0	0	112	L179 L200 N205 I207 L210 Q226 L227 N230	L179-I202 HydrophobicContact CB-CG2 4.41Å; L200-I202 HydrophobicContact CD1-CG2 3.79Å; L200-I202 HydrophobicContact CG-CG2 4.05Å; I202-N205 PolarHBondContact O-ND2 3.38Å; I202-I207 HydrophobicContact CB-CD1 4.18Å; I202-I207 HydrophobicContact CD1-CD1 3.88Å; I202-I207 HydrophobicContact CG1-CD1 4.47Å; I202-L210 HydrophobicContact CD1-CD1 4.2Å; I202-Q226 VanDerWaalsContact CG1-O 3.3Å; I202-Q226 WeakPolarHBondContact CG1-O 3.32Å; I202-Q226 PolarHBondContact N-O 3.34Å; I202-L227 HydrophobicContact CD1-CD2 3.78Å; I202-L227 HydrophobicContact CG1-CD2 4.07Å; I202-N230 PolarHBondContact O-ND2 3.41Å
203	R	85.8	Confident	87.2	Confident	27 Å²	27	45.7 Å²	45.7	10%	0.102	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	160.6	179.7	-70.8	176.5	-65.6	-169.9	3.8	113.7	N180 D181 D201 N205 Q226 D228	N180-R203 CarbonylContact C-O 3.55Å; N180-R203 WeakPolarHBondContact CA-O 3.09Å; N180-R203 HydrophobicContact CB-CB 4.07Å; D181-R203 PolarHBondContact N-O 3.22Å; D201-R203 WeakPolarHBondContact OD1-CB 3.46Å; D201-R203 WeakPolarHBondContact OD1-CG 3.47Å; D201-R203 IonicContact OD1-CZ 3.18Å; D201-R203 PolarHBondContact OD1-N 3.11Å; D201-R203 IonicContact OD1-NE 2.89Å; D201-R203 PolarHBondContact OD1-NE 3.29Å; D201-R203 IonicContact OD1-NH2 2.69Å; D201-R203 IonicContact OD2-CZ 2.61Å; D201-R203 VanDerWaalsContact OD2-CZ 3.31Å; D201-R203 IonicContact OD2-NE 3.62Å; D201-R203 PolarHBondContact OD2-NE 2.87Å; D201-R203 IonicContact OD2-NH2 2.94Å; D201-R203 PolarHBondContact OD2-NH2 3.36Å; R203-N205 PolarHBondContact O-N 2.92Å; R203-N205 PolarHBondContact O-ND2 3.33Å; R203-Q226 HydrophobicContact CG-CB 3.83Å; R203-D228 VanDerWaalsContact CA-O 3.26Å; R203-D228 WeakPolarHBondContact CA-O 3.4Å; R203-D228 WeakPolarHBondContact CD-OD2 3.47Å; R203-D228 HydrophobicContact CG-CB 3.87Å
204	G	83.3	Confident	86.9	Confident	18 Å²	18	38.6 Å²	38.6	19%	0.186	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.5	15	171	0	0	0	0	0	115.1	D228 D229	G204-D228 PolarHBondContact N-O 3.29Å; G204-D229 VanDerWaalsContact CA-O 3.3Å; G204-D229 WeakPolarHBondContact CA-O 3.34Å; G204-D229 PolarHBondContact N-O 2.61Å
205	N	92.6	Very high	87	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	17%	0.174	C	C	.	.	S	Bend	trans	-94.4	-167.8	-178.2	-87.7	-86.2	0	0	0	111.4	L179 N182 I184 I202 R203 I207 N230 P231	L179-N205 PolarHBondContact O-ND2 3.04Å; N182-N205 WeakPolarHBondContact CB-OD1 3.25Å; N182-N205 PolarHBondContact O-OD1 3.43Å; I184-N205 HydrophobicContact CB-CB 4.48Å; I184-N205 VanDerWaalsContact CB-OD1 3.24Å; I184-N205 WeakPolarHBondContact CB-OD1 3.43Å; I184-N205 VanDerWaalsContact CG1-OD1 3.29Å; I184-N205 WeakPolarHBondContact CG1-OD1 3.49Å; I184-N205 PolarHBondContact N-OD1 3.27Å; I202-N205 PolarHBondContact O-ND2 3.38Å; R203-N205 PolarHBondContact O-N 2.92Å; R203-N205 PolarHBondContact O-ND2 3.33Å; N205-I207 HydrophobicContact CB-CD1 4.32Å; N205-I207 HydrophobicContact CB-CG1 4.2Å; N205-N230 WeakPolarHBondContact CA-OD1 3.28Å; N205-N230 WeakPolarHBondContact CB-OD1 3.2Å; N205-N230 PolarHBondContact O-OD1 3.16Å; N205-P231 WeakPolarHBondContact O-CD 3.45Å
206	R	91.9	Very high	86.9	Confident	124 Å²	124	34.1 Å²	34.1	47%	0.468	17%	0.172	S	C	.	.			trans	-115.5	26.1	-180	-59.8	-61.6	174	179.8	-5.7	112.5	I184 Q185 Q208	I184-R206 CarbonylContact O-C 3.19Å; I184-R206 VanDerWaalsContact O-CA 3.25Å; I184-R206 WeakPolarHBondContact O-CA 3.31Å; I184-R206 PolarHBondContact O-N 2.68Å; Q185-R206 WeakPolarHBondContact CA-O 3.39Å; Q185-R206 HydrophobicContact CG-CB 4.28Å; R206-Q208 PolarHBondContact O-N 2.66Å
207	I	92.7	Very high	86.8	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.173	C	C	.	.			trans	-73.5	120.7	-176.4	-59.3	171.9	0	0	0	109.6	I184 Q185 L187 I202 N205 N209 L210 N230 P231 W232	I184-I207 HydrophobicContact CG2-CD1 4.36Å; I184-I207 HydrophobicContact CG2-CG1 4.24Å; I184-I207 WeakPolarHBondContact O-CG1 3.48Å; I184-I207 PolarHBondContact O-N 3.44Å; Q185-I207 WeakPolarHBondContact O-CA 3.4Å; L187-I207 HydrophobicContact CG-CD1 4.38Å; I202-I207 HydrophobicContact CB-CD1 4.18Å; I202-I207 HydrophobicContact CD1-CD1 3.88Å; I202-I207 HydrophobicContact CG1-CD1 4.47Å; N205-I207 HydrophobicContact CB-CD1 4.32Å; N205-I207 HydrophobicContact CB-CG1 4.2Å; I207-N209 VanDerWaalsContact CG2-O 3.22Å; I207-N209 WeakPolarHBondContact CG2-O 3.37Å; I207-L210 HydrophobicContact CG2-CD2 4.11Å; I207-L210 HydrophobicContact CG2-CG 4.28Å; I207-N230 WeakPolarHBondContact CB-OD1 3.13Å; I207-N230 PolarHBondContact N-OD1 3.23Å; I207-N230 VanDerWaalsContact N-OD1 3.09Å; I207-P231 WeakPolarHBondContact O-CD 3.39Å; I207-W232 HydrophobicContact CB-CH2 4.4Å; I207-W232 HydrophobicContact CG2-CH2 3.81Å; I207-W232 HydrophobicContact CG2-CZ3 3.78Å
208	Q	89.6	Confident	86.6	Confident	96 Å²	96	38 Å²	38	45%	0.449	18%	0.183	S	C	.	.			trans	-94	-32.1	178.6	-65.1	178.6	25.4	0	0	112.4	R206 P231 N233	R206-Q208 PolarHBondContact O-N 2.66Å; Q208-P231 HydrophobicContact CG-CG 4.27Å; Q208-N233 HydrophobicContact CB-CB 3.98Å; Q208-N233 PolarHBondContact O-N 3.3Å
209	N	89.4	Confident	86.4	Confident	55 Å²	55	37.4 Å²	37.4	29%	0.294	18%	0.18	S	C	.	.			trans	-146.6	160.8	177	63.4	26.4	0	0	0	113.2	I207 L238	I207-N209 VanDerWaalsContact CG2-O 3.22Å; I207-N209 WeakPolarHBondContact CG2-O 3.37Å; N209-L238 HydrophobicContact CB-CD1 3.91Å
210	L	89.4	Confident	85.7	Confident	4 Å²	4	40 Å²	40	2%	0.021	21%	0.207	C	C	.	.			trans	-127.9	107.4	169.3	-71.1	174.7	0	0	0	108.5	L187 I202 I207 V215 L216 L227 W232 L241	L187-L210 HydrophobicContact CD1-CD2 3.8Å; L187-L210 HydrophobicContact CG-CD2 4.31Å; I202-L210 HydrophobicContact CD1-CD1 4.2Å; I207-L210 HydrophobicContact CG2-CD2 4.11Å; I207-L210 HydrophobicContact CG2-CG 4.28Å; L210-V215 HydrophobicContact CD2-CG1 4.39Å; L210-L216 HydrophobicContact CB-CD1 4.45Å; L210-L216 HydrophobicContact CB-CD2 4.1Å; L210-L216 HydrophobicContact CB-CG 4.37Å; L210-L216 HydrophobicContact CD1-CD2 4.17Å; L210-L227 HydrophobicContact CD1-CD2 4.17Å; L210-W232 HydrophobicContact CD1-CH2 3.65Å; L210-W232 HydrophobicContact CD1-CZ3 4.16Å; L210-W232 HydrophobicContact CG-CH2 3.79Å; L210-W232 HydrophobicContact CG-CZ3 3.87Å; L210-L241 HydrophobicContact CB-CD1 4.34Å; L210-L241 HydrophobicContact CB-CD2 4.27Å; L210-L241 HydrophobicContact CD1-CD1 4.12Å; L210-L241 HydrophobicContact CD1-CD2 4.26Å
211	P	86.4	Confident	84.9	Confident	50 Å²	50	48.6 Å²	48.6	33%	0.325	24%	0.24	S	C	.	.			trans	-69.5	145	177.2	29.3	-34.2	0	0	0	110.4	V215 L216	P211-V215 HydrophobicContact CG-CG2 4.06Å; P211-V215 WeakPolarHBondContact O-CB 3.22Å; P211-L216 PolarHBondContact O-N 3.44Å
212	Y	83.6	Confident	84.7	Confident	110 Å²	110	48.5 Å²	48.5	43%	0.431	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-51	175.3	176.9	-87.5	0	0	0	111.5	G214 V215 L216 E217	Y212-G214 PolarHBondContact O-N 2.91Å; Y212-V215 PolarHBondContact O-N 3.08Å; Y212-L216 HydrophobicContact CD2-CB 4.06Å; Y212-L216 PolarHBondContact O-N 2.97Å; Y212-E217 HydrophobicContact CE1-CB 4.24Å; Y212-E217 WeakPolarHBondContact O-CB 3.32Å; Y212-E217 PolarHBondContact O-N 3.02Å
213	L	82.6	Confident	83.9	Confident	133 Å²	133	49.8 Å²	49.8	70%	0.696	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	122.6	-178.7	-168.3	74	0	0	0	110.6	V215	L213-V215 PolarHBondContact O-N 3.45Å; L213-V215 VanDerWaalsContact O-N 3.11Å
214	G	79.4	Confident	83.5	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.01	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.5	-7.1	177.4	0	0	0	0	0	116.7	N190 Y212 E217 H218	N190-G214 WeakPolarHBondContact CA-O 3.17Å; N190-G214 PolarHBondContact N-O 3.39Å; Y212-G214 PolarHBondContact O-N 2.91Å; G214-E217 PolarHBondContact N-OE2 2.96Å; G214-H218 PolarHBondContact O-CD2 2.95Å
215	V	86.3	Confident	83.7	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.5	-77.3	170.5	-174.1	0	0	0	0	110.1	L187 F192 L210 P211 Y212 L213 E217 H218 I219	L187-V215 HydrophobicContact CD1-CG1 4.24Å; F192-V215 HydrophobicContact CD2-CG1 4.18Å; F192-V215 HydrophobicContact CE2-CG1 4.05Å; L210-V215 HydrophobicContact CD2-CG1 4.39Å; P211-V215 HydrophobicContact CG-CG2 4.06Å; P211-V215 WeakPolarHBondContact O-CB 3.22Å; Y212-V215 PolarHBondContact O-N 3.08Å; L213-V215 PolarHBondContact O-N 3.45Å; L213-V215 VanDerWaalsContact O-N 3.11Å; V215-E217 PolarHBondContact O-N 3.39Å; V215-H218 PolarHBondContact O-N 3.14Å; V215-H218 VanDerWaalsContact O-N 3.09Å; V215-I219 HydrophobicContact CG1-CD1 4.33Å; V215-I219 WeakPolarHBondContact O-CG1 3.32Å
216	L	84.9	Confident	83.2	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.01	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-64.6	-26.7	-174.8	-52.7	174.4	0	0	0	113.6	L210 P211 Y212 H218 I219 L241 W244	L210-L216 HydrophobicContact CB-CD1 4.45Å; L210-L216 HydrophobicContact CB-CD2 4.1Å; L210-L216 HydrophobicContact CB-CG 4.37Å; L210-L216 HydrophobicContact CD1-CD2 4.17Å; P211-L216 PolarHBondContact O-N 3.44Å; Y212-L216 HydrophobicContact CD2-CB 4.06Å; Y212-L216 PolarHBondContact O-N 2.97Å; L216-H218 PolarHBondContact O-N 3Å; L216-I219 HydrophobicContact CD2-CD1 4.18Å; L216-I219 PolarHBondContact O-N 2.79Å; L216-I219 VanDerWaalsContact O-N 3.11Å; L216-L241 HydrophobicContact CD1-CB 4.04Å; L216-L241 HydrophobicContact CD1-CD1 3.74Å; L216-L241 HydrophobicContact CD2-CD1 3.96Å; L216-W244 HydrophobicContact CB-CG 4.15Å; L216-W244 HydrophobicContact CD1-CB 4.09Å; L216-W244 HydrophobicContact CD1-CG 4.12Å; L216-W244 PolarHBondContact O-NE1 3.36Å
217	E	83.4	Confident	83.1	Confident	91 Å²	91	44.2 Å²	44.2	43%	0.425	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-47.8	-36.9	170.5	-178.3	-177.8	-176.4	0	0	112.9	Y212 G214 V215	Y212-E217 HydrophobicContact CE1-CB 4.24Å; Y212-E217 WeakPolarHBondContact O-CB 3.32Å; Y212-E217 PolarHBondContact O-N 3.02Å; G214-E217 PolarHBondContact N-OE2 2.96Å; V215-E217 PolarHBondContact O-N 3.39Å
218	H	83.2	Confident	82.6	Confident	51 Å²	51	46.1 Å²	46.1	24%	0.236	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-93.2	-8.5	-175.8	-56.2	-49.9	0	0	0	113.4	N190 F192 G214 V215 L216 G220	N190-H218 PolarHBondContact OD1-NE2 3.22Å; F192-H218 HydrophobicContact CB-CB 4.06Å; G214-H218 PolarHBondContact O-CD2 2.95Å; V215-H218 PolarHBondContact O-N 3.14Å; V215-H218 VanDerWaalsContact O-N 3.09Å; L216-H218 PolarHBondContact O-N 3Å; H218-G220 VanDerWaalsContact C-N 3.26Å; H218-G220 PolarHBondContact O-N 3.38Å; H218-G220 VanDerWaalsContact O-N 3.16Å
219	I	80.4	Confident	82.3	Confident	5 Å²	5	45.4 Å²	45.4	3%	0.026	23%	0.232	C	C	.	.			trans	-92.5	47.2	-175.2	-46.3	-178.9	0	0	0	110.7	F192 L200 V215 L216 I222 W244	F192-I219 HydrophobicContact CD2-CD1 3.84Å; F192-I219 HydrophobicContact CD2-CG1 3.95Å; F192-I219 HydrophobicContact CE2-CD1 3.91Å; L200-I219 HydrophobicContact CD2-CD1 4.21Å; V215-I219 HydrophobicContact CG1-CD1 4.33Å; V215-I219 WeakPolarHBondContact O-CG1 3.32Å; L216-I219 HydrophobicContact CD2-CD1 4.18Å; L216-I219 PolarHBondContact O-N 2.79Å; L216-I219 VanDerWaalsContact O-N 3.11Å; I219-I222 HydrophobicContact CG2-CB 3.86Å; I219-I222 HydrophobicContact CG2-CD1 3.51Å; I219-I222 HydrophobicContact CG2-CG1 4.31Å; I219-I222 HydrophobicContact CG2-CG2 3.96Å; I219-W244 HydrophobicContact CB-CZ2 4.01Å; I219-W244 HydrophobicContact CG2-CH2 4.46Å; I219-W244 HydrophobicContact CG2-CZ2 3.94Å
220	G	67.7	Low	82.2	Confident	59 Å²	59	43.1 Å²	43.1	61%	0.608	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	0.8	-172.8	0	0	0	0	0	116.5	H218	H218-G220 VanDerWaalsContact C-N 3.26Å; H218-G220 PolarHBondContact O-N 3.38Å; H218-G220 VanDerWaalsContact O-N 3.16Å
221	R	73.5	Confident	82.2	Confident	185 Å²	185	43.7 Å²	43.7	70%	0.698	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-134.9	23.6	-172.8	-67.2	-176.3	174.7	169	-4.5	113.8
222	I	80.4	Confident	82.4	Confident	6 Å²	6	41.3 Å²	41.3	3%	0.031	21%	0.208	C	C	.	.			trans	-78.9	141.2	-175	-162.8	148.5	0	0	0	111.7	T198 L200 I219 E224 L225 W244 M248 I252	T198-I222 WeakPolarHBondContact O-CG1 3.33Å; L200-I222 HydrophobicContact CB-CD1 3.79Å; I219-I222 HydrophobicContact CG2-CB 3.86Å; I219-I222 HydrophobicContact CG2-CD1 3.51Å; I219-I222 HydrophobicContact CG2-CG1 4.31Å; I219-I222 HydrophobicContact CG2-CG2 3.96Å; I222-E224 WeakPolarHBondContact CD1-O 3.47Å; I222-E224 WeakPolarHBondContact CG1-O 3.46Å; I222-L225 HydrophobicContact CD1-CB 3.64Å; I222-L225 HydrophobicContact CD1-CD1 3.87Å; I222-L225 HydrophobicContact CD1-CG 4.2Å; I222-L225 HydrophobicContact CG1-CB 4.09Å; I222-W244 HydrophobicContact CG2-CH2 4.09Å; I222-W244 HydrophobicContact CG2-CZ2 4.32Å; I222-M248 HydrophobicContact CG2-CE 4.35Å; I222-I252 HydrophobicContact CG2-CG2 4.26Å; I222-I252 WeakPolarHBondContact O-CD1 3.22Å; I222-I252 WeakPolarHBondContact O-CG1 3Å
223	V	76.3	Confident	82.7	Confident	28 Å²	28	37.7 Å²	37.7	17%	0.17	20%	0.196	C	C	.	.	S	Bend	trans	-107.8	-37.3	174.9	-171.6	0	0	0	0	109.9	T198 I252 F253 E846 L850	T198-V223 PolarHBondContact O-N 2.93Å; V223-I252 WeakPolarHBondContact O-CA 3.38Å; V223-I252 WeakPolarHBondContact O-CG2 3.5Å; V223-F253 PolarHBondContact O-N 3.24Å; V223-E846 WeakPolarHBondContact CG1-OE2 3.49Å; V223-L850 HydrophobicContact CG2-CD1 3.73Å
224	E	76.5	Confident	82.9	Confident	36 Å²	36	31.4 Å²	31.4	17%	0.168	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	123.8	174.3	176.9	158.1	-119.8	0	0	111.8	T198 H199 L200 I222 Q226 F253	T198-E224 PolarHBondContact O-N 2.99Å; H199-E224 WeakPolarHBondContact CA-O 3.44Å; H199-E224 IonicContact CD2-OE2 2.67Å; L200-E224 PolarHBondContact N-O 2.95Å; I222-E224 WeakPolarHBondContact CD1-O 3.47Å; I222-E224 WeakPolarHBondContact CG1-O 3.46Å; E224-Q226 HydrophobicContact CG-CG 3.91Å; E224-Q226 PolarHBondContact OE1-NE2 3.42Å; E224-F253 WeakPolarHBondContact CA-O 2.92Å; E224-F253 HydrophobicContact CG-CD1 4.07Å; E224-F253 VanDerWaalsContact OE1-CD1 3.23Å; E224-F253 WeakPolarHBondContact OE1-CD1 3.49Å
225	L	86.8	Confident	83.2	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	110.3	173.3	178.7	60.1	0	0	0	110.7	L200 I222 L227 W244 F253 I254 G255	L200-L225 HydrophobicContact CB-CD1 3.9Å; L200-L225 HydrophobicContact CD2-CD1 3.86Å; L200-L225 HydrophobicContact CG-CD1 3.96Å; L200-L225 WeakPolarHBondContact O-CA 3.42Å; I222-L225 HydrophobicContact CD1-CB 3.64Å; I222-L225 HydrophobicContact CD1-CD1 3.87Å; I222-L225 HydrophobicContact CD1-CG 4.2Å; I222-L225 HydrophobicContact CG1-CB 4.09Å; L225-L227 HydrophobicContact CD1-CD2 3.9Å; L225-L227 HydrophobicContact CD2-CD1 4.19Å; L225-L227 HydrophobicContact CD2-CD2 4.05Å; L225-L227 HydrophobicContact CD2-CG 4.25Å; L225-L227 HydrophobicContact CG-CD1 4.4Å; L225-L227 HydrophobicContact CG-CD2 3.8Å; L225-L227 HydrophobicContact CG-CG 3.95Å; L225-W244 HydrophobicContact CD2-CH2 3.34Å; L225-W244 HydrophobicContact CD2-CZ2 4.4Å; L225-W244 HydrophobicContact CD2-CZ3 3.52Å; L225-F253 PolarHBondContact N-O 2.97Å; L225-I254 HydrophobicContact CB-CG2 4.45Å; L225-I254 CarbonylContact O-C 3.5Å; L225-I254 VanDerWaalsContact O-CA 3.28Å; L225-I254 WeakPolarHBondContact O-CA 3.24Å; L225-G255 PolarHBondContact O-N 2.82Å
226	Q	83	Confident	83.1	Confident	16 Å²	16	36.3 Å²	36.3	8%	0.075	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	120.8	-177.1	-64.4	172.2	-16.3	0	0	110.4	L200 D201 I202 R203 E224 F253	L200-Q226 PolarHBondContact O-N 3.14Å; D201-Q226 HydrophobicContact CB-CB 4.36Å; D201-Q226 PolarHBondContact OD2-OE1 3.24Å; I202-Q226 VanDerWaalsContact CG1-O 3.3Å; I202-Q226 WeakPolarHBondContact CG1-O 3.32Å; I202-Q226 PolarHBondContact N-O 3.34Å; R203-Q226 HydrophobicContact CG-CB 3.83Å; E224-Q226 HydrophobicContact CG-CG 3.91Å; E224-Q226 PolarHBondContact OE1-NE2 3.42Å; Q226-F253 HydrophobicContact CG-CD1 4.48Å; Q226-F253 HydrophobicContact CG-CE1 4.32Å
227	L	88.8	Confident	83	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.22	C	C	.	.			trans	-121.7	-0.6	-167.2	-62.8	-177.9	0	0	0	113.7	I202 L210 L225 W232 L245 I254 A257	I202-L227 HydrophobicContact CD1-CD2 3.78Å; I202-L227 HydrophobicContact CG1-CD2 4.07Å; L210-L227 HydrophobicContact CD1-CD2 4.17Å; L225-L227 HydrophobicContact CD1-CD2 3.9Å; L225-L227 HydrophobicContact CD2-CD1 4.19Å; L225-L227 HydrophobicContact CD2-CD2 4.05Å; L225-L227 HydrophobicContact CD2-CG 4.25Å; L225-L227 HydrophobicContact CG-CD1 4.4Å; L225-L227 HydrophobicContact CG-CD2 3.8Å; L225-L227 HydrophobicContact CG-CG 3.95Å; L227-W232 HydrophobicContact CB-CZ2 4.03Å; L227-W232 HydrophobicContact CD2-CH2 4.43Å; L227-W232 HydrophobicContact CD2-CZ2 4.15Å; L227-W232 PolarHBondContact O-NE1 3.04Å; L227-L245 HydrophobicContact CD1-CD2 4.15Å; L227-I254 HydrophobicContact CD1-CG2 4.12Å; L227-A257 HydrophobicContact CB-CB 4.23Å; L227-A257 HydrophobicContact CD1-CB 4.22Å
228	D	82.1	Confident	83.3	Confident	40 Å²	40	36.6 Å²	36.6	21%	0.214	20%	0.2	C	C	.	.			trans	-65.6	164.5	-171.9	-37.3	-106	0	0	0	111.6	R203 G204 N230 G255 E256	R203-D228 VanDerWaalsContact CA-O 3.26Å; R203-D228 WeakPolarHBondContact CA-O 3.4Å; R203-D228 WeakPolarHBondContact CD-OD2 3.47Å; R203-D228 HydrophobicContact CG-CB 3.87Å; G204-D228 PolarHBondContact N-O 3.29Å; D228-N230 PolarHBondContact O-N 3.18Å; D228-N230 VanDerWaalsContact O-N 3.1Å; D228-N230 PolarHBondContact O-ND2 2.7Å; D228-G255 WeakPolarHBondContact OD2-CA 3.3Å; D228-E256 PolarHBondContact OD1-N 3.16Å
229	D	83.6	Confident	83.4	Confident	81 Å²	81	35 Å²	35	43%	0.433	20%	0.195	S	C	.	.	S	Bend	trans	53.2	32.8	174.6	-68.6	-46.1	0	0	0	115.4	G204 K831	G204-D229 VanDerWaalsContact CA-O 3.3Å; G204-D229 WeakPolarHBondContact CA-O 3.34Å; G204-D229 PolarHBondContact N-O 2.61Å; D229-K831 IonicContact OD1-NZ 2.66Å; D229-K831 PolarHBondContact OD1-NZ 3.45Å; D229-K831 VanDerWaalsContact OD2-CE 3.26Å; D229-K831 WeakPolarHBondContact OD2-CE 3.33Å; D229-K831 IonicContact OD2-NZ 2.68Å; D229-K831 PolarHBondContact OD2-NZ 3.31Å
230	N	89.1	Confident	83.6	Confident	7 Å²	7	37 Å²	37	4%	0.037	21%	0.209	C	C	.	.			trans	-116.3	145.6	174	-85	-92	0	0	0	111.3	I202 N205 I207 D228 W232	I202-N230 PolarHBondContact O-ND2 3.41Å; N205-N230 WeakPolarHBondContact CA-OD1 3.28Å; N205-N230 WeakPolarHBondContact CB-OD1 3.2Å; N205-N230 PolarHBondContact O-OD1 3.16Å; I207-N230 WeakPolarHBondContact CB-OD1 3.13Å; I207-N230 PolarHBondContact N-OD1 3.23Å; I207-N230 VanDerWaalsContact N-OD1 3.09Å; D228-N230 PolarHBondContact O-N 3.18Å; D228-N230 VanDerWaalsContact O-N 3.1Å; D228-N230 PolarHBondContact O-ND2 2.7Å; N230-W232 HydrophobicContact CB-CD2 4.37Å; N230-W232 HydrophobicContact CB-CZ2 3.91Å; N230-W232 PolarHBondContact O-N 3.06Å
231	P	89.3	Confident	84.6	Confident	15 Å²	15	34.2 Å²	34.2	10%	0.097	18%	0.18	C	C	.	.			trans	-79.6	63.4	-175.3	35.1	-39	0	0	0	112.2	N205 I207 Q208 N233 E260	N205-P231 WeakPolarHBondContact O-CD 3.45Å; I207-P231 WeakPolarHBondContact O-CD 3.39Å; Q208-P231 HydrophobicContact CG-CG 4.27Å; P231-N233 PolarHBondContact O-N 3.43Å; P231-E260 WeakPolarHBondContact CA-OE2 3.45Å; P231-E260 HydrophobicContact CB-CB 4.33Å; P231-E260 VanDerWaalsContact CB-OE2 3.24Å; P231-E260 WeakPolarHBondContact CB-OE2 3.17Å
232	W	90.7	Very high	85.2	Confident	1 Å²	1	26.1 Å²	26.1	0%	0.004	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	123.3	-171.9	-65.5	105.7	0	0	0	112.4	I207 L210 L227 N230 C234 L238 L241 A257 E260 T261	I207-W232 HydrophobicContact CB-CH2 4.4Å; I207-W232 HydrophobicContact CG2-CH2 3.81Å; I207-W232 HydrophobicContact CG2-CZ3 3.78Å; L210-W232 HydrophobicContact CD1-CH2 3.65Å; L210-W232 HydrophobicContact CD1-CZ3 4.16Å; L210-W232 HydrophobicContact CG-CH2 3.79Å; L210-W232 HydrophobicContact CG-CZ3 3.87Å; L227-W232 HydrophobicContact CB-CZ2 4.03Å; L227-W232 HydrophobicContact CD2-CH2 4.43Å; L227-W232 HydrophobicContact CD2-CZ2 4.15Å; L227-W232 PolarHBondContact O-NE1 3.04Å; N230-W232 HydrophobicContact CB-CD2 4.37Å; N230-W232 HydrophobicContact CB-CZ2 3.91Å; N230-W232 PolarHBondContact O-N 3.06Å; W232-C234 PolarHBondContact O-N 2.93Å; W232-L238 HydrophobicContact CB-CD2 4.12Å; W232-L238 HydrophobicContact CE3-CD1 3.96Å; W232-L238 HydrophobicContact CE3-CD2 4.26Å; W232-L238 HydrophobicContact CZ3-CD1 4.29Å; W232-L241 HydrophobicContact CE3-CD2 4.17Å; W232-L241 HydrophobicContact CH2-CD2 4.22Å; W232-L241 HydrophobicContact CZ3-CD2 3.85Å; W232-A257 HydrophobicContact CD2-CB 4.44Å; W232-A257 HydrophobicContact CG-CB 4.4Å; W232-E260 PolarHBondContact O-N 2.77Å; W232-T261 PolarHBondContact O-N 3.34Å
233	N	88.6	Confident	85.4	Confident	33 Å²	33	27.9 Å²	27.9	18%	0.176	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	92.7	176.2	-176.5	14.4	0	0	0	109.7	Q208 P231 T235 T261	Q208-N233 HydrophobicContact CB-CB 3.98Å; Q208-N233 PolarHBondContact O-N 3.3Å; P231-N233 PolarHBondContact O-N 3.43Å; N233-T235 PolarHBondContact O-N 3.21Å; N233-T235 WeakPolarHBondContact OD1-CG2 3.33Å; N233-T261 CarbonylContact C-O 3.07Å; N233-T261 WeakPolarHBondContact CA-OG1 3.33Å; N233-T261 WeakPolarHBondContact CB-OG1 2.98Å; N233-T261 PolarHBondContact OD1-OG1 3.16Å
234	C	86.7	Confident	85.8	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.007	16%	0.161	C	C	.	.			trans	-76.5	52.1	-178.3	-67.9	0	0	0	0	112.7	W232 L238 C259 T261 P262 L265 L278	W232-C234 PolarHBondContact O-N 2.93Å; C234-L238 HydrophobicContact CB-CD2 4.39Å; C234-C259 HydrophobicContact CB-CB 3.78Å; C234-C259 WeakPolarHBondContact CB-SG 3.38Å; C234-C259 VanDerWaalsContact SG-CA 3.52Å; C234-C259 WeakPolarHBondContact SG-CB 3.22Å; C234-C259 CovalentContact SG-SG 2.02Å; C234-C259 PolarHBondContact SG-SG 3.34Å; C234-T261 WeakPolarHBondContact CB-O 3.08Å; C234-T261 PolarHBondContact N-O 2.88Å; C234-P262 WeakPolarHBondContact O-CD 3.03Å; C234-L265 HydrophobicContact CB-CB 4.35Å; C234-L265 HydrophobicContact CB-CD1 3.93Å; C234-L265 VanDerWaalsContact O-CD1 3.26Å; C234-L265 WeakPolarHBondContact O-CD1 3.33Å; C234-L278 HydrophobicContact CB-CD2 3.6Å; C234-L278 VanDerWaalsContact O-CD2 3.24Å; C234-L278 WeakPolarHBondContact O-CD2 3.36Å
235	T	86.4	Confident	86.2	Confident	40 Å²	40	26.2 Å²	26.2	25%	0.245	16%	0.155	C	C	.	.	S	Bend	trans	-86.9	-175.7	161.6	54.2	0	0	0	0	110.4	N233 D237 L238 L278	N233-T235 PolarHBondContact O-N 3.21Å; N233-T235 WeakPolarHBondContact OD1-CG2 3.33Å; T235-D237 PolarHBondContact O-N 3.25Å; T235-D237 VanDerWaalsContact O-N 3.17Å; T235-D237 PolarHBondContact OG1-OD2 2.97Å; T235-L238 PolarHBondContact O-N 2.83Å; T235-L278 CarbonylContact C-O 3.17Å
236	C	84.3	Confident	85.9	Confident	64 Å²	64	31 Å²	31	43%	0.432	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-60.9	-24.3	178.6	-163.1	0	0	0	0	113	L238 A239 L278 C279	C236-L238 PolarHBondContact O-N 3.23Å; C236-L238 VanDerWaalsContact O-N 3.16Å; C236-A239 WeakPolarHBondContact O-CB 3.4Å; C236-A239 PolarHBondContact O-N 3.24Å; C236-L278 WeakPolarHBondContact CA-O 3.26Å; C236-L278 PolarHBondContact N-O 2.85Å; C236-C279 WeakPolarHBondContact CA-SG 3.12Å; C236-C279 HydrophobicContact CB-CB 3.87Å; C236-C279 WeakPolarHBondContact CB-SG 3.47Å; C236-C279 WeakPolarHBondContact SG-CB 3.22Å; C236-C279 CovalentContact SG-SG 2.04Å; C236-C279 PolarHBondContact SG-SG 2.71Å
237	D	83.4	Confident	85.7	Confident	100 Å²	100	36.8 Å²	36.8	54%	0.535	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-61.3	-21.4	174.9	-49.3	-57.2	0	0	0	113.1	T235 P240	T235-D237 PolarHBondContact O-N 3.25Å; T235-D237 VanDerWaalsContact O-N 3.17Å; T235-D237 PolarHBondContact OG1-OD2 2.97Å; D237-P240 WeakPolarHBondContact O-CD 3.43Å
238	L	88.3	Confident	84.9	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-96.3	-5.2	178.6	-151.8	62.3	0	0	0	113.5	N209 W232 C234 T235 C236 P240 L241 K242 L270	N209-L238 HydrophobicContact CB-CD1 3.91Å; W232-L238 HydrophobicContact CB-CD2 4.12Å; W232-L238 HydrophobicContact CE3-CD1 3.96Å; W232-L238 HydrophobicContact CE3-CD2 4.26Å; W232-L238 HydrophobicContact CZ3-CD1 4.29Å; C234-L238 HydrophobicContact CB-CD2 4.39Å; T235-L238 PolarHBondContact O-N 2.83Å; C236-L238 PolarHBondContact O-N 3.23Å; C236-L238 VanDerWaalsContact O-N 3.16Å; L238-P240 VanDerWaalsContact C-N 3.32Å; L238-L241 HydrophobicContact CD1-CB 4.03Å; L238-L241 HydrophobicContact CD1-CD2 3.69Å; L238-L241 HydrophobicContact CD1-CG 4.49Å; L238-L241 HydrophobicContact CG-CB 4.32Å; L238-L241 HydrophobicContact CG-CD2 4.24Å; L238-L241 PolarHBondContact O-N 2.89Å; L238-K242 PolarHBondContact O-N 3.13Å; L238-L270 HydrophobicContact CD2-CD1 3.86Å; L238-L270 HydrophobicContact CD2-CD2 3.81Å; L238-L270 HydrophobicContact CD2-CG 4.44Å; L238-L270 HydrophobicContact CG-CD1 4.08Å; L238-L270 HydrophobicContact CG-CD2 3.81Å
239	A	85.3	Confident	84.1	Confident	17 Å²	17	39.7 Å²	39.7	14%	0.14	23%	0.227	C	C	.	.	H	α-helix	trans	-57.3	-33.9	174	0	0	0	0	0	114.3	C236 K242 A243 L278	C236-A239 WeakPolarHBondContact O-CB 3.4Å; C236-A239 PolarHBondContact O-N 3.24Å; A239-K242 PolarHBondContact O-N 3.04Å; A239-A243 PolarHBondContact O-N 3.18Å; A239-L278 HydrophobicContact CB-CD1 4.32Å
240	P	85.9	Confident	82.8	Confident	48 Å²	48	47 Å²	47	31%	0.312	25%	0.25	S	S	.	.	H	α-helix	trans	-66.8	-38.2	174.4	-19.1	32.6	0	0	0	113	D237 L238 A243 W244	D237-P240 WeakPolarHBondContact O-CD 3.43Å; L238-P240 VanDerWaalsContact C-N 3.32Å; P240-A243 PolarHBondContact O-N 3.42Å; P240-W244 WeakPolarHBondContact O-CB 3.45Å; P240-W244 PolarHBondContact O-N 2.94Å
241	L	87.9	Confident	81.1	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-64.7	-44	173.6	178.4	63.1	0	0	0	110.9	L210 L216 W232 L238 A243 W244 L245 L270	L210-L241 HydrophobicContact CB-CD1 4.34Å; L210-L241 HydrophobicContact CB-CD2 4.27Å; L210-L241 HydrophobicContact CD1-CD1 4.12Å; L210-L241 HydrophobicContact CD1-CD2 4.26Å; L216-L241 HydrophobicContact CD1-CB 4.04Å; L216-L241 HydrophobicContact CD1-CD1 3.74Å; L216-L241 HydrophobicContact CD2-CD1 3.96Å; W232-L241 HydrophobicContact CE3-CD2 4.17Å; W232-L241 HydrophobicContact CH2-CD2 4.22Å; W232-L241 HydrophobicContact CZ3-CD2 3.85Å; L238-L241 HydrophobicContact CD1-CB 4.03Å; L238-L241 HydrophobicContact CD1-CD2 3.69Å; L238-L241 HydrophobicContact CD1-CG 4.49Å; L238-L241 HydrophobicContact CG-CB 4.32Å; L238-L241 HydrophobicContact CG-CD2 4.24Å; L238-L241 PolarHBondContact O-N 2.89Å; L241-A243 PolarHBondContact O-N 2.97Å; L241-W244 HydrophobicContact CD1-CE3 4.46Å; L241-W244 PolarHBondContact O-N 3Å; L241-L245 HydrophobicContact CD1-CD1 4.29Å; L241-L245 HydrophobicContact CD1-CG 4.25Å; L241-L245 HydrophobicContact CG-CD1 3.99Å; L241-L245 HydrophobicContact CG-CG 4.39Å; L241-L245 WeakPolarHBondContact O-CB 3.43Å; L241-L245 VanDerWaalsContact O-CG 3.26Å; L241-L245 WeakPolarHBondContact O-CG 3.46Å; L241-L245 PolarHBondContact O-N 2.98Å; L241-L270 HydrophobicContact CB-CD2 4.21Å; L241-L270 HydrophobicContact CD2-CD2 3.6Å; L241-L270 HydrophobicContact CG-CD2 3.75Å
242	K	85.3	Confident	79.9	Confident	15 Å²	15	52.9 Å²	52.9	7%	0.065	28%	0.281	C	S	.	.	H	α-helix	trans	-55.8	-50.8	173.7	-178.9	-172.4	172	-70.1	0	111.7	L238 A239 W244 L245 E246 L270 T273 L278	L238-K242 PolarHBondContact O-N 3.13Å; A239-K242 PolarHBondContact O-N 3.04Å; K242-W244 VanDerWaalsContact C-N 3.28Å; K242-W244 PolarHBondContact O-N 3.25Å; K242-L245 WeakPolarHBondContact O-CB 3.46Å; K242-L245 PolarHBondContact O-N 2.95Å; K242-L245 VanDerWaalsContact O-N 3.14Å; K242-E246 IonicContact NZ-OE1 3.05Å; K242-E246 PolarHBondContact NZ-OE1 2.99Å; K242-E246 IonicContact NZ-OE2 3.47Å; K242-E246 PolarHBondContact NZ-OE2 3Å; K242-E246 WeakPolarHBondContact O-CG 3.39Å; K242-E246 PolarHBondContact O-N 3.35Å; K242-L270 HydrophobicContact CB-CD1 4.07Å; K242-L270 HydrophobicContact CB-CG 4.14Å; K242-T273 WeakPolarHBondContact CE-O 3.22Å; K242-L278 HydrophobicContact CB-CD1 4.14Å; K242-L278 HydrophobicContact CD-CD1 3.63Å; K242-L278 HydrophobicContact CG-CD1 4.48Å
243	A	84.6	Confident	78.6	Confident	42 Å²	42	58.7 Å²	58.7	35%	0.347	31%	0.306	S	S	.	.	H	α-helix	trans	-62.6	-35.1	-179.3	0	0	0	0	0	112.3	A239 P240 L241 N247	A239-A243 PolarHBondContact O-N 3.18Å; P240-A243 PolarHBondContact O-N 3.42Å; L241-A243 PolarHBondContact O-N 2.97Å; A243-N247 PolarHBondContact O-N 3.22Å; A243-N247 PolarHBondContact O-ND2 3.11Å
244	W	86.2	Confident	78.2	Confident	21 Å²	21	59.2 Å²	59.2	8%	0.08	31%	0.308	C	S	.	.	H	α-helix	trans	-65.6	-45.3	172.9	-175.2	99.7	0	0	0	111.5	L216 I219 I222 L225 P240 L241 K242 E246 N247 M248 I254	L216-W244 HydrophobicContact CB-CG 4.15Å; L216-W244 HydrophobicContact CD1-CB 4.09Å; L216-W244 HydrophobicContact CD1-CG 4.12Å; L216-W244 PolarHBondContact O-NE1 3.36Å; I219-W244 HydrophobicContact CB-CZ2 4.01Å; I219-W244 HydrophobicContact CG2-CH2 4.46Å; I219-W244 HydrophobicContact CG2-CZ2 3.94Å; I222-W244 HydrophobicContact CG2-CH2 4.09Å; I222-W244 HydrophobicContact CG2-CZ2 4.32Å; L225-W244 HydrophobicContact CD2-CH2 3.34Å; L225-W244 HydrophobicContact CD2-CZ2 4.4Å; L225-W244 HydrophobicContact CD2-CZ3 3.52Å; P240-W244 WeakPolarHBondContact O-CB 3.45Å; P240-W244 PolarHBondContact O-N 2.94Å; L241-W244 HydrophobicContact CD1-CE3 4.46Å; L241-W244 PolarHBondContact O-N 3Å; K242-W244 VanDerWaalsContact C-N 3.28Å; K242-W244 PolarHBondContact O-N 3.25Å; W244-E246 VanDerWaalsContact C-N 3.27Å; W244-E246 PolarHBondContact O-N 3.31Å; W244-N247 PolarHBondContact O-N 3.18Å; W244-M248 HydrophobicContact CD2-CE 4.27Å; W244-M248 HydrophobicContact CD2-CG 4.4Å; W244-M248 VanDerWaalsContact CE2-CE 3.49Å; W244-M248 HydrophobicContact CE3-CG 4.21Å; W244-M248 HydrophobicContact CH2-CE 3.79Å; W244-M248 HydrophobicContact CH2-CG 4.17Å; W244-M248 HydrophobicContact CZ2-CE 3.24Å; W244-M248 HydrophobicContact CZ2-CG 4.41Å; W244-M248 HydrophobicContact CZ3-CG 4.08Å; W244-M248 PolarHBondContact O-N 3.1Å; W244-I254 HydrophobicContact CZ3-CD1 4.39Å
245	L	83.8	Confident	77.3	Confident	8 Å²	8	59.6 Å²	59.6	4%	0.042	31%	0.312	C	S	.	.	H	α-helix	trans	-64.6	-24.2	177.5	-70.8	169.8	0	0	0	114.3	L227 L241 K242 I254 L270 K271	L227-L245 HydrophobicContact CD1-CD2 4.15Å; L241-L245 HydrophobicContact CD1-CD1 4.29Å; L241-L245 HydrophobicContact CD1-CG 4.25Å; L241-L245 HydrophobicContact CG-CD1 3.99Å; L241-L245 HydrophobicContact CG-CG 4.39Å; L241-L245 WeakPolarHBondContact O-CB 3.43Å; L241-L245 VanDerWaalsContact O-CG 3.26Å; L241-L245 WeakPolarHBondContact O-CG 3.46Å; L241-L245 PolarHBondContact O-N 2.98Å; K242-L245 WeakPolarHBondContact O-CB 3.46Å; K242-L245 PolarHBondContact O-N 2.95Å; K242-L245 VanDerWaalsContact O-N 3.14Å; L245-I254 HydrophobicContact CD2-CD1 4.24Å; L245-I254 HydrophobicContact CD2-CG2 3.61Å; L245-L270 HydrophobicContact CD1-CD2 3.79Å; L245-L270 HydrophobicContact CD1-CG 4.29Å; L245-K271 WeakPolarHBondContact O-CE 3.32Å; L245-K271 PolarHBondContact O-NZ 2.8Å
246	E	81.3	Confident	77	Confident	102 Å²	102	62.5 Å²	62.5	48%	0.477	32%	0.323	S	S	.	.	H	α-helix	trans	-80.9	-30.2	175.4	-75.2	172.7	128.6	0	0	113.3	K242 W244	K242-E246 IonicContact NZ-OE1 3.05Å; K242-E246 PolarHBondContact NZ-OE1 2.99Å; K242-E246 IonicContact NZ-OE2 3.47Å; K242-E246 PolarHBondContact NZ-OE2 3Å; K242-E246 WeakPolarHBondContact O-CG 3.39Å; K242-E246 PolarHBondContact O-N 3.35Å; W244-E246 VanDerWaalsContact C-N 3.27Å; W244-E246 PolarHBondContact O-N 3.31Å
247	N	79.1	Confident	77.1	Confident	138 Å²	138	59.5 Å²	59.5	74%	0.738	30%	0.303	S	S	*	.	H	α-helix	trans	-89.1	-10.6	-177.9	-74.2	-66.6	0	0	0	114	A243 W244	A243-N247 PolarHBondContact O-N 3.22Å; A243-N247 PolarHBondContact O-ND2 3.11Å; W244-N247 PolarHBondContact O-N 3.18Å
248	M	72.1	Confident	77.1	Confident	32 Å²	32	58.5 Å²	58.5	16%	0.158	30%	0.297	C	S	.	.	S	Bend	trans	-75.2	136	178.4	-79.5	-58.5	-173.3	0	0	113	I222 W244 I252 I254	I222-M248 HydrophobicContact CG2-CE 4.35Å; W244-M248 HydrophobicContact CD2-CE 4.27Å; W244-M248 HydrophobicContact CD2-CG 4.4Å; W244-M248 VanDerWaalsContact CE2-CE 3.49Å; W244-M248 HydrophobicContact CE3-CG 4.21Å; W244-M248 HydrophobicContact CH2-CE 3.79Å; W244-M248 HydrophobicContact CH2-CG 4.17Å; W244-M248 HydrophobicContact CZ2-CE 3.24Å; W244-M248 HydrophobicContact CZ2-CG 4.41Å; W244-M248 HydrophobicContact CZ3-CG 4.08Å; W244-M248 PolarHBondContact O-N 3.1Å; M248-I252 HydrophobicContact CB-CD1 4.33Å; M248-I252 HydrophobicContact CG-CD1 4.37Å; M248-I252 HydrophobicContact SD-CD1 3.61Å; M248-I254 HydrophobicContact CB-CD1 3.92Å; M248-I254 HydrophobicContact CG-CD1 4.31Å
249	P	64.9	Low	76.9	Confident	68 Å²	68	58.6 Å²	58.6	44%	0.442	30%	0.298	S	S	.	.			trans	-70.8	151.6	-177.2	30	-37.2	0	0	0	113.3	N251 I252	P249-N251 WeakPolarHBondContact CB-OD1 3.49Å; P249-N251 WeakPolarHBondContact CG-OD1 3.06Å; P249-N251 PolarHBondContact O-N 3.19Å; P249-I252 HydrophobicContact CG-CD1 3.85Å; P249-I252 HydrophobicContact CG-CG1 4.19Å; P249-I252 PolarHBondContact O-N 3.09Å
250	Y	56.3	Low	76.8	Confident	236 Å²	236	62.2 Å²	62.2	93%	0.925	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-1.6	-170.9	-58.9	-84.3	0	0	0	116.3
251	N	53.8	Low	76.5	Confident	116 Å²	116	62.7 Å²	62.7	62%	0.62	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-7	177.1	65.7	-50.2	0	0	0	113.8	P249	P249-N251 WeakPolarHBondContact CB-OD1 3.49Å; P249-N251 WeakPolarHBondContact CG-OD1 3.06Å; P249-N251 PolarHBondContact O-N 3.19Å
252	I	63.8	Low	75.9	Confident	29 Å²	29	64.8 Å²	64.8	15%	0.149	33%	0.328	C	S	.	.	S	Bend	trans	-86.3	131.2	174.6	-58.5	176.2	0	0	0	108.7	I222 V223 M248 P249 I254	I222-I252 HydrophobicContact CG2-CG2 4.26Å; I222-I252 WeakPolarHBondContact O-CD1 3.22Å; I222-I252 WeakPolarHBondContact O-CG1 3Å; V223-I252 WeakPolarHBondContact O-CA 3.38Å; V223-I252 WeakPolarHBondContact O-CG2 3.5Å; M248-I252 HydrophobicContact CB-CD1 4.33Å; M248-I252 HydrophobicContact CG-CD1 4.37Å; M248-I252 HydrophobicContact SD-CD1 3.61Å; P249-I252 HydrophobicContact CG-CD1 3.85Å; P249-I252 HydrophobicContact CG-CG1 4.19Å; P249-I252 PolarHBondContact O-N 3.09Å; I252-I254 HydrophobicContact CB-CG1 4.34Å; I252-I254 HydrophobicContact CG2-CD1 4.07Å; I252-I254 HydrophobicContact CG2-CG1 3.68Å
253	F	63.8	Low	75.5	Confident	123 Å²	123	69.3 Å²	69.3	54%	0.539	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	121.1	171	-171.6	-92.8	0	0	0	109.5	V223 E224 L225 Q226	V223-F253 PolarHBondContact O-N 3.24Å; E224-F253 WeakPolarHBondContact CA-O 2.92Å; E224-F253 HydrophobicContact CG-CD1 4.07Å; E224-F253 VanDerWaalsContact OE1-CD1 3.23Å; E224-F253 WeakPolarHBondContact OE1-CD1 3.49Å; L225-F253 PolarHBondContact N-O 2.97Å; Q226-F253 HydrophobicContact CG-CD1 4.48Å; Q226-F253 HydrophobicContact CG-CE1 4.32Å
254	I	78.3	Confident	75	Confident	43 Å²	43	73.6 Å²	73.6	22%	0.221	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	126	179.5	-49.2	178.8	0	0	0	109.7	L225 L227 W244 L245 M248 I252	L225-I254 HydrophobicContact CB-CG2 4.45Å; L225-I254 CarbonylContact O-C 3.5Å; L225-I254 VanDerWaalsContact O-CA 3.28Å; L225-I254 WeakPolarHBondContact O-CA 3.24Å; L227-I254 HydrophobicContact CD1-CG2 4.12Å; W244-I254 HydrophobicContact CZ3-CD1 4.39Å; L245-I254 HydrophobicContact CD2-CD1 4.24Å; L245-I254 HydrophobicContact CD2-CG2 3.61Å; M248-I254 HydrophobicContact CB-CD1 3.92Å; M248-I254 HydrophobicContact CG-CD1 4.31Å; I252-I254 HydrophobicContact CB-CG1 4.34Å; I252-I254 HydrophobicContact CG2-CD1 4.07Å; I252-I254 HydrophobicContact CG2-CG1 3.68Å
255	G	68.6	Low	74.6	Confident	9 Å²	9	72.9 Å²	72.9	9%	0.093	38%	0.376	C	S	.	.			trans	-68.9	164.1	179.3	0	0	0	0	0	114.3	L225 D228 A257	L225-G255 PolarHBondContact O-N 2.82Å; D228-G255 WeakPolarHBondContact OD2-CA 3.3Å; G255-A257 PolarHBondContact O-N 3.13Å
256	E	80	Confident	74.3	Confident	101 Å²	101	79.4 Å²	79.4	47%	0.472	40%	0.401	S	S	.	.			trans	-84.7	98	-171.9	-69.9	-163.5	175.4	0	0	112.2	D228 I258 L269	D228-E256 PolarHBondContact OD1-N 3.16Å; E256-I258 HydrophobicContact CB-CG1 4.38Å; E256-I258 PolarHBondContact O-N 2.84Å; E256-L269 HydrophobicContact CB-CD1 3.75Å; E256-L269 HydrophobicContact CG-CD1 4.05Å
257	A	85.8	Confident	74	Confident	2 Å²	2	76.4 Å²	76.4	2%	0.017	40%	0.397	C	S	.	.			trans	-72.9	92.2	172.2	0	0	0	0	0	111.4	L227 W232 G255 L270	L227-A257 HydrophobicContact CB-CB 4.23Å; L227-A257 HydrophobicContact CD1-CB 4.22Å; W232-A257 HydrophobicContact CD2-CB 4.44Å; W232-A257 HydrophobicContact CG-CB 4.4Å; G255-A257 PolarHBondContact O-N 3.13Å; A257-L270 HydrophobicContact CB-CB 4.1Å; A257-L270 HydrophobicContact CB-CD2 4.34Å; A257-L270 WeakPolarHBondContact O-CB 3.41Å; A257-L270 PolarHBondContact O-N 2.86Å
258	I	83.3	Confident	73.7	Confident	78 Å²	78	72.2 Å²	72.2	40%	0.4	37%	0.371	S	S	.	.	B	Isolated β-bridge	trans	-92.4	125.4	-179.3	-59.4	170.3	0	0	0	110.8	E256 E260 R268	E256-I258 HydrophobicContact CB-CG1 4.38Å; E256-I258 PolarHBondContact O-N 2.84Å; I258-E260 PolarHBondContact O-N 2.82Å; I258-R268 WeakPolarHBondContact CA-O 3.28Å
259	C	85.1	Confident	74	Confident	2 Å²	2	72.6 Å²	72.6	1%	0.014	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	127.4	176.3	-59.6	0	0	0	0	112.5	C234 L265 Y266 G267 R268	C234-C259 HydrophobicContact CB-CB 3.78Å; C234-C259 WeakPolarHBondContact CB-SG 3.38Å; C234-C259 VanDerWaalsContact SG-CA 3.52Å; C234-C259 WeakPolarHBondContact SG-CB 3.22Å; C234-C259 CovalentContact SG-SG 2.02Å; C234-C259 PolarHBondContact SG-SG 3.34Å; C259-L265 HydrophobicContact CB-CB 4.36Å; C259-L265 WeakPolarHBondContact CB-O 3.24Å; C259-Y266 CarbonylContact O-C 3.51Å; C259-Y266 WeakPolarHBondContact O-CA 3.1Å; C259-G267 PolarHBondContact O-N 2.69Å; C259-R268 HydrophobicContact CB-CB 4.49Å; C259-R268 WeakPolarHBondContact CB-O 3.41Å; C259-R268 PolarHBondContact N-O 2.83Å; C259-R268 PolarHBondContact SG-O 3.42Å; C259-R268 VanDerWaalsContact SG-O 3.35Å
260	E	83.6	Confident	74.9	Confident	93 Å²	93	69.3 Å²	69.3	44%	0.435	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	-27.1	169.1	-166.3	176.1	142.4	0	0	111.7	P231 W232 I258 Y266	P231-E260 WeakPolarHBondContact CA-OE2 3.45Å; P231-E260 HydrophobicContact CB-CB 4.33Å; P231-E260 VanDerWaalsContact CB-OE2 3.24Å; P231-E260 WeakPolarHBondContact CB-OE2 3.17Å; W232-E260 PolarHBondContact O-N 2.77Å; I258-E260 PolarHBondContact O-N 2.82Å; E260-Y266 HydrophobicContact CG-CD2 4.35Å; E260-Y266 HydrophobicContact CG-CE2 4Å; E260-Y266 VanDerWaalsContact O-CD2 3.26Å; E260-Y266 WeakPolarHBondContact O-CD2 3.44Å
261	T	78.1	Confident	75.8	Confident	58 Å²	58	62.6 Å²	62.6	36%	0.356	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	158.2	173.7	45.9	0	0	0	0	110.8	W232 N233 C234	W232-T261 PolarHBondContact O-N 3.34Å; N233-T261 CarbonylContact C-O 3.07Å; N233-T261 WeakPolarHBondContact CA-OG1 3.33Å; N233-T261 WeakPolarHBondContact CB-OG1 2.98Å; N233-T261 PolarHBondContact OD1-OG1 3.16Å; C234-T261 WeakPolarHBondContact CB-O 3.08Å; C234-T261 PolarHBondContact N-O 2.88Å
262	P	76.8	Confident	76.6	Confident	45 Å²	45	60.2 Å²	60.2	29%	0.292	31%	0.313	S	S	.	.	S	Bend	cis	-69.9	170.7	-13.9	33.3	-37.3	0	0	0	112.4	C234 D264 L265 Y266	C234-P262 WeakPolarHBondContact O-CD 3.03Å; P262-D264 VanDerWaalsContact C-N 3.26Å; P262-D264 PolarHBondContact O-N 3.35Å; P262-D264 VanDerWaalsContact O-N 3.13Å; P262-L265 HydrophobicContact CG-CD1 4.31Å; P262-L265 HydrophobicContact CG-CG 4.28Å; P262-L265 CarbonylContact O-C 3.59Å; P262-L265 PolarHBondContact O-N 2.9Å; P262-Y266 PolarHBondContact O-N 2.96Å
263	S	75.4	Confident	77.1	Confident	109 Å²	109	59.1 Å²	59.1	76%	0.762	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-54.7	-34.3	-173.5	-51.5	0	0	0	0	114.7	L265 Y266	S263-L265 PolarHBondContact O-N 2.89Å; S263-Y266 PolarHBondContact O-N 2.01Å
264	D	75.6	Confident	77.8	Confident	132 Å²	132	56.8 Å²	56.8	71%	0.706	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-68.7	-18.4	179.2	-51.1	-72.1	0	0	0	113.7	P262 R268	P262-D264 VanDerWaalsContact C-N 3.26Å; P262-D264 PolarHBondContact O-N 3.35Å; P262-D264 VanDerWaalsContact O-N 3.13Å; D264-R268 PolarHBondContact O-NE 3.37Å; D264-R268 PolarHBondContact O-NH2 3.41Å
265	L	78	Confident	77.6	Confident	6 Å²	6	61.8 Å²	61.8	3%	0.031	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-112.9	-1.6	-179.2	-53.8	-175.2	0	0	0	113.6	C234 C259 P262 S263 G267 R268 E277 L278	C234-L265 HydrophobicContact CB-CB 4.35Å; C234-L265 HydrophobicContact CB-CD1 3.93Å; C234-L265 VanDerWaalsContact O-CD1 3.26Å; C234-L265 WeakPolarHBondContact O-CD1 3.33Å; C259-L265 HydrophobicContact CB-CB 4.36Å; C259-L265 WeakPolarHBondContact CB-O 3.24Å; P262-L265 HydrophobicContact CG-CD1 4.31Å; P262-L265 HydrophobicContact CG-CG 4.28Å; P262-L265 CarbonylContact O-C 3.59Å; P262-L265 PolarHBondContact O-N 2.9Å; S263-L265 PolarHBondContact O-N 2.89Å; L265-G267 PolarHBondContact O-N 2.71Å; L265-R268 VanDerWaalsContact O-CB 3.26Å; L265-R268 WeakPolarHBondContact O-CB 3.4Å; L265-R268 WeakPolarHBondContact O-CG 3.26Å; L265-R268 PolarHBondContact O-N 3.48Å; L265-R268 VanDerWaalsContact O-N 3.13Å; L265-E277 HydrophobicContact CD2-CB 4.18Å; L265-L278 HydrophobicContact CD1-CD2 4.08Å
266	Y	77.3	Confident	77.8	Confident	145 Å²	145	67.7 Å²	67.7	57%	0.569	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	132.2	176.7	-174.4	-77.7	0	0	0	112	C259 E260 P262 S263 R268	C259-Y266 CarbonylContact O-C 3.51Å; C259-Y266 WeakPolarHBondContact O-CA 3.1Å; E260-Y266 HydrophobicContact CG-CD2 4.35Å; E260-Y266 HydrophobicContact CG-CE2 4Å; E260-Y266 VanDerWaalsContact O-CD2 3.26Å; E260-Y266 WeakPolarHBondContact O-CD2 3.44Å; P262-Y266 PolarHBondContact O-N 2.96Å; S263-Y266 PolarHBondContact O-N 2.01Å; Y266-R268 VanDerWaalsContact C-N 3.29Å; Y266-R268 PolarHBondContact O-N 2.69Å
267	G	73.7	Confident	77.5	Confident	39 Å²	39	66.6 Å²	66.6	40%	0.402	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.9	13.8	178.1	0	0	0	0	0	115	C259 L265	C259-G267 PolarHBondContact O-N 2.69Å; L265-G267 PolarHBondContact O-N 2.71Å
268	R	72.9	Confident	77.1	Confident	50 Å²	50	66.8 Å²	66.8	19%	0.189	34%	0.338	C	S	.	.			trans	-92.2	139.4	172.4	-61.2	-178.5	-176.6	-143.3	14.7	111	I258 C259 D264 L265 Y266 T273 E277 K357	I258-R268 WeakPolarHBondContact CA-O 3.28Å; C259-R268 HydrophobicContact CB-CB 4.49Å; C259-R268 WeakPolarHBondContact CB-O 3.41Å; C259-R268 PolarHBondContact N-O 2.83Å; C259-R268 PolarHBondContact SG-O 3.42Å; C259-R268 VanDerWaalsContact SG-O 3.35Å; D264-R268 PolarHBondContact O-NE 3.37Å; D264-R268 PolarHBondContact O-NH2 3.41Å; L265-R268 VanDerWaalsContact O-CB 3.26Å; L265-R268 WeakPolarHBondContact O-CB 3.4Å; L265-R268 WeakPolarHBondContact O-CG 3.26Å; L265-R268 PolarHBondContact O-N 3.48Å; L265-R268 VanDerWaalsContact O-N 3.13Å; Y266-R268 VanDerWaalsContact C-N 3.29Å; Y266-R268 PolarHBondContact O-N 2.69Å; R268-T273 HydrophobicContact CB-CG2 4.11Å; R268-E277 IonicContact CZ-OE1 3.79Å; R268-E277 IonicContact CZ-OE2 3.31Å; R268-E277 IonicContact NH1-OE1 3.75Å; R268-E277 PolarHBondContact NH1-OE1 3.19Å; R268-E277 IonicContact NH1-OE2 3.88Å; R268-E277 PolarHBondContact NH1-OE2 3.42Å; R268-E277 IonicContact NH2-OE1 2.66Å; R268-K357 VanDerWaalsContact CD-NZ 3.27Å; R268-K357 VanDerWaalsContact NH1-NZ 3.13Å
269	L	80.1	Confident	76.9	Confident	40 Å²	40	64.4 Å²	64.4	21%	0.209	33%	0.328	C	S	.	.	B	Isolated β-bridge	trans	-71.4	128.5	167.3	-176.6	63.4	0	0	0	109.7	E256 K271 E272 T273	E256-L269 HydrophobicContact CB-CD1 3.75Å; E256-L269 HydrophobicContact CG-CD1 4.05Å; L269-K271 VanDerWaalsContact C-N 3.27Å; L269-K271 HydrophobicContact CG-CB 4.42Å; L269-K271 PolarHBondContact O-N 2.68Å; L269-E272 HydrophobicContact CB-CB 4.44Å; L269-E272 HydrophobicContact CB-CG 4.29Å; L269-E272 HydrophobicContact CD2-CG 4.2Å; L269-E272 CarbonylContact O-C 3.56Å; L269-E272 WeakPolarHBondContact O-CA 3.26Å; L269-E272 PolarHBondContact O-N 3.17Å; L269-T273 PolarHBondContact O-N 3.47Å
270	L	82.4	Confident	76.2	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-54.7	-41	-176.7	178.3	60.6	0	0	0	112.7	L238 L241 K242 L245 A257 E272 T273 L278	L238-L270 HydrophobicContact CD2-CD1 3.86Å; L238-L270 HydrophobicContact CD2-CD2 3.81Å; L238-L270 HydrophobicContact CD2-CG 4.44Å; L238-L270 HydrophobicContact CG-CD1 4.08Å; L238-L270 HydrophobicContact CG-CD2 3.81Å; L241-L270 HydrophobicContact CB-CD2 4.21Å; L241-L270 HydrophobicContact CD2-CD2 3.6Å; L241-L270 HydrophobicContact CG-CD2 3.75Å; K242-L270 HydrophobicContact CB-CD1 4.07Å; K242-L270 HydrophobicContact CB-CG 4.14Å; L245-L270 HydrophobicContact CD1-CD2 3.79Å; L245-L270 HydrophobicContact CD1-CG 4.29Å; A257-L270 HydrophobicContact CB-CB 4.1Å; A257-L270 HydrophobicContact CB-CD2 4.34Å; A257-L270 WeakPolarHBondContact O-CB 3.41Å; A257-L270 PolarHBondContact O-N 2.86Å; L270-E272 PolarHBondContact O-N 2.89Å; L270-T273 PolarHBondContact O-N 3.1Å; L270-T273 VanDerWaalsContact O-N 3.1Å; L270-T273 PolarHBondContact O-OG1 3Å; L270-L278 HydrophobicContact CD1-CD1 4.07Å; L270-L278 HydrophobicContact CD1-CD2 4.22Å
271	K	76.3	Confident	74.8	Confident	95 Å²	95	73.1 Å²	73.1	41%	0.413	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-64.3	-16	177.2	-170	160.6	-179.5	155.3	0	113.7	L245 L269	L245-K271 WeakPolarHBondContact O-CE 3.32Å; L245-K271 PolarHBondContact O-NZ 2.8Å; L269-K271 VanDerWaalsContact C-N 3.27Å; L269-K271 HydrophobicContact CG-CB 4.42Å; L269-K271 PolarHBondContact O-N 2.68Å
272	E	70	Confident	73.2	Confident	65 Å²	65	73.4 Å²	73.4	30%	0.304	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-106.6	2.3	175.5	-60.2	-172.1	162.4	0	0	113.8	L269 L270 K389	L269-E272 HydrophobicContact CB-CB 4.44Å; L269-E272 HydrophobicContact CB-CG 4.29Å; L269-E272 HydrophobicContact CD2-CG 4.2Å; L269-E272 CarbonylContact O-C 3.56Å; L269-E272 WeakPolarHBondContact O-CA 3.26Å; L269-E272 PolarHBondContact O-N 3.17Å; L270-E272 PolarHBondContact O-N 2.89Å; E272-K389 IonicContact OE1-NZ 3.63Å; E272-K389 PolarHBondContact OE1-NZ 3.08Å
273	T	75.1	Confident	71.3	Confident	7 Å²	7	78.1 Å²	78.1	4%	0.043	42%	0.422	C	S	.	.	S	Bend	trans	-77.8	154.6	170.4	64.2	0	0	0	0	110.7	K242 R268 L269 L270	K242-T273 WeakPolarHBondContact CE-O 3.22Å; R268-T273 HydrophobicContact CB-CG2 4.11Å; L269-T273 PolarHBondContact O-N 3.47Å; L270-T273 PolarHBondContact O-N 3.1Å; L270-T273 VanDerWaalsContact O-N 3.1Å; L270-T273 PolarHBondContact O-OG1 3Å
274	N	76.7	Confident	69.5	Low	73 Å²	73	76.6 Å²	76.6	39%	0.39	42%	0.423	S	S	.	.			trans	-90	144.3	170.6	-177.9	-1.8	0	0	0	110.6	Q276 E277 L278	N274-Q276 PolarHBondContact ND2-OE1 3.17Å; N274-Q276 PolarHBondContact O-N 2.66Å; N274-Q276 VanDerWaalsContact O-N 3.12Å; N274-Q276 PolarHBondContact OD1-N 3.38Å; N274-E277 HydrophobicContact CB-CB 4.41Å; N274-E277 HydrophobicContact CB-CG 4.04Å; N274-E277 PolarHBondContact N-OE2 3.44Å; N274-E277 WeakPolarHBondContact O-CB 3.26Å; N274-E277 PolarHBondContact O-N 2.75Å; N274-L278 PolarHBondContact O-N 2.02Å; N274-L278 VanDerWaalsContact O-N 3.13Å
275	R	74	Confident	67.5	Low	148 Å²	148	75.3 Å²	75.3	56%	0.558	42%	0.424	S	S	*	.	H	α-helix	trans	-54.9	-31.1	173.6	-170.1	172.4	81.5	158.3	1.5	111.9	C279	R275-C279 WeakPolarHBondContact O-CB 3.39Å; R275-C279 PolarHBondContact O-N 2.9Å
276	Q	72.8	Confident	65.5	Low	134 Å²	134	83.9 Å²	83.9	63%	0.626	46%	0.464	S	S	*	.	H	α-helix	trans	-78.2	-18.4	177.2	-64.5	155.5	-23.5	0	0	113.8	N274 C279	N274-Q276 PolarHBondContact ND2-OE1 3.17Å; N274-Q276 PolarHBondContact O-N 2.66Å; N274-Q276 VanDerWaalsContact O-N 3.12Å; N274-Q276 PolarHBondContact OD1-N 3.38Å; Q276-C279 CarbonylContact O-C 3.27Å
277	E	73.9	Confident	63.5	Low	78 Å²	78	85 Å²	85	36%	0.364	47%	0.473	S	S	.	.	H	α-helix	trans	-82.9	-38.6	171	-70.7	-179	138.4	0	0	111.2	L265 R268 N274	L265-E277 HydrophobicContact CD2-CB 4.18Å; R268-E277 IonicContact CZ-OE1 3.79Å; R268-E277 IonicContact CZ-OE2 3.31Å; R268-E277 IonicContact NH1-OE1 3.75Å; R268-E277 PolarHBondContact NH1-OE1 3.19Å; R268-E277 IonicContact NH1-OE2 3.88Å; R268-E277 PolarHBondContact NH1-OE2 3.42Å; R268-E277 IonicContact NH2-OE1 2.66Å; N274-E277 HydrophobicContact CB-CB 4.41Å; N274-E277 HydrophobicContact CB-CG 4.04Å; N274-E277 PolarHBondContact N-OE2 3.44Å; N274-E277 WeakPolarHBondContact O-CB 3.26Å; N274-E277 PolarHBondContact O-N 2.75Å
278	L	78.4	Confident	61.5	Low	5 Å²	5	89.1 Å²	89.1	3%	0.026	49%	0.485	C	S	.	.	H	α-helix	trans	-68.2	-43.3	173.1	-62.7	176.5	0	0	0	111.8	C234 T235 C236 A239 K242 L265 L270 N274 P280	C234-L278 HydrophobicContact CB-CD2 3.6Å; C234-L278 VanDerWaalsContact O-CD2 3.24Å; C234-L278 WeakPolarHBondContact O-CD2 3.36Å; T235-L278 CarbonylContact C-O 3.17Å; C236-L278 WeakPolarHBondContact CA-O 3.26Å; C236-L278 PolarHBondContact N-O 2.85Å; A239-L278 HydrophobicContact CB-CD1 4.32Å; K242-L278 HydrophobicContact CB-CD1 4.14Å; K242-L278 HydrophobicContact CD-CD1 3.63Å; K242-L278 HydrophobicContact CG-CD1 4.48Å; L265-L278 HydrophobicContact CD1-CD2 4.08Å; L270-L278 HydrophobicContact CD1-CD1 4.07Å; L270-L278 HydrophobicContact CD1-CD2 4.22Å; N274-L278 PolarHBondContact O-N 2.02Å; N274-L278 VanDerWaalsContact O-N 3.13Å; L278-P280 VanDerWaalsContact C-CD 3.48Å; L278-P280 VanDerWaalsContact O-CD 3.32Å; L278-P280 WeakPolarHBondContact O-CD 3.31Å
279	C	79.8	Confident	59.7	Low	29 Å²	29	94 Å²	94	20%	0.196	51%	0.513	C	S	.	.	S	Bend	trans	-117.1	76.5	-179.4	-54.9	0	0	0	0	110.4	C236 R275 Q276 M281	C236-C279 WeakPolarHBondContact CA-SG 3.12Å; C236-C279 HydrophobicContact CB-CB 3.87Å; C236-C279 WeakPolarHBondContact CB-SG 3.47Å; C236-C279 WeakPolarHBondContact SG-CB 3.22Å; C236-C279 CovalentContact SG-SG 2.04Å; C236-C279 PolarHBondContact SG-SG 2.71Å; R275-C279 WeakPolarHBondContact O-CB 3.39Å; R275-C279 PolarHBondContact O-N 2.9Å; Q276-C279 CarbonylContact O-C 3.27Å; C279-M281 PolarHBondContact O-N 2.94Å
280	P	69.1	Low	57.4	Low	100 Å²	100	101.3 Å²	101.3	65%	0.649	54%	0.544	S	S	*	.			trans	-60.6	127.5	168.8	26.3	-33.2	0	0	0	109.3	L278 G282	L278-P280 VanDerWaalsContact C-CD 3.48Å; L278-P280 VanDerWaalsContact O-CD 3.32Å; L278-P280 WeakPolarHBondContact O-CD 3.31Å; P280-G282 PolarHBondContact O-N 3.05Å
281	M	54.2	Low	54.9	Low	177 Å²	177	109 Å²	109	87%	0.872	58%	0.582	S	S	*	*			trans	-65.6	97.5	-166.2	-82.6	-74.6	-173.1	0	0	113.8	C279	C279-M281 PolarHBondContact O-N 2.94Å
282	G	45.3	Very low	52.9	Low	64 Å²	64	109.6 Å²	109.6	66%	0.66	60%	0.595	S	S	*	*			trans	-110.9	92.5	167.2	0	0	0	0	0	111.8	P280	P280-G282 PolarHBondContact O-N 3.05Å
283	T	35.6	Very low	51.1	Low	145 Å²	145	112.8 Å²	112.8	89%	0.89	62%	0.621	S	S	*	*	S	Bend	trans	45.8	85	164.9	54.1	0	0	0	0	118.1
284	G	37.7	Very low	49	Very low	77 Å²	77	116.8 Å²	116.8	79%	0.794	66%	0.655	S	S	*	*			trans	68.2	88.9	131.5	0	0	0	0	0	119.9
285	S	33.4	Very low	47	Very low	104 Å²	104	122.2 Å²	122.2	73%	0.727	68%	0.678	S	S	*	*				-151.8	130.2	125.6	50.8	0	0	0	0	110	F287	S285-F287 PolarHBondContact O-N 3.17Å
286	E	37.7	Very low	45.4	Very low	186 Å²	186	120.6 Å²	120.6	87%	0.869	69%	0.687	S	S	*	*			trans	-81.9	111.6	174.3	-71.4	176	123.4	0	0	109.8
287	F	35.2	Very low	43.4	Very low	170 Å²	170	122.6 Å²	122.6	75%	0.746	70%	0.696	S	S	*	*			trans	-113.8	69.5	161.2	-91	-81	0	0	0	109.7	S285 I289	S285-F287 PolarHBondContact O-N 3.17Å; F287-I289 VanDerWaalsContact C-N 3.25Å; F287-I289 PolarHBondContact O-N 2.87Å
288	D	31.7	Very low	41.2	Very low	125 Å²	125	126.4 Å²	126.4	67%	0.668	72%	0.719	S	S	*	*			trans	-73.8	81.1	169.5	-108.6	16.3	0	0	0	109.4	K290	D288-K290 VanDerWaalsContact C-N 3.25Å; D288-K290 PolarHBondContact O-N 2.9Å
289	I	34.2	Very low	38.8	Very low	151 Å²	151	129 Å²	129	77%	0.774	75%	0.747	S	S	*	*			trans	-71.9	84.2	172.7	-56.3	179.4	0	0	0	108.6	F287 M291	F287-I289 VanDerWaalsContact C-N 3.25Å; F287-I289 PolarHBondContact O-N 2.87Å; I289-M291 PolarHBondContact O-N 2.91Å
290	K	31.2	Very low	36.4	Very low	195 Å²	195	137.5 Å²	137.5	85%	0.848	78%	0.784	S	S	*	*			trans	-86.9	103.6	176.2	-159.1	169.6	-170.3	170.3	0	109.6	D288	D288-K290 VanDerWaalsContact C-N 3.25Å; D288-K290 PolarHBondContact O-N 2.9Å
291	M	31.5	Very low	34.4	Very low	161 Å²	161	136.4 Å²	136.4	79%	0.793	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-67.9	130	-172.4	-160.8	165.5	73.8	0	0	112.2	I289	I289-M291 PolarHBondContact O-N 2.91Å
292	P	33.6	Very low	34.1	Very low	108 Å²	108	134 Å²	134	70%	0.701	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-78.1	152.2	178.7	-13.8	29.6	0	0	0	113.4
293	P	32.5	Very low	33.3	Very low	131 Å²	131	137.1 Å²	137.1	85%	0.851	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-71.3	160.2	163	32.7	-34.8	0	0	0	111.3
294	A	30.4	Very low	32.9	Very low	91 Å²	91	139.4 Å²	139.4	75%	0.752	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-97.6	137	-163.1	0	0	0	0	0	115.9
295	Q	34.3	Very low	32.3	Very low	188 Å²	188	144.2 Å²	144.2	88%	0.879	80%	0.802	S	S	*	*			trans	67.9	161.7	155.7	-66.8	-176.3	-5.9	0	0	119.4
296	P	41.5	Very low	31.8	Very low	114 Å²	114	145.7 Å²	145.7	74%	0.74	81%	0.807	S	S	*	*			cis	-126	171.7	-11.6	20.9	3.1	0	0	0	116
297	E	29.2	Very low	32.4	Very low	175 Å²	175	142.3 Å²	142.3	82%	0.818	80%	0.801	S	S	*	*			trans	16.1	122.9	157.6	-57.1	-173.4	158.2	0	0	122.8
298	N	28.5	Very low	31.9	Very low	159 Å²	159	140.4 Å²	140.4	85%	0.85	80%	0.803	S	S	*	*				-178.3	155.8	98.7	-114.9	-65.4	0	0	0	116.2
299	G	28.6	Very low	31.8	Very low	60 Å²	60	140.6 Å²	140.6	62%	0.619	81%	0.809	S	S	*	*			trans	75.5	103.1	137.1	0	0	0	0	0	123.6
300	Q	29	Very low	31.4	Very low	207 Å²	207	138.6 Å²	138.6	97%	0.967	82%	0.815	S	S	*	*			trans	60.6	137.1	135.2	-60.1	-180	-11.8	0	0	123.6
301	G	27.8	Very low	31.2	Very low	77 Å²	77	133.8 Å²	133.8	79%	0.794	81%	0.812	S	S	*	*			trans	113.6	121.9	137.7	0	0	0	0	0	118.9
302	P	47.4	Very low	32	Very low	127 Å²	127	131.1 Å²	131.1	83%	0.825	81%	0.806	S	S	*	*			trans	-119.1	161.2	-178	40.8	-31.9	0	0	0	116
303	S	28.6	Very low	31.8	Very low	129 Å²	129	135.6 Å²	135.6	90%	0.902	82%	0.815	S	S	*	*			trans	-168.9	172.3	147.1	40.2	0	0	0	0	114.9
304	K	26.8	Very low	31.6	Very low	193 Å²	193	134.6 Å²	134.6	84%	0.839	81%	0.811	S	S	*	*			trans	-77.5	178.6	-170.6	-62.5	168.5	179.4	173	0	111.8
305	M	25.5	Very low	32	Very low	178 Å²	178	135.4 Å²	135.4	88%	0.877	81%	0.808	S	S	*	*			cis	-173.1	-179.6	45.9	-158.3	144.7	156.6	0	0	112.9
306	T	23.1	Very low	31.8	Very low	135 Å²	135	135.7 Å²	135.7	83%	0.828	81%	0.807	S	S	*	*			trans	-123.5	-154.2	-167.5	57	0	0	0	0	113.9
307	P	51	Low	31.3	Very low	114 Å²	114	135.4 Å²	135.4	74%	0.74	80%	0.803	S	S	*	*				-132.6	175.8	-116.9	41	-20.1	0	0	0	118.1
308	T	24.6	Very low	31.3	Very low	130 Å²	130	132.8 Å²	132.8	80%	0.798	80%	0.799	S	S	*	*			trans	-168.6	131.8	163.2	33.2	0	0	0	0	109.4
309	T	28.3	Very low	31.3	Very low	130 Å²	130	129.7 Å²	129.7	80%	0.798	78%	0.783	S	S	*	*			cis	85.4	118.3	49	62.9	0	0	0	0	117.1
310	A	25.9	Very low	31.2	Very low	109 Å²	109	131.6 Å²	131.6	90%	0.901	79%	0.787	S	S	*	*			trans	161.2	168.8	139.3	0	0	0	0	0	115.3
311	A	28	Very low	31.4	Very low	94 Å²	94	126 Å²	126	78%	0.777	77%	0.77	S	S	*	*			trans	-149.8	-152	-180	0	0	0	0	0	108.7
312	P	47.6	Very low	31.5	Very low	105 Å²	105	130.5 Å²	130.5	68%	0.682	77%	0.768	S	S	*	*			cis	-145.9	-163.2	-3	39.1	-14.7	0	0	0	116.9
313	K	29.2	Very low	30.5	Very low	202 Å²	202	132.1 Å²	132.1	88%	0.878	76%	0.762	S	S	*	*			trans	102.6	159.1	150.5	-74.4	165.1	-175.9	177.2	0	122.4
314	S	29	Very low	30.4	Very low	109 Å²	109	135.8 Å²	135.8	76%	0.762	76%	0.758	S	S	*	*			trans	-137.5	177.6	-169.3	62	0	0	0	0	111.8
315	P	37.7	Very low	30.4	Very low	108 Å²	108	129.8 Å²	129.8	70%	0.701	75%	0.751	S	S	*	*				-164.5	152.7	90.3	40.4	-18.5	0	0	0	121.7
316	K	31.2	Very low	30.6	Very low	194 Å²	194	130 Å²	130	84%	0.843	76%	0.755	S	S	*	*			trans	64.5	165.5	147.5	-70.1	-174.4	173.4	-177	0	120
317	T	30.3	Very low	30.7	Very low	109 Å²	109	127.2 Å²	127.2	67%	0.669	75%	0.754	S	S	*	*			cis	-156.2	-162.6	-20.7	31.8	0	0	0	0	108.1
318	T	28.6	Very low	30	Very low	119 Å²	119	130 Å²	130	73%	0.73	76%	0.76	S	S	*	*			cis	-165.8	-179.1	21.2	-25.8	0	0	0	0	112.5
319	D	28.6	Very low	30.1	Very low	95 Å²	95	130.6 Å²	130.6	51%	0.508	76%	0.764	S	S	.	*			trans	-64.5	167.8	178	-84	-51.2	0	0	0	117.5	F725	D319-F725 VanDerWaalsContact OD1-CB 3.26Å; D319-F725 WeakPolarHBondContact OD1-CB 3.29Å; D319-F725 WeakPolarHBondContact OD1-CD2 3.21Å; D319-F725 WeakPolarHBondContact OD1-CG 3.42Å
320	S	27.6	Very low	30.2	Very low	100 Å²	100	129.2 Å²	129.2	70%	0.699	77%	0.765	S	S	*	*			cis	-177.3	-165.6	-14.5	63.7	0	0	0	0	109.4
321	S	32.7	Very low	30.4	Very low	88 Å²	88	127.7 Å²	127.7	62%	0.615	76%	0.761	S	S	*	*			cis	-166.4	177	1.2	58.1	0	0	0	0	112.4
322	K	30	Very low	30.4	Very low	173 Å²	173	131.3 Å²	131.3	75%	0.752	77%	0.766	S	S	*	*			trans	80.3	118.6	148.5	-76.4	179.9	-179.7	178.2	0	124.5
323	F	26.6	Very low	30.4	Very low	160 Å²	160	131.5 Å²	131.5	70%	0.702	77%	0.767	S	S	*	*			trans	60.2	155.7	138.4	-71.8	-62.1	0	0	0	121.2
324	Y	27.1	Very low	31.1	Very low	207 Å²	207	126.5 Å²	126.5	81%	0.812	76%	0.755	S	S	*	*			cis	-155.6	156.2	0.7	-131.6	-57.5	0	0	0	110.1
325	G	26.6	Very low	31.1	Very low	67 Å²	67	130.9 Å²	130.9	69%	0.691	76%	0.761	S	S	*	*			trans	112.4	138.7	139.6	0	0	0	0	0	119.5
326	N	28.1	Very low	30.7	Very low	181 Å²	181	129.5 Å²	129.5	97%	0.968	77%	0.766	S	S	*	*			trans	-97.7	155.9	170.8	-70.1	-12.6	0	0	0	111.2
327	G	26.3	Very low	30.9	Very low	78 Å²	78	129.9 Å²	129.9	80%	0.804	77%	0.768	S	S	*	*			trans	-173.2	127.8	165.5	0	0	0	0	0	114.3
328	I	35.4	Very low	30.9	Very low	171 Å²	171	131.9 Å²	131.9	88%	0.877	78%	0.775	S	S	*	*			trans	-109.4	120.1	172.9	-60	169.5	0	0	0	108.5
329	V	28	Very low	31.3	Very low	144 Å²	144	137.6 Å²	137.6	87%	0.873	78%	0.783	S	S	*	*			trans	-146.3	140.6	163.2	-176.8	0	0	0	0	108.8
330	A	30.7	Very low	31.4	Very low	100 Å²	100	139.8 Å²	139.8	83%	0.826	80%	0.795	S	S	*	*			trans	-96	142.5	172.8	0	0	0	0	0	111.2
331	G	28.5	Very low	31.8	Very low	78 Å²	78	142.6 Å²	142.6	80%	0.804	80%	0.8	S	S	*	*			trans	-164.3	144.9	179.2	0	0	0	0	0	114
332	L	29.3	Very low	31.8	Very low	169 Å²	169	143.6 Å²	143.6	89%	0.885	80%	0.802	S	S	*	*			trans	-150.4	160	178	-87.3	163.3	0	0	0	106.8
333	P	46.1	Very low	32	Very low	110 Å²	110	140.6 Å²	140.6	71%	0.714	80%	0.801	S	S	*	*			cis	-122.6	-139.5	-20.1	36.6	-15.1	0	0	0	107.3
334	P	45.2	Very low	32.2	Very low	96 Å²	96	144.1 Å²	144.1	62%	0.623	81%	0.809	S	S	*	*			cis	-136.8	-175.9	-13.1	29	-3.8	0	0	0	116.7
335	F	28.6	Very low	32.7	Very low	201 Å²	201	139.9 Å²	139.9	88%	0.882	81%	0.805	S	S	*	*			trans	70.6	104.5	163.3	-66.1	-67.1	0	0	0	120
336	G	29.4	Very low	33.3	Very low	79 Å²	79	141.5 Å²	141.5	81%	0.814	80%	0.803	S	S	*	*			trans	-159	113.7	154.5	0	0	0	0	0	108.9
337	K	35.4	Very low	34.1	Very low	202 Å²	202	140 Å²	140	88%	0.878	80%	0.795	S	S	*	*			trans	-84.9	127.9	179.4	-67.5	176.4	-176.8	172	0	109.8
338	N	30.6	Very low	35.5	Very low	151 Å²	151	140.5 Å²	140.5	81%	0.807	78%	0.777	S	S	*	*			trans	-150.7	154.7	133.7	-115.8	-9.4	0	0	0	111.7
339	R	35.9	Very low	36.7	Very low	240 Å²	240	137 Å²	137	91%	0.906	76%	0.759	S	S	*	*			trans	-110.5	85.7	179.6	-80.1	177.4	162.8	178.5	-6.2	109.2
340	D	32.3	Very low	38.8	Very low	141 Å²	141	131.7 Å²	131.7	75%	0.754	73%	0.728	S	S	*	*			trans	-81.7	119.6	164.9	-69.2	-58.4	0	0	0	109.3	V342	D340-V342 VanDerWaalsContact C-N 3.35Å; D340-V342 PolarHBondContact O-N 2.79Å
341	I	34.7	Very low	40.9	Very low	159 Å²	159	126.9 Å²	126.9	82%	0.815	69%	0.689	S	S	*	*			trans	-77.6	90.7	-178.7	-61.3	173.1	0	0	0	107.4	P343	I341-P343 VanDerWaalsContact O-CD 3.27Å; I341-P343 WeakPolarHBondContact O-CD 3.42Å
342	V	32.6	Very low	42.8	Very low	108 Å²	108	128 Å²	128	66%	0.655	68%	0.682	S	S	*	*			trans	-56.5	119.3	165.6	178.2	0	0	0	0	107.7	D340 R344	D340-V342 VanDerWaalsContact C-N 3.35Å; D340-V342 PolarHBondContact O-N 2.79Å; V342-R344 VanDerWaalsContact C-N 3.31Å; V342-R344 PolarHBondContact O-N 2.04Å
343	P	33.7	Very low	44.9	Very low	111 Å²	111	122.8 Å²	122.8	72%	0.721	66%	0.658	S	S	*	*			trans	-65.1	101.1	164.2	28.1	-31.1	0	0	0	106.1	I341 T345	I341-P343 VanDerWaalsContact O-CD 3.27Å; I341-P343 WeakPolarHBondContact O-CD 3.42Å; P343-T345 VanDerWaalsContact C-N 3.26Å; P343-T345 PolarHBondContact O-N 3.07Å
344	R	31.9	Very low	46.6	Very low	233 Å²	233	118.4 Å²	118.4	88%	0.879	63%	0.63	S	S	*	*			trans	-63.5	92.5	174.3	-79.4	-178	170.5	179.2	-3.9	108	V342	V342-R344 VanDerWaalsContact C-N 3.31Å; V342-R344 PolarHBondContact O-N 2.04Å
345	T	37.5	Very low	48.2	Very low	118 Å²	118	116.8 Å²	116.8	72%	0.724	62%	0.621	S	S	*	*			trans	-47.9	128.8	149.9	39.2	0	0	0	0	106.6	P343 L347	P343-T345 VanDerWaalsContact C-N 3.26Å; P343-T345 PolarHBondContact O-N 3.07Å; T345-L347 PolarHBondContact O-N 3.16Å; T345-L347 VanDerWaalsContact O-N 3.1Å
346	P	39.8	Very low	50.8	Low	102 Å²	102	108.7 Å²	108.7	66%	0.662	59%	0.589	S	S	*	*			trans	-58.3	124.7	178	24.2	-32.3	0	0	0	107.1	M348	P346-M348 PolarHBondContact O-N 3.42Å
347	L	43.6	Very low	52.7	Low	150 Å²	150	108.1 Å²	108.1	79%	0.785	56%	0.564	S	S	*	*			trans	-57	114.3	176.4	-74.2	167.6	0	0	0	106.9	T345 L349	T345-L347 PolarHBondContact O-N 3.16Å; T345-L347 VanDerWaalsContact O-N 3.1Å; L347-L349 HydrophobicContact CB-CD1 3.67Å; L347-L349 WeakPolarHBondContact O-CD1 3.04Å; L347-L349 PolarHBondContact O-N 3.06Å
348	M	55.4	Low	54.3	Low	88 Å²	88	101.8 Å²	101.8	43%	0.433	55%	0.549	S	S	.	.			trans	-74	82.1	-178.8	-74.1	-67.2	-68.9	0	0	108.4	P346 C350 V365	P346-M348 PolarHBondContact O-N 3.42Å; M348-C350 VanDerWaalsContact C-N 3.25Å; M348-C350 PolarHBondContact O-N 3.17Å; M348-V365 HydrophobicContact CE-CB 4.3Å; M348-V365 HydrophobicContact CE-CG1 3.74Å; M348-V365 HydrophobicContact CE-CG2 3.49Å; M348-V365 VanDerWaalsContact CE-CG2 3.49Å
349	L	61.2	Low	55.5	Low	96 Å²	96	98 Å²	98	50%	0.503	53%	0.526	S	S	.	.			trans	-65.7	87.8	175.2	-88	67.9	0	0	0	109	L347	L347-L349 HydrophobicContact CB-CD1 3.67Å; L347-L349 WeakPolarHBondContact O-CD1 3.04Å; L347-L349 PolarHBondContact O-N 3.06Å
350	C	72	Confident	56.1	Low	33 Å²	33	92.2 Å²	92.2	22%	0.223	52%	0.52	C	S	.	.	P	Polyproline II helix	trans	-78.6	137.4	166.4	-166.8	0	0	0	0	109.4	M348 P352 C354 S355 C356	M348-C350 VanDerWaalsContact C-N 3.25Å; M348-C350 PolarHBondContact O-N 3.17Å; C350-P352 VanDerWaalsContact O-CD 3.27Å; C350-P352 WeakPolarHBondContact O-CD 3.24Å; C350-C354 PolarHBondContact SG-O 3.46Å; C350-S355 VanDerWaalsContact SG-C 3.52Å; C350-C356 WeakPolarHBondContact CA-SG 3Å; C350-C356 HydrophobicContact CB-CB 3.6Å; C350-C356 WeakPolarHBondContact CB-SG 3.41Å; C350-C356 WeakPolarHBondContact SG-CB 3.41Å; C350-C356 PolarHBondContact SG-N 2.98Å; C350-C356 CovalentContact SG-SG 2.03Å; C350-C356 PolarHBondContact SG-SG 2.92Å
351	P	76.3	Confident	57	Low	0 Å²	0	89.8 Å²	89.8	0%	0	51%	0.514	C	S	.	.	P	Polyproline II helix	trans	-72.3	117.4	176.2	25.8	-29	0	0	0	109.8	C354 L380 N381 S382	P351-C354 HydrophobicContact CG-CB 4.41Å; P351-C354 WeakPolarHBondContact O-CA 3.28Å; P351-C354 WeakPolarHBondContact O-CB 3.22Å; P351-C354 PolarHBondContact O-N 3.26Å; P351-L380 HydrophobicContact CB-CB 4.05Å; P351-L380 HydrophobicContact CB-CD2 4.28Å; P351-L380 HydrophobicContact CG-CB 4.25Å; P351-L380 HydrophobicContact CG-CD2 4.21Å; P351-N381 WeakPolarHBondContact CA-O 3.44Å; P351-N381 WeakPolarHBondContact CB-O 3.3Å; P351-S382 VanDerWaalsContact CB-O 3.32Å; P351-S382 WeakPolarHBondContact CB-O 3.23Å; P351-S382 WeakPolarHBondContact CD-O 3.41Å; P351-S382 WeakPolarHBondContact CG-O 3.32Å
352	P	68.1	Low	58	Low	102 Å²	102	87.3 Å²	87.3	66%	0.662	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	134.1	165.6	28.8	-32.7	0	0	0	108.1	C350	C350-P352 VanDerWaalsContact O-CD 3.27Å; C350-P352 WeakPolarHBondContact O-CD 3.24Å
353	P	71.7	Confident	59.2	Low	59 Å²	59	90.7 Å²	90.7	38%	0.383	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	cis	-97.6	17.5	20.5	39	-38.7	0	0	0	116	R372 I374	P353-R372 HydrophobicContact CB-CB 4.21Å; P353-R372 HydrophobicContact CB-CG 4.34Å; P353-R372 HydrophobicContact CG-CB 3.66Å; P353-R372 HydrophobicContact CG-CG 4.15Å; P353-I374 HydrophobicContact CG-CD1 4.21Å; P353-I374 HydrophobicContact CG-CG1 4.13Å
354	C	82.2	Confident	60.9	Low	18 Å²	18	85.5 Å²	85.5	12%	0.122	48%	0.476	C	S	.	.			trans	-84.5	164.2	-174.3	-49.7	0	0	0	0	113.8	C350 P351 V367 S368 C369 L380	C350-C354 PolarHBondContact SG-O 3.46Å; P351-C354 HydrophobicContact CG-CB 4.41Å; P351-C354 WeakPolarHBondContact O-CA 3.28Å; P351-C354 WeakPolarHBondContact O-CB 3.22Å; P351-C354 PolarHBondContact O-N 3.26Å; C354-V367 HydrophobicContact CB-CG1 4.28Å; C354-S368 WeakPolarHBondContact CA-O 3.4Å; C354-S368 WeakPolarHBondContact CB-O 3.37Å; C354-C369 HydrophobicContact CB-CB 4.03Å; C354-C369 WeakPolarHBondContact CB-SG 3.42Å; C354-C369 WeakPolarHBondContact SG-CB 3.21Å; C354-C369 CovalentContact SG-SG 2.03Å; C354-C369 PolarHBondContact SG-SG 3Å; C354-L380 WeakPolarHBondContact SG-CD2 3.39Å
355	S	80.4	Confident	63.2	Low	61 Å²	61	74.7 Å²	74.7	43%	0.427	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	136.1	167.8	-175.7	0	0	0	0	109.7	C350 S368	C350-S355 VanDerWaalsContact SG-C 3.52Å; S355-S368 PolarHBondContact N-O 3.26Å; S355-S368 PolarHBondContact O-N 2.78Å
356	C	81.3	Confident	65.3	Low	31 Å²	31	69.8 Å²	69.8	21%	0.209	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	139.5	179.1	-57.4	0	0	0	0	110.6	C350 V365 S366	C350-C356 WeakPolarHBondContact CA-SG 3Å; C350-C356 HydrophobicContact CB-CB 3.6Å; C350-C356 WeakPolarHBondContact CB-SG 3.41Å; C350-C356 WeakPolarHBondContact SG-CB 3.41Å; C350-C356 PolarHBondContact SG-N 2.98Å; C350-C356 CovalentContact SG-SG 2.03Å; C350-C356 PolarHBondContact SG-SG 2.92Å; C356-V365 HydrophobicContact CB-CG1 4.05Å; C356-S366 CarbonylContact C-O 3.47Å; C356-S366 VanDerWaalsContact CA-O 3.29Å; C356-S366 WeakPolarHBondContact CA-O 3.26Å
357	K	70.6	Confident	67.6	Low	67 Å²	67	65 Å²	65	29%	0.291	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	133	177.9	-61.5	-176.8	-178	-177.2	0	110.5	R268 V365 S366	R268-K357 VanDerWaalsContact CD-NZ 3.27Å; R268-K357 VanDerWaalsContact NH1-NZ 3.13Å; K357-V365 CarbonylContact O-C 3.57Å; K357-V365 WeakPolarHBondContact O-CA 3.04Å; K357-S366 PolarHBondContact N-O 3.23Å; K357-S366 PolarHBondContact O-N 3Å
358	A	67.8	Low	69.5	Low	69 Å²	69	59.7 Å²	59.7	57%	0.57	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	132.5	165.7	0	0	0	0	0	109.5
359	H	56.2	Low	71	Confident	71 Å²	71	55.5 Å²	55.5	33%	0.329	33%	0.33	S	S	.	.			trans	-89.1	119.4	176.6	-160.8	-115.7	0	0	0	109.4	S361 D362 F363 G364	H359-S361 PolarHBondContact O-N 3.13Å; H359-S361 VanDerWaalsContact O-N 3.16Å; H359-D362 IonicContact CE1-OD2 3.55Å; H359-D362 PolarHBondContact CE1-OD2 3.16Å; H359-D362 IonicContact CG-OD2 3.23Å; H359-D362 IonicContact ND1-OD2 2.73Å; H359-D362 PolarHBondContact ND1-OD2 3.04Å; H359-D362 PolarHBondContact O-N 3.31Å; H359-F363 PolarHBondContact O-N 2.93Å; H359-G364 PolarHBondContact N-O 3.34Å
360	P	49.5	Very low	71.9	Confident	119 Å²	119	54.6 Å²	54.6	77%	0.773	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-27.6	-172.9	-26.5	35.5	0	0	0	114.8
361	S	51.5	Low	72.4	Confident	91 Å²	91	59.5 Å²	59.5	64%	0.636	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-32.1	-174	-43.4	0	0	0	0	114	H359	H359-S361 PolarHBondContact O-N 3.13Å; H359-S361 VanDerWaalsContact O-N 3.16Å
362	D	54.4	Low	72.7	Confident	106 Å²	106	66.1 Å²	66.1	57%	0.567	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.3	0.5	-162.9	-48.1	-73.2	0	0	0	113.8	H359 G364	H359-D362 IonicContact CE1-OD2 3.55Å; H359-D362 PolarHBondContact CE1-OD2 3.16Å; H359-D362 IonicContact CG-OD2 3.23Å; H359-D362 IonicContact ND1-OD2 2.73Å; H359-D362 PolarHBondContact ND1-OD2 3.04Å; H359-D362 PolarHBondContact O-N 3.31Å; D362-G364 PolarHBondContact O-N 3Å
363	F	58.9	Low	73.5	Confident	180 Å²	180	64.5 Å²	64.5	79%	0.789	36%	0.358	S	S	*	.	S	Bend	trans	54.9	12.2	-169.8	-61.4	-91.8	0	0	0	114.9	H359	H359-F363 PolarHBondContact O-N 2.93Å
364	G	68.4	Low	74.2	Confident	2 Å²	2	62 Å²	62	2%	0.021	34%	0.342	C	S	.	.			trans	-90.8	157.5	-177.4	0	0	0	0	0	113.6	H359 D362 N386	H359-G364 PolarHBondContact N-O 3.34Å; D362-G364 PolarHBondContact O-N 3Å; G364-N386 CarbonylContact C-O 3.54Å; G364-N386 WeakPolarHBondContact CA-O 3.2Å
365	V	80.7	Confident	74.3	Confident	5 Å²	5	69.4 Å²	69.4	3%	0.03	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	124.7	-178.3	-166	0	0	0	0	110.7	M348 C356 K357 V367 P384 P385 N386 A387 K388 K389	M348-V365 HydrophobicContact CE-CB 4.3Å; M348-V365 HydrophobicContact CE-CG1 3.74Å; M348-V365 HydrophobicContact CE-CG2 3.49Å; M348-V365 VanDerWaalsContact CE-CG2 3.49Å; C356-V365 HydrophobicContact CB-CG1 4.05Å; K357-V365 CarbonylContact O-C 3.57Å; K357-V365 WeakPolarHBondContact O-CA 3.04Å; V365-V367 HydrophobicContact CG1-CG2 4.24Å; V365-P384 HydrophobicContact CG1-CB 4.24Å; V365-P384 HydrophobicContact CG1-CG 4.16Å; V365-P385 VanDerWaalsContact CG2-O 3.28Å; V365-P385 WeakPolarHBondContact CG2-O 3.45Å; V365-N386 PolarHBondContact N-O 2.95Å; V365-A387 CarbonylContact O-C 3.6Å; V365-A387 WeakPolarHBondContact O-CA 3.39Å; V365-K388 PolarHBondContact O-N 2.94Å; V365-K389 PolarHBondContact O-N 3.45Å
366	S	82.5	Confident	74.4	Confident	16 Å²	16	70.8 Å²	70.8	11%	0.112	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	131.5	165.2	-173.4	0	0	0	0	109.3	C356 K357	C356-S366 CarbonylContact C-O 3.47Å; C356-S366 VanDerWaalsContact CA-O 3.29Å; C356-S366 WeakPolarHBondContact CA-O 3.26Å; K357-S366 PolarHBondContact N-O 3.23Å; K357-S366 PolarHBondContact O-N 3Å
367	V	86.2	Confident	74.4	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	114.2	-178.5	-176.8	0	0	0	0	108.9	C354 V365 P384 A387 K389 L390 H391	C354-V367 HydrophobicContact CB-CG1 4.28Å; V365-V367 HydrophobicContact CG1-CG2 4.24Å; V367-P384 HydrophobicContact CG2-CG 3.6Å; V367-A387 HydrophobicContact CG2-CB 4.48Å; V367-K389 PolarHBondContact N-O 3.28Å; V367-L390 HydrophobicContact CB-CD1 3.88Å; V367-L390 HydrophobicContact CG1-CD1 3.77Å; V367-L390 WeakPolarHBondContact O-CA 3.4Å; V367-H391 PolarHBondContact O-N 3.36Å
368	S	85.1	Confident	74.6	Confident	39 Å²	39	69.5 Å²	69.5	27%	0.273	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	111.1	-175.5	-68.9	0	0	0	0	111.2	C354 S355	C354-S368 WeakPolarHBondContact CA-O 3.4Å; C354-S368 WeakPolarHBondContact CB-O 3.37Å; S355-S368 PolarHBondContact N-O 3.26Å; S355-S368 PolarHBondContact O-N 2.78Å
369	C	85.4	Confident	74.7	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.363	C	S	.	.			trans	-119.8	20.9	-175.4	-58.9	0	0	0	0	112	C354 I374 H391 L392 N395	C354-C369 HydrophobicContact CB-CB 4.03Å; C354-C369 WeakPolarHBondContact CB-SG 3.42Å; C354-C369 WeakPolarHBondContact SG-CB 3.21Å; C354-C369 CovalentContact SG-SG 2.03Å; C354-C369 PolarHBondContact SG-SG 3Å; C369-I374 HydrophobicContact CB-CD1 3.76Å; C369-H391 CarbonylContact C-O 3.13Å; C369-H391 WeakPolarHBondContact CA-O 3.07Å; C369-H391 WeakPolarHBondContact CB-O 3.26Å; C369-H391 PolarHBondContact N-O 3.41Å; C369-L392 HydrophobicContact CB-CD2 3.43Å; C369-L392 VanDerWaalsContact CB-CD2 3.43Å; C369-L392 HydrophobicContact CB-CG 4.14Å; C369-N395 PolarHBondContact O-ND2 2.73Å
370	Q	81.4	Confident	75.6	Confident	77 Å²	77	66.3 Å²	66.3	36%	0.36	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	139.8	-171	-47.5	-167	38.9	0	0	112.1	R372 H391 S393	Q370-R372 WeakPolarHBondContact O-CG 3.48Å; Q370-R372 PolarHBondContact O-N 3.45Å; Q370-R372 VanDerWaalsContact O-N 3.08Å; Q370-R372 PolarHBondContact O-NE 3.07Å; Q370-H391 HydrophobicContact CG-CB 3.81Å; Q370-S393 CarbonylContact C-O 3.55Å; Q370-S393 VanDerWaalsContact CA-O 3.3Å; Q370-S393 WeakPolarHBondContact CA-O 3.17Å; Q370-S393 WeakPolarHBondContact CG-OG 3.19Å; Q370-S393 PolarHBondContact OE1-OG 3.45Å
371	E	81.9	Confident	76.3	Confident	137 Å²	137	65.9 Å²	65.9	64%	0.64	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	19	176.5	-57.5	-172.6	160.2	0	0	115.6	S373 S393 G394	E371-S373 PolarHBondContact O-N 3.35Å; E371-S393 PolarHBondContact N-O 2.93Å; E371-G394 WeakPolarHBondContact CA-O 3.48Å
372	R	83.1	Confident	77	Confident	139 Å²	139	64.3 Å²	64.3	53%	0.525	33%	0.329	S	S	.	.	S	Bend	trans	-83.1	13.7	-177.4	-57.4	-52.2	171.9	138.6	-8.7	114.8	P353 Q370 I374 N395	P353-R372 HydrophobicContact CB-CB 4.21Å; P353-R372 HydrophobicContact CB-CG 4.34Å; P353-R372 HydrophobicContact CG-CB 3.66Å; P353-R372 HydrophobicContact CG-CG 4.15Å; Q370-R372 WeakPolarHBondContact O-CG 3.48Å; Q370-R372 PolarHBondContact O-N 3.45Å; Q370-R372 VanDerWaalsContact O-N 3.08Å; Q370-R372 PolarHBondContact O-NE 3.07Å; R372-I374 HydrophobicContact CB-CD1 3.99Å; R372-I374 HydrophobicContact CB-CG1 3.99Å; R372-I374 PolarHBondContact O-N 2.95Å; R372-I374 VanDerWaalsContact O-N 3.15Å; R372-N395 PolarHBondContact N-OD1 3.15Å; R372-N395 VanDerWaalsContact N-OD1 3.09Å
373	S	84.9	Confident	77.9	Confident	67 Å²	67	62.6 Å²	62.6	47%	0.469	32%	0.317	S	S	.	.			trans	55.7	24.4	-178.9	-61.5	0	0	0	0	114.8	E371 N395	E371-S373 PolarHBondContact O-N 3.35Å; S373-N395 PolarHBondContact N-OD1 3.42Å
374	I	85.1	Confident	78.4	Confident	8 Å²	8	54.1 Å²	54.1	4%	0.041	28%	0.28	C	S	.	.			trans	-62.1	142.5	-179	-64.3	163.4	0	0	0	109.8	P353 C369 R372 N376 L380 L392 N395 Y396 I397	P353-I374 HydrophobicContact CG-CD1 4.21Å; P353-I374 HydrophobicContact CG-CG1 4.13Å; C369-I374 HydrophobicContact CB-CD1 3.76Å; R372-I374 HydrophobicContact CB-CD1 3.99Å; R372-I374 HydrophobicContact CB-CG1 3.99Å; R372-I374 PolarHBondContact O-N 2.95Å; R372-I374 VanDerWaalsContact O-N 3.15Å; I374-N376 WeakPolarHBondContact CG2-O 3.35Å; I374-L380 HydrophobicContact CD1-CD2 4.18Å; I374-L392 HydrophobicContact CD1-CD2 3.99Å; I374-N395 HydrophobicContact CB-CB 4.23Å; I374-N395 WeakPolarHBondContact CB-OD1 3.48Å; I374-N395 PolarHBondContact N-OD1 3.21Å; I374-Y396 CarbonylContact O-C 3.57Å; I374-Y396 WeakPolarHBondContact O-CA 3.16Å; I374-Y396 PolarHBondContact O-N 2.9Å; I374-I397 HydrophobicContact CG2-CG1 4.34Å
375	R	85.1	Confident	78.3	Confident	173 Å²	173	58.1 Å²	58.1	65%	0.653	31%	0.306	S	S	*	.			trans	-114.8	-36.7	-179.6	-65.7	-177.3	-177.4	-175.7	1.5	113	I397	R375-I397 WeakPolarHBondContact O-CA 3.43Å
376	N	82.5	Confident	78.1	Confident	89 Å²	89	63.3 Å²	63.3	48%	0.476	33%	0.333	S	S	.	.			trans	-125.8	142.6	176.1	-35.8	-75.8	0	0	0	109.5	I374 A378 D379	I374-N376 WeakPolarHBondContact CG2-O 3.35Å; N376-A378 HydrophobicContact CB-CB 4.29Å; N376-A378 PolarHBondContact O-N 2.84Å; N376-D379 PolarHBondContact N-OD2 3.33Å; N376-D379 PolarHBondContact ND2-OD1 3.42Å; N376-D379 PolarHBondContact ND2-OD2 3.22Å; N376-D379 VanDerWaalsContact O-CB 3.25Å; N376-D379 WeakPolarHBondContact O-CB 3.32Å; N376-D379 PolarHBondContact O-N 3.28Å; N376-D379 VanDerWaalsContact O-N 3.1Å; N376-D379 VanDerWaalsContact O-OD2 3.09Å
377	L	81	Confident	78	Confident	3 Å²	3	62.7 Å²	62.7	2%	0.016	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-69.5	-23.5	171	-87.6	71.2	0	0	0	111.8	D379 L380 L392 I397 I400 D404 F405	L377-D379 PolarHBondContact O-N 3.17Å; L377-D379 VanDerWaalsContact O-N 3.13Å; L377-L380 HydrophobicContact CB-CD1 4.33Å; L377-L380 HydrophobicContact CG-CD1 4.13Å; L377-L380 WeakPolarHBondContact O-CB 3.42Å; L377-L380 WeakPolarHBondContact O-CG 3.34Å; L377-L380 PolarHBondContact O-N 3.05Å; L377-L392 HydrophobicContact CD1-CD1 4.29Å; L377-L392 HydrophobicContact CD2-CD1 3.85Å; L377-L392 HydrophobicContact CG-CD1 3.98Å; L377-I397 HydrophobicContact CD1-CB 4.39Å; L377-I397 HydrophobicContact CD1-CD1 3.52Å; L377-I397 HydrophobicContact CD1-CG1 3.84Å; L377-I397 HydrophobicContact CD1-CG2 3.64Å; L377-I400 HydrophobicContact CD1-CG2 4.27Å; L377-D404 HydrophobicContact CB-CB 3.56Å; L377-D404 VanDerWaalsContact CB-OD1 3.3Å; L377-D404 WeakPolarHBondContact CB-OD1 3.08Å; L377-D404 HydrophobicContact CD2-CB 3.92Å; L377-D404 HydrophobicContact CG-CB 4.38Å; L377-F405 HydrophobicContact CD2-CD1 4.28Å; L377-F405 HydrophobicContact CD2-CE1 3.43Å; L377-F405 VanDerWaalsContact CD2-CE1 3.43Å; L377-F405 HydrophobicContact CD2-CE2 4.05Å; L377-F405 HydrophobicContact CD2-CZ 3.29Å
378	A	75.3	Confident	77.9	Confident	68 Å²	68	66.2 Å²	66.2	56%	0.562	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-56.6	-19.8	167.4	0	0	0	0	0	114.2	N376 L380 N381 D404	N376-A378 HydrophobicContact CB-CB 4.29Å; N376-A378 PolarHBondContact O-N 2.84Å; A378-L380 PolarHBondContact O-N 3.21Å; A378-N381 PolarHBondContact O-ND2 3.35Å; A378-D404 PolarHBondContact N-OD1 3.32Å
379	D	70.4	Confident	77.9	Confident	67 Å²	67	67.2 Å²	67.2	36%	0.358	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-68.8	-20.7	174.6	-53.2	-28.4	0	0	0	111.3	N376 L377 N381	N376-D379 PolarHBondContact N-OD2 3.33Å; N376-D379 PolarHBondContact ND2-OD1 3.42Å; N376-D379 PolarHBondContact ND2-OD2 3.22Å; N376-D379 VanDerWaalsContact O-CB 3.25Å; N376-D379 WeakPolarHBondContact O-CB 3.32Å; N376-D379 PolarHBondContact O-N 3.28Å; N376-D379 VanDerWaalsContact O-N 3.1Å; N376-D379 VanDerWaalsContact O-OD2 3.09Å; L377-D379 PolarHBondContact O-N 3.17Å; L377-D379 VanDerWaalsContact O-N 3.13Å; D379-N381 VanDerWaalsContact C-N 3.25Å; D379-N381 PolarHBondContact O-N 2.81Å; D379-N381 PolarHBondContact O-ND2 3.37Å
380	L	74.3	Confident	78	Confident	6 Å²	6	67.2 Å²	67.2	3%	0.031	34%	0.343	C	S	.	.			trans	-74.5	67.3	-179.6	-58.2	173.3	0	0	0	112.6	P351 C354 I374 L377 A378 S382 L392	P351-L380 HydrophobicContact CB-CB 4.05Å; P351-L380 HydrophobicContact CB-CD2 4.28Å; P351-L380 HydrophobicContact CG-CB 4.25Å; P351-L380 HydrophobicContact CG-CD2 4.21Å; C354-L380 WeakPolarHBondContact SG-CD2 3.39Å; I374-L380 HydrophobicContact CD1-CD2 4.18Å; L377-L380 HydrophobicContact CB-CD1 4.33Å; L377-L380 HydrophobicContact CG-CD1 4.13Å; L377-L380 WeakPolarHBondContact O-CB 3.42Å; L377-L380 WeakPolarHBondContact O-CG 3.34Å; L377-L380 PolarHBondContact O-N 3.05Å; A378-L380 PolarHBondContact O-N 3.21Å; L380-S382 PolarHBondContact O-N 3.25Å; L380-L392 HydrophobicContact CD1-CD1 4.44Å; L380-L392 HydrophobicContact CD1-CD2 4.22Å
381	N	63.8	Low	78.2	Confident	111 Å²	111	65 Å²	65	59%	0.594	33%	0.333	S	S	*	.			trans	-72.7	122.3	-177.8	-76.4	-86.7	0	0	0	111.6	P351 A378 D379	P351-N381 WeakPolarHBondContact CA-O 3.44Å; P351-N381 WeakPolarHBondContact CB-O 3.3Å; A378-N381 PolarHBondContact O-ND2 3.35Å; D379-N381 VanDerWaalsContact C-N 3.25Å; D379-N381 PolarHBondContact O-N 2.81Å; D379-N381 PolarHBondContact O-ND2 3.37Å
382	S	66	Low	78.5	Confident	57 Å²	57	58.4 Å²	58.4	40%	0.399	30%	0.302	S	S	.	.	S	Bend	trans	78.3	112.1	-164.7	-33.8	0	0	0	0	113.6	P351 L380	P351-S382 VanDerWaalsContact CB-O 3.32Å; P351-S382 WeakPolarHBondContact CB-O 3.23Å; P351-S382 WeakPolarHBondContact CD-O 3.41Å; P351-S382 WeakPolarHBondContact CG-O 3.32Å; L380-S382 PolarHBondContact O-N 3.25Å
383	K	73.2	Confident	78.8	Confident	71 Å²	71	52.5 Å²	52.5	31%	0.309	28%	0.282	S	S	.	.			trans	-105	121.2	177.4	-56.2	178.6	-173.8	-171.4	0	108	T403 D404 Q406 F408	K383-T403 PolarHBondContact NZ-O 3.13Å; K383-D404 PolarHBondContact NZ-O 3.4Å; K383-Q406 WeakPolarHBondContact CD-O 3.42Å; K383-Q406 WeakPolarHBondContact CE-O 3.44Å; K383-Q406 PolarHBondContact NZ-O 3.21Å; K383-F408 HydrophobicContact CB-CE2 4.06Å; K383-F408 HydrophobicContact CB-CZ 4.09Å; K383-F408 HydrophobicContact CD-CD2 3.92Å; K383-F408 HydrophobicContact CD-CE2 3.59Å; K383-F408 HydrophobicContact CD-CZ 4.44Å; K383-F408 HydrophobicContact CG-CD2 4.45Å; K383-F408 HydrophobicContact CG-CE2 3.7Å; K383-F408 HydrophobicContact CG-CZ 4.1Å
384	P	70.8	Confident	78.6	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.006	27%	0.272	C	S	.	.			trans	-71.9	136.9	-172.6	26.9	-33	0	0	0	111.1	V365 V367 A387	V365-P384 HydrophobicContact CG1-CB 4.24Å; V365-P384 HydrophobicContact CG1-CG 4.16Å; V367-P384 HydrophobicContact CG2-CG 3.6Å; P384-A387 PolarHBondContact O-N 3.38Å
385	P	66.4	Low	78.8	Confident	87 Å²	87	50.3 Å²	50.3	57%	0.565	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	145.9	175.3	27.1	-34.3	0	0	0	110.5	V365 A387	V365-P385 VanDerWaalsContact CG2-O 3.28Å; V365-P385 WeakPolarHBondContact CG2-O 3.45Å; P385-A387 VanDerWaalsContact C-N 3.33Å; P385-A387 PolarHBondContact O-N 3.14Å
386	N	74.9	Confident	79.1	Confident	114 Å²	114	47.3 Å²	47.3	61%	0.61	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	30.7	-177.8	-56.2	-14.9	0	0	0	115.3	G364 V365 K388	G364-N386 CarbonylContact C-O 3.54Å; G364-N386 WeakPolarHBondContact CA-O 3.2Å; V365-N386 PolarHBondContact N-O 2.95Å; N386-K388 PolarHBondContact O-N 3.23Å
387	A	80.3	Confident	79.5	Confident	2 Å²	2	43.1 Å²	43.1	2%	0.017	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.3	126.5	167.4	0	0	0	0	0	112	V365 V367 P384 P385 F408 G410 L411	V365-A387 CarbonylContact O-C 3.6Å; V365-A387 WeakPolarHBondContact O-CA 3.39Å; V367-A387 HydrophobicContact CG2-CB 4.48Å; P384-A387 PolarHBondContact O-N 3.38Å; P385-A387 VanDerWaalsContact C-N 3.33Å; P385-A387 PolarHBondContact O-N 3.14Å; A387-F408 HydrophobicContact CB-CD1 3.52Å; A387-F408 HydrophobicContact CB-CE1 3.73Å; A387-G410 CarbonylContact O-C 3.52Å; A387-L411 HydrophobicContact CB-CD2 4.27Å; A387-L411 PolarHBondContact O-N 2.95Å
388	K	84.3	Confident	79.9	Confident	74 Å²	74	50 Å²	50	32%	0.322	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	-32	-178.1	-84.2	-74.3	164.2	-161.8	0	113.7	V365 N386 G410 L411 D412 L413	V365-K388 PolarHBondContact O-N 2.94Å; N386-K388 PolarHBondContact O-N 3.23Å; K388-G410 VanDerWaalsContact CD-O 3.29Å; K388-G410 WeakPolarHBondContact CD-O 3.37Å; K388-G410 WeakPolarHBondContact CE-O 3.42Å; K388-G410 PolarHBondContact NZ-O 2.76Å; K388-L411 VanDerWaalsContact C-CD2 3.46Å; K388-D412 HydrophobicContact CD-CB 4.39Å; K388-D412 PolarHBondContact O-N 3.2Å; K388-L413 PolarHBondContact O-N 2.96Å
389	K	85.1	Confident	80.5	Confident	60 Å²	60	51 Å²	51	26%	0.261	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	138.6	173.3	-53.1	-174.9	-176.5	-175.3	0	109.7	E272 V365 V367 L413	E272-K389 IonicContact OE1-NZ 3.63Å; E272-K389 PolarHBondContact OE1-NZ 3.08Å; V365-K389 PolarHBondContact O-N 3.45Å; V367-K389 PolarHBondContact N-O 3.28Å; K389-L413 WeakPolarHBondContact CA-O 3.43Å; K389-L413 HydrophobicContact CB-CB 4.48Å; K389-L413 HydrophobicContact CG-CB 4.29Å
390	L	88.5	Confident	81.5	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	113.1	174.9	177.1	57.2	0	0	0	110.1	V367 L392 F405 F408 L411 L413 L414 H415	V367-L390 HydrophobicContact CB-CD1 3.88Å; V367-L390 HydrophobicContact CG1-CD1 3.77Å; V367-L390 WeakPolarHBondContact O-CA 3.4Å; L390-L392 HydrophobicContact CD1-CD1 4.02Å; L390-L392 HydrophobicContact CD1-CG 4.09Å; L390-L392 HydrophobicContact CD2-CD1 3.88Å; L390-L392 HydrophobicContact CG-CD1 3.81Å; L390-L392 HydrophobicContact CG-CG 4.23Å; L390-F405 HydrophobicContact CD2-CE1 4.24Å; L390-F408 HydrophobicContact CD2-CD1 4.14Å; L390-F408 HydrophobicContact CD2-CD2 4.41Å; L390-F408 HydrophobicContact CD2-CE1 4.04Å; L390-F408 HydrophobicContact CD2-CE2 4.28Å; L390-F408 HydrophobicContact CD2-CG 4.35Å; L390-F408 HydrophobicContact CD2-CZ 4.1Å; L390-L411 HydrophobicContact CB-CD1 3.89Å; L390-L411 HydrophobicContact CB-CD2 3.82Å; L390-L411 HydrophobicContact CD2-CD1 4.17Å; L390-L413 PolarHBondContact N-O 3.07Å; L390-L414 HydrophobicContact CB-CD1 4.09Å; L390-L414 HydrophobicContact CD2-CD1 3.91Å; L390-L414 HydrophobicContact CG-CD1 3.99Å; L390-H415 PolarHBondContact O-N 3.44Å
391	H	86.1	Confident	82.2	Confident	30 Å²	30	48.5 Å²	48.5	14%	0.139	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	111.9	-178.8	-58.2	-104.7	0	0	0	110.6	V367 C369 Q370	V367-H391 PolarHBondContact O-N 3.36Å; C369-H391 CarbonylContact C-O 3.13Å; C369-H391 WeakPolarHBondContact CA-O 3.07Å; C369-H391 WeakPolarHBondContact CB-O 3.26Å; C369-H391 PolarHBondContact N-O 3.41Å; Q370-H391 HydrophobicContact CG-CB 3.81Å
392	L	87.6	Confident	83.2	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.238	C	C	.	.			trans	-121.8	22.1	-176.4	-79.5	161.1	0	0	0	112.1	C369 I374 L377 L380 L390 N395 I397 H415 L416 N419	C369-L392 HydrophobicContact CB-CD2 3.43Å; C369-L392 VanDerWaalsContact CB-CD2 3.43Å; C369-L392 HydrophobicContact CB-CG 4.14Å; I374-L392 HydrophobicContact CD1-CD2 3.99Å; L377-L392 HydrophobicContact CD1-CD1 4.29Å; L377-L392 HydrophobicContact CD2-CD1 3.85Å; L377-L392 HydrophobicContact CG-CD1 3.98Å; L380-L392 HydrophobicContact CD1-CD1 4.44Å; L380-L392 HydrophobicContact CD1-CD2 4.22Å; L390-L392 HydrophobicContact CD1-CD1 4.02Å; L390-L392 HydrophobicContact CD1-CG 4.09Å; L390-L392 HydrophobicContact CD2-CD1 3.88Å; L390-L392 HydrophobicContact CG-CD1 3.81Å; L390-L392 HydrophobicContact CG-CG 4.23Å; L392-N395 PolarHBondContact O-ND2 3.17Å; L392-I397 HydrophobicContact CB-CD1 4.18Å; L392-I397 HydrophobicContact CD2-CD1 4.24Å; L392-H415 CarbonylContact C-O 3.54Å; L392-H415 WeakPolarHBondContact CA-O 3.19Å; L392-H415 PolarHBondContact N-O 3.39Å; L392-L416 HydrophobicContact CB-CD2 3.96Å; L392-L416 HydrophobicContact CD1-CD2 3.84Å; L392-N419 PolarHBondContact O-ND2 2.87Å
393	S	88.3	Confident	84	Confident	14 Å²	14	47.6 Å²	47.6	10%	0.098	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	148.5	179.7	8.4	0	0	0	0	113.9	Q370 E371 N395 H415 G417	Q370-S393 CarbonylContact C-O 3.55Å; Q370-S393 VanDerWaalsContact CA-O 3.3Å; Q370-S393 WeakPolarHBondContact CA-O 3.17Å; Q370-S393 WeakPolarHBondContact CG-OG 3.19Å; Q370-S393 PolarHBondContact OE1-OG 3.45Å; E371-S393 PolarHBondContact N-O 2.93Å; S393-N395 VanDerWaalsContact C-N 3.32Å; S393-N395 PolarHBondContact O-N 3.1Å; S393-N395 PolarHBondContact O-ND2 2.04Å; S393-H415 PolarHBondContact OG-ND1 3.09Å; S393-G417 VanDerWaalsContact CA-O 3.27Å; S393-G417 WeakPolarHBondContact CA-O 3.07Å
394	G	81.1	Confident	84.6	Confident	25 Å²	25	44.9 Å²	44.9	26%	0.258	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.4	26.5	169.7	0	0	0	0	0	114.4	E371 G417 S418	E371-G394 WeakPolarHBondContact CA-O 3.48Å; G394-G417 PolarHBondContact N-O 3.04Å; G394-S418 WeakPolarHBondContact CA-O 3.23Å; G394-S418 PolarHBondContact N-O 2.91Å
395	N	89.9	Confident	85.4	Confident	4 Å²	4	45 Å²	45	2%	0.021	24%	0.235	C	C	.	.	S	Bend	trans	-105.3	-172.6	179.5	-75.3	-70.5	0	0	0	110.9	C369 R372 S373 I374 L392 S393 I397 S418 N419	C369-N395 PolarHBondContact O-ND2 2.73Å; R372-N395 PolarHBondContact N-OD1 3.15Å; R372-N395 VanDerWaalsContact N-OD1 3.09Å; S373-N395 PolarHBondContact N-OD1 3.42Å; I374-N395 HydrophobicContact CB-CB 4.23Å; I374-N395 WeakPolarHBondContact CB-OD1 3.48Å; I374-N395 PolarHBondContact N-OD1 3.21Å; L392-N395 PolarHBondContact O-ND2 3.17Å; S393-N395 VanDerWaalsContact C-N 3.32Å; S393-N395 PolarHBondContact O-N 3.1Å; S393-N395 PolarHBondContact O-ND2 2.04Å; N395-I397 HydrophobicContact CB-CD1 4.03Å; N395-I397 HydrophobicContact CB-CG1 4.22Å; N395-S418 PolarHBondContact N-O 3.22Å; N395-N419 WeakPolarHBondContact CA-OD1 3.1Å; N395-N419 WeakPolarHBondContact CB-OD1 3.32Å; N395-N419 PolarHBondContact O-OD1 3.16Å; N395-N419 VanDerWaalsContact O-OD1 3.14Å
396	Y	91.1	Very high	86.2	Confident	111 Å²	111	46.8 Å²	46.8	44%	0.435	24%	0.235	S	C	.	.			trans	-116.5	32.6	-177.6	-55.8	-52.5	0	0	0	112.2	I374 N419	I374-Y396 CarbonylContact O-C 3.57Å; I374-Y396 WeakPolarHBondContact O-CA 3.16Å; I374-Y396 PolarHBondContact O-N 2.9Å; Y396-N419 PolarHBondContact N-OD1 2.96Å
397	I	91.3	Very high	86.3	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.229	C	C	.	.			trans	-70.6	135.7	178.7	-57.8	154.5	0	0	0	109.3	I374 R375 L377 L392 N395 I400 L416 N419 Q420 I421	I374-I397 HydrophobicContact CG2-CG1 4.34Å; R375-I397 WeakPolarHBondContact O-CA 3.43Å; L377-I397 HydrophobicContact CD1-CB 4.39Å; L377-I397 HydrophobicContact CD1-CD1 3.52Å; L377-I397 HydrophobicContact CD1-CG1 3.84Å; L377-I397 HydrophobicContact CD1-CG2 3.64Å; L392-I397 HydrophobicContact CB-CD1 4.18Å; L392-I397 HydrophobicContact CD2-CD1 4.24Å; N395-I397 HydrophobicContact CB-CD1 4.03Å; N395-I397 HydrophobicContact CB-CG1 4.22Å; I397-I400 HydrophobicContact CG2-CG2 3.86Å; I397-L416 HydrophobicContact CD1-CD2 4.47Å; I397-N419 WeakPolarHBondContact CB-OD1 3.49Å; I397-N419 WeakPolarHBondContact CD1-OD1 3.43Å; I397-N419 WeakPolarHBondContact CG1-OD1 3.34Å; I397-N419 PolarHBondContact N-OD1 2.97Å; I397-N419 VanDerWaalsContact N-OD1 3.14Å; I397-Q420 CarbonylContact O-C 3.08Å; I397-Q420 VanDerWaalsContact O-CA 3.23Å; I397-Q420 WeakPolarHBondContact O-CA 3.49Å; I397-Q420 WeakPolarHBondContact O-CB 3.5Å; I397-Q420 PolarHBondContact O-N 3.13Å; I397-I421 HydrophobicContact CB-CG1 4.34Å; I397-I421 HydrophobicContact CG2-CD1 4.29Å; I397-I421 HydrophobicContact CG2-CG1 4.06Å; I397-I421 PolarHBondContact O-N 2.72Å; I397-I421 VanDerWaalsContact O-N 3.14Å
398	R	89.5	Confident	86.5	Confident	147 Å²	147	43.5 Å²	43.5	56%	0.555	23%	0.229	S	C	*	.			trans	-119.7	-38.2	-174.9	-72.3	178.9	177	-174.9	-4.6	115.3	Q420 I421 A422	R398-Q420 WeakPolarHBondContact CA-O 3.33Å; R398-Q420 HydrophobicContact CG-CB 3.73Å; R398-I421 VanDerWaalsContact O-CA 3.31Å; R398-I421 WeakPolarHBondContact O-CA 3.3Å; R398-A422 PolarHBondContact O-N 3.19Å
399	D	87.9	Confident	86.6	Confident	91 Å²	91	44.3 Å²	44.3	49%	0.487	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	140.6	-176.2	-57.5	-81.6	0	0	0	107.2
400	I	91.1	Very high	86.6	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	136	174.4	55.4	176.9	0	0	0	110.6	L377 I397 F405 L416 I421 V423 V424 Q425 V428 F429	L377-I400 HydrophobicContact CD1-CG2 4.27Å; I397-I400 HydrophobicContact CG2-CG2 3.86Å; I400-F405 HydrophobicContact CB-CE2 4.31Å; I400-F405 HydrophobicContact CD1-CE2 4.39Å; I400-L416 HydrophobicContact CD1-CD1 4.2Å; I400-I421 HydrophobicContact CG1-CG2 4.44Å; I400-I421 HydrophobicContact CG2-CD1 4.32Å; I400-V423 PolarHBondContact N-O 3.45Å; I400-V424 HydrophobicContact CD1-CB 4.42Å; I400-V424 HydrophobicContact CD1-CG1 3.99Å; I400-V424 HydrophobicContact CD1-CG2 3.96Å; I400-V424 HydrophobicContact CG1-CB 4.33Å; I400-V424 HydrophobicContact CG1-CG1 4.11Å; I400-V424 HydrophobicContact CG1-CG2 4.18Å; I400-Q425 WeakPolarHBondContact O-CB 3.04Å; I400-Q425 WeakPolarHBondContact O-CG 3.48Å; I400-Q425 PolarHBondContact O-N 3.47Å; I400-V428 HydrophobicContact CB-CG1 4.15Å; I400-V428 HydrophobicContact CD1-CG1 3.92Å; I400-V428 HydrophobicContact CG1-CG1 3.95Å; I400-V428 HydrophobicContact CG1-CG2 4.48Å; I400-V428 WeakPolarHBondContact O-CG2 3.27Å; I400-F429 HydrophobicContact CD1-CE1 4.11Å; I400-F429 HydrophobicContact CD1-CZ 3.79Å
401	S	88.3	Confident	86.6	Confident	19 Å²	19	42.5 Å²	42.5	13%	0.133	23%	0.232	C	C	.	.			trans	-120.6	157	-172.4	74.4	0	0	0	0	112.1	T403 D404	S401-T403 PolarHBondContact O-N 3.16Å; S401-T403 PolarHBondContact OG-OG1 2.9Å; S401-D404 WeakPolarHBondContact CA-OD2 3.41Å; S401-D404 WeakPolarHBondContact CB-OD2 3.38Å; S401-D404 PolarHBondContact N-OD2 3.4Å; S401-D404 WeakPolarHBondContact O-CB 3.4Å; S401-D404 PolarHBondContact O-N 3.31Å; S401-D404 VanDerWaalsContact OG-CG 3.24Å; S401-D404 PolarHBondContact OG-OD2 3.18Å
402	P	85.1	Confident	86.6	Confident	59 Å²	59	43.1 Å²	43.1	38%	0.383	24%	0.237	S	C	.	.	H	α-helix	trans	-59.8	-27.5	178.2	-25.3	35.9	0	0	0	114.3	D404 K426 V428	P402-D404 VanDerWaalsContact C-N 3.31Å; P402-D404 PolarHBondContact O-N 3.28Å; P402-K426 WeakPolarHBondContact CG-O 3.27Å; P402-V428 HydrophobicContact CG-CG2 4.32Å
403	T	84.2	Confident	86.7	Confident	91 Å²	91	43.7 Å²	43.7	56%	0.558	24%	0.24	S	C	*	.	H	α-helix	trans	-69.6	-24.2	175.9	30.7	0	0	0	0	113.9	K383 S401	K383-T403 PolarHBondContact NZ-O 3.13Å; S401-T403 PolarHBondContact O-N 3.16Å; S401-T403 PolarHBondContact OG-OG1 2.9Å
404	D	85.1	Confident	86.9	Confident	14 Å²	14	43 Å²	43	8%	0.075	24%	0.235	C	C	.	.	H	α-helix	trans	-67.5	-40.1	-179	-68.5	-53.6	0	0	0	111.9	L377 A378 K383 S401 P402	L377-D404 HydrophobicContact CB-CB 3.56Å; L377-D404 VanDerWaalsContact CB-OD1 3.3Å; L377-D404 WeakPolarHBondContact CB-OD1 3.08Å; L377-D404 HydrophobicContact CD2-CB 3.92Å; L377-D404 HydrophobicContact CG-CB 4.38Å; A378-D404 PolarHBondContact N-OD1 3.32Å; K383-D404 PolarHBondContact NZ-O 3.4Å; S401-D404 WeakPolarHBondContact CA-OD2 3.41Å; S401-D404 WeakPolarHBondContact CB-OD2 3.38Å; S401-D404 PolarHBondContact N-OD2 3.4Å; S401-D404 WeakPolarHBondContact O-CB 3.4Å; S401-D404 PolarHBondContact O-N 3.31Å; S401-D404 VanDerWaalsContact OG-CG 3.24Å; S401-D404 PolarHBondContact OG-OD2 3.18Å; P402-D404 VanDerWaalsContact C-N 3.31Å; P402-D404 PolarHBondContact O-N 3.28Å
405	F	86.8	Confident	87.3	Confident	4 Å²	4	43.6 Å²	43.6	2%	0.018	23%	0.231	C	C	.	.	H	α-helix	trans	-94	-1.6	-179.8	-60.2	-70.3	0	0	0	114.5	L377 L390 I400 G407 F408 L414 L416 V428 F429 L432	L377-F405 HydrophobicContact CD2-CD1 4.28Å; L377-F405 HydrophobicContact CD2-CE1 3.43Å; L377-F405 VanDerWaalsContact CD2-CE1 3.43Å; L377-F405 HydrophobicContact CD2-CE2 4.05Å; L377-F405 HydrophobicContact CD2-CZ 3.29Å; L390-F405 HydrophobicContact CD2-CE1 4.24Å; I400-F405 HydrophobicContact CB-CE2 4.31Å; I400-F405 HydrophobicContact CD1-CE2 4.39Å; F405-G407 PolarHBondContact O-N 2.95Å; F405-G407 VanDerWaalsContact O-N 3.16Å; F405-F408 WeakPolarHBondContact O-CB 3.27Å; F405-F408 PolarHBondContact O-N 3.13Å; F405-L414 HydrophobicContact CD1-CD2 4.2Å; F405-L414 HydrophobicContact CE1-CD1 3.81Å; F405-L414 HydrophobicContact CE1-CD2 3.66Å; F405-L414 HydrophobicContact CE1-CG 4.41Å; F405-L414 HydrophobicContact CZ-CD1 4.44Å; F405-L414 HydrophobicContact CZ-CD2 3.93Å; F405-L416 HydrophobicContact CZ-CD1 4.04Å; F405-V428 HydrophobicContact CD2-CG1 3.51Å; F405-V428 HydrophobicContact CE2-CG1 3.48Å; F405-V428 VanDerWaalsContact CE2-CG1 3.48Å; F405-F429 HydrophobicContact CD2-CD1 4.3Å; F405-F429 HydrophobicContact CD2-CE1 4.33Å; F405-F429 HydrophobicContact CE2-CD1 4.32Å; F405-F429 AromaticContact CE2-CE1 3.89Å; F405-F429 HydrophobicContact CE2-CE1 3.89Å; F405-F429 HydrophobicContact CZ-CE1 4.32Å; F405-L432 HydrophobicContact CB-CD1 4.29Å; F405-L432 HydrophobicContact CB-CD2 4.21Å; F405-L432 HydrophobicContact CB-CG 4.39Å; F405-L432 HydrophobicContact CD1-CD1 4.29Å; F405-L432 HydrophobicContact CG-CD1 4.18Å
406	Q	82.9	Confident	87.4	Confident	123 Å²	123	43.4 Å²	43.4	58%	0.575	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	121	172.8	-170.4	178.7	16.9	0	0	110.5	K383	K383-Q406 WeakPolarHBondContact CD-O 3.42Å; K383-Q406 WeakPolarHBondContact CE-O 3.44Å; K383-Q406 PolarHBondContact NZ-O 3.21Å
407	G	77.9	Confident	87.3	Confident	47 Å²	47	38.1 Å²	38.1	49%	0.485	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.8	-6.8	-173.2	0	0	0	0	0	115.7	F405	F405-G407 PolarHBondContact O-N 2.95Å; F405-G407 VanDerWaalsContact O-N 3.16Å
408	F	84.3	Confident	87.2	Confident	1 Å²	1	41.6 Å²	41.6	0%	0.004	23%	0.234	C	C	.	.			trans	-98.7	21	174.8	-76	-74.4	0	0	0	113.2	K383 A387 L390 F405 G410 L411 L432	K383-F408 HydrophobicContact CB-CE2 4.06Å; K383-F408 HydrophobicContact CB-CZ 4.09Å; K383-F408 HydrophobicContact CD-CD2 3.92Å; K383-F408 HydrophobicContact CD-CE2 3.59Å; K383-F408 HydrophobicContact CD-CZ 4.44Å; K383-F408 HydrophobicContact CG-CD2 4.45Å; K383-F408 HydrophobicContact CG-CE2 3.7Å; K383-F408 HydrophobicContact CG-CZ 4.1Å; A387-F408 HydrophobicContact CB-CD1 3.52Å; A387-F408 HydrophobicContact CB-CE1 3.73Å; L390-F408 HydrophobicContact CD2-CD1 4.14Å; L390-F408 HydrophobicContact CD2-CD2 4.41Å; L390-F408 HydrophobicContact CD2-CE1 4.04Å; L390-F408 HydrophobicContact CD2-CE2 4.28Å; L390-F408 HydrophobicContact CD2-CG 4.35Å; L390-F408 HydrophobicContact CD2-CZ 4.1Å; F405-F408 WeakPolarHBondContact O-CB 3.27Å; F405-F408 PolarHBondContact O-N 3.13Å; F408-G410 PolarHBondContact O-N 2.82Å; F408-L411 HydrophobicContact CB-CD1 3.78Å; F408-L411 HydrophobicContact CB-CG 4.01Å; F408-L411 HydrophobicContact CD1-CD1 4.21Å; F408-L411 HydrophobicContact CD1-CD2 4.36Å; F408-L411 HydrophobicContact CD1-CG 4.26Å; F408-L411 HydrophobicContact CG-CD1 4.27Å; F408-L411 WeakPolarHBondContact O-CB 3.45Å; F408-L411 VanDerWaalsContact O-CG 3.27Å; F408-L411 WeakPolarHBondContact O-CG 3.42Å; F408-L411 PolarHBondContact O-N 3.39Å; F408-L432 HydrophobicContact CB-CD2 4.28Å; F408-L432 VanDerWaalsContact O-CD2 3.23Å; F408-L432 WeakPolarHBondContact O-CD2 3.47Å
409	E	86.1	Confident	87.3	Confident	90 Å²	90	35.2 Å²	35.2	42%	0.421	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-20	-171.6	-45.8	-170.9	153.9	0	0	114	N431 N434	E409-N431 HydrophobicContact CG-CB 3.98Å; E409-N431 PolarHBondContact OE1-ND2 3.29Å; E409-N434 PolarHBondContact O-ND2 3.33Å
410	G	84.6	Confident	87.5	Confident	23 Å²	23	33.3 Å²	33.3	24%	0.237	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-7	176.3	0	0	0	0	0	115.8	A387 K388 F408	A387-G410 CarbonylContact O-C 3.52Å; K388-G410 VanDerWaalsContact CD-O 3.29Å; K388-G410 WeakPolarHBondContact CD-O 3.37Å; K388-G410 WeakPolarHBondContact CE-O 3.42Å; K388-G410 PolarHBondContact NZ-O 2.76Å; F408-G410 PolarHBondContact O-N 2.82Å
411	L	89.1	Confident	87.7	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.199	C	C	.	.			trans	-59.2	139.8	-173.3	-75.4	179.8	0	0	0	113.6	A387 K388 L390 F408 L414 L432 N434 L435	A387-L411 HydrophobicContact CB-CD2 4.27Å; A387-L411 PolarHBondContact O-N 2.95Å; K388-L411 VanDerWaalsContact C-CD2 3.46Å; L390-L411 HydrophobicContact CB-CD1 3.89Å; L390-L411 HydrophobicContact CB-CD2 3.82Å; L390-L411 HydrophobicContact CD2-CD1 4.17Å; F408-L411 HydrophobicContact CB-CD1 3.78Å; F408-L411 HydrophobicContact CB-CG 4.01Å; F408-L411 HydrophobicContact CD1-CD1 4.21Å; F408-L411 HydrophobicContact CD1-CD2 4.36Å; F408-L411 HydrophobicContact CD1-CG 4.26Å; F408-L411 HydrophobicContact CG-CD1 4.27Å; F408-L411 WeakPolarHBondContact O-CB 3.45Å; F408-L411 VanDerWaalsContact O-CG 3.27Å; F408-L411 WeakPolarHBondContact O-CG 3.42Å; F408-L411 PolarHBondContact O-N 3.39Å; L411-L414 HydrophobicContact CD1-CB 4.44Å; L411-L414 HydrophobicContact CD1-CD1 4.46Å; L411-L432 HydrophobicContact CD1-CD2 4.43Å; L411-N434 CarbonylContact O-C 3.09Å; L411-N434 VanDerWaalsContact O-CB 3.29Å; L411-N434 WeakPolarHBondContact O-CB 3.49Å; L411-L435 HydrophobicContact CB-CD1 3.81Å; L411-L435 WeakPolarHBondContact O-CA 3.44Å; L411-L435 PolarHBondContact O-N 3.45Å; L411-L435 VanDerWaalsContact O-N 3.17Å
412	D	86.8	Confident	87.8	Confident	43 Å²	43	34.7 Å²	34.7	23%	0.23	21%	0.211	C	C	.	.	S	Bend	trans	-106.5	-34.4	171.3	-177.7	83.9	0	0	0	110.8	K388 R436 R437	K388-D412 HydrophobicContact CD-CB 4.39Å; K388-D412 PolarHBondContact O-N 3.2Å; D412-R436 PolarHBondContact O-N 3.08Å; D412-R436 WeakPolarHBondContact OD1-CD 3.38Å; D412-R436 WeakPolarHBondContact OD1-CG 3.35Å; D412-R436 IonicContact OD1-NE 3.84Å; D412-R436 PolarHBondContact OD1-NE 2.87Å; D412-R437 PolarHBondContact O-N 3.22Å; D412-R437 VanDerWaalsContact O-N 3.1Å
413	L	88.8	Confident	88	Confident	12 Å²	12	35.4 Å²	35.4	6%	0.063	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	130.7	177.7	-175.1	156.8	0	0	0	111.8	K388 K389 L390 H415 R437 Y439	K388-L413 PolarHBondContact O-N 2.96Å; K389-L413 WeakPolarHBondContact CA-O 3.43Å; K389-L413 HydrophobicContact CB-CB 4.48Å; K389-L413 HydrophobicContact CG-CB 4.29Å; L390-L413 PolarHBondContact N-O 3.07Å; L413-H415 HydrophobicContact CD2-CB 4.06Å; L413-R437 HydrophobicContact CB-CB 4.41Å; L413-R437 HydrophobicContact CD1-CB 4.43Å; L413-R437 HydrophobicContact CG-CB 4.14Å; L413-Y439 HydrophobicContact CD1-CE2 4.21Å; L413-Y439 HydrophobicContact CG-CE2 4.16Å
414	L	93.1	Very high	88.3	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	116.8	173.3	175	56.1	0	0	0	109.6	L390 F405 L411 L416 F429 L432 L435 R437 L438 Y439	L390-L414 HydrophobicContact CB-CD1 4.09Å; L390-L414 HydrophobicContact CD2-CD1 3.91Å; L390-L414 HydrophobicContact CG-CD1 3.99Å; F405-L414 HydrophobicContact CD1-CD2 4.2Å; F405-L414 HydrophobicContact CE1-CD1 3.81Å; F405-L414 HydrophobicContact CE1-CD2 3.66Å; F405-L414 HydrophobicContact CE1-CG 4.41Å; F405-L414 HydrophobicContact CZ-CD1 4.44Å; F405-L414 HydrophobicContact CZ-CD2 3.93Å; L411-L414 HydrophobicContact CD1-CB 4.44Å; L411-L414 HydrophobicContact CD1-CD1 4.46Å; L414-L416 HydrophobicContact CD1-CD1 4.26Å; L414-L416 HydrophobicContact CD1-CD2 4.43Å; L414-L416 HydrophobicContact CD1-CG 4.01Å; L414-L416 HydrophobicContact CD2-CD1 4Å; L414-L416 HydrophobicContact CG-CD1 4.03Å; L414-L416 HydrophobicContact CG-CG 4.13Å; L414-F429 HydrophobicContact CD2-CD1 4.32Å; L414-F429 HydrophobicContact CD2-CE1 3.94Å; L414-L432 HydrophobicContact CD2-CD1 3.83Å; L414-L435 HydrophobicContact CB-CD1 3.73Å; L414-L435 HydrophobicContact CB-CD2 4.09Å; L414-R437 PolarHBondContact N-O 3.46Å; L414-L438 HydrophobicContact CB-CD1 4.18Å; L414-L438 HydrophobicContact CD2-CD1 3.98Å; L414-L438 HydrophobicContact CG-CD1 3.99Å; L414-L438 WeakPolarHBondContact O-CA 3.26Å; L414-Y439 PolarHBondContact O-N 3.29Å
415	H	88.7	Confident	88.5	Confident	37 Å²	37	35.3 Å²	35.3	17%	0.171	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	101.6	-178.5	-169.4	-62.9	0	0	0	111.6	L390 L392 S393 L413 G417 Y439	L390-H415 PolarHBondContact O-N 3.44Å; L392-H415 CarbonylContact C-O 3.54Å; L392-H415 WeakPolarHBondContact CA-O 3.19Å; L392-H415 PolarHBondContact N-O 3.39Å; S393-H415 PolarHBondContact OG-ND1 3.09Å; L413-H415 HydrophobicContact CD2-CB 4.06Å; H415-G417 PolarHBondContact ND1-N 2.84Å; H415-Y439 HydrophobicContact CB-CD2 4.05Å; H415-Y439 HydrophobicContact CB-CG 4.45Å; H415-Y439 AromaticContact CD2-CD1 3.7Å; H415-Y439 AromaticContact CD2-CD2 3.5Å; H415-Y439 VanDerWaalsContact CD2-CD2 3.5Å; H415-Y439 WeakPolarHBondContact CD2-CD2 3.19Å; H415-Y439 AromaticContact CD2-CG 3.29Å; H415-Y439 AromaticContact CG-CG 4Å; H415-Y439 AromaticContact NE2-CD1 3.89Å; H415-Y439 AromaticContact NE2-CG 3.81Å
416	L	92.7	Very high	88.6	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.233	C	C	.	.			trans	-107.5	10.3	178	-67.9	162.9	0	0	0	112.5	L392 I397 I400 F405 L414 N419 I421 Y439 L440 N443	L392-L416 HydrophobicContact CB-CD2 3.96Å; L392-L416 HydrophobicContact CD1-CD2 3.84Å; I397-L416 HydrophobicContact CD1-CD2 4.47Å; I400-L416 HydrophobicContact CD1-CD1 4.2Å; F405-L416 HydrophobicContact CZ-CD1 4.04Å; L414-L416 HydrophobicContact CD1-CD1 4.26Å; L414-L416 HydrophobicContact CD1-CD2 4.43Å; L414-L416 HydrophobicContact CD1-CG 4.01Å; L414-L416 HydrophobicContact CD2-CD1 4Å; L414-L416 HydrophobicContact CG-CD1 4.03Å; L414-L416 HydrophobicContact CG-CG 4.13Å; L416-N419 PolarHBondContact O-ND2 2.92Å; L416-I421 HydrophobicContact CB-CD1 3.94Å; L416-I421 HydrophobicContact CD1-CD1 4.4Å; L416-I421 HydrophobicContact CD2-CD1 4.33Å; L416-I421 HydrophobicContact CG-CD1 4.46Å; L416-Y439 CarbonylContact C-O 3.59Å; L416-Y439 WeakPolarHBondContact CA-O 3.26Å; L416-Y439 WeakPolarHBondContact CB-O 3.14Å; L416-Y439 PolarHBondContact N-O 3.06Å; L416-L440 HydrophobicContact CB-CD2 3.98Å; L416-L440 HydrophobicContact CD1-CD2 3.93Å; L416-N443 PolarHBondContact O-ND2 3.18Å
417	G	89	Confident	88.8	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.212	C	C	.	.			trans	-61.6	156.8	-177.6	0	0	0	0	0	114.5	S393 G394 H415 N419 Y439 N441	S393-G417 VanDerWaalsContact CA-O 3.27Å; S393-G417 WeakPolarHBondContact CA-O 3.07Å; G394-G417 PolarHBondContact N-O 3.04Å; H415-G417 PolarHBondContact ND1-N 2.84Å; G417-N419 PolarHBondContact O-ND2 2.83Å; G417-Y439 PolarHBondContact N-O 3.35Å; G417-N441 CarbonylContact C-O 3.46Å; G417-N441 WeakPolarHBondContact CA-O 3.49Å; G417-N441 VanDerWaalsContact CA-OD1 3.25Å; G417-N441 WeakPolarHBondContact CA-OD1 3.45Å
418	S	88.8	Confident	89.4	Confident	73 Å²	73	33.9 Å²	33.9	51%	0.51	19%	0.19	S	C	.	.	S	Bend	trans	53.7	60.7	-177.7	-60.4	0	0	0	0	112.6	G394 N395 N441 G442	G394-S418 WeakPolarHBondContact CA-O 3.23Å; G394-S418 PolarHBondContact N-O 2.91Å; N395-S418 PolarHBondContact N-O 3.22Å; S418-N441 PolarHBondContact N-O 3.05Å; S418-G442 WeakPolarHBondContact CA-O 3.35Å; S418-G442 PolarHBondContact N-O 2.67Å
419	N	91.6	Very high	89.7	Confident	13 Å²	13	33.8 Å²	33.8	7%	0.07	19%	0.19	C	C	.	.	S	Bend	trans	-131.9	-166.4	177.2	-90.3	-85.5	0	0	0	110	L392 N395 Y396 I397 L416 G417 I421 G442 N443	L392-N419 PolarHBondContact O-ND2 2.87Å; N395-N419 WeakPolarHBondContact CA-OD1 3.1Å; N395-N419 WeakPolarHBondContact CB-OD1 3.32Å; N395-N419 PolarHBondContact O-OD1 3.16Å; N395-N419 VanDerWaalsContact O-OD1 3.14Å; Y396-N419 PolarHBondContact N-OD1 2.96Å; I397-N419 WeakPolarHBondContact CB-OD1 3.49Å; I397-N419 WeakPolarHBondContact CD1-OD1 3.43Å; I397-N419 WeakPolarHBondContact CG1-OD1 3.34Å; I397-N419 PolarHBondContact N-OD1 2.97Å; I397-N419 VanDerWaalsContact N-OD1 3.14Å; L416-N419 PolarHBondContact O-ND2 2.92Å; G417-N419 PolarHBondContact O-ND2 2.83Å; N419-I421 HydrophobicContact CB-CD1 4.3Å; N419-I421 HydrophobicContact CB-CG1 4.04Å; N419-G442 PolarHBondContact N-O 3.24Å; N419-G442 VanDerWaalsContact N-O 3.15Å; N419-N443 WeakPolarHBondContact CA-OD1 3.35Å; N419-N443 WeakPolarHBondContact CB-OD1 3.22Å; N419-N443 PolarHBondContact N-OD1 2.81Å; N419-N443 PolarHBondContact O-OD1 3.08Å
420	Q	93.3	Very high	89.8	Confident	51 Å²	51	31.2 Å²	31.2	24%	0.238	18%	0.184	C	C	.	.			trans	-111.4	25.1	176.3	-63	-178.6	8.7	0	0	111.7	I397 R398 A422	I397-Q420 CarbonylContact O-C 3.08Å; I397-Q420 VanDerWaalsContact O-CA 3.23Å; I397-Q420 WeakPolarHBondContact O-CA 3.49Å; I397-Q420 WeakPolarHBondContact O-CB 3.5Å; I397-Q420 PolarHBondContact O-N 3.13Å; R398-Q420 WeakPolarHBondContact CA-O 3.33Å; R398-Q420 HydrophobicContact CG-CB 3.73Å; Q420-A422 PolarHBondContact O-N 3.13Å; Q420-A422 VanDerWaalsContact O-N 3.12Å
421	I	94.3	Very high	89.9	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.194	C	C	.	.			trans	-68.6	114.3	-169.9	-57	171.8	0	0	0	109.7	I397 R398 I400 L416 N419 V424 L440 N443 Q444 L445	I397-I421 HydrophobicContact CB-CG1 4.34Å; I397-I421 HydrophobicContact CG2-CD1 4.29Å; I397-I421 HydrophobicContact CG2-CG1 4.06Å; I397-I421 PolarHBondContact O-N 2.72Å; I397-I421 VanDerWaalsContact O-N 3.14Å; R398-I421 VanDerWaalsContact O-CA 3.31Å; R398-I421 WeakPolarHBondContact O-CA 3.3Å; I400-I421 HydrophobicContact CG1-CG2 4.44Å; I400-I421 HydrophobicContact CG2-CD1 4.32Å; L416-I421 HydrophobicContact CB-CD1 3.94Å; L416-I421 HydrophobicContact CD1-CD1 4.4Å; L416-I421 HydrophobicContact CD2-CD1 4.33Å; L416-I421 HydrophobicContact CG-CD1 4.46Å; N419-I421 HydrophobicContact CB-CD1 4.3Å; N419-I421 HydrophobicContact CB-CG1 4.04Å; I421-V424 HydrophobicContact CG2-CG2 4.28Å; I421-L440 HydrophobicContact CD1-CD2 4.35Å; I421-N443 HydrophobicContact CB-CB 4.3Å; I421-N443 VanDerWaalsContact CB-OD1 3.28Å; I421-N443 WeakPolarHBondContact CB-OD1 3.4Å; I421-N443 WeakPolarHBondContact CG1-OD1 3.33Å; I421-N443 PolarHBondContact N-OD1 3.47Å; I421-Q444 CarbonylContact O-C 3.57Å; I421-Q444 VanDerWaalsContact O-C 3.27Å; I421-Q444 WeakPolarHBondContact O-CA 3.35Å; I421-Q444 PolarHBondContact O-N 2.87Å; I421-L445 HydrophobicContact CG2-CD2 4.08Å; I421-L445 PolarHBondContact O-N 3.1Å
422	A	91.3	Very high	90	Very high	48 Å²	48	34.2 Å²	34.2	40%	0.397	20%	0.195	S	C	.	.			trans	-106.8	-30.5	177.6	0	0	0	0	0	112.1	R398 Q420 Q444	R398-A422 PolarHBondContact O-N 3.19Å; Q420-A422 PolarHBondContact O-N 3.13Å; Q420-A422 VanDerWaalsContact O-N 3.12Å; A422-Q444 HydrophobicContact CB-CB 4.22Å
423	V	88.2	Confident	90.1	Very high	73 Å²	73	35 Å²	35	44%	0.442	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	122.1	-177.1	-175.1	0	0	0	0	111.1	I400	I400-V423 PolarHBondContact N-O 3.45Å
424	V	92	Very high	90.2	Very high	17 Å²	17	37.9 Å²	37.9	10%	0.103	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	116	164.9	-174.5	0	0	0	0	107.8	I400 I421 V428 F429 L445 M452	I400-V424 HydrophobicContact CD1-CB 4.42Å; I400-V424 HydrophobicContact CD1-CG1 3.99Å; I400-V424 HydrophobicContact CD1-CG2 3.96Å; I400-V424 HydrophobicContact CG1-CB 4.33Å; I400-V424 HydrophobicContact CG1-CG1 4.11Å; I400-V424 HydrophobicContact CG1-CG2 4.18Å; I421-V424 HydrophobicContact CG2-CG2 4.28Å; V424-V428 HydrophobicContact CG1-CB 4.08Å; V424-V428 HydrophobicContact CG1-CG1 4.46Å; V424-V428 HydrophobicContact CG1-CG2 4.14Å; V424-F429 HydrophobicContact CG1-CE2 4.07Å; V424-F429 HydrophobicContact CG1-CZ 4.32Å; V424-L445 HydrophobicContact CG2-CD2 3.85Å; V424-M452 HydrophobicContact CB-CB 3.87Å; V424-M452 HydrophobicContact CB-CE 4.22Å; V424-M452 HydrophobicContact CG1-CB 3.63Å; V424-M452 HydrophobicContact CG2-CE 4.15Å
425	Q	88.9	Confident	90.2	Very high	87 Å²	87	37.9 Å²	37.9	41%	0.407	22%	0.217	S	C	.	.			trans	-69.5	164	179.6	-63.5	177.5	10	0	0	112.2	I400 G427 V428	I400-Q425 WeakPolarHBondContact O-CB 3.04Å; I400-Q425 WeakPolarHBondContact O-CG 3.48Å; I400-Q425 PolarHBondContact O-N 3.47Å; Q425-G427 PolarHBondContact O-N 2.87Å; Q425-V428 HydrophobicContact CB-CG2 3.68Å; Q425-V428 WeakPolarHBondContact O-CG2 3.41Å; Q425-V428 PolarHBondContact O-N 3.25Å
426	K	88.9	Confident	90.2	Very high	126 Å²	126	40.6 Å²	40.6	55%	0.548	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	127.8	174.1	173.4	172.9	-155.6	141.4	0	111.3	P402 V428 E451	P402-K426 WeakPolarHBondContact CG-O 3.27Å; K426-V428 VanDerWaalsContact C-N 3.28Å; K426-V428 PolarHBondContact O-N 2.94Å; K426-E451 HydrophobicContact CB-CB 4.39Å; K426-E451 VanDerWaalsContact CD-OE2 3.23Å; K426-E451 WeakPolarHBondContact CD-OE2 3.42Å; K426-E451 WeakPolarHBondContact CE-OE1 3.31Å; K426-E451 WeakPolarHBondContact CE-OE2 3.18Å; K426-E451 HydrophobicContact CG-CB 4.15Å; K426-E451 IonicContact NZ-OE1 2.63Å; K426-E451 PolarHBondContact NZ-OE1 3.39Å; K426-E451 IonicContact NZ-OE2 2.74Å; K426-E451 PolarHBondContact NZ-OE2 3.06Å
427	G	85.8	Confident	90.1	Very high	13 Å²	13	45.3 Å²	45.3	13%	0.134	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.2	18.6	171.7	0	0	0	0	0	115.3	Q425 F429 A430 E451	Q425-G427 PolarHBondContact O-N 2.87Å; G427-F429 PolarHBondContact O-N 3.32Å; G427-A430 WeakPolarHBondContact O-CB 3.42Å; G427-A430 PolarHBondContact O-N 2.93Å; G427-E451 PolarHBondContact N-O 2.96Å
428	V	90.4	Very high	90.4	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.024	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-35.9	178.2	170.5	0	0	0	0	112.4	I400 P402 F405 V424 Q425 K426	I400-V428 HydrophobicContact CB-CG1 4.15Å; I400-V428 HydrophobicContact CD1-CG1 3.92Å; I400-V428 HydrophobicContact CG1-CG1 3.95Å; I400-V428 HydrophobicContact CG1-CG2 4.48Å; I400-V428 WeakPolarHBondContact O-CG2 3.27Å; P402-V428 HydrophobicContact CG-CG2 4.32Å; F405-V428 HydrophobicContact CD2-CG1 3.51Å; F405-V428 HydrophobicContact CE2-CG1 3.48Å; F405-V428 VanDerWaalsContact CE2-CG1 3.48Å; V424-V428 HydrophobicContact CG1-CB 4.08Å; V424-V428 HydrophobicContact CG1-CG1 4.46Å; V424-V428 HydrophobicContact CG1-CG2 4.14Å; Q425-V428 HydrophobicContact CB-CG2 3.68Å; Q425-V428 WeakPolarHBondContact O-CG2 3.41Å; Q425-V428 PolarHBondContact O-N 3.25Å; K426-V428 VanDerWaalsContact C-N 3.28Å; K426-V428 PolarHBondContact O-N 2.94Å
429	F	92.3	Very high	90.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	11.9	179.3	-49.9	-49.1	0	0	0	113.8	I400 F405 L414 V424 G427 N431 L432 L438 L440 M452 F453 L454 L456	I400-F429 HydrophobicContact CD1-CE1 4.11Å; I400-F429 HydrophobicContact CD1-CZ 3.79Å; F405-F429 HydrophobicContact CD2-CD1 4.3Å; F405-F429 HydrophobicContact CD2-CE1 4.33Å; F405-F429 HydrophobicContact CE2-CD1 4.32Å; F405-F429 AromaticContact CE2-CE1 3.89Å; F405-F429 HydrophobicContact CE2-CE1 3.89Å; F405-F429 HydrophobicContact CZ-CE1 4.32Å; L414-F429 HydrophobicContact CD2-CD1 4.32Å; L414-F429 HydrophobicContact CD2-CE1 3.94Å; V424-F429 HydrophobicContact CG1-CE2 4.07Å; V424-F429 HydrophobicContact CG1-CZ 4.32Å; G427-F429 PolarHBondContact O-N 3.32Å; F429-N431 PolarHBondContact O-N 3.43Å; F429-N431 VanDerWaalsContact O-N 3.12Å; F429-L432 HydrophobicContact CB-CB 4.46Å; F429-L432 HydrophobicContact CB-CD1 4.33Å; F429-L432 HydrophobicContact CD1-CD1 3.76Å; F429-L432 HydrophobicContact CG-CD1 4.46Å; F429-L432 WeakPolarHBondContact O-CB 3.43Å; F429-L432 PolarHBondContact O-N 2.77Å; F429-L438 HydrophobicContact CD2-CD2 4.24Å; F429-L438 HydrophobicContact CE2-CD2 3.87Å; F429-L438 HydrophobicContact CZ-CD1 4.36Å; F429-L438 HydrophobicContact CZ-CD2 4.19Å; F429-L440 HydrophobicContact CE2-CD1 4.49Å; F429-L440 HydrophobicContact CZ-CD1 4.5Å; F429-M452 WeakPolarHBondContact CD2-O 3.32Å; F429-F453 HydrophobicContact CD2-CD1 4.49Å; F429-F453 HydrophobicContact CE2-CD1 4.47Å; F429-L454 CarbonylContact C-O 3.3Å; F429-L454 VanDerWaalsContact C-O 3.3Å; F429-L456 HydrophobicContact CB-CD1 4.12Å; F429-L456 HydrophobicContact CB-CD2 3.71Å; F429-L456 HydrophobicContact CB-CG 3.77Å; F429-L456 HydrophobicContact CD2-CD1 3.77Å; F429-L456 HydrophobicContact CD2-CG 4.38Å; F429-L456 HydrophobicContact CG-CD1 4.21Å; F429-L456 HydrophobicContact CG-CD2 4.31Å; F429-L456 HydrophobicContact CG-CG 4.39Å
430	A	88.4	Confident	90.7	Very high	36 Å²	36	42.9 Å²	42.9	30%	0.298	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-34.9	-171.3	0	0	0	0	0	114.2	G427 L454	G427-A430 WeakPolarHBondContact O-CB 3.42Å; G427-A430 PolarHBondContact O-N 2.93Å; A430-L454 VanDerWaalsContact CA-O 3.26Å; A430-L454 WeakPolarHBondContact CA-O 3.39Å; A430-L454 PolarHBondContact N-O 2.91Å
431	N	86.4	Confident	90.6	Very high	84 Å²	84	42 Å²	42	45%	0.449	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-5.7	179.9	-63.6	29.1	0	0	0	113	E409 F429 T433	E409-N431 HydrophobicContact CG-CB 3.98Å; E409-N431 PolarHBondContact OE1-ND2 3.29Å; F429-N431 PolarHBondContact O-N 3.43Å; F429-N431 VanDerWaalsContact O-N 3.12Å; N431-T433 PolarHBondContact O-N 3.04Å
432	L	90.5	Very high	90.2	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	23%	0.232	C	C	.	.			trans	-83.7	45.1	-177.5	-59.4	-170.7	0	0	0	112.4	F405 F408 L411 L414 F429 N434 L435 L456	F405-L432 HydrophobicContact CB-CD1 4.29Å; F405-L432 HydrophobicContact CB-CD2 4.21Å; F405-L432 HydrophobicContact CB-CG 4.39Å; F405-L432 HydrophobicContact CD1-CD1 4.29Å; F405-L432 HydrophobicContact CG-CD1 4.18Å; F408-L432 HydrophobicContact CB-CD2 4.28Å; F408-L432 VanDerWaalsContact O-CD2 3.23Å; F408-L432 WeakPolarHBondContact O-CD2 3.47Å; L411-L432 HydrophobicContact CD1-CD2 4.43Å; L414-L432 HydrophobicContact CD2-CD1 3.83Å; F429-L432 HydrophobicContact CB-CB 4.46Å; F429-L432 HydrophobicContact CB-CD1 4.33Å; F429-L432 HydrophobicContact CD1-CD1 3.76Å; F429-L432 HydrophobicContact CG-CD1 4.46Å; F429-L432 WeakPolarHBondContact O-CB 3.43Å; F429-L432 PolarHBondContact O-N 2.77Å; L432-N434 PolarHBondContact O-N 3.14Å; L432-N434 VanDerWaalsContact O-N 3.13Å; L432-L435 HydrophobicContact CB-CB 4.23Å; L432-L435 HydrophobicContact CD1-CD2 4.38Å; L432-L435 VanDerWaalsContact O-CB 3.25Å; L432-L435 WeakPolarHBondContact O-CB 3.34Å; L432-L435 PolarHBondContact O-N 3.19Å; L432-L456 HydrophobicContact CB-CD2 4.24Å
433	T	90.1	Very high	90.4	Very high	59 Å²	59	41.4 Å²	41.4	36%	0.362	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-19.2	-173.5	57.9	0	0	0	0	114.1	N431 N458	N431-T433 PolarHBondContact O-N 3.04Å; T433-N458 WeakPolarHBondContact O-CB 3.36Å; T433-N458 PolarHBondContact O-ND2 3.35Å
434	N	89.9	Confident	90.7	Very high	73 Å²	73	43 Å²	43	39%	0.39	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-9.5	176.7	-69.2	-75.4	0	0	0	114.1	E409 L411 L432 R436	E409-N434 PolarHBondContact O-ND2 3.33Å; L411-N434 CarbonylContact O-C 3.09Å; L411-N434 VanDerWaalsContact O-CB 3.29Å; L411-N434 WeakPolarHBondContact O-CB 3.49Å; L432-N434 PolarHBondContact O-N 3.14Å; L432-N434 VanDerWaalsContact O-N 3.13Å; N434-R436 PolarHBondContact O-N 3.21Å
435	L	93.8	Very high	90.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.214	C	C	.	.			trans	-70.3	128.5	-167.8	-162.5	76.1	0	0	0	111.7	L411 L414 L432 L438 L456 N458 L459	L411-L435 HydrophobicContact CB-CD1 3.81Å; L411-L435 WeakPolarHBondContact O-CA 3.44Å; L411-L435 PolarHBondContact O-N 3.45Å; L411-L435 VanDerWaalsContact O-N 3.17Å; L414-L435 HydrophobicContact CB-CD1 3.73Å; L414-L435 HydrophobicContact CB-CD2 4.09Å; L432-L435 HydrophobicContact CB-CB 4.23Å; L432-L435 HydrophobicContact CD1-CD2 4.38Å; L432-L435 VanDerWaalsContact O-CB 3.25Å; L432-L435 WeakPolarHBondContact O-CB 3.34Å; L432-L435 PolarHBondContact O-N 3.19Å; L435-L438 HydrophobicContact CD2-CB 4.07Å; L435-L438 HydrophobicContact CD2-CD1 4.36Å; L435-L456 HydrophobicContact CB-CD2 4.03Å; L435-L456 HydrophobicContact CD2-CD2 3.64Å; L435-L456 HydrophobicContact CG-CD2 4.45Å; L435-N458 CarbonylContact O-C 3.49Å; L435-L459 HydrophobicContact CB-CD1 4.36Å; L435-L459 HydrophobicContact CD2-CD1 3.94Å; L435-L459 HydrophobicContact CG-CD1 4Å; L435-L459 VanDerWaalsContact O-CA 3.23Å; L435-L459 WeakPolarHBondContact O-CA 3.47Å; L435-L459 PolarHBondContact O-N 2.77Å; L435-L459 VanDerWaalsContact O-N 3.11Å
436	R	88.9	Confident	91.1	Very high	95 Å²	95	43 Å²	43	36%	0.358	22%	0.217	S	C	.	.			trans	-104.8	-33.1	176.3	-63.7	-175.8	-168.5	-80.7	-8.5	113.4	D412 N434 Q460 Y461	D412-R436 PolarHBondContact O-N 3.08Å; D412-R436 WeakPolarHBondContact OD1-CD 3.38Å; D412-R436 WeakPolarHBondContact OD1-CG 3.35Å; D412-R436 IonicContact OD1-NE 3.84Å; D412-R436 PolarHBondContact OD1-NE 2.87Å; N434-R436 PolarHBondContact O-N 3.21Å; R436-Q460 PolarHBondContact O-N 3.37Å; R436-Y461 PolarHBondContact O-N 3.32Å
437	R	89.1	Confident	91.3	Very high	98 Å²	98	40.6 Å²	40.6	37%	0.37	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	122.1	-173.8	-63.1	179.8	-177.1	149.5	5.5	110.9	D412 L413 L414 Y439 Y461	D412-R437 PolarHBondContact O-N 3.22Å; D412-R437 VanDerWaalsContact O-N 3.1Å; L413-R437 HydrophobicContact CB-CB 4.41Å; L413-R437 HydrophobicContact CD1-CB 4.43Å; L413-R437 HydrophobicContact CG-CB 4.14Å; L414-R437 PolarHBondContact N-O 3.46Å; R437-Y439 HydrophobicContact CB-CE2 3.96Å; R437-Y461 HydrophobicContact CG-CD2 3.66Å; R437-Y461 HydrophobicContact CG-CE2 4.48Å; R437-Y461 HydrophobicContact CG-CG 4.19Å
438	L	95.6	Very high	91.8	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	118.5	177.3	178.3	56.1	0	0	0	109.8	L414 F429 L435 L440 F453 L456 L459 Y461 L462 Y463	L414-L438 HydrophobicContact CB-CD1 4.18Å; L414-L438 HydrophobicContact CD2-CD1 3.98Å; L414-L438 HydrophobicContact CG-CD1 3.99Å; L414-L438 WeakPolarHBondContact O-CA 3.26Å; F429-L438 HydrophobicContact CD2-CD2 4.24Å; F429-L438 HydrophobicContact CE2-CD2 3.87Å; F429-L438 HydrophobicContact CZ-CD1 4.36Å; F429-L438 HydrophobicContact CZ-CD2 4.19Å; L435-L438 HydrophobicContact CD2-CB 4.07Å; L435-L438 HydrophobicContact CD2-CD1 4.36Å; L438-L440 HydrophobicContact CD1-CD1 4.31Å; L438-L440 HydrophobicContact CD1-CG 4.12Å; L438-L440 HydrophobicContact CD2-CD1 3.9Å; L438-L440 HydrophobicContact CG-CD1 4Å; L438-L440 HydrophobicContact CG-CG 4.14Å; L438-F453 HydrophobicContact CD2-CE1 4.39Å; L438-L456 HydrophobicContact CD2-CD1 3.75Å; L438-L459 HydrophobicContact CB-CD1 3.75Å; L438-L459 HydrophobicContact CB-CD2 4.13Å; L438-Y461 PolarHBondContact N-O 2.9Å; L438-L462 HydrophobicContact CB-CD1 4.12Å; L438-L462 HydrophobicContact CD2-CD1 4Å; L438-L462 HydrophobicContact CG-CD1 4.03Å; L438-Y463 PolarHBondContact O-N 3.45Å
439	Y	91.1	Very high	91.9	Very high	35 Å²	35	42.8 Å²	42.8	14%	0.137	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	115.7	175.1	-53.8	-106.3	0	0	0	109.6	L413 L414 H415 L416 G417 R437 Y463	L413-Y439 HydrophobicContact CD1-CE2 4.21Å; L413-Y439 HydrophobicContact CG-CE2 4.16Å; L414-Y439 PolarHBondContact O-N 3.29Å; H415-Y439 HydrophobicContact CB-CD2 4.05Å; H415-Y439 HydrophobicContact CB-CG 4.45Å; H415-Y439 AromaticContact CD2-CD1 3.7Å; H415-Y439 AromaticContact CD2-CD2 3.5Å; H415-Y439 VanDerWaalsContact CD2-CD2 3.5Å; H415-Y439 WeakPolarHBondContact CD2-CD2 3.19Å; H415-Y439 AromaticContact CD2-CG 3.29Å; H415-Y439 AromaticContact CG-CG 4Å; H415-Y439 AromaticContact NE2-CD1 3.89Å; H415-Y439 AromaticContact NE2-CG 3.81Å; L416-Y439 CarbonylContact C-O 3.59Å; L416-Y439 WeakPolarHBondContact CA-O 3.26Å; L416-Y439 WeakPolarHBondContact CB-O 3.14Å; L416-Y439 PolarHBondContact N-O 3.06Å; G417-Y439 PolarHBondContact N-O 3.35Å; R437-Y439 HydrophobicContact CB-CE2 3.96Å; Y439-Y463 AromaticContact CD1-CD2 3.36Å; Y439-Y463 HydrophobicContact CD1-CD2 3.36Å; Y439-Y463 AromaticContact CD1-CE2 3.92Å; Y439-Y463 HydrophobicContact CD1-CE2 3.92Å; Y439-Y463 AromaticContact CD1-CG 3.71Å; Y439-Y463 HydrophobicContact CD1-CG 3.71Å; Y439-Y463 HydrophobicContact CD2-CD2 4.48Å; Y439-Y463 AromaticContact CE1-CD2 3.36Å; Y439-Y463 HydrophobicContact CE1-CD2 3.36Å; Y439-Y463 AromaticContact CE1-CE2 3.38Å; Y439-Y463 HydrophobicContact CE1-CE2 3.38Å; Y439-Y463 AromaticContact CE1-CG 3.96Å; Y439-Y463 HydrophobicContact CE1-CG 3.96Å; Y439-Y463 HydrophobicContact CE2-CD2 4.47Å; Y439-Y463 HydrophobicContact CE2-CE2 4.47Å; Y439-Y463 AromaticContact CG-CD2 3.95Å; Y439-Y463 HydrophobicContact CG-CD2 3.95Å; Y439-Y463 HydrophobicContact CG-CG 4.49Å; Y439-Y463 AromaticContact CZ-CD2 3.94Å; Y439-Y463 AromaticContact CZ-CE2 3.7Å
440	L	94.6	Very high	91.9	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.226	C	C	.	.			trans	-124.4	13.4	175.2	-74.7	166.6	0	0	0	110.9	L416 I421 F429 L438 N443 L445 F453 Y463 L464 N467	L416-L440 HydrophobicContact CB-CD2 3.98Å; L416-L440 HydrophobicContact CD1-CD2 3.93Å; I421-L440 HydrophobicContact CD1-CD2 4.35Å; F429-L440 HydrophobicContact CE2-CD1 4.49Å; F429-L440 HydrophobicContact CZ-CD1 4.5Å; L438-L440 HydrophobicContact CD1-CD1 4.31Å; L438-L440 HydrophobicContact CD1-CG 4.12Å; L438-L440 HydrophobicContact CD2-CD1 3.9Å; L438-L440 HydrophobicContact CG-CD1 4Å; L438-L440 HydrophobicContact CG-CG 4.14Å; L440-N443 WeakPolarHBondContact O-CB 3.34Å; L440-N443 PolarHBondContact O-ND2 3.15Å; L440-N443 VanDerWaalsContact O-ND2 3.08Å; L440-L445 HydrophobicContact CB-CD1 4.29Å; L440-F453 HydrophobicContact CD1-CE1 4.21Å; L440-Y463 CarbonylContact C-O 3.2Å; L440-Y463 WeakPolarHBondContact CA-O 3.41Å; L440-Y463 PolarHBondContact N-O 3.39Å; L440-L464 HydrophobicContact CB-CD2 3.68Å; L440-L464 HydrophobicContact CD1-CD2 4.08Å; L440-N467 PolarHBondContact O-ND2 3.19Å
441	N	91.5	Very high	92	Very high	32 Å²	32	47.6 Å²	47.6	17%	0.171	23%	0.234	C	C	.	.			trans	-64.3	153.1	178.8	58.7	-14.8	0	0	0	113	G417 S418 N443 Y463 E465	G417-N441 CarbonylContact C-O 3.46Å; G417-N441 WeakPolarHBondContact CA-O 3.49Å; G417-N441 VanDerWaalsContact CA-OD1 3.25Å; G417-N441 WeakPolarHBondContact CA-OD1 3.45Å; S418-N441 PolarHBondContact N-O 3.05Å; N441-N443 PolarHBondContact O-N 3.22Å; N441-N443 PolarHBondContact O-ND2 2.87Å; N441-Y463 PolarHBondContact N-O 3.16Å; N441-E465 CarbonylContact C-O 3.44Å; N441-E465 WeakPolarHBondContact CA-O 3.33Å; N441-E465 HydrophobicContact CB-CG 3.85Å; N441-E465 VanDerWaalsContact CB-O 3.3Å; N441-E465 WeakPolarHBondContact CB-O 3.27Å; N441-E465 VanDerWaalsContact CB-OE1 3.22Å; N441-E465 WeakPolarHBondContact CB-OE1 3.23Å; N441-E465 PolarHBondContact ND2-OE1 3.28Å
442	G	86.9	Confident	92.3	Very high	26 Å²	26	44 Å²	44	27%	0.268	21%	0.214	S	C	.	.	S	Bend	trans	62.2	44.5	-179.6	0	0	0	0	0	113.4	S418 N419 E465 Y466	S418-G442 WeakPolarHBondContact CA-O 3.35Å; S418-G442 PolarHBondContact N-O 2.67Å; N419-G442 PolarHBondContact N-O 3.24Å; N419-G442 VanDerWaalsContact N-O 3.15Å; G442-E465 PolarHBondContact N-O 2.67Å; G442-Y466 CarbonylContact C-O 3.39Å; G442-Y466 WeakPolarHBondContact CA-O 3.11Å; G442-Y466 PolarHBondContact N-O 3.4Å
443	N	94.3	Very high	92.4	Very high	10 Å²	10	44 Å²	44	5%	0.053	21%	0.214	C	C	.	.	S	Bend	trans	-126.2	-168.2	179.3	-85.5	-74.2	0	0	0	110.8	L416 N419 I421 L440 N441 Y466 N467	L416-N443 PolarHBondContact O-ND2 3.18Å; N419-N443 WeakPolarHBondContact CA-OD1 3.35Å; N419-N443 WeakPolarHBondContact CB-OD1 3.22Å; N419-N443 PolarHBondContact N-OD1 2.81Å; N419-N443 PolarHBondContact O-OD1 3.08Å; I421-N443 HydrophobicContact CB-CB 4.3Å; I421-N443 VanDerWaalsContact CB-OD1 3.28Å; I421-N443 WeakPolarHBondContact CB-OD1 3.4Å; I421-N443 WeakPolarHBondContact CG1-OD1 3.33Å; I421-N443 PolarHBondContact N-OD1 3.47Å; L440-N443 WeakPolarHBondContact O-CB 3.34Å; L440-N443 PolarHBondContact O-ND2 3.15Å; L440-N443 VanDerWaalsContact O-ND2 3.08Å; N441-N443 PolarHBondContact O-N 3.22Å; N441-N443 PolarHBondContact O-ND2 2.87Å; N443-Y466 PolarHBondContact N-O 3.01Å; N443-N467 WeakPolarHBondContact CA-OD1 3.36Å; N443-N467 WeakPolarHBondContact CB-OD1 3.36Å; N443-N467 PolarHBondContact O-OD1 3.22Å
444	Q	94.8	Very high	92.5	Very high	106 Å²	106	45 Å²	45	50%	0.495	22%	0.217	S	C	.	.			trans	-117.3	26.4	-173.6	-59.8	-172.2	-8.4	0	0	112.4	I421 A422 E446 N467	I421-Q444 CarbonylContact O-C 3.57Å; I421-Q444 VanDerWaalsContact O-C 3.27Å; I421-Q444 WeakPolarHBondContact O-CA 3.35Å; I421-Q444 PolarHBondContact O-N 2.87Å; A422-Q444 HydrophobicContact CB-CB 4.22Å; Q444-E446 PolarHBondContact O-N 2.88Å; Q444-N467 PolarHBondContact N-OD1 3.14Å
445	L	95.4	Very high	92.4	Very high	4 Å²	4	42.3 Å²	42.3	2%	0.021	21%	0.206	C	C	.	.			trans	-66.7	124.2	179.9	-58.8	175.2	0	0	0	110.5	I421 V424 L440 L464 N467 A468 I469	I421-L445 HydrophobicContact CG2-CD2 4.08Å; I421-L445 PolarHBondContact O-N 3.1Å; V424-L445 HydrophobicContact CG2-CD2 3.85Å; L440-L445 HydrophobicContact CB-CD1 4.29Å; L445-L464 HydrophobicContact CD1-CD2 3.75Å; L445-N467 HydrophobicContact CB-CB 4.31Å; L445-N467 WeakPolarHBondContact CB-OD1 3.5Å; L445-N467 WeakPolarHBondContact CG-OD1 3.22Å; L445-N467 PolarHBondContact N-OD1 2.88Å; L445-N467 VanDerWaalsContact N-OD1 3.12Å; L445-A468 CarbonylContact O-C 3.07Å; L445-A468 WeakPolarHBondContact O-CA 3.3Å; L445-A468 PolarHBondContact O-N 3.41Å; L445-I469 HydrophobicContact CB-CG1 4.18Å; L445-I469 WeakPolarHBondContact O-CA 3.1Å; L445-I469 VanDerWaalsContact O-CG1 3.32Å; L445-I469 WeakPolarHBondContact O-CG1 3.13Å; L445-I469 PolarHBondContact O-N 2.98Å
446	E	94.1	Very high	92.4	Very high	102 Å²	102	42.3 Å²	42.3	48%	0.477	21%	0.206	S	C	.	.			trans	-99.9	-24.4	-179.9	-61.6	-150.6	139.6	0	0	114.7	Q444 A468 I469 K470	Q444-E446 PolarHBondContact O-N 2.88Å; E446-A468 HydrophobicContact CG-CB 4.36Å; E446-I469 WeakPolarHBondContact O-CA 3.33Å; E446-K470 HydrophobicContact CB-CD 4.49Å; E446-K470 PolarHBondContact O-N 3.44Å; E446-K470 WeakPolarHBondContact OE1-CE 3.13Å; E446-K470 IonicContact OE1-NZ 2.6Å; E446-K470 PolarHBondContact OE1-NZ 3.49Å; E446-K470 IonicContact OE2-NZ 2.71Å; E446-K470 PolarHBondContact OE2-NZ 3.39Å
447	Q	94	Very high	92.5	Very high	75 Å²	75	40.8 Å²	40.8	35%	0.35	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	144.4	-175.9	-163.6	175	21.6	0	0	109.8	H449 E471	Q447-H449 PolarHBondContact OE1-CE1 2.88Å; Q447-H449 PolarHBondContact OE1-NE2 3.49Å; Q447-E471 WeakPolarHBondContact CA-O 3.35Å; Q447-E471 HydrophobicContact CG-CB 4.26Å; Q447-E471 PolarHBondContact NE2-OE2 3.15Å
448	L	95.2	Very high	92.7	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	140.8	173.8	-49.9	-177.7	0	0	0	111.3	M452 F453 L464 I469 E471 I472 L473 T476 F477 L488	L448-M452 HydrophobicContact CD2-CE 3.66Å; L448-M452 HydrophobicContact CD2-SD 4.45Å; L448-F453 HydrophobicContact CB-CE2 4.43Å; L448-F453 HydrophobicContact CD1-CE2 4.33Å; L448-F453 HydrophobicContact CD2-CZ 4.4Å; L448-L464 HydrophobicContact CD1-CD1 3.83Å; L448-L464 HydrophobicContact CD2-CD2 4.48Å; L448-I469 HydrophobicContact CD1-CD1 4.15Å; L448-I469 HydrophobicContact CD2-CD1 3.91Å; L448-I469 HydrophobicContact CD2-CG1 4.31Å; L448-I469 HydrophobicContact CG-CD1 4.13Å; L448-I469 HydrophobicContact CG-CG2 3.96Å; L448-E471 PolarHBondContact N-O 3.25Å; L448-I472 HydrophobicContact CB-CG1 4.3Å; L448-I472 HydrophobicContact CB-CG2 4.25Å; L448-I472 HydrophobicContact CD1-CD1 3.93Å; L448-I472 HydrophobicContact CD1-CG1 3.91Å; L448-I472 HydrophobicContact CG-CG1 4.2Å; L448-L473 PolarHBondContact O-N 3.42Å; L448-T476 HydrophobicContact CB-CG2 3.76Å; L448-T476 PolarHBondContact O-OG1 3.33Å; L448-F477 HydrophobicContact CD1-CE1 4.3Å; L448-F477 HydrophobicContact CD1-CZ 4.32Å; L448-L488 HydrophobicContact CD1-CD2 4.26Å
449	H	93.5	Very high	92.7	Very high	63 Å²	63	39 Å²	39	29%	0.292	21%	0.205	S	C	.	.			trans	-133.9	158.8	-177.5	-52.7	-87.1	0	0	0	111.6	Q447 E451 M452 L473	Q447-H449 PolarHBondContact OE1-CE1 2.88Å; Q447-H449 PolarHBondContact OE1-NE2 3.49Å; H449-E451 VanDerWaalsContact C-N 3.26Å; H449-E451 PolarHBondContact O-N 3.23Å; H449-M452 HydrophobicContact CB-CG 4.27Å; H449-M452 HydrophobicContact CB-SD 4.42Å; H449-M452 PolarHBondContact N-SD 3.08Å; H449-M452 VanDerWaalsContact N-SD 3.44Å; H449-M452 WeakPolarHBondContact O-CG 3.44Å; H449-L473 WeakPolarHBondContact ND1-CD1 3.46Å
450	P	91.9	Very high	92.6	Very high	39 Å²	39	39.3 Å²	39.3	25%	0.253	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-59.8	-34.5	175.5	-23	32.7	0	0	0	114	M452 F453 A474	P450-M452 VanDerWaalsContact C-N 3.28Å; P450-M452 PolarHBondContact O-N 3.12Å; P450-F453 PolarHBondContact O-N 3.48Å; P450-A474 VanDerWaalsContact CG-O 3.3Å; P450-A474 WeakPolarHBondContact CG-O 3.19Å
451	E	90.4	Very high	92.5	Very high	97 Å²	97	42.2 Å²	42.2	45%	0.453	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-74.1	-16.2	-168.5	-53.8	-150.4	140.9	0	0	114.4	K426 G427 H449	K426-E451 HydrophobicContact CB-CB 4.39Å; K426-E451 VanDerWaalsContact CD-OE2 3.23Å; K426-E451 WeakPolarHBondContact CD-OE2 3.42Å; K426-E451 WeakPolarHBondContact CE-OE1 3.31Å; K426-E451 WeakPolarHBondContact CE-OE2 3.18Å; K426-E451 HydrophobicContact CG-CB 4.15Å; K426-E451 IonicContact NZ-OE1 2.63Å; K426-E451 PolarHBondContact NZ-OE1 3.39Å; K426-E451 IonicContact NZ-OE2 2.74Å; K426-E451 PolarHBondContact NZ-OE2 3.06Å; G427-E451 PolarHBondContact N-O 2.96Å; H449-E451 VanDerWaalsContact C-N 3.26Å; H449-E451 PolarHBondContact O-N 3.23Å
452	M	92.6	Very high	92.7	Very high	9 Å²	9	40.7 Å²	40.7	4%	0.044	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-87.2	-26.3	179.7	43	-178.7	-77.4	0	0	113.3	V424 F429 L448 H449 P450	V424-M452 HydrophobicContact CB-CB 3.87Å; V424-M452 HydrophobicContact CB-CE 4.22Å; V424-M452 HydrophobicContact CG1-CB 3.63Å; V424-M452 HydrophobicContact CG2-CE 4.15Å; F429-M452 WeakPolarHBondContact CD2-O 3.32Å; L448-M452 HydrophobicContact CD2-CE 3.66Å; L448-M452 HydrophobicContact CD2-SD 4.45Å; H449-M452 HydrophobicContact CB-CG 4.27Å; H449-M452 HydrophobicContact CB-SD 4.42Å; H449-M452 PolarHBondContact N-SD 3.08Å; H449-M452 VanDerWaalsContact N-SD 3.44Å; H449-M452 WeakPolarHBondContact O-CG 3.44Å; P450-M452 VanDerWaalsContact C-N 3.28Å; P450-M452 PolarHBondContact O-N 3.12Å
453	F	93.4	Very high	93	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.206	C	C	.	.	S	Bend	trans	-99.1	7	176.5	-61.1	-58.2	0	0	0	114	F429 L438 L440 L448 P450 G455 L456 L462 L464 T476 F477 S479 M480	F429-F453 HydrophobicContact CD2-CD1 4.49Å; F429-F453 HydrophobicContact CE2-CD1 4.47Å; L438-F453 HydrophobicContact CD2-CE1 4.39Å; L440-F453 HydrophobicContact CD1-CE1 4.21Å; L448-F453 HydrophobicContact CB-CE2 4.43Å; L448-F453 HydrophobicContact CD1-CE2 4.33Å; L448-F453 HydrophobicContact CD2-CZ 4.4Å; P450-F453 PolarHBondContact O-N 3.48Å; F453-G455 PolarHBondContact O-N 3.47Å; F453-L456 HydrophobicContact CB-CD1 4.21Å; F453-L456 HydrophobicContact CD1-CD1 3.88Å; F453-L456 WeakPolarHBondContact O-CB 3.28Å; F453-L456 PolarHBondContact O-N 3.2Å; F453-L462 HydrophobicContact CE1-CD1 4.23Å; F453-L462 HydrophobicContact CE1-CD2 4.17Å; F453-L462 HydrophobicContact CZ-CD2 4.11Å; F453-L464 HydrophobicContact CZ-CD1 4.14Å; F453-T476 HydrophobicContact CD2-CG2 3.74Å; F453-T476 HydrophobicContact CE2-CG2 3.76Å; F453-F477 HydrophobicContact CE2-CE1 4.22Å; F453-S479 WeakPolarHBondContact O-CB 3.45Å; F453-M480 HydrophobicContact CB-CE 3.72Å; F453-M480 HydrophobicContact CB-SD 4.04Å; F453-M480 HydrophobicContact CD1-CE 4.2Å; F453-M480 HydrophobicContact CD1-SD 4.31Å; F453-M480 HydrophobicContact CD2-CE 3.84Å; F453-M480 HydrophobicContact CE2-CE 4.49Å; F453-M480 HydrophobicContact CG-CE 3.66Å; F453-M480 HydrophobicContact CG-SD 4.2Å
454	L	91.6	Very high	93	Very high	82 Å²	82	40.9 Å²	40.9	43%	0.429	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	128.7	178.3	-173.2	69.9	0	0	0	111	F429 A430	F429-L454 CarbonylContact C-O 3.3Å; F429-L454 VanDerWaalsContact C-O 3.3Å; A430-L454 VanDerWaalsContact CA-O 3.26Å; A430-L454 WeakPolarHBondContact CA-O 3.39Å; A430-L454 PolarHBondContact N-O 2.91Å
455	G	87.3	Confident	92.7	Very high	15 Å²	15	36.8 Å²	36.8	16%	0.155	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	98.8	-12.7	177.7	0	0	0	0	0	116	F453 T457	F453-G455 PolarHBondContact O-N 3.47Å; G455-T457 PolarHBondContact O-N 3.01Å
456	L	93.6	Very high	92.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.199	C	C	.	.			trans	-77.6	46.2	-175.5	-69.2	-179.7	0	0	0	114.6	F429 L432 L435 L438 F453 N458 L459 S479 M480	F429-L456 HydrophobicContact CB-CD1 4.12Å; F429-L456 HydrophobicContact CB-CD2 3.71Å; F429-L456 HydrophobicContact CB-CG 3.77Å; F429-L456 HydrophobicContact CD2-CD1 3.77Å; F429-L456 HydrophobicContact CD2-CG 4.38Å; F429-L456 HydrophobicContact CG-CD1 4.21Å; F429-L456 HydrophobicContact CG-CD2 4.31Å; F429-L456 HydrophobicContact CG-CG 4.39Å; L432-L456 HydrophobicContact CB-CD2 4.24Å; L435-L456 HydrophobicContact CB-CD2 4.03Å; L435-L456 HydrophobicContact CD2-CD2 3.64Å; L435-L456 HydrophobicContact CG-CD2 4.45Å; L438-L456 HydrophobicContact CD2-CD1 3.75Å; F453-L456 HydrophobicContact CB-CD1 4.21Å; F453-L456 HydrophobicContact CD1-CD1 3.88Å; F453-L456 WeakPolarHBondContact O-CB 3.28Å; F453-L456 PolarHBondContact O-N 3.2Å; L456-N458 VanDerWaalsContact C-N 3.29Å; L456-N458 PolarHBondContact O-N 3.09Å; L456-L459 HydrophobicContact CB-CB 4.18Å; L456-L459 HydrophobicContact CD1-CD2 4.36Å; L456-L459 WeakPolarHBondContact O-CB 3.36Å; L456-L459 PolarHBondContact O-N 3.07Å; L456-L459 VanDerWaalsContact O-N 3.09Å; L456-S479 CarbonylContact C-O 3.58Å; L456-M480 HydrophobicContact CB-CG 3.66Å; L456-M480 HydrophobicContact CB-SD 4.03Å; L456-M480 HydrophobicContact CD1-SD 3.97Å; L456-M480 WeakPolarHBondContact O-CG 3.44Å
457	T	91.8	Very high	92.4	Very high	63 Å²	63	36.4 Å²	36.4	39%	0.387	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-27.5	-168	56.1	0	0	0	0	115	G455 N482	G455-T457 PolarHBondContact O-N 3.01Å; T457-N482 PolarHBondContact O-ND2 2.98Å
458	N	92.8	Very high	92.4	Very high	61 Å²	61	34.4 Å²	34.4	33%	0.326	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	8	178.3	-73.5	-71.3	0	0	0	114.2	T433 L435 L456 Q460	T433-N458 WeakPolarHBondContact O-CB 3.36Å; T433-N458 PolarHBondContact O-ND2 3.35Å; L435-N458 CarbonylContact O-C 3.49Å; L456-N458 VanDerWaalsContact C-N 3.29Å; L456-N458 PolarHBondContact O-N 3.09Å; N458-Q460 PolarHBondContact O-N 3.09Å
459	L	95.8	Very high	92.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.176	C	C	.	.			trans	-66.8	131.8	-177.1	-158.8	82.5	0	0	0	111.2	L435 L438 L456 L462 M480 N482 L483	L435-L459 HydrophobicContact CB-CD1 4.36Å; L435-L459 HydrophobicContact CD2-CD1 3.94Å; L435-L459 HydrophobicContact CG-CD1 4Å; L435-L459 VanDerWaalsContact O-CA 3.23Å; L435-L459 WeakPolarHBondContact O-CA 3.47Å; L435-L459 PolarHBondContact O-N 2.77Å; L435-L459 VanDerWaalsContact O-N 3.11Å; L438-L459 HydrophobicContact CB-CD1 3.75Å; L438-L459 HydrophobicContact CB-CD2 4.13Å; L456-L459 HydrophobicContact CB-CB 4.18Å; L456-L459 HydrophobicContact CD1-CD2 4.36Å; L456-L459 WeakPolarHBondContact O-CB 3.36Å; L456-L459 PolarHBondContact O-N 3.07Å; L456-L459 VanDerWaalsContact O-N 3.09Å; L459-L462 HydrophobicContact CD2-CB 3.93Å; L459-L462 HydrophobicContact CD2-CD1 4.25Å; L459-L462 HydrophobicContact CD2-CD2 4.44Å; L459-L462 HydrophobicContact CD2-CG 4.44Å; L459-M480 HydrophobicContact CB-CG 4.23Å; L459-M480 HydrophobicContact CB-SD 4.24Å; L459-M480 HydrophobicContact CD2-CG 4.5Å; L459-M480 HydrophobicContact CD2-SD 3.44Å; L459-M480 WeakPolarHBondContact CD2-SD 3.46Å; L459-M480 HydrophobicContact CG-SD 4.46Å; L459-N482 CarbonylContact O-C 3.37Å; L459-L483 HydrophobicContact CD2-CD1 4.25Å; L459-L483 VanDerWaalsContact O-CA 3.31Å; L459-L483 WeakPolarHBondContact O-CA 3.48Å; L459-L483 PolarHBondContact O-N 3.11Å; L459-L483 VanDerWaalsContact O-N 3.11Å
460	Q	90.1	Very high	92.5	Very high	41 Å²	41	36.3 Å²	36.3	19%	0.192	18%	0.184	C	C	.	.			trans	-115.2	-31.7	-178.1	-71.1	172.6	-31.9	0	0	112.1	R436 N458 Q484 L485	R436-Q460 PolarHBondContact O-N 3.37Å; N458-Q460 PolarHBondContact O-N 3.09Å; Q460-Q484 PolarHBondContact O-N 3.08Å; Q460-L485 PolarHBondContact O-N 3.49Å
461	Y	91.1	Very high	92.6	Very high	61 Å²	61	39 Å²	39	24%	0.239	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	124	-176.2	-51.2	-97.1	0	0	0	110.7	R436 R437 L438 L485	R436-Y461 PolarHBondContact O-N 3.32Å; R437-Y461 HydrophobicContact CG-CD2 3.66Å; R437-Y461 HydrophobicContact CG-CE2 4.48Å; R437-Y461 HydrophobicContact CG-CG 4.19Å; L438-Y461 PolarHBondContact N-O 2.9Å; Y461-L485 HydrophobicContact CD1-CB 3.74Å; Y461-L485 HydrophobicContact CD1-CD1 4.11Å; Y461-L485 HydrophobicContact CD1-CD2 4.25Å; Y461-L485 HydrophobicContact CD1-CG 4.25Å; Y461-L485 HydrophobicContact CE1-CB 4.33Å; Y461-L485 HydrophobicContact CE1-CD1 4.47Å
462	L	96.3	Very high	92.9	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	116.5	178.5	-178.3	53.6	0	0	0	110.8	L438 F453 L459 L464 F477 M480 L483 L485 L486 Y487	L438-L462 HydrophobicContact CB-CD1 4.12Å; L438-L462 HydrophobicContact CD2-CD1 4Å; L438-L462 HydrophobicContact CG-CD1 4.03Å; F453-L462 HydrophobicContact CE1-CD1 4.23Å; F453-L462 HydrophobicContact CE1-CD2 4.17Å; F453-L462 HydrophobicContact CZ-CD2 4.11Å; L459-L462 HydrophobicContact CD2-CB 3.93Å; L459-L462 HydrophobicContact CD2-CD1 4.25Å; L459-L462 HydrophobicContact CD2-CD2 4.44Å; L459-L462 HydrophobicContact CD2-CG 4.44Å; L462-L464 HydrophobicContact CD1-CD1 4.13Å; L462-L464 HydrophobicContact CD1-CG 4.1Å; L462-L464 HydrophobicContact CD2-CD1 3.84Å; L462-L464 HydrophobicContact CG-CD1 3.76Å; L462-L464 HydrophobicContact CG-CG 4.1Å; L462-F477 HydrophobicContact CD2-CE1 4.4Å; L462-M480 HydrophobicContact CD2-CE 3.85Å; L462-M480 HydrophobicContact CD2-SD 4.16Å; L462-L483 HydrophobicContact CB-CD1 3.76Å; L462-L485 PolarHBondContact N-O 3.4Å; L462-L486 HydrophobicContact CB-CD1 4.15Å; L462-L486 HydrophobicContact CD2-CD1 4Å; L462-L486 HydrophobicContact CG-CD1 4.05Å; L462-Y487 PolarHBondContact O-N 3.04Å
463	Y	92.6	Very high	92.9	Very high	41 Å²	41	36.9 Å²	36.9	16%	0.161	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	115.7	-179.5	-60.7	-88.8	0	0	0	109.9	L438 Y439 L440 N441 E465 L485 Y487	L438-Y463 PolarHBondContact O-N 3.45Å; Y439-Y463 AromaticContact CD1-CD2 3.36Å; Y439-Y463 HydrophobicContact CD1-CD2 3.36Å; Y439-Y463 AromaticContact CD1-CE2 3.92Å; Y439-Y463 HydrophobicContact CD1-CE2 3.92Å; Y439-Y463 AromaticContact CD1-CG 3.71Å; Y439-Y463 HydrophobicContact CD1-CG 3.71Å; Y439-Y463 HydrophobicContact CD2-CD2 4.48Å; Y439-Y463 AromaticContact CE1-CD2 3.36Å; Y439-Y463 HydrophobicContact CE1-CD2 3.36Å; Y439-Y463 AromaticContact CE1-CE2 3.38Å; Y439-Y463 HydrophobicContact CE1-CE2 3.38Å; Y439-Y463 AromaticContact CE1-CG 3.96Å; Y439-Y463 HydrophobicContact CE1-CG 3.96Å; Y439-Y463 HydrophobicContact CE2-CD2 4.47Å; Y439-Y463 HydrophobicContact CE2-CE2 4.47Å; Y439-Y463 AromaticContact CG-CD2 3.95Å; Y439-Y463 HydrophobicContact CG-CD2 3.95Å; Y439-Y463 HydrophobicContact CG-CG 4.49Å; Y439-Y463 AromaticContact CZ-CD2 3.94Å; Y439-Y463 AromaticContact CZ-CE2 3.7Å; L440-Y463 CarbonylContact C-O 3.2Å; L440-Y463 WeakPolarHBondContact CA-O 3.41Å; L440-Y463 PolarHBondContact N-O 3.39Å; N441-Y463 PolarHBondContact N-O 3.16Å; Y463-E465 WeakPolarHBondContact CA-OE2 3.25Å; Y463-E465 WeakPolarHBondContact CB-OE2 3.07Å; Y463-L485 HydrophobicContact CD1-CD2 4.32Å; Y463-L485 HydrophobicContact CE1-CD2 3.69Å; Y463-L485 HydrophobicContact CE2-CD2 4.3Å; Y463-Y487 HydrophobicContact CD1-CD1 4.4Å; Y463-Y487 HydrophobicContact CD1-CG 4.25Å; Y463-Y487 HydrophobicContact CE1-CG 4.47Å
464	L	94.7	Very high	92.9	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.208	C	C	.	.			trans	-132.2	10.3	-176.4	-73	163	0	0	0	112	L440 L445 L448 F453 L462 N467 I469 L486 Y487 L488 N491	L440-L464 HydrophobicContact CB-CD2 3.68Å; L440-L464 HydrophobicContact CD1-CD2 4.08Å; L445-L464 HydrophobicContact CD1-CD2 3.75Å; L448-L464 HydrophobicContact CD1-CD1 3.83Å; L448-L464 HydrophobicContact CD2-CD2 4.48Å; F453-L464 HydrophobicContact CZ-CD1 4.14Å; L462-L464 HydrophobicContact CD1-CD1 4.13Å; L462-L464 HydrophobicContact CD1-CG 4.1Å; L462-L464 HydrophobicContact CD2-CD1 3.84Å; L462-L464 HydrophobicContact CG-CD1 3.76Å; L462-L464 HydrophobicContact CG-CG 4.1Å; L464-N467 PolarHBondContact O-ND2 3.44Å; L464-I469 HydrophobicContact CB-CD1 4.17Å; L464-I469 HydrophobicContact CD2-CD1 4.48Å; L464-L486 HydrophobicContact CD1-CD1 4.35Å; L464-Y487 CarbonylContact C-O 3.54Å; L464-Y487 WeakPolarHBondContact CA-O 3.18Å; L464-Y487 WeakPolarHBondContact CB-O 3.3Å; L464-Y487 PolarHBondContact N-O 3.22Å; L464-L488 HydrophobicContact CB-CD2 3.86Å; L464-L488 HydrophobicContact CD1-CD2 3.93Å; L464-N491 PolarHBondContact O-ND2 3.38Å
465	E	87.9	Confident	92.9	Very high	19 Å²	19	38.5 Å²	38.5	9%	0.089	21%	0.206	C	C	.	.			trans	-62.3	153.3	176.6	68.1	-78.6	-179.3	0	0	112.9	N441 G442 Y463 N467 Y487 N489	N441-E465 CarbonylContact C-O 3.44Å; N441-E465 WeakPolarHBondContact CA-O 3.33Å; N441-E465 HydrophobicContact CB-CG 3.85Å; N441-E465 VanDerWaalsContact CB-O 3.3Å; N441-E465 WeakPolarHBondContact CB-O 3.27Å; N441-E465 VanDerWaalsContact CB-OE1 3.22Å; N441-E465 WeakPolarHBondContact CB-OE1 3.23Å; N441-E465 PolarHBondContact ND2-OE1 3.28Å; G442-E465 PolarHBondContact N-O 2.67Å; Y463-E465 WeakPolarHBondContact CA-OE2 3.25Å; Y463-E465 WeakPolarHBondContact CB-OE2 3.07Å; E465-N467 PolarHBondContact O-N 3.23Å; E465-N467 PolarHBondContact O-ND2 3.05Å; E465-Y487 PolarHBondContact N-O 3.48Å; E465-Y487 VanDerWaalsContact OE2-CB 3.3Å; E465-Y487 WeakPolarHBondContact OE2-CB 3.38Å; E465-N489 WeakPolarHBondContact CA-O 3.48Å; E465-N489 VanDerWaalsContact CB-O 3.23Å; E465-N489 WeakPolarHBondContact CB-O 3.44Å; E465-N489 WeakPolarHBondContact CB-OD1 2.83Å
466	Y	89.6	Confident	93.2	Very high	84 Å²	84	37.8 Å²	37.8	33%	0.329	20%	0.199	S	C	.	.	S	Bend	trans	54.8	49.8	-175.2	-56.6	-78.7	0	0	0	113.2	G442 N443 N489 N490 L834	G442-Y466 CarbonylContact C-O 3.39Å; G442-Y466 WeakPolarHBondContact CA-O 3.11Å; G442-Y466 PolarHBondContact N-O 3.4Å; N443-Y466 PolarHBondContact N-O 3.01Å; Y466-N489 PolarHBondContact N-O 3.04Å; Y466-N490 WeakPolarHBondContact CA-O 3.44Å; Y466-N490 HydrophobicContact CD1-CB 3.68Å; Y466-N490 HydrophobicContact CE1-CB 3.35Å; Y466-N490 VanDerWaalsContact CE1-CG 3.4Å; Y466-N490 HydrophobicContact CE2-CB 4.36Å; Y466-N490 HydrophobicContact CG-CB 4.31Å; Y466-N490 VanDerWaalsContact CZ-ND2 3.26Å; Y466-N490 PolarHBondContact N-O 3.3Å; Y466-N490 PolarHBondContact OH-ND2 3.18Å; Y466-N490 PolarHBondContact OH-OD1 2.87Å; Y466-L834 HydrophobicContact CE1-CD1 4.47Å; Y466-L834 HydrophobicContact CE2-CD1 4.34Å; Y466-L834 HydrophobicContact CE2-CD2 3.77Å; Y466-L834 HydrophobicContact CE2-CG 4.31Å; Y466-L834 WeakPolarHBondContact OH-CD2 3.48Å; Y466-L834 WeakPolarHBondContact OH-CG 3.3Å
467	N	93.4	Very high	93.3	Very high	14 Å²	14	37.8 Å²	37.8	8%	0.075	20%	0.199	C	C	.	.	S	Bend	trans	-116.1	-175.8	165.7	-83.3	-91.9	0	0	0	109.6	L440 N443 Q444 L445 L464 E465 I469 N491	L440-N467 PolarHBondContact O-ND2 3.19Å; N443-N467 WeakPolarHBondContact CA-OD1 3.36Å; N443-N467 WeakPolarHBondContact CB-OD1 3.36Å; N443-N467 PolarHBondContact O-OD1 3.22Å; Q444-N467 PolarHBondContact N-OD1 3.14Å; L445-N467 HydrophobicContact CB-CB 4.31Å; L445-N467 WeakPolarHBondContact CB-OD1 3.5Å; L445-N467 WeakPolarHBondContact CG-OD1 3.22Å; L445-N467 PolarHBondContact N-OD1 2.88Å; L445-N467 VanDerWaalsContact N-OD1 3.12Å; L464-N467 PolarHBondContact O-ND2 3.44Å; E465-N467 PolarHBondContact O-N 3.23Å; E465-N467 PolarHBondContact O-ND2 3.05Å; N467-I469 HydrophobicContact CB-CD1 3.99Å; N467-I469 HydrophobicContact CB-CG1 3.81Å; N467-N491 WeakPolarHBondContact CA-OD1 3.46Å; N467-N491 WeakPolarHBondContact CB-OD1 3.39Å; N467-N491 PolarHBondContact N-OD1 2.9Å; N467-N491 PolarHBondContact O-OD1 3.21Å; N467-N491 VanDerWaalsContact O-OD1 3.08Å
468	A	95	Very high	93.3	Very high	34 Å²	34	38.7 Å²	38.7	28%	0.281	20%	0.201	S	C	.	.			trans	-105	28	178.6	0	0	0	0	0	112.2	L445 E446 K470 V492	L445-A468 CarbonylContact O-C 3.07Å; L445-A468 WeakPolarHBondContact O-CA 3.3Å; L445-A468 PolarHBondContact O-N 3.41Å; E446-A468 HydrophobicContact CG-CB 4.36Å; A468-K470 PolarHBondContact O-N 2.99Å; A468-V492 WeakPolarHBondContact O-CG2 3.42Å
469	I	96.9	Very high	93.1	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.195	C	C	.	.			trans	-69.7	119.5	-166.3	-53.3	163.2	0	0	0	110.2	L445 E446 L448 L464 N467 I472 L488 N491 V492 L493	L445-I469 HydrophobicContact CB-CG1 4.18Å; L445-I469 WeakPolarHBondContact O-CA 3.1Å; L445-I469 VanDerWaalsContact O-CG1 3.32Å; L445-I469 WeakPolarHBondContact O-CG1 3.13Å; L445-I469 PolarHBondContact O-N 2.98Å; E446-I469 WeakPolarHBondContact O-CA 3.33Å; L448-I469 HydrophobicContact CD1-CD1 4.15Å; L448-I469 HydrophobicContact CD2-CD1 3.91Å; L448-I469 HydrophobicContact CD2-CG1 4.31Å; L448-I469 HydrophobicContact CG-CD1 4.13Å; L448-I469 HydrophobicContact CG-CG2 3.96Å; L464-I469 HydrophobicContact CB-CD1 4.17Å; L464-I469 HydrophobicContact CD2-CD1 4.48Å; N467-I469 HydrophobicContact CB-CD1 3.99Å; N467-I469 HydrophobicContact CB-CG1 3.81Å; I469-I472 HydrophobicContact CG2-CG1 4.27Å; I469-L488 HydrophobicContact CD1-CD2 4.1Å; I469-N491 HydrophobicContact CB-CB 4.26Å; I469-N491 VanDerWaalsContact CB-OD1 3.31Å; I469-N491 WeakPolarHBondContact CB-OD1 3.5Å; I469-N491 WeakPolarHBondContact CD1-OD1 3.39Å; I469-N491 WeakPolarHBondContact CG1-OD1 3.49Å; I469-N491 PolarHBondContact N-OD1 3.12Å; I469-V492 CarbonylContact O-C 3.44Å; I469-V492 WeakPolarHBondContact O-CA 3.18Å; I469-V492 WeakPolarHBondContact O-CG2 3.35Å; I469-V492 PolarHBondContact O-N 2.78Å; I469-L493 HydrophobicContact CB-CD2 4.24Å; I469-L493 HydrophobicContact CG2-CD2 3.64Å; I469-L493 PolarHBondContact O-N 2.93Å; I469-L493 VanDerWaalsContact O-N 3.09Å
470	K	94.1	Very high	93.1	Very high	103 Å²	103	37 Å²	37	45%	0.448	20%	0.195	S	C	.	.			trans	-95.5	-37.3	-178.8	-63	159.8	-165.6	176.6	0	112	E446 A468 V492	E446-K470 HydrophobicContact CB-CD 4.49Å; E446-K470 PolarHBondContact O-N 3.44Å; E446-K470 WeakPolarHBondContact OE1-CE 3.13Å; E446-K470 IonicContact OE1-NZ 2.6Å; E446-K470 PolarHBondContact OE1-NZ 3.49Å; E446-K470 IonicContact OE2-NZ 2.71Å; E446-K470 PolarHBondContact OE2-NZ 3.39Å; A468-K470 PolarHBondContact O-N 2.99Å; K470-V492 HydrophobicContact CB-CG2 4.35Å; K470-V492 HydrophobicContact CG-CG2 3.56Å
471	E	93.7	Very high	93.2	Very high	95 Å²	95	38.1 Å²	38.1	44%	0.444	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	148.8	-174.9	-178.8	178.8	-142.1	0	0	111.4	Q447 L448 L473	Q447-E471 WeakPolarHBondContact CA-O 3.35Å; Q447-E471 HydrophobicContact CG-CB 4.26Å; Q447-E471 PolarHBondContact NE2-OE2 3.15Å; L448-E471 PolarHBondContact N-O 3.25Å; E471-L473 HydrophobicContact CG-CD2 4.3Å
472	I	95.9	Very high	93.2	Very high	3 Å²	3	38.6 Å²	38.6	2%	0.015	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	125.1	169.9	-57.1	-178.1	0	0	0	106.1	L448 I469 T476 F477 L488 L493 L496 P497 I500	L448-I472 HydrophobicContact CB-CG1 4.3Å; L448-I472 HydrophobicContact CB-CG2 4.25Å; L448-I472 HydrophobicContact CD1-CD1 3.93Å; L448-I472 HydrophobicContact CD1-CG1 3.91Å; L448-I472 HydrophobicContact CG-CG1 4.2Å; I469-I472 HydrophobicContact CG2-CG1 4.27Å; I472-T476 HydrophobicContact CG2-CG2 3.99Å; I472-F477 HydrophobicContact CD1-CZ 4.11Å; I472-F477 HydrophobicContact CG2-CE2 4.34Å; I472-F477 HydrophobicContact CG2-CZ 4.19Å; I472-L488 HydrophobicContact CD1-CD1 3.8Å; I472-L488 HydrophobicContact CD1-CD2 4.2Å; I472-L493 HydrophobicContact CD1-CD1 4.12Å; I472-L493 HydrophobicContact CD1-CD2 4.07Å; I472-L493 HydrophobicContact CG1-CD2 3.8Å; I472-L496 HydrophobicContact CD1-CD2 3.9Å; I472-P497 VanDerWaalsContact O-CD 3.32Å; I472-P497 WeakPolarHBondContact O-CD 3.46Å; I472-P497 VanDerWaalsContact O-CG 3.28Å; I472-P497 WeakPolarHBondContact O-CG 3.34Å; I472-I500 HydrophobicContact CG2-CD1 4.01Å; I472-I500 HydrophobicContact CG2-CG1 4.31Å
473	L	94.3	Very high	93.2	Very high	59 Å²	59	38.7 Å²	38.7	31%	0.309	21%	0.213	S	C	.	.			trans	-74.5	156.9	176.4	-65.4	-163.3	0	0	0	112	L448 H449 E471 T476 I500	L448-L473 PolarHBondContact O-N 3.42Å; H449-L473 WeakPolarHBondContact ND1-CD1 3.46Å; E471-L473 HydrophobicContact CG-CD2 4.3Å; L473-T476 VanDerWaalsContact O-CB 3.31Å; L473-T476 WeakPolarHBondContact O-CB 3.3Å; L473-T476 PolarHBondContact O-N 2.84Å; L473-T476 PolarHBondContact O-OG1 3.44Å; L473-I500 WeakPolarHBondContact O-CD1 3.43Å
474	A	91.9	Very high	93	Very high	58 Å²	58	40.5 Å²	40.5	48%	0.479	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	149.9	170.3	0	0	0	0	0	111.3	P450 T476 P497	P450-A474 VanDerWaalsContact CG-O 3.3Å; P450-A474 WeakPolarHBondContact CG-O 3.19Å; A474-T476 PolarHBondContact O-N 2.89Å; A474-P497 HydrophobicContact CB-CB 4.17Å
475	S	91.9	Very high	92.8	Very high	58 Å²	58	41.4 Å²	41.4	41%	0.406	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	14	-176.1	-71.6	0	0	0	0	117	F477 D478	S475-F477 VanDerWaalsContact C-N 3.27Å; S475-F477 PolarHBondContact O-N 2.76Å; S475-D478 VanDerWaalsContact CA-CG 3.47Å; S475-D478 VanDerWaalsContact CA-OD1 3.26Å; S475-D478 WeakPolarHBondContact CA-OD1 3.33Å; S475-D478 WeakPolarHBondContact CA-OD2 3.46Å; S475-D478 WeakPolarHBondContact CB-OD2 3.36Å; S475-D478 PolarHBondContact O-N 2.94Å; S475-D478 PolarHBondContact OG-OD2 3.29Å
476	T	94.4	Very high	93.2	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-31.4	-177	-69	0	0	0	0	113.6	L448 F453 I472 L473 A474	L448-T476 HydrophobicContact CB-CG2 3.76Å; L448-T476 PolarHBondContact O-OG1 3.33Å; F453-T476 HydrophobicContact CD2-CG2 3.74Å; F453-T476 HydrophobicContact CE2-CG2 3.76Å; I472-T476 HydrophobicContact CG2-CG2 3.99Å; L473-T476 VanDerWaalsContact O-CB 3.31Å; L473-T476 WeakPolarHBondContact O-CB 3.3Å; L473-T476 PolarHBondContact O-N 2.84Å; L473-T476 PolarHBondContact O-OG1 3.44Å; A474-T476 PolarHBondContact O-N 2.89Å
477	F	94.6	Very high	93.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-3.8	-176.2	-54.8	-44.4	0	0	0	114.4	L448 F453 L462 I472 S475 S479 M480 L486 L488 I500 F501 I504	L448-F477 HydrophobicContact CD1-CE1 4.3Å; L448-F477 HydrophobicContact CD1-CZ 4.32Å; F453-F477 HydrophobicContact CE2-CE1 4.22Å; L462-F477 HydrophobicContact CD2-CE1 4.4Å; I472-F477 HydrophobicContact CD1-CZ 4.11Å; I472-F477 HydrophobicContact CG2-CE2 4.34Å; I472-F477 HydrophobicContact CG2-CZ 4.19Å; S475-F477 VanDerWaalsContact C-N 3.27Å; S475-F477 PolarHBondContact O-N 2.76Å; F477-S479 PolarHBondContact O-N 3.27Å; F477-M480 HydrophobicContact CB-CE 4.28Å; F477-M480 HydrophobicContact CD1-CE 3.61Å; F477-M480 HydrophobicContact CE1-CE 4.49Å; F477-M480 HydrophobicContact CG-CE 4.4Å; F477-M480 PolarHBondContact O-N 3.04Å; F477-L486 HydrophobicContact CD2-CD2 4.24Å; F477-L486 HydrophobicContact CE1-CD2 4.48Å; F477-L486 HydrophobicContact CE2-CD2 3.65Å; F477-L486 HydrophobicContact CZ-CD1 4.35Å; F477-L486 HydrophobicContact CZ-CD2 3.78Å; F477-L488 HydrophobicContact CZ-CD1 4.47Å; F477-I500 HydrophobicContact CD2-CD1 3.85Å; F477-I500 HydrophobicContact CD2-CG1 3.73Å; F477-I500 HydrophobicContact CE2-CD1 4.2Å; F477-I500 HydrophobicContact CE2-CG1 3.86Å; F477-I500 HydrophobicContact CG-CD1 4.46Å; F477-F501 HydrophobicContact CD2-CD1 4.12Å; F477-F501 AromaticContact CD2-CE1 3.86Å; F477-F501 HydrophobicContact CD2-CE1 3.86Å; F477-F501 AromaticContact CE2-CE1 3.8Å; F477-F501 HydrophobicContact CE2-CE1 3.8Å; F477-I504 HydrophobicContact CB-CD1 3.43Å; F477-I504 VanDerWaalsContact CB-CD1 3.43Å
478	D	91.6	Very high	93.3	Very high	81 Å²	81	37.9 Å²	37.9	43%	0.433	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-23.1	-176	-60.3	15.8	0	0	0	113.4	S475 M480	S475-D478 VanDerWaalsContact CA-CG 3.47Å; S475-D478 VanDerWaalsContact CA-OD1 3.26Å; S475-D478 WeakPolarHBondContact CA-OD1 3.33Å; S475-D478 WeakPolarHBondContact CA-OD2 3.46Å; S475-D478 WeakPolarHBondContact CB-OD2 3.36Å; S475-D478 PolarHBondContact O-N 2.94Å; S475-D478 PolarHBondContact OG-OD2 3.29Å; D478-M480 PolarHBondContact O-N 3.02Å
479	S	89.9	Confident	93.1	Very high	27 Å²	27	36.9 Å²	36.9	19%	0.189	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-8	174.6	-66.9	0	0	0	0	114.1	F453 L456 F477 P481	F453-S479 WeakPolarHBondContact O-CB 3.45Å; L456-S479 CarbonylContact C-O 3.58Å; F477-S479 PolarHBondContact O-N 3.27Å; S479-P481 VanDerWaalsContact C-CD 3.42Å; S479-P481 WeakPolarHBondContact O-CD 3.18Å
480	M	94.3	Very high	92.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.211	C	C	.	.			trans	-124.7	62.1	-172	-61.2	178.6	-71.2	0	0	111.6	F453 L456 L459 L462 F477 D478 N482 L483	F453-M480 HydrophobicContact CB-CE 3.72Å; F453-M480 HydrophobicContact CB-SD 4.04Å; F453-M480 HydrophobicContact CD1-CE 4.2Å; F453-M480 HydrophobicContact CD1-SD 4.31Å; F453-M480 HydrophobicContact CD2-CE 3.84Å; F453-M480 HydrophobicContact CE2-CE 4.49Å; F453-M480 HydrophobicContact CG-CE 3.66Å; F453-M480 HydrophobicContact CG-SD 4.2Å; L456-M480 HydrophobicContact CB-CG 3.66Å; L456-M480 HydrophobicContact CB-SD 4.03Å; L456-M480 HydrophobicContact CD1-SD 3.97Å; L456-M480 WeakPolarHBondContact O-CG 3.44Å; L459-M480 HydrophobicContact CB-CG 4.23Å; L459-M480 HydrophobicContact CB-SD 4.24Å; L459-M480 HydrophobicContact CD2-CG 4.5Å; L459-M480 HydrophobicContact CD2-SD 3.44Å; L459-M480 WeakPolarHBondContact CD2-SD 3.46Å; L459-M480 HydrophobicContact CG-SD 4.46Å; L462-M480 HydrophobicContact CD2-CE 3.85Å; L462-M480 HydrophobicContact CD2-SD 4.16Å; F477-M480 HydrophobicContact CB-CE 4.28Å; F477-M480 HydrophobicContact CD1-CE 3.61Å; F477-M480 HydrophobicContact CE1-CE 4.49Å; F477-M480 HydrophobicContact CG-CE 4.4Å; F477-M480 PolarHBondContact O-N 3.04Å; D478-M480 PolarHBondContact O-N 3.02Å; M480-N482 PolarHBondContact O-N 2.99Å; M480-L483 HydrophobicContact CB-CB 4.24Å; M480-L483 WeakPolarHBondContact O-CB 3.46Å; M480-L483 PolarHBondContact O-N 3.02Å; M480-L483 VanDerWaalsContact O-N 3.12Å
481	P	92.3	Very high	92.8	Very high	64 Å²	64	34 Å²	34	42%	0.416	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-8.3	-173.6	29.8	-37.9	0	0	0	114.6	S479 P505	S479-P481 VanDerWaalsContact C-CD 3.42Å; S479-P481 WeakPolarHBondContact O-CD 3.18Å; P481-P505 WeakPolarHBondContact O-CD 3.36Å
482	N	92.2	Very high	92.9	Very high	71 Å²	71	31.7 Å²	31.7	38%	0.38	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	7.3	177.7	-70.8	-72.1	0	0	0	113.4	T457 L459 M480 Q484	T457-N482 PolarHBondContact O-ND2 2.98Å; L459-N482 CarbonylContact O-C 3.37Å; M480-N482 PolarHBondContact O-N 2.99Å; N482-Q484 PolarHBondContact O-N 2.92Å
483	L	95.3	Very high	92.9	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.01	18%	0.183	C	C	.	.			trans	-67.2	121.7	-174.5	-173.3	69.9	0	0	0	111.4	L459 L462 M480 L486 I504 P505 L506	L459-L483 HydrophobicContact CD2-CD1 4.25Å; L459-L483 VanDerWaalsContact O-CA 3.31Å; L459-L483 WeakPolarHBondContact O-CA 3.48Å; L459-L483 PolarHBondContact O-N 3.11Å; L459-L483 VanDerWaalsContact O-N 3.11Å; L462-L483 HydrophobicContact CB-CD1 3.76Å; M480-L483 HydrophobicContact CB-CB 4.24Å; M480-L483 WeakPolarHBondContact O-CB 3.46Å; M480-L483 PolarHBondContact O-N 3.02Å; M480-L483 VanDerWaalsContact O-N 3.12Å; L483-L486 HydrophobicContact CD2-CB 4.35Å; L483-I504 HydrophobicContact CB-CG2 3.82Å; L483-I504 VanDerWaalsContact O-CG2 3.29Å; L483-I504 WeakPolarHBondContact O-CG2 3.43Å; L483-P505 CarbonylContact O-C 3.55Å; L483-L506 HydrophobicContact CD2-CD1 4.32Å; L483-L506 HydrophobicContact CG-CD1 4.09Å
484	Q	89.8	Confident	92.9	Very high	78 Å²	78	36.8 Å²	36.8	36%	0.364	20%	0.198	S	C	.	.			trans	-108.8	-30.7	-177.6	-69	176.4	-9.6	0	0	112.5	Q460 N482 A507 R508	Q460-Q484 PolarHBondContact O-N 3.08Å; N482-Q484 PolarHBondContact O-N 2.92Å; Q484-A507 WeakPolarHBondContact O-CA 3.49Å; Q484-A507 PolarHBondContact O-N 3.11Å; Q484-R508 PolarHBondContact O-N 2.96Å
485	L	90.3	Very high	92.9	Very high	20 Å²	20	37.4 Å²	37.4	11%	0.105	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	126.4	-176.1	-179.1	148.1	0	0	0	110.7	Q460 Y461 L462 Y463 Y487 R508	Q460-L485 PolarHBondContact O-N 3.49Å; Y461-L485 HydrophobicContact CD1-CB 3.74Å; Y461-L485 HydrophobicContact CD1-CD1 4.11Å; Y461-L485 HydrophobicContact CD1-CD2 4.25Å; Y461-L485 HydrophobicContact CD1-CG 4.25Å; Y461-L485 HydrophobicContact CE1-CB 4.33Å; Y461-L485 HydrophobicContact CE1-CD1 4.47Å; L462-L485 PolarHBondContact N-O 3.4Å; Y463-L485 HydrophobicContact CD1-CD2 4.32Å; Y463-L485 HydrophobicContact CE1-CD2 3.69Å; Y463-L485 HydrophobicContact CE2-CD2 4.3Å; L485-Y487 HydrophobicContact CD1-CD2 4.43Å; L485-Y487 HydrophobicContact CD1-CE2 3.8Å; L485-Y487 HydrophobicContact CD2-CD2 3.48Å; L485-Y487 VanDerWaalsContact CD2-CD2 3.48Å; L485-Y487 HydrophobicContact CD2-CE2 3.7Å; L485-Y487 HydrophobicContact CD2-CG 4.35Å; L485-Y487 HydrophobicContact CG-CD2 3.86Å; L485-Y487 HydrophobicContact CG-CE2 3.7Å; L485-R508 WeakPolarHBondContact CA-O 3.4Å; L485-R508 HydrophobicContact CD1-CB 4.28Å; L485-R508 HydrophobicContact CG-CB 4.27Å
486	L	95.9	Very high	93.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	115.2	179.8	177.3	59	0	0	0	110.5	L462 L464 F477 L483 L488 F501 L506 R508 L509 N510	L462-L486 HydrophobicContact CB-CD1 4.15Å; L462-L486 HydrophobicContact CD2-CD1 4Å; L462-L486 HydrophobicContact CG-CD1 4.05Å; L464-L486 HydrophobicContact CD1-CD1 4.35Å; F477-L486 HydrophobicContact CD2-CD2 4.24Å; F477-L486 HydrophobicContact CE1-CD2 4.48Å; F477-L486 HydrophobicContact CE2-CD2 3.65Å; F477-L486 HydrophobicContact CZ-CD1 4.35Å; F477-L486 HydrophobicContact CZ-CD2 3.78Å; L483-L486 HydrophobicContact CD2-CB 4.35Å; L486-L488 HydrophobicContact CD1-CD1 4.22Å; L486-L488 HydrophobicContact CD1-CG 4.05Å; L486-L488 HydrophobicContact CD2-CD1 3.85Å; L486-L488 HydrophobicContact CG-CD1 3.94Å; L486-L488 HydrophobicContact CG-CG 4.1Å; L486-F501 HydrophobicContact CD2-CE1 3.76Å; L486-F501 HydrophobicContact CD2-CZ 4.39Å; L486-L506 HydrophobicContact CB-CD1 3.82Å; L486-L506 HydrophobicContact CB-CD2 4.34Å; L486-R508 PolarHBondContact N-O 3.12Å; L486-L509 HydrophobicContact CB-CD1 4.4Å; L486-L509 HydrophobicContact CD2-CD1 4.13Å; L486-L509 HydrophobicContact CG-CD1 4.3Å; L486-N510 PolarHBondContact O-N 3.37Å
487	Y	90.6	Very high	93	Very high	43 Å²	43	36.6 Å²	36.6	17%	0.169	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	117.8	177.1	-84.2	-138.2	0	0	0	109.8	L462 Y463 L464 E465 L485 N489 R508 N510	L462-Y487 PolarHBondContact O-N 3.04Å; Y463-Y487 HydrophobicContact CD1-CD1 4.4Å; Y463-Y487 HydrophobicContact CD1-CG 4.25Å; Y463-Y487 HydrophobicContact CE1-CG 4.47Å; L464-Y487 CarbonylContact C-O 3.54Å; L464-Y487 WeakPolarHBondContact CA-O 3.18Å; L464-Y487 WeakPolarHBondContact CB-O 3.3Å; L464-Y487 PolarHBondContact N-O 3.22Å; E465-Y487 PolarHBondContact N-O 3.48Å; E465-Y487 VanDerWaalsContact OE2-CB 3.3Å; E465-Y487 WeakPolarHBondContact OE2-CB 3.38Å; L485-Y487 HydrophobicContact CD1-CD2 4.43Å; L485-Y487 HydrophobicContact CD1-CE2 3.8Å; L485-Y487 HydrophobicContact CD2-CD2 3.48Å; L485-Y487 VanDerWaalsContact CD2-CD2 3.48Å; L485-Y487 HydrophobicContact CD2-CE2 3.7Å; L485-Y487 HydrophobicContact CD2-CG 4.35Å; L485-Y487 HydrophobicContact CG-CD2 3.86Å; L485-Y487 HydrophobicContact CG-CE2 3.7Å; Y487-N489 WeakPolarHBondContact CD1-OD1 3.36Å; Y487-R508 HydrophobicContact CE2-CG 4.15Å; Y487-R508 PolarHBondContact OH-NE 2.89Å; Y487-N510 HydrophobicContact CD1-CB 4.25Å; Y487-N510 HydrophobicContact CD2-CB 3.94Å; Y487-N510 HydrophobicContact CE1-CB 4.5Å; Y487-N510 HydrophobicContact CE2-CB 4.2Å; Y487-N510 HydrophobicContact CG-CB 3.97Å
488	L	95.3	Very high	92.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.213	C	C	.	.			trans	-127.2	12.2	-179.5	-75.1	166.9	0	0	0	111.5	L448 L464 I469 I472 F477 L486 N491 L493 N510 L511 N514	L448-L488 HydrophobicContact CD1-CD2 4.26Å; L464-L488 HydrophobicContact CB-CD2 3.86Å; L464-L488 HydrophobicContact CD1-CD2 3.93Å; I469-L488 HydrophobicContact CD1-CD2 4.1Å; I472-L488 HydrophobicContact CD1-CD1 3.8Å; I472-L488 HydrophobicContact CD1-CD2 4.2Å; F477-L488 HydrophobicContact CZ-CD1 4.47Å; L486-L488 HydrophobicContact CD1-CD1 4.22Å; L486-L488 HydrophobicContact CD1-CG 4.05Å; L486-L488 HydrophobicContact CD2-CD1 3.85Å; L486-L488 HydrophobicContact CG-CD1 3.94Å; L486-L488 HydrophobicContact CG-CG 4.1Å; L488-N491 PolarHBondContact O-ND2 3.23Å; L488-L493 HydrophobicContact CB-CD1 4.17Å; L488-L493 HydrophobicContact CD1-CD1 4.33Å; L488-L493 HydrophobicContact CD2-CD1 4.47Å; L488-N510 CarbonylContact C-O 3.4Å; L488-N510 WeakPolarHBondContact CA-O 3.3Å; L488-N510 PolarHBondContact N-O 2.81Å; L488-L511 HydrophobicContact CB-CD2 4.01Å; L488-L511 HydrophobicContact CD1-CD2 4.04Å; L488-N514 PolarHBondContact O-ND2 2.67Å
489	N	90.9	Very high	92.7	Very high	12 Å²	12	42.5 Å²	42.5	6%	0.064	22%	0.221	C	C	.	.			trans	-68.2	149	-176.1	52.9	-69.9	0	0	0	113.1	E465 Y466 Y487 N510 K512	E465-N489 WeakPolarHBondContact CA-O 3.48Å; E465-N489 VanDerWaalsContact CB-O 3.23Å; E465-N489 WeakPolarHBondContact CB-O 3.44Å; E465-N489 WeakPolarHBondContact CB-OD1 2.83Å; Y466-N489 PolarHBondContact N-O 3.04Å; Y487-N489 WeakPolarHBondContact CD1-OD1 3.36Å; N489-N510 WeakPolarHBondContact CB-OD1 3.22Å; N489-N510 PolarHBondContact N-O 2.9Å; N489-N510 PolarHBondContact OD1-ND2 3.14Å; N489-N510 VanDerWaalsContact OD1-ND2 3.17Å; N489-K512 CarbonylContact C-O 3.11Å; N489-K512 WeakPolarHBondContact CA-O 3.45Å; N489-K512 HydrophobicContact CB-CB 4.05Å; N489-K512 WeakPolarHBondContact CB-O 3.4Å
490	N	89.8	Confident	92.8	Very high	37 Å²	37	41.2 Å²	41.2	20%	0.198	21%	0.212	C	C	.	.	S	Bend	trans	57.6	54.3	-176	-47.5	-98.4	0	0	0	111.2	Y466 K512 N513	Y466-N490 WeakPolarHBondContact CA-O 3.44Å; Y466-N490 HydrophobicContact CD1-CB 3.68Å; Y466-N490 HydrophobicContact CE1-CB 3.35Å; Y466-N490 VanDerWaalsContact CE1-CG 3.4Å; Y466-N490 HydrophobicContact CE2-CB 4.36Å; Y466-N490 HydrophobicContact CG-CB 4.31Å; Y466-N490 VanDerWaalsContact CZ-ND2 3.26Å; Y466-N490 PolarHBondContact N-O 3.3Å; Y466-N490 PolarHBondContact OH-ND2 3.18Å; Y466-N490 PolarHBondContact OH-OD1 2.87Å; N490-K512 PolarHBondContact N-O 3.27Å; N490-N513 WeakPolarHBondContact CA-O 3.38Å; N490-N513 PolarHBondContact N-O 2.92Å; N490-N513 WeakPolarHBondContact OD1-CB 3.37Å; N490-N513 PolarHBondContact OD1-ND2 3.02Å
491	N	94.4	Very high	92.8	Very high	5 Å²	5	41.3 Å²	41.3	3%	0.027	21%	0.212	C	C	.	.	S	Bend	trans	-122.4	-171.9	166.7	-83.5	-81.1	0	0	0	108	L464 N467 I469 L488 L493 N514	L464-N491 PolarHBondContact O-ND2 3.38Å; N467-N491 WeakPolarHBondContact CA-OD1 3.46Å; N467-N491 WeakPolarHBondContact CB-OD1 3.39Å; N467-N491 PolarHBondContact N-OD1 2.9Å; N467-N491 PolarHBondContact O-OD1 3.21Å; N467-N491 VanDerWaalsContact O-OD1 3.08Å; I469-N491 HydrophobicContact CB-CB 4.26Å; I469-N491 VanDerWaalsContact CB-OD1 3.31Å; I469-N491 WeakPolarHBondContact CB-OD1 3.5Å; I469-N491 WeakPolarHBondContact CD1-OD1 3.39Å; I469-N491 WeakPolarHBondContact CG1-OD1 3.49Å; I469-N491 PolarHBondContact N-OD1 3.12Å; L488-N491 PolarHBondContact O-ND2 3.23Å; N491-L493 HydrophobicContact CB-CG 4.29Å; N491-N514 WeakPolarHBondContact CA-OD1 3.45Å; N491-N514 WeakPolarHBondContact CB-OD1 3.36Å; N491-N514 PolarHBondContact O-OD1 2.89Å
492	V	96.3	Very high	92.7	Very high	47 Å²	47	40.4 Å²	40.4	29%	0.285	21%	0.21	S	C	.	.			trans	-116.9	29.2	-179.1	-64.9	0	0	0	0	112.4	A468 I469 K470	A468-V492 WeakPolarHBondContact O-CG2 3.42Å; I469-V492 CarbonylContact O-C 3.44Å; I469-V492 WeakPolarHBondContact O-CA 3.18Å; I469-V492 WeakPolarHBondContact O-CG2 3.35Å; I469-V492 PolarHBondContact O-N 2.78Å; K470-V492 HydrophobicContact CB-CG2 4.35Å; K470-V492 HydrophobicContact CG-CG2 3.56Å
493	L	96.1	Very high	92.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.229	C	C	.	.			trans	-63.7	137.2	-179.8	-64	171.1	0	0	0	111.1	I469 I472 L488 N491 N514 H515 F516	I469-L493 HydrophobicContact CB-CD2 4.24Å; I469-L493 HydrophobicContact CG2-CD2 3.64Å; I469-L493 PolarHBondContact O-N 2.93Å; I469-L493 VanDerWaalsContact O-N 3.09Å; I472-L493 HydrophobicContact CD1-CD1 4.12Å; I472-L493 HydrophobicContact CD1-CD2 4.07Å; I472-L493 HydrophobicContact CG1-CD2 3.8Å; L488-L493 HydrophobicContact CB-CD1 4.17Å; L488-L493 HydrophobicContact CD1-CD1 4.33Å; L488-L493 HydrophobicContact CD2-CD1 4.47Å; N491-L493 HydrophobicContact CB-CG 4.29Å; L493-N514 HydrophobicContact CB-CB 4.39Å; L493-N514 VanDerWaalsContact CB-OD1 3.28Å; L493-N514 WeakPolarHBondContact CB-OD1 3.08Å; L493-N514 WeakPolarHBondContact CG-OD1 3.28Å; L493-N514 PolarHBondContact N-OD1 3.17Å; L493-N514 VanDerWaalsContact N-OD1 3.11Å; L493-H515 CarbonylContact O-C 3.45Å; L493-H515 WeakPolarHBondContact O-CA 3.48Å; L493-H515 WeakPolarHBondContact O-CB 3.49Å; L493-H515 PolarHBondContact O-N 3.29Å; L493-F516 HydrophobicContact CB-CE1 4.23Å; L493-F516 HydrophobicContact CB-CE2 3.91Å; L493-F516 HydrophobicContact CB-CZ 3.58Å; L493-F516 HydrophobicContact CD1-CE2 4.39Å; L493-F516 HydrophobicContact CD1-CZ 4.07Å; L493-F516 HydrophobicContact CG-CZ 4.47Å; L493-F516 PolarHBondContact O-N 3.08Å
494	R	93.4	Very high	92.2	Very high	170 Å²	170	41 Å²	41	64%	0.642	23%	0.231	S	C	*	.			trans	-111.3	-26.4	179.1	-62.6	-178	179.1	-139	-2.8	114.2	H515 F516	R494-H515 HydrophobicContact CG-CB 4.07Å; R494-F516 WeakPolarHBondContact O-CD1 3.45Å
495	S	92.6	Very high	92.2	Very high	71 Å²	71	39.5 Å²	39.5	50%	0.497	23%	0.228	S	C	.	.			trans	-156	164.3	-177.6	57.1	0	0	0	0	109.8
496	L	94.3	Very high	92.3	Very high	9 Å²	9	38.6 Å²	38.6	5%	0.047	22%	0.223	C	C	.	.			trans	-120	143	169.3	-66.6	-179	0	0	0	108.7	I472 I500 F501 L511 F516 L519 V524	I472-L496 HydrophobicContact CD1-CD2 3.9Å; L496-I500 HydrophobicContact CB-CG2 4.35Å; L496-F501 HydrophobicContact CD1-CE2 3.89Å; L496-F501 HydrophobicContact CD1-CZ 3.95Å; L496-L511 HydrophobicContact CD1-CD1 4.19Å; L496-F516 HydrophobicContact CD2-CE1 4.41Å; L496-F516 HydrophobicContact CD2-CZ 4.14Å; L496-F516 HydrophobicContact CG-CE1 3.93Å; L496-F516 HydrophobicContact CG-CZ 3.99Å; L496-L519 HydrophobicContact CD1-CD1 4.12Å; L496-L519 HydrophobicContact CG-CD1 4.34Å; L496-V524 HydrophobicContact CB-CG1 4.34Å; L496-V524 HydrophobicContact CD1-CG1 4.15Å
497	P	92.6	Very high	91.9	Very high	31 Å²	31	39.9 Å²	39.9	20%	0.201	23%	0.234	C	C	.	.			trans	-71.2	153	177.2	29.2	-32.8	0	0	0	111	I472 A474 I500	I472-P497 VanDerWaalsContact O-CD 3.32Å; I472-P497 WeakPolarHBondContact O-CD 3.46Å; I472-P497 VanDerWaalsContact O-CG 3.28Å; I472-P497 WeakPolarHBondContact O-CG 3.34Å; A474-P497 HydrophobicContact CB-CB 4.17Å; P497-I500 HydrophobicContact CG-CB 4.02Å; P497-I500 HydrophobicContact CG-CD1 4.06Å; P497-I500 HydrophobicContact CG-CG1 4.03Å; P497-I500 WeakPolarHBondContact O-CB 3.32Å; P497-I500 WeakPolarHBondContact O-CG2 3.48Å
498	A	89.6	Confident	91.7	Very high	55 Å²	55	42 Å²	42	46%	0.455	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	145.4	175.5	0	0	0	0	0	111.4	I500	A498-I500 PolarHBondContact O-N 2.95Å
499	Y	90.1	Very high	91.6	Very high	151 Å²	151	42 Å²	42	59%	0.592	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.6	12.4	178.7	-47.8	-71.4	0	0	0	116	F501 A502 G523	Y499-F501 PolarHBondContact O-N 2.91Å; Y499-A502 WeakPolarHBondContact O-CB 3.39Å; Y499-A502 PolarHBondContact O-N 2.87Å; Y499-G523 WeakPolarHBondContact CA-O 3.46Å; Y499-G523 PolarHBondContact N-O 3.4Å
500	I	93.5	Very high	91.5	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-18.5	-178	-165.3	51.3	0	0	0	115.8	I472 L473 F477 L496 P497 A498 V524	I472-I500 HydrophobicContact CG2-CD1 4.01Å; I472-I500 HydrophobicContact CG2-CG1 4.31Å; L473-I500 WeakPolarHBondContact O-CD1 3.43Å; F477-I500 HydrophobicContact CD2-CD1 3.85Å; F477-I500 HydrophobicContact CD2-CG1 3.73Å; F477-I500 HydrophobicContact CE2-CD1 4.2Å; F477-I500 HydrophobicContact CE2-CG1 3.86Å; F477-I500 HydrophobicContact CG-CD1 4.46Å; L496-I500 HydrophobicContact CB-CG2 4.35Å; P497-I500 HydrophobicContact CG-CB 4.02Å; P497-I500 HydrophobicContact CG-CD1 4.06Å; P497-I500 HydrophobicContact CG-CG1 4.03Å; P497-I500 WeakPolarHBondContact O-CB 3.32Å; P497-I500 WeakPolarHBondContact O-CG2 3.48Å; A498-I500 PolarHBondContact O-N 2.95Å; I500-V524 HydrophobicContact CG2-CG1 4.12Å
501	F	93.1	Very high	91.7	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.009	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.2	14.1	176	-54.7	-51.5	0	0	0	112.8	F477 L486 L496 Y499 G503 I504 L506 L509 V524 N527 L528	F477-F501 HydrophobicContact CD2-CD1 4.12Å; F477-F501 AromaticContact CD2-CE1 3.86Å; F477-F501 HydrophobicContact CD2-CE1 3.86Å; F477-F501 AromaticContact CE2-CE1 3.8Å; F477-F501 HydrophobicContact CE2-CE1 3.8Å; L486-F501 HydrophobicContact CD2-CE1 3.76Å; L486-F501 HydrophobicContact CD2-CZ 4.39Å; L496-F501 HydrophobicContact CD1-CE2 3.89Å; L496-F501 HydrophobicContact CD1-CZ 3.95Å; Y499-F501 PolarHBondContact O-N 2.91Å; F501-G503 PolarHBondContact O-N 3.21Å; F501-I504 PolarHBondContact O-N 2.85Å; F501-L506 HydrophobicContact CD1-CD2 4.31Å; F501-L506 HydrophobicContact CE1-CD2 4.29Å; F501-L509 HydrophobicContact CE2-CD2 3.78Å; F501-L509 HydrophobicContact CZ-CD1 4.04Å; F501-L509 HydrophobicContact CZ-CD2 3.91Å; F501-V524 HydrophobicContact CD2-CG1 3.91Å; F501-V524 HydrophobicContact CE2-CG1 3.86Å; F501-N527 HydrophobicContact CB-CB 4.43Å; F501-L528 HydrophobicContact CB-CD2 3.77Å; F501-L528 HydrophobicContact CD2-CD1 4.33Å; F501-L528 HydrophobicContact CD2-CD2 3.74Å; F501-L528 HydrophobicContact CD2-CG 4.17Å; F501-L528 HydrophobicContact CE2-CD2 4.49Å; F501-L528 HydrophobicContact CG-CD2 3.8Å
502	A	90	Very high	91.5	Very high	45 Å²	45	42.4 Å²	42.4	37%	0.372	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	120.9	-177	0	0	0	0	0	111.4	Y499 I504	Y499-A502 WeakPolarHBondContact O-CB 3.39Å; Y499-A502 PolarHBondContact O-N 2.87Å; A502-I504 VanDerWaalsContact C-N 3.33Å
503	G	85.1	Confident	91.3	Very high	75 Å²	75	43 Å²	43	77%	0.773	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.1	2.1	179.8	0	0	0	0	0	115.5	F501	F501-G503 PolarHBondContact O-N 3.21Å
504	I	92.3	Very high	91.2	Very high	9 Å²	9	43.1 Å²	43.1	5%	0.046	24%	0.244	C	C	.	.			trans	-97.1	126.7	-178.9	-56.6	-177.8	0	0	0	110.1	F477 L483 F501 A502 L506	F477-I504 HydrophobicContact CB-CD1 3.43Å; F477-I504 VanDerWaalsContact CB-CD1 3.43Å; L483-I504 HydrophobicContact CB-CG2 3.82Å; L483-I504 VanDerWaalsContact O-CG2 3.29Å; L483-I504 WeakPolarHBondContact O-CG2 3.43Å; F501-I504 PolarHBondContact O-N 2.85Å; A502-I504 VanDerWaalsContact C-N 3.33Å; I504-L506 HydrophobicContact CG2-CB 4.23Å; I504-L506 PolarHBondContact O-N 3.2Å
505	P	89.4	Confident	91.3	Very high	48 Å²	48	39 Å²	39	31%	0.312	23%	0.232	S	C	.	.			trans	-81.8	50.9	-178	36.6	-37.6	0	0	0	111.9	P481 L483 A507	P481-P505 WeakPolarHBondContact O-CD 3.36Å; L483-P505 CarbonylContact O-C 3.55Å; P505-A507 PolarHBondContact O-N 2.67Å
506	L	93.1	Very high	91.4	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	21%	0.208	C	C	.	.			trans	-69.1	120.9	-171.9	-164.8	74.1	0	0	0	111	L483 L486 F501 I504 L509 L528 S530 L531	L483-L506 HydrophobicContact CD2-CD1 4.32Å; L483-L506 HydrophobicContact CG-CD1 4.09Å; L486-L506 HydrophobicContact CB-CD1 3.82Å; L486-L506 HydrophobicContact CB-CD2 4.34Å; F501-L506 HydrophobicContact CD1-CD2 4.31Å; F501-L506 HydrophobicContact CE1-CD2 4.29Å; I504-L506 HydrophobicContact CG2-CB 4.23Å; I504-L506 PolarHBondContact O-N 3.2Å; L506-L509 HydrophobicContact CD2-CB 3.83Å; L506-L509 HydrophobicContact CD2-CD1 4.1Å; L506-L509 HydrophobicContact CD2-CD2 4.32Å; L506-L509 HydrophobicContact CD2-CG 4.29Å; L506-L528 HydrophobicContact CB-CD2 4.01Å; L506-L528 HydrophobicContact CD2-CD2 3.87Å; L506-S530 CarbonylContact O-C 3.15Å; L506-L531 WeakPolarHBondContact O-CA 3.31Å; L506-L531 PolarHBondContact O-N 3.12Å
507	A	87.8	Confident	91.3	Very high	27 Å²	27	40 Å²	40	22%	0.223	23%	0.229	C	C	.	.			trans	-95.4	-37.6	179.3	0	0	0	0	0	112.5	Q484 P505 S530 T532 Q533	Q484-A507 WeakPolarHBondContact O-CA 3.49Å; Q484-A507 PolarHBondContact O-N 3.11Å; P505-A507 PolarHBondContact O-N 2.67Å; A507-S530 WeakPolarHBondContact CA-O 3.45Å; A507-T532 PolarHBondContact O-N 3.13Å; A507-T532 PolarHBondContact O-OG1 2.65Å; A507-Q533 PolarHBondContact O-N 2.8Å; A507-Q533 VanDerWaalsContact O-N 3.12Å
508	R	86.3	Confident	91.2	Very high	87 Å²	87	40.9 Å²	40.9	33%	0.328	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	122.1	-179	-164.8	164.8	-168.2	169.9	3.7	111.8	Q484 L485 L486 Y487 Q533	Q484-R508 PolarHBondContact O-N 2.96Å; L485-R508 WeakPolarHBondContact CA-O 3.4Å; L485-R508 HydrophobicContact CD1-CB 4.28Å; L485-R508 HydrophobicContact CG-CB 4.27Å; L486-R508 PolarHBondContact N-O 3.12Å; Y487-R508 HydrophobicContact CE2-CG 4.15Å; Y487-R508 PolarHBondContact OH-NE 2.89Å; R508-Q533 WeakPolarHBondContact CA-O 3.38Å; R508-Q533 HydrophobicContact CG-CB 4.1Å; R508-Q533 HydrophobicContact CG-CG 4.28Å; R508-Q533 VanDerWaalsContact NH2-CD 3.26Å
509	L	93.6	Very high	91.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	112.9	179.3	177.1	56.6	0	0	0	110.5	L486 F501 L506 L511 L528 L531 Q533 I534 D535	L486-L509 HydrophobicContact CB-CD1 4.4Å; L486-L509 HydrophobicContact CD2-CD1 4.13Å; L486-L509 HydrophobicContact CG-CD1 4.3Å; F501-L509 HydrophobicContact CE2-CD2 3.78Å; F501-L509 HydrophobicContact CZ-CD1 4.04Å; F501-L509 HydrophobicContact CZ-CD2 3.91Å; L506-L509 HydrophobicContact CD2-CB 3.83Å; L506-L509 HydrophobicContact CD2-CD1 4.1Å; L506-L509 HydrophobicContact CD2-CD2 4.32Å; L506-L509 HydrophobicContact CD2-CG 4.29Å; L509-L511 HydrophobicContact CD1-CD1 4.41Å; L509-L511 HydrophobicContact CD1-CD2 4.2Å; L509-L511 HydrophobicContact CD1-CG 4.03Å; L509-L511 HydrophobicContact CD2-CD1 4.05Å; L509-L511 HydrophobicContact CD2-CG 4.5Å; L509-L511 HydrophobicContact CG-CD1 4.15Å; L509-L511 HydrophobicContact CG-CG 4.06Å; L509-L528 HydrophobicContact CD2-CD1 3.73Å; L509-L531 HydrophobicContact CB-CD1 4.2Å; L509-Q533 PolarHBondContact N-O 2.96Å; L509-Q533 VanDerWaalsContact N-O 3.11Å; L509-I534 HydrophobicContact CB-CG1 4.31Å; L509-I534 HydrophobicContact CD2-CD1 4.13Å; L509-I534 HydrophobicContact CD2-CG1 4.48Å; L509-I534 HydrophobicContact CG-CG1 4.44Å; L509-I534 WeakPolarHBondContact O-CA 3.44Å; L509-D535 PolarHBondContact O-N 3.07Å; L509-D535 VanDerWaalsContact O-N 3.08Å
510	N	88.6	Confident	91.2	Very high	16 Å²	16	34.2 Å²	34.2	9%	0.086	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	111	177.9	-166.9	-8	0	0	0	111.1	L486 Y487 L488 N489 K512 D535	L486-N510 PolarHBondContact O-N 3.37Å; Y487-N510 HydrophobicContact CD1-CB 4.25Å; Y487-N510 HydrophobicContact CD2-CB 3.94Å; Y487-N510 HydrophobicContact CE1-CB 4.5Å; Y487-N510 HydrophobicContact CE2-CB 4.2Å; Y487-N510 HydrophobicContact CG-CB 3.97Å; L488-N510 CarbonylContact C-O 3.4Å; L488-N510 WeakPolarHBondContact CA-O 3.3Å; L488-N510 PolarHBondContact N-O 2.81Å; N489-N510 WeakPolarHBondContact CB-OD1 3.22Å; N489-N510 PolarHBondContact N-O 2.9Å; N489-N510 PolarHBondContact OD1-ND2 3.14Å; N489-N510 VanDerWaalsContact OD1-ND2 3.17Å; N510-K512 VanDerWaalsContact OD1-CB 3.27Å; N510-K512 WeakPolarHBondContact OD1-CB 3.03Å; N510-K512 PolarHBondContact OD1-N 2.91Å; N510-K512 VanDerWaalsContact OD1-N 3.16Å; N510-D535 WeakPolarHBondContact OD1-CB 3.44Å
511	L	94.6	Very high	90.9	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	21%	0.211	C	C	.	.			trans	-115.6	11	177.7	-65	171.4	0	0	0	112	L488 L496 L509 N514 F516 L519 D535 L536 N539	L488-L511 HydrophobicContact CB-CD2 4.01Å; L488-L511 HydrophobicContact CD1-CD2 4.04Å; L496-L511 HydrophobicContact CD1-CD1 4.19Å; L509-L511 HydrophobicContact CD1-CD1 4.41Å; L509-L511 HydrophobicContact CD1-CD2 4.2Å; L509-L511 HydrophobicContact CD1-CG 4.03Å; L509-L511 HydrophobicContact CD2-CD1 4.05Å; L509-L511 HydrophobicContact CD2-CG 4.5Å; L509-L511 HydrophobicContact CG-CD1 4.15Å; L509-L511 HydrophobicContact CG-CG 4.06Å; L511-N514 PolarHBondContact O-ND2 3.14Å; L511-N514 VanDerWaalsContact O-ND2 3.08Å; L511-F516 HydrophobicContact CB-CE2 4.04Å; L511-F516 HydrophobicContact CD1-CE2 4.33Å; L511-F516 HydrophobicContact CD2-CE2 3.91Å; L511-F516 HydrophobicContact CD2-CZ 4.1Å; L511-F516 HydrophobicContact CG-CE2 4.32Å; L511-L519 HydrophobicContact CD1-CD2 4.3Å; L511-D535 CarbonylContact C-O 3.55Å; L511-D535 WeakPolarHBondContact CA-O 3.32Å; L511-D535 PolarHBondContact N-O 2.98Å; L511-L536 HydrophobicContact CB-CD2 4.2Å; L511-L536 HydrophobicContact CD1-CD2 3.99Å; L511-N539 PolarHBondContact O-ND2 2.98Å
512	K	90.1	Very high	90.6	Very high	47 Å²	47	39.7 Å²	39.7	20%	0.204	24%	0.242	C	C	.	.			trans	-53.4	145.6	-178.2	174.9	165.7	-175.3	165	0	112.3	N489 N490 N510 N514 D535 E537	N489-K512 CarbonylContact C-O 3.11Å; N489-K512 WeakPolarHBondContact CA-O 3.45Å; N489-K512 HydrophobicContact CB-CB 4.05Å; N489-K512 WeakPolarHBondContact CB-O 3.4Å; N490-K512 PolarHBondContact N-O 3.27Å; N510-K512 VanDerWaalsContact OD1-CB 3.27Å; N510-K512 WeakPolarHBondContact OD1-CB 3.03Å; N510-K512 PolarHBondContact OD1-N 2.91Å; N510-K512 VanDerWaalsContact OD1-N 3.16Å; K512-N514 PolarHBondContact O-ND2 3.06Å; K512-D535 HydrophobicContact CB-CB 4.38Å; K512-D535 PolarHBondContact N-O 3Å; K512-D535 VanDerWaalsContact N-O 3.15Å; K512-E537 CarbonylContact C-O 3.51Å; K512-E537 VanDerWaalsContact CA-O 3.28Å; K512-E537 WeakPolarHBondContact CA-O 3.42Å; K512-E537 HydrophobicContact CD-CB 4.06Å; K512-E537 VanDerWaalsContact CE-CD 3.5Å; K512-E537 WeakPolarHBondContact CE-OE1 3.33Å; K512-E537 WeakPolarHBondContact CE-OE2 3.02Å; K512-E537 HydrophobicContact CG-CB 4.16Å; K512-E537 IonicContact NZ-OE1 3.55Å; K512-E537 PolarHBondContact NZ-OE1 3.4Å; K512-E537 IonicContact NZ-OE2 2.7Å; K512-E537 PolarHBondContact NZ-OE2 2.88Å
513	N	90.8	Very high	90.3	Very high	60 Å²	60	37.6 Å²	37.6	32%	0.321	23%	0.225	S	C	.	.	S	Bend	trans	53.5	57.9	176.2	-60.7	-1.8	0	0	0	112.5	N490 E537	N490-N513 WeakPolarHBondContact CA-O 3.38Å; N490-N513 PolarHBondContact N-O 2.92Å; N490-N513 WeakPolarHBondContact OD1-CB 3.37Å; N490-N513 PolarHBondContact OD1-ND2 3.02Å; N513-E537 PolarHBondContact N-O 2.9Å
514	N	95.3	Very high	90.5	Very high	2 Å²	2	34 Å²	34	1%	0.011	19%	0.188	C	C	.	.	S	Bend	trans	-118	-160.8	171.1	-90.2	-85.8	0	0	0	109.5	L488 N491 L493 L511 K512 F516 N539 P540	L488-N514 PolarHBondContact O-ND2 2.67Å; N491-N514 WeakPolarHBondContact CA-OD1 3.45Å; N491-N514 WeakPolarHBondContact CB-OD1 3.36Å; N491-N514 PolarHBondContact O-OD1 2.89Å; L493-N514 HydrophobicContact CB-CB 4.39Å; L493-N514 VanDerWaalsContact CB-OD1 3.28Å; L493-N514 WeakPolarHBondContact CB-OD1 3.08Å; L493-N514 WeakPolarHBondContact CG-OD1 3.28Å; L493-N514 PolarHBondContact N-OD1 3.17Å; L493-N514 VanDerWaalsContact N-OD1 3.11Å; L511-N514 PolarHBondContact O-ND2 3.14Å; L511-N514 VanDerWaalsContact O-ND2 3.08Å; K512-N514 PolarHBondContact O-ND2 3.06Å; N514-F516 HydrophobicContact CB-CD2 3.62Å; N514-F516 HydrophobicContact CB-CE2 3.68Å; N514-N539 WeakPolarHBondContact CA-OD1 3.18Å; N514-N539 WeakPolarHBondContact CB-OD1 3.31Å; N514-N539 PolarHBondContact N-OD1 3.33Å; N514-N539 VanDerWaalsContact N-OD1 3.14Å; N514-N539 PolarHBondContact O-OD1 3.42Å; N514-P540 WeakPolarHBondContact O-CD 3.46Å
515	H	95.4	Very high	90.3	Very high	84 Å²	84	33.7 Å²	33.7	39%	0.389	19%	0.187	S	C	.	.			trans	-117.6	30.8	177.9	-65	-18.9	0	0	0	112.5	L493 R494 M517 N539	L493-H515 CarbonylContact O-C 3.45Å; L493-H515 WeakPolarHBondContact O-CA 3.48Å; L493-H515 WeakPolarHBondContact O-CB 3.49Å; L493-H515 PolarHBondContact O-N 3.29Å; R494-H515 HydrophobicContact CG-CB 4.07Å; H515-M517 PolarHBondContact O-N 3.45Å; H515-N539 PolarHBondContact N-OD1 3.04Å
516	F	94.5	Very high	90.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.19	C	C	.	.			trans	-66.5	115.2	174.7	-67.5	-72.5	0	0	0	110.9	L493 R494 L496 L511 N514 L519 N539 P540 W541	L493-F516 HydrophobicContact CB-CE1 4.23Å; L493-F516 HydrophobicContact CB-CE2 3.91Å; L493-F516 HydrophobicContact CB-CZ 3.58Å; L493-F516 HydrophobicContact CD1-CE2 4.39Å; L493-F516 HydrophobicContact CD1-CZ 4.07Å; L493-F516 HydrophobicContact CG-CZ 4.47Å; L493-F516 PolarHBondContact O-N 3.08Å; R494-F516 WeakPolarHBondContact O-CD1 3.45Å; L496-F516 HydrophobicContact CD2-CE1 4.41Å; L496-F516 HydrophobicContact CD2-CZ 4.14Å; L496-F516 HydrophobicContact CG-CE1 3.93Å; L496-F516 HydrophobicContact CG-CZ 3.99Å; L511-F516 HydrophobicContact CB-CE2 4.04Å; L511-F516 HydrophobicContact CD1-CE2 4.33Å; L511-F516 HydrophobicContact CD2-CE2 3.91Å; L511-F516 HydrophobicContact CD2-CZ 4.1Å; L511-F516 HydrophobicContact CG-CE2 4.32Å; N514-F516 HydrophobicContact CB-CD2 3.62Å; N514-F516 HydrophobicContact CB-CE2 3.68Å; F516-L519 HydrophobicContact CD1-CD1 4.47Å; F516-L519 HydrophobicContact CE1-CD1 4.4Å; F516-N539 HydrophobicContact CB-CB 4.27Å; F516-N539 VanDerWaalsContact CD2-OD1 3.3Å; F516-N539 WeakPolarHBondContact CD2-OD1 3.49Å; F516-N539 PolarHBondContact N-OD1 2.88Å; F516-N539 VanDerWaalsContact N-OD1 3.17Å; F516-P540 CarbonylContact O-C 3.59Å; F516-P540 WeakPolarHBondContact O-CD 3.33Å; F516-W541 HydrophobicContact CB-CE3 4.43Å; F516-W541 HydrophobicContact CB-CH2 3.62Å; F516-W541 HydrophobicContact CB-CZ2 4.21Å; F516-W541 HydrophobicContact CB-CZ3 3.75Å; F516-W541 HydrophobicContact CG-CH2 4.3Å
517	M	92.1	Very high	89.8	Confident	100 Å²	100	36.3 Å²	36.3	49%	0.493	20%	0.198	S	C	.	.	S	Bend	trans	-86.5	-43.1	168.1	-70	169.7	172.5	0	0	110.2	H515 E542	H515-M517 PolarHBondContact O-N 3.45Å; M517-E542 HydrophobicContact CB-CB 4.23Å; M517-E542 PolarHBondContact O-N 3.37Å
518	T	90.4	Very high	89.8	Confident	50 Å²	50	35.6 Å²	35.6	31%	0.307	19%	0.19	S	C	.	.			trans	-136.4	156	173	60.6	0	0	0	0	110.2	D546 L547	T518-D546 HydrophobicContact CG2-CB 4.29Å; T518-L547 HydrophobicContact CG2-CD1 4.4Å
519	L	91.2	Very high	89.6	Confident	4 Å²	4	41.9 Å²	41.9	2%	0.021	21%	0.214	C	C	.	.			trans	-139.1	109.8	178.5	-178.8	61.3	0	0	0	108.4	L496 L511 F516 L525 L536 W541	L496-L519 HydrophobicContact CD1-CD1 4.12Å; L496-L519 HydrophobicContact CG-CD1 4.34Å; L511-L519 HydrophobicContact CD1-CD2 4.3Å; F516-L519 HydrophobicContact CD1-CD1 4.47Å; F516-L519 HydrophobicContact CE1-CD1 4.4Å; L519-L525 HydrophobicContact CD2-CD1 3.9Å; L519-L525 HydrophobicContact CD2-CD2 4.25Å; L519-L525 HydrophobicContact CD2-CG 4.43Å; L519-L525 HydrophobicContact CG-CD1 4.02Å; L519-L525 HydrophobicContact CG-CG 4.45Å; L519-L536 HydrophobicContact CD2-CD2 3.92Å; L519-W541 HydrophobicContact CB-CH2 3.73Å; L519-W541 HydrophobicContact CB-CZ3 3.63Å; L519-W541 HydrophobicContact CD2-CH2 3.99Å
520	P	87.9	Confident	89.2	Confident	62 Å²	62	45 Å²	45	40%	0.403	24%	0.236	S	C	.	.			trans	-66.8	136.1	-178.4	26.6	-34.5	0	0	0	110.8	V524	P520-V524 HydrophobicContact CG-CG2 4.15Å; P520-V524 WeakPolarHBondContact O-CB 3.49Å
521	V	87.6	Confident	89.1	Confident	23 Å²	23	44.9 Å²	44.9	14%	0.139	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-47.8	172.3	172.5	0	0	0	0	110.8	G523 V524 L525 D526 A549 L550 W553	V521-G523 PolarHBondContact O-N 2.83Å; V521-V524 PolarHBondContact O-N 2.03Å; V521-V524 VanDerWaalsContact O-N 3.14Å; V521-L525 HydrophobicContact CG1-CB 4.37Å; V521-L525 HydrophobicContact CG2-CD1 4.1Å; V521-L525 PolarHBondContact O-N 2.85Å; V521-D526 PolarHBondContact O-N 2.78Å; V521-D526 VanDerWaalsContact O-N 3.13Å; V521-A549 HydrophobicContact CB-CB 4.43Å; V521-A549 HydrophobicContact CG2-CB 4.23Å; V521-A549 WeakPolarHBondContact CG2-O 3.47Å; V521-L550 HydrophobicContact CG2-CB 4.42Å; V521-W553 HydrophobicContact CB-CB 4.47Å; V521-W553 HydrophobicContact CG1-CB 3.98Å; V521-W553 HydrophobicContact CG1-CG 3.89Å; V521-W553 HydrophobicContact CG2-CB 3.6Å; V521-W553 HydrophobicContact CG2-CG 3.99Å
522	S	86.5	Confident	88.6	Confident	94 Å²	94	48.8 Å²	48.8	66%	0.657	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	122	-177.7	-171.3	0	0	0	0	110.9	V524 D526	S522-V524 VanDerWaalsContact C-N 3.3Å; S522-V524 PolarHBondContact O-N 2.83Å; S522-D526 WeakPolarHBondContact CA-OD2 3.46Å
523	G	82.9	Confident	88.2	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.01	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.5	-5.9	-176.3	0	0	0	0	0	115.7	Y499 V521 D526 N527	Y499-G523 WeakPolarHBondContact CA-O 3.46Å; Y499-G523 PolarHBondContact N-O 3.4Å; V521-G523 PolarHBondContact O-N 2.83Å; G523-D526 VanDerWaalsContact C-OD1 3.26Å; G523-D526 VanDerWaalsContact CA-OD1 3.26Å; G523-D526 WeakPolarHBondContact CA-OD1 3.41Å; G523-D526 PolarHBondContact N-OD1 2.8Å; G523-D526 PolarHBondContact N-OD2 2.87Å; G523-N527 VanDerWaalsContact C-ND2 3.34Å; G523-N527 PolarHBondContact O-ND2 2.88Å
524	V	89.6	Confident	88.1	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.9	-67.4	-179.5	-178	0	0	0	0	111.1	L496 I500 F501 P520 V521 S522 D526	L496-V524 HydrophobicContact CB-CG1 4.34Å; L496-V524 HydrophobicContact CD1-CG1 4.15Å; I500-V524 HydrophobicContact CG2-CG1 4.12Å; F501-V524 HydrophobicContact CD2-CG1 3.91Å; F501-V524 HydrophobicContact CE2-CG1 3.86Å; P520-V524 HydrophobicContact CG-CG2 4.15Å; P520-V524 WeakPolarHBondContact O-CB 3.49Å; V521-V524 PolarHBondContact O-N 2.03Å; V521-V524 VanDerWaalsContact O-N 3.14Å; S522-V524 VanDerWaalsContact C-N 3.3Å; S522-V524 PolarHBondContact O-N 2.83Å; V524-D526 PolarHBondContact N-OD1 3Å; V524-D526 VanDerWaalsContact N-OD1 3.14Å
525	L	88.8	Confident	87.7	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.01	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-83.1	-19.3	-175.9	-59.2	176.6	0	0	0	113.2	L519 V521 N527 L528 I534 L550 W553	L519-L525 HydrophobicContact CD2-CD1 3.9Å; L519-L525 HydrophobicContact CD2-CD2 4.25Å; L519-L525 HydrophobicContact CD2-CG 4.43Å; L519-L525 HydrophobicContact CG-CD1 4.02Å; L519-L525 HydrophobicContact CG-CG 4.45Å; V521-L525 HydrophobicContact CG1-CB 4.37Å; V521-L525 HydrophobicContact CG2-CD1 4.1Å; V521-L525 PolarHBondContact O-N 2.85Å; L525-N527 VanDerWaalsContact C-N 3.27Å; L525-N527 PolarHBondContact O-N 3.07Å; L525-L528 HydrophobicContact CD2-CD1 3.63Å; L525-L528 PolarHBondContact O-N 3Å; L525-I534 HydrophobicContact CD2-CD1 3.99Å; L525-L550 HydrophobicContact CD1-CD1 3.47Å; L525-L550 VanDerWaalsContact CD1-CD1 3.47Å; L525-W553 HydrophobicContact CB-CD2 4.12Å; L525-W553 HydrophobicContact CB-CH2 4.27Å; L525-W553 HydrophobicContact CB-CZ2 3.75Å; L525-W553 HydrophobicContact CD1-CD2 4.23Å; L525-W553 HydrophobicContact CD1-CE3 3.98Å; L525-W553 HydrophobicContact CD1-CH2 4.32Å; L525-W553 HydrophobicContact CD1-CZ3 4.03Å; L525-W553 HydrophobicContact CD2-CH2 4.25Å; L525-W553 HydrophobicContact CD2-CZ2 4.45Å; L525-W553 HydrophobicContact CG-CZ2 4.48Å; L525-W553 PolarHBondContact O-NE1 2.85Å
526	D	85.9	Confident	87.5	Confident	71 Å²	71	41.3 Å²	41.3	38%	0.38	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-71	-19.1	172.1	61.2	-5.4	0	0	0	114	V521 S522 G523 V524	V521-D526 PolarHBondContact O-N 2.78Å; V521-D526 VanDerWaalsContact O-N 3.13Å; S522-D526 WeakPolarHBondContact CA-OD2 3.46Å; G523-D526 VanDerWaalsContact C-OD1 3.26Å; G523-D526 VanDerWaalsContact CA-OD1 3.26Å; G523-D526 WeakPolarHBondContact CA-OD1 3.41Å; G523-D526 PolarHBondContact N-OD1 2.8Å; G523-D526 PolarHBondContact N-OD2 2.87Å; V524-D526 PolarHBondContact N-OD1 3Å; V524-D526 VanDerWaalsContact N-OD1 3.14Å
527	N	86.2	Confident	87.3	Confident	32 Å²	32	44.6 Å²	44.6	17%	0.171	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-80.7	-18.3	174.3	-72.1	-56	0	0	0	113.4	F501 G523 L525 R529	F501-N527 HydrophobicContact CB-CB 4.43Å; G523-N527 VanDerWaalsContact C-ND2 3.34Å; G523-N527 PolarHBondContact O-ND2 2.88Å; L525-N527 VanDerWaalsContact C-N 3.27Å; L525-N527 PolarHBondContact O-N 3.07Å; N527-R529 VanDerWaalsContact C-N 3.26Å; N527-R529 PolarHBondContact O-N 3.14Å
528	L	86.9	Confident	87	Confident	13 Å²	13	42.2 Å²	42.2	7%	0.068	24%	0.24	C	C	.	.			trans	-78.5	65.2	-175	-61.9	178	0	0	0	112.6	F501 L506 L509 L525 S530 L531	F501-L528 HydrophobicContact CB-CD2 3.77Å; F501-L528 HydrophobicContact CD2-CD1 4.33Å; F501-L528 HydrophobicContact CD2-CD2 3.74Å; F501-L528 HydrophobicContact CD2-CG 4.17Å; F501-L528 HydrophobicContact CE2-CD2 4.49Å; F501-L528 HydrophobicContact CG-CD2 3.8Å; L506-L528 HydrophobicContact CB-CD2 4.01Å; L506-L528 HydrophobicContact CD2-CD2 3.87Å; L509-L528 HydrophobicContact CD2-CD1 3.73Å; L525-L528 HydrophobicContact CD2-CD1 3.63Å; L525-L528 PolarHBondContact O-N 3Å; L528-S530 PolarHBondContact O-N 3.34Å; L528-L531 HydrophobicContact CB-CB 4.18Å; L528-L531 HydrophobicContact CB-CD1 4.43Å; L528-L531 HydrophobicContact CB-CD2 4.04Å; L528-L531 HydrophobicContact CB-CG 4.48Å; L528-L531 HydrophobicContact CD1-CD1 4.28Å; L528-L531 HydrophobicContact CD1-CD2 4.05Å; L528-L531 WeakPolarHBondContact O-CB 3.25Å
529	R	82.8	Confident	87.2	Confident	218 Å²	218	40.3 Å²	40.3	82%	0.823	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-12	-172.6	-61.5	-179.1	-171.5	-178.6	4.9	115.4	N527	N527-R529 VanDerWaalsContact C-N 3.26Å; N527-R529 PolarHBondContact O-N 3.14Å
530	S	85.1	Confident	87.3	Confident	65 Å²	65	42.1 Å²	42.1	46%	0.455	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.6	11.1	-178.1	-59.6	0	0	0	0	112.8	L506 A507 L528	L506-S530 CarbonylContact O-C 3.15Å; A507-S530 WeakPolarHBondContact CA-O 3.45Å; L528-S530 PolarHBondContact O-N 3.34Å
531	L	86.2	Confident	87.5	Confident	14 Å²	14	39.2 Å²	39.2	7%	0.073	22%	0.221	C	C	.	.			trans	-66.7	129.1	-172.8	-162.9	68.7	0	0	0	111.3	L506 L509 L528 Q533 I534 W553 V561	L506-L531 WeakPolarHBondContact O-CA 3.31Å; L506-L531 PolarHBondContact O-N 3.12Å; L509-L531 HydrophobicContact CB-CD1 4.2Å; L528-L531 HydrophobicContact CB-CB 4.18Å; L528-L531 HydrophobicContact CB-CD1 4.43Å; L528-L531 HydrophobicContact CB-CD2 4.04Å; L528-L531 HydrophobicContact CB-CG 4.48Å; L528-L531 HydrophobicContact CD1-CD1 4.28Å; L528-L531 HydrophobicContact CD1-CD2 4.05Å; L528-L531 WeakPolarHBondContact O-CB 3.25Å; L531-Q533 WeakPolarHBondContact CD1-O 3.27Å; L531-I534 HydrophobicContact CD2-CB 4.02Å; L531-I534 HydrophobicContact CD2-CD1 4.38Å; L531-I534 HydrophobicContact CD2-CG2 4.15Å; L531-W553 HydrophobicContact CD2-CH2 3.83Å; L531-W553 HydrophobicContact CD2-CZ2 3.98Å; L531-V561 HydrophobicContact CD2-CG1 4.32Å; L531-V561 HydrophobicContact CG-CG1 4.22Å; L531-V561 VanDerWaalsContact O-CG2 3.3Å; L531-V561 WeakPolarHBondContact O-CG2 3.32Å
532	T	83.9	Confident	87.7	Confident	82 Å²	82	41.8 Å²	41.8	50%	0.503	23%	0.231	S	C	.	.	S	Bend	trans	-114.2	-22.7	173.1	60.8	0	0	0	0	112.2	A507 V561 A562	A507-T532 PolarHBondContact O-N 3.13Å; A507-T532 PolarHBondContact O-OG1 2.65Å; T532-V561 CarbonylContact O-C 3.51Å; T532-V561 WeakPolarHBondContact O-CA 3.28Å; T532-A562 PolarHBondContact O-N 2.97Å
533	Q	82.6	Confident	87.9	Confident	22 Å²	22	37.4 Å²	37.4	10%	0.103	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	139.4	173.1	172.7	163.3	-5.4	0	0	112.9	A507 R508 L509 L531 D535 A562	A507-Q533 PolarHBondContact O-N 2.8Å; A507-Q533 VanDerWaalsContact O-N 3.12Å; R508-Q533 WeakPolarHBondContact CA-O 3.38Å; R508-Q533 HydrophobicContact CG-CB 4.1Å; R508-Q533 HydrophobicContact CG-CG 4.28Å; R508-Q533 VanDerWaalsContact NH2-CD 3.26Å; L509-Q533 PolarHBondContact N-O 2.96Å; L509-Q533 VanDerWaalsContact N-O 3.11Å; L531-Q533 WeakPolarHBondContact CD1-O 3.27Å; Q533-D535 PolarHBondContact NE2-OD1 3.25Å; Q533-D535 PolarHBondContact NE2-OD2 3.48Å; Q533-A562 VanDerWaalsContact CA-O 3.32Å; Q533-A562 WeakPolarHBondContact CA-O 3.42Å; Q533-A562 HydrophobicContact CB-CB 4.12Å; Q533-A562 HydrophobicContact CG-CB 4.14Å
534	I	89.1	Confident	88.1	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.01	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	124.1	170.9	-169.4	174	0	0	0	112.3	L509 L525 L531 L536 W553 L557 A562 A563	L509-I534 HydrophobicContact CB-CG1 4.31Å; L509-I534 HydrophobicContact CD2-CD1 4.13Å; L509-I534 HydrophobicContact CD2-CG1 4.48Å; L509-I534 HydrophobicContact CG-CG1 4.44Å; L509-I534 WeakPolarHBondContact O-CA 3.44Å; L525-I534 HydrophobicContact CD2-CD1 3.99Å; L531-I534 HydrophobicContact CD2-CB 4.02Å; L531-I534 HydrophobicContact CD2-CD1 4.38Å; L531-I534 HydrophobicContact CD2-CG2 4.15Å; I534-L536 HydrophobicContact CD1-CD1 4.37Å; I534-L536 HydrophobicContact CD1-CD2 3.96Å; I534-L536 HydrophobicContact CD1-CG 4.18Å; I534-L536 HydrophobicContact CG1-CD2 4.02Å; I534-L536 HydrophobicContact CG1-CG 4.07Å; I534-W553 HydrophobicContact CD1-CH2 3.73Å; I534-W553 HydrophobicContact CD1-CZ3 4.11Å; I534-W553 HydrophobicContact CG2-CH2 4.14Å; I534-W553 HydrophobicContact CG2-CZ3 4.33Å; I534-L557 HydrophobicContact CG2-CD1 4.37Å; I534-A562 PolarHBondContact N-O 2.97Å; I534-A563 HydrophobicContact CG2-CB 3.88Å
535	D	86	Confident	88	Confident	11 Å²	11	41.4 Å²	41.4	6%	0.059	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	109	-179.8	-66.4	-76.1	0	0	0	110.2	L509 N510 L511 K512 Q533	L509-D535 PolarHBondContact O-N 3.07Å; L509-D535 VanDerWaalsContact O-N 3.08Å; N510-D535 WeakPolarHBondContact OD1-CB 3.44Å; L511-D535 CarbonylContact C-O 3.55Å; L511-D535 WeakPolarHBondContact CA-O 3.32Å; L511-D535 PolarHBondContact N-O 2.98Å; K512-D535 HydrophobicContact CB-CB 4.38Å; K512-D535 PolarHBondContact N-O 3Å; K512-D535 VanDerWaalsContact N-O 3.15Å; Q533-D535 PolarHBondContact NE2-OD1 3.25Å; Q533-D535 PolarHBondContact NE2-OD2 3.48Å
536	L	91.6	Very high	87.9	Confident	2 Å²	2	47.1 Å²	47.1	1%	0.01	26%	0.258	C	S	.	.			trans	-111.5	2.2	-177.6	-65.5	-175.2	0	0	0	113.8	L511 L519 I534 N539 W541 L550 L554 V566	L511-L536 HydrophobicContact CB-CD2 4.2Å; L511-L536 HydrophobicContact CD1-CD2 3.99Å; L519-L536 HydrophobicContact CD2-CD2 3.92Å; I534-L536 HydrophobicContact CD1-CD1 4.37Å; I534-L536 HydrophobicContact CD1-CD2 3.96Å; I534-L536 HydrophobicContact CD1-CG 4.18Å; I534-L536 HydrophobicContact CG1-CD2 4.02Å; I534-L536 HydrophobicContact CG1-CG 4.07Å; L536-N539 PolarHBondContact O-ND2 2.8Å; L536-W541 HydrophobicContact CB-CZ2 3.98Å; L536-W541 HydrophobicContact CD2-CZ2 4.32Å; L536-W541 PolarHBondContact O-NE1 3.04Å; L536-W541 VanDerWaalsContact O-NE1 3.07Å; L536-L550 HydrophobicContact CD1-CD1 4.15Å; L536-L554 HydrophobicContact CD1-CD2 4.25Å; L536-V566 HydrophobicContact CB-CG2 3.82Å; L536-V566 HydrophobicContact CD1-CG2 4.13Å
537	E	89.6	Confident	88	Confident	69 Å²	69	43.8 Å²	43.8	32%	0.322	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	158.8	-175	-156.7	-157.9	127.4	0	0	112.9	K512 N513 N539	K512-E537 CarbonylContact C-O 3.51Å; K512-E537 VanDerWaalsContact CA-O 3.28Å; K512-E537 WeakPolarHBondContact CA-O 3.42Å; K512-E537 HydrophobicContact CD-CB 4.06Å; K512-E537 VanDerWaalsContact CE-CD 3.5Å; K512-E537 WeakPolarHBondContact CE-OE1 3.33Å; K512-E537 WeakPolarHBondContact CE-OE2 3.02Å; K512-E537 HydrophobicContact CG-CB 4.16Å; K512-E537 IonicContact NZ-OE1 3.55Å; K512-E537 PolarHBondContact NZ-OE1 3.4Å; K512-E537 IonicContact NZ-OE2 2.7Å; K512-E537 PolarHBondContact NZ-OE2 2.88Å; N513-E537 PolarHBondContact N-O 2.9Å; E537-N539 PolarHBondContact O-N 2.6Å; E537-N539 VanDerWaalsContact O-N 3.16Å; E537-N539 PolarHBondContact O-ND2 3.3Å
538	G	87.2	Confident	88.2	Confident	50 Å²	50	43 Å²	43	52%	0.515	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	15.8	171.3	0	0	0	0	0	115.9
539	N	93.4	Very high	88.2	Confident	9 Å²	9	44.6 Å²	44.6	5%	0.048	25%	0.252	C	S	.	.			trans	-98.4	147.1	175.5	-82	-78	0	0	0	111.5	L511 N514 H515 F516 L536 E537 W541	L511-N539 PolarHBondContact O-ND2 2.98Å; N514-N539 WeakPolarHBondContact CA-OD1 3.18Å; N514-N539 WeakPolarHBondContact CB-OD1 3.31Å; N514-N539 PolarHBondContact N-OD1 3.33Å; N514-N539 VanDerWaalsContact N-OD1 3.14Å; N514-N539 PolarHBondContact O-OD1 3.42Å; H515-N539 PolarHBondContact N-OD1 3.04Å; F516-N539 HydrophobicContact CB-CB 4.27Å; F516-N539 VanDerWaalsContact CD2-OD1 3.3Å; F516-N539 WeakPolarHBondContact CD2-OD1 3.49Å; F516-N539 PolarHBondContact N-OD1 2.88Å; F516-N539 VanDerWaalsContact N-OD1 3.17Å; L536-N539 PolarHBondContact O-ND2 2.8Å; E537-N539 PolarHBondContact O-N 2.6Å; E537-N539 VanDerWaalsContact O-N 3.16Å; E537-N539 PolarHBondContact O-ND2 3.3Å; N539-W541 HydrophobicContact CB-CD2 4.19Å; N539-W541 HydrophobicContact CB-CG 4.42Å; N539-W541 HydrophobicContact CB-CZ2 3.79Å; N539-W541 VanDerWaalsContact O-CD1 3.26Å; N539-W541 PolarHBondContact O-N 3.47Å
540	P	93.1	Very high	88.6	Confident	43 Å²	43	34.2 Å²	34.2	28%	0.279	21%	0.213	S	C	.	.			trans	-80.2	59.7	-177.2	35.6	-38.3	0	0	0	112.2	N514 F516 E542 A569	N514-P540 WeakPolarHBondContact O-CD 3.46Å; F516-P540 CarbonylContact O-C 3.59Å; F516-P540 WeakPolarHBondContact O-CD 3.33Å; P540-E542 PolarHBondContact O-N 3.47Å; P540-A569 HydrophobicContact CB-CB 4.26Å
541	W	93.6	Very high	88.8	Confident	1 Å²	1	31.5 Å²	31.5	0%	0.004	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	125.5	-173.2	-65.1	109.9	0	0	0	112.9	F516 L519 L536 N539 L547 L550 V566 A569 S570	F516-W541 HydrophobicContact CB-CE3 4.43Å; F516-W541 HydrophobicContact CB-CH2 3.62Å; F516-W541 HydrophobicContact CB-CZ2 4.21Å; F516-W541 HydrophobicContact CB-CZ3 3.75Å; F516-W541 HydrophobicContact CG-CH2 4.3Å; L519-W541 HydrophobicContact CB-CH2 3.73Å; L519-W541 HydrophobicContact CB-CZ3 3.63Å; L519-W541 HydrophobicContact CD2-CH2 3.99Å; L536-W541 HydrophobicContact CB-CZ2 3.98Å; L536-W541 HydrophobicContact CD2-CZ2 4.32Å; L536-W541 PolarHBondContact O-NE1 3.04Å; L536-W541 VanDerWaalsContact O-NE1 3.07Å; N539-W541 HydrophobicContact CB-CD2 4.19Å; N539-W541 HydrophobicContact CB-CG 4.42Å; N539-W541 HydrophobicContact CB-CZ2 3.79Å; N539-W541 VanDerWaalsContact O-CD1 3.26Å; N539-W541 PolarHBondContact O-N 3.47Å; W541-L547 HydrophobicContact CB-CD2 4.08Å; W541-L547 HydrophobicContact CE3-CD1 3.78Å; W541-L547 HydrophobicContact CE3-CD2 4.42Å; W541-L547 HydrophobicContact CZ3-CD1 4.18Å; W541-L550 HydrophobicContact CE3-CD2 4.2Å; W541-L550 HydrophobicContact CH2-CD2 4.17Å; W541-L550 HydrophobicContact CZ3-CD2 3.93Å; W541-V566 HydrophobicContact CD2-CG1 4.26Å; W541-V566 HydrophobicContact CG-CG1 4Å; W541-A569 PolarHBondContact O-N 3.3Å; W541-S570 PolarHBondContact O-N 3.41Å; W541-S570 VanDerWaalsContact O-N 3.13Å
542	E	91.4	Very high	88.8	Confident	76 Å²	76	33.6 Å²	33.6	36%	0.355	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	100.7	171.4	-176.6	169	-139.6	0	0	109.3	M517 P540 S544 S570	M517-E542 HydrophobicContact CB-CB 4.23Å; M517-E542 PolarHBondContact O-N 3.37Å; P540-E542 PolarHBondContact O-N 3.47Å; E542-S544 PolarHBondContact O-N 3.2Å; E542-S570 CarbonylContact C-O 3.56Å; E542-S570 WeakPolarHBondContact CA-O 3.23Å
543	C	89.6	Confident	89.1	Confident	3 Å²	3	31.3 Å²	31.3	2%	0.02	19%	0.186	C	C	.	.			trans	-80.2	64.5	179.3	-67.3	0	0	0	0	110.7	L547 C568 S570 I582 L587	C543-L547 HydrophobicContact CB-CD2 4.42Å; C543-L547 VanDerWaalsContact SG-CD2 3.55Å; C543-C568 HydrophobicContact CB-CB 3.77Å; C543-C568 WeakPolarHBondContact CB-SG 3.43Å; C543-C568 VanDerWaalsContact SG-CA 3.54Å; C543-C568 WeakPolarHBondContact SG-CB 3.31Å; C543-C568 CovalentContact SG-SG 2.01Å; C543-C568 PolarHBondContact SG-SG 3.46Å; C543-S570 PolarHBondContact N-O 3.11Å; C543-I582 HydrophobicContact CB-CD1 4.39Å; C543-L587 HydrophobicContact CB-CD2 3.85Å; C543-L587 VanDerWaalsContact O-CD2 3.24Å; C543-L587 WeakPolarHBondContact O-CD2 3.38Å
544	S	88.3	Confident	89.3	Confident	29 Å²	29	30.6 Å²	30.6	20%	0.203	18%	0.183	C	C	.	.	S	Bend	trans	-95.2	-169.2	168.5	77	0	0	0	0	110.7	E542 D546 L547 L587	E542-S544 PolarHBondContact O-N 3.2Å; S544-D546 VanDerWaalsContact C-N 3.27Å; S544-D546 PolarHBondContact O-N 2.73Å; S544-D546 PolarHBondContact OG-N 2.98Å; S544-D546 PolarHBondContact OG-OD2 2.85Å; S544-L547 PolarHBondContact O-N 3.13Å; S544-L587 CarbonylContact C-O 3.41Å
545	C	87.1	Confident	89.2	Confident	55 Å²	55	35.3 Å²	35.3	37%	0.372	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-65.4	-28.8	177.5	-171.9	0	0	0	0	113.1	L547 V548 L587 C588	C545-L547 VanDerWaalsContact C-N 3.28Å; C545-L547 PolarHBondContact O-N 3.4Å; C545-V548 WeakPolarHBondContact O-CB 3.2Å; C545-V548 WeakPolarHBondContact O-CG2 3.38Å; C545-V548 PolarHBondContact O-N 2.98Å; C545-L587 VanDerWaalsContact CA-O 3.27Å; C545-L587 WeakPolarHBondContact CA-O 2.97Å; C545-L587 WeakPolarHBondContact CB-O 3.15Å; C545-L587 PolarHBondContact N-O 3.49Å; C545-L587 VanDerWaalsContact N-O 3.09Å; C545-C588 WeakPolarHBondContact CA-SG 3.5Å; C545-C588 HydrophobicContact CB-CB 3.97Å; C545-C588 WeakPolarHBondContact CB-SG 3.14Å; C545-C588 PolarHBondContact O-SG 3.47Å; C545-C588 WeakPolarHBondContact SG-CB 3.39Å; C545-C588 CovalentContact SG-SG 2.04Å; C545-C588 PolarHBondContact SG-SG 3.19Å
546	D	85.9	Confident	89.1	Confident	122 Å²	122	44.2 Å²	44.2	65%	0.652	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-68.6	-28.8	-177.9	-56	-59.9	0	0	0	112.2	T518 S544 V548	T518-D546 HydrophobicContact CG2-CB 4.29Å; S544-D546 VanDerWaalsContact C-N 3.27Å; S544-D546 PolarHBondContact O-N 2.73Å; S544-D546 PolarHBondContact OG-N 2.98Å; S544-D546 PolarHBondContact OG-OD2 2.85Å; D546-V548 VanDerWaalsContact C-N 3.27Å; D546-V548 PolarHBondContact O-N 3.1Å
547	L	89.1	Confident	88.6	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-78.5	-7.6	179.3	-147.3	70	0	0	0	113.6	T518 W541 C543 S544 C545 A549 L550 K551 L579	T518-L547 HydrophobicContact CG2-CD1 4.4Å; W541-L547 HydrophobicContact CB-CD2 4.08Å; W541-L547 HydrophobicContact CE3-CD1 3.78Å; W541-L547 HydrophobicContact CE3-CD2 4.42Å; W541-L547 HydrophobicContact CZ3-CD1 4.18Å; C543-L547 HydrophobicContact CB-CD2 4.42Å; C543-L547 VanDerWaalsContact SG-CD2 3.55Å; S544-L547 PolarHBondContact O-N 3.13Å; C545-L547 VanDerWaalsContact C-N 3.28Å; C545-L547 PolarHBondContact O-N 3.4Å; L547-A549 PolarHBondContact O-N 3.38Å; L547-L550 HydrophobicContact CD1-CB 4.17Å; L547-L550 HydrophobicContact CD1-CD2 3.69Å; L547-L550 HydrophobicContact CG-CB 4.28Å; L547-L550 HydrophobicContact CG-CD2 4.13Å; L547-L550 PolarHBondContact O-N 3.44Å; L547-L550 VanDerWaalsContact O-N 3.16Å; L547-K551 PolarHBondContact O-N 2.66Å; L547-L579 HydrophobicContact CD2-CD1 3.98Å; L547-L579 HydrophobicContact CD2-CD2 3.7Å; L547-L579 HydrophobicContact CD2-CG 4.44Å; L547-L579 HydrophobicContact CG-CD1 4.42Å; L547-L579 HydrophobicContact CG-CD2 3.89Å
548	V	88.9	Confident	87.5	Confident	15 Å²	15	46.3 Å²	46.3	9%	0.091	26%	0.258	C	S	.	.	H	α-helix	trans	-62.7	-31	175.7	175.2	0	0	0	0	111.7	C545 D546 K551 L552 N584 L587 C588	C545-V548 WeakPolarHBondContact O-CB 3.2Å; C545-V548 WeakPolarHBondContact O-CG2 3.38Å; C545-V548 PolarHBondContact O-N 2.98Å; D546-V548 VanDerWaalsContact C-N 3.27Å; D546-V548 PolarHBondContact O-N 3.1Å; V548-K551 PolarHBondContact O-N 2.03Å; V548-L552 HydrophobicContact CG1-CD1 4.01Å; V548-L552 HydrophobicContact CG1-CG 4.33Å; V548-L552 WeakPolarHBondContact O-CB 3.02Å; V548-L552 WeakPolarHBondContact O-CG 2.99Å; V548-L552 PolarHBondContact O-N 3.46Å; V548-N584 HydrophobicContact CG1-CB 4.49Å; V548-L587 HydrophobicContact CG2-CB 3.49Å; V548-L587 VanDerWaalsContact CG2-CB 3.49Å; V548-L587 HydrophobicContact CG2-CD1 3.8Å; V548-L587 HydrophobicContact CG2-CG 4.28Å; V548-C588 VanDerWaalsContact CG2-SG 3.57Å
549	A	87.9	Confident	86.1	Confident	48 Å²	48	51.7 Å²	51.7	40%	0.397	27%	0.274	S	S	.	.	H	α-helix	trans	-61.7	-50.3	172.6	0	0	0	0	0	111.3	V521 L547 K551 L552 W553	V521-A549 HydrophobicContact CB-CB 4.43Å; V521-A549 HydrophobicContact CG2-CB 4.23Å; V521-A549 WeakPolarHBondContact CG2-O 3.47Å; L547-A549 PolarHBondContact O-N 3.38Å; A549-K551 VanDerWaalsContact C-N 3.34Å; A549-K551 PolarHBondContact O-N 3.19Å; A549-L552 PolarHBondContact O-N 2.93Å; A549-W553 PolarHBondContact O-N 2.97Å
550	L	90.3	Very high	84.4	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-59.7	-44.4	177.3	-178.9	66.5	0	0	0	111.1	V521 L525 L536 W541 L547 L552 W553 L554 L579	V521-L550 HydrophobicContact CG2-CB 4.42Å; L525-L550 HydrophobicContact CD1-CD1 3.47Å; L525-L550 VanDerWaalsContact CD1-CD1 3.47Å; L536-L550 HydrophobicContact CD1-CD1 4.15Å; W541-L550 HydrophobicContact CE3-CD2 4.2Å; W541-L550 HydrophobicContact CH2-CD2 4.17Å; W541-L550 HydrophobicContact CZ3-CD2 3.93Å; L547-L550 HydrophobicContact CD1-CB 4.17Å; L547-L550 HydrophobicContact CD1-CD2 3.69Å; L547-L550 HydrophobicContact CG-CB 4.28Å; L547-L550 HydrophobicContact CG-CD2 4.13Å; L547-L550 PolarHBondContact O-N 3.44Å; L547-L550 VanDerWaalsContact O-N 3.16Å; L550-L552 PolarHBondContact O-N 3.44Å; L550-W553 HydrophobicContact CD1-CE3 4.19Å; L550-W553 PolarHBondContact O-N 3.37Å; L550-L554 HydrophobicContact CD1-CD1 4.34Å; L550-L554 HydrophobicContact CD1-CG 4.36Å; L550-L554 HydrophobicContact CD2-CD1 4.47Å; L550-L554 HydrophobicContact CG-CD1 3.92Å; L550-L554 HydrophobicContact CG-CG 4.37Å; L550-L554 WeakPolarHBondContact O-CG 3.26Å; L550-L554 PolarHBondContact O-N 2.97Å; L550-L579 HydrophobicContact CD2-CD2 4.31Å; L550-L579 HydrophobicContact CG-CD2 4.46Å
551	K	88.9	Confident	83.5	Confident	8 Å²	8	52.9 Å²	52.9	4%	0.035	29%	0.293	C	S	.	.	H	α-helix	trans	-56.3	-51	175.4	-173.1	-169.8	174.7	-172.3	0	112	L547 V548 A549 W553 L554 Q555 L579 R580 I582 N584 L587	L547-K551 PolarHBondContact O-N 2.66Å; V548-K551 PolarHBondContact O-N 2.03Å; A549-K551 VanDerWaalsContact C-N 3.34Å; A549-K551 PolarHBondContact O-N 3.19Å; K551-W553 PolarHBondContact O-N 3.07Å; K551-L554 PolarHBondContact O-N 2.9Å; K551-Q555 WeakPolarHBondContact O-CG 3.45Å; K551-Q555 PolarHBondContact O-N 2.73Å; K551-L579 HydrophobicContact CB-CD1 4.09Å; K551-L579 HydrophobicContact CB-CD2 4.06Å; K551-L579 HydrophobicContact CB-CG 3.86Å; K551-L579 HydrophobicContact CD-CD1 4.48Å; K551-L579 VanDerWaalsContact CD-O 3.26Å; K551-L579 WeakPolarHBondContact CD-O 3.34Å; K551-L579 WeakPolarHBondContact CE-O 3.44Å; K551-L579 HydrophobicContact CG-CD1 4.4Å; K551-L579 HydrophobicContact CG-CG 4.05Å; K551-R580 WeakPolarHBondContact CE-O 3.3Å; K551-R580 PolarHBondContact NZ-O 2.73Å; K551-R580 VanDerWaalsContact NZ-O 3.17Å; K551-I582 PolarHBondContact NZ-O 3.06Å; K551-N584 PolarHBondContact NZ-OD1 2.91Å; K551-L587 HydrophobicContact CD-CD1 4.25Å
552	L	87.9	Confident	82.3	Confident	58 Å²	58	54.9 Å²	54.9	30%	0.304	31%	0.31	S	S	.	.	H	α-helix	trans	-65.2	-25.1	-179.4	-72.2	172.4	0	0	0	112.7	V548 A549 L550 R556	V548-L552 HydrophobicContact CG1-CD1 4.01Å; V548-L552 HydrophobicContact CG1-CG 4.33Å; V548-L552 WeakPolarHBondContact O-CB 3.02Å; V548-L552 WeakPolarHBondContact O-CG 2.99Å; V548-L552 PolarHBondContact O-N 3.46Å; A549-L552 PolarHBondContact O-N 2.93Å; L550-L552 PolarHBondContact O-N 3.44Å; L552-R556 WeakPolarHBondContact O-CB 3.46Å; L552-R556 VanDerWaalsContact O-CD 3.3Å; L552-R556 WeakPolarHBondContact O-CD 3.44Å; L552-R556 WeakPolarHBondContact O-CG 3.42Å; L552-R556 PolarHBondContact O-N 3.14Å
553	W	89.5	Confident	81.8	Confident	34 Å²	34	52.3 Å²	52.3	13%	0.129	30%	0.302	C	S	.	.	H	α-helix	trans	-77	-44.1	172	-178.7	89.7	0	0	0	111.8	V521 L525 L531 I534 A549 L550 K551 Q555 R556 L557	V521-W553 HydrophobicContact CB-CB 4.47Å; V521-W553 HydrophobicContact CG1-CB 3.98Å; V521-W553 HydrophobicContact CG1-CG 3.89Å; V521-W553 HydrophobicContact CG2-CB 3.6Å; V521-W553 HydrophobicContact CG2-CG 3.99Å; L525-W553 HydrophobicContact CB-CD2 4.12Å; L525-W553 HydrophobicContact CB-CH2 4.27Å; L525-W553 HydrophobicContact CB-CZ2 3.75Å; L525-W553 HydrophobicContact CD1-CD2 4.23Å; L525-W553 HydrophobicContact CD1-CE3 3.98Å; L525-W553 HydrophobicContact CD1-CH2 4.32Å; L525-W553 HydrophobicContact CD1-CZ3 4.03Å; L525-W553 HydrophobicContact CD2-CH2 4.25Å; L525-W553 HydrophobicContact CD2-CZ2 4.45Å; L525-W553 HydrophobicContact CG-CZ2 4.48Å; L525-W553 PolarHBondContact O-NE1 2.85Å; L531-W553 HydrophobicContact CD2-CH2 3.83Å; L531-W553 HydrophobicContact CD2-CZ2 3.98Å; I534-W553 HydrophobicContact CD1-CH2 3.73Å; I534-W553 HydrophobicContact CD1-CZ3 4.11Å; I534-W553 HydrophobicContact CG2-CH2 4.14Å; I534-W553 HydrophobicContact CG2-CZ3 4.33Å; A549-W553 PolarHBondContact O-N 2.97Å; L550-W553 HydrophobicContact CD1-CE3 4.19Å; L550-W553 PolarHBondContact O-N 3.37Å; K551-W553 PolarHBondContact O-N 3.07Å; W553-Q555 PolarHBondContact O-N 2.85Å; W553-Q555 VanDerWaalsContact O-N 3.13Å; W553-R556 CarbonylContact O-C 3.48Å; W553-R556 WeakPolarHBondContact O-CA 3.14Å; W553-R556 PolarHBondContact O-N 2.97Å; W553-L557 HydrophobicContact CD2-CD2 4.43Å; W553-L557 HydrophobicContact CE3-CD1 4.37Å; W553-L557 HydrophobicContact CE3-CG 4.36Å; W553-L557 HydrophobicContact CH2-CD1 4.21Å; W553-L557 HydrophobicContact CH2-CD2 3.79Å; W553-L557 HydrophobicContact CH2-CG 4.34Å; W553-L557 HydrophobicContact CZ2-CD2 3.67Å; W553-L557 HydrophobicContact CZ2-CG 4.49Å; W553-L557 HydrophobicContact CZ3-CD1 3.95Å; W553-L557 HydrophobicContact CZ3-CD2 4.21Å; W553-L557 HydrophobicContact CZ3-CG 4.27Å; W553-L557 PolarHBondContact O-N 3.34Å
554	L	87.9	Confident	81.1	Confident	7 Å²	7	55.6 Å²	55.6	4%	0.037	32%	0.315	C	S	.	.	H	α-helix	trans	-64.2	-13.4	173.4	-69	169.8	0	0	0	114.4	L536 L550 K551 L557 A563 V566 L579 R580	L536-L554 HydrophobicContact CD1-CD2 4.25Å; L550-L554 HydrophobicContact CD1-CD1 4.34Å; L550-L554 HydrophobicContact CD1-CG 4.36Å; L550-L554 HydrophobicContact CD2-CD1 4.47Å; L550-L554 HydrophobicContact CG-CD1 3.92Å; L550-L554 HydrophobicContact CG-CG 4.37Å; L550-L554 WeakPolarHBondContact O-CG 3.26Å; L550-L554 PolarHBondContact O-N 2.97Å; K551-L554 PolarHBondContact O-N 2.9Å; L554-L557 HydrophobicContact CD2-CD1 4.05Å; L554-A563 HydrophobicContact CD2-CB 4.47Å; L554-V566 HydrophobicContact CD1-CB 4.12Å; L554-V566 HydrophobicContact CD1-CG1 4.48Å; L554-V566 HydrophobicContact CD1-CG2 3.76Å; L554-L579 HydrophobicContact CD1-CD2 4.26Å; L554-R580 PolarHBondContact O-NE 3.37Å; L554-R580 PolarHBondContact O-NH2 3.36Å
555	Q	85.4	Confident	80.8	Confident	101 Å²	101	58.9 Å²	58.9	47%	0.472	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-1.7	171	-69.2	-178.7	-44.7	0	0	113.5	K551 W553	K551-Q555 WeakPolarHBondContact O-CG 3.45Å; K551-Q555 PolarHBondContact O-N 2.73Å; W553-Q555 PolarHBondContact O-N 2.85Å; W553-Q555 VanDerWaalsContact O-N 3.13Å
556	R	84.6	Confident	80.8	Confident	198 Å²	198	56.4 Å²	56.4	75%	0.747	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.1	-5.1	180	-74.3	175.7	-177.9	171.1	1	113.8	L552 W553 S558	L552-R556 WeakPolarHBondContact O-CB 3.46Å; L552-R556 VanDerWaalsContact O-CD 3.3Å; L552-R556 WeakPolarHBondContact O-CD 3.44Å; L552-R556 WeakPolarHBondContact O-CG 3.42Å; L552-R556 PolarHBondContact O-N 3.14Å; W553-R556 CarbonylContact O-C 3.48Å; W553-R556 WeakPolarHBondContact O-CA 3.14Å; W553-R556 PolarHBondContact O-N 2.97Å; R556-S558 PolarHBondContact O-N 2.78Å
557	L	81.1	Confident	81	Confident	33 Å²	33	55.4 Å²	55.4	17%	0.173	30%	0.301	C	S	.	.	S	Bend	trans	-51.8	132.6	161.8	-74.6	177.6	0	0	0	108.5	I534 W553 L554 V561 A563	I534-L557 HydrophobicContact CG2-CD1 4.37Å; W553-L557 HydrophobicContact CD2-CD2 4.43Å; W553-L557 HydrophobicContact CE3-CD1 4.37Å; W553-L557 HydrophobicContact CE3-CG 4.36Å; W553-L557 HydrophobicContact CH2-CD1 4.21Å; W553-L557 HydrophobicContact CH2-CD2 3.79Å; W553-L557 HydrophobicContact CH2-CG 4.34Å; W553-L557 HydrophobicContact CZ2-CD2 3.67Å; W553-L557 HydrophobicContact CZ2-CG 4.49Å; W553-L557 HydrophobicContact CZ3-CD1 3.95Å; W553-L557 HydrophobicContact CZ3-CD2 4.21Å; W553-L557 HydrophobicContact CZ3-CG 4.27Å; W553-L557 PolarHBondContact O-N 3.34Å; L554-L557 HydrophobicContact CD2-CD1 4.05Å; L557-V561 HydrophobicContact CB-CB 4.38Å; L557-V561 HydrophobicContact CD1-CG1 4.3Å; L557-V561 HydrophobicContact CD2-CB 4.32Å; L557-V561 HydrophobicContact CD2-CG1 4.09Å; L557-V561 HydrophobicContact CD2-CG2 4.44Å; L557-A563 HydrophobicContact CD1-CB 3.72Å
558	S	66.8	Low	81.1	Confident	82 Å²	82	55.4 Å²	55.4	57%	0.573	30%	0.301	S	S	*	.			trans	-64.5	147.3	172.3	48.1	0	0	0	0	110.1	R556 G560 V561	R556-S558 PolarHBondContact O-N 2.78Å; S558-G560 PolarHBondContact O-N 2.97Å; S558-V561 WeakPolarHBondContact O-CG2 3.29Å; S558-V561 PolarHBondContact O-N 2.82Å
559	D	57.1	Low	81.1	Confident	162 Å²	162	57 Å²	57	87%	0.866	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-28.6	-167.5	-48	-63.8	0	0	0	114	V561	D559-V561 VanDerWaalsContact C-N 3.27Å; D559-V561 PolarHBondContact O-N 3.28Å
560	G	57.8	Low	81.1	Confident	60 Å²	60	56.8 Å²	56.8	62%	0.619	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	21.8	173.9	0	0	0	0	0	116.5	S558	S558-G560 PolarHBondContact O-N 2.97Å
561	V	73.5	Confident	80.8	Confident	18 Å²	18	59 Å²	59	11%	0.109	33%	0.326	C	S	.	.	S	Bend	trans	-111	107.3	171.7	-173.1	0	0	0	0	110	L531 T532 L557 S558 D559 A563	L531-V561 HydrophobicContact CD2-CG1 4.32Å; L531-V561 HydrophobicContact CG-CG1 4.22Å; L531-V561 VanDerWaalsContact O-CG2 3.3Å; L531-V561 WeakPolarHBondContact O-CG2 3.32Å; T532-V561 CarbonylContact O-C 3.51Å; T532-V561 WeakPolarHBondContact O-CA 3.28Å; L557-V561 HydrophobicContact CB-CB 4.38Å; L557-V561 HydrophobicContact CD1-CG1 4.3Å; L557-V561 HydrophobicContact CD2-CB 4.32Å; L557-V561 HydrophobicContact CD2-CG1 4.09Å; L557-V561 HydrophobicContact CD2-CG2 4.44Å; S558-V561 WeakPolarHBondContact O-CG2 3.29Å; S558-V561 PolarHBondContact O-N 2.82Å; D559-V561 VanDerWaalsContact C-N 3.27Å; D559-V561 PolarHBondContact O-N 3.28Å; V561-A563 PolarHBondContact O-N 3.1Å; V561-A563 VanDerWaalsContact O-N 3.08Å
562	A	69.8	Low	80.5	Confident	43 Å²	43	64.9 Å²	64.9	36%	0.355	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	110	178.9	0	0	0	0	0	110.6	T532 Q533 I534	T532-A562 PolarHBondContact O-N 2.97Å; Q533-A562 VanDerWaalsContact CA-O 3.32Å; Q533-A562 WeakPolarHBondContact CA-O 3.42Å; Q533-A562 HydrophobicContact CB-CB 4.12Å; Q533-A562 HydrophobicContact CG-CB 4.14Å; I534-A562 PolarHBondContact N-O 2.97Å
563	A	81.3	Confident	80.2	Confident	21 Å²	21	69.3 Å²	69.3	17%	0.174	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	107.1	180	0	0	0	0	0	110.6	I534 L554 L557 V561	I534-A563 HydrophobicContact CG2-CB 3.88Å; L554-A563 HydrophobicContact CD2-CB 4.47Å; L557-A563 HydrophobicContact CD1-CB 3.72Å; V561-A563 PolarHBondContact O-N 3.1Å; V561-A563 VanDerWaalsContact O-N 3.08Å
564	K	75.1	Confident	80	Confident	72 Å²	72	69.2 Å²	69.2	31%	0.313	38%	0.381	S	S	.	.			trans	-70.1	159.6	-178.4	-64.4	-166.3	174.1	-165	0	112.4	V566	K564-V566 PolarHBondContact O-N 2.82Å
565	E	80.1	Confident	79.8	Confident	99 Å²	99	70.9 Å²	70.9	46%	0.463	40%	0.396	S	S	.	.			trans	-50.5	132.2	-176.5	-68	177.8	179.1	0	0	113.6	K567 E578	E565-K567 WeakPolarHBondContact OE2-CE 3.44Å; E565-K567 IonicContact OE2-NZ 2.61Å; E565-K567 PolarHBondContact OE2-NZ 3Å; E565-E578 HydrophobicContact CB-CG 4.21Å; E565-E578 HydrophobicContact CG-CG 4.45Å
566	V	88.3	Confident	79.7	Confident	3 Å²	3	72.6 Å²	72.6	2%	0.018	41%	0.409	C	S	.	.			trans	-103.2	104.9	175.7	170.2	0	0	0	0	108.8	L536 W541 L554 K564 E578 L579	L536-V566 HydrophobicContact CB-CG2 3.82Å; L536-V566 HydrophobicContact CD1-CG2 4.13Å; W541-V566 HydrophobicContact CD2-CG1 4.26Å; W541-V566 HydrophobicContact CG-CG1 4Å; L554-V566 HydrophobicContact CD1-CB 4.12Å; L554-V566 HydrophobicContact CD1-CG1 4.48Å; L554-V566 HydrophobicContact CD1-CG2 3.76Å; K564-V566 PolarHBondContact O-N 2.82Å; V566-E578 WeakPolarHBondContact O-CA 3.38Å; V566-L579 HydrophobicContact CB-CB 4.32Å; V566-L579 HydrophobicContact CG1-CB 3.97Å; V566-L579 HydrophobicContact CG1-CD2 3.78Å; V566-L579 WeakPolarHBondContact O-CB 3.32Å; V566-L579 PolarHBondContact O-N 3.43Å
567	K	89.1	Confident	79.7	Confident	100 Å²	100	66.5 Å²	66.5	44%	0.435	39%	0.39	S	S	.	.	B	Isolated β-bridge	trans	-98.2	132.3	-177.6	-73.6	171.3	179	155.9	0	111.8	E565 I577	E565-K567 WeakPolarHBondContact OE2-CE 3.44Å; E565-K567 IonicContact OE2-NZ 2.61Å; E565-K567 PolarHBondContact OE2-NZ 3Å; K567-I577 WeakPolarHBondContact CA-O 3.08Å
568	C	90.9	Very high	80	Confident	2 Å²	2	66.4 Å²	66.4	1%	0.014	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	143.3	177.9	-62	0	0	0	0	111.6	C543 F574 A575 N576 I577 I582	C543-C568 HydrophobicContact CB-CB 3.77Å; C543-C568 WeakPolarHBondContact CB-SG 3.43Å; C543-C568 VanDerWaalsContact SG-CA 3.54Å; C543-C568 WeakPolarHBondContact SG-CB 3.31Å; C543-C568 CovalentContact SG-SG 2.01Å; C543-C568 PolarHBondContact SG-SG 3.46Å; C568-F574 HydrophobicContact CB-CB 4.18Å; C568-F574 WeakPolarHBondContact CB-O 3.33Å; C568-A575 CarbonylContact O-C 3.08Å; C568-A575 WeakPolarHBondContact O-CA 3.35Å; C568-N576 PolarHBondContact O-N 3.05Å; C568-I577 PolarHBondContact N-O 2.87Å; C568-I582 WeakPolarHBondContact SG-CD1 3.45Å
569	A	90.4	Very high	81	Confident	47 Å²	47	62.5 Å²	62.5	39%	0.388	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	-32.1	172.9	0	0	0	0	0	112.6	P540 W541	P540-A569 HydrophobicContact CB-CB 4.26Å; W541-A569 PolarHBondContact O-N 3.3Å
570	S	86.6	Confident	82.3	Confident	45 Å²	45	59 Å²	59	32%	0.315	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	149.6	176.5	-176.3	0	0	0	0	110.2	W541 E542 C543	W541-S570 PolarHBondContact O-N 3.41Å; W541-S570 VanDerWaalsContact O-N 3.13Å; E542-S570 CarbonylContact C-O 3.56Å; E542-S570 WeakPolarHBondContact CA-O 3.23Å; C543-S570 PolarHBondContact N-O 3.11Å
571	P	84.8	Confident	83.5	Confident	46 Å²	46	62.4 Å²	62.4	30%	0.299	34%	0.339	S	S	.	.	S	Bend	cis	-66.4	162.8	-15.2	30.4	-37.2	0	0	0	111.8	Q573 F574 A575	P571-Q573 PolarHBondContact O-N 3.25Å; P571-F574 HydrophobicContact CG-CD2 3.7Å; P571-F574 HydrophobicContact CG-CE2 3.9Å; P571-F574 PolarHBondContact O-N 3.28Å; P571-A575 PolarHBondContact O-N 2.83Å
572	V	83.2	Confident	83.9	Confident	132 Å²	132	62 Å²	62	80%	0.8	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-55.4	-22.5	-177.5	-63.3	0	0	0	0	114.8	F574 A575	V572-F574 PolarHBondContact O-N 3.12Å; V572-A575 PolarHBondContact O-N 2.87Å
573	Q	81.8	Confident	84.5	Confident	151 Å²	151	66.4 Å²	66.4	71%	0.706	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-64	-23.5	175.2	-62.2	177	5.7	0	0	113.3	P571	P571-Q573 PolarHBondContact O-N 3.25Å
574	F	83.9	Confident	84.5	Confident	31 Å²	31	67.9 Å²	67.9	14%	0.136	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-117.4	6.6	180	-50.4	-44	0	0	0	112.8	C568 P571 V572 N576 I577 I582 I586	C568-F574 HydrophobicContact CB-CB 4.18Å; C568-F574 WeakPolarHBondContact CB-O 3.33Å; P571-F574 HydrophobicContact CG-CD2 3.7Å; P571-F574 HydrophobicContact CG-CE2 3.9Å; P571-F574 PolarHBondContact O-N 3.28Å; V572-F574 PolarHBondContact O-N 3.12Å; F574-N576 PolarHBondContact O-N 2.86Å; F574-I577 HydrophobicContact CB-CD1 4.5Å; F574-I577 HydrophobicContact CD1-CD1 4.42Å; F574-I577 WeakPolarHBondContact O-CB 3.29Å; F574-I577 PolarHBondContact O-N 3.32Å; F574-I582 HydrophobicContact CB-CD1 3.8Å; F574-I582 HydrophobicContact CD1-CD1 4.43Å; F574-I582 HydrophobicContact CG-CD1 4Å; F574-I586 HydrophobicContact CE1-CG2 3.79Å; F574-I586 HydrophobicContact CE2-CG2 4.14Å; F574-I586 HydrophobicContact CZ-CG2 3.32Å
575	A	84.1	Confident	84.6	Confident	42 Å²	42	70.6 Å²	70.6	35%	0.347	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	134	-178.3	0	0	0	0	0	111.8	C568 P571 V572 I577	C568-A575 CarbonylContact O-C 3.08Å; C568-A575 WeakPolarHBondContact O-CA 3.35Å; P571-A575 PolarHBondContact O-N 2.83Å; V572-A575 PolarHBondContact O-N 2.87Å; A575-I577 PolarHBondContact O-N 2.8Å
576	N	82.9	Confident	84.5	Confident	137 Å²	137	70.1 Å²	70.1	73%	0.733	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	2.2	-173	-59.3	-32.2	0	0	0	116.7	C568 F574	C568-N576 PolarHBondContact O-N 3.05Å; F574-N576 PolarHBondContact O-N 2.86Å
577	I	85.8	Confident	84.1	Confident	70 Å²	70	70.2 Å²	70.2	36%	0.359	37%	0.367	S	S	.	.			trans	-80.1	141.3	173.4	-55.2	178.4	0	0	0	109.8	K567 C568 F574 A575 I582	K567-I577 WeakPolarHBondContact CA-O 3.08Å; C568-I577 PolarHBondContact N-O 2.87Å; F574-I577 HydrophobicContact CB-CD1 4.5Å; F574-I577 HydrophobicContact CD1-CD1 4.42Å; F574-I577 WeakPolarHBondContact O-CB 3.29Å; F574-I577 PolarHBondContact O-N 3.32Å; A575-I577 PolarHBondContact O-N 2.8Å; I577-I582 HydrophobicContact CB-CD1 4.36Å; I577-I582 HydrophobicContact CB-CG1 4.49Å; I577-I582 HydrophobicContact CG2-CD1 4.13Å; I577-I582 HydrophobicContact CG2-CG1 3.74Å
578	E	87.6	Confident	83.7	Confident	32 Å²	32	65.8 Å²	65.8	15%	0.15	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-73.6	133.3	175.7	-158.6	-144.9	169	0	0	111.8	E565 V566 R580 L581	E565-E578 HydrophobicContact CB-CG 4.21Å; E565-E578 HydrophobicContact CG-CG 4.45Å; V566-E578 WeakPolarHBondContact O-CA 3.38Å; E578-R580 PolarHBondContact O-N 2.92Å; E578-R580 VanDerWaalsContact OE1-CD 3.31Å; E578-R580 WeakPolarHBondContact OE1-CD 3.18Å; E578-R580 WeakPolarHBondContact OE1-CG 3.37Å; E578-R580 IonicContact OE1-NH1 2.67Å; E578-L581 HydrophobicContact CB-CD1 4.07Å; E578-L581 HydrophobicContact CB-CG 4.26Å; E578-L581 WeakPolarHBondContact O-CB 3.1Å; E578-L581 PolarHBondContact O-N 3.33Å
579	L	86.7	Confident	82.5	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-30.5	-178.3	178.3	60	0	0	0	113.5	L547 L550 K551 L554 V566 L581 L587	L547-L579 HydrophobicContact CD2-CD1 3.98Å; L547-L579 HydrophobicContact CD2-CD2 3.7Å; L547-L579 HydrophobicContact CD2-CG 4.44Å; L547-L579 HydrophobicContact CG-CD1 4.42Å; L547-L579 HydrophobicContact CG-CD2 3.89Å; L550-L579 HydrophobicContact CD2-CD2 4.31Å; L550-L579 HydrophobicContact CG-CD2 4.46Å; K551-L579 HydrophobicContact CB-CD1 4.09Å; K551-L579 HydrophobicContact CB-CD2 4.06Å; K551-L579 HydrophobicContact CB-CG 3.86Å; K551-L579 HydrophobicContact CD-CD1 4.48Å; K551-L579 VanDerWaalsContact CD-O 3.26Å; K551-L579 WeakPolarHBondContact CD-O 3.34Å; K551-L579 WeakPolarHBondContact CE-O 3.44Å; K551-L579 HydrophobicContact CG-CD1 4.4Å; K551-L579 HydrophobicContact CG-CG 4.05Å; L554-L579 HydrophobicContact CD1-CD2 4.26Å; V566-L579 HydrophobicContact CB-CB 4.32Å; V566-L579 HydrophobicContact CG1-CB 3.97Å; V566-L579 HydrophobicContact CG1-CD2 3.78Å; V566-L579 WeakPolarHBondContact O-CB 3.32Å; V566-L579 PolarHBondContact O-N 3.43Å; L579-L581 VanDerWaalsContact C-N 3.3Å; L579-L581 PolarHBondContact O-N 3.16Å; L579-L587 HydrophobicContact CD1-CD1 4.08Å
580	R	84.7	Confident	81	Confident	89 Å²	89	76 Å²	76	34%	0.336	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-36	176.9	-70.4	-174.8	167.6	134.2	-10	112	K551 L554 E578	K551-R580 WeakPolarHBondContact CE-O 3.3Å; K551-R580 PolarHBondContact NZ-O 2.73Å; K551-R580 VanDerWaalsContact NZ-O 3.17Å; L554-R580 PolarHBondContact O-NE 3.37Å; L554-R580 PolarHBondContact O-NH2 3.36Å; E578-R580 PolarHBondContact O-N 2.92Å; E578-R580 VanDerWaalsContact OE1-CD 3.31Å; E578-R580 WeakPolarHBondContact OE1-CD 3.18Å; E578-R580 WeakPolarHBondContact OE1-CG 3.37Å; E578-R580 IonicContact OE1-NH1 2.67Å
581	L	82.4	Confident	79.4	Confident	130 Å²	130	80.6 Å²	80.6	68%	0.681	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-30	-175	-59.1	173.9	0	0	0	113.9	E578 L579 K583	E578-L581 HydrophobicContact CB-CD1 4.07Å; E578-L581 HydrophobicContact CB-CG 4.26Å; E578-L581 WeakPolarHBondContact O-CB 3.1Å; E578-L581 PolarHBondContact O-N 3.33Å; L579-L581 VanDerWaalsContact C-N 3.3Å; L579-L581 PolarHBondContact O-N 3.16Å; L581-K583 PolarHBondContact O-N 2.59Å
582	I	82.9	Confident	77.6	Confident	10 Å²	10	83 Å²	83	5%	0.051	43%	0.426	C	S	.	.	S	Bend	trans	-74.5	123.1	-174.5	-52.2	172.5	0	0	0	110.7	C543 K551 C568 F574 I577 I586 L587	C543-I582 HydrophobicContact CB-CD1 4.39Å; K551-I582 PolarHBondContact NZ-O 3.06Å; C568-I582 WeakPolarHBondContact SG-CD1 3.45Å; F574-I582 HydrophobicContact CB-CD1 3.8Å; F574-I582 HydrophobicContact CD1-CD1 4.43Å; F574-I582 HydrophobicContact CG-CD1 4Å; I577-I582 HydrophobicContact CB-CD1 4.36Å; I577-I582 HydrophobicContact CB-CG1 4.49Å; I577-I582 HydrophobicContact CG2-CD1 4.13Å; I577-I582 HydrophobicContact CG2-CG1 3.74Å; I582-I586 HydrophobicContact CG2-CB 4.27Å; I582-I586 HydrophobicContact CG2-CG2 4.3Å; I582-L587 HydrophobicContact CB-CD1 4.4Å; I582-L587 HydrophobicContact CB-CD2 4.41Å; I582-L587 HydrophobicContact CB-CG 4.42Å; I582-L587 HydrophobicContact CD1-CD2 4.48Å; I582-L587 HydrophobicContact CG2-CD1 4.31Å; I582-L587 HydrophobicContact CG2-CD2 3.84Å; I582-L587 HydrophobicContact CG2-CG 3.81Å
583	K	81.7	Confident	75.3	Confident	135 Å²	135	81.4 Å²	81.4	59%	0.587	42%	0.417	S	S	*	.			trans	-61.4	140.6	179.8	-66.4	-175.2	177.8	-176.5	0	112.4	L581 E585 I586 L587	L581-K583 PolarHBondContact O-N 2.59Å; K583-E585 PolarHBondContact O-N 2.79Å; K583-I586 HydrophobicContact CB-CD1 3.96Å; K583-I586 HydrophobicContact CB-CG1 4.12Å; K583-I586 HydrophobicContact CG-CD1 4.49Å; K583-I586 WeakPolarHBondContact O-CB 3.11Å; K583-I586 PolarHBondContact O-N 3.18Å; K583-L587 PolarHBondContact O-N 3.29Å
584	N	81.8	Confident	73.3	Confident	53 Å²	53	79.6 Å²	79.6	28%	0.283	42%	0.418	S	S	.	.	H	α-helix	trans	-61.6	-30.8	-176.5	-57.5	11.2	0	0	0	112.5	V548 K551 I586 L587 C588	V548-N584 HydrophobicContact CG1-CB 4.49Å; K551-N584 PolarHBondContact NZ-OD1 2.91Å; N584-I586 VanDerWaalsContact C-N 3.27Å; N584-I586 PolarHBondContact O-N 3.06Å; N584-L587 PolarHBondContact O-N 3.35Å; N584-C588 PolarHBondContact O-N 3.41Å
585	E	77.3	Confident	71	Confident	129 Å²	129	83.5 Å²	83.5	60%	0.603	45%	0.446	S	S	*	.	H	α-helix	trans	-60.5	-33	173.8	-65.9	155	-167	0	0	113	K583 C588	K583-E585 PolarHBondContact O-N 2.79Å; E585-C588 CarbonylContact O-C 3.43Å
586	I	78.6	Confident	68.9	Low	88 Å²	88	87.4 Å²	87.4	45%	0.451	47%	0.468	S	S	.	.	H	α-helix	trans	-80.4	-36	-178.9	-58	174.2	0	0	0	110.2	F574 I582 K583 N584	F574-I586 HydrophobicContact CE1-CG2 3.79Å; F574-I586 HydrophobicContact CE2-CG2 4.14Å; F574-I586 HydrophobicContact CZ-CG2 3.32Å; I582-I586 HydrophobicContact CG2-CB 4.27Å; I582-I586 HydrophobicContact CG2-CG2 4.3Å; K583-I586 HydrophobicContact CB-CD1 3.96Å; K583-I586 HydrophobicContact CB-CG1 4.12Å; K583-I586 HydrophobicContact CG-CD1 4.49Å; K583-I586 WeakPolarHBondContact O-CB 3.11Å; K583-I586 PolarHBondContact O-N 3.18Å; N584-I586 VanDerWaalsContact C-N 3.27Å; N584-I586 PolarHBondContact O-N 3.06Å
587	L	78.4	Confident	66.9	Low	6 Å²	6	89.1 Å²	89.1	3%	0.031	48%	0.476	C	S	.	.	H	α-helix	trans	-72.4	-39.6	175.4	-62.8	168.9	0	0	0	112.1	C543 S544 C545 V548 K551 L579 I582 K583 N584 P589	C543-L587 HydrophobicContact CB-CD2 3.85Å; C543-L587 VanDerWaalsContact O-CD2 3.24Å; C543-L587 WeakPolarHBondContact O-CD2 3.38Å; S544-L587 CarbonylContact C-O 3.41Å; C545-L587 VanDerWaalsContact CA-O 3.27Å; C545-L587 WeakPolarHBondContact CA-O 2.97Å; C545-L587 WeakPolarHBondContact CB-O 3.15Å; C545-L587 PolarHBondContact N-O 3.49Å; C545-L587 VanDerWaalsContact N-O 3.09Å; V548-L587 HydrophobicContact CG2-CB 3.49Å; V548-L587 VanDerWaalsContact CG2-CB 3.49Å; V548-L587 HydrophobicContact CG2-CD1 3.8Å; V548-L587 HydrophobicContact CG2-CG 4.28Å; K551-L587 HydrophobicContact CD-CD1 4.25Å; L579-L587 HydrophobicContact CD1-CD1 4.08Å; I582-L587 HydrophobicContact CB-CD1 4.4Å; I582-L587 HydrophobicContact CB-CD2 4.41Å; I582-L587 HydrophobicContact CB-CG 4.42Å; I582-L587 HydrophobicContact CD1-CD2 4.48Å; I582-L587 HydrophobicContact CG2-CD1 4.31Å; I582-L587 HydrophobicContact CG2-CD2 3.84Å; I582-L587 HydrophobicContact CG2-CG 3.81Å; K583-L587 PolarHBondContact O-N 3.29Å; N584-L587 PolarHBondContact O-N 3.35Å; L587-P589 WeakPolarHBondContact O-CD 3.3Å
588	C	80.3	Confident	64.4	Low	6 Å²	6	91.3 Å²	91.3	4%	0.041	50%	0.497	C	S	.	.			trans	-120.8	70.1	-179.9	-73.1	0	0	0	0	112.6	C545 V548 N584 E585 K590 L591	C545-C588 WeakPolarHBondContact CA-SG 3.5Å; C545-C588 HydrophobicContact CB-CB 3.97Å; C545-C588 WeakPolarHBondContact CB-SG 3.14Å; C545-C588 PolarHBondContact O-SG 3.47Å; C545-C588 WeakPolarHBondContact SG-CB 3.39Å; C545-C588 CovalentContact SG-SG 2.04Å; C545-C588 PolarHBondContact SG-SG 3.19Å; V548-C588 VanDerWaalsContact CG2-SG 3.57Å; N584-C588 PolarHBondContact O-N 3.41Å; E585-C588 CarbonylContact O-C 3.43Å; C588-K590 PolarHBondContact O-N 3.47Å; C588-L591 HydrophobicContact CB-CD1 3.79Å; C588-L591 HydrophobicContact CB-CG 4.22Å; C588-L591 PolarHBondContact O-N 2.75Å
589	P	67.3	Low	61.8	Low	79 Å²	79	95.3 Å²	95.3	51%	0.513	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-60.4	-20.8	176.7	24.2	-34.2	0	0	0	113.4	L587 L591 T592	L587-P589 WeakPolarHBondContact O-CD 3.3Å; P589-L591 PolarHBondContact O-N 3.28Å; P589-T592 PolarHBondContact O-N 3.28Å; P589-T592 VanDerWaalsContact O-N 3.1Å
590	K	58.4	Low	59.2	Low	186 Å²	186	100.5 Å²	100.5	81%	0.809	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-67.3	-9.6	174.9	-68.8	-176.7	178.7	175.5	0	114.6	C588 T592	C588-K590 PolarHBondContact O-N 3.47Å; K590-T592 VanDerWaalsContact C-N 3.26Å
591	L	53.4	Low	56.7	Low	140 Å²	140	102.8 Å²	102.8	73%	0.733	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-78.5	-9.4	170.1	-77.9	167.2	0	0	0	113.1	C588 P589	C588-L591 HydrophobicContact CB-CD1 3.79Å; C588-L591 HydrophobicContact CB-CG 4.22Å; C588-L591 PolarHBondContact O-N 2.75Å; P589-L591 PolarHBondContact O-N 3.28Å
592	T	46.2	Very low	54.1	Low	98 Å²	98	101 Å²	101	60%	0.601	59%	0.593	S	S	*	*	S	Bend	trans	-124.2	4.2	-167.8	-27.8	0	0	0	0	113.9	P589 K590	P589-T592 PolarHBondContact O-N 3.28Å; P589-T592 VanDerWaalsContact O-N 3.1Å; K590-T592 VanDerWaalsContact C-N 3.26Å
593	T	35.6	Very low	51.6	Low	98 Å²	98	108 Å²	108	60%	0.601	63%	0.629	S	S	*	*			trans	-111.5	109	-178.1	55.2	0	0	0	0	113
594	P	39.6	Very low	49.1	Very low	112 Å²	112	107.6 Å²	107.6	73%	0.727	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-60	148.6	155.3	-16.8	31.1	0	0	0	110
595	P	35.7	Very low	46.6	Very low	113 Å²	113	111.1 Å²	111.1	73%	0.734	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-68	139.3	179.4	28.1	-34.2	0	0	0	111.4
596	P	39.5	Very low	44.4	Very low	124 Å²	124	109.6 Å²	109.6	81%	0.805	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-70	141.3	176.6	29.4	-34.5	0	0	0	111.3
597	I	41.7	Very low	42.1	Very low	174 Å²	174	112 Å²	112	89%	0.892	68%	0.683	S	S	*	*			trans	-100	105.5	178.7	-57.9	174.1	0	0	0	109.4
598	S	33.5	Very low	39.9	Very low	115 Å²	115	117 Å²	117	80%	0.804	72%	0.719	S	S	*	*			trans	-150.5	127.6	162	31	0	0	0	0	111.7
599	S	32.1	Very low	38.1	Very low	117 Å²	117	122.4 Å²	122.4	82%	0.818	75%	0.754	S	S	*	*			trans	-74.6	141.4	-168.1	49.9	0	0	0	0	116.5
600	S	33.2	Very low	36.4	Very low	109 Å²	109	123.6 Å²	123.6	76%	0.762	77%	0.77	S	S	*	*				-169.9	102.7	126.3	57.6	0	0	0	0	114.9
601	T	30.4	Very low	35	Very low	136 Å²	136	118.2 Å²	118.2	83%	0.834	77%	0.767	S	S	*	*			trans	33.9	108.7	142.8	53.6	0	0	0	0	123
602	A	28.4	Very low	34	Very low	94 Å²	94	118.7 Å²	118.7	78%	0.777	78%	0.776	S	S	*	*				-176.6	95.4	129.4	0	0	0	0	0	109.3
603	I	30.1	Very low	33.4	Very low	155 Å²	155	117.5 Å²	117.5	80%	0.795	78%	0.783	S	S	*	*				79.1	117.5	84.9	-71.4	175	0	0	0	114.2
604	V	30.6	Very low	33.4	Very low	128 Å²	128	123.3 Å²	123.3	78%	0.776	80%	0.8	S	S	*	*			trans	64.8	117.8	165.1	167.9	0	0	0	0	114.8
605	T	28.8	Very low	33	Very low	127 Å²	127	122.2 Å²	122.2	78%	0.779	80%	0.801	S	S	*	*			cis	-160	-178.9	12.1	1.6	0	0	0	0	109.1
606	S	30.1	Very low	33.3	Very low	96 Å²	96	122.2 Å²	122.2	67%	0.671	80%	0.801	S	S	*	*			cis	-164.9	155.7	2.3	35.9	0	0	0	0	110.9
607	V	30.8	Very low	33.7	Very low	138 Å²	138	122.9 Å²	122.9	84%	0.836	81%	0.805	S	S	*	*			trans	48.8	109.7	154.3	-178.5	0	0	0	0	119.1
608	S	33.1	Very low	34	Very low	113 Å²	113	118.5 Å²	118.5	79%	0.79	80%	0.803	S	S	*	*			trans	-104	169	150.1	-45.6	0	0	0	0	108.9
609	P	42.1	Very low	34.8	Very low	119 Å²	119	116 Å²	116	77%	0.773	79%	0.794	S	S	*	*				-150.2	163.1	82.4	39.3	-21.8	0	0	0	116.7
610	A	30.6	Very low	35.8	Very low	103 Å²	103	116.7 Å²	116.7	85%	0.851	80%	0.797	S	S	*	*			trans	49.5	135.1	155.7	0	0	0	0	0	120.8
611	G	30.2	Very low	37.2	Very low	73 Å²	73	115.9 Å²	115.9	75%	0.753	79%	0.787	S	S	*	*			cis	119.8	102.5	-3.3	0	0	0	0	0	113.8
612	V	32.9	Very low	38.8	Very low	151 Å²	151	113 Å²	113	92%	0.915	77%	0.77	S	S	*	*			trans	-137	134.5	163.2	-178.6	0	0	0	0	107.9
613	G	31.9	Very low	40.4	Very low	73 Å²	73	115.1 Å²	115.1	75%	0.753	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-86.9	170.8	-171.2	0	0	0	0	0	115.4
614	K	36.8	Very low	42.4	Very low	220 Å²	220	111.3 Å²	111.3	96%	0.957	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-71.2	132.8	168.8	-72.8	-178.9	175.8	178.5	0	110.5
615	A	31.7	Very low	44.4	Very low	89 Å²	89	110.2 Å²	110.2	74%	0.736	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-94.6	158.5	170.5	0	0	0	0	0	111.4
616	P	40.8	Very low	46.5	Very low	113 Å²	113	108.1 Å²	108.1	73%	0.734	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-67.4	163.4	174.2	28.7	-35.8	0	0	0	112.9
617	P	47.2	Very low	48.9	Very low	137 Å²	137	108.7 Å²	108.7	89%	0.89	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	132.4	-179.8	27.9	-35.1	0	0	0	112
618	G	49.2	Very low	50.7	Low	83 Å²	83	107.8 Å²	107.8	86%	0.856	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	134.2	-0.4	176.2	0	0	0	0	0	116.6
619	G	49.5	Very low	52.8	Low	61 Å²	61	104.8 Å²	104.8	63%	0.629	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-75.4	153.1	177.5	0	0	0	0	0	114.2
620	P	53	Low	54.8	Low	133 Å²	133	103.8 Å²	103.8	86%	0.864	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-62.9	138.9	177.6	-21.8	33.5	0	0	0	113.4
621	V	63.3	Low	57.4	Low	92 Å²	92	103.9 Å²	103.9	56%	0.558	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-70.3	134.8	177.7	-180	0	0	0	0	110.4	L623 I625 M626	V621-L623 PolarHBondContact O-N 3.2Å; V621-I625 HydrophobicContact CG1-CB 4.28Å; V621-I625 HydrophobicContact CG1-CG2 4.45Å; V621-M626 HydrophobicContact CB-CG 4.43Å; V621-M626 HydrophobicContact CG1-CG 4.07Å
622	P	63.3	Low	60	Low	75 Å²	75	104.3 Å²	104.3	49%	0.487	65%	0.65	S	S	.	*	P	Polyproline II helix	trans	-57	132.6	176.4	-26.7	34.9	0	0	0	113.2	S624 I625 M626	P622-S624 PolarHBondContact O-N 3.27Å; P622-S624 VanDerWaalsContact O-N 3.1Å; P622-I625 HydrophobicContact CB-CD1 4.48Å; P622-I625 HydrophobicContact CB-CG1 4.47Å; P622-I625 HydrophobicContact CG-CD1 4.33Å; P622-I625 PolarHBondContact O-N 2.82Å; P622-M626 PolarHBondContact O-N 2.97Å
623	L	63.2	Low	62.6	Low	139 Å²	139	101.3 Å²	101.3	73%	0.728	63%	0.632	S	S	*	*	H	α-helix	trans	-54	-32.6	-179.6	-79.4	161.8	0	0	0	113.3	V621 I625 M626 I627	V621-L623 PolarHBondContact O-N 3.2Å; L623-I625 PolarHBondContact O-N 3.34Å; L623-M626 PolarHBondContact O-N 2.82Å; L623-I627 WeakPolarHBondContact O-CB 3.07Å; L623-I627 WeakPolarHBondContact O-CD1 3.26Å; L623-I627 WeakPolarHBondContact O-CG1 3.43Å; L623-I627 PolarHBondContact O-N 3.44Å
624	S	71.9	Confident	65.2	Low	74 Å²	74	102.7 Å²	102.7	52%	0.517	62%	0.621	S	S	.	*	H	α-helix	trans	-60.1	-41.6	176.1	49.2	0	0	0	0	113.3	P622 L628	P622-S624 PolarHBondContact O-N 3.27Å; P622-S624 VanDerWaalsContact O-N 3.1Å; S624-L628 VanDerWaalsContact O-CD1 3.29Å; S624-L628 WeakPolarHBondContact O-CD1 3.16Å; S624-L628 PolarHBondContact O-N 3.29Å; S624-L628 VanDerWaalsContact O-N 3.07Å
625	I	72.4	Confident	67.7	Low	105 Å²	105	96.3 Å²	96.3	54%	0.538	60%	0.597	S	S	.	*	H	α-helix	trans	-70.9	-41.8	178.7	-59.1	178.5	0	0	0	109.9	V621 P622 L623 L628 S629	V621-I625 HydrophobicContact CG1-CB 4.28Å; V621-I625 HydrophobicContact CG1-CG2 4.45Å; P622-I625 HydrophobicContact CB-CD1 4.48Å; P622-I625 HydrophobicContact CB-CG1 4.47Å; P622-I625 HydrophobicContact CG-CD1 4.33Å; P622-I625 PolarHBondContact O-N 2.82Å; L623-I625 PolarHBondContact O-N 3.34Å; I625-L628 PolarHBondContact O-N 3.34Å; I625-S629 WeakPolarHBondContact O-CB 3.4Å; I625-S629 PolarHBondContact O-N 3.05Å; I625-S629 PolarHBondContact O-OG 2.89Å
626	M	72.1	Confident	70.3	Confident	84 Å²	84	97 Å²	97	41%	0.414	59%	0.587	S	S	.	*	H	α-helix	trans	-60.4	-47.6	175	-75.5	-96	58.9	0	0	111.6	V621 P622 L623 L628 S629 I630	V621-M626 HydrophobicContact CB-CG 4.43Å; V621-M626 HydrophobicContact CG1-CG 4.07Å; P622-M626 PolarHBondContact O-N 2.97Å; L623-M626 PolarHBondContact O-N 2.82Å; M626-L628 PolarHBondContact O-N 2.96Å; M626-S629 WeakPolarHBondContact CE-OG 3.34Å; M626-S629 PolarHBondContact O-N 3.43Å; M626-S629 PolarHBondContact O-OG 3.02Å; M626-I630 WeakPolarHBondContact O-CB 3.23Å; M626-I630 VanDerWaalsContact O-CG1 3.29Å; M626-I630 WeakPolarHBondContact O-CG1 3.49Å; M626-I630 PolarHBondContact O-N 3.03Å
627	I	80.8	Confident	72.7	Confident	108 Å²	108	95.4 Å²	95.4	55%	0.554	58%	0.576	S	S	*	*	H	α-helix	trans	-60.5	-45.2	178.4	-70	162.4	0	0	0	111.5	L623 I630 L631	L623-I627 WeakPolarHBondContact O-CB 3.07Å; L623-I627 WeakPolarHBondContact O-CD1 3.26Å; L623-I627 WeakPolarHBondContact O-CG1 3.43Å; L623-I627 PolarHBondContact O-N 3.44Å; I627-I630 PolarHBondContact O-N 3.29Å; I627-L631 WeakPolarHBondContact O-CB 3.5Å; I627-L631 PolarHBondContact O-N 3.17Å
628	L	69.7	Low	74.8	Confident	118 Å²	118	93 Å²	93	62%	0.618	56%	0.559	S	S	*	*	H	α-helix	trans	-61.9	-43.6	174.7	-96.6	86.4	0	0	0	112.3	S624 I625 M626 I630 L631 V632	S624-L628 VanDerWaalsContact O-CD1 3.29Å; S624-L628 WeakPolarHBondContact O-CD1 3.16Å; S624-L628 PolarHBondContact O-N 3.29Å; S624-L628 VanDerWaalsContact O-N 3.07Å; I625-L628 PolarHBondContact O-N 3.34Å; M626-L628 PolarHBondContact O-N 2.96Å; L628-I630 VanDerWaalsContact C-N 3.34Å; L628-I630 PolarHBondContact O-N 3.31Å; L628-L631 PolarHBondContact O-N 3.11Å; L628-V632 WeakPolarHBondContact O-CG2 3.28Å; L628-V632 PolarHBondContact O-N 3.09Å
629	S	77.2	Confident	76.7	Confident	50 Å²	50	95.5 Å²	95.5	35%	0.35	55%	0.546	S	S	.	.	H	α-helix	trans	-63	-40.5	179.5	71.7	0	0	0	0	112.3	I625 M626 V632 V633	I625-S629 WeakPolarHBondContact O-CB 3.4Å; I625-S629 PolarHBondContact O-N 3.05Å; I625-S629 PolarHBondContact O-OG 2.89Å; M626-S629 WeakPolarHBondContact CE-OG 3.34Å; M626-S629 PolarHBondContact O-N 3.43Å; M626-S629 PolarHBondContact O-OG 3.02Å; S629-V632 PolarHBondContact O-N 3.18Å; S629-V633 WeakPolarHBondContact O-CG2 3.46Å; S629-V633 PolarHBondContact O-N 3.47Å; S629-V633 VanDerWaalsContact O-N 3.1Å
630	I	82.6	Confident	78.7	Confident	99 Å²	99	96.9 Å²	96.9	51%	0.508	54%	0.542	S	S	.	.	H	α-helix	trans	-67	-41.7	176.9	-69	164.2	0	0	0	110	M626 I627 L628 V632 V633 L634	M626-I630 WeakPolarHBondContact O-CB 3.23Å; M626-I630 VanDerWaalsContact O-CG1 3.29Å; M626-I630 WeakPolarHBondContact O-CG1 3.49Å; M626-I630 PolarHBondContact O-N 3.03Å; I627-I630 PolarHBondContact O-N 3.29Å; L628-I630 VanDerWaalsContact C-N 3.34Å; L628-I630 PolarHBondContact O-N 3.31Å; I630-V632 PolarHBondContact O-N 2.82Å; I630-V633 PolarHBondContact O-N 2.86Å; I630-L634 WeakPolarHBondContact O-CB 3.2Å; I630-L634 PolarHBondContact O-N 2.98Å
631	L	85.6	Confident	80.3	Confident	104 Å²	104	93.2 Å²	93.2	55%	0.545	52%	0.523	S	S	.	.	H	α-helix	trans	-60.2	-44.1	177.3	-163.5	82.6	0	0	0	111.8	I627 L628 L634 I635	I627-L631 WeakPolarHBondContact O-CB 3.5Å; I627-L631 PolarHBondContact O-N 3.17Å; L628-L631 PolarHBondContact O-N 3.11Å; L631-L634 PolarHBondContact O-N 3.06Å; L631-I635 HydrophobicContact CD2-CD1 4.41Å; L631-I635 HydrophobicContact CG-CD1 4.18Å; L631-I635 VanDerWaalsContact O-CG1 3.29Å; L631-I635 WeakPolarHBondContact O-CG1 3.33Å; L631-I635 PolarHBondContact O-N 3.13Å
632	V	85.2	Confident	81.5	Confident	82 Å²	82	95 Å²	95	50%	0.497	52%	0.524	S	S	.	.	H	α-helix	trans	-64.1	-43.4	177.7	171.3	0	0	0	0	111.4	L628 S629 I630 L634 I635 L636	L628-V632 WeakPolarHBondContact O-CG2 3.28Å; L628-V632 PolarHBondContact O-N 3.09Å; S629-V632 PolarHBondContact O-N 3.18Å; I630-V632 PolarHBondContact O-N 2.82Å; V632-L634 VanDerWaalsContact C-N 3.34Å; V632-L634 PolarHBondContact O-N 3.41Å; V632-I635 PolarHBondContact O-N 3.04Å; V632-L636 HydrophobicContact CG1-CD1 3.96Å; V632-L636 WeakPolarHBondContact O-CB 3.25Å; V632-L636 WeakPolarHBondContact O-CG 3.35Å; V632-L636 PolarHBondContact O-N 2.63Å
633	V	87.1	Confident	82.4	Confident	88 Å²	88	95.2 Å²	95.2	53%	0.533	53%	0.526	S	S	.	.	H	α-helix	trans	-63.6	-39.6	175.5	171.6	0	0	0	0	111.5	S629 I630 L636 T637	S629-V633 WeakPolarHBondContact O-CG2 3.46Å; S629-V633 PolarHBondContact O-N 3.47Å; S629-V633 VanDerWaalsContact O-N 3.1Å; I630-V633 PolarHBondContact O-N 2.86Å; V633-L636 PolarHBondContact O-N 3.01Å; V633-T637 WeakPolarHBondContact O-CG2 3.27Å; V633-T637 PolarHBondContact O-N 2.89Å; V633-T637 PolarHBondContact O-OG1 2.77Å
634	L	87.3	Confident	83.3	Confident	103 Å²	103	93.6 Å²	93.6	54%	0.539	52%	0.517	S	S	.	.	H	α-helix	trans	-67	-41.2	178.3	-153.1	160.7	0	0	0	111.5	I630 L631 V632 T637 V638	I630-L634 WeakPolarHBondContact O-CB 3.2Å; I630-L634 PolarHBondContact O-N 2.98Å; L631-L634 PolarHBondContact O-N 3.06Å; V632-L634 VanDerWaalsContact C-N 3.34Å; V632-L634 PolarHBondContact O-N 3.41Å; L634-T637 WeakPolarHBondContact CA-OG1 3.45Å; L634-T637 PolarHBondContact O-OG1 2.75Å; L634-V638 HydrophobicContact CD2-CG2 4.18Å; L634-V638 WeakPolarHBondContact O-CG2 3.29Å; L634-V638 PolarHBondContact O-N 2.87Å; L634-V638 VanDerWaalsContact O-N 3.11Å
635	I	89.3	Confident	83.9	Confident	86 Å²	86	94.9 Å²	94.9	44%	0.441	52%	0.518	S	S	.	.	H	α-helix	trans	-61.5	-48.2	172.5	-68.9	163.6	0	0	0	111.1	L631 V632 T637 V638 F639	L631-I635 HydrophobicContact CD2-CD1 4.41Å; L631-I635 HydrophobicContact CG-CD1 4.18Å; L631-I635 VanDerWaalsContact O-CG1 3.29Å; L631-I635 WeakPolarHBondContact O-CG1 3.33Å; L631-I635 PolarHBondContact O-N 3.13Å; V632-I635 PolarHBondContact O-N 3.04Å; I635-T637 PolarHBondContact O-N 3.16Å; I635-V638 PolarHBondContact O-N 3.34Å; I635-F639 HydrophobicContact CG2-CD2 3.94Å; I635-F639 HydrophobicContact CG2-CE2 4Å; I635-F639 WeakPolarHBondContact O-CD2 3.29Å; I635-F639 PolarHBondContact O-N 2.74Å; I635-F639 VanDerWaalsContact O-N 3.07Å
636	L	86.6	Confident	84.5	Confident	102 Å²	102	92.6 Å²	92.6	53%	0.534	51%	0.509	S	S	.	.	H	α-helix	trans	-61.2	-43.7	-179.8	-75.6	168	0	0	0	112.3	V632 V633 V638 F639 V640	V632-L636 HydrophobicContact CG1-CD1 3.96Å; V632-L636 WeakPolarHBondContact O-CB 3.25Å; V632-L636 WeakPolarHBondContact O-CG 3.35Å; V632-L636 PolarHBondContact O-N 2.63Å; V633-L636 PolarHBondContact O-N 3.01Å; L636-V638 PolarHBondContact O-N 2.81Å; L636-F639 PolarHBondContact O-N 3.01Å; L636-V640 WeakPolarHBondContact O-CG2 3.37Å; L636-V640 PolarHBondContact O-N 2.63Å
637	T	89.6	Confident	84.8	Confident	81 Å²	81	94.4 Å²	94.4	50%	0.497	52%	0.515	S	S	.	.	H	α-helix	trans	-65.2	-36.6	177.8	46.2	0	0	0	0	113	V633 L634 I635 V640 A641	V633-T637 WeakPolarHBondContact O-CG2 3.27Å; V633-T637 PolarHBondContact O-N 2.89Å; V633-T637 PolarHBondContact O-OG1 2.77Å; L634-T637 WeakPolarHBondContact CA-OG1 3.45Å; L634-T637 PolarHBondContact O-OG1 2.75Å; I635-T637 PolarHBondContact O-N 3.16Å; T637-V640 PolarHBondContact O-N 3.12Å; T637-A641 WeakPolarHBondContact O-CB 3.22Å; T637-A641 PolarHBondContact O-N 3.1Å
638	V	92.2	Very high	84.6	Confident	87 Å²	87	92.8 Å²	92.8	53%	0.527	51%	0.51	S	S	.	.	H	α-helix	trans	-63.1	-43.5	171.9	169.1	0	0	0	0	111.5	L634 I635 L636 A641 F642	L634-V638 HydrophobicContact CD2-CG2 4.18Å; L634-V638 WeakPolarHBondContact O-CG2 3.29Å; L634-V638 PolarHBondContact O-N 2.87Å; L634-V638 VanDerWaalsContact O-N 3.11Å; I635-V638 PolarHBondContact O-N 3.34Å; L636-V638 PolarHBondContact O-N 2.81Å; V638-A641 PolarHBondContact O-N 2.98Å; V638-F642 WeakPolarHBondContact O-CB 3.35Å; V638-F642 PolarHBondContact O-N 2.86Å
639	F	90.1	Very high	84.7	Confident	134 Å²	134	92.5 Å²	92.5	59%	0.588	51%	0.508	S	S	*	.	H	α-helix	trans	-62.7	-43.8	175.5	-90.4	-76.5	0	0	0	112.6	I635 L636 F642 C643	I635-F639 HydrophobicContact CG2-CD2 3.94Å; I635-F639 HydrophobicContact CG2-CE2 4Å; I635-F639 WeakPolarHBondContact O-CD2 3.29Å; I635-F639 PolarHBondContact O-N 2.74Å; I635-F639 VanDerWaalsContact O-N 3.07Å; L636-F639 PolarHBondContact O-N 3.01Å; F639-F642 PolarHBondContact O-N 2.93Å; F639-C643 PolarHBondContact O-N 2.86Å; F639-C643 PolarHBondContact O-SG 2.98Å; F639-C643 VanDerWaalsContact O-SG 3.35Å
640	V	89.8	Confident	84	Confident	90 Å²	90	99.7 Å²	99.7	55%	0.545	53%	0.528	S	S	.	.	H	α-helix	trans	-62.3	-44	176.3	171.5	0	0	0	0	111.2	L636 T637 F642 C643 L644	L636-V640 WeakPolarHBondContact O-CG2 3.37Å; L636-V640 PolarHBondContact O-N 2.63Å; T637-V640 PolarHBondContact O-N 3.12Å; V640-F642 VanDerWaalsContact C-N 3.35Å; V640-F642 PolarHBondContact O-N 3.24Å; V640-C643 PolarHBondContact O-N 2.79Å; V640-L644 HydrophobicContact CG1-CD1 4.02Å; V640-L644 WeakPolarHBondContact O-CG 3.36Å; V640-L644 PolarHBondContact O-N 3.38Å
641	A	86.3	Confident	83	Confident	57 Å²	57	103.9 Å²	103.9	47%	0.471	54%	0.537	S	S	.	.	H	α-helix	trans	-61.4	-41	176.3	0	0	0	0	0	112.3	T637 V638 L644 L645	T637-A641 WeakPolarHBondContact O-CB 3.22Å; T637-A641 PolarHBondContact O-N 3.1Å; V638-A641 PolarHBondContact O-N 2.98Å; A641-L644 PolarHBondContact O-N 2.89Å; A641-L645 WeakPolarHBondContact O-CB 3.19Å; A641-L645 PolarHBondContact O-N 3.43Å
642	F	90.2	Very high	81.4	Confident	130 Å²	130	105 Å²	105	57%	0.57	54%	0.544	S	S	*	.	H	α-helix	trans	-64.3	-44.5	175.6	-175.9	-98.1	0	0	0	112.2	V638 F639 V640 L644 L645 V646	V638-F642 WeakPolarHBondContact O-CB 3.35Å; V638-F642 PolarHBondContact O-N 2.86Å; F639-F642 PolarHBondContact O-N 2.93Å; V640-F642 VanDerWaalsContact C-N 3.35Å; V640-F642 PolarHBondContact O-N 3.24Å; F642-L644 VanDerWaalsContact C-N 3.35Å; F642-L644 PolarHBondContact O-N 3.35Å; F642-L645 WeakPolarHBondContact O-CB 3.47Å; F642-L645 PolarHBondContact O-N 3.41Å; F642-V646 HydrophobicContact CD1-CG2 4.31Å; F642-V646 HydrophobicContact CE1-CG2 3.94Å; F642-V646 HydrophobicContact CZ-CG2 4.11Å; F642-V646 WeakPolarHBondContact O-CG2 3.26Å; F642-V646 PolarHBondContact O-N 3.01Å
643	C	81.6	Confident	79.9	Confident	79 Å²	79	109.9 Å²	109.9	53%	0.534	56%	0.558	S	S	.	*	H	α-helix	trans	-61.1	-41.6	175.6	-71.3	0	0	0	0	112.3	F639 V640 V646 F647	F639-C643 PolarHBondContact O-N 2.86Å; F639-C643 PolarHBondContact O-SG 2.98Å; F639-C643 VanDerWaalsContact O-SG 3.35Å; V640-C643 PolarHBondContact O-N 2.79Å; C643-V646 PolarHBondContact O-N 2.79Å; C643-F647 WeakPolarHBondContact O-CB 3.48Å; C643-F647 PolarHBondContact O-N 2.86Å
644	L	82.8	Confident	77.9	Confident	104 Å²	104	114.8 Å²	114.8	55%	0.545	57%	0.572	S	S	.	*	H	α-helix	trans	-65.4	-39.7	175	-71.5	171.3	0	0	0	112.1	V640 A641 F642 F647 V648	V640-L644 HydrophobicContact CG1-CD1 4.02Å; V640-L644 WeakPolarHBondContact O-CG 3.36Å; V640-L644 PolarHBondContact O-N 3.38Å; A641-L644 PolarHBondContact O-N 2.89Å; F642-L644 VanDerWaalsContact C-N 3.35Å; F642-L644 PolarHBondContact O-N 3.35Å; L644-F647 PolarHBondContact O-N 3.44Å; L644-V648 WeakPolarHBondContact O-CG2 3.23Å; L644-V648 PolarHBondContact O-N 3.32Å
645	L	83.4	Confident	75.9	Confident	101 Å²	101	115.8 Å²	115.8	53%	0.529	59%	0.585	S	S	.	*	H	α-helix	trans	-60.8	-47.1	174.7	-172.2	73.2	0	0	0	111.2	A641 F642 F647 V648 L649	A641-L645 WeakPolarHBondContact O-CB 3.19Å; A641-L645 PolarHBondContact O-N 3.43Å; F642-L645 WeakPolarHBondContact O-CB 3.47Å; F642-L645 PolarHBondContact O-N 3.41Å; L645-F647 VanDerWaalsContact C-N 3.31Å; L645-F647 PolarHBondContact O-N 3.03Å; L645-V648 PolarHBondContact O-N 2.96Å; L645-L649 HydrophobicContact CG-CD1 4.07Å; L645-L649 WeakPolarHBondContact O-CB 3.1Å; L645-L649 VanDerWaalsContact O-CG 3.27Å; L645-L649 WeakPolarHBondContact O-CG 3.16Å; L645-L649 PolarHBondContact O-N 3.47Å
646	V	84.3	Confident	73.4	Confident	57 Å²	57	118.8 Å²	118.8	35%	0.345	61%	0.607	S	S	.	*	H	α-helix	trans	-62.3	-38.3	176.4	172.8	0	0	0	0	111.6	F642 C643 L649 R650	F642-V646 HydrophobicContact CD1-CG2 4.31Å; F642-V646 HydrophobicContact CE1-CG2 3.94Å; F642-V646 HydrophobicContact CZ-CG2 4.11Å; F642-V646 WeakPolarHBondContact O-CG2 3.26Å; F642-V646 PolarHBondContact O-N 3.01Å; C643-V646 PolarHBondContact O-N 2.79Å; V646-L649 PolarHBondContact O-N 3.07Å; V646-R650 WeakPolarHBondContact O-CG 3.27Å; V646-R650 PolarHBondContact O-N 3.1Å
647	F	78.6	Confident	71.1	Confident	123 Å²	123	117.2 Å²	117.2	54%	0.539	62%	0.615	S	S	.	*	H	α-helix	trans	-64.5	-45.1	175.5	-178.6	-102.9	0	0	0	112.4	C643 L644 L645 R650 R651	C643-F647 WeakPolarHBondContact O-CB 3.48Å; C643-F647 PolarHBondContact O-N 2.86Å; L644-F647 PolarHBondContact O-N 3.44Å; L645-F647 VanDerWaalsContact C-N 3.31Å; L645-F647 PolarHBondContact O-N 3.03Å; F647-R650 PolarHBondContact O-N 3.45Å; F647-R651 WeakPolarHBondContact O-CB 3.47Å; F647-R651 PolarHBondContact O-N 2.92Å
648	V	77.9	Confident	68.3	Low	74 Å²	74	125.3 Å²	125.3	45%	0.448	64%	0.637	S	S	.	*	H	α-helix	trans	-64.4	-43	175.7	171.6	0	0	0	0	111.4	L644 L645 R650 R651 N652	L644-V648 WeakPolarHBondContact O-CG2 3.23Å; L644-V648 PolarHBondContact O-N 3.32Å; L645-V648 PolarHBondContact O-N 2.96Å; V648-R650 VanDerWaalsContact C-N 3.31Å; V648-R650 PolarHBondContact O-N 2.94Å; V648-R651 PolarHBondContact O-N 3.1Å; V648-R651 VanDerWaalsContact O-N 3.15Å; V648-N652 PolarHBondContact O-N 3.27Å
649	L	70.7	Confident	65.4	Low	112 Å²	112	129.8 Å²	129.8	59%	0.586	65%	0.652	S	S	*	*	H	α-helix	trans	-62.9	-34.5	176.6	-72.5	170.2	0	0	0	112.7	L645 V646	L645-L649 HydrophobicContact CG-CD1 4.07Å; L645-L649 WeakPolarHBondContact O-CB 3.1Å; L645-L649 VanDerWaalsContact O-CG 3.27Å; L645-L649 WeakPolarHBondContact O-CG 3.16Å; L645-L649 PolarHBondContact O-N 3.47Å; V646-L649 PolarHBondContact O-N 3.07Å
650	R	62.3	Low	62.4	Low	201 Å²	201	132.4 Å²	132.4	76%	0.758	67%	0.666	S	S	*	*	H	α-helix	trans	-70.3	-43.5	170	-76.4	-174.7	173.6	-159.5	-1.3	112.1	V646 F647 V648 N652 K653	V646-R650 WeakPolarHBondContact O-CG 3.27Å; V646-R650 PolarHBondContact O-N 3.1Å; F647-R650 PolarHBondContact O-N 3.45Å; V648-R650 VanDerWaalsContact C-N 3.31Å; V648-R650 PolarHBondContact O-N 2.94Å; R650-N652 VanDerWaalsContact C-N 3.25Å; R650-N652 PolarHBondContact O-N 3.45Å; R650-K653 PolarHBondContact O-N 3.42Å
651	R	61.7	Low	59.6	Low	186 Å²	186	131.2 Å²	131.2	70%	0.702	67%	0.672	S	S	*	*	H	α-helix	trans	-64.2	-26.6	-178	-170.4	170.3	179.3	162.8	-0.4	113.5	F647 V648 K653	F647-R651 WeakPolarHBondContact O-CB 3.47Å; F647-R651 PolarHBondContact O-N 2.92Å; V648-R651 PolarHBondContact O-N 3.1Å; V648-R651 VanDerWaalsContact O-N 3.15Å; R651-K653 VanDerWaalsContact C-N 3.28Å; R651-K653 PolarHBondContact O-N 3.21Å
652	N	53.4	Low	56.9	Low	128 Å²	128	137.2 Å²	137.2	68%	0.684	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	1.3	178.1	-75.3	-2	0	0	0	114.9	V648 R650	V648-N652 PolarHBondContact O-N 3.27Å; R650-N652 VanDerWaalsContact C-N 3.25Å; R650-N652 PolarHBondContact O-N 3.45Å
653	K	53.6	Low	53.9	Low	185 Å²	185	134.8 Å²	134.8	80%	0.804	71%	0.706	S	S	*	*			trans	-105.2	84.8	167.7	-73.9	-167.1	175	-173.1	0	111.5	R650 R651	R650-K653 PolarHBondContact O-N 3.42Å; R651-K653 VanDerWaalsContact C-N 3.28Å; R651-K653 PolarHBondContact O-N 3.21Å
654	K	45	Very low	51.3	Low	190 Å²	190	138 Å²	138	83%	0.826	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-79.5	145.4	159.6	-83.8	-168	172.7	-172.4	0	110.4
655	P	45.7	Very low	48.9	Very low	124 Å²	124	139.8 Å²	139.8	81%	0.805	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-75.4	143	176.1	31.5	-34.3	0	0	0	111.4
656	V	35.1	Very low	46.2	Very low	149 Å²	149	142.6 Å²	142.6	90%	0.903	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-98.8	121.8	163.3	177.7	0	0	0	0	106.9
657	G	39.8	Very low	43.3	Very low	69 Å²	69	145.6 Å²	145.6	71%	0.711	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-101.8	154.3	179.3	0	0	0	0	0	112.8
658	R	29.3	Very low	40.8	Very low	251 Å²	251	143 Å²	143	95%	0.947	76%	0.764	S	S	*	*			trans	-153.7	149.2	158.8	-113.6	177.5	-177.4	176.9	-0.3	109.8
659	Q	31.3	Very low	38.3	Very low	181 Å²	181	144.5 Å²	144.5	85%	0.846	78%	0.778	S	S	*	*			trans	-75.1	172.9	165.1	-61.8	162	-75.2	0	0	107.9
660	E	28.4	Very low	36.2	Very low	190 Å²	190	146.5 Å²	146.5	89%	0.888	79%	0.788	S	S	*	*			cis	-152.4	174	28.3	-58.6	165.6	114.5	0	0	111.3
661	G	29.9	Very low	34.4	Very low	64 Å²	64	141.7 Å²	141.7	66%	0.66	79%	0.786	S	S	*	*			trans	107.5	108	144.1	0	0	0	0	0	119.1
662	L	28.9	Very low	32.6	Very low	184 Å²	184	139.5 Å²	139.5	96%	0.963	79%	0.787	S	S	*	*			trans	44.5	139.4	147.5	-71.8	76.2	0	0	0	121.4
663	G	27.9	Very low	31.2	Very low	78 Å²	78	141.1 Å²	141.1	80%	0.804	79%	0.791	S	S	*	*			trans	121.7	120.5	130	0	0	0	0	0	117.8
664	N	27.6	Very low	30	Very low	148 Å²	148	140.1 Å²	140.1	79%	0.791	79%	0.793	S	S	*	*			trans	-53.1	140.9	175	-87	26.8	0	0	0	116.7
665	Q	31.8	Very low	28.9	Very low	140 Å²	140	142.2 Å²	142.2	65%	0.654	80%	0.796	S	S	*	*				71.4	121.6	120.8	-165.5	173.3	0.1	0	0	121.5
666	E	27.6	Very low	27.9	Very low	160 Å²	160	147.5 Å²	147.5	75%	0.748	80%	0.8	S	S	*	*			trans	64	154.7	156.7	-70.4	167.5	-129.7	0	0	117.6
667	C	23.3	Very low	27.6	Very low	121 Å²	121	150.1 Å²	150.1	82%	0.818	80%	0.802	S	S	*	*			cis	-139.3	-160	0.6	-154.2	0	0	0	0	110.6
668	G	25.8	Very low	27	Very low	68 Å²	68	149.9 Å²	149.9	70%	0.701	80%	0.8	S	S	*	*			trans	-73.4	-172.5	173.4	0	0	0	0	0	114.5
669	S	25.3	Very low	27	Very low	106 Å²	106	147 Å²	147	74%	0.741	80%	0.796	S	S	*	*			cis	-169	175	10.8	60.1	0	0	0	0	113.4
670	L	26.6	Very low	26.9	Very low	153 Å²	153	147.5 Å²	147.5	80%	0.801	80%	0.796	S	S	*	*			trans	75.5	139.6	144.9	-97.9	159.5	0	0	0	123
671	S	24.9	Very low	27.1	Very low	101 Å²	101	144.1 Å²	144.1	71%	0.706	79%	0.793	S	S	*	*			trans	73.4	152.8	161.3	79.2	0	0	0	0	116.7
672	L	23.3	Very low	27.1	Very low	139 Å²	139	144.8 Å²	144.8	73%	0.728	80%	0.8	S	S	*	*			cis	-135.9	151.9	20.5	-79.7	155.2	0	0	0	114.6
673	Q	24.7	Very low	27.3	Very low	163 Å²	163	145.7 Å²	145.7	76%	0.762	80%	0.796	S	S	*	*			trans	22.6	137.7	141.6	-52.9	177	15.5	0	0	121.8
674	L	26.9	Very low	27.4	Very low	163 Å²	163	151.9 Å²	151.9	85%	0.853	80%	0.801	S	S	*	*				-153.3	135.9	107.1	-146	66	0	0	0	116.3
675	R	22.8	Very low	27.5	Very low	235 Å²	235	148.3 Å²	148.3	89%	0.887	80%	0.799	S	S	*	*			trans	-34.4	150.1	162.4	-97.3	168.1	163.6	166.9	-4.4	115.8
676	R	25.7	Very low	27.4	Very low	235 Å²	235	146.7 Å²	146.7	89%	0.887	80%	0.803	S	S	*	*				168.3	118.4	95.1	-175.1	179	-165.1	176.1	4.2	114.4
677	H	27	Very low	27.8	Very low	203 Å²	203	146.7 Å²	146.7	94%	0.94	81%	0.807	S	S	*	*			trans	-153.2	167.2	143	-115.8	69.1	0	0	0	110.9
678	G	27	Very low	29.1	Very low	65 Å²	65	146.4 Å²	146.4	67%	0.67	80%	0.803	S	S	*	*			trans	-115.1	171	-161.1	0	0	0	0	0	117.4
679	H	29.8	Very low	29.5	Very low	189 Å²	189	146.3 Å²	146.3	88%	0.875	80%	0.802	S	S	*	*			trans	-30	147	175.3	-57.2	-80.9	0	0	0	116.6
680	K	29.6	Very low	29.9	Very low	193 Å²	193	148.1 Å²	148.1	84%	0.839	80%	0.804	S	S	*	*				-159.3	142.4	62.8	-84.4	178.6	175	175.9	0	116.2
681	S	31.8	Very low	30.1	Very low	119 Å²	119	147.3 Å²	147.3	83%	0.832	80%	0.8	S	S	*	*			trans	33.2	136	144.1	63	0	0	0	0	123.1
682	G	30.3	Very low	30.7	Very low	77 Å²	77	150.1 Å²	150.1	79%	0.794	81%	0.806	S	S	*	*			trans	-162.3	-14.7	169.3	0	0	0	0	0	125.6
683	K	33.8	Very low	31	Very low	204 Å²	204	146.8 Å²	146.8	89%	0.887	81%	0.805	S	S	*	*			trans	63.5	126	173.5	-69.9	177.9	175.1	173.6	0	121.4
684	K	30.8	Very low	31.2	Very low	208 Å²	208	142.5 Å²	142.5	90%	0.904	81%	0.805	S	S	*	*			trans	76.6	114.1	135.2	-76.4	-165.4	167.8	-164.1	0	123.8
685	G	29.6	Very low	31.3	Very low	73 Å²	73	143.9 Å²	143.9	75%	0.753	81%	0.807	S	S	*	*				99.1	150.2	129.9	0	0	0	0	0	118.6
686	S	29	Very low	31.6	Very low	105 Å²	105	138 Å²	138	73%	0.734	80%	0.798	S	S	*	*			cis	-177.4	119.9	-26.8	37.1	0	0	0	0	112.4
687	I	35.8	Very low	31.6	Very low	161 Å²	161	135.1 Å²	135.1	83%	0.826	79%	0.792	S	S	*	*				52	137.2	125.3	-66.3	169.5	0	0	0	119.6
688	P	51.1	Low	31.5	Very low	114 Å²	114	131.9 Å²	131.9	74%	0.74	78%	0.78	S	S	*	*			cis	-148	-160.5	-24.2	44	-23	0	0	0	114.5
689	G	34.6	Very low	32.3	Very low	66 Å²	66	133.4 Å²	133.4	68%	0.68	78%	0.778	S	S	*	*			trans	104.4	146.1	135.8	0	0	0	0	0	119.1
690	D	32.3	Very low	32.2	Very low	145 Å²	145	132.6 Å²	132.6	78%	0.775	78%	0.775	S	S	*	*			cis	-164	171.2	-16.1	-119.3	-30.3	0	0	0	112.9
691	D	30.8	Very low	32.1	Very low	136 Å²	136	128.3 Å²	128.3	73%	0.727	77%	0.765	S	S	*	*			trans	59.4	144.8	169.1	-68	-16.5	0	0	0	119.6
692	L	38.9	Very low	31.9	Very low	159 Å²	159	129.1 Å²	129.1	83%	0.832	76%	0.759	S	S	*	*			cis	-159.8	-176.2	-14.6	-106.5	168.1	0	0	0	106.2
693	G	29.7	Very low	31.7	Very low	69 Å²	69	132.4 Å²	132.4	71%	0.711	75%	0.753	S	S	*	*			cis	122.9	130.7	9.7	0	0	0	0	0	111.1
694	G	28.8	Very low	31.4	Very low	74 Å²	74	129.2 Å²	129.2	76%	0.763	74%	0.741	S	S	*	*			cis	177.7	-168.6	-1.9	0	0	0	0	0	113.1
695	E	28.7	Very low	31.2	Very low	191 Å²	191	126.6 Å²	126.6	89%	0.893	74%	0.735	S	S	*	*			trans	80.2	162.7	167.3	-52.3	-153.3	155.4	0	0	121
696	T	28.5	Very low	30.9	Very low	113 Å²	113	126.7 Å²	126.7	69%	0.693	74%	0.737	S	S	*	*				-165	-177.7	-122.2	39.8	0	0	0	0	115.5
697	F	25	Very low	30.7	Very low	174 Å²	174	131.3 Å²	131.3	76%	0.763	74%	0.743	S	S	*	*			trans	81.6	137.6	170.1	-70.8	-99.6	0	0	0	118.7
698	I	26.4	Very low	30.2	Very low	135 Å²	135	127.7 Å²	127.7	69%	0.692	73%	0.732	S	S	*	*			cis	100.6	137.3	19.9	-71.1	166.7	0	0	0	112.8
699	P	42.3	Very low	29	Very low	96 Å²	96	130.1 Å²	130.1	62%	0.623	73%	0.734	S	S	*	*			cis	-152.9	-160.6	-20.3	44.7	-23.6	0	0	0	117
700	Q	27.9	Very low	28.6	Very low	172 Å²	172	132.6 Å²	132.6	80%	0.804	74%	0.736	S	S	*	*			trans	71	155.4	148.3	-74	-172.2	-6.7	0	0	119.4
701	T	27	Very low	28.1	Very low	103 Å²	103	132.2 Å²	132.2	63%	0.632	74%	0.743	S	S	*	*			cis	-167	166.4	-10	24.4	0	0	0	0	113.3
702	I	28.1	Very low	27.8	Very low	137 Å²	137	128.9 Å²	128.9	70%	0.703	74%	0.74	S	S	*	*			trans	84.7	112.9	137.5	-84.5	163.4	0	0	0	122.1
703	E	26.8	Very low	27.2	Very low	146 Å²	146	129.4 Å²	129.4	68%	0.682	74%	0.742	S	S	*	*				110.2	124.6	128.4	-86.8	-175	-140.6	0	0	126.9
704	H	27.7	Very low	26.9	Very low	136 Å²	136	129.5 Å²	129.5	63%	0.63	74%	0.743	S	S	*	*			trans	61.6	119	133.9	-71.1	146.7	0	0	0	126.3
705	I	25.4	Very low	26.7	Very low	153 Å²	153	137.4 Å²	137.4	79%	0.785	75%	0.75	S	S	*	*				53.9	122.1	121.3	-58.3	167.8	0	0	0	119.3
706	G	24.8	Very low	26.6	Very low	76 Å²	76	133.4 Å²	133.4	78%	0.784	74%	0.743	S	S	*	*			trans	-169.5	104.3	162	0	0	0	0	0	113.9
707	K	24.8	Very low	26.5	Very low	201 Å²	201	133.7 Å²	133.7	87%	0.874	75%	0.75	S	S	*	*			trans	-69.8	144.1	-175.9	-71.5	174.4	176.5	174.9	0	114.1
708	S	24.3	Very low	26.6	Very low	85 Å²	85	132.3 Å²	132.3	59%	0.594	75%	0.75	S	S	*	*			trans	-10	146.9	150.6	55.5	0	0	0	0	119.9
709	H	27.1	Very low	26.6	Very low	165 Å²	165	134 Å²	134	76%	0.764	76%	0.758	S	S	*	*				-172.5	119.3	110	-101.1	-68.7	0	0	0	116.5
710	T	25	Very low	25.9	Very low	119 Å²	119	136.7 Å²	136.7	73%	0.73	77%	0.767	S	S	*	*			trans	31.2	123.6	137.8	49.7	0	0	0	0	124.7
711	C	23	Very low	25.8	Very low	137 Å²	137	133.1 Å²	133.1	93%	0.926	77%	0.766	S	S	*	*				83.2	136	129.8	-158.5	0	0	0	0	121.5
712	G	23.3	Very low	25.8	Very low	65 Å²	65	131.3 Å²	131.3	67%	0.67	77%	0.769	S	S	*	*			trans	-178.6	69.4	177.5	0	0	0	0	0	118.4
713	I	26.5	Very low	25.6	Very low	170 Å²	170	135.1 Å²	135.1	87%	0.872	78%	0.781	S	S	*	*			trans	55.3	106.3	139.9	-53.9	159.8	0	0	0	120.5
714	G	23.1	Very low	25.7	Very low	71 Å²	71	137 Å²	137	73%	0.732	79%	0.786	S	S	*	*				92.4	135	101.8	0	0	0	0	0	123.9
715	R	25.6	Very low	25.7	Very low	240 Å²	240	138 Å²	138	91%	0.906	79%	0.789	S	S	*	*			trans	84.4	92.2	149.9	-71.2	-174.4	169.5	174.1	-3.2	123.3
716	S	25.1	Very low	25.7	Very low	107 Å²	107	135.2 Å²	135.2	75%	0.748	79%	0.789	S	S	*	*				41.5	117.3	112.9	63.5	0	0	0	0	122.8
717	S	27.6	Very low	25.7	Very low	120 Å²	120	137.6 Å²	137.6	84%	0.839	78%	0.784	S	S	*	*			trans	172.6	165.4	143.1	40.9	0	0	0	0	110.4
718	D	26.1	Very low	25.8	Very low	144 Å²	144	133.3 Å²	133.3	77%	0.77	78%	0.779	S	S	*	*				-159.2	154.4	-50	-147.9	-15.3	0	0	0	110.6
719	M	26.6	Very low	26.2	Very low	172 Å²	172	135.7 Å²	135.7	85%	0.847	78%	0.781	S	S	*	*			trans	50.6	158.1	160.3	-80.5	-66.7	158.3	0	0	125
720	D	28.1	Very low	26.1	Very low	152 Å²	152	137.9 Å²	137.9	81%	0.813	78%	0.782	S	S	*	*			trans	-108.2	157.4	-177	-159.8	-6	0	0	0	111.1
721	A	26.3	Very low	26.1	Very low	96 Å²	96	138.4 Å²	138.4	79%	0.793	78%	0.776	S	S	*	*			trans	158.2	147.7	150	0	0	0	0	0	114.4
722	G	26.9	Very low	26.1	Very low	66 Å²	66	139.8 Å²	139.8	68%	0.68	77%	0.767	S	S	*	*			trans	-140.2	165.8	162.7	0	0	0	0	0	111.9
723	F	23.7	Very low	26.1	Very low	217 Å²	217	143 Å²	143	95%	0.952	77%	0.767	S	S	*	*			trans	-151.6	169.6	174.1	-109.7	-77.7	0	0	0	113.9
724	K	29.8	Very low	25.9	Very low	185 Å²	185	142.1 Å²	142.1	80%	0.804	76%	0.763	S	S	*	*			trans	-120.4	156.6	-172.4	-58.2	177	179.2	178.5	0	113.2
725	F	26.2	Very low	25.8	Very low	158 Å²	158	146 Å²	146	69%	0.693	77%	0.766	S	S	*	*			trans	-158.6	155.2	152.3	-90.1	-62.9	0	0	0	108.2	D319	D319-F725 VanDerWaalsContact OD1-CB 3.26Å; D319-F725 WeakPolarHBondContact OD1-CB 3.29Å; D319-F725 WeakPolarHBondContact OD1-CD2 3.21Å; D319-F725 WeakPolarHBondContact OD1-CG 3.42Å
726	A	25.2	Very low	25.6	Very low	94 Å²	94	146 Å²	146	78%	0.777	77%	0.766	S	S	*	*			cis	-150.6	-176.6	-6.9	0	0	0	0	0	110.7
727	D	25.8	Very low	25.4	Very low	126 Å²	126	148.1 Å²	148.1	67%	0.674	77%	0.769	S	S	*	*			trans	-94.4	161.3	-173.2	176.4	32.5	0	0	0	114.3	Q729	D727-Q729 PolarHBondContact OD1-N 3.47Å; D727-Q729 VanDerWaalsContact OD1-N 3.14Å
728	S	27.1	Very low	25.1	Very low	111 Å²	111	148.3 Å²	148.3	78%	0.776	77%	0.769	S	S	*	*			trans	-170	93.8	132.6	25.9	0	0	0	0	114.3
729	Q	31.7	Very low	26	Very low	135 Å²	135	146.7 Å²	146.7	63%	0.631	77%	0.766	S	S	*	*			trans	41.2	135.9	132.4	-51.9	-177.5	10.8	0	0	120	D727	D727-Q729 PolarHBondContact OD1-N 3.47Å; D727-Q729 VanDerWaalsContact OD1-N 3.14Å
730	R	25.1	Very low	25.8	Very low	210 Å²	210	145.9 Å²	145.9	79%	0.792	77%	0.765	S	S	*	*				-154.7	131.3	58.2	-85.4	-174.6	173.4	-176.8	-1.4	112.1
731	Q	26.1	Very low	25.8	Very low	130 Å²	130	146.9 Å²	146.9	61%	0.607	76%	0.762	S	S	*	*				78	128.5	83.2	-123.9	-175.4	45.4	0	0	111.8
732	K	23.2	Very low	25.7	Very low	166 Å²	166	148.6 Å²	148.6	72%	0.722	76%	0.758	S	S	*	*			cis	-153.4	133.3	46.7	-93.8	-171	177.1	-178.9	0	111.9
733	I	22.5	Very low	25.6	Very low	133 Å²	133	153.6 Å²	153.6	68%	0.682	76%	0.761	S	S	*	*				76.3	130.2	98	-70.5	179.1	0	0	0	113.2
734	I	22.1	Very low	25.6	Very low	151 Å²	151	149.3 Å²	149.3	77%	0.774	75%	0.748	S	S	*	*			cis	-148.6	176.7	12.9	-136.4	166.7	0	0	0	114.3
735	L	21	Very low	25.3	Very low	153 Å²	153	147.7 Å²	147.7	80%	0.801	75%	0.748	S	S	*	*			trans	-60	164.7	177.8	-81.3	71.7	0	0	0	114.9
736	R	21.8	Very low	25.3	Very low	241 Å²	241	148.1 Å²	148.1	91%	0.909	76%	0.756	S	S	*	*				-169.1	175.1	65.6	-153	169.4	-176.9	159.9	0.7	115.2
737	N	20.8	Very low	25.3	Very low	150 Å²	150	148.7 Å²	148.7	80%	0.802	76%	0.755	S	S	*	*			trans	-102	156.1	-169.6	-85.7	3.7	0	0	0	115.9
738	C	20.9	Very low	25.3	Very low	125 Å²	125	148.3 Å²	148.3	85%	0.845	76%	0.757	S	S	*	*			trans	72.9	172.2	146.1	-102.3	0	0	0	0	118.7
739	P	44.9	Very low	25.2	Very low	109 Å²	109	150 Å²	150	71%	0.708	76%	0.756	S	S	*	*				-119.5	175.1	-128.9	44.3	-33	0	0	0	114.1
740	D	23.5	Very low	24.9	Very low	156 Å²	156	149.5 Å²	149.5	83%	0.834	75%	0.754	S	S	*	*			trans	-164	-173.6	135.6	-126.1	-43.2	0	0	0	113.7
741	K	26.3	Very low	24.9	Very low	173 Å²	173	149 Å²	149	75%	0.752	75%	0.752	S	S	*	*			trans	-88.1	-179.2	-174.5	-62	175.6	178.7	172.8	0	115.6
742	D	25.2	Very low	25	Very low	131 Å²	131	148.8 Å²	148.8	70%	0.701	76%	0.755	S	S	*	*			trans	87.1	102	148	-66.5	-40.2	0	0	0	120
743	K	24.6	Very low	25.2	Very low	172 Å²	172	149.3 Å²	149.3	75%	0.748	76%	0.757	S	S	*	*				71.1	145.1	119.4	-80.3	-170.1	173.9	-170.7	0	123.7
744	D	23.5	Very low	25.3	Very low	126 Å²	126	153.3 Å²	153.3	67%	0.674	76%	0.764	S	S	*	*			trans	82.1	113.9	145.5	-62.5	-12	0	0	0	122.2
745	L	24.4	Very low	25.4	Very low	152 Å²	152	153.2 Å²	153.2	80%	0.796	76%	0.764	S	S	*	*			trans	73.9	92.2	135.2	-60.4	172	0	0	0	121.2
746	L	25.2	Very low	25.6	Very low	166 Å²	166	150.1 Å²	150.1	87%	0.869	76%	0.755	S	S	*	*				20.8	125.3	124.4	-80.8	164.9	0	0	0	119.8
747	S	24.7	Very low	26	Very low	107 Å²	107	144.5 Å²	144.5	75%	0.748	75%	0.748	S	S	*	*			trans	-159.3	134	133.7	45.3	0	0	0	0	114
748	T	25.6	Very low	26.4	Very low	117 Å²	117	143.8 Å²	143.8	72%	0.718	74%	0.743	S	S	*	*			trans	40.7	116.4	148.1	49	0	0	0	0	121.1
749	L	25.1	Very low	26.6	Very low	146 Å²	146	144.3 Å²	144.3	76%	0.764	74%	0.737	S	S	*	*				74.6	139.7	85.9	-98.9	80.3	0	0	0	114.7
750	E	27.1	Very low	25.6	Very low	125 Å²	125	147.6 Å²	147.6	58%	0.584	74%	0.743	S	S	*	*			cis	-168.6	174.4	-0.5	-155	-176.2	-133.5	0	0	111.6
751	R	25.3	Very low	25.7	Very low	201 Å²	201	147.8 Å²	147.8	76%	0.758	74%	0.743	S	S	*	*			trans	77.2	132.9	161.3	-60.1	159	-162.3	176.3	9.3	115.5
752	N	27.3	Very low	25.7	Very low	124 Å²	124	149.3 Å²	149.3	66%	0.663	75%	0.753	S	S	*	*			cis	-145.6	175.8	6.6	-69	-77.5	0	0	0	108.1
753	K	27	Very low	25.6	Very low	178 Å²	178	151 Å²	151	77%	0.774	76%	0.757	S	S	*	*			cis	-179.8	150.4	-26.1	-93.2	172.1	179.6	130.7	0	103.9
754	R	24.9	Very low	25.4	Very low	216 Å²	216	151.2 Å²	151.2	82%	0.815	76%	0.758	S	S	*	*			cis	-119.5	-170	-3.9	-95.2	-173.7	156.4	162.9	-7.2	107.4
755	L	23.8	Very low	25.4	Very low	150 Å²	150	152.4 Å²	152.4	79%	0.785	76%	0.764	S	S	*	*			cis	71.2	147.4	26.4	-78.3	92.2	0	0	0	115
756	S	26.1	Very low	25.6	Very low	88 Å²	88	150.4 Å²	150.4	62%	0.615	76%	0.759	S	S	*	*			cis	-169	150.5	1.2	34.5	0	0	0	0	108.4
757	T	28.9	Very low	25.6	Very low	122 Å²	122	150 Å²	150	75%	0.748	76%	0.758	S	S	*	*			cis	-157.2	-156.1	-10.9	24.2	0	0	0	0	104.6
758	I	29.7	Very low	25.6	Very low	136 Å²	136	157 Å²	157	70%	0.697	77%	0.768	S	S	*	*			cis	-158.9	175.6	8.2	-143.4	165.7	0	0	0	105.6
759	D	24.8	Very low	25.5	Very low	136 Å²	136	160.5 Å²	160.5	73%	0.727	78%	0.777	S	S	*	*			cis	-151.7	136	15.2	-121.3	-46.2	0	0	0	109.5
760	E	25.1	Very low	26	Very low	177 Å²	177	159.1 Å²	159.1	83%	0.827	78%	0.776	S	S	*	*			trans	-168.1	157.4	161.3	-147.2	174.4	-139.1	0	0	109.9
761	L	25.5	Very low	25.9	Very low	161 Å²	161	158.3 Å²	158.3	84%	0.843	79%	0.785	S	S	*	*			trans	69	114.3	174.8	-67.5	136.1	0	0	0	119.1
762	E	25.1	Very low	26	Very low	204 Å²	204	156.2 Å²	156.2	95%	0.953	79%	0.788	S	S	*	*			trans	-144.8	100.7	143.8	-169.1	170.1	-124.6	0	0	110
763	E	24.1	Very low	25.9	Very low	167 Å²	167	159.9 Å²	159.9	78%	0.78	80%	0.798	S	S	*	*			trans	-153.8	159.2	165.6	-161.6	167.7	-138.3	0	0	109.2
764	F	21.1	Very low	25.9	Very low	177 Å²	177	158.8 Å²	158.8	78%	0.776	80%	0.799	S	S	*	*			trans	67.6	125.4	-165.9	-55.9	-91	0	0	0	113.8
765	L	22.5	Very low	25.9	Very low	151 Å²	151	156 Å²	156	79%	0.791	80%	0.795	S	S	*	*			cis	-169	178.2	0.3	-95	175.8	0	0	0	107.2
766	P	28.1	Very low	25.9	Very low	109 Å²	109	155.2 Å²	155.2	71%	0.708	79%	0.792	S	S	*	*			cis	-131.4	-176.4	-28.6	38	-20.5	0	0	0	113.8
767	N	25.9	Very low	25.9	Very low	159 Å²	159	160.8 Å²	160.8	85%	0.85	81%	0.805	S	S	*	*			trans	-28.9	134.8	173.4	-59	-2.9	0	0	0	119.2
768	R	24.3	Very low	25.7	Very low	252 Å²	252	163.5 Å²	163.5	95%	0.951	81%	0.814	S	S	*	*			trans	-151.8	139.6	138.6	-108	174.9	-173.4	-176.3	1.7	110.6
769	E	24.5	Very low	25.5	Very low	192 Å²	192	164.5 Å²	164.5	90%	0.897	82%	0.821	S	S	*	*			trans	-88.3	163	-176.8	-94.7	-163.5	152.6	0	0	114
770	P	34.5	Very low	25.4	Very low	116 Å²	116	162.9 Å²	162.9	75%	0.753	82%	0.82	S	S	*	*			trans	-97.7	141.9	-158.1	36.3	-35	0	0	0	115.2
771	S	24.9	Very low	25.5	Very low	109 Å²	109	163.4 Å²	163.4	76%	0.762	82%	0.82	S	S	*	*			trans	-169.5	157.8	146.7	43.9	0	0	0	0	111.3
772	L	27.8	Very low	25.6	Very low	157 Å²	157	166.4 Å²	166.4	82%	0.822	82%	0.82	S	S	*	*			trans	59.6	92	169.6	-59	170.5	0	0	0	117.4
773	F	25.2	Very low	25.6	Very low	200 Å²	200	163.1 Å²	163.1	88%	0.877	81%	0.809	S	S	*	*				-163.4	129	98	-122.4	-91.1	0	0	0	111.6
774	I	27.1	Very low	25.6	Very low	155 Å²	155	165.3 Å²	165.3	80%	0.795	82%	0.816	S	S	*	*			trans	-105.6	117.7	168.9	-65.6	174.1	0	0	0	107.6
775	H	25.1	Very low	25.8	Very low	159 Å²	159	163.7 Å²	163.7	74%	0.736	82%	0.816	S	S	*	*			trans	-169.2	162.7	137.2	-124.3	-93.2	0	0	0	112.7
776	N	23.8	Very low	26	Very low	133 Å²	133	161.3 Å²	161.3	71%	0.711	81%	0.811	S	S	*	*	S	Bend	trans	64.8	74.9	160.4	-57.2	-15.8	0	0	0	118.4
777	F	25.7	Very low	25.9	Very low	204 Å²	204	164.5 Å²	164.5	90%	0.895	82%	0.821	S	S	*	*	S	Bend		-160	45.4	120.8	-128.8	-85.4	0	0	0	114.7
778	L	25.6	Very low	25.8	Very low	179 Å²	179	160 Å²	160	94%	0.937	81%	0.812	S	S	*	*			trans	-132	82	164.5	-81.2	179.4	0	0	0	110
779	D	24.6	Very low	25.8	Very low	158 Å²	158	158 Å²	158	85%	0.845	82%	0.816	S	S	*	*			trans	-153.1	155.2	154	-147.7	-22.2	0	0	0	110.4
780	S	24.2	Very low	25.7	Very low	102 Å²	102	152.5 Å²	152.5	71%	0.713	81%	0.811	S	S	*	*	S	Bend	trans	63.8	114.6	-166.2	-156.3	0	0	0	0	113.6
781	K	26.4	Very low	25.1	Very low	188 Å²	188	150 Å²	150	82%	0.817	81%	0.807	S	S	*	*			cis	-158	145.2	5	-141.8	177.9	179.3	-179.4	0	111.9
782	R	26.7	Very low	25.1	Very low	223 Å²	223	155.8 Å²	155.8	84%	0.842	81%	0.813	S	S	*	*			trans	-109.6	176	159	-85.9	-171.8	176.8	171.9	0.8	109.9
783	D	25.3	Very low	24.8	Very low	136 Å²	136	156.4 Å²	156.4	73%	0.727	81%	0.812	S	S	*	*			trans	70.6	129.7	172.7	-45.1	-35.3	0	0	0	114
784	F	24.2	Very low	24.6	Very low	213 Å²	213	152.7 Å²	152.7	93%	0.934	80%	0.8	S	S	*	*			cis	-118.9	167.7	38.8	-93.9	-101.5	0	0	0	116.2
785	N	25.2	Very low	24.3	Very low	143 Å²	143	156.2 Å²	156.2	77%	0.765	80%	0.804	S	S	*	*			trans	-130.2	146.1	-177.5	-141.6	-3.3	0	0	0	113
786	S	26.1	Very low	24.3	Very low	100 Å²	100	159.5 Å²	159.5	70%	0.699	81%	0.811	S	S	*	*			trans	48.3	92.7	154	63.2	0	0	0	0	121.9
787	I	27.9	Very low	24.3	Very low	177 Å²	177	159 Å²	159	91%	0.908	82%	0.815	S	S	*	*			trans	-148	141.8	142.5	-53.8	-176.9	0	0	0	107.3
788	G	22.4	Very low	24.2	Very low	65 Å²	65	157 Å²	157	67%	0.67	81%	0.809	S	S	*	*			cis	161.1	100.6	-11.2	0	0	0	0	0	114.9
789	M	23.8	Very low	24.2	Very low	208 Å²	208	158.8 Å²	158.8	100%	1.025	81%	0.809	S	S	*	*			trans	68.1	131.3	160.9	-147.2	175.8	-163.6	0	0	120.2
790	G	22.9	Very low	24.1	Very low	77 Å²	77	156 Å²	156	79%	0.794	80%	0.797	S	S	*	*			trans	116.9	98.7	144.2	0	0	0	0	0	121
791	G	22.9	Very low	24.2	Very low	65 Å²	65	158.4 Å²	158.4	67%	0.67	80%	0.801	S	S	*	*				77.6	147.3	127.7	0	0	0	0	0	123
792	Y	23.8	Very low	24	Very low	229 Å²	229	154.5 Å²	154.5	90%	0.898	79%	0.789	S	S	*	*			trans	72.4	100.3	155.6	-54.4	-74.2	0	0	0	121
793	E	21	Very low	24	Very low	171 Å²	171	151.5 Å²	151.5	80%	0.799	78%	0.782	S	S	*	*				2.9	151.7	122.9	-158.8	-169.3	-176.1	0	0	119.9
794	I	22.2	Very low	24	Very low	121 Å²	121	153.5 Å²	153.5	62%	0.621	79%	0.785	S	S	*	*			trans	131.8	121.3	142.3	-68.2	-179.8	0	0	0	116.1
795	R	19.8	Very low	23.9	Very low	230 Å²	230	151.1 Å²	151.1	87%	0.868	78%	0.778	S	S	*	*			trans	65.2	127.5	155.4	-74.3	163.6	-157.8	179.9	6.4	122.6
796	Y	25.8	Very low	23.9	Very low	228 Å²	228	154.4 Å²	154.4	89%	0.894	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-63	142	143.1	-67.1	-96.4	0	0	0	111.3
797	P	24.3	Very low	23.9	Very low	123 Å²	123	159.3 Å²	159.3	80%	0.799	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-91.8	128.9	162.9	33.3	-29.2	0	0	0	111.7
798	E	22.5	Very low	23.7	Very low	162 Å²	162	156.3 Å²	156.3	76%	0.757	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-67	155.5	165.5	-64.1	172.1	88.3	0	0	111.7	T800	E798-T800 HydrophobicContact CB-CG2 4.44Å; E798-T800 WeakPolarHBondContact OE1-CG2 3.41Å
799	K	26	Very low	23.8	Very low	216 Å²	216	158 Å²	158	94%	0.939	79%	0.791	S	S	*	*			trans	-132.4	131.2	135.4	-78.7	-164.1	174.6	179.7	0	110.2
800	T	22.4	Very low	23.9	Very low	99 Å²	99	155.3 Å²	155.3	61%	0.607	78%	0.78	S	S	*	*			trans	-110.5	-174.5	-174.6	46.7	0	0	0	0	111.2	E798	E798-T800 HydrophobicContact CB-CG2 4.44Å; E798-T800 WeakPolarHBondContact OE1-CG2 3.41Å
801	L	26.3	Very low	24	Very low	152 Å²	152	159.1 Å²	159.1	80%	0.796	78%	0.781	S	S	*	*			trans	76	134.6	-178.8	-83.8	77.2	0	0	0	116.1
802	D	23.7	Very low	24.1	Very low	106 Å²	106	159.8 Å²	159.8	57%	0.567	79%	0.787	S	S	*	*			cis	-161.8	164.9	-10	-149.4	-9.6	0	0	0	114.7
803	K	26.1	Very low	24	Very low	160 Å²	160	152.5 Å²	152.5	70%	0.696	78%	0.782	S	S	*	*			trans	63	100.8	153.1	-79.4	147.1	-171.6	143.2	0	122.6
804	K	23.9	Very low	24.2	Very low	178 Å²	178	152.4 Å²	152.4	77%	0.774	79%	0.787	S	S	*	*				75.4	115.2	120.4	-73.9	-172.7	174	-177.8	0	123.1
805	M	23.9	Very low	24.4	Very low	163 Å²	163	155.7 Å²	155.7	80%	0.803	80%	0.799	S	S	*	*				66.2	107.9	127.4	-67	-178.2	156.1	0	0	121.8
806	K	24.1	Very low	24.6	Very low	213 Å²	213	150.2 Å²	150.2	93%	0.926	80%	0.796	S	S	*	*				-175	173	101	-101.1	172.4	-177.8	177.7	0	113
807	K	27.1	Very low	24.6	Very low	203 Å²	203	148.6 Å²	148.6	88%	0.883	79%	0.794	S	S	*	*			trans	-92.9	133.3	-178.2	-65.2	178.5	176	-178.3	0	113
808	S	23.8	Very low	24.6	Very low	113 Å²	113	150.3 Å²	150.3	79%	0.79	79%	0.794	S	S	*	*			trans	175	118.3	143.3	49.1	0	0	0	0	108
809	S	23.1	Very low	24.7	Very low	102 Å²	102	148.3 Å²	148.3	71%	0.713	79%	0.793	S	S	*	*				86.4	112	65.5	-169	0	0	0	0	114.1
810	L	26.8	Very low	24.8	Very low	150 Å²	150	143.9 Å²	143.9	79%	0.785	78%	0.784	S	S	*	*			trans	72	128.8	154.3	-66.6	169.2	0	0	0	122.3
811	I	25.6	Very low	25	Very low	158 Å²	158	147.9 Å²	147.9	81%	0.81	80%	0.796	S	S	*	*			trans	72.6	122.7	138.7	-63	165.5	0	0	0	120.6
812	G	23	Very low	25.2	Very low	78 Å²	78	148.4 Å²	148.4	80%	0.804	79%	0.794	S	S	*	*			trans	112.5	119.8	133.6	0	0	0	0	0	117.9
813	G	23.5	Very low	25.5	Very low	77 Å²	77	152.5 Å²	152.5	79%	0.794	80%	0.802	S	S	*	*			trans	169.9	104.3	170.4	0	0	0	0	0	114.9
814	N	23.8	Very low	25.9	Very low	168 Å²	168	153.5 Å²	153.5	90%	0.898	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-52.6	147.4	-177.6	-64	-36.9	0	0	0	115.9
815	H	26.5	Very low	26.3	Very low	191 Å²	191	148.5 Å²	148.5	88%	0.884	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-101.1	142.7	148.8	-85.2	-75.1	0	0	0	110.9
816	S	24.8	Very low	26.8	Very low	114 Å²	114	145.3 Å²	145.3	80%	0.797	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-78.8	149.4	179.1	41.2	0	0	0	0	112.5
817	K	25.5	Very low	27.3	Very low	194 Å²	194	142.3 Å²	142.3	84%	0.843	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-66.2	138	173	-67.3	-179.2	177.5	-178.7	0	111
818	I	25.1	Very low	27.7	Very low	159 Å²	159	138.6 Å²	138.6	82%	0.815	74%	0.742	S	S	*	*			trans	-109.3	130.3	146.8	-63.6	176.3	0	0	0	105.7
819	V	24.7	Very low	28	Very low	121 Å²	121	137.8 Å²	137.8	73%	0.733	73%	0.726	S	S	*	*			trans	-97.2	127.1	176.6	177.1	0	0	0	0	107.9
820	V	26.9	Very low	28.5	Very low	123 Å²	123	138.9 Å²	138.9	75%	0.745	72%	0.723	S	S	*	*			trans	-109.5	121	167.6	178.8	0	0	0	0	107.1	Q822	V820-Q822 PolarHBondContact O-N 3.26Å
821	E	26	Very low	28.8	Very low	183 Å²	183	134.3 Å²	134.3	86%	0.855	70%	0.697	S	S	*	*			trans	-91.9	97	-174.8	-169.5	164.1	-147	0	0	109.6
822	Q	31.4	Very low	29.2	Very low	163 Å²	163	127.1 Å²	127.1	76%	0.762	66%	0.661	S	S	*	*			trans	-68.2	131.6	178.4	-71.6	-175.9	-75.7	0	0	110.9	V820	V820-Q822 PolarHBondContact O-N 3.26Å
823	R	30.2	Very low	29.6	Very low	192 Å²	192	128.9 Å²	128.9	73%	0.725	65%	0.646	S	S	*	*			trans	-75.7	134.2	178.3	-56.5	-171.2	-161	-161.5	7.5	109.9	S825 E826	R823-S825 PolarHBondContact O-N 2.96Å; R823-E826 PolarHBondContact O-N 3.45Å
824	K	33.7	Very low	29.8	Very low	181 Å²	181	128.6 Å²	128.6	79%	0.787	63%	0.626	S	S	*	*	H	α-helix	trans	-57	-19.3	-179.4	-73.9	-174.5	173.4	-175.7	0	115	Y828	K824-Y828 VanDerWaalsContact O-CD2 3.31Å; K824-Y828 WeakPolarHBondContact O-CD2 3.37Å
825	S	32.6	Very low	30.5	Very low	72 Å²	72	123.3 Å²	123.3	50%	0.503	60%	0.596	S	S	.	*	H	α-helix	trans	-64	-45.2	179.7	47.2	0	0	0	0	113.3	R823 Y827 Y828 E829	R823-S825 PolarHBondContact O-N 2.96Å; S825-Y827 PolarHBondContact O-N 3.39Å; S825-Y828 PolarHBondContact O-N 3.5Å; S825-E829 PolarHBondContact O-N 2.93Å; S825-E829 VanDerWaalsContact O-N 3.16Å
826	E	34.1	Very low	31	Very low	97 Å²	97	116.8 Å²	116.8	45%	0.453	58%	0.58	S	S	.	*	H	α-helix	trans	-63.2	-30.3	-175.2	-66.8	167	-168	0	0	111.8	R823 E829 L830	R823-E826 PolarHBondContact O-N 3.45Å; E826-E829 PolarHBondContact O-N 3.49Å; E826-L830 WeakPolarHBondContact O-CD1 3.29Å; E826-L830 PolarHBondContact O-N 2.86Å
827	Y	35.3	Very low	31.5	Very low	149 Å²	149	113.7 Å²	113.7	58%	0.584	56%	0.557	S	S	*	*	H	α-helix	trans	-62.9	-46.8	178.1	-179.5	-103.7	0	0	0	112.6	S825 L830 K831	S825-Y827 PolarHBondContact O-N 3.39Å; Y827-L830 PolarHBondContact O-N 3.32Å; Y827-K831 WeakPolarHBondContact O-CB 3.42Å; Y827-K831 PolarHBondContact O-N 2.97Å
828	Y	34.4	Very low	32	Very low	125 Å²	125	105.3 Å²	105.3	49%	0.49	52%	0.522	S	S	.	.	H	α-helix	trans	-73.9	-33.5	177.4	-64.1	-81.6	0	0	0	112	Y157 K824 S825 L830 K831	Y157-Y828 PolarHBondContact OH-O 2.97Å; K824-Y828 VanDerWaalsContact O-CD2 3.31Å; K824-Y828 WeakPolarHBondContact O-CD2 3.37Å; S825-Y828 PolarHBondContact O-N 3.5Å; Y828-L830 PolarHBondContact O-N 3.41Å; Y828-K831 PolarHBondContact O-N 2.97Å; Y828-K831 VanDerWaalsContact O-N 3.08Å
829	E	32	Very low	32.7	Very low	97 Å²	97	101.7 Å²	101.7	45%	0.453	50%	0.504	S	S	.	.	H	α-helix	trans	-70	-20.5	175.4	-146.2	-158.7	130.5	0	0	113.4	Y157 S825 E826 K833	Y157-E829 PolarHBondContact OH-O 2.89Å; S825-E829 PolarHBondContact O-N 2.93Å; S825-E829 VanDerWaalsContact O-N 3.16Å; E826-E829 PolarHBondContact O-N 3.49Å; E829-K833 WeakPolarHBondContact O-CD 3.44Å; E829-K833 IonicContact OE1-NZ 2.84Å; E829-K833 PolarHBondContact OE1-NZ 3.43Å
830	L	33.5	Very low	33.3	Very low	125 Å²	125	97.3 Å²	97.3	65%	0.654	48%	0.475	S	S	*	.	H	α-helix	trans	-84.4	-35.3	162.7	-90.6	90.7	0	0	0	113	E826 Y827 Y828 A832 K833 L834	E826-L830 WeakPolarHBondContact O-CD1 3.29Å; E826-L830 PolarHBondContact O-N 2.86Å; Y827-L830 PolarHBondContact O-N 3.32Å; Y828-L830 PolarHBondContact O-N 3.41Å; L830-A832 VanDerWaalsContact C-N 3.27Å; L830-A832 PolarHBondContact O-N 3.35Å; L830-A832 VanDerWaalsContact O-N 3.14Å; L830-K833 PolarHBondContact O-N 3.32Å; L830-L834 WeakPolarHBondContact O-CB 3.4Å
831	K	31.5	Very low	33.8	Very low	54 Å²	54	96.4 Å²	96.4	24%	0.235	47%	0.465	C	S	.	.	H	α-helix	trans	-59.6	-27.3	-167.9	-167.6	178.5	179.6	-169.1	0	115.2	D229 Y827 Y828 L834	D229-K831 IonicContact OD1-NZ 2.66Å; D229-K831 PolarHBondContact OD1-NZ 3.45Å; D229-K831 VanDerWaalsContact OD2-CE 3.26Å; D229-K831 WeakPolarHBondContact OD2-CE 3.33Å; D229-K831 IonicContact OD2-NZ 2.68Å; D229-K831 PolarHBondContact OD2-NZ 3.31Å; Y827-K831 WeakPolarHBondContact O-CB 3.42Å; Y827-K831 PolarHBondContact O-N 2.97Å; Y828-K831 PolarHBondContact O-N 2.97Å; Y828-K831 VanDerWaalsContact O-N 3.08Å; K831-L834 WeakPolarHBondContact O-CB 3.49Å; K831-L834 WeakPolarHBondContact O-CD1 3.34Å
832	A	34.5	Very low	34.7	Very low	7 Å²	7	90.9 Å²	90.9	6%	0.058	44%	0.439	C	S	.	.	S	Bend	trans	-116.2	-7.2	-179.9	0	0	0	0	0	115.4	Y157 D181 L830 L834 Q835	Y157-A832 HydrophobicContact CE1-CB 4.35Å; Y157-A832 VanDerWaalsContact CE2-C 3.45Å; Y157-A832 HydrophobicContact CE2-CB 3.72Å; Y157-A832 VanDerWaalsContact OH-C 3.27Å; Y157-A832 VanDerWaalsContact OH-CA 3.22Å; Y157-A832 WeakPolarHBondContact OH-CA 3.42Å; Y157-A832 WeakPolarHBondContact OH-CB 3.48Å; Y157-A832 PolarHBondContact OH-N 2.94Å; D181-A832 HydrophobicContact CB-CB 4.18Å; D181-A832 WeakPolarHBondContact OD2-CB 3.4Å; L830-A832 VanDerWaalsContact C-N 3.27Å; L830-A832 PolarHBondContact O-N 3.35Å; L830-A832 VanDerWaalsContact O-N 3.14Å; A832-L834 PolarHBondContact O-N 3.43Å; A832-Q835 PolarHBondContact O-N 3.39Å
833	K	31	Very low	35.3	Very low	115 Å²	115	83.2 Å²	83.2	50%	0.5	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	25.9	160.7	-69.6	179.7	-175	165	0	112.4	Y157 E829 L830	Y157-K833 HydrophobicContact CD2-CG 4.47Å; Y157-K833 HydrophobicContact CE2-CB 4.46Å; Y157-K833 HydrophobicContact CE2-CG 3.6Å; Y157-K833 PolarHBondContact OH-N 3.33Å; E829-K833 WeakPolarHBondContact O-CD 3.44Å; E829-K833 IonicContact OE1-NZ 2.84Å; E829-K833 PolarHBondContact OE1-NZ 3.43Å; L830-K833 PolarHBondContact O-N 3.32Å
834	L	29	Very low	35.8	Very low	71 Å²	71	77 Å²	77	37%	0.372	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.5	-35.4	-150.4	-155.9	161	0	0	0	109.1	Y466 L830 K831 A832	Y466-L834 HydrophobicContact CE1-CD1 4.47Å; Y466-L834 HydrophobicContact CE2-CD1 4.34Å; Y466-L834 HydrophobicContact CE2-CD2 3.77Å; Y466-L834 HydrophobicContact CE2-CG 4.31Å; Y466-L834 WeakPolarHBondContact OH-CD2 3.48Å; Y466-L834 WeakPolarHBondContact OH-CG 3.3Å; L830-L834 WeakPolarHBondContact O-CB 3.4Å; K831-L834 WeakPolarHBondContact O-CB 3.49Å; K831-L834 WeakPolarHBondContact O-CD1 3.34Å; A832-L834 PolarHBondContact O-N 3.43Å
835	Q	37	Very low	36.3	Very low	57 Å²	57	73.8 Å²	73.8	27%	0.266	37%	0.372	S	S	.	.	S	Bend	trans	-98.3	115.3	-179.8	-64.9	168.5	-9.1	0	0	107.1	A832	A832-Q835 PolarHBondContact O-N 3.39Å
836	G	38.8	Very low	36.9	Very low	54 Å²	54	72.9 Å²	72.9	56%	0.557	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-74.4	129.5	-178.4	0	0	0	0	0	110.7
837	T	34.6	Very low	37.2	Very low	49 Å²	49	72 Å²	72	30%	0.301	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-57.9	141.6	173.1	54.5	0	0	0	0	111.2	I178	I178-T837 HydrophobicContact CD1-CG2 3.91Å
838	P	36.1	Very low	37.6	Very low	17 Å²	17	67.9 Å²	67.9	11%	0.11	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-62	142.5	172.5	26	-34.4	0	0	0	110.4	V176 I178	V176-P838 HydrophobicContact CG1-CG 4.2Å; I178-P838 HydrophobicContact CD1-CG 4.11Å
839	D	38.6	Very low	37.8	Very low	83 Å²	83	64.7 Å²	64.7	44%	0.444	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-82.5	131.2	178.8	-163.6	-41.3	0	0	0	110.2	L841 Q842 V843	D839-L841 PolarHBondContact O-N 3.42Å; D839-L841 VanDerWaalsContact O-N 3.13Å; D839-L841 PolarHBondContact OD1-N 3.42Å; D839-Q842 HydrophobicContact CB-CB 4.37Å; D839-Q842 WeakPolarHBondContact O-CB 3.37Å; D839-Q842 PolarHBondContact O-N 3.28Å; D839-V843 WeakPolarHBondContact O-CG2 3.41Å; D839-V843 PolarHBondContact O-N 2.96Å
840	Y	37.8	Very low	38.1	Very low	29 Å²	29	64.4 Å²	64.4	11%	0.114	35%	0.347	C	S	.	.	H	α-helix	trans	-55.6	-28.2	177.2	170.3	-103	0	0	0	113.4	E151 L844	E151-Y840 HydrophobicContact CB-CE2 3.6Å; E151-Y840 VanDerWaalsContact CD-OH 3.25Å; E151-Y840 PolarHBondContact OE1-OH 2.93Å; E151-Y840 PolarHBondContact OE2-OH 3.45Å; Y840-L844 PolarHBondContact O-N 3.28Å
841	L	38.1	Very low	38.1	Very low	105 Å²	105	62.6 Å²	62.6	55%	0.55	35%	0.345	S	S	.	.	H	α-helix	trans	-70.2	-45	173.3	-80.1	164.5	0	0	0	112.7	D839 V843 L844 E845	D839-L841 PolarHBondContact O-N 3.42Å; D839-L841 VanDerWaalsContact O-N 3.13Å; D839-L841 PolarHBondContact OD1-N 3.42Å; L841-V843 VanDerWaalsContact C-N 3.26Å; L841-V843 PolarHBondContact O-N 2.9Å; L841-L844 WeakPolarHBondContact O-CA 3.34Å; L841-L844 WeakPolarHBondContact O-CB 3.5Å; L841-L844 PolarHBondContact O-N 3.33Å; L841-E845 PolarHBondContact O-N 2.76Å
842	Q	45.1	Very low	38.1	Very low	66 Å²	66	67.8 Å²	67.8	31%	0.308	37%	0.367	S	S	.	.	H	α-helix	trans	-55.5	-44.5	176.6	-176.6	-167.5	-26.8	0	0	110.7	D839 L844 E845 E846	D839-Q842 HydrophobicContact CB-CB 4.37Å; D839-Q842 WeakPolarHBondContact O-CB 3.37Å; D839-Q842 PolarHBondContact O-N 3.28Å; Q842-L844 VanDerWaalsContact C-N 3.26Å; Q842-L844 PolarHBondContact O-N 3.39Å; Q842-E845 PolarHBondContact O-N 2.94Å; Q842-E845 VanDerWaalsContact O-N 3.16Å; Q842-E846 WeakPolarHBondContact CG-OE1 3.43Å; Q842-E846 PolarHBondContact NE2-OE1 3.15Å; Q842-E846 WeakPolarHBondContact O-CG 3.38Å; Q842-E846 PolarHBondContact O-N 3.07Å
843	V	42.9	Very low	38	Very low	2 Å²	2	78.4 Å²	78.4	1%	0.012	42%	0.418	C	S	.	.	H	α-helix	trans	-61.1	-34.4	177.3	-178	0	0	0	0	112.6	K175 V176 T198 H199 D839 L841 Q847	K175-V843 HydrophobicContact CB-CG1 4.42Å; V176-V843 HydrophobicContact CG2-CB 4.09Å; V176-V843 HydrophobicContact CG2-CG1 3.82Å; V176-V843 HydrophobicContact CG2-CG2 3.68Å; T198-V843 WeakPolarHBondContact OG1-CG1 3.43Å; H199-V843 VanDerWaalsContact CE1-CG2 3.45Å; H199-V843 WeakPolarHBondContact CE1-CG2 3.29Å; H199-V843 WeakPolarHBondContact ND1-CG2 3.39Å; D839-V843 WeakPolarHBondContact O-CG2 3.41Å; D839-V843 PolarHBondContact O-N 2.96Å; L841-V843 VanDerWaalsContact C-N 3.26Å; L841-V843 PolarHBondContact O-N 2.9Å; V843-Q847 WeakPolarHBondContact O-CB 3.39Å; V843-Q847 PolarHBondContact O-N 3.22Å; V843-Q847 VanDerWaalsContact O-N 3.13Å
844	L	42.1	Very low	38.4	Very low	61 Å²	61	76.6 Å²	76.6	32%	0.319	41%	0.414	S	S	.	.	H	α-helix	trans	-74.3	-33.8	177.9	-157.2	72	0	0	0	112.2	K175 Y840 L841 Q842 T848	K175-L844 VanDerWaalsContact NZ-CD1 3.3Å; Y840-L844 PolarHBondContact O-N 3.28Å; L841-L844 WeakPolarHBondContact O-CA 3.34Å; L841-L844 WeakPolarHBondContact O-CB 3.5Å; L841-L844 PolarHBondContact O-N 3.33Å; Q842-L844 VanDerWaalsContact C-N 3.26Å; Q842-L844 PolarHBondContact O-N 3.39Å; L844-T848 WeakPolarHBondContact O-CB 3.27Å; L844-T848 PolarHBondContact O-N 3.32Å; L844-T848 PolarHBondContact O-OG1 3.24Å
845	E	43	Very low	38.9	Very low	114 Å²	114	76.8 Å²	76.8	53%	0.533	42%	0.417	S	S	.	.	H	α-helix	trans	-73.9	-44.1	177.4	-69	-176.9	163.1	0	0	111.9	L841 Q842 Q847 T848 A849	L841-E845 PolarHBondContact O-N 2.76Å; Q842-E845 PolarHBondContact O-N 2.94Å; Q842-E845 VanDerWaalsContact O-N 3.16Å; E845-Q847 VanDerWaalsContact C-N 3.33Å; E845-Q847 PolarHBondContact O-N 2.99Å; E845-T848 CarbonylContact O-C 3.43Å; E845-T848 WeakPolarHBondContact O-CA 3.43Å; E845-T848 WeakPolarHBondContact O-CB 3.41Å; E845-T848 PolarHBondContact O-N 2.98Å; E845-A849 PolarHBondContact O-N 3.32Å
846	E	46.2	Very low	39	Very low	54 Å²	54	77.9 Å²	77.9	25%	0.252	43%	0.425	S	S	.	.	H	α-helix	trans	-60.9	-41	173.1	-71.1	173.4	-176.3	0	0	111.6	H199 V223 Q842 T848 A849 L850	H199-E846 IonicContact CE1-OE2 2.65Å; H199-E846 PolarHBondContact CE1-OE2 2.97Å; H199-E846 VanDerWaalsContact CE1-OE2 3.23Å; H199-E846 IonicContact NE2-OE2 2.69Å; V223-E846 WeakPolarHBondContact CG1-OE2 3.49Å; Q842-E846 WeakPolarHBondContact CG-OE1 3.43Å; Q842-E846 PolarHBondContact NE2-OE1 3.15Å; Q842-E846 WeakPolarHBondContact O-CG 3.38Å; Q842-E846 PolarHBondContact O-N 3.07Å; E846-T848 VanDerWaalsContact C-N 3.29Å; E846-T848 PolarHBondContact O-N 3.3Å; E846-A849 PolarHBondContact O-N 3.11Å; E846-L850 PolarHBondContact O-N 3.01Å
847	Q	39.8	Very low	39	Very low	79 Å²	79	79.4 Å²	79.4	37%	0.369	42%	0.417	S	S	.	.	H	α-helix	trans	-59.6	-39.5	170.5	-175.2	-178.3	6.7	0	0	111.8	V843 E845 A849 L850 S851	V843-Q847 WeakPolarHBondContact O-CB 3.39Å; V843-Q847 PolarHBondContact O-N 3.22Å; V843-Q847 VanDerWaalsContact O-N 3.13Å; E845-Q847 VanDerWaalsContact C-N 3.33Å; E845-Q847 PolarHBondContact O-N 2.99Å; Q847-A849 VanDerWaalsContact C-N 3.33Å; Q847-L850 PolarHBondContact O-N 3.49Å; Q847-S851 PolarHBondContact O-N 2.91Å
848	T	43.5	Very low	39.3	Very low	61 Å²	61	81.3 Å²	81.3	37%	0.374	43%	0.425	S	S	.	.	H	α-helix	trans	-74.3	-22.3	-179.2	-58.2	0	0	0	0	112.9	L844 E845 E846 K852	L844-T848 WeakPolarHBondContact O-CB 3.27Å; L844-T848 PolarHBondContact O-N 3.32Å; L844-T848 PolarHBondContact O-OG1 3.24Å; E845-T848 CarbonylContact O-C 3.43Å; E845-T848 WeakPolarHBondContact O-CA 3.43Å; E845-T848 WeakPolarHBondContact O-CB 3.41Å; E845-T848 PolarHBondContact O-N 2.98Å; E846-T848 VanDerWaalsContact C-N 3.29Å; E846-T848 PolarHBondContact O-N 3.3Å; T848-K852 WeakPolarHBondContact O-CD 3.47Å; T848-K852 WeakPolarHBondContact O-CG 3.48Å
849	A	38.7	Very low	39.5	Very low	58 Å²	58	85.5 Å²	85.5	48%	0.479	45%	0.445	S	S	.	.	H	α-helix	trans	-74.9	-47.1	166.8	0	0	0	0	0	111.2	E845 E846 Q847 S851 K852	E845-A849 PolarHBondContact O-N 3.32Å; E846-A849 PolarHBondContact O-N 3.11Å; Q847-A849 VanDerWaalsContact C-N 3.33Å; A849-S851 VanDerWaalsContact C-N 3.29Å; A849-S851 PolarHBondContact O-N 3.03Å; A849-K852 PolarHBondContact O-N 2.94Å; A849-K852 VanDerWaalsContact O-N 3.16Å
850	L	37.6	Very low	39.5	Very low	92 Å²	92	85.7 Å²	85.7	48%	0.482	45%	0.446	S	S	.	.	H	α-helix	trans	-65	-27.3	179.4	-82	164.4	0	0	0	113.7	V223 E846 Q847 K852	V223-L850 HydrophobicContact CG2-CD1 3.73Å; E846-L850 PolarHBondContact O-N 3.01Å; Q847-L850 PolarHBondContact O-N 3.49Å; L850-K852 PolarHBondContact O-N 3.39Å
851	S	33.5	Very low	39.7	Very low	87 Å²	87	90.1 Å²	90.1	61%	0.608	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	11.2	175.6	87.9	0	0	0	0	114.4	Q847 A849	Q847-S851 PolarHBondContact O-N 2.91Å; A849-S851 VanDerWaalsContact C-N 3.29Å; A849-S851 PolarHBondContact O-N 3.03Å
852	K	32.3	Very low	39.8	Very low	162 Å²	162	88.8 Å²	88.8	70%	0.704	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127	6.2	-179.4	-69.1	178.1	-173.7	166.7	0	113.4	T848 A849 L850	T848-K852 WeakPolarHBondContact O-CD 3.47Å; T848-K852 WeakPolarHBondContact O-CG 3.48Å; A849-K852 PolarHBondContact O-N 2.94Å; A849-K852 VanDerWaalsContact O-N 3.16Å; L850-K852 PolarHBondContact O-N 3.39Å
853	M	32.9	Very low	39.3	Very low	230 Å²	230	90.9 Å²	90.9	100%	1.133	48%	0.479	S	S	*	.			trans	-105.4	0	166.2	-66.9	-169.8	176.9	0	0	110.1

Retrieved 853 of 853 residues in 1531.4 ms (Link to these results)

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